#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bg9 s VAL 2 N 0.00 1.88 0.37 5.09 0.11 -1.26 -4.30 120.40 122.28 1bg9 s VAL 2 Ca 0.00 -0.89 -0.05 0.00 -2.93 0.00 0.00 61.98 58.11 1bg9 s VAL 2 Cb 0.00 -1.65 -0.05 0.00 -1.53 0.00 0.00 36.38 33.16 1bg9 s VAL 2 CO 0.00 0.52 0.64 -0.76 -3.33 0.00 0.00 175.10 172.17 1bg9 s LEU 3 N 0.59 3.91 0.07 2.54 1.43 0.21 -0.73 118.68 126.70 1bg9 s LEU 3 Ca -0.14 0.78 0.05 0.00 -1.03 0.00 0.00 54.13 53.80 1bg9 s LEU 3 Cb -0.17 -3.65 -0.03 0.00 0.03 0.00 0.00 46.19 42.38 1bg9 s LEU 3 CO 0.04 -0.34 -0.15 0.12 0.23 0.00 0.00 176.35 176.25 1bg9 s PHE 4 N -2.34 1.30 -0.40 0.29 5.36 0.09 -0.20 117.98 122.08 1bg9 s PHE 4 Ca 0.45 -0.43 -0.09 0.00 -0.96 0.00 0.00 56.93 55.89 1bg9 s PHE 4 Cb -0.10 -0.73 0.07 0.00 -0.34 0.00 0.00 43.02 41.91 1bg9 s PHE 4 CO 0.35 0.07 0.24 -1.14 -1.46 0.00 0.00 175.22 173.28 1bg9 s GLN 5 N -1.64 2.66 -0.24 10.12 0.74 -0.49 -0.91 119.66 129.90 1bg9 s GLN 5 Ca -0.00 -1.36 -0.03 0.00 0.05 0.00 0.00 55.36 54.02 1bg9 s GLN 5 Cb -0.10 -3.75 0.03 0.00 1.10 0.00 0.00 33.01 30.29 1bg9 s GLN 5 CO 0.02 -0.88 2.56 0.41 -0.55 0.00 0.00 175.29 176.85 1bg9 n GLY 6 N 4.93 3.66 3.62 2.59 0.00 0.29 -2.47 105.19 117.81 1bg9 n GLY 6 Ca -0.11 -1.15 0.02 0.00 0.00 0.00 0.00 46.02 44.78 1bg9 n GLY 6 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1bg9 s PHE 7 N -0.89 -0.04 0.00 1.61 -0.71 -1.26 -4.79 117.98 111.89 1bg9 s PHE 7 Ca 0.41 -0.05 0.00 0.00 -1.04 0.00 0.00 56.93 56.24 1bg9 s PHE 7 Cb 0.25 0.54 0.00 0.00 -1.21 0.00 0.00 43.02 42.61 1bg9 s PHE 7 CO -0.06 -0.26 0.00 0.27 -1.34 0.00 0.00 175.22 173.82 1bg9 n ASN 8 N -0.48 0.00 0.22 1.98 0.23 -1.26 -4.59 115.26 111.36 1bg9 n ASN 8 Ca -0.08 -0.73 0.15 0.00 -0.53 0.00 0.00 54.58 53.39 1bg9 n ASN 8 Cb 0.63 0.00 0.56 0.00 -2.08 0.00 0.00 39.78 38.89 1bg9 n ASN 8 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 1bg9 h TRP 9 N 0.73 0.00 -0.01 -2.53 -0.00 -1.95 -2.43 115.95 109.76 1bg9 h TRP 9 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.89 1bg9 h TRP 9 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.16 1bg9 h TRP 9 CO 0.00 0.00 -0.59 0.39 -0.00 0.00 0.00 178.44 178.24 1bg9 n GLU 10 N -2.77 0.94 0.05 2.65 -0.58 -1.26 -4.56 120.64 115.11 1bg9 n GLU 10 Ca 0.02 -0.78 0.09 0.00 -0.42 0.00 0.00 57.16 56.07 1bg9 n GLU 10 Cb 0.31 -1.48 0.53 0.00 -0.57 0.00 0.00 31.44 30.23 1bg9 n GLU 10 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 1bg9 h SER 11 N 1.90 0.27 0.10 1.62 0.02 -1.83 -0.26 113.55 115.36 1bg9 h SER 11 Ca 0.00 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1bg9 h SER 11 Cb 0.70 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.18 1bg9 h SER 11 CO 0.00 0.18 -0.10 4.11 -1.14 0.00 0.00 176.83 179.89 1bg9 h TRP 12 N 0.31 0.00 0.00 3.45 5.08 -1.82 -1.91 115.95 121.06 1bg9 h TRP 12 Ca 0.16 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.13 1bg9 h TRP 12 Cb 0.23 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.39 1bg9 h TRP 12 CO -0.00 0.10 0.00 0.87 -1.28 0.00 0.00 178.44 178.13 1bg9 h LYS 13 N 0.00 0.00 -6.45 0.12 1.57 -1.36 -3.43 116.57 107.02 1bg9 h LYS 13 Ca -0.00 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.16 1bg9 h LYS 13 Cb 0.17 0.00 0.08 0.00 0.08 0.00 0.00 32.23 32.56 1bg9 h LYS 13 CO 0.01 0.00 0.48 1.58 -0.57 0.00 0.00 179.45 180.96 1bg9 n HIS 14 N -2.67 1.78 -1.76 -1.35 -0.00 -0.72 -4.87 115.22 105.62 1bg9 n HIS 14 Ca 0.01 0.53 -0.42 0.00 0.46 0.00 0.00 57.72 58.30 1bg9 n HIS 14 Cb 0.27 -2.39 -0.03 0.00 -0.12 0.00 0.00 29.99 27.72 1bg9 n HIS 14 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1bg9 s ASN 15 N 0.26 6.50 0.00 0.26 3.04 -1.26 -1.91 114.94 121.83 1bg9 s ASN 15 Ca 0.73 2.59 0.00 0.00 0.04 0.00 0.00 52.86 56.22 1bg9 s ASN 15 Cb -0.76 -2.54 0.00 0.00 -1.54 0.00 0.00 41.25 36.41 1bg9 s ASN 15 CO 0.49 -1.01 0.00 0.61 -3.04 0.00 0.00 177.10 174.15 1bg9 n GLY 16 N 4.38 0.80 0.06 1.21 0.00 -1.26 -4.85 105.19 105.53 1bg9 n GLY 16 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1bg9 n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bg9 n GLY 17 N -2.00 -0.28 0.23 -0.02 0.00 -0.80 -4.74 105.19 97.59 1bg9 n GLY 17 Ca 0.00 -1.17 -0.07 0.00 0.00 0.00 0.00 46.02 44.78 1bg9 n GLY 17 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1bg9 h TRP 18 N 0.00 0.73 -0.62 1.61 2.91 -1.70 -0.28 115.95 118.60 1bg9 h TRP 18 Ca 0.00 -0.01 -0.05 0.00 1.13 0.00 0.00 58.89 59.96 1bg9 h TRP 18 Cb 0.00 -0.24 -0.03 0.00 -0.51 0.00 0.00 29.16 28.39 1bg9 h TRP 18 CO 0.00 0.52 0.17 1.88 -1.03 0.00 0.00 178.44 179.98 1bg9 h TYR 19 N 0.73 1.02 -0.78 2.65 0.05 -1.76 0.19 116.97 119.07 1bg9 h TYR 19 Ca 0.19 -0.11 0.05 0.00 0.05 0.00 0.00 58.73 58.91 1bg9 h TYR 19 Cb 0.01 -0.29 -0.05 0.00 1.01 0.00 0.00 36.73 37.40 1bg9 h TYR 19 CO -0.02 0.85 0.48 -0.91 -1.05 0.00 0.00 178.16 177.50 1bg9 h ASN 20 N 0.90 0.76 -0.13 3.88 2.35 -1.76 -0.68 115.58 120.90 1bg9 h ASN 20 Ca 0.20 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1bg9 h ASN 20 Cb 0.32 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 1bg9 h ASN 20 CO -0.00 0.50 0.07 0.15 -1.65 0.00 0.00 177.43 176.50 1bg9 h PHE 21 N 0.90 0.18 0.00 1.19 3.57 -0.16 -2.80 116.94 119.81 1bg9 h PHE 21 Ca 0.33 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.80 1bg9 h PHE 21 Cb 0.12 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 38.80 1bg9 h PHE 21 CO -0.04 0.21 -0.11 1.25 -2.23 0.00 0.00 178.31 177.38 1bg9 h LEU 22 N 0.10 0.00 -0.80 0.59 5.85 0.30 -1.45 115.31 119.91 1bg9 h LEU 22 Ca 0.04 0.00 0.19 0.00 0.84 0.00 0.00 57.88 58.96 1bg9 h LEU 22 Cb 0.09 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 40.99 1bg9 h LEU 22 CO -0.01 0.11 0.13 0.24 -0.34 0.00 0.00 178.44 178.58 1bg9 h MET 23 N 0.00 0.18 0.00 1.25 2.86 -0.88 -0.02 114.93 118.32 1bg9 h MET 23 Ca -0.00 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1bg9 h MET 23 Cb 0.25 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 31.87 1bg9 h MET 23 CO 0.01 0.12 -0.08 0.78 1.06 0.00 0.00 176.91 178.81 1bg9 h GLY 24 N 0.18 0.00 -1.45 8.32 0.00 -1.37 -2.81 103.07 105.94 1bg9 h GLY 24 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.80 1bg9 h GLY 24 CO -0.63 0.00 -0.00 0.28 0.00 0.00 0.00 176.54 176.19 1bg9 n LYS 25 N -3.86 2.11 -0.33 4.80 4.76 -0.03 -4.48 118.16 121.11 1bg9 n LYS 25 Ca -0.02 -1.61 0.03 0.00 -2.87 0.00 0.00 58.31 53.83 1bg9 n LYS 25 Cb 0.17 -1.47 0.20 0.00 -1.84 0.00 0.00 35.03 32.10 1bg9 n LYS 25 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1bg9 h VAL 26 N 3.93 1.10 -0.24 -0.18 2.07 -1.38 -0.84 116.25 120.71 1bg9 h VAL 26 Ca 0.00 -0.39 -0.07 0.00 0.82 0.00 0.00 66.70 67.07 1bg9 h VAL 26 Cb 0.84 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1bg9 h VAL 26 CO 0.00 0.21 -0.12 0.44 0.02 0.00 0.00 177.57 178.12 1bg9 h ASP 27 N 1.12 0.52 -0.67 0.57 5.19 -1.82 0.58 116.42 121.91 1bg9 h ASP 27 Ca 0.40 -0.41 0.02 0.00 -0.62 0.00 0.00 57.03 56.41 1bg9 h ASP 27 Cb 0.13 -0.14 -0.04 0.00 0.18 0.00 0.00 39.33 39.46 1bg9 h ASP 27 CO -0.15 0.81 0.43 0.44 -3.12 0.00 0.00 179.24 177.66 1bg9 h ASP 28 N 0.22 0.73 -0.45 6.45 5.19 -1.77 0.20 116.42 126.99 1bg9 h ASP 28 Ca 0.05 -0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.39 1bg9 h ASP 28 Cb 0.62 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 39.94 1bg9 h ASP 28 CO 0.04 0.52 0.04 0.40 -3.12 0.00 0.00 179.24 177.12 1bg9 h ILE 29 N 0.87 1.25 -0.50 0.35 2.04 -0.93 -1.10 117.51 119.50 1bg9 h ILE 29 Ca 0.25 -0.96 -0.04 0.00 1.00 0.00 0.00 64.86 65.11 1bg9 h ILE 29 Cb -0.05 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 1bg9 h ILE 29 CO -0.07 0.33 0.15 0.00 0.00 0.00 0.00 178.15 178.56 1bg9 h ALA 30 N 0.93 0.65 -0.86 1.87 0.00 -0.20 -2.86 119.26 118.79 1bg9 h ALA 30 Ca 0.13 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1bg9 h ALA 30 Cb 0.43 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1bg9 h ALA 30 CO 0.01 0.31 0.47 0.00 0.00 0.00 0.00 179.25 180.04 1bg9 h ALA 31 N 1.01 1.20 0.00 0.00 0.00 -0.42 -2.40 119.26 118.65 1bg9 h ALA 31 Ca 0.16 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1bg9 h ALA 31 Cb 0.28 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1bg9 h ALA 31 CO -0.00 0.64 0.01 0.00 0.00 0.00 0.00 179.25 179.89 1bg9 h ALA 32 N 1.31 1.01 0.00 0.00 0.00 -0.96 -3.44 119.26 117.17 1bg9 h ALA 32 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1bg9 h ALA 32 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1bg9 h ALA 32 CO -0.05 -0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.61 1bg9 n GLY 33 N -1.20 1.03 3.73 0.00 0.00 -0.90 -4.71 105.19 103.15 1bg9 n GLY 33 Ca -0.02 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1bg9 n GLY 33 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bg9 s ILE 34 N -2.00 4.61 -0.07 -0.61 1.01 -1.19 -4.42 121.20 118.53 1bg9 s ILE 34 Ca 0.00 1.89 0.14 0.00 0.00 0.00 0.00 60.65 62.68 1bg9 s ILE 34 Cb 0.00 -4.24 -0.20 0.00 0.01 0.00 0.00 42.46 38.03 1bg9 s ILE 34 CO 0.00 0.33 0.21 0.35 0.00 0.00 0.00 174.94 175.83 1bg9 n THR 35 N 2.83 0.39 -3.85 2.92 -2.24 0.09 -4.71 114.28 109.70 1bg9 n THR 35 Ca 0.00 -0.44 -0.12 0.00 -2.27 0.00 0.00 64.05 61.23 1bg9 n THR 35 Cb 0.50 -0.17 -0.13 0.00 -2.10 0.00 0.00 70.33 68.43 1bg9 n THR 35 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1bg9 s HIS 36 N -2.74 -0.06 -0.03 4.78 3.76 -1.13 -1.59 115.29 118.27 1bg9 s HIS 36 Ca -0.06 0.15 0.06 0.00 -0.15 0.00 0.00 55.06 55.06 1bg9 s HIS 36 Cb 0.07 0.01 -0.01 0.00 1.11 0.00 0.00 32.58 33.76 1bg9 s HIS 36 CO 0.59 -0.05 -0.22 0.14 -0.85 0.00 0.00 174.74 174.35 1bg9 s VAL 37 N -0.07 1.75 -0.32 -0.90 -7.23 0.27 -0.73 120.40 113.17 1bg9 s VAL 37 Ca -0.01 -0.92 -0.15 0.00 -1.81 0.00 0.00 61.98 59.09 1bg9 s VAL 37 Cb -0.01 -1.47 -0.02 0.00 0.56 0.00 0.00 36.38 35.44 1bg9 s VAL 37 CO 0.00 0.49 0.36 0.86 -0.31 0.00 0.00 175.10 176.50 1bg9 s TRP 38 N -0.31 3.22 0.22 2.82 -0.00 -0.09 -0.22 118.94 124.57 1bg9 s TRP 38 Ca 0.03 0.12 -0.02 0.00 -0.00 0.00 0.00 56.10 56.22 1bg9 s TRP 38 Cb -0.10 -2.63 -0.05 0.00 -0.00 0.00 0.00 33.47 30.69 1bg9 s TRP 38 CO 0.01 -0.36 0.43 -0.51 -0.00 0.00 0.00 176.95 176.52 1bg9 s LEU 39 N 2.03 4.19 0.86 5.86 2.01 -0.33 -0.55 118.68 132.74 1bg9 s LEU 39 Ca 0.13 0.51 -0.12 0.00 0.01 0.00 0.00 54.13 54.65 1bg9 s LEU 39 Cb -0.16 -3.28 0.11 0.00 0.01 0.00 0.00 46.19 42.86 1bg9 s LEU 39 CO 0.11 -0.07 1.12 -2.16 1.01 0.00 0.00 176.35 176.36 1bg9 s PRO 40 N -3.30 1.59 -0.14 1.29 0.04 -1.26 -3.44 135.00 129.77 1bg9 s PRO 40 Ca 0.40 0.43 -0.37 0.00 0.04 0.00 0.00 61.00 61.51 1bg9 s PRO 40 Cb -0.11 -1.88 -0.14 0.00 0.04 0.00 0.00 34.50 32.42 1bg9 s PRO 40 CO 0.29 -1.92 1.79 -2.30 0.04 0.00 0.00 177.00 174.90 1bg9 n PRO 41 N -3.60 1.74 0.07 0.56 -0.02 -1.26 -4.53 135.00 127.96 1bg9 n PRO 41 Ca 0.07 0.64 -0.13 0.00 -2.02 0.00 0.00 63.50 62.05 1bg9 n PRO 41 Cb 0.58 -2.41 -0.05 0.00 -0.02 0.00 0.00 33.50 31.60 1bg9 n PRO 41 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bg9 h ALA 42 N 8.06 0.36 -2.28 3.55 0.00 -1.91 -3.44 119.26 123.59 1bg9 h ALA 42 Ca -0.47 -0.72 -0.45 0.00 0.00 0.00 0.00 54.91 53.26 1bg9 h ALA 42 Cb 1.29 -0.02 0.15 0.00 0.00 0.00 0.00 17.79 19.21 1bg9 h ALA 42 CO 0.94 0.84 0.29 -1.12 0.00 0.00 0.00 179.25 180.20 1bg9 s SER 43 N -7.07 2.83 0.19 0.00 0.01 -1.26 -4.33 113.70 104.07 1bg9 s SER 43 Ca -0.05 0.74 -0.32 0.00 1.31 0.00 0.00 55.95 57.63 1bg9 s SER 43 Cb 0.09 -1.13 -0.12 0.00 0.21 0.00 0.00 66.02 65.07 1bg9 s SER 43 CO 0.86 -2.95 1.75 1.67 0.41 0.00 0.00 173.24 174.98 1bg9 n GLN 44 N -4.00 2.80 -4.06 12.44 0.00 -0.86 -4.56 117.38 119.15 1bg9 n GLN 44 Ca 0.10 1.01 -0.13 0.00 -0.00 0.00 0.00 57.00 57.98 1bg9 n GLN 44 Cb 0.59 -2.87 -0.11 0.00 0.00 0.00 0.00 30.24 27.85 1bg9 n GLN 44 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1bg9 s SER 45 N 1.48 0.80 0.15 1.69 0.15 -1.26 -0.39 113.70 116.32 1bg9 s SER 45 Ca 0.76 -0.55 -0.03 0.00 0.70 0.00 0.00 55.95 56.83 1bg9 s SER 45 Cb -0.50 0.04 -0.03 0.00 -1.71 0.00 0.00 66.02 63.83 1bg9 s SER 45 CO 0.33 -0.22 1.36 0.58 1.20 0.00 0.00 173.24 176.49 1bg9 h VAL 46 N 4.48 1.40 -3.22 4.45 2.07 -1.77 -3.41 116.25 120.25 1bg9 h VAL 46 Ca -0.35 -2.33 -0.60 0.00 0.82 0.00 0.00 66.70 64.24 1bg9 h VAL 46 Cb 1.20 2.29 -0.10 0.00 -1.52 0.00 0.00 31.29 33.16 1bg9 h VAL 46 CO 0.41 0.70 -0.37 0.00 0.02 0.00 0.00 177.57 178.33 1bg9 s ALA 47 N -3.41 3.64 0.54 1.67 0.00 -1.26 -4.97 121.76 117.96 1bg9 s ALA 47 Ca -0.06 -0.51 0.24 0.00 0.00 0.00 0.00 51.96 51.63 1bg9 s ALA 47 Cb 0.10 -2.31 1.40 0.00 0.00 0.00 0.00 23.12 22.30 1bg9 s ALA 47 CO 0.85 0.17 2.04 0.93 0.00 0.00 0.00 175.76 179.75 1bg9 h GLU 48 N 6.45 0.00 0.00 0.00 3.07 -1.99 -1.15 114.58 120.96 1bg9 h GLU 48 Ca -0.43 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.43 1bg9 h GLU 48 Cb 1.17 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.08 1bg9 h GLU 48 CO 0.74 0.00 0.00 1.96 -1.40 0.00 0.00 179.01 180.31 1bg9 h GLN 49 N 0.00 0.00 0.00 2.33 7.50 -1.93 -3.42 115.11 119.59 1bg9 h GLN 49 Ca 0.18 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.33 1bg9 h GLN 49 Cb 0.74 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.27 1bg9 h GLN 49 CO -0.00 0.00 0.00 0.41 -1.50 0.00 0.00 178.83 177.74 1bg9 n GLY 50 N 0.94 2.18 0.92 3.46 0.00 -0.43 -4.48 105.19 107.77 1bg9 n GLY 50 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1bg9 n GLY 50 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1bg9 n TYR 51 N -0.12 0.55 -3.00 1.61 4.01 -1.26 -3.77 117.16 115.18 1bg9 n TYR 51 Ca 0.00 -0.29 -0.17 0.00 -0.16 0.00 0.00 57.90 57.28 1bg9 n TYR 51 Cb 0.00 -0.24 -0.02 0.00 -0.31 0.00 0.00 39.34 38.78 1bg9 n TYR 51 CO 0.00 0.00 0.00 -0.12 -0.46 0.00 0.00 176.86 176.28 1bg9 n MET 52 N 0.14 1.35 -2.15 -0.72 1.56 -1.26 -5.03 117.12 111.01 1bg9 n MET 52 Ca 0.08 -3.55 -0.36 0.00 -0.27 0.00 0.00 57.70 53.61 1bg9 n MET 52 Cb 0.53 -1.67 0.02 0.00 2.15 0.00 0.00 33.22 34.25 1bg9 n MET 52 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 1bg9 s PRO 53 N -2.75 3.21 0.00 2.12 0.04 -1.25 -2.10 135.00 134.26 1bg9 s PRO 53 Ca 0.38 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.14 1bg9 s PRO 53 Cb 0.37 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.92 1bg9 s PRO 53 CO -0.06 -0.99 0.00 0.41 0.04 0.00 0.00 177.00 176.40 1bg9 n GLY 54 N 0.32 0.30 3.52 0.56 0.00 0.47 0.72 105.19 111.09 1bg9 n GLY 54 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1bg9 n GLY 54 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bg9 s ARG 55 N 0.00 3.85 0.38 1.61 0.52 -1.24 -4.72 118.95 119.34 1bg9 s ARG 55 Ca 0.00 -1.89 0.18 0.00 -0.52 0.00 0.00 55.73 53.50 1bg9 s ARG 55 Cb 0.00 -5.27 1.13 0.00 0.52 0.00 0.00 34.95 31.33 1bg9 s ARG 55 CO 0.00 -2.04 1.71 -0.07 0.02 0.00 0.00 175.30 174.92 1bg9 h LEU 56 N 11.54 0.46 -0.07 2.53 4.07 -1.74 0.38 115.31 132.49 1bg9 h LEU 56 Ca 0.30 0.13 0.00 0.00 0.08 0.00 0.00 57.88 58.39 1bg9 h LEU 56 Cb 0.93 0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.74 1bg9 h LEU 56 CO 1.34 -0.02 -0.26 -1.22 -1.08 0.00 0.00 178.44 177.20 1bg9 n TYR 57 N -4.78 0.00 -2.89 1.13 4.01 0.27 -4.54 117.16 110.36 1bg9 n TYR 57 Ca 0.29 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.60 1bg9 n TYR 57 Cb 0.99 -0.31 -0.01 0.00 -0.31 0.00 0.00 39.34 39.70 1bg9 n TYR 57 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1bg9 s ASP 58 N -2.88 6.92 0.26 7.72 2.15 0.12 -4.75 116.67 126.22 1bg9 s ASP 58 Ca 0.16 -2.66 0.25 0.00 0.43 0.00 0.00 52.55 50.73 1bg9 s ASP 58 Cb 0.19 -2.43 0.91 0.00 -0.30 0.00 0.00 42.92 41.29 1bg9 s ASP 58 CO 0.60 -0.90 1.75 -0.07 -0.17 0.00 0.00 175.17 176.38 1bg9 h LEU 59 N 10.31 0.00 -0.96 -1.34 3.38 -1.81 -2.29 115.31 122.61 1bg9 h LEU 59 Ca 0.29 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.16 1bg9 h LEU 59 Cb 0.91 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1bg9 h LEU 59 CO 1.24 0.00 -0.38 0.44 0.09 0.00 0.00 178.44 179.84 1bg9 h ASP 60 N 0.00 0.29 0.00 -0.43 3.32 -1.85 -2.71 116.42 115.04 1bg9 h ASP 60 Ca 0.00 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1bg9 h ASP 60 Cb 0.54 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1bg9 h ASP 60 CO 0.00 0.64 0.00 0.00 -1.72 0.00 0.00 179.24 178.16 1bg9 n ALA 61 N -2.48 2.34 -1.77 3.45 0.00 -1.25 -4.51 120.51 116.29 1bg9 n ALA 61 Ca -0.01 -0.11 -0.40 0.00 0.00 0.00 0.00 53.44 52.92 1bg9 n ALA 61 Cb 0.46 -1.27 -0.00 0.00 0.00 0.00 0.00 19.45 18.63 1bg9 n ALA 61 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1bg9 s SER 62 N -1.79 6.31 0.00 0.00 0.15 -1.02 -4.72 113.70 112.62 1bg9 s SER 62 Ca 0.25 2.78 0.24 0.00 0.70 0.00 0.00 55.95 59.93 1bg9 s SER 62 Cb 0.12 -2.65 1.10 0.00 -1.71 0.00 0.00 66.02 62.87 1bg9 s SER 62 CO 0.19 -0.87 1.79 0.29 1.20 0.00 0.00 173.24 175.85 1bg9 n LYS 63 N 0.23 0.10 0.08 5.44 4.76 -1.26 -3.11 118.16 124.40 1bg9 n LYS 63 Ca 0.03 0.08 0.01 0.00 -2.87 0.00 0.00 58.31 55.55 1bg9 n LYS 63 Cb 0.42 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 32.07 1bg9 n LYS 63 CO 0.00 0.00 0.00 1.88 -1.37 0.00 0.00 177.40 177.91 1bg9 h TYR 64 N 0.00 0.00 0.00 2.13 0.05 -1.88 -3.43 116.97 113.84 1bg9 h TYR 64 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1bg9 h TYR 64 Cb 0.36 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.10 1bg9 h TYR 64 CO 0.00 0.55 0.00 0.41 -1.05 0.00 0.00 178.16 178.07 1bg9 n GLY 65 N 1.32 -1.89 3.94 3.88 0.00 -1.18 -1.99 105.19 109.27 1bg9 n GLY 65 Ca -0.04 -1.44 -0.20 0.00 0.00 0.00 0.00 46.02 44.33 1bg9 n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bg9 s ASN 66 N -0.77 5.17 0.26 1.61 6.03 -1.26 -3.90 114.94 122.08 1bg9 s ASN 66 Ca 0.00 -0.73 -0.03 0.00 -1.03 0.00 0.00 52.86 51.07 1bg9 s ASN 66 Cb 0.00 -0.37 0.53 0.00 -3.03 0.00 0.00 41.25 38.38 1bg9 s ASN 66 CO 0.00 -0.83 1.67 0.50 -2.03 0.00 0.00 177.10 176.41 1bg9 h LYS 67 N 0.78 0.22 -0.63 3.55 3.64 -1.88 0.84 116.57 123.10 1bg9 h LYS 67 Ca -0.39 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.05 1bg9 h LYS 67 Cb 1.28 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.99 1bg9 h LYS 67 CO 0.52 0.15 0.31 0.00 -2.27 0.00 0.00 179.45 178.16 1bg9 h ALA 68 N 1.68 0.83 -0.30 5.00 0.00 -1.95 -1.56 119.26 122.95 1bg9 h ALA 68 Ca 0.46 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 55.26 1bg9 h ALA 68 Cb 0.83 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1bg9 h ALA 68 CO -0.58 -0.05 -0.40 1.96 0.00 0.00 0.00 179.25 180.18 1bg9 h GLN 69 N 0.57 0.72 -0.04 0.00 4.20 -1.25 -2.36 115.11 116.95 1bg9 h GLN 69 Ca 0.29 -0.37 0.01 0.00 0.06 0.00 0.00 58.65 58.64 1bg9 h GLN 69 Cb 0.25 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1bg9 h GLN 69 CO -0.22 0.99 -0.02 1.25 -0.67 0.00 0.00 178.83 180.16 1bg9 h LEU 70 N 0.59 -0.07 -1.16 1.46 6.46 -0.66 -1.09 115.31 120.83 1bg9 h LEU 70 Ca 0.05 0.02 -0.06 0.00 -0.12 0.00 0.00 57.88 57.76 1bg9 h LEU 70 Cb 0.94 0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.89 1bg9 h LEU 70 CO 0.09 -0.03 -0.09 0.11 -0.62 0.00 0.00 178.44 177.89 1bg9 h LYS 71 N -0.02 0.47 -0.06 1.25 1.57 -1.17 0.16 116.57 118.77 1bg9 h LYS 71 Ca 0.02 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 1bg9 h LYS 71 Cb 0.06 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1bg9 h LYS 71 CO -0.05 0.57 0.01 0.77 -0.57 0.00 0.00 179.45 180.18 1bg9 h SER 72 N 0.44 0.09 -0.37 0.86 0.02 -1.12 0.18 113.55 113.66 1bg9 h SER 72 Ca 0.09 -0.26 0.02 0.00 -0.84 0.00 0.00 61.79 60.80 1bg9 h SER 72 Cb 0.44 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.93 1bg9 h SER 72 CO 0.02 0.33 0.20 0.25 -1.14 0.00 0.00 176.83 176.49 1bg9 h LEU 73 N -0.14 0.30 -1.16 5.07 6.46 -0.20 0.14 115.31 125.78 1bg9 h LEU 73 Ca 0.02 0.01 -0.09 0.00 -0.12 0.00 0.00 57.88 57.70 1bg9 h LEU 73 Cb 0.27 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.14 1bg9 h LEU 73 CO 0.00 0.22 -0.42 0.40 -0.62 0.00 0.00 178.44 178.02 1bg9 h ILE 74 N 0.41 1.27 -0.49 4.05 2.04 -0.61 -0.10 117.51 124.08 1bg9 h ILE 74 Ca 0.15 -1.44 -0.04 0.00 1.00 0.00 0.00 64.86 64.54 1bg9 h ILE 74 Cb 0.04 1.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.89 1bg9 h ILE 74 CO -0.09 0.41 0.17 1.23 0.00 0.00 0.00 178.15 179.86 1bg9 h GLY 75 N 1.30 0.80 0.84 5.37 0.00 0.86 -0.07 103.07 112.16 1bg9 h GLY 75 Ca -0.00 -0.46 -0.04 0.00 0.00 0.00 0.00 47.33 46.82 1bg9 h GLY 75 CO 0.05 0.44 -0.03 0.00 0.00 0.00 0.00 176.54 177.00 1bg9 h ALA 76 N 1.02 0.32 -0.64 3.60 0.00 -0.01 0.29 119.26 123.84 1bg9 h ALA 76 Ca 0.16 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1bg9 h ALA 76 Cb 0.25 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1bg9 h ALA 76 CO -0.01 0.08 0.38 -0.07 0.00 0.00 0.00 179.25 179.64 1bg9 h LEU 77 N 0.19 0.77 -0.60 0.00 3.38 -0.87 -1.56 115.31 116.60 1bg9 h LEU 77 Ca 0.06 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1bg9 h LEU 77 Cb 0.46 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1bg9 h LEU 77 CO 0.02 0.60 -0.20 0.45 0.09 0.00 0.00 178.44 179.40 1bg9 h HIS 78 N 0.87 1.02 0.00 1.13 3.86 -0.68 0.13 115.15 121.48 1bg9 h HIS 78 Ca 0.23 -0.23 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 1bg9 h HIS 78 Cb -0.02 -0.24 -0.00 0.00 1.06 0.00 0.00 27.41 28.20 1bg9 h HIS 78 CO -0.02 1.01 -0.05 0.78 0.86 0.00 0.00 177.93 180.52 1bg9 h GLY 79 N 0.93 0.00 -2.66 2.45 0.00 0.41 -0.13 103.07 104.07 1bg9 h GLY 79 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 1bg9 h GLY 79 CO 0.06 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.88 1bg9 n LYS 80 N -3.53 2.69 0.00 4.80 4.76 -0.59 -4.95 118.16 121.35 1bg9 n LYS 80 Ca -0.02 -2.60 0.00 0.00 -2.87 0.00 0.00 58.31 52.82 1bg9 n LYS 80 Cb 0.16 -1.57 0.00 0.00 -1.84 0.00 0.00 35.03 31.79 1bg9 n LYS 80 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1bg9 n GLY 81 N 1.64 1.71 3.92 0.72 0.00 -0.06 -4.92 105.19 108.19 1bg9 n GLY 81 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 1bg9 n GLY 81 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1bg9 s VAL 82 N -2.40 5.36 0.50 1.61 -7.23 -0.07 -4.94 120.40 113.23 1bg9 s VAL 82 Ca 0.00 -0.33 -0.04 0.00 -1.81 0.00 0.00 61.98 59.80 1bg9 s VAL 82 Cb 0.00 -3.63 -0.02 0.00 0.56 0.00 0.00 36.38 33.30 1bg9 s VAL 82 CO 0.00 0.13 0.78 -0.54 -0.31 0.00 0.00 175.10 175.17 1bg9 s LYS 83 N -2.51 3.24 -0.10 4.82 1.02 -0.62 -2.91 119.74 122.68 1bg9 s LYS 83 Ca 0.36 -0.04 0.02 0.00 0.02 0.00 0.00 55.97 56.33 1bg9 s LYS 83 Cb -0.13 -2.40 0.01 0.00 -0.52 0.00 0.00 37.83 34.80 1bg9 s LYS 83 CO 0.27 -0.36 -0.17 0.00 -0.92 0.00 0.00 175.35 174.18 1bg9 s ALA 84 N -2.76 1.74 0.09 5.17 0.00 -1.26 -0.56 121.76 124.17 1bg9 s ALA 84 Ca 0.49 -0.73 0.09 0.00 0.00 0.00 0.00 51.96 51.81 1bg9 s ALA 84 Cb -0.10 -0.77 -0.04 0.00 0.00 0.00 0.00 23.12 22.21 1bg9 s ALA 84 CO 0.43 0.07 -0.24 0.96 0.00 0.00 0.00 175.76 176.98 1bg9 s ILE 85 N 0.73 2.42 -0.01 0.00 -4.36 0.69 -1.14 121.20 119.54 1bg9 s ILE 85 Ca -0.12 -1.51 0.02 0.00 -0.26 0.00 0.00 60.65 58.78 1bg9 s ILE 85 Cb -0.16 -2.03 -0.03 0.00 1.25 0.00 0.00 42.46 41.48 1bg9 s ILE 85 CO 0.02 0.21 -0.02 0.00 0.24 0.00 0.00 174.94 175.39 1bg9 s ALA 86 N -0.98 3.19 -0.49 2.27 0.00 -0.52 -1.19 121.76 124.03 1bg9 s ALA 86 Ca 0.14 -0.96 -0.25 0.00 0.00 0.00 0.00 51.96 50.89 1bg9 s ALA 86 Cb -0.10 -1.28 0.03 0.00 0.00 0.00 0.00 23.12 21.77 1bg9 s ALA 86 CO 0.05 0.63 0.93 0.34 0.00 0.00 0.00 175.76 177.71 1bg9 s ASP 87 N -1.46 6.44 -0.44 0.00 -1.08 -1.22 0.07 116.67 118.97 1bg9 s ASP 87 Ca 0.18 -0.06 -0.18 0.00 -0.52 0.00 0.00 52.55 51.97 1bg9 s ASP 87 Cb -0.11 -2.44 0.03 0.00 -1.46 0.00 0.00 42.92 38.93 1bg9 s ASP 87 CO 0.09 -1.11 0.50 -0.63 0.52 0.00 0.00 175.17 174.54 1bg9 s ILE 88 N 3.82 5.01 -0.48 4.11 -1.09 0.00 -4.44 121.20 128.13 1bg9 s ILE 88 Ca 0.34 -0.31 -0.10 0.00 -2.23 0.00 0.00 60.65 58.34 1bg9 s ILE 88 Cb -0.11 -4.11 0.12 0.00 -1.58 0.00 0.00 42.46 36.78 1bg9 s ILE 88 CO 0.24 -0.52 0.37 -0.69 -1.23 0.00 0.00 174.94 173.11 1bg9 s VAL 89 N 2.32 4.40 -0.01 2.92 1.01 -1.26 -1.15 120.40 128.63 1bg9 s VAL 89 Ca 0.14 -1.73 0.01 0.00 0.00 0.00 0.00 61.98 60.40 1bg9 s VAL 89 Cb -0.17 -3.88 0.01 0.00 0.00 0.00 0.00 36.38 32.34 1bg9 s VAL 89 CO 0.14 -0.79 0.81 2.30 0.00 0.00 0.00 175.10 177.55 1bg9 n ILE 90 N 4.97 0.61 0.05 2.22 -5.35 -1.26 -4.74 119.36 115.85 1bg9 n ILE 90 Ca -0.09 -0.62 -0.06 0.00 -0.27 0.00 0.00 62.75 61.71 1bg9 n ILE 90 Cb 0.41 0.67 0.13 0.00 -1.74 0.00 0.00 39.64 39.10 1bg9 n ILE 90 CO 0.00 0.00 0.00 -1.13 -1.76 0.00 0.00 176.55 173.66 1bg9 h ASN 91 N 0.00 0.43 -5.24 7.28 -1.24 -1.88 -3.42 115.58 111.50 1bg9 h ASN 91 Ca 0.00 -0.21 -0.12 0.00 0.71 0.00 0.00 56.30 56.68 1bg9 h ASN 91 Cb 0.75 -0.12 -0.15 0.00 0.73 0.00 0.00 38.32 39.53 1bg9 h ASN 91 CO 0.00 0.86 -0.60 -1.38 -1.29 0.00 0.00 177.43 175.01 1bg9 s HIS 92 N -4.02 0.47 -0.01 0.67 -3.43 -1.26 -1.17 115.29 106.55 1bg9 s HIS 92 Ca -0.06 -0.98 -0.18 0.00 -0.80 0.00 0.00 55.06 53.04 1bg9 s HIS 92 Cb 0.12 -0.32 0.03 0.00 -1.43 0.00 0.00 32.58 30.98 1bg9 s HIS 92 CO 0.81 -0.44 0.39 0.50 -2.00 0.00 0.00 174.74 174.00 1bg9 s ARG 93 N -3.92 0.79 0.10 -0.38 3.52 -0.74 -4.68 118.95 113.63 1bg9 s ARG 93 Ca 0.09 -0.16 0.03 0.00 -0.13 0.00 0.00 55.73 55.56 1bg9 s ARG 93 Cb 0.07 0.35 -0.04 0.00 -1.56 0.00 0.00 34.95 33.78 1bg9 s ARG 93 CO -0.09 -0.24 0.13 0.95 -0.81 0.00 0.00 175.30 175.25 1bg9 s THR 94 N -1.56 4.74 0.12 4.11 -4.23 0.22 -3.55 115.64 115.50 1bg9 s THR 94 Ca -0.11 -0.75 -0.03 0.00 -1.18 0.00 0.00 61.69 59.61 1bg9 s THR 94 Cb -0.03 -3.33 -0.05 0.00 1.34 0.00 0.00 72.50 70.43 1bg9 s THR 94 CO 0.04 0.07 0.32 0.00 -0.54 0.00 0.00 174.62 174.51 1bg9 s ALA 95 N -1.51 3.86 -0.01 3.99 0.00 -1.26 -4.39 121.76 122.44 1bg9 s ALA 95 Ca 0.31 -0.65 -0.05 0.00 0.00 0.00 0.00 51.96 51.57 1bg9 s ALA 95 Cb -0.12 -2.03 -0.29 0.00 0.00 0.00 0.00 23.12 20.68 1bg9 s ALA 95 CO 0.24 0.72 0.81 1.49 0.00 0.00 0.00 175.76 179.02 1bg9 h GLU 96 N 2.91 0.30 -4.58 0.00 4.57 -1.12 -3.47 114.58 113.18 1bg9 h GLU 96 Ca -0.46 -0.51 -0.27 0.00 -1.18 0.00 0.00 59.36 56.95 1bg9 h GLU 96 Cb 1.16 0.19 -0.21 0.00 -0.16 0.00 0.00 28.75 29.73 1bg9 h GLU 96 CO 0.74 1.17 -0.73 -1.01 -1.18 0.00 0.00 179.01 178.00 1bg9 s HIS 97 N -2.61 0.69 0.23 0.92 3.76 0.61 -5.00 115.29 113.91 1bg9 s HIS 97 Ca -0.11 -0.53 -0.21 0.00 -0.15 0.00 0.00 55.06 54.06 1bg9 s HIS 97 Cb 0.06 -0.41 -0.08 0.00 1.11 0.00 0.00 32.58 33.25 1bg9 s HIS 97 CO 0.86 -0.09 0.76 0.15 -0.85 0.00 0.00 174.74 175.57 1bg9 s LYS 98 N -1.75 4.32 0.00 1.40 1.02 -1.26 -0.74 119.74 122.73 1bg9 s LYS 98 Ca -0.08 0.96 0.00 0.00 0.02 0.00 0.00 55.97 56.86 1bg9 s LYS 98 Cb -0.09 -2.89 0.00 0.00 -0.52 0.00 0.00 37.83 34.33 1bg9 s LYS 98 CO 0.00 0.39 0.00 -0.40 -0.92 0.00 0.00 175.35 174.42 1bg9 n ASP 99 N 0.76 0.00 -0.35 2.83 5.75 -0.16 -4.84 116.55 120.54 1bg9 n ASP 99 Ca -0.02 -0.70 0.11 0.00 -0.01 0.00 0.00 54.79 54.17 1bg9 n ASP 99 Cb 0.51 0.00 0.29 0.00 -1.03 0.00 0.00 41.12 40.89 1bg9 n ASP 99 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1bg9 h GLY 100 N 0.00 1.71 1.59 6.12 0.00 -1.97 0.14 103.07 110.67 1bg9 h GLY 100 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1bg9 h GLY 100 CO 0.00 -0.03 0.00 0.54 0.00 0.00 0.00 176.54 177.05 1bg9 n ARG 101 N -4.76 0.24 -1.00 4.80 1.74 -1.26 -4.82 116.66 111.60 1bg9 n ARG 101 Ca 0.22 0.12 0.00 0.00 -0.77 0.00 0.00 57.85 57.42 1bg9 n ARG 101 Cb 0.52 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.46 1bg9 n ARG 101 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bg9 n GLY 102 N 0.21 0.47 3.84 -0.13 0.00 0.50 -5.03 105.19 105.05 1bg9 n GLY 102 Ca 0.08 -0.29 -0.37 0.00 0.00 0.00 0.00 46.02 45.44 1bg9 n GLY 102 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bg9 s ILE 103 N -2.00 5.32 -1.03 -0.61 1.01 -1.25 -4.81 121.20 117.82 1bg9 s ILE 103 Ca 0.00 0.14 -0.23 0.00 0.00 0.00 0.00 60.65 60.56 1bg9 s ILE 103 Cb 0.00 -3.31 0.00 0.00 0.01 0.00 0.00 42.46 39.16 1bg9 s ILE 103 CO 0.00 0.61 1.72 -0.31 0.00 0.00 0.00 174.94 176.96 1bg9 s TYR 104 N -0.97 2.24 -0.03 3.97 2.02 -1.26 -0.98 117.35 122.33 1bg9 s TYR 104 Ca 0.15 -0.27 0.10 0.00 -0.37 0.00 0.00 57.07 56.68 1bg9 s TYR 104 Cb -0.12 -4.40 0.17 0.00 -0.40 0.00 0.00 41.96 37.22 1bg9 s TYR 104 CO 0.04 -1.77 1.08 0.00 -1.57 0.00 0.00 175.55 173.32 1bg9 s ILE 106 N -0.53 3.00 0.43 0.00 1.01 0.09 -2.94 121.20 122.27 1bg9 s ILE 106 Ca 0.15 -0.79 -0.08 0.00 0.00 0.00 0.00 60.65 59.93 1bg9 s ILE 106 Cb 0.16 -2.43 -0.05 0.00 0.01 0.00 0.00 42.46 40.14 1bg9 s ILE 106 CO -0.05 0.33 0.77 -0.36 0.00 0.00 0.00 174.94 175.63 1bg9 s PHE 107 N 1.39 3.51 -0.14 3.97 0.08 0.39 -0.28 117.98 126.89 1bg9 s PHE 107 Ca 0.03 0.95 -0.04 0.00 0.12 0.00 0.00 56.93 57.99 1bg9 s PHE 107 Cb -0.15 -2.38 0.05 0.00 -0.57 0.00 0.00 43.02 39.97 1bg9 s PHE 107 CO -0.05 -0.17 0.07 -2.00 -0.10 0.00 0.00 175.22 172.97 1bg9 s GLU 108 N -4.19 0.20 0.56 0.44 2.56 -1.26 -4.01 118.70 113.01 1bg9 s GLU 108 Ca 0.50 -0.05 0.35 0.00 0.00 0.00 0.00 54.97 55.77 1bg9 s GLU 108 Cb -0.10 -1.57 1.93 0.00 2.00 0.00 0.00 34.13 36.38 1bg9 s GLU 108 CO 0.37 -0.57 2.08 0.78 -0.56 0.00 0.00 175.26 177.36 1bg9 h GLY 109 N 8.38 0.00 0.00 -1.50 0.00 -1.58 -3.31 103.07 105.06 1bg9 h GLY 109 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1bg9 h GLY 109 CO 0.27 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.42 1bg9 n GLY 110 N -1.16 0.35 3.44 4.60 0.00 -1.26 -0.56 105.19 110.59 1bg9 n GLY 110 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 1bg9 n GLY 110 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bg9 s THR 111 N -2.00 2.20 0.25 2.61 -4.23 -1.26 -4.65 115.64 108.56 1bg9 s THR 111 Ca 0.00 -2.32 0.36 0.00 -1.18 0.00 0.00 61.69 58.55 1bg9 s THR 111 Cb 0.00 -2.26 0.38 0.00 1.34 0.00 0.00 72.50 71.96 1bg9 s THR 111 CO 0.00 -0.44 2.09 -0.65 -0.54 0.00 0.00 174.62 175.08 1bg9 h PRO 112 N 2.34 0.00 0.00 3.99 0.11 -1.99 -3.42 132.00 133.03 1bg9 h PRO 112 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1bg9 h PRO 112 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1bg9 h PRO 112 CO 0.62 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.01 1bg9 n ASP 113 N -2.89 0.00 -0.36 -2.05 5.68 -1.26 -5.03 116.55 110.65 1bg9 n ASP 113 Ca -0.01 -0.27 0.11 0.00 -0.50 0.00 0.00 54.79 54.12 1bg9 n ASP 113 Cb 0.16 0.00 0.04 0.00 -1.14 0.00 0.00 41.12 40.18 1bg9 n ASP 113 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1bg9 n ALA 114 N -3.00 3.70 -1.68 2.12 0.00 -1.26 -4.86 120.51 115.52 1bg9 n ALA 114 Ca 0.00 -0.59 -0.51 0.00 0.00 0.00 0.00 53.44 52.34 1bg9 n ALA 114 Cb 0.00 -0.85 -0.06 0.00 0.00 0.00 0.00 19.45 18.54 1bg9 n ALA 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1bg9 n ARG 115 N -0.42 1.77 -1.22 0.00 1.74 -1.26 -0.21 116.66 117.05 1bg9 n ARG 115 Ca 0.09 0.65 -0.07 0.00 -0.77 0.00 0.00 57.85 57.74 1bg9 n ARG 115 Cb 0.42 -2.41 -0.03 0.00 -1.02 0.00 0.00 32.46 29.42 1bg9 n ARG 115 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1bg9 n LEU 116 N 5.49 -0.24 -3.89 0.55 4.32 -1.26 -3.51 117.00 118.46 1bg9 n LEU 116 Ca 0.23 0.19 -0.43 0.00 -0.02 0.00 0.00 56.01 55.98 1bg9 n LEU 116 Cb 0.23 -1.96 0.00 0.00 -1.62 0.00 0.00 43.42 40.08 1bg9 n LEU 116 CO 0.73 -0.70 1.91 0.47 -1.22 0.00 0.00 177.39 178.58 1bg9 n ASP 117 N -0.43 5.14 -4.29 -1.43 8.00 0.70 -3.16 116.55 121.08 1bg9 n ASP 117 Ca -0.07 -3.12 -0.27 0.00 0.71 0.00 0.00 54.79 52.03 1bg9 n ASP 117 Cb 0.40 -1.47 0.16 0.00 -0.02 0.00 0.00 41.12 40.19 1bg9 n ASP 117 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1bg9 s TRP 118 N 0.32 1.44 0.00 1.24 0.51 -1.26 -4.78 118.94 116.41 1bg9 s TRP 118 Ca 0.39 0.03 0.00 0.00 -2.12 0.00 0.00 56.10 54.41 1bg9 s TRP 118 Cb 0.09 -3.71 0.00 0.00 -0.81 0.00 0.00 33.47 29.04 1bg9 s TRP 118 CO 0.01 -2.37 0.00 0.41 -0.51 0.00 0.00 176.95 174.49 1bg9 n GLY 119 N -3.44 4.37 0.34 0.98 0.00 -1.26 -0.46 105.19 105.71 1bg9 n GLY 119 Ca 0.16 -1.62 0.18 0.00 0.00 0.00 0.00 46.02 44.74 1bg9 n GLY 119 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1bg9 h PRO 120 N 0.00 0.00 0.00 1.61 0.11 -1.83 -0.11 132.00 131.78 1bg9 h PRO 120 Ca 0.00 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.06 1bg9 h PRO 120 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 1bg9 h PRO 120 CO 0.00 0.00 -0.24 1.25 -0.21 0.00 0.00 178.00 178.80 1bg9 h HIS 121 N 0.00 0.00 -0.38 0.65 2.76 -1.93 -1.44 115.15 114.81 1bg9 h HIS 121 Ca 0.05 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 1bg9 h HIS 121 Cb 0.45 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.41 1bg9 h HIS 121 CO 0.00 0.24 0.00 -1.33 -1.30 0.00 0.00 177.93 175.54 1bg9 n MET 122 N -3.77 2.18 -4.03 5.26 2.81 -0.05 -3.92 117.12 115.60 1bg9 n MET 122 Ca -0.01 -1.50 -0.35 0.00 -1.81 0.00 0.00 57.70 54.03 1bg9 n MET 122 Cb 0.34 -1.44 -0.09 0.00 -0.71 0.00 0.00 33.22 31.32 1bg9 n MET 122 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1bg9 s ILE 123 N -1.57 4.90 -0.16 2.02 1.01 -0.54 -1.28 121.20 125.57 1bg9 s ILE 123 Ca 0.27 -0.01 -0.41 0.00 0.00 0.00 0.00 60.65 60.51 1bg9 s ILE 123 Cb 0.16 -3.17 -0.18 0.00 0.01 0.00 0.00 42.46 39.28 1bg9 s ILE 123 CO 0.16 0.52 1.41 0.00 0.00 0.00 0.00 174.94 177.03 1bg9 n ARG 125 N 3.18 -0.03 -0.52 0.00 0.63 0.94 -1.42 116.66 119.43 1bg9 n ARG 125 Ca 0.24 0.50 0.10 0.00 -0.92 0.00 0.00 57.85 57.77 1bg9 n ARG 125 Cb 0.08 -0.78 0.33 0.00 0.45 0.00 0.00 32.46 32.54 1bg9 n ARG 125 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1bg9 n ASP 126 N -4.35 4.43 -4.15 6.15 8.00 -1.26 -3.43 116.55 121.94 1bg9 n ASP 126 Ca 0.07 -2.34 -0.44 0.00 0.71 0.00 0.00 54.79 52.80 1bg9 n ASP 126 Cb 0.23 -0.53 0.00 0.00 -0.02 0.00 0.00 41.12 40.80 1bg9 n ASP 126 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1bg9 n ASP 127 N 1.14 5.74 -4.77 -2.24 2.03 -0.51 -4.97 116.55 112.98 1bg9 n ASP 127 Ca 0.24 -3.18 -0.38 0.00 0.52 0.00 0.00 54.79 51.99 1bg9 n ASP 127 Cb 0.80 -1.39 0.00 0.00 -0.72 0.00 0.00 41.12 39.81 1bg9 n ASP 127 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1bg9 s ARG 128 N -1.13 3.72 0.00 -0.67 0.52 -1.26 -0.89 118.95 119.23 1bg9 s ARG 128 Ca 0.34 1.96 0.29 0.00 -0.52 0.00 0.00 55.73 57.80 1bg9 s ARG 128 Cb 0.00 -2.49 1.29 0.00 0.52 0.00 0.00 34.95 34.27 1bg9 s ARG 128 CO 0.02 -0.64 1.89 -0.35 0.02 0.00 0.00 175.30 176.24 1bg9 n PRO 129 N -0.38 0.95 -0.06 3.54 -0.04 -1.26 -4.86 135.00 132.89 1bg9 n PRO 129 Ca 0.07 -0.35 -0.14 0.00 -0.04 0.00 0.00 63.50 63.04 1bg9 n PRO 129 Cb 0.46 -1.49 -0.07 0.00 -0.04 0.00 0.00 33.50 32.36 1bg9 n PRO 129 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1bg9 h TYR 130 N 0.86 0.57 -4.14 0.54 0.05 -1.53 -3.44 116.97 109.88 1bg9 h TYR 130 Ca 0.00 -0.20 -0.54 0.00 0.05 0.00 0.00 58.73 58.04 1bg9 h TYR 130 Cb 0.33 -0.11 0.15 0.00 1.01 0.00 0.00 36.73 38.11 1bg9 h TYR 130 CO 0.00 0.89 0.44 0.00 -1.05 0.00 0.00 178.16 178.44 1bg9 s ALA 131 N -4.12 2.28 -0.20 3.88 0.00 -0.07 -4.76 121.76 118.76 1bg9 s ALA 131 Ca -0.13 1.01 0.16 0.00 0.00 0.00 0.00 51.96 52.99 1bg9 s ALA 131 Cb 0.06 -3.49 0.60 0.00 0.00 0.00 0.00 23.12 20.29 1bg9 s ALA 131 CO 0.79 -1.66 1.51 -0.40 0.00 0.00 0.00 175.76 176.00 1bg9 n ASP 132 N -2.26 4.24 0.00 0.00 5.75 -1.25 -4.77 116.55 118.26 1bg9 n ASP 132 Ca 0.14 -3.05 0.00 0.00 -0.01 0.00 0.00 54.79 51.87 1bg9 n ASP 132 Cb 0.49 -0.59 0.00 0.00 -1.03 0.00 0.00 41.12 40.00 1bg9 n ASP 132 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1bg9 n GLY 133 N -0.30 1.65 0.49 6.12 0.00 -1.22 -4.82 105.19 107.10 1bg9 n GLY 133 Ca 0.24 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.39 1bg9 n GLY 133 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bg9 n THR 134 N -2.00 0.00 -2.60 2.61 -2.24 -1.26 -4.80 114.28 103.99 1bg9 n THR 134 Ca 0.00 -0.25 -0.24 0.00 -2.27 0.00 0.00 64.05 61.29 1bg9 n THR 134 Cb 0.00 0.82 0.12 0.00 -2.10 0.00 0.00 70.33 69.18 1bg9 n THR 134 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1bg9 s GLY 135 N -2.29 1.75 0.59 3.38 0.00 -1.25 -4.97 107.32 104.54 1bg9 s GLY 135 Ca 0.27 -1.85 -0.15 0.00 0.00 0.00 0.00 44.72 42.99 1bg9 s GLY 135 CO 0.45 -1.22 1.04 -1.31 0.00 0.00 0.00 173.10 172.06 1bg9 s ASN 136 N -4.81 5.92 0.93 1.64 0.01 -1.26 -3.37 114.94 114.01 1bg9 s ASN 136 Ca 0.68 1.71 -0.12 0.00 -0.71 0.00 0.00 52.86 54.43 1bg9 s ASN 136 Cb -0.04 -2.52 0.15 0.00 0.41 0.00 0.00 41.25 39.25 1bg9 s ASN 136 CO 0.45 -1.07 1.09 -2.16 -1.51 0.00 0.00 177.10 173.90 1bg9 s PRO 137 N -4.28 0.94 0.20 -0.60 0.04 -1.26 -0.04 135.00 130.00 1bg9 s PRO 137 Ca 0.61 0.88 -0.30 0.00 0.04 0.00 0.00 61.00 62.23 1bg9 s PRO 137 Cb -0.14 -1.77 -0.09 0.00 0.04 0.00 0.00 34.50 32.54 1bg9 s PRO 137 CO 0.39 -2.47 1.33 0.34 0.04 0.00 0.00 177.00 176.63 1bg9 s ASP 138 N -3.25 6.86 0.00 6.66 -1.08 -1.26 -4.75 116.67 119.85 1bg9 s ASP 138 Ca 0.64 2.42 0.18 0.00 -0.52 0.00 0.00 52.55 55.28 1bg9 s ASP 138 Cb -0.19 -2.61 0.89 0.00 -1.46 0.00 0.00 42.92 39.55 1bg9 s ASP 138 CO 0.58 -0.56 1.56 0.35 0.52 0.00 0.00 175.17 177.62 1bg9 n THR 139 N 2.71 0.52 -2.12 1.71 -2.24 -1.26 -4.92 114.28 108.67 1bg9 n THR 139 Ca 0.07 0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 1bg9 n THR 139 Cb 0.42 -0.83 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 1bg9 n THR 139 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bg9 n GLY 140 N 0.28 2.51 3.77 3.38 0.00 -1.22 -2.69 105.19 111.22 1bg9 n GLY 140 Ca 0.08 -0.69 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 1bg9 n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bg9 s ALA 141 N -1.00 2.23 -0.00 4.61 0.00 0.12 -4.76 121.76 122.96 1bg9 s ALA 141 Ca 0.00 0.23 -0.02 0.00 0.00 0.00 0.00 51.96 52.17 1bg9 s ALA 141 Cb 0.00 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 1bg9 s ALA 141 CO 0.00 -1.78 0.17 0.34 0.00 0.00 0.00 175.76 174.49 1bg9 s ASP 142 N -3.42 6.28 -0.23 0.00 2.15 -1.26 -4.45 116.67 115.73 1bg9 s ASP 142 Ca 0.61 0.31 -0.06 0.00 0.43 0.00 0.00 52.55 53.84 1bg9 s ASP 142 Cb -0.17 -1.95 -0.02 0.00 -0.30 0.00 0.00 42.92 40.48 1bg9 s ASP 142 CO 0.56 0.25 0.03 0.12 -0.17 0.00 0.00 175.17 175.96 1bg9 s PHE 143 N -1.33 3.05 0.04 -5.34 5.36 -1.26 -5.04 117.98 113.46 1bg9 s PHE 143 Ca 0.27 -0.55 -0.23 0.00 -0.96 0.00 0.00 56.93 55.46 1bg9 s PHE 143 Cb -0.13 -2.18 -0.12 0.00 -0.34 0.00 0.00 43.02 40.26 1bg9 s PHE 143 CO 0.19 -0.38 1.34 0.78 -1.46 0.00 0.00 175.22 175.69 1bg9 h GLY 144 N 8.07 -0.92 1.53 13.12 0.00 -1.99 -3.27 103.07 119.61 1bg9 h GLY 144 Ca -0.39 0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1bg9 h GLY 144 CO 0.59 -0.32 0.20 0.00 0.00 0.00 0.00 176.54 177.01 1bg9 h ALA 145 N -1.51 1.16 -2.43 3.60 0.00 -2.02 -3.44 119.26 114.63 1bg9 h ALA 145 Ca -0.07 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 1bg9 h ALA 145 Cb 0.61 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.25 1bg9 h ALA 145 CO 0.09 -0.16 -0.61 0.00 0.00 0.00 0.00 179.25 178.56 1bg9 s ALA 146 N -3.72 0.72 0.15 0.00 0.00 -1.23 -5.09 121.76 112.59 1bg9 s ALA 146 Ca -0.03 -1.37 -0.33 0.00 0.00 0.00 0.00 51.96 50.23 1bg9 s ALA 146 Cb 0.07 0.80 -0.16 0.00 0.00 0.00 0.00 23.12 23.83 1bg9 s ALA 146 CO 0.22 -0.49 1.14 -2.30 0.00 0.00 0.00 175.76 174.33 1bg9 n PRO 147 N -0.09 1.02 -4.04 0.00 -0.02 -1.23 -4.71 135.00 125.93 1bg9 n PRO 147 Ca -0.07 0.36 -0.35 0.00 -2.02 0.00 0.00 63.50 61.43 1bg9 n PRO 147 Cb 0.63 -1.85 -0.09 0.00 -0.02 0.00 0.00 33.50 32.17 1bg9 n PRO 147 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1bg9 s ASP 148 N -0.02 5.63 0.21 2.55 1.11 -1.26 -1.79 116.67 123.10 1bg9 s ASP 148 Ca 0.75 0.12 -0.30 0.00 0.18 0.00 0.00 52.55 53.30 1bg9 s ASP 148 Cb -0.89 -1.92 -0.08 0.00 1.07 0.00 0.00 42.92 41.10 1bg9 s ASP 148 CO 0.52 0.22 1.07 -0.63 1.18 0.00 0.00 175.17 177.54 1bg9 s ILE 149 N 0.11 3.82 -0.85 0.77 -1.09 -0.32 -2.10 121.20 121.54 1bg9 s ILE 149 Ca 0.05 1.66 -0.24 0.00 -2.23 0.00 0.00 60.65 59.89 1bg9 s ILE 149 Cb -0.12 -4.06 0.06 0.00 -1.58 0.00 0.00 42.46 36.76 1bg9 s ILE 149 CO 0.01 0.33 1.26 -0.62 -1.23 0.00 0.00 174.94 174.68 1bg9 s ASP 150 N -0.44 6.35 0.00 3.58 2.15 -0.41 -4.65 116.67 123.26 1bg9 s ASP 150 Ca 0.47 -1.13 0.22 0.00 0.43 0.00 0.00 52.55 52.55 1bg9 s ASP 150 Cb -0.29 -2.51 1.34 0.00 -0.30 0.00 0.00 42.92 41.15 1bg9 s ASP 150 CO 0.36 -1.54 1.80 1.41 -0.17 0.00 0.00 175.17 177.03 1bg9 n HIS 151 N 8.49 0.00 0.68 -5.34 8.25 -1.26 -2.06 115.22 123.98 1bg9 n HIS 151 Ca 0.15 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.73 1bg9 n HIS 151 Cb 0.49 0.00 0.19 0.00 1.12 0.00 0.00 29.99 31.79 1bg9 n HIS 151 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1bg9 n LEU 152 N -0.88 0.63 -4.74 2.41 4.32 -1.26 -4.71 117.00 112.77 1bg9 n LEU 152 Ca 0.17 0.17 -0.41 0.00 -0.02 0.00 0.00 56.01 55.91 1bg9 n LEU 152 Cb 0.08 -0.20 -0.03 0.00 -1.62 0.00 0.00 43.42 41.65 1bg9 n LEU 152 CO 0.13 -0.01 0.99 0.21 -1.22 0.00 0.00 177.39 177.49 1bg9 s ASN 153 N -3.90 6.89 0.34 -1.43 3.84 -0.87 -4.94 114.94 114.87 1bg9 s ASN 153 Ca 0.07 2.40 0.16 0.00 0.21 0.00 0.00 52.86 55.71 1bg9 s ASN 153 Cb 0.15 -2.61 0.52 0.00 -0.55 0.00 0.00 41.25 38.75 1bg9 s ASN 153 CO 0.72 -0.53 1.66 -0.07 -2.79 0.00 0.00 177.10 176.08 1bg9 h LEU 154 N 5.38 0.00 -0.43 3.21 3.38 -1.90 -1.61 115.31 123.34 1bg9 h LEU 154 Ca -0.45 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.36 1bg9 h LEU 154 Cb 1.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 1bg9 h LEU 154 CO 0.77 0.46 -0.52 -0.09 0.09 0.00 0.00 178.44 179.15 1bg9 h ARG 155 N 0.00 0.73 0.39 1.13 2.43 -1.97 -0.91 114.38 116.18 1bg9 h ARG 155 Ca -0.00 -0.44 -0.01 0.00 -0.81 0.00 0.00 59.98 58.71 1bg9 h ARG 155 Cb 1.02 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 1bg9 h ARG 155 CO 0.06 1.06 -0.28 0.28 -1.51 0.00 0.00 179.97 179.59 1bg9 h VAL 156 N 0.57 0.42 -0.86 0.20 2.07 -1.81 0.45 116.25 117.29 1bg9 h VAL 156 Ca 0.02 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.62 1bg9 h VAL 156 Cb 1.09 0.42 -0.07 0.00 -1.52 0.00 0.00 31.29 31.21 1bg9 h VAL 156 CO 0.11 0.00 0.52 1.56 0.02 0.00 0.00 177.57 179.78 1bg9 h GLN 157 N -0.65 0.88 -0.30 1.57 4.20 -1.22 0.07 115.11 119.67 1bg9 h GLN 157 Ca -0.04 -0.05 -0.16 0.00 0.06 0.00 0.00 58.65 58.47 1bg9 h GLN 157 Cb 0.56 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 28.14 1bg9 h GLN 157 CO 0.01 0.58 -0.42 0.87 -0.67 0.00 0.00 178.83 179.21 1bg9 h LYS 158 N 0.91 0.81 -0.03 1.46 1.79 -0.39 -1.31 116.57 119.81 1bg9 h LYS 158 Ca 0.40 -0.47 -0.20 0.00 -2.18 0.00 0.00 60.65 58.19 1bg9 h LYS 158 Cb 0.27 0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.96 1bg9 h LYS 158 CO -0.21 1.11 -0.84 0.93 -1.08 0.00 0.00 179.45 179.36 1bg9 h GLU 159 N 0.58 0.34 -0.26 3.15 5.08 -0.69 0.15 114.58 122.92 1bg9 h GLU 159 Ca 0.03 -0.33 -0.16 0.00 -1.00 0.00 0.00 59.36 57.90 1bg9 h GLU 159 Cb 1.02 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.34 1bg9 h GLU 159 CO 0.10 1.00 -0.50 1.25 -1.00 0.00 0.00 179.01 179.86 1bg9 h LEU 160 N 0.21 0.80 -0.87 1.33 5.85 -1.01 0.37 115.31 121.99 1bg9 h LEU 160 Ca -0.05 -0.41 -0.10 0.00 0.84 0.00 0.00 57.88 58.17 1bg9 h LEU 160 Cb 1.45 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 1bg9 h LEU 160 CO 0.14 1.16 -0.18 0.58 -0.34 0.00 0.00 178.44 179.79 1bg9 h VAL 161 N 0.58 1.26 -0.85 1.05 2.07 -0.97 -0.80 116.25 118.58 1bg9 h VAL 161 Ca 0.03 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.31 1bg9 h VAL 161 Cb 1.06 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.99 1bg9 h VAL 161 CO 0.10 0.40 0.47 -0.33 0.02 0.00 0.00 177.57 178.23 1bg9 h GLU 162 N 0.57 1.19 -0.41 1.57 5.08 -0.59 -0.46 114.58 121.53 1bg9 h GLU 162 Ca 0.09 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 1bg9 h GLU 162 Cb 0.63 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1bg9 h GLU 162 CO 0.04 0.88 -0.10 2.35 -1.00 0.00 0.00 179.01 181.18 1bg9 h TRP 163 N 1.19 0.88 -0.34 4.33 7.01 -0.34 0.59 115.95 129.27 1bg9 h TRP 163 Ca 0.30 -0.19 0.04 0.00 2.11 0.00 0.00 58.89 61.15 1bg9 h TRP 163 Cb 0.03 -0.21 -0.04 0.00 -2.10 0.00 0.00 29.16 26.84 1bg9 h TRP 163 CO 0.01 0.91 0.11 -0.07 -2.79 0.00 0.00 178.44 176.60 1bg9 h LEU 164 N 0.60 0.11 -1.42 0.65 4.07 -0.95 -0.04 115.31 118.33 1bg9 h LEU 164 Ca 0.10 0.04 -0.06 0.00 0.08 0.00 0.00 57.88 58.04 1bg9 h LEU 164 Cb 0.62 0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.38 1bg9 h LEU 164 CO 0.04 0.10 -0.27 0.78 -1.08 0.00 0.00 178.44 178.01 1bg9 h ASN 165 N 0.25 0.00 -0.19 -0.43 2.35 -0.78 -1.18 115.58 115.60 1bg9 h ASN 165 Ca 0.15 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.81 1bg9 h ASN 165 Cb 0.13 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.50 1bg9 h ASN 165 CO -0.16 0.27 -0.25 -0.25 -1.65 0.00 0.00 177.43 175.39 1bg9 h TRP 166 N 0.00 0.61 -0.97 1.19 7.01 0.33 0.20 115.95 124.32 1bg9 h TRP 166 Ca -0.00 -0.20 0.09 0.00 2.11 0.00 0.00 58.89 60.89 1bg9 h TRP 166 Cb 0.59 -0.12 -0.07 0.00 -2.10 0.00 0.00 29.16 27.45 1bg9 h TRP 166 CO 0.00 0.89 0.61 -0.07 -2.79 0.00 0.00 178.44 177.09 1bg9 h LEU 167 N 0.16 0.94 0.37 0.65 3.38 -0.66 0.81 115.31 120.97 1bg9 h LEU 167 Ca 0.02 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1bg9 h LEU 167 Cb 0.81 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1bg9 h LEU 167 CO 0.06 0.55 -0.18 0.11 0.09 0.00 0.00 178.44 179.07 1bg9 h LYS 168 N 1.05 -0.48 0.20 1.13 1.57 -0.96 0.27 116.57 119.34 1bg9 h LYS 168 Ca 0.45 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.26 1bg9 h LYS 168 Cb 0.32 0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.75 1bg9 h LYS 168 CO -0.22 -0.17 -0.10 0.00 -0.57 0.00 0.00 179.45 178.39 1bg9 h ALA 169 N -0.56 -0.52 -0.01 3.86 0.00 -0.21 -0.82 119.26 121.00 1bg9 h ALA 169 Ca -0.05 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 1bg9 h ALA 169 Cb 0.54 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1bg9 h ALA 169 CO 0.08 -0.50 -0.81 0.22 0.00 0.00 0.00 179.25 178.25 1bg9 h ASP 170 N -0.52 0.16 0.08 0.00 1.82 0.42 -3.35 116.42 115.04 1bg9 h ASP 170 Ca -0.03 -0.13 -0.37 0.00 -0.39 0.00 0.00 57.03 56.12 1bg9 h ASP 170 Cb 0.21 -0.05 -0.06 0.00 0.68 0.00 0.00 39.33 40.11 1bg9 h ASP 170 CO 0.05 0.90 -2.27 -0.38 -1.61 0.00 0.00 179.24 175.92 1bg9 n ILE 171 N -3.67 1.54 0.00 2.25 2.08 -0.76 -5.01 119.36 115.79 1bg9 n ILE 171 Ca -0.02 -0.68 0.00 0.00 0.56 0.00 0.00 62.75 62.60 1bg9 n ILE 171 Cb 0.76 -1.22 0.00 0.00 -0.75 0.00 0.00 39.64 38.43 1bg9 n ILE 171 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1bg9 n GLY 172 N 2.01 1.11 3.77 7.39 0.00 0.86 -4.71 105.19 115.61 1bg9 n GLY 172 Ca -0.37 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.26 1bg9 n GLY 172 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bg9 s PHE 173 N -2.00 2.86 -0.13 1.61 0.08 -0.62 -4.80 117.98 114.97 1bg9 s PHE 173 Ca 0.00 1.41 0.18 0.00 0.12 0.00 0.00 56.93 58.65 1bg9 s PHE 173 Cb 0.00 -3.67 -0.24 0.00 -0.57 0.00 0.00 43.02 38.54 1bg9 s PHE 173 CO 0.00 -2.04 0.39 -0.25 -0.10 0.00 0.00 175.22 173.22 1bg9 n ASP 174 N 0.24 0.25 -2.16 1.36 8.00 -0.29 -4.29 116.55 119.66 1bg9 n ASP 174 Ca 0.03 0.11 -0.06 0.00 0.71 0.00 0.00 54.79 55.58 1bg9 n ASP 174 Cb 0.43 1.00 0.01 0.00 -0.02 0.00 0.00 41.12 42.55 1bg9 n ASP 174 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bg9 n GLY 175 N 1.53 1.46 3.14 0.44 0.00 -1.22 -1.48 105.19 109.07 1bg9 n GLY 175 Ca -0.19 -1.21 -0.18 0.00 0.00 0.00 0.00 46.02 44.44 1bg9 n GLY 175 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1bg9 s TRP 176 N -4.52 1.15 -0.15 1.61 0.23 -0.59 -1.44 118.94 115.24 1bg9 s TRP 176 Ca 0.11 -0.41 0.00 0.00 -2.03 0.00 0.00 56.10 53.77 1bg9 s TRP 176 Cb -0.03 -0.66 -0.01 0.00 0.03 0.00 0.00 33.47 32.80 1bg9 s TRP 176 CO 0.08 0.03 -0.15 -0.98 0.96 0.00 0.00 176.95 176.90 1bg9 s ARG 177 N -1.45 3.26 -0.50 4.98 1.04 0.11 -1.02 118.95 125.38 1bg9 s ARG 177 Ca -0.01 -0.73 -0.19 0.00 -1.04 0.00 0.00 55.73 53.75 1bg9 s ARG 177 Cb -0.09 -2.62 0.06 0.00 -2.04 0.00 0.00 34.95 30.26 1bg9 s ARG 177 CO 0.02 0.08 0.60 -0.06 -0.04 0.00 0.00 175.30 175.90 1bg9 s PHE 178 N 0.66 3.07 0.33 5.89 0.08 -0.35 -0.82 117.98 126.85 1bg9 s PHE 178 Ca -0.08 -0.53 -0.29 0.00 0.12 0.00 0.00 56.93 56.16 1bg9 s PHE 178 Cb -0.16 -3.47 -0.11 0.00 -0.57 0.00 0.00 43.02 38.71 1bg9 s PHE 178 CO 0.02 -0.99 1.54 -3.47 -0.10 0.00 0.00 175.22 172.22 1bg9 n ASP 179 N 6.08 3.78 -3.98 1.36 2.03 -0.30 -1.92 116.55 123.60 1bg9 n ASP 179 Ca -0.07 1.18 -0.40 0.00 0.52 0.00 0.00 54.79 56.03 1bg9 n ASP 179 Cb 0.45 -1.60 0.01 0.00 -0.72 0.00 0.00 41.12 39.27 1bg9 n ASP 179 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1bg9 n PHE 180 N 1.40 -1.54 0.84 -0.67 7.35 -1.25 -4.63 117.46 118.97 1bg9 n PHE 180 Ca 0.06 0.28 0.09 0.00 -0.76 0.00 0.00 57.45 57.11 1bg9 n PHE 180 Cb 0.37 -3.04 0.46 0.00 0.35 0.00 0.00 39.48 37.63 1bg9 n PHE 180 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1bg9 n ALA 181 N -4.73 1.98 0.35 3.13 0.00 -1.00 0.00 120.51 120.25 1bg9 n ALA 181 Ca -0.14 -0.08 0.06 0.00 0.00 0.00 0.00 53.44 53.27 1bg9 n ALA 181 Cb 0.59 -1.31 0.27 0.00 0.00 0.00 0.00 19.45 19.00 1bg9 n ALA 181 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1bg9 n LYS 182 N -1.34 0.03 0.24 0.00 5.02 -1.26 -3.53 118.16 117.32 1bg9 n LYS 182 Ca 0.08 0.35 0.12 0.00 -2.02 0.00 0.00 58.31 56.83 1bg9 n LYS 182 Cb 0.17 -1.56 0.54 0.00 -0.02 0.00 0.00 35.03 34.16 1bg9 n LYS 182 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1bg9 h GLY 183 N 1.77 0.00 -3.00 0.72 0.00 -0.64 0.35 103.07 102.27 1bg9 h GLY 183 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 1bg9 h GLY 183 CO 0.00 0.00 -0.28 -2.52 0.00 0.00 0.00 176.54 173.74 1bg9 s TYR 184 N -3.71 0.14 0.68 5.60 1.13 -1.23 -3.04 117.35 116.91 1bg9 s TYR 184 Ca 0.00 -0.53 -0.14 0.00 -1.41 0.00 0.00 57.07 55.00 1bg9 s TYR 184 Cb 0.10 0.02 0.01 0.00 -1.10 0.00 0.00 41.96 40.99 1bg9 s TYR 184 CO 0.61 -0.64 1.09 -1.54 -2.51 0.00 0.00 175.55 172.56 1bg9 s SER 185 N -2.88 5.12 0.62 -0.18 1.04 -1.10 -4.71 113.70 111.61 1bg9 s SER 185 Ca 0.08 1.89 0.38 0.00 0.48 0.00 0.00 55.95 58.79 1bg9 s SER 185 Cb 0.04 -2.54 2.09 0.00 0.10 0.00 0.00 66.02 65.70 1bg9 s SER 185 CO -0.08 -1.62 2.28 0.00 0.98 0.00 0.00 173.24 174.80 1bg9 h ALA 186 N -0.22 1.15 -0.24 5.32 0.00 -1.90 -0.01 119.26 123.36 1bg9 h ALA 186 Ca -0.46 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.35 1bg9 h ALA 186 Cb 1.23 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1bg9 h ALA 186 CO 0.54 0.02 -0.20 -0.44 0.00 0.00 0.00 179.25 179.17 1bg9 h ASP 187 N 0.00 0.59 -0.35 0.00 3.32 -1.91 0.26 116.42 118.34 1bg9 h ASP 187 Ca -0.00 -0.46 -0.06 0.00 0.02 0.00 0.00 57.03 56.54 1bg9 h ASP 187 Cb 0.09 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 1bg9 h ASP 187 CO 0.00 0.93 -0.00 0.58 -1.72 0.00 0.00 179.24 179.03 1bg9 h VAL 188 N 0.27 1.26 -0.79 -1.35 2.07 -1.40 -2.62 116.25 113.69 1bg9 h VAL 188 Ca 0.04 -0.98 0.02 0.00 0.82 0.00 0.00 66.70 66.60 1bg9 h VAL 188 Cb 0.74 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 1bg9 h VAL 188 CO 0.05 0.32 0.51 0.00 0.02 0.00 0.00 177.57 178.48 1bg9 h ALA 189 N 0.86 1.02 -0.59 1.67 0.00 -1.14 -2.08 119.26 119.00 1bg9 h ALA 189 Ca 0.10 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.07 1bg9 h ALA 189 Cb 0.46 -0.29 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 1bg9 h ALA 189 CO 0.02 0.37 0.14 -0.22 0.00 0.00 0.00 179.25 179.56 1bg9 h LYS 190 N 1.03 0.27 -0.30 0.00 3.64 -0.61 0.14 116.57 120.74 1bg9 h LYS 190 Ca 0.30 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.73 1bg9 h LYS 190 Cb -0.06 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 31.65 1bg9 h LYS 190 CO -0.09 0.18 -0.07 0.82 -2.27 0.00 0.00 179.45 178.02 1bg9 h ILE 191 N 0.28 0.71 -0.32 2.00 2.04 -1.02 0.15 117.51 121.35 1bg9 h ILE 191 Ca 0.31 -0.00 -0.06 0.00 1.00 0.00 0.00 64.86 66.11 1bg9 h ILE 191 Cb 0.44 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 1bg9 h ILE 191 CO -0.38 0.00 -0.05 1.88 0.00 0.00 0.00 178.15 179.61 1bg9 h TYR 192 N 0.00 0.54 -0.03 1.37 0.05 -0.67 0.84 116.97 119.08 1bg9 h TYR 192 Ca 0.14 -0.06 -0.04 0.00 0.05 0.00 0.00 58.73 58.81 1bg9 h TYR 192 Cb 0.22 -0.15 0.00 0.00 1.01 0.00 0.00 36.73 37.80 1bg9 h TYR 192 CO -0.28 0.56 -0.15 0.82 -1.05 0.00 0.00 178.16 178.06 1bg9 h ILE 193 N 0.49 1.50 -0.38 -2.88 2.04 -0.46 -1.50 117.51 116.32 1bg9 h ILE 193 Ca 0.10 -1.68 -0.01 0.00 1.00 0.00 0.00 64.86 64.26 1bg9 h ILE 193 Cb 0.39 2.53 -0.02 0.00 -0.74 0.00 0.00 36.82 38.98 1bg9 h ILE 193 CO 0.02 0.46 0.19 0.44 0.00 0.00 0.00 178.15 179.26 1bg9 h ASP 194 N -0.46 0.49 1.85 1.72 3.32 -0.49 0.20 116.42 123.06 1bg9 h ASP 194 Ca -0.01 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 1bg9 h ASP 194 Cb 0.83 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 40.25 1bg9 h ASP 194 CO 0.03 0.47 -0.15 0.03 -1.72 0.00 0.00 179.24 177.90 1bg9 h ARG 195 N 0.48 0.00 0.00 3.56 3.08 -0.90 -3.16 114.38 117.45 1bg9 h ARG 195 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 1bg9 h ARG 195 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1bg9 h ARG 195 CO -0.02 0.03 -1.20 -1.13 -1.07 0.00 0.00 179.97 176.58 1bg9 n SER 196 N -3.05 0.56 -3.62 7.04 3.41 -0.56 -4.99 113.62 112.41 1bg9 n SER 196 Ca 0.03 -0.17 -0.21 0.00 -0.26 0.00 0.00 58.87 58.26 1bg9 n SER 196 Cb 0.54 0.99 0.01 0.00 -0.26 0.00 0.00 64.21 65.49 1bg9 n SER 196 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1bg9 n GLU 197 N -2.07 -1.34 -1.57 4.33 1.02 0.69 -4.91 120.64 116.80 1bg9 n GLU 197 Ca 0.01 0.85 -0.31 0.00 -0.02 0.00 0.00 57.16 57.69 1bg9 n GLU 197 Cb 0.47 -3.42 0.05 0.00 -0.02 0.00 0.00 31.44 28.52 1bg9 n GLU 197 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1bg9 s PRO 198 N -4.79 2.88 0.00 3.49 0.04 -1.25 -4.95 135.00 130.41 1bg9 s PRO 198 Ca 0.10 1.00 0.27 0.00 0.04 0.00 0.00 61.00 62.42 1bg9 s PRO 198 Cb -0.04 -1.98 0.96 0.00 0.04 0.00 0.00 34.50 33.47 1bg9 s PRO 198 CO 0.86 -1.15 1.71 -1.13 0.04 0.00 0.00 177.00 177.33 1bg9 n SER 199 N -3.10 0.47 -3.59 6.66 3.41 -0.55 -4.80 113.62 112.12 1bg9 n SER 199 Ca 0.08 -0.32 -0.14 0.00 -0.26 0.00 0.00 58.87 58.23 1bg9 n SER 199 Cb 0.53 -0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.38 1bg9 n SER 199 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1bg9 s PHE 200 N -2.73 -0.63 -0.19 7.33 5.36 -1.26 -4.92 117.98 120.94 1bg9 s PHE 200 Ca 0.20 1.35 -0.13 0.00 -0.96 0.00 0.00 56.93 57.40 1bg9 s PHE 200 Cb 0.19 0.35 0.06 0.00 -0.34 0.00 0.00 43.02 43.28 1bg9 s PHE 200 CO 0.56 -0.41 0.49 0.00 -1.46 0.00 0.00 175.22 174.40 1bg9 s ALA 201 N -0.30 -1.24 -0.04 11.12 0.00 -1.07 -1.54 121.76 128.69 1bg9 s ALA 201 Ca -0.03 1.62 0.03 0.00 0.00 0.00 0.00 51.96 53.58 1bg9 s ALA 201 Cb -0.03 -0.96 0.00 0.00 0.00 0.00 0.00 23.12 22.13 1bg9 s ALA 201 CO 0.02 -0.27 -0.12 0.54 0.00 0.00 0.00 175.76 175.93 1bg9 s VAL 202 N 1.01 1.07 0.12 0.00 0.11 -0.19 -1.27 120.40 121.26 1bg9 s VAL 202 Ca -0.06 -0.50 -0.00 0.00 -2.93 0.00 0.00 61.98 58.49 1bg9 s VAL 202 Cb -0.06 -0.95 -0.04 0.00 -1.53 0.00 0.00 36.38 33.80 1bg9 s VAL 202 CO -0.09 0.32 0.29 0.00 -3.33 0.00 0.00 175.10 172.30 1bg9 s ALA 203 N 0.26 3.93 -0.65 1.54 0.00 0.88 -1.21 121.76 126.51 1bg9 s ALA 203 Ca -0.06 -0.83 -0.08 0.00 0.00 0.00 0.00 51.96 50.99 1bg9 s ALA 203 Cb -0.11 -1.91 0.17 0.00 0.00 0.00 0.00 23.12 21.27 1bg9 s ALA 203 CO 0.02 0.66 0.52 -2.00 0.00 0.00 0.00 175.76 174.96 1bg9 s GLU 204 N -2.85 2.88 -0.42 0.00 2.12 -0.81 -1.85 118.70 117.78 1bg9 s GLU 204 Ca 0.37 -2.30 -0.13 0.00 0.36 0.00 0.00 54.97 53.27 1bg9 s GLU 204 Cb -0.12 -4.02 0.05 0.00 0.26 0.00 0.00 34.13 30.30 1bg9 s GLU 204 CO 0.28 -1.22 0.30 0.42 -0.54 0.00 0.00 175.26 174.50 1bg9 s ILE 205 N 0.41 4.94 -0.25 -3.70 -1.09 -1.26 -2.38 121.20 117.87 1bg9 s ILE 205 Ca 0.14 -0.93 0.03 0.00 -2.23 0.00 0.00 60.65 57.65 1bg9 s ILE 205 Cb -0.19 -3.85 0.06 0.00 -1.58 0.00 0.00 42.46 36.90 1bg9 s ILE 205 CO -0.04 -0.40 -0.12 0.86 -1.23 0.00 0.00 174.94 174.01 1bg9 s TRP 206 N 1.60 3.18 0.40 3.97 -0.11 -1.26 -4.80 118.94 121.92 1bg9 s TRP 206 Ca 0.04 -2.23 0.04 0.00 1.22 0.00 0.00 56.10 55.17 1bg9 s TRP 206 Cb -0.21 -1.92 -0.04 0.00 -1.50 0.00 0.00 33.47 29.80 1bg9 s TRP 206 CO 0.07 -0.87 0.06 0.95 -4.62 0.00 0.00 176.95 172.55 1bg9 s THR 207 N 1.13 1.12 0.56 5.86 -4.23 -1.26 -5.08 115.64 113.74 1bg9 s THR 207 Ca -0.07 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.32 1bg9 s THR 207 Cb -0.19 -2.57 -0.05 0.00 1.34 0.00 0.00 72.50 71.03 1bg9 s THR 207 CO -0.06 0.00 0.97 -0.44 -0.54 0.00 0.00 174.62 174.55 1bg9 s SER 208 N -3.62 6.35 0.62 3.99 0.01 -1.26 -5.03 113.70 114.75 1bg9 s SER 208 Ca 0.27 1.38 -0.09 0.00 1.31 0.00 0.00 55.95 58.82 1bg9 s SER 208 Cb 0.06 -2.44 -0.01 0.00 0.21 0.00 0.00 66.02 63.84 1bg9 s SER 208 CO 0.13 -0.73 0.97 -0.76 0.41 0.00 0.00 173.24 173.26 1bg9 s LEU 209 N -4.77 3.19 0.01 2.44 1.02 -1.26 -4.89 118.68 114.43 1bg9 s LEU 209 Ca 0.55 1.06 -0.29 0.00 0.02 0.00 0.00 54.13 55.47 1bg9 s LEU 209 Cb -0.11 -3.95 -0.04 0.00 0.02 0.00 0.00 46.19 42.12 1bg9 s LEU 209 CO 0.46 -1.02 0.92 0.00 0.02 0.00 0.00 176.35 176.73 1bg9 s ALA 210 N -3.11 3.22 -0.09 4.21 0.00 -1.26 -5.01 121.76 119.72 1bg9 s ALA 210 Ca 0.54 0.47 0.01 0.00 0.00 0.00 0.00 51.96 52.98 1bg9 s ALA 210 Cb -0.11 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 1bg9 s ALA 210 CO 0.49 -0.15 -0.10 0.71 0.00 0.00 0.00 175.76 176.71 1bg9 s TYR 211 N 0.71 2.84 0.65 0.00 1.51 -1.26 -1.00 117.35 120.81 1bg9 s TYR 211 Ca 0.48 -0.24 -0.02 0.00 -1.01 0.00 0.00 57.07 56.28 1bg9 s TYR 211 Cb -0.21 -1.75 0.13 0.00 -0.11 0.00 0.00 41.96 40.03 1bg9 s TYR 211 CO 0.27 0.11 0.90 0.41 -1.11 0.00 0.00 175.55 176.12 1bg9 n GLY 212 N 2.73 0.38 3.21 0.71 0.00 -0.43 -4.85 105.19 106.95 1bg9 n GLY 212 Ca -0.18 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.44 1bg9 n GLY 212 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bg9 n GLY 213 N -1.71 3.31 0.00 -0.02 0.00 -1.26 -1.98 105.19 103.54 1bg9 n GLY 213 Ca 0.14 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.67 1bg9 n GLY 213 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1bg9 n ASP 214 N 7.58 0.00 0.00 1.61 5.75 -1.26 -4.99 116.55 125.24 1bg9 n ASP 214 Ca 0.50 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.28 1bg9 n ASP 214 Cb 0.43 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.52 1bg9 n ASP 214 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1bg9 n GLY 215 N 0.00 0.66 3.43 6.12 0.00 -0.84 -5.02 105.19 109.53 1bg9 n GLY 215 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1bg9 n GLY 215 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bg9 s LYS 216 N -0.09 1.54 0.61 1.61 1.02 -1.26 -4.93 119.74 118.25 1bg9 s LYS 216 Ca 0.00 -1.63 -0.18 0.00 0.02 0.00 0.00 55.97 54.18 1bg9 s LYS 216 Cb 0.00 -1.67 -0.02 0.00 -0.52 0.00 0.00 37.83 35.62 1bg9 s LYS 216 CO 0.00 0.33 1.18 -2.14 -0.92 0.00 0.00 175.35 173.80 1bg9 s PRO 217 N -3.18 2.90 0.62 -1.68 0.02 -1.26 -1.31 135.00 131.11 1bg9 s PRO 217 Ca 0.25 1.71 -0.17 0.00 0.02 0.00 0.00 61.00 62.81 1bg9 s PRO 217 Cb -0.06 -1.93 -0.02 0.00 0.02 0.00 0.00 34.50 32.51 1bg9 s PRO 217 CO 0.11 -1.24 1.14 -0.80 -0.33 0.00 0.00 177.00 175.88 1bg9 s ASN 218 N -1.84 5.22 0.23 2.53 0.01 -0.17 -4.68 114.94 116.25 1bg9 s ASN 218 Ca 0.75 2.13 -0.04 0.00 -0.71 0.00 0.00 52.86 54.98 1bg9 s ASN 218 Cb -0.27 -2.57 0.25 0.00 0.41 0.00 0.00 41.25 39.07 1bg9 s ASN 218 CO 0.35 -1.56 1.72 0.25 -1.51 0.00 0.00 177.10 176.35 1bg9 h LEU 219 N 0.46 0.84 -9.12 0.60 5.85 -1.94 -3.41 115.31 108.59 1bg9 h LEU 219 Ca -0.48 -0.22 -0.60 0.00 0.84 0.00 0.00 57.88 57.42 1bg9 h LEU 219 Cb 1.26 -0.23 -0.10 0.00 0.37 0.00 0.00 40.66 41.97 1bg9 h LEU 219 CO 0.55 0.92 0.06 0.21 -0.34 0.00 0.00 178.44 179.83 1bg9 s ASN 220 N -6.63 6.64 -0.34 1.25 3.84 -1.26 -4.75 114.94 113.69 1bg9 s ASN 220 Ca -0.10 0.78 0.13 0.00 0.21 0.00 0.00 52.86 53.88 1bg9 s ASN 220 Cb 0.14 -2.33 0.46 0.00 -0.55 0.00 0.00 41.25 38.97 1bg9 s ASN 220 CO 0.83 -0.24 1.06 0.00 -2.79 0.00 0.00 177.10 175.96 1bg9 n GLN 221 N 4.93 2.34 0.12 0.43 1.13 -1.26 -4.86 117.38 120.21 1bg9 n GLN 221 Ca -0.03 -3.83 -0.02 0.00 -1.94 0.00 0.00 57.00 51.18 1bg9 n GLN 221 Cb 0.50 -1.78 0.20 0.00 0.11 0.00 0.00 30.24 29.27 1bg9 n GLN 221 CO 0.00 0.00 0.00 -0.44 -1.44 0.00 0.00 177.06 175.18 1bg9 h ASP 222 N 2.68 0.14 -0.64 1.08 5.19 -1.90 -1.55 116.42 121.41 1bg9 h ASP 222 Ca 0.09 -0.07 -0.06 0.00 -0.62 0.00 0.00 57.03 56.37 1bg9 h ASP 222 Cb 1.17 -0.04 -0.03 0.00 0.18 0.00 0.00 39.33 40.61 1bg9 h ASP 222 CO 0.59 0.64 0.18 -0.61 -3.12 0.00 0.00 179.24 176.92 1bg9 h GLN 223 N 0.10 1.03 0.13 3.56 4.15 -2.00 -0.48 115.11 121.61 1bg9 h GLN 223 Ca 0.00 -0.22 -0.01 0.00 0.77 0.00 0.00 58.65 59.19 1bg9 h GLN 223 Cb 0.96 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.50 1bg9 h GLN 223 CO 0.07 0.90 -0.06 1.25 -1.93 0.00 0.00 178.83 179.06 1bg9 h HIS 224 N 0.99 -0.17 0.00 3.99 2.76 -1.79 -3.05 115.15 117.89 1bg9 h HIS 224 Ca 0.21 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.36 1bg9 h HIS 224 Cb 0.32 0.06 -0.00 0.00 1.55 0.00 0.00 27.41 29.33 1bg9 h HIS 224 CO 0.02 0.21 -0.10 0.07 -1.30 0.00 0.00 177.93 176.83 1bg9 h ARG 225 N -0.59 0.00 -0.46 5.26 0.11 -1.26 -3.20 114.38 114.24 1bg9 h ARG 225 Ca -0.02 0.00 0.03 0.00 0.10 0.00 0.00 59.98 60.09 1bg9 h ARG 225 Cb 0.45 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.50 1bg9 h ARG 225 CO 0.03 0.10 0.24 0.37 0.10 0.00 0.00 179.97 180.81 1bg9 h GLN 226 N 0.00 0.47 -1.00 0.08 5.75 -1.00 -1.71 115.11 117.71 1bg9 h GLN 226 Ca -0.00 -0.03 0.12 0.00 -0.15 0.00 0.00 58.65 58.59 1bg9 h GLN 226 Cb 0.76 -0.11 -0.09 0.00 1.07 0.00 0.00 27.48 29.12 1bg9 h GLN 226 CO 0.01 0.31 0.63 1.49 -2.65 0.00 0.00 178.83 178.62 1bg9 h GLU 227 N 0.48 0.95 -0.07 1.69 4.81 -1.53 0.25 114.58 121.17 1bg9 h GLU 227 Ca 0.19 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 1bg9 h GLU 227 Cb 0.08 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.24 1bg9 h GLU 227 CO -0.12 0.63 -0.00 -0.07 -0.73 0.00 0.00 179.01 178.72 1bg9 h LEU 228 N 0.98 0.12 -1.20 1.64 3.38 -1.49 -2.65 115.31 116.10 1bg9 h LEU 228 Ca 0.50 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 1bg9 h LEU 228 Cb 0.50 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1bg9 h LEU 228 CO -0.27 0.41 0.28 0.58 0.09 0.00 0.00 178.44 179.53 1bg9 h VAL 229 N -0.17 1.20 -0.59 1.22 2.07 -0.57 -1.81 116.25 117.60 1bg9 h VAL 229 Ca 0.02 -0.56 -0.09 0.00 0.82 0.00 0.00 66.70 66.89 1bg9 h VAL 229 Cb 0.35 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1bg9 h VAL 229 CO 0.00 0.23 0.01 0.78 0.02 0.00 0.00 177.57 178.61 1bg9 h ASN 230 N 0.83 1.01 -0.47 0.57 -0.26 -0.50 -2.06 115.58 114.70 1bg9 h ASN 230 Ca 0.21 -0.30 -0.01 0.00 -0.56 0.00 0.00 56.30 55.64 1bg9 h ASN 230 Cb 0.10 -0.27 -0.02 0.00 -1.06 0.00 0.00 38.32 37.06 1bg9 h ASN 230 CO -0.03 1.06 0.27 -0.25 -1.06 0.00 0.00 177.43 177.42 1bg9 h TRP 231 N 0.92 0.64 -0.22 1.19 7.01 -0.96 -1.64 115.95 122.89 1bg9 h TRP 231 Ca 0.17 -0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.11 1bg9 h TRP 231 Cb 0.54 -0.21 -0.01 0.00 -2.10 0.00 0.00 29.16 27.38 1bg9 h TRP 231 CO 0.04 0.46 -0.06 0.28 -2.79 0.00 0.00 178.44 176.37 1bg9 h VAL 232 N 0.62 1.17 0.34 2.65 2.07 -1.30 0.47 116.25 122.28 1bg9 h VAL 232 Ca 0.17 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 1bg9 h VAL 232 Cb 0.03 1.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 1bg9 h VAL 232 CO -0.03 0.23 -0.17 0.44 0.02 0.00 0.00 177.57 178.07 1bg9 h ASP 233 N 0.32 -0.39 -0.68 0.57 3.32 -0.76 -1.03 116.42 117.77 1bg9 h ASP 233 Ca 0.07 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 1bg9 h ASP 233 Cb 0.32 0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.94 1bg9 h ASP 233 CO 0.01 -0.06 0.33 0.11 -1.72 0.00 0.00 179.24 177.92 1bg9 h LYS 234 N -0.76 1.00 -0.36 3.56 1.57 -0.86 -1.75 116.57 118.97 1bg9 h LYS 234 Ca -0.05 -0.14 -0.12 0.00 -1.87 0.00 0.00 60.65 58.47 1bg9 h LYS 234 Cb 0.51 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 1bg9 h LYS 234 CO 0.08 0.78 -0.27 0.28 -0.57 0.00 0.00 179.45 179.74 1bg9 h VAL 235 N 1.00 1.28 0.00 0.50 2.07 -0.94 -3.45 116.25 116.70 1bg9 h VAL 235 Ca 0.24 -1.40 0.00 0.00 0.82 0.00 0.00 66.70 66.36 1bg9 h VAL 235 Cb 0.11 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1bg9 h VAL 235 CO -0.03 0.46 0.00 0.61 0.02 0.00 0.00 177.57 178.63 1bg9 n GLY 236 N -0.16 2.66 0.34 2.17 0.00 -0.42 -4.79 105.19 104.98 1bg9 n GLY 236 Ca -0.00 -0.42 0.20 0.00 0.00 0.00 0.00 46.02 45.79 1bg9 n GLY 236 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1bg9 h GLY 237 N 0.00 0.00 -0.10 -0.02 0.00 -1.57 0.05 103.07 101.43 1bg9 h GLY 237 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1bg9 h GLY 237 CO 0.00 0.00 -0.28 0.28 0.00 0.00 0.00 176.54 176.54 1bg9 n LYS 238 N -3.02 1.00 -1.13 4.80 4.01 -1.26 -4.94 118.16 117.62 1bg9 n LYS 238 Ca -0.03 -0.65 -0.23 0.00 -0.51 0.00 0.00 58.31 56.90 1bg9 n LYS 238 Cb 0.19 -1.49 0.17 0.00 -0.51 0.00 0.00 35.03 33.40 1bg9 n LYS 238 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1bg9 n GLY 239 N 1.34 -2.04 0.03 0.72 0.00 0.00 -4.93 105.19 100.32 1bg9 n GLY 239 Ca 0.12 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.55 1bg9 n GLY 239 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1bg9 n PRO 240 N -3.58 1.00 -2.90 1.61 -0.04 -1.26 -4.96 135.00 124.88 1bg9 n PRO 240 Ca 0.12 -0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.18 1bg9 n PRO 240 Cb 0.44 -1.03 -0.05 0.00 -0.04 0.00 0.00 33.50 32.82 1bg9 n PRO 240 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bg9 s ALA 241 N -1.94 3.36 0.20 0.55 0.00 -1.26 -2.59 121.76 120.08 1bg9 s ALA 241 Ca 0.00 0.41 -0.01 0.00 0.00 0.00 0.00 51.96 52.36 1bg9 s ALA 241 Cb 0.00 -3.07 -0.04 0.00 0.00 0.00 0.00 23.12 20.01 1bg9 s ALA 241 CO 0.00 0.12 0.12 0.95 0.00 0.00 0.00 175.76 176.96 1bg9 s THR 242 N -0.47 0.06 0.10 0.00 -4.23 -0.40 -4.85 115.64 105.85 1bg9 s THR 242 Ca 0.40 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.98 1bg9 s THR 242 Cb -0.22 -2.49 -0.03 0.00 1.34 0.00 0.00 72.50 71.10 1bg9 s THR 242 CO 0.26 -0.03 -0.17 0.42 -0.54 0.00 0.00 174.62 174.56 1bg9 s THR 243 N -4.11 1.43 0.32 3.99 -4.23 -0.95 -0.09 115.64 112.00 1bg9 s THR 243 Ca 0.38 -1.49 -0.29 0.00 -1.18 0.00 0.00 61.69 59.11 1bg9 s THR 243 Cb 0.07 -1.38 -0.10 0.00 1.34 0.00 0.00 72.50 72.43 1bg9 s THR 243 CO 0.12 -0.18 1.31 -0.36 -0.54 0.00 0.00 174.62 174.96 1bg9 s PHE 244 N -1.38 3.07 -1.12 3.99 0.08 -0.77 -2.06 117.98 119.80 1bg9 s PHE 244 Ca 0.04 1.39 -0.17 0.00 0.12 0.00 0.00 56.93 58.31 1bg9 s PHE 244 Cb -0.09 -3.67 0.12 0.00 -0.57 0.00 0.00 43.02 38.81 1bg9 s PHE 244 CO 0.03 -1.86 1.41 0.34 -0.10 0.00 0.00 175.22 175.04 1bg9 s ASP 245 N -0.41 6.81 0.48 1.36 -1.08 0.19 -4.78 116.67 119.24 1bg9 s ASP 245 Ca 0.50 -2.39 0.27 0.00 -0.52 0.00 0.00 52.55 50.41 1bg9 s ASP 245 Cb -0.39 -2.46 1.03 0.00 -1.46 0.00 0.00 42.92 39.64 1bg9 s ASP 245 CO 0.51 -1.03 1.86 -0.26 0.52 0.00 0.00 175.17 176.77 1bg9 h PHE 246 N 8.11 0.00 0.00 -5.34 -1.00 -1.87 -2.87 116.94 113.97 1bg9 h PHE 246 Ca 0.28 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 61.06 1bg9 h PHE 246 Cb 0.94 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.50 1bg9 h PHE 246 CO 1.21 0.13 -0.00 1.15 -1.61 0.00 0.00 178.31 179.19 1bg9 h THR 247 N 0.00 1.16 -0.39 -1.55 2.02 -1.93 0.10 112.91 112.33 1bg9 h THR 247 Ca -0.00 -0.48 -0.02 0.00 0.77 0.00 0.00 66.41 66.68 1bg9 h THR 247 Cb 0.69 1.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.57 1bg9 h THR 247 CO 0.02 0.13 0.16 0.74 0.37 0.00 0.00 175.52 176.93 1bg9 h THR 248 N -0.21 1.19 -0.18 3.16 2.02 -1.88 -0.74 112.91 116.27 1bg9 h THR 248 Ca -0.00 -0.58 0.03 0.00 0.77 0.00 0.00 66.41 66.62 1bg9 h THR 248 Cb 0.21 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 1bg9 h THR 248 CO 0.00 0.21 0.02 0.50 0.37 0.00 0.00 175.52 176.62 1bg9 h LYS 249 N 0.48 0.09 -0.56 6.66 1.63 -1.40 0.88 116.57 124.36 1bg9 h LYS 249 Ca 0.13 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.93 1bg9 h LYS 249 Cb 0.18 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.76 1bg9 h LYS 249 CO -0.01 0.06 0.36 0.78 -3.45 0.00 0.00 179.45 177.18 1bg9 h GLY 250 N 0.09 0.79 0.74 5.01 0.00 -0.38 -1.96 103.07 107.36 1bg9 h GLY 250 Ca 0.08 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1bg9 h GLY 250 CO -0.12 0.30 -0.09 -2.22 0.00 0.00 0.00 176.54 174.41 1bg9 h ILE 251 N 0.75 0.91 -0.93 2.60 2.04 -0.74 -3.14 117.51 118.99 1bg9 h ILE 251 Ca 0.20 -0.54 0.11 0.00 1.00 0.00 0.00 64.86 65.63 1bg9 h ILE 251 Cb -0.06 1.23 -0.08 0.00 -0.74 0.00 0.00 36.82 37.17 1bg9 h ILE 251 CO -0.04 0.12 0.56 0.25 0.00 0.00 0.00 178.15 179.04 1bg9 h LEU 252 N -0.52 0.82 -1.07 1.44 5.85 -0.68 0.30 115.31 121.44 1bg9 h LEU 252 Ca -0.03 0.05 0.25 0.00 0.84 0.00 0.00 57.88 58.99 1bg9 h LEU 252 Cb 0.39 -0.11 -0.12 0.00 0.37 0.00 0.00 40.66 41.19 1bg9 h LEU 252 CO 0.04 0.45 0.61 0.78 -0.34 0.00 0.00 178.44 179.98 1bg9 h ASN 253 N 0.91 0.64 0.07 1.25 4.21 -1.31 -1.04 115.58 120.32 1bg9 h ASN 253 Ca 0.45 0.13 -0.34 0.00 1.21 0.00 0.00 56.30 57.74 1bg9 h ASN 253 Cb 0.42 0.03 -0.03 0.00 -1.12 0.00 0.00 38.32 37.62 1bg9 h ASN 253 CO -0.26 0.11 -1.91 0.52 -1.29 0.00 0.00 177.43 174.60 1bg9 n VAL 254 N -4.83 1.67 -0.35 2.81 0.31 0.46 -4.36 118.33 114.05 1bg9 n VAL 254 Ca 0.27 -0.48 0.05 0.00 -0.01 0.00 0.00 64.34 64.17 1bg9 n VAL 254 Cb 0.77 -1.78 0.21 0.00 -0.91 0.00 0.00 33.84 32.12 1bg9 n VAL 254 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1bg9 h ALA 255 N -0.14 1.41 0.00 3.52 0.00 0.48 -1.81 119.26 122.72 1bg9 h ALA 255 Ca -0.44 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 1bg9 h ALA 255 Cb 1.82 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.39 1bg9 h ALA 255 CO -0.04 0.24 -0.20 -0.24 0.00 0.00 0.00 179.25 179.02 1bg9 h VAL 256 N 0.99 0.96 -0.65 0.00 3.04 -1.43 0.18 116.25 119.34 1bg9 h VAL 256 Ca 0.46 -0.73 -0.72 0.00 -1.01 0.00 0.00 66.70 64.70 1bg9 h VAL 256 Cb 0.39 1.41 -0.08 0.00 -2.01 0.00 0.00 31.29 31.01 1bg9 h VAL 256 CO -0.24 0.20 2.78 -0.62 -1.01 0.00 0.00 177.57 178.68 1bg9 n GLU 257 N -4.04 3.55 -1.56 4.17 -0.58 -0.68 -4.58 120.64 116.91 1bg9 n GLU 257 Ca -0.02 -2.98 -0.16 0.00 -0.42 0.00 0.00 57.16 53.58 1bg9 n GLU 257 Cb 0.28 -2.97 -0.06 0.00 -0.57 0.00 0.00 31.44 28.11 1bg9 n GLU 257 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1bg9 n GLY 258 N 3.18 1.36 2.31 0.62 0.00 -1.20 -4.87 105.19 106.59 1bg9 n GLY 258 Ca 0.54 -0.27 -0.19 0.00 0.00 0.00 0.00 46.02 46.10 1bg9 n GLY 258 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1bg9 n GLU 259 N -2.54 3.06 0.10 1.61 1.02 0.53 -4.62 120.64 119.80 1bg9 n GLU 259 Ca -0.16 -4.06 0.07 0.00 -0.02 0.00 0.00 57.16 52.99 1bg9 n GLU 259 Cb 0.53 -2.08 0.37 0.00 -0.02 0.00 0.00 31.44 30.24 1bg9 n GLU 259 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1bg9 n LEU 260 N -0.59 0.35 0.30 -4.62 7.99 -0.66 -1.20 117.00 118.57 1bg9 n LEU 260 Ca 0.34 0.66 0.16 0.00 -0.01 0.00 0.00 56.01 57.16 1bg9 n LEU 260 Cb 0.86 -0.71 0.94 0.00 -0.11 0.00 0.00 43.42 44.40 1bg9 n LEU 260 CO 0.32 -0.78 1.12 4.11 -1.51 0.00 0.00 177.39 180.64 1bg9 h TRP 261 N 0.00 0.00 -0.01 -1.77 5.08 -1.69 -1.67 115.95 115.88 1bg9 h TRP 261 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1bg9 h TRP 261 Cb 0.00 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.16 1bg9 h TRP 261 CO 0.00 0.01 0.17 0.00 -1.28 0.00 0.00 178.44 177.34 1bg9 h ARG 262 N 0.00 0.00 -0.03 0.12 3.08 -1.48 -2.77 114.38 113.30 1bg9 h ARG 262 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1bg9 h ARG 262 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1bg9 h ARG 262 CO 0.00 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.18 1bg9 n LEU 263 N -3.04 0.31 -4.04 3.04 4.32 -0.63 -4.56 117.00 112.41 1bg9 n LEU 263 Ca -0.02 -0.13 -0.31 0.00 -0.02 0.00 0.00 56.01 55.53 1bg9 n LEU 263 Cb 0.23 -0.02 -0.16 0.00 -1.62 0.00 0.00 43.42 41.85 1bg9 n LEU 263 CO 0.17 0.07 -0.48 -0.60 -1.22 0.00 0.00 177.39 175.33 1bg9 s ARG 264 N -1.96 2.33 0.22 3.23 3.52 -1.05 -4.29 118.95 120.95 1bg9 s ARG 264 Ca 0.28 -0.82 -0.04 0.00 -0.13 0.00 0.00 55.73 55.03 1bg9 s ARG 264 Cb 0.13 -2.42 0.05 0.00 -1.56 0.00 0.00 34.95 31.16 1bg9 s ARG 264 CO 0.22 -0.34 0.26 0.41 -0.81 0.00 0.00 175.30 175.03 1bg9 n GLY 265 N 4.67 -1.70 0.36 8.12 0.00 0.11 -4.78 105.19 111.97 1bg9 n GLY 265 Ca -0.17 -1.59 0.08 0.00 0.00 0.00 0.00 46.02 44.34 1bg9 n GLY 265 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1bg9 h THR 266 N -1.39 0.96 -0.43 2.61 2.02 -1.85 0.40 112.91 115.23 1bg9 h THR 266 Ca -0.09 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.82 1bg9 h THR 266 Cb 0.25 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1bg9 h THR 266 CO 0.06 0.14 0.00 -0.90 0.37 0.00 0.00 175.52 175.19 1bg9 n ASP 267 N -4.51 2.76 0.00 4.18 5.68 -1.26 -4.91 116.55 118.50 1bg9 n ASP 267 Ca 0.14 -2.13 0.00 0.00 -0.50 0.00 0.00 54.79 52.30 1bg9 n ASP 267 Cb 0.31 -0.37 0.00 0.00 -1.14 0.00 0.00 41.12 39.92 1bg9 n ASP 267 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1bg9 n GLY 268 N 1.03 0.45 3.83 6.12 0.00 0.13 -5.00 105.19 111.75 1bg9 n GLY 268 Ca 0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 1bg9 n GLY 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bg9 s LYS 269 N -0.60 2.43 0.44 1.61 1.02 -1.26 -4.67 119.74 118.71 1bg9 s LYS 269 Ca 0.00 -1.64 -0.26 0.00 0.02 0.00 0.00 55.97 54.09 1bg9 s LYS 269 Cb 0.00 -2.25 -0.09 0.00 -0.52 0.00 0.00 37.83 34.97 1bg9 s LYS 269 CO 0.00 -0.18 1.39 0.00 -0.92 0.00 0.00 175.35 175.64 1bg9 n ALA 270 N -1.45 1.85 0.48 5.17 0.00 -1.26 0.05 120.51 125.35 1bg9 n ALA 270 Ca 0.02 0.26 0.13 0.00 0.00 0.00 0.00 53.44 53.85 1bg9 n ALA 270 Cb 0.63 -2.36 0.34 0.00 0.00 0.00 0.00 19.45 18.06 1bg9 n ALA 270 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1bg9 h PRO 271 N 2.29 0.00 0.00 0.00 0.13 -1.85 -3.35 132.00 129.22 1bg9 h PRO 271 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1bg9 h PRO 271 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1bg9 h PRO 271 CO 0.61 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.79 1bg9 n GLY 272 N 1.14 0.51 0.23 1.56 0.00 -1.26 -4.65 105.19 102.72 1bg9 n GLY 272 Ca 0.05 -1.86 -0.03 0.00 0.00 0.00 0.00 46.02 44.18 1bg9 n GLY 272 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1bg9 h MET 273 N 0.00 0.44 0.00 1.61 1.85 -1.91 -2.17 114.93 114.75 1bg9 h MET 273 Ca 0.00 -0.17 0.00 0.00 -0.61 0.00 0.00 59.70 58.92 1bg9 h MET 273 Cb 0.00 -0.02 0.00 0.00 0.43 0.00 0.00 31.60 32.01 1bg9 h MET 273 CO 0.00 0.68 0.08 0.44 -0.40 0.00 0.00 176.91 177.72 1bg9 n ILE 274 N -4.10 1.42 0.15 1.77 -5.35 -1.26 0.27 119.36 112.25 1bg9 n ILE 274 Ca -0.01 0.58 0.10 0.00 -0.27 0.00 0.00 62.75 63.16 1bg9 n ILE 274 Cb 0.42 -1.58 0.06 0.00 -1.74 0.00 0.00 39.64 36.80 1bg9 n ILE 274 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1bg9 h GLY 275 N 0.00 0.00 0.00 3.28 0.00 -1.52 -3.32 103.07 101.51 1bg9 h GLY 275 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.13 1bg9 h GLY 275 CO 0.00 0.00 -1.70 0.79 0.00 0.00 0.00 176.54 175.63 1bg9 n TRP 276 N -2.90 0.00 -3.19 5.60 8.01 0.14 -4.81 117.44 120.29 1bg9 n TRP 276 Ca 0.01 0.00 -0.22 0.00 -1.31 0.00 0.00 57.50 55.98 1bg9 n TRP 276 Cb 0.58 -0.46 -0.05 0.00 -2.01 0.00 0.00 31.31 29.37 1bg9 n TRP 276 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 177.69 178.55 1bg9 n TRP 277 N -3.33 0.10 -0.29 -5.99 -0.00 0.22 -4.95 117.44 103.20 1bg9 n TRP 277 Ca -0.24 -3.70 0.23 0.00 -0.00 0.00 0.00 57.50 53.79 1bg9 n TRP 277 Cb 0.69 -0.39 0.54 0.00 -0.00 0.00 0.00 31.31 32.16 1bg9 n TRP 277 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 1bg9 h PRO 278 N 3.56 0.33 -0.49 5.87 0.13 -1.71 0.09 132.00 139.78 1bg9 h PRO 278 Ca 0.09 -0.02 0.06 0.00 -0.87 0.00 0.00 66.00 65.26 1bg9 h PRO 278 Cb 0.90 -0.07 -0.05 0.00 0.13 0.00 0.00 31.00 31.90 1bg9 h PRO 278 CO 0.50 0.22 0.20 0.00 -0.23 0.00 0.00 178.00 178.69 1bg9 h ALA 279 N 1.59 0.61 -0.51 -0.56 0.00 -1.92 -2.58 119.26 115.89 1bg9 h ALA 279 Ca 0.54 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.50 1bg9 h ALA 279 Cb 1.49 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.28 1bg9 h ALA 279 CO -0.22 -0.18 0.00 1.63 0.00 0.00 0.00 179.25 180.49 1bg9 n LYS 280 N -4.96 3.81 -4.57 0.00 4.76 0.01 -4.78 118.16 112.42 1bg9 n LYS 280 Ca 0.05 -2.50 -0.33 0.00 -2.87 0.00 0.00 58.31 52.65 1bg9 n LYS 280 Cb 0.17 -1.98 -0.15 0.00 -1.84 0.00 0.00 35.03 31.23 1bg9 n LYS 280 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1bg9 s ALA 281 N -2.16 2.51 -0.15 7.82 0.00 -0.98 -2.25 121.76 126.55 1bg9 s ALA 281 Ca 0.44 -1.03 -0.01 0.00 0.00 0.00 0.00 51.96 51.37 1bg9 s ALA 281 Cb 0.31 -1.22 -0.01 0.00 0.00 0.00 0.00 23.12 22.20 1bg9 s ALA 281 CO 0.16 0.01 -0.12 0.54 0.00 0.00 0.00 175.76 176.35 1bg9 s VAL 282 N 0.75 3.05 0.22 0.00 0.11 -0.87 -1.09 120.40 122.57 1bg9 s VAL 282 Ca -0.06 -0.65 -0.01 0.00 -2.93 0.00 0.00 61.98 58.33 1bg9 s VAL 282 Cb -0.15 -2.30 -0.04 0.00 -1.53 0.00 0.00 36.38 32.35 1bg9 s VAL 282 CO 0.01 0.51 0.42 0.42 -3.33 0.00 0.00 175.10 173.12 1bg9 s THR 283 N 0.62 5.18 0.09 5.04 -4.23 -0.03 -0.64 115.64 121.67 1bg9 s THR 283 Ca -0.07 -0.34 -0.23 0.00 -1.18 0.00 0.00 61.69 59.88 1bg9 s THR 283 Cb -0.15 -3.74 0.06 0.00 1.34 0.00 0.00 72.50 70.00 1bg9 s THR 283 CO 0.03 -0.22 0.55 0.72 -0.54 0.00 0.00 174.62 175.16 1bg9 s PHE 284 N -1.92 -0.47 -0.15 3.99 -0.71 -1.26 -0.41 117.98 117.05 1bg9 s PHE 284 Ca 0.39 0.41 -0.03 0.00 -1.04 0.00 0.00 56.93 56.66 1bg9 s PHE 284 Cb -0.11 0.42 -0.24 0.00 -1.21 0.00 0.00 43.02 41.89 1bg9 s PHE 284 CO 0.29 -0.73 0.24 0.28 -1.34 0.00 0.00 175.22 173.96 1bg9 n VAL 285 N 0.07 1.70 -3.62 -2.49 0.31 -1.26 -4.48 118.33 108.55 1bg9 n VAL 285 Ca -0.18 -0.65 -0.07 0.00 -0.01 0.00 0.00 64.34 63.43 1bg9 n VAL 285 Cb 0.62 -1.59 -0.02 0.00 -0.91 0.00 0.00 33.84 31.94 1bg9 n VAL 285 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1bg9 s ASP 286 N -6.83 -0.32 0.18 4.52 1.01 -1.26 -4.41 116.67 109.56 1bg9 s ASP 286 Ca -0.24 -0.20 0.03 0.00 0.71 0.00 0.00 52.55 52.84 1bg9 s ASP 286 Cb 0.07 0.49 -0.01 0.00 1.01 0.00 0.00 42.92 44.48 1bg9 s ASP 286 CO 0.73 -0.84 0.19 -0.46 0.21 0.00 0.00 175.17 175.00 1bg9 n ASN 287 N -0.37 -0.50 0.32 0.27 0.23 -1.26 -4.57 115.26 109.39 1bg9 n ASN 287 Ca -0.09 -2.13 0.19 0.00 -0.53 0.00 0.00 54.58 52.03 1bg9 n ASN 287 Cb 0.62 1.05 1.03 0.00 -2.08 0.00 0.00 39.78 40.40 1bg9 n ASN 287 CO 0.00 0.00 0.00 1.12 -0.93 0.00 0.00 177.26 177.45 1bg9 h HIS 288 N 1.57 0.00 0.00 -2.53 2.07 -1.86 0.77 115.15 115.17 1bg9 h HIS 288 Ca -0.13 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.29 1bg9 h HIS 288 Cb 0.64 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.61 1bg9 h HIS 288 CO 0.00 0.00 -1.04 -0.25 -3.07 0.00 0.00 177.93 173.57 1bg9 n ASP 289 N -3.12 1.87 -0.34 3.10 8.00 -1.26 -4.37 116.55 120.43 1bg9 n ASP 289 Ca -0.02 0.48 -0.03 0.00 0.71 0.00 0.00 54.79 55.92 1bg9 n ASP 289 Cb 0.21 -0.84 0.10 0.00 -0.02 0.00 0.00 41.12 40.56 1bg9 n ASP 289 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 1bg9 h THR 290 N -1.00 1.26 -0.13 -3.53 1.35 -1.81 -0.97 112.91 108.08 1bg9 h THR 290 Ca -0.15 -0.60 0.00 0.00 -0.55 0.00 0.00 66.41 65.11 1bg9 h THR 290 Cb 0.93 -0.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.33 1bg9 h THR 290 CO -0.09 0.28 0.00 0.61 -0.25 0.00 0.00 175.52 176.07 1bg9 n GLY 291 N -1.20 3.85 7.00 5.82 0.00 0.25 -0.66 105.19 120.25 1bg9 n GLY 291 Ca 0.10 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.44 1bg9 n GLY 291 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1bg9 n SER 292 N 0.00 0.00 -0.18 1.61 2.88 -1.25 -0.93 113.62 115.74 1bg9 n SER 292 Ca 0.00 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.69 1bg9 n SER 292 Cb 0.00 0.00 0.73 0.00 -0.75 0.00 0.00 64.21 64.19 1bg9 n SER 292 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1bg9 n THR 293 N 0.00 0.00 0.02 2.46 -2.24 -1.26 -3.85 114.28 109.41 1bg9 n THR 293 Ca 0.00 -0.09 -0.16 0.00 -2.27 0.00 0.00 64.05 61.52 1bg9 n THR 293 Cb 0.00 -0.08 -0.14 0.00 -2.10 0.00 0.00 70.33 68.01 1bg9 n THR 293 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1bg9 h GLN 294 N 0.89 0.19 -5.94 -0.78 4.20 -1.65 -3.48 115.11 108.54 1bg9 h GLN 294 Ca 0.00 -0.33 -0.40 0.00 0.06 0.00 0.00 58.65 57.98 1bg9 h GLN 294 Cb 0.25 0.12 0.09 0.00 0.30 0.00 0.00 27.48 28.24 1bg9 h GLN 294 CO 0.00 0.99 -0.76 0.72 -0.67 0.00 0.00 178.83 179.11 1bg9 n HIS 295 N -3.36 -2.35 0.13 2.96 8.25 -0.11 -4.89 115.22 115.86 1bg9 n HIS 295 Ca -0.23 0.93 0.02 0.00 -0.26 0.00 0.00 57.72 58.18 1bg9 n HIS 295 Cb 1.05 -4.70 0.02 0.00 1.12 0.00 0.00 29.99 27.48 1bg9 n HIS 295 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 1bg9 h MET 296 N -2.16 0.00 0.00 -0.41 2.86 0.54 -3.40 114.93 112.35 1bg9 h MET 296 Ca -0.59 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 56.85 1bg9 h MET 296 Cb 1.36 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 32.88 1bg9 h MET 296 CO 0.57 0.55 -0.31 1.87 1.06 0.00 0.00 176.91 180.64 1bg9 n TRP 297 N -3.25 -2.29 -2.19 -0.22 -0.00 -0.33 -4.95 117.44 104.21 1bg9 n TRP 297 Ca 0.02 -1.80 -0.35 0.00 -0.00 0.00 0.00 57.50 55.37 1bg9 n TRP 297 Cb 0.75 1.53 0.01 0.00 -0.00 0.00 0.00 31.31 33.60 1bg9 n TRP 297 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 1bg9 s PRO 298 N 0.21 3.30 0.27 5.87 0.04 -0.89 -4.61 135.00 139.20 1bg9 s PRO 298 Ca 0.21 1.53 -0.30 0.00 0.04 0.00 0.00 61.00 62.49 1bg9 s PRO 298 Cb 0.29 -2.01 -0.09 0.00 0.04 0.00 0.00 34.50 32.73 1bg9 s PRO 298 CO -0.08 -0.88 1.08 0.12 0.04 0.00 0.00 177.00 177.28 1bg9 s PHE 299 N -1.92 3.63 -0.32 0.56 5.36 -1.26 -4.96 117.98 119.08 1bg9 s PHE 299 Ca 0.71 1.72 -0.40 0.00 -0.96 0.00 0.00 56.93 58.01 1bg9 s PHE 299 Cb -0.22 -3.25 -0.15 0.00 -0.34 0.00 0.00 43.02 39.06 1bg9 s PHE 299 CO 0.29 -0.43 1.88 -2.30 -1.46 0.00 0.00 175.22 173.20 1bg9 n PRO 300 N 1.30 1.03 -0.25 10.12 -0.02 -1.26 -4.87 135.00 141.04 1bg9 n PRO 300 Ca -0.01 0.35 0.01 0.00 -2.02 0.00 0.00 63.50 61.83 1bg9 n PRO 300 Cb 0.45 -2.13 0.13 0.00 -0.02 0.00 0.00 33.50 31.94 1bg9 n PRO 300 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1bg9 h SER 301 N 8.49 0.55 0.00 2.55 4.64 -2.00 -1.24 113.55 126.53 1bg9 h SER 301 Ca -0.39 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 1bg9 h SER 301 Cb 1.33 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1bg9 h SER 301 CO 0.99 0.33 0.00 -0.90 -0.87 0.00 0.00 176.83 176.37 1bg9 n ASP 302 N -4.81 0.00 0.00 4.97 5.75 -1.26 -2.73 116.55 118.47 1bg9 n ASP 302 Ca 0.11 -0.76 0.00 0.00 -0.01 0.00 0.00 54.79 54.13 1bg9 n ASP 302 Cb 0.24 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.33 1bg9 n ASP 302 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1bg9 n ARG 303 N -0.89 1.28 0.09 0.11 1.74 -0.48 -4.82 116.66 113.69 1bg9 n ARG 303 Ca 0.12 -0.93 0.08 0.00 -0.77 0.00 0.00 57.85 56.34 1bg9 n ARG 303 Cb 0.05 -0.82 0.54 0.00 -1.02 0.00 0.00 32.46 31.21 1bg9 n ARG 303 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 1bg9 h VAL 304 N 0.92 1.01 0.00 1.55 -1.51 -1.33 0.23 116.25 117.12 1bg9 h VAL 304 Ca 0.00 -0.10 -0.04 0.00 -1.23 0.00 0.00 66.70 65.33 1bg9 h VAL 304 Cb 0.56 0.71 -0.01 0.00 -2.13 0.00 0.00 31.29 30.42 1bg9 h VAL 304 CO 0.00 0.05 -0.20 0.24 -1.23 0.00 0.00 177.57 176.43 1bg9 h MET 305 N 0.28 0.00 0.00 5.19 2.86 -1.87 0.14 114.93 121.53 1bg9 h MET 305 Ca 0.11 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1bg9 h MET 305 Cb 0.11 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 1bg9 h MET 305 CO -0.02 0.20 -0.33 1.96 1.06 0.00 0.00 176.91 179.77 1bg9 h GLN 306 N 0.00 0.00 -0.10 1.72 4.20 -1.28 0.77 115.11 120.43 1bg9 h GLN 306 Ca -0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1bg9 h GLN 306 Cb 0.43 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.21 1bg9 h GLN 306 CO 0.03 0.33 -0.04 0.78 -0.67 0.00 0.00 178.83 179.26 1bg9 h GLY 307 N 1.28 0.21 1.83 3.46 0.00 -0.67 -0.95 103.07 108.23 1bg9 h GLY 307 Ca -0.00 -0.19 -0.12 0.00 0.00 0.00 0.00 47.33 47.02 1bg9 h GLY 307 CO 0.04 0.17 -0.51 -0.97 0.00 0.00 0.00 176.54 175.27 1bg9 h TYR 308 N -0.15 0.22 -0.88 5.60 0.05 -0.94 0.30 116.97 121.17 1bg9 h TYR 308 Ca 0.02 -0.07 0.00 0.00 0.05 0.00 0.00 58.73 58.73 1bg9 h TYR 308 Cb 0.47 -0.04 -0.04 0.00 1.01 0.00 0.00 36.73 38.12 1bg9 h TYR 308 CO 0.06 0.66 0.57 0.00 -1.05 0.00 0.00 178.16 178.40 1bg9 h ALA 309 N 1.33 1.12 0.53 3.88 0.00 -0.68 0.25 119.26 125.70 1bg9 h ALA 309 Ca 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1bg9 h ALA 309 Cb 0.95 -0.36 0.01 0.00 0.00 0.00 0.00 17.79 18.39 1bg9 h ALA 309 CO 0.08 0.54 -0.26 -0.92 0.00 0.00 0.00 179.25 178.69 1bg9 h TYR 310 N 1.20 -0.66 -0.36 0.00 5.03 -0.81 -3.08 116.97 118.29 1bg9 h TYR 310 Ca 0.32 -0.02 -0.11 0.00 2.58 0.00 0.00 58.73 61.50 1bg9 h TYR 310 Cb -0.11 0.22 -0.01 0.00 1.55 0.00 0.00 36.73 38.37 1bg9 h TYR 310 CO -0.01 -0.39 -0.23 -0.84 -1.32 0.00 0.00 178.16 175.37 1bg9 h ILE 311 N -1.17 1.27 0.00 1.81 3.07 -0.84 -2.06 117.51 119.59 1bg9 h ILE 311 Ca -0.07 -1.32 0.00 0.00 1.55 0.00 0.00 64.86 65.02 1bg9 h ILE 311 Cb 0.57 1.24 0.00 0.00 -0.27 0.00 0.00 36.82 38.36 1bg9 h ILE 311 CO 0.12 0.44 0.00 -0.07 -1.05 0.00 0.00 178.15 177.59 1bg9 h LEU 312 N 0.62 0.00 0.00 0.16 4.07 -1.08 -2.97 115.31 116.11 1bg9 h LEU 312 Ca 0.09 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.05 1bg9 h LEU 312 Cb 0.72 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.46 1bg9 h LEU 312 CO 0.06 0.00 -1.60 0.35 -1.08 0.00 0.00 178.44 176.16 1bg9 n THR 313 N -2.99 0.00 -3.07 0.22 -2.24 -0.91 -4.63 114.28 100.66 1bg9 n THR 313 Ca 0.01 -0.33 -0.25 0.00 -2.27 0.00 0.00 64.05 61.21 1bg9 n THR 313 Cb 0.29 0.32 -0.00 0.00 -2.10 0.00 0.00 70.33 68.84 1bg9 n THR 313 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1bg9 s HIS 314 N -3.18 3.45 1.35 4.78 3.76 -0.82 -4.85 115.29 119.78 1bg9 s HIS 314 Ca -0.03 0.45 -0.21 0.00 -0.15 0.00 0.00 55.06 55.12 1bg9 s HIS 314 Cb 0.13 -2.12 0.33 0.00 1.11 0.00 0.00 32.58 32.03 1bg9 s HIS 314 CO 0.79 -0.12 0.76 -0.35 -0.85 0.00 0.00 174.74 174.97 1bg9 n PRO 315 N -2.00 -4.10 0.00 8.40 -0.04 -1.26 -4.84 135.00 131.16 1bg9 n PRO 315 Ca -0.02 -1.21 0.00 0.00 -0.04 0.00 0.00 63.50 62.23 1bg9 n PRO 315 Cb 0.56 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.18 1bg9 n PRO 315 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bg9 n GLY 316 N 1.95 -0.63 3.32 0.55 0.00 0.19 -4.91 105.19 105.66 1bg9 n GLY 316 Ca 0.11 -1.70 -0.37 0.00 0.00 0.00 0.00 46.02 44.06 1bg9 n GLY 316 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bg9 s THR 317 N -2.05 3.73 0.49 2.61 2.01 -0.25 -3.84 115.64 118.35 1bg9 s THR 317 Ca 0.00 -0.74 -0.20 0.00 0.31 0.00 0.00 61.69 61.06 1bg9 s THR 317 Cb 0.00 -2.91 -0.08 0.00 0.01 0.00 0.00 72.50 69.52 1bg9 s THR 317 CO 0.00 0.12 1.02 -2.16 -0.69 0.00 0.00 174.62 172.91 1bg9 s PRO 318 N 1.47 3.82 -0.19 4.92 0.04 -1.26 -0.85 135.00 142.95 1bg9 s PRO 318 Ca 0.02 1.28 0.00 0.00 0.04 0.00 0.00 61.00 62.35 1bg9 s PRO 318 Cb -0.17 -2.10 0.04 0.00 0.04 0.00 0.00 34.50 32.31 1bg9 s PRO 318 CO 0.01 -0.40 -0.08 0.00 0.04 0.00 0.00 177.00 176.57 1bg9 s ILE 320 N 1.48 4.51 -0.08 0.00 1.01 0.72 -4.45 121.20 124.40 1bg9 s ILE 320 Ca -0.01 1.48 -0.12 0.00 0.00 0.00 0.00 60.65 62.00 1bg9 s ILE 320 Cb -0.16 -4.02 -0.05 0.00 0.01 0.00 0.00 42.46 38.24 1bg9 s ILE 320 CO -0.08 0.48 0.29 0.12 0.00 0.00 0.00 174.94 175.75 1bg9 s PHE 321 N -1.20 3.63 0.07 3.97 5.36 -1.26 -1.39 117.98 127.15 1bg9 s PHE 321 Ca 0.35 0.75 -0.13 0.00 -0.96 0.00 0.00 56.93 56.93 1bg9 s PHE 321 Cb -0.21 -2.18 -0.03 0.00 -0.34 0.00 0.00 43.02 40.26 1bg9 s PHE 321 CO 0.23 0.59 1.20 0.98 -1.46 0.00 0.00 175.22 176.76 1bg9 n TYR 322 N 2.26 -0.19 -0.32 10.12 9.36 -1.03 -1.86 117.16 135.50 1bg9 n TYR 322 Ca -0.16 0.53 0.15 0.00 3.32 0.00 0.00 57.90 61.75 1bg9 n TYR 322 Cb 0.53 -0.53 0.34 0.00 -0.63 0.00 0.00 39.34 39.06 1bg9 n TYR 322 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 1bg9 h ASP 323 N 0.00 0.44 -0.21 2.98 5.19 -1.88 0.18 116.42 123.12 1bg9 h ASP 323 Ca 0.07 0.15 -0.04 0.00 -0.62 0.00 0.00 57.03 56.59 1bg9 h ASP 323 Cb 0.17 0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.78 1bg9 h ASP 323 CO -0.40 0.02 -0.01 0.45 -3.12 0.00 0.00 179.24 176.18 1bg9 h HIS 324 N 0.45 0.42 0.21 4.55 3.86 -1.76 0.40 115.15 123.27 1bg9 h HIS 324 Ca 0.60 -0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.72 1bg9 h HIS 324 Cb 1.16 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 29.53 1bg9 h HIS 324 CO -0.09 0.58 -0.10 0.35 0.86 0.00 0.00 177.93 179.54 1bg9 h PHE 325 N 0.14 -0.26 0.00 2.45 3.57 -1.29 -3.15 116.94 118.40 1bg9 h PHE 325 Ca 0.06 -0.01 -0.19 0.00 3.53 0.00 0.00 57.97 61.36 1bg9 h PHE 325 Cb 0.42 0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 1bg9 h PHE 325 CO 0.04 0.12 -1.66 1.19 -2.23 0.00 0.00 178.31 175.77 1bg9 n PHE 326 N -5.02 0.72 0.18 0.41 3.72 -0.01 -3.19 117.46 114.26 1bg9 n PHE 326 Ca -0.09 0.24 0.02 0.00 -0.05 0.00 0.00 57.45 57.58 1bg9 n PHE 326 Cb 0.26 -1.02 -0.03 0.00 -0.94 0.00 0.00 39.48 37.74 1bg9 n PHE 326 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1bg9 n ASP 327 N -2.81 1.07 0.00 4.37 8.00 0.13 -4.54 116.55 122.77 1bg9 n ASP 327 Ca -0.14 -0.47 0.11 0.00 0.71 0.00 0.00 54.79 55.00 1bg9 n ASP 327 Cb 0.88 1.05 -0.04 0.00 -0.02 0.00 0.00 41.12 43.00 1bg9 n ASP 327 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 1bg9 n TRP 328 N -1.24 0.02 -0.75 1.24 7.02 -0.52 -4.96 117.44 118.23 1bg9 n TRP 328 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.49 1bg9 n TRP 328 Cb 0.09 -0.10 0.00 0.00 -2.42 0.00 0.00 31.31 28.88 1bg9 n TRP 328 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1bg9 n GLY 329 N 1.48 0.62 0.27 6.99 0.00 -1.25 -4.91 105.19 108.40 1bg9 n GLY 329 Ca 0.04 -0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.14 1bg9 n GLY 329 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bg9 n LEU 330 N 0.00 0.83 -0.31 0.99 4.32 -1.19 -4.46 117.00 117.18 1bg9 n LEU 330 Ca 0.00 -0.33 0.04 0.00 -0.02 0.00 0.00 56.01 55.70 1bg9 n LEU 330 Cb 0.00 -0.04 0.13 0.00 -1.62 0.00 0.00 43.42 41.88 1bg9 n LEU 330 CO 0.00 0.17 0.70 0.50 -1.22 0.00 0.00 177.39 177.54 1bg9 h LYS 331 N 1.15 0.01 -0.24 3.23 3.64 -1.71 0.62 116.57 123.26 1bg9 h LYS 331 Ca 0.00 -0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.20 1bg9 h LYS 331 Cb 0.25 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1bg9 h LYS 331 CO 0.00 0.00 -0.55 0.93 -2.27 0.00 0.00 179.45 177.57 1bg9 h GLU 332 N 0.01 0.80 -0.38 1.90 3.07 -1.89 0.15 114.58 118.24 1bg9 h GLU 332 Ca 0.43 -0.54 -0.14 0.00 -0.50 0.00 0.00 59.36 58.61 1bg9 h GLU 332 Cb 0.67 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.65 1bg9 h GLU 332 CO -0.89 1.16 -0.34 0.93 -1.40 0.00 0.00 179.01 178.48 1bg9 h GLU 333 N 0.55 0.86 -0.39 2.33 5.08 -1.25 -1.32 114.58 120.45 1bg9 h GLU 333 Ca 0.00 -0.42 -0.00 0.00 -1.00 0.00 0.00 59.36 57.94 1bg9 h GLU 333 Cb 1.16 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.39 1bg9 h GLU 333 CO 0.12 1.06 0.23 0.82 -1.00 0.00 0.00 179.01 180.25 1bg9 h ILE 334 N 0.72 1.12 -0.14 3.13 2.04 -1.06 -1.76 117.51 121.56 1bg9 h ILE 334 Ca 0.07 -0.28 0.05 0.00 1.00 0.00 0.00 64.86 65.70 1bg9 h ILE 334 Cb 0.90 0.62 -0.06 0.00 -0.74 0.00 0.00 36.82 37.54 1bg9 h ILE 334 CO 0.08 0.12 -0.23 0.44 0.00 0.00 0.00 178.15 178.56 1bg9 h ASP 335 N 0.51 -0.73 -0.61 1.72 3.32 -0.35 -0.06 116.42 120.22 1bg9 h ASP 335 Ca 0.14 0.12 0.09 0.00 0.02 0.00 0.00 57.03 57.40 1bg9 h ASP 335 Cb -0.00 0.33 -0.07 0.00 0.22 0.00 0.00 39.33 39.81 1bg9 h ASP 335 CO -0.03 -0.28 0.24 -0.09 -1.72 0.00 0.00 179.24 177.36 1bg9 h ARG 336 N -0.29 0.43 -0.63 3.56 2.43 -0.88 0.28 114.38 119.28 1bg9 h ARG 336 Ca 0.10 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1bg9 h ARG 336 Cb 0.45 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.87 1bg9 h ARG 336 CO -0.31 0.28 0.26 -0.07 -1.51 0.00 0.00 179.97 178.62 1bg9 h LEU 337 N 0.44 0.87 -1.08 3.80 -0.00 -0.83 -0.64 115.31 117.87 1bg9 h LEU 337 Ca 0.30 -0.17 -0.03 0.00 -0.00 0.00 0.00 57.88 57.99 1bg9 h LEU 337 Cb 0.35 -0.22 -0.03 0.00 -0.00 0.00 0.00 40.66 40.75 1bg9 h LEU 337 CO -0.28 0.79 0.33 0.58 -0.00 0.00 0.00 178.44 179.86 1bg9 h VAL 338 N 0.88 1.22 0.73 1.22 2.07 0.13 -1.53 116.25 120.98 1bg9 h VAL 338 Ca 0.21 -0.63 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 1bg9 h VAL 338 Cb 0.19 0.34 0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1bg9 h VAL 338 CO -0.02 0.26 -0.36 0.28 0.02 0.00 0.00 177.57 177.75 1bg9 h SER 339 N 0.97 -0.86 -0.87 0.57 0.02 -0.11 0.48 113.55 113.77 1bg9 h SER 339 Ca 0.24 0.03 0.18 0.00 -0.84 0.00 0.00 61.79 61.40 1bg9 h SER 339 Cb 0.10 0.23 -0.16 0.00 0.14 0.00 0.00 62.40 62.71 1bg9 h SER 339 CO -0.03 -0.60 -0.20 0.58 -1.14 0.00 0.00 176.83 175.44 1bg9 h VAL 340 N -0.99 0.14 0.19 2.27 2.07 -0.67 0.29 116.25 119.54 1bg9 h VAL 340 Ca -0.10 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1bg9 h VAL 340 Cb 0.77 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 1bg9 h VAL 340 CO 0.16 0.00 -0.16 -0.09 0.02 0.00 0.00 177.57 177.50 1bg9 h ARG 341 N 0.00 -0.36 -0.31 1.57 2.43 -1.05 -1.55 114.38 115.12 1bg9 h ARG 341 Ca 0.42 0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 59.46 1bg9 h ARG 341 Cb 0.66 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.29 1bg9 h ARG 341 CO -0.88 -0.24 -0.42 1.79 -1.51 0.00 0.00 179.97 178.71 1bg9 h THR 342 N -0.37 1.28 -0.46 0.20 1.35 0.15 -1.19 112.91 113.87 1bg9 h THR 342 Ca -0.00 -1.60 0.08 0.00 -0.55 0.00 0.00 66.41 64.34 1bg9 h THR 342 Cb 0.34 1.57 -0.07 0.00 -1.73 0.00 0.00 68.15 68.26 1bg9 h THR 342 CO -0.03 0.52 0.06 -0.09 -0.25 0.00 0.00 175.52 175.73 1bg9 h ARG 343 N 0.61 0.17 -0.37 4.72 2.43 -0.45 0.00 114.38 121.50 1bg9 h ARG 343 Ca 0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1bg9 h ARG 343 Cb 1.02 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1bg9 h ARG 343 CO 0.10 0.12 0.00 0.72 -1.51 0.00 0.00 179.97 179.39 1bg9 n HIS 344 N -5.15 0.48 -2.18 2.20 8.25 -0.59 -4.90 115.22 113.33 1bg9 n HIS 344 Ca 0.04 -0.23 -0.18 0.00 -0.26 0.00 0.00 57.72 57.09 1bg9 n HIS 344 Cb 0.23 -0.02 -0.02 0.00 1.12 0.00 0.00 29.99 31.30 1bg9 n HIS 344 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1bg9 n GLY 345 N 0.99 0.06 3.77 -1.41 0.00 -0.01 -4.94 105.19 103.65 1bg9 n GLY 345 Ca 0.11 -0.11 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1bg9 n GLY 345 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bg9 s ILE 346 N -2.87 2.69 0.20 -0.61 -1.09 -0.48 -4.99 121.20 114.05 1bg9 s ILE 346 Ca 0.00 0.61 -0.15 0.00 -2.23 0.00 0.00 60.65 58.89 1bg9 s ILE 346 Cb 0.00 -3.36 0.01 0.00 -1.58 0.00 0.00 42.46 37.53 1bg9 s ILE 346 CO 0.00 0.08 0.46 -1.38 -1.23 0.00 0.00 174.94 172.88 1bg9 s HIS 347 N -1.28 0.10 0.48 3.97 -3.43 -1.26 -4.71 115.29 109.16 1bg9 s HIS 347 Ca 0.57 -0.46 0.35 0.00 -0.80 0.00 0.00 55.06 54.72 1bg9 s HIS 347 Cb -0.37 0.25 1.49 0.00 -1.43 0.00 0.00 32.58 32.53 1bg9 s HIS 347 CO 0.47 -0.90 1.65 -2.95 -2.00 0.00 0.00 174.74 171.01 1bg9 h ASN 348 N 2.29 0.17 -0.61 7.38 -1.07 -1.91 0.21 115.58 122.03 1bg9 h ASN 348 Ca -0.28 0.08 -0.09 0.00 0.07 0.00 0.00 56.30 56.07 1bg9 h ASN 348 Cb 1.25 0.07 -0.06 0.00 -2.07 0.00 0.00 38.32 37.52 1bg9 h ASN 348 CO 0.39 -0.10 0.11 -0.62 0.07 0.00 0.00 177.43 177.28 1bg9 n GLU 349 N -4.45 4.17 -1.30 4.14 1.02 -1.26 -0.63 120.64 122.32 1bg9 n GLU 349 Ca 0.37 -3.11 -0.35 0.00 -0.02 0.00 0.00 57.16 54.05 1bg9 n GLU 349 Cb 1.50 -2.20 0.11 0.00 -0.02 0.00 0.00 31.44 30.83 1bg9 n GLU 349 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1bg9 s SER 350 N -1.05 3.88 0.20 1.62 0.01 0.72 -4.97 113.70 114.11 1bg9 s SER 350 Ca 0.54 2.46 -0.30 0.00 1.31 0.00 0.00 55.95 59.96 1bg9 s SER 350 Cb 0.42 -2.60 -0.08 0.00 0.21 0.00 0.00 66.02 63.97 1bg9 s SER 350 CO 0.14 -2.48 0.93 -0.54 0.41 0.00 0.00 173.24 171.70 1bg9 s LYS 351 N -3.89 4.79 -0.04 12.44 1.02 -1.26 -4.60 119.74 128.20 1bg9 s LYS 351 Ca 0.76 1.45 0.06 0.00 0.02 0.00 0.00 55.97 58.26 1bg9 s LYS 351 Cb -0.32 -3.30 -0.01 0.00 -0.52 0.00 0.00 37.83 33.68 1bg9 s LYS 351 CO 0.47 0.45 -0.22 -1.17 -0.92 0.00 0.00 175.35 173.96 1bg9 s LEU 352 N -0.88 2.02 -0.09 3.17 2.96 -1.26 -0.82 118.68 123.78 1bg9 s LEU 352 Ca 0.42 -0.44 0.01 0.00 -0.22 0.00 0.00 54.13 53.89 1bg9 s LEU 352 Cb -0.25 -1.21 0.02 0.00 0.50 0.00 0.00 46.19 45.25 1bg9 s LEU 352 CO 0.31 0.24 -0.09 -1.58 -1.32 0.00 0.00 176.35 173.91 1bg9 s GLN 353 N -0.24 1.51 -0.39 1.98 0.74 -0.36 -4.99 119.66 117.91 1bg9 s GLN 353 Ca 0.01 -0.29 -0.22 0.00 0.05 0.00 0.00 55.36 54.91 1bg9 s GLN 353 Cb -0.12 -1.45 0.01 0.00 1.10 0.00 0.00 33.01 32.56 1bg9 s GLN 353 CO 0.02 -0.15 0.71 0.42 -0.55 0.00 0.00 175.29 175.75 1bg9 s ILE 354 N 1.27 4.78 -0.07 -2.34 1.01 -1.26 -0.14 121.20 124.45 1bg9 s ILE 354 Ca -0.03 0.58 -0.20 0.00 0.00 0.00 0.00 60.65 61.00 1bg9 s ILE 354 Cb -0.14 -4.19 -0.15 0.00 0.01 0.00 0.00 42.46 37.99 1bg9 s ILE 354 CO -0.03 -0.48 0.75 0.40 0.00 0.00 0.00 174.94 175.58 1bg9 h ILE 355 N 5.79 0.87 -3.24 2.92 2.04 -1.27 -3.48 117.51 121.14 1bg9 h ILE 355 Ca -0.25 -1.28 -0.12 0.00 1.00 0.00 0.00 64.86 64.20 1bg9 h ILE 355 Cb 1.10 1.52 -0.20 0.00 -0.74 0.00 0.00 36.82 38.50 1bg9 h ILE 355 CO 0.89 0.25 -0.35 -0.70 0.00 0.00 0.00 178.15 178.24 1bg9 s GLU 356 N -3.01 0.63 -0.34 2.37 2.56 -0.89 -4.98 118.70 115.03 1bg9 s GLU 356 Ca -0.12 -0.32 0.04 0.00 0.00 0.00 0.00 54.97 54.57 1bg9 s GLU 356 Cb -0.00 0.27 0.16 0.00 2.00 0.00 0.00 34.13 36.56 1bg9 s GLU 356 CO 0.45 -0.17 0.45 0.00 -0.56 0.00 0.00 175.26 175.43 1bg9 s ALA 357 N -1.54 -1.26 0.29 6.30 0.00 -1.25 -1.14 121.76 123.16 1bg9 s ALA 357 Ca -0.13 -0.14 0.11 0.00 0.00 0.00 0.00 51.96 51.80 1bg9 s ALA 357 Cb -0.05 -2.24 -0.05 0.00 0.00 0.00 0.00 23.12 20.78 1bg9 s ALA 357 CO 0.02 -1.99 -0.16 0.34 0.00 0.00 0.00 175.76 173.98 1bg9 s ASP 358 N 2.04 3.73 0.35 0.00 -1.08 0.89 -4.23 116.67 118.36 1bg9 s ASP 358 Ca 0.13 -1.02 0.19 0.00 -0.52 0.00 0.00 52.55 51.34 1bg9 s ASP 358 Cb -0.11 -0.37 1.25 0.00 -1.46 0.00 0.00 42.92 42.23 1bg9 s ASP 358 CO -0.16 -0.01 1.49 0.00 0.52 0.00 0.00 175.17 177.00 1bg9 n ALA 359 N -0.69 0.95 -0.54 3.66 0.00 -1.26 -1.83 120.51 120.80 1bg9 n ALA 359 Ca -0.05 0.96 0.07 0.00 0.00 0.00 0.00 53.44 54.42 1bg9 n ALA 359 Cb 0.61 -0.95 0.18 0.00 0.00 0.00 0.00 19.45 19.28 1bg9 n ALA 359 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1bg9 n ASP 360 N -5.14 3.16 -3.64 0.00 5.75 -1.26 -2.16 116.55 113.27 1bg9 n ASP 360 Ca 0.35 -2.47 -0.08 0.00 -0.01 0.00 0.00 54.79 52.58 1bg9 n ASP 360 Cb 1.20 -0.34 -0.07 0.00 -1.03 0.00 0.00 41.12 40.87 1bg9 n ASP 360 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1bg9 s LEU 361 N -1.84 -0.76 -0.05 -2.12 2.96 -0.76 -1.95 118.68 114.17 1bg9 s LEU 361 Ca 0.29 1.29 0.02 0.00 -0.22 0.00 0.00 54.13 55.51 1bg9 s LEU 361 Cb 0.20 2.22 0.01 0.00 0.50 0.00 0.00 46.19 49.12 1bg9 s LEU 361 CO 0.11 -0.21 -0.10 -0.47 -1.32 0.00 0.00 176.35 174.36 1bg9 s TYR 362 N 1.13 1.16 -0.05 5.38 5.04 -0.44 -0.08 117.35 129.48 1bg9 s TYR 362 Ca -0.06 -0.36 -0.02 0.00 -2.44 0.00 0.00 57.07 54.19 1bg9 s TYR 362 Cb -0.05 -0.86 0.03 0.00 0.35 0.00 0.00 41.96 41.44 1bg9 s TYR 362 CO -0.13 -0.19 0.09 -1.17 -1.34 0.00 0.00 175.55 172.81 1bg9 s LEU 363 N 0.50 0.21 0.05 6.97 2.96 -0.30 -0.58 118.68 128.50 1bg9 s LEU 363 Ca -0.09 0.15 0.01 0.00 -0.22 0.00 0.00 54.13 53.98 1bg9 s LEU 363 Cb -0.13 -0.00 -0.03 0.00 0.50 0.00 0.00 46.19 46.53 1bg9 s LEU 363 CO 0.02 -0.23 -0.06 0.00 -1.32 0.00 0.00 176.35 174.76 1bg9 s ALA 364 N 2.04 0.59 -0.13 5.97 0.00 -0.48 -0.72 121.76 129.03 1bg9 s ALA 364 Ca 0.02 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 51.05 1bg9 s ALA 364 Cb -0.12 0.13 0.01 0.00 0.00 0.00 0.00 23.12 23.14 1bg9 s ALA 364 CO -0.04 -0.15 -0.19 -2.00 0.00 0.00 0.00 175.76 173.38 1bg9 s GLU 365 N -2.51 2.70 -0.18 0.00 2.12 0.80 -1.40 118.70 120.22 1bg9 s GLU 365 Ca -0.03 -0.73 -0.05 0.00 0.36 0.00 0.00 54.97 54.52 1bg9 s GLU 365 Cb -0.03 -2.24 -0.03 0.00 0.26 0.00 0.00 34.13 32.09 1bg9 s GLU 365 CO -0.03 -0.06 -0.01 0.42 -0.54 0.00 0.00 175.26 175.04 1bg9 s ILE 366 N 0.96 4.01 -1.10 -3.70 1.09 0.39 -1.23 121.20 121.62 1bg9 s ILE 366 Ca -0.05 -0.30 0.00 0.00 -1.10 0.00 0.00 60.65 59.20 1bg9 s ILE 366 Cb -0.15 -2.79 0.00 0.00 -1.06 0.00 0.00 42.46 38.46 1bg9 s ILE 366 CO -0.03 0.45 0.00 0.47 -0.10 0.00 0.00 174.94 175.73 1bg9 n ASP 367 N 3.93 -4.85 0.00 3.58 9.92 -0.00 -1.48 116.55 127.65 1bg9 n ASP 367 Ca -0.17 0.26 0.00 0.00 -0.53 0.00 0.00 54.79 54.35 1bg9 n ASP 367 Cb 0.52 -3.73 0.00 0.00 -0.64 0.00 0.00 41.12 37.28 1bg9 n ASP 367 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1bg9 n GLY 368 N 0.16 1.82 0.00 0.44 0.00 -1.26 -4.85 105.19 101.50 1bg9 n GLY 368 Ca -0.10 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.95 1bg9 n GLY 368 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bg9 n LYS 369 N -2.00 0.97 -4.07 1.61 5.02 -0.55 -4.86 118.16 114.28 1bg9 n LYS 369 Ca 0.00 -0.05 -0.14 0.00 -2.02 0.00 0.00 58.31 56.10 1bg9 n LYS 369 Cb 0.00 -1.11 -0.13 0.00 -0.02 0.00 0.00 35.03 33.77 1bg9 n LYS 369 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1bg9 s VAL 370 N -2.35 0.35 -0.02 -0.18 1.01 -0.93 -0.59 120.40 117.69 1bg9 s VAL 370 Ca -0.02 -0.46 0.05 0.00 0.00 0.00 0.00 61.98 61.55 1bg9 s VAL 370 Cb 0.05 -0.35 -0.01 0.00 0.00 0.00 0.00 36.38 36.07 1bg9 s VAL 370 CO 0.29 -0.09 -0.16 -0.63 0.00 0.00 0.00 175.10 174.51 1bg9 s ILE 371 N -0.54 1.29 -0.03 2.22 1.01 0.18 -0.47 121.20 124.86 1bg9 s ILE 371 Ca -0.03 -0.68 0.05 0.00 0.00 0.00 0.00 60.65 59.99 1bg9 s ILE 371 Cb -0.04 -1.08 -0.01 0.00 0.01 0.00 0.00 42.46 41.34 1bg9 s ILE 371 CO -0.00 0.37 -0.19 0.54 0.00 0.00 0.00 174.94 175.65 1bg9 s VAL 372 N -0.27 1.56 -0.07 2.92 0.11 -0.49 -0.20 120.40 123.96 1bg9 s VAL 372 Ca 0.04 -0.81 0.04 0.00 -2.93 0.00 0.00 61.98 58.31 1bg9 s VAL 372 Cb -0.07 -1.32 0.00 0.00 -1.53 0.00 0.00 36.38 33.46 1bg9 s VAL 372 CO -0.00 0.44 -0.19 -0.75 -3.33 0.00 0.00 175.10 171.27 1bg9 s LYS 373 N -0.18 2.33 0.13 1.54 2.36 0.11 -1.39 119.74 124.64 1bg9 s LYS 373 Ca 0.00 -0.68 0.11 0.00 -2.55 0.00 0.00 55.97 52.85 1bg9 s LYS 373 Cb -0.10 -1.86 -0.04 0.00 -1.05 0.00 0.00 37.83 34.78 1bg9 s LYS 373 CO 0.01 0.16 -0.27 -0.51 1.55 0.00 0.00 175.35 176.30 1bg9 s LEU 374 N 0.34 2.32 0.00 5.43 1.43 0.26 -0.96 118.68 127.50 1bg9 s LEU 374 Ca -0.13 -0.74 0.00 0.00 -1.03 0.00 0.00 54.13 52.22 1bg9 s LEU 374 Cb -0.16 -1.21 0.00 0.00 0.03 0.00 0.00 46.19 44.86 1bg9 s LEU 374 CO 0.06 0.18 0.00 0.61 0.23 0.00 0.00 176.35 177.42 1bg9 n GLY 375 N 0.93 2.84 0.03 -3.19 0.00 0.28 -1.33 105.19 104.76 1bg9 n GLY 375 Ca -0.18 -1.98 0.13 0.00 0.00 0.00 0.00 46.02 43.99 1bg9 n GLY 375 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1bg9 n PRO 376 N -0.09 0.10 -1.62 1.61 -0.04 -1.16 -4.42 135.00 129.38 1bg9 n PRO 376 Ca 0.00 0.06 -0.54 0.00 -0.04 0.00 0.00 63.50 62.97 1bg9 n PRO 376 Cb 0.00 -1.59 -0.06 0.00 -0.04 0.00 0.00 33.50 31.80 1bg9 n PRO 376 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1bg9 n ARG 377 N -1.76 1.07 -0.09 0.54 3.00 -0.82 -4.90 116.66 113.70 1bg9 n ARG 377 Ca 0.06 0.39 -0.16 0.00 -0.00 0.00 0.00 57.85 58.14 1bg9 n ARG 377 Cb 0.37 -2.03 -0.08 0.00 0.00 0.00 0.00 32.46 30.72 1bg9 n ARG 377 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.63 178.61 1bg9 n TYR 378 N 3.27 0.95 -2.22 -0.14 9.36 -1.26 -4.75 117.16 122.36 1bg9 n TYR 378 Ca 0.21 0.41 -0.34 0.00 3.32 0.00 0.00 57.90 61.49 1bg9 n TYR 378 Cb 0.16 -0.98 -0.04 0.00 -0.63 0.00 0.00 39.34 37.86 1bg9 n TYR 378 CO 0.00 0.00 0.00 0.16 0.22 0.00 0.00 176.86 177.24 1bg9 s ASP 379 N -6.47 5.60 0.00 2.98 -4.77 -1.26 -4.59 116.67 108.17 1bg9 s ASP 379 Ca -0.24 -0.59 0.00 0.00 -3.30 0.00 0.00 52.55 48.42 1bg9 s ASP 379 Cb 0.05 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 39.32 1bg9 s ASP 379 CO 0.45 -2.27 0.00 0.55 0.70 0.00 0.00 175.17 174.60 1bg9 n VAL 380 N 7.32 0.00 -0.37 2.11 3.14 -1.26 -4.92 118.33 124.35 1bg9 n VAL 380 Ca 0.29 0.00 0.29 0.00 -2.96 0.00 0.00 64.34 61.96 1bg9 n VAL 380 Cb 0.49 -0.43 0.55 0.00 -1.06 0.00 0.00 33.84 33.40 1bg9 n VAL 380 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1bg9 h GLY 381 N 0.00 1.65 0.84 7.55 0.00 -1.93 -0.34 103.07 110.83 1bg9 h GLY 381 Ca 0.00 -0.18 0.13 0.00 0.00 0.00 0.00 47.33 47.28 1bg9 h GLY 381 CO 0.00 -0.41 0.46 3.45 0.00 0.00 0.00 176.54 180.03 1bg9 h ASN 382 N 0.23 0.00 0.04 0.19 7.08 -1.98 -1.14 115.58 120.00 1bg9 h ASN 382 Ca 0.75 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.97 1bg9 h ASN 382 Cb 2.01 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 38.25 1bg9 h ASN 382 CO -0.49 0.00 -1.16 0.18 -2.08 0.00 0.00 177.43 173.87 1bg9 n LEU 383 N -3.76 0.78 -4.67 6.14 4.32 -0.14 -4.87 117.00 114.80 1bg9 n LEU 383 Ca 0.08 -0.37 -0.37 0.00 -0.02 0.00 0.00 56.01 55.33 1bg9 n LEU 383 Cb 0.64 -0.01 -0.08 0.00 -1.62 0.00 0.00 43.42 42.35 1bg9 n LEU 383 CO 0.28 0.19 0.00 0.27 -1.22 0.00 0.00 177.39 176.92 1bg9 s ILE 384 N -3.10 5.26 0.83 -0.08 -5.25 -0.43 -5.04 121.20 113.39 1bg9 s ILE 384 Ca 0.05 0.53 -0.14 0.00 -0.99 0.00 0.00 60.65 60.10 1bg9 s ILE 384 Cb 0.16 -3.65 0.01 0.00 2.95 0.00 0.00 42.46 41.93 1bg9 s ILE 384 CO 0.87 0.30 0.60 -2.65 -1.79 0.00 0.00 174.94 172.26 1bg9 n PRO 385 N 4.31 0.05 -2.34 0.37 -0.02 -1.26 -4.96 135.00 131.16 1bg9 n PRO 385 Ca -0.11 0.07 -0.41 0.00 -2.02 0.00 0.00 63.50 61.03 1bg9 n PRO 385 Cb 0.51 -1.95 -0.03 0.00 -0.02 0.00 0.00 33.50 32.02 1bg9 n PRO 385 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1bg9 s GLY 386 N -1.79 2.54 0.00 -1.23 0.00 -1.26 -3.33 107.32 102.25 1bg9 s GLY 386 Ca 0.63 0.98 0.00 0.00 0.00 0.00 0.00 44.72 46.33 1bg9 s GLY 386 CO 0.60 1.96 0.00 0.61 0.00 0.00 0.00 173.10 176.27 1bg9 n GLY 387 N 2.48 1.97 3.82 0.20 0.00 -1.26 -5.09 105.19 107.30 1bg9 n GLY 387 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 1bg9 n GLY 387 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bg9 s PHE 388 N -1.92 3.39 0.11 1.61 0.40 -1.21 -0.87 117.98 119.50 1bg9 s PHE 388 Ca 0.00 0.30 0.09 0.00 -0.60 0.00 0.00 56.93 56.72 1bg9 s PHE 388 Cb 0.00 -1.80 -0.04 0.00 0.51 0.00 0.00 43.02 41.69 1bg9 s PHE 388 CO 0.00 0.60 -0.22 0.15 0.70 0.00 0.00 175.22 176.45 1bg9 s LYS 389 N -1.57 1.17 0.06 0.44 1.02 0.37 -4.90 119.74 116.34 1bg9 s LYS 389 Ca 0.21 -1.20 -0.31 0.00 0.02 0.00 0.00 55.97 54.70 1bg9 s LYS 389 Cb -0.12 -1.48 -0.06 0.00 -0.52 0.00 0.00 37.83 35.65 1bg9 s LYS 389 CO 0.12 0.34 1.34 0.54 -0.92 0.00 0.00 175.35 176.77 1bg9 s VAL 390 N -1.16 3.64 -0.12 3.17 0.11 -1.26 -0.31 120.40 124.47 1bg9 s VAL 390 Ca 0.08 1.13 0.08 0.00 -2.93 0.00 0.00 61.98 60.34 1bg9 s VAL 390 Cb -0.10 -3.73 -0.23 0.00 -1.53 0.00 0.00 36.38 30.79 1bg9 s VAL 390 CO 0.05 0.06 0.35 0.00 -3.33 0.00 0.00 175.10 172.22 1bg9 n ALA 391 N 4.41 1.34 -3.28 1.54 0.00 0.18 -4.81 120.51 119.88 1bg9 n ALA 391 Ca 0.11 -0.89 -0.13 0.00 0.00 0.00 0.00 53.44 52.52 1bg9 n ALA 391 Cb 0.44 -0.57 -0.05 0.00 0.00 0.00 0.00 19.45 19.27 1bg9 n ALA 391 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bg9 s ALA 392 N -2.55 -1.30 0.10 0.00 0.00 -0.46 -4.99 121.76 112.55 1bg9 s ALA 392 Ca -0.14 0.53 -0.26 0.00 0.00 0.00 0.00 51.96 52.10 1bg9 s ALA 392 Cb 0.07 0.43 0.08 0.00 0.00 0.00 0.00 23.12 23.70 1bg9 s ALA 392 CO 0.78 -0.53 0.83 -3.38 0.00 0.00 0.00 175.76 173.46 1bg9 s HIS 393 N -2.62 -0.32 0.00 0.00 -3.43 -1.26 -0.46 115.29 107.20 1bg9 s HIS 393 Ca -0.04 0.09 0.00 0.00 -0.80 0.00 0.00 55.06 54.30 1bg9 s HIS 393 Cb -0.00 0.59 0.00 0.00 -1.43 0.00 0.00 32.58 31.73 1bg9 s HIS 393 CO -0.03 -0.75 0.00 0.41 -2.00 0.00 0.00 174.74 172.36 1bg9 n GLY 394 N -0.35 1.69 0.43 -1.38 0.00 -0.82 -4.98 105.19 99.78 1bg9 n GLY 394 Ca -0.09 -0.26 -0.12 0.00 0.00 0.00 0.00 46.02 45.54 1bg9 n GLY 394 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1bg9 h ASN 395 N 0.00 -1.71 -1.21 1.61 -1.24 -1.98 -3.22 115.58 107.83 1bg9 h ASN 395 Ca 0.00 0.24 -0.38 0.00 0.71 0.00 0.00 56.30 56.86 1bg9 h ASN 395 Cb 0.00 0.72 -0.34 0.00 0.73 0.00 0.00 38.32 39.43 1bg9 h ASN 395 CO 0.00 -0.39 -1.00 0.47 -1.29 0.00 0.00 177.43 175.21 1bg9 n ASP 396 N -5.39 0.27 -3.55 1.15 8.00 -1.26 -4.98 116.55 110.79 1bg9 n ASP 396 Ca -0.02 -2.97 -0.15 0.00 0.71 0.00 0.00 54.79 52.36 1bg9 n ASP 396 Cb 0.35 -0.05 -0.05 0.00 -0.02 0.00 0.00 41.12 41.34 1bg9 n ASP 396 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1bg9 s TYR 397 N -1.98 -0.49 -0.20 1.24 1.13 -1.22 -0.55 117.35 115.29 1bg9 s TYR 397 Ca 0.32 0.64 -0.27 0.00 -1.41 0.00 0.00 57.07 56.34 1bg9 s TYR 397 Cb 0.38 0.37 0.09 0.00 -1.10 0.00 0.00 41.96 41.70 1bg9 s TYR 397 CO -0.04 -0.64 0.81 0.00 -2.51 0.00 0.00 175.55 173.17 1bg9 s ALA 398 N -2.15 -1.84 -0.03 9.51 0.00 -0.13 -1.95 121.76 125.17 1bg9 s ALA 398 Ca -0.07 1.74 0.01 0.00 0.00 0.00 0.00 51.96 53.64 1bg9 s ALA 398 Cb -0.01 -0.84 0.02 0.00 0.00 0.00 0.00 23.12 22.29 1bg9 s ALA 398 CO 0.01 -0.32 -0.04 0.54 0.00 0.00 0.00 175.76 175.95 1bg9 s VAL 399 N -0.29 0.42 0.19 0.00 0.11 0.39 0.06 120.40 121.28 1bg9 s VAL 399 Ca -0.03 -0.10 0.04 0.00 -2.93 0.00 0.00 61.98 58.96 1bg9 s VAL 399 Cb -0.03 -0.44 -0.03 0.00 -1.53 0.00 0.00 36.38 34.34 1bg9 s VAL 399 CO 0.02 0.18 0.24 0.26 -3.33 0.00 0.00 175.10 172.47 1bg9 s TRP 400 N 0.66 3.33 0.06 1.54 0.51 0.72 0.47 118.94 126.22 1bg9 s TRP 400 Ca -0.08 0.02 0.02 0.00 -2.12 0.00 0.00 56.10 53.94 1bg9 s TRP 400 Cb -0.11 -1.56 -0.03 0.00 -0.81 0.00 0.00 33.47 30.96 1bg9 s TRP 400 CO -0.00 0.50 -0.07 -1.83 -0.51 0.00 0.00 176.95 175.04 1bg9 s GLU 401 N -3.44 0.62 -0.07 4.98 -1.05 0.58 -0.65 118.70 119.67 1bg9 s GLU 401 Ca 0.33 -0.93 -0.25 0.00 -0.15 0.00 0.00 54.97 53.97 1bg9 s GLU 401 Cb -0.10 -0.26 -0.03 0.00 -0.44 0.00 0.00 34.13 33.30 1bg9 s GLU 401 CO 0.27 0.03 0.77 0.21 0.95 0.00 0.00 175.26 177.48 1bg9 s LYS 402 N -2.26 4.43 0.00 -4.83 2.20 0.24 -0.48 119.74 119.05 1bg9 s LYS 402 Ca -0.03 0.99 0.00 0.00 -0.36 0.00 0.00 55.97 56.57 1bg9 s LYS 402 Cb -0.05 -3.47 0.00 0.00 -1.51 0.00 0.00 37.83 32.80 1bg9 s LYS 402 CO -0.01 -0.02 0.00 0.44 -0.36 0.00 0.00 175.35 175.40