#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bg0 s ASP 3 N 0.00 2.08 0.32 4.52 1.47 -1.26 -4.90 116.67 118.91 1bg0 s ASP 3 Ca 0.00 1.39 0.23 0.00 1.18 0.00 0.00 52.55 55.35 1bg0 s ASP 3 Cb 0.00 -2.10 0.17 0.00 -0.34 0.00 0.00 42.92 40.66 1bg0 s ASP 3 CO 0.00 -3.50 1.33 -0.61 0.68 0.00 0.00 175.17 173.07 1bg0 h GLN 4 N -2.14 0.00 -0.31 2.11 5.75 -2.03 -2.94 115.11 115.54 1bg0 h GLN 4 Ca -0.56 0.00 -0.08 0.00 -0.15 0.00 0.00 58.65 57.85 1bg0 h GLN 4 Cb 1.32 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.86 1bg0 h GLN 4 CO 0.54 0.00 -0.13 0.00 -2.65 0.00 0.00 178.83 176.59 1bg0 h ALA 5 N 2.00 0.44 -0.45 3.38 0.00 -1.98 0.28 119.26 122.92 1bg0 h ALA 5 Ca -0.00 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 1bg0 h ALA 5 Cb 1.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1bg0 h ALA 5 CO 0.00 0.32 -0.07 1.15 0.00 0.00 0.00 179.25 180.65 1bg0 h THR 6 N 0.41 1.27 -0.86 0.00 2.02 -1.94 0.27 112.91 114.07 1bg0 h THR 6 Ca 0.07 -1.17 0.03 0.00 0.77 0.00 0.00 66.41 66.11 1bg0 h THR 6 Cb 0.65 1.12 -0.05 0.00 -1.74 0.00 0.00 68.15 68.13 1bg0 h THR 6 CO 0.04 0.40 0.57 -0.07 0.37 0.00 0.00 175.52 176.83 1bg0 h LEU 7 N 0.67 0.95 -0.40 2.58 3.38 -1.38 0.73 115.31 121.85 1bg0 h LEU 7 Ca 0.12 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.90 1bg0 h LEU 7 Cb 0.60 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 1bg0 h LEU 7 CO 0.04 0.67 -0.51 0.44 0.09 0.00 0.00 178.44 179.16 1bg0 h ASP 8 N 1.11 0.86 -0.11 -0.43 3.32 -0.51 -0.96 116.42 119.70 1bg0 h ASP 8 Ca 0.33 -0.44 -0.12 0.00 0.02 0.00 0.00 57.03 56.82 1bg0 h ASP 8 Cb -0.03 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 1bg0 h ASP 8 CO -0.09 1.21 -0.31 0.11 -1.72 0.00 0.00 179.24 178.44 1bg0 h LYS 9 N 0.61 0.59 -0.24 3.56 1.57 0.12 -1.89 116.57 120.89 1bg0 h LYS 9 Ca 0.02 -0.26 -0.04 0.00 -1.87 0.00 0.00 60.65 58.50 1bg0 h LYS 9 Cb 1.09 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.38 1bg0 h LYS 9 CO 0.11 0.83 -0.02 -0.07 -0.57 0.00 0.00 179.45 179.73 1bg0 h LEU 10 N 0.50 0.43 -0.87 2.94 3.38 0.62 0.27 115.31 122.57 1bg0 h LEU 10 Ca 0.06 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1bg0 h LEU 10 Cb 0.79 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.38 1bg0 h LEU 10 CO 0.06 0.65 0.50 -0.33 0.09 0.00 0.00 178.44 179.41 1bg0 h GLU 11 N 0.19 1.20 -0.47 1.13 4.39 -1.10 -0.25 114.58 119.67 1bg0 h GLU 11 Ca 0.06 -0.13 -0.05 0.00 0.34 0.00 0.00 59.36 59.59 1bg0 h GLU 11 Cb 0.45 -0.24 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 1bg0 h GLU 11 CO 0.02 0.86 0.11 0.00 -1.16 0.00 0.00 179.01 178.83 1bg0 h ALA 12 N 1.27 0.62 -0.66 3.43 0.00 -1.16 -2.25 119.26 120.51 1bg0 h ALA 12 Ca 0.31 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1bg0 h ALA 12 Cb -0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1bg0 h ALA 12 CO -0.05 0.32 0.24 0.78 0.00 0.00 0.00 179.25 180.54 1bg0 h GLY 13 N 0.63 1.07 1.01 0.00 0.00 -0.46 -0.90 103.07 104.42 1bg0 h GLY 13 Ca 0.15 -0.60 0.01 0.00 0.00 0.00 0.00 47.33 46.88 1bg0 h GLY 13 CO 0.00 0.57 0.56 -2.75 0.00 0.00 0.00 176.54 174.92 1bg0 h PHE 14 N 0.94 1.08 -0.59 5.60 3.57 -0.90 -1.16 116.94 125.48 1bg0 h PHE 14 Ca 0.22 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.66 1bg0 h PHE 14 Cb 0.24 -0.36 -0.02 0.00 2.79 0.00 0.00 35.95 38.59 1bg0 h PHE 14 CO 0.02 0.69 0.08 -0.22 -2.23 0.00 0.00 178.31 176.64 1bg0 h LYS 15 N 1.16 0.99 -0.86 1.11 3.64 -1.03 -1.57 116.57 120.01 1bg0 h LYS 15 Ca 0.31 -0.28 0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1bg0 h LYS 15 Cb -0.12 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 31.55 1bg0 h LYS 15 CO -0.07 0.95 0.57 -0.22 -2.27 0.00 0.00 179.45 178.41 1bg0 h LYS 16 N 0.89 1.13 -0.53 1.90 3.64 -0.59 0.27 116.57 123.28 1bg0 h LYS 16 Ca 0.18 -0.07 -0.06 0.00 -1.27 0.00 0.00 60.65 59.43 1bg0 h LYS 16 Cb 0.45 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1bg0 h LYS 16 CO 0.02 0.75 0.10 -0.07 -2.27 0.00 0.00 179.45 177.97 1bg0 h LEU 17 N 1.16 0.84 -0.51 5.20 3.38 -0.86 -1.89 115.31 122.63 1bg0 h LEU 17 Ca 0.32 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 1bg0 h LEU 17 Cb -0.12 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 1bg0 h LEU 17 CO -0.07 0.87 0.01 1.56 0.09 0.00 0.00 178.44 180.90 1bg0 h GLN 18 N 0.76 0.90 0.00 1.13 1.08 -0.73 -2.96 115.11 115.29 1bg0 h GLN 18 Ca 0.16 -0.28 -0.02 0.00 -1.45 0.00 0.00 58.65 57.06 1bg0 h GLN 18 Cb 0.38 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 27.73 1bg0 h GLN 18 CO 0.01 0.92 -0.12 0.93 -0.95 0.00 0.00 178.83 179.62 1bg0 h GLU 19 N 0.76 0.00 -5.97 1.46 5.08 -0.85 -3.38 114.58 111.69 1bg0 h GLU 19 Ca 0.15 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.87 1bg0 h GLU 19 Cb 0.51 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.67 1bg0 h GLU 19 CO 0.02 0.12 1.78 0.00 -1.00 0.00 0.00 179.01 179.93 1bg0 s ALA 20 N -3.67 2.99 0.28 3.43 0.00 -0.72 -4.84 121.76 119.23 1bg0 s ALA 20 Ca 0.01 -2.56 -0.02 0.00 0.00 0.00 0.00 51.96 49.39 1bg0 s ALA 20 Cb 0.10 -4.57 0.42 0.00 0.00 0.00 0.00 23.12 19.08 1bg0 s ALA 20 CO 0.59 -3.46 1.92 0.77 0.00 0.00 0.00 175.76 175.58 1bg0 h SER 21 N 8.83 1.01 -0.53 0.00 0.02 -1.83 -2.81 113.55 118.22 1bg0 h SER 21 Ca 0.30 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 1bg0 h SER 21 Cb 0.95 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.26 1bg0 h SER 21 CO 1.43 0.68 0.00 0.47 -1.14 0.00 0.00 176.83 178.27 1bg0 n ASP 22 N -4.45 3.99 -4.68 3.07 8.00 -1.26 -4.92 116.55 116.30 1bg0 n ASP 22 Ca 0.13 -2.37 -0.42 0.00 0.71 0.00 0.00 54.79 52.83 1bg0 n ASP 22 Cb 0.12 -0.52 -0.03 0.00 -0.02 0.00 0.00 41.12 40.67 1bg0 n ASP 22 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bg0 n LYS 24 N 5.24 3.32 -1.98 0.00 5.02 -1.26 -4.91 118.16 123.59 1bg0 n LYS 24 Ca 0.10 -2.86 -0.33 0.00 -2.02 0.00 0.00 58.31 53.20 1bg0 n LYS 24 Cb 0.47 -1.89 0.02 0.00 -0.02 0.00 0.00 35.03 33.61 1bg0 n LYS 24 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1bg0 s SER 25 N -1.63 5.52 0.43 4.39 1.04 -1.22 -4.89 113.70 117.33 1bg0 s SER 25 Ca 0.44 1.95 0.18 0.00 0.48 0.00 0.00 55.95 59.00 1bg0 s SER 25 Cb 0.34 -2.55 0.96 0.00 0.10 0.00 0.00 66.02 64.88 1bg0 s SER 25 CO 0.11 -1.35 1.90 -0.07 0.98 0.00 0.00 173.24 174.81 1bg0 h LEU 26 N 0.43 0.00 0.63 2.42 3.38 -1.19 -2.59 115.31 118.39 1bg0 h LEU 26 Ca -0.47 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.47 1bg0 h LEU 26 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 1bg0 h LEU 26 CO 0.56 0.27 -0.33 0.25 0.09 0.00 0.00 178.44 179.28 1bg0 h LEU 27 N 0.00 -0.80 -0.56 1.67 5.85 -1.52 0.20 115.31 120.14 1bg0 h LEU 27 Ca -0.00 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.81 1bg0 h LEU 27 Cb 0.57 0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.76 1bg0 h LEU 27 CO 0.04 -0.54 0.27 0.50 -0.34 0.00 0.00 178.44 178.37 1bg0 h LYS 28 N -0.89 0.50 -0.86 1.25 3.64 -1.82 0.27 116.57 118.66 1bg0 h LYS 28 Ca -0.08 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 1bg0 h LYS 28 Cb 0.69 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.36 1bg0 h LYS 28 CO 0.12 0.33 0.52 -0.22 -2.27 0.00 0.00 179.45 177.93 1bg0 h LYS 29 N 0.52 1.17 0.00 1.90 3.64 -1.25 -3.27 116.57 119.29 1bg0 h LYS 29 Ca 0.26 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1bg0 h LYS 29 Cb 0.20 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1bg0 h LYS 29 CO -0.20 0.83 -1.26 0.72 -2.27 0.00 0.00 179.45 177.27 1bg0 n HIS 30 N -4.42 0.00 -2.36 1.91 8.25 0.04 -4.70 115.22 113.95 1bg0 n HIS 30 Ca 0.09 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.12 1bg0 n HIS 30 Cb 0.06 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.02 1bg0 n HIS 30 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1bg0 n LEU 31 N -1.71 6.00 -4.82 2.41 7.94 0.91 -4.87 117.00 122.85 1bg0 n LEU 31 Ca 0.01 -4.29 -0.31 0.00 -1.11 0.00 0.00 56.01 50.32 1bg0 n LEU 31 Cb 0.38 -1.62 0.06 0.00 0.53 0.00 0.00 43.42 42.77 1bg0 n LEU 31 CO 0.42 0.87 0.71 0.42 -1.11 0.00 0.00 177.39 178.70 1bg0 s THR 32 N 2.35 3.70 0.35 1.96 -4.23 -1.26 -4.77 115.64 113.73 1bg0 s THR 32 Ca 0.46 0.55 0.06 0.00 -1.18 0.00 0.00 61.69 61.58 1bg0 s THR 32 Cb 0.07 -3.31 0.30 0.00 1.34 0.00 0.00 72.50 70.89 1bg0 s THR 32 CO -0.00 -0.72 1.93 0.50 -0.54 0.00 0.00 174.62 175.79 1bg0 h LYS 33 N -0.83 0.77 0.02 3.99 3.64 -1.98 0.22 116.57 122.39 1bg0 h LYS 33 Ca -0.45 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 58.88 1bg0 h LYS 33 Cb 1.23 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1bg0 h LYS 33 CO 0.58 0.51 -0.01 0.22 -2.27 0.00 0.00 179.45 178.48 1bg0 h ASP 34 N 0.79 -0.02 -0.37 4.20 1.82 -1.98 0.22 116.42 121.08 1bg0 h ASP 34 Ca 0.35 -0.04 -0.03 0.00 -0.39 0.00 0.00 57.03 56.92 1bg0 h ASP 34 Cb 0.34 0.01 -0.02 0.00 0.68 0.00 0.00 39.33 40.34 1bg0 h ASP 34 CO -0.13 0.03 0.11 0.58 -1.61 0.00 0.00 179.24 178.22 1bg0 h VAL 35 N -0.07 1.21 -0.05 2.25 2.07 -1.68 -2.60 116.25 117.39 1bg0 h VAL 35 Ca -0.00 -0.71 0.04 0.00 0.82 0.00 0.00 66.70 66.85 1bg0 h VAL 35 Cb 0.06 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 1bg0 h VAL 35 CO 0.00 0.25 -0.23 0.15 0.02 0.00 0.00 177.57 177.76 1bg0 h PHE 36 N 0.45 -0.61 -0.36 1.57 3.57 -0.36 -2.36 116.94 118.84 1bg0 h PHE 36 Ca 0.12 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 1bg0 h PHE 36 Cb 0.27 0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 1bg0 h PHE 36 CO 0.01 -0.31 0.18 -0.44 -2.23 0.00 0.00 178.31 175.52 1bg0 h ASP 37 N -0.33 0.44 1.19 0.41 3.32 -0.92 -0.34 116.42 120.19 1bg0 h ASP 37 Ca 0.07 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1bg0 h ASP 37 Cb 0.44 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1bg0 h ASP 37 CO -0.24 0.38 0.00 0.77 -1.72 0.00 0.00 179.24 178.43 1bg0 h SER 38 N 0.51 0.00 0.00 6.45 4.64 -1.02 -3.35 113.55 120.77 1bg0 h SER 38 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1bg0 h SER 38 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1bg0 h SER 38 CO -0.02 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.24 1bg0 n ILE 39 N -3.09 0.00 0.27 0.95 -5.35 -1.03 -4.78 119.36 106.33 1bg0 n ILE 39 Ca 0.01 -0.25 0.16 0.00 -0.27 0.00 0.00 62.75 62.39 1bg0 n ILE 39 Cb 0.34 1.43 0.71 0.00 -1.74 0.00 0.00 39.64 40.39 1bg0 n ILE 39 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 1bg0 h LYS 40 N 0.00 0.00 -0.24 6.28 2.10 -1.20 -2.49 116.57 121.02 1bg0 h LYS 40 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1bg0 h LYS 40 Cb 0.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.55 1bg0 h LYS 40 CO 0.00 0.07 0.00 0.09 -2.00 0.00 0.00 179.45 177.61 1bg0 n ASN 41 N -3.25 2.86 -4.87 7.07 4.13 -1.26 -4.77 115.26 115.17 1bg0 n ASN 41 Ca -0.00 -1.91 -0.31 0.00 1.68 0.00 0.00 54.58 54.04 1bg0 n ASN 41 Cb 0.29 -0.15 -0.05 0.00 -1.54 0.00 0.00 39.78 38.33 1bg0 n ASN 41 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1bg0 s LYS 42 N -1.70 3.81 -0.09 3.52 1.02 -0.94 -4.03 119.74 121.33 1bg0 s LYS 42 Ca 0.35 0.33 -0.08 0.00 0.02 0.00 0.00 55.97 56.60 1bg0 s LYS 42 Cb 0.21 -2.58 0.03 0.00 -0.52 0.00 0.00 37.83 34.97 1bg0 s LYS 42 CO 0.30 0.23 0.24 0.21 -0.92 0.00 0.00 175.35 175.41 1bg0 s LYS 43 N -3.07 0.26 0.82 1.68 2.20 -1.26 -4.26 119.74 116.10 1bg0 s LYS 43 Ca 0.49 0.37 -0.12 0.00 -0.36 0.00 0.00 55.97 56.35 1bg0 s LYS 43 Cb -0.11 0.08 0.10 0.00 -1.51 0.00 0.00 37.83 36.39 1bg0 s LYS 43 CO 0.23 -0.06 1.18 0.95 -0.36 0.00 0.00 175.35 177.29 1bg0 s THR 44 N 0.37 2.04 0.58 3.43 -4.23 -0.17 -4.89 115.64 112.76 1bg0 s THR 44 Ca -0.02 -0.04 0.28 0.00 -1.18 0.00 0.00 61.69 60.72 1bg0 s THR 44 Cb -0.04 -2.99 0.35 0.00 1.34 0.00 0.00 72.50 71.16 1bg0 s THR 44 CO -0.02 0.00 2.16 1.23 -0.54 0.00 0.00 174.62 177.45 1bg0 h GLY 45 N -1.09 0.00 -1.57 3.99 0.00 -1.98 0.12 103.07 102.54 1bg0 h GLY 45 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1bg0 h GLY 45 CO 0.60 0.00 0.00 1.03 0.00 0.00 0.00 176.54 178.17 1bg0 n MET 46 N -3.92 2.07 -0.88 4.80 2.81 -1.26 -4.92 117.12 115.81 1bg0 n MET 46 Ca -0.00 -1.63 0.00 0.00 -1.81 0.00 0.00 57.70 54.25 1bg0 n MET 46 Cb 0.22 -1.40 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 1bg0 n MET 46 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1bg0 n GLY 47 N 1.27 0.50 3.74 3.03 0.00 0.41 -5.03 105.19 109.11 1bg0 n GLY 47 Ca 0.17 -0.57 -0.40 0.00 0.00 0.00 0.00 46.02 45.21 1bg0 n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bg0 s ALA 48 N -2.00 3.31 0.45 4.61 0.00 -1.26 -4.76 121.76 122.11 1bg0 s ALA 48 Ca 0.00 0.62 0.04 0.00 0.00 0.00 0.00 51.96 52.63 1bg0 s ALA 48 Cb 0.00 -3.25 -0.05 0.00 0.00 0.00 0.00 23.12 19.82 1bg0 s ALA 48 CO 0.00 0.08 0.01 0.95 0.00 0.00 0.00 175.76 176.80 1bg0 s THR 49 N -0.67 1.64 0.58 0.00 -4.23 -1.26 -1.00 115.64 110.69 1bg0 s THR 49 Ca 0.44 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.23 1bg0 s THR 49 Cb -0.25 -2.64 0.35 0.00 1.34 0.00 0.00 72.50 71.30 1bg0 s THR 49 CO 0.32 0.00 2.18 0.25 -0.54 0.00 0.00 174.62 176.82 1bg0 h LEU 50 N 1.58 0.00 -0.32 4.79 5.85 -1.82 -0.93 115.31 124.45 1bg0 h LEU 50 Ca -0.44 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.21 1bg0 h LEU 50 Cb 1.27 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.29 1bg0 h LEU 50 CO 0.78 0.00 -0.06 0.25 -0.34 0.00 0.00 178.44 179.07 1bg0 h LEU 51 N 0.00 0.61 -1.90 2.25 5.85 -1.94 0.18 115.31 120.36 1bg0 h LEU 51 Ca 0.04 -0.35 -0.02 0.00 0.84 0.00 0.00 57.88 58.39 1bg0 h LEU 51 Cb 0.22 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.08 1bg0 h LEU 51 CO -0.00 0.82 -0.08 0.44 -0.34 0.00 0.00 178.44 179.29 1bg0 h ASP 52 N 0.40 0.00 0.05 1.25 3.32 -1.57 0.19 116.42 120.06 1bg0 h ASP 52 Ca 0.08 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 1bg0 h ASP 52 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1bg0 h ASP 52 CO 0.03 0.08 -0.03 0.58 -1.72 0.00 0.00 179.24 178.18 1bg0 h VAL 53 N 0.00 1.21 -0.01 -1.35 2.07 -1.04 -3.39 116.25 113.74 1bg0 h VAL 53 Ca -0.00 -1.60 0.00 0.00 0.82 0.00 0.00 66.70 65.92 1bg0 h VAL 53 Cb 0.14 2.15 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1bg0 h VAL 53 CO 0.01 0.36 -0.48 2.30 0.02 0.00 0.00 177.57 179.78 1bg0 n ILE 54 N -4.77 0.00 -0.28 4.57 -5.35 -0.00 -2.00 119.36 111.53 1bg0 n ILE 54 Ca -0.08 -0.13 0.05 0.00 -0.27 0.00 0.00 62.75 62.32 1bg0 n ILE 54 Cb 0.32 0.74 0.15 0.00 -1.74 0.00 0.00 39.64 39.10 1bg0 n ILE 54 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 1bg0 h GLN 55 N 1.23 0.05 -0.92 6.28 4.15 -0.81 -0.03 115.11 125.06 1bg0 h GLN 55 Ca 0.00 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1bg0 h GLN 55 Cb 0.58 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 28.22 1bg0 h GLN 55 CO 0.00 0.03 0.59 1.03 -1.93 0.00 0.00 178.83 178.55 1bg0 h SER 56 N 0.05 1.08 0.09 -0.69 0.87 -1.76 -1.23 113.55 111.95 1bg0 h SER 56 Ca 0.42 -0.04 -0.13 0.00 -1.23 0.00 0.00 61.79 60.80 1bg0 h SER 56 Cb 0.73 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 1bg0 h SER 56 CO -0.76 0.80 -0.46 1.23 -0.53 0.00 0.00 176.83 177.11 1bg0 h GLY 57 N 1.26 0.49 0.81 5.77 0.00 0.76 -0.11 103.07 112.04 1bg0 h GLY 57 Ca 0.33 -0.51 -0.06 0.00 0.00 0.00 0.00 47.33 47.09 1bg0 h GLY 57 CO -0.07 0.46 -0.12 -2.08 0.00 0.00 0.00 176.54 174.73 1bg0 h VAL 58 N 0.36 1.31 -0.14 4.60 2.07 -0.75 -3.27 116.25 120.44 1bg0 h VAL 58 Ca 0.02 -1.21 -0.20 0.00 0.82 0.00 0.00 66.70 66.13 1bg0 h VAL 58 Cb 0.95 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 1bg0 h VAL 58 CO 0.08 0.37 -0.73 -0.33 0.02 0.00 0.00 177.57 176.98 1bg0 h GLU 59 N 0.12 0.64 -3.63 1.57 4.39 -1.23 -3.37 114.58 113.06 1bg0 h GLU 59 Ca 0.04 -0.50 -0.73 0.00 0.34 0.00 0.00 59.36 58.51 1bg0 h GLU 59 Cb 0.62 0.10 -0.32 0.00 -0.10 0.00 0.00 28.75 29.05 1bg0 h GLU 59 CO 0.03 1.12 -0.18 -0.80 -1.16 0.00 0.00 179.01 178.02 1bg0 s ASN 60 N -7.04 5.81 0.60 1.42 0.01 -0.06 -4.90 114.94 110.78 1bg0 s ASN 60 Ca -0.08 -2.88 0.37 0.00 -0.71 0.00 0.00 52.86 49.56 1bg0 s ASN 60 Cb 0.10 -1.98 1.83 0.00 0.41 0.00 0.00 41.25 41.60 1bg0 s ASN 60 CO 0.88 -0.42 2.16 -0.07 -1.51 0.00 0.00 177.10 178.14 1bg0 h LEU 61 N 7.19 0.00 -0.07 0.60 3.38 -1.74 -1.97 115.31 122.71 1bg0 h LEU 61 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1bg0 h LEU 61 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1bg0 h LEU 61 CO 0.73 0.02 0.00 -0.90 0.09 0.00 0.00 178.44 178.39 1bg0 n ASP 62 N -3.18 0.10 -4.76 -0.43 5.75 -1.26 -4.51 116.55 108.25 1bg0 n ASP 62 Ca -0.01 -1.80 -0.38 0.00 -0.01 0.00 0.00 54.79 52.59 1bg0 n ASP 62 Cb 0.20 -0.01 0.02 0.00 -1.03 0.00 0.00 41.12 40.30 1bg0 n ASP 62 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1bg0 s SER 63 N -1.20 5.64 -0.04 -1.12 0.01 -0.74 -4.95 113.70 111.29 1bg0 s SER 63 Ca 0.11 2.53 -0.03 0.00 1.31 0.00 0.00 55.95 59.87 1bg0 s SER 63 Cb 0.05 -2.62 -0.27 0.00 0.21 0.00 0.00 66.02 63.39 1bg0 s SER 63 CO 0.08 -1.30 0.67 1.23 0.41 0.00 0.00 173.24 174.34 1bg0 h GLY 64 N 1.65 0.28 0.00 3.44 0.00 -1.90 -3.23 103.07 103.30 1bg0 h GLY 64 Ca -0.50 -0.71 0.00 0.00 0.00 0.00 0.00 47.33 46.11 1bg0 h GLY 64 CO 0.58 0.63 -0.39 -0.62 0.00 0.00 0.00 176.54 176.73 1bg0 n VAL 65 N -3.43 1.25 -0.42 4.60 0.31 -1.26 -1.31 118.33 118.07 1bg0 n VAL 65 Ca -0.22 0.29 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 1bg0 n VAL 65 Cb 1.05 -1.86 0.00 0.00 -0.91 0.00 0.00 33.84 32.12 1bg0 n VAL 65 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1bg0 n GLY 66 N 2.63 0.76 3.19 2.92 0.00 -1.26 -1.44 105.19 111.98 1bg0 n GLY 66 Ca -0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 1bg0 n GLY 66 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1bg0 s ILE 67 N -2.86 0.88 0.08 -0.61 -4.36 -1.26 -0.93 121.20 112.13 1bg0 s ILE 67 Ca 0.00 -1.85 -0.06 0.00 -0.26 0.00 0.00 60.65 58.48 1bg0 s ILE 67 Cb 0.00 -1.59 -0.02 0.00 1.25 0.00 0.00 42.46 42.10 1bg0 s ILE 67 CO 0.00 -0.73 0.11 -0.31 0.24 0.00 0.00 174.94 174.25 1bg0 s TYR 68 N -3.13 0.33 -0.40 1.37 2.02 -0.84 -4.55 117.35 112.14 1bg0 s TYR 68 Ca 0.10 -0.79 -0.12 0.00 -0.37 0.00 0.00 57.07 55.89 1bg0 s TYR 68 Cb 0.02 -0.19 0.03 0.00 -0.40 0.00 0.00 41.96 41.42 1bg0 s TYR 68 CO -0.02 -0.50 0.25 0.00 -1.57 0.00 0.00 175.55 173.72 1bg0 s ALA 69 N -3.90 3.36 0.37 3.71 0.00 -0.34 -4.38 121.76 120.59 1bg0 s ALA 69 Ca 0.07 -1.78 0.05 0.00 0.00 0.00 0.00 51.96 50.30 1bg0 s ALA 69 Cb 0.06 -2.73 0.72 0.00 0.00 0.00 0.00 23.12 21.17 1bg0 s ALA 69 CO -0.09 -1.46 2.00 -1.35 0.00 0.00 0.00 175.76 174.86 1bg0 h PRO 70 N 8.52 0.74 -4.03 0.00 0.11 -1.87 -3.44 132.00 132.03 1bg0 h PRO 70 Ca -0.26 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 65.66 1bg0 h PRO 70 Cb 1.11 -0.17 -0.11 0.00 0.11 0.00 0.00 31.00 31.94 1bg0 h PRO 70 CO 0.71 0.49 -0.29 0.16 -0.21 0.00 0.00 178.00 178.85 1bg0 s ASP 71 N -6.41 0.13 0.23 -2.05 1.47 -1.26 -2.55 116.67 106.23 1bg0 s ASP 71 Ca -0.10 -1.16 -0.08 0.00 1.18 0.00 0.00 52.55 52.40 1bg0 s ASP 71 Cb 0.18 0.53 0.22 0.00 -0.34 0.00 0.00 42.92 43.51 1bg0 s ASP 71 CO 0.76 -1.06 1.90 0.00 0.68 0.00 0.00 175.17 177.45 1bg0 h ALA 72 N 2.35 1.11 -0.39 2.11 0.00 -1.95 -2.49 119.26 120.00 1bg0 h ALA 72 Ca -0.29 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.61 1bg0 h ALA 72 Cb 1.25 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1bg0 h ALA 72 CO 0.41 0.48 0.26 1.49 0.00 0.00 0.00 179.25 181.90 1bg0 h GLU 73 N 1.15 0.30 -0.98 0.00 4.81 -1.99 -2.65 114.58 115.23 1bg0 h GLU 73 Ca 0.32 -0.02 0.16 0.00 -0.13 0.00 0.00 59.36 59.69 1bg0 h GLU 73 Cb -0.11 -0.07 -0.09 0.00 0.63 0.00 0.00 28.75 29.12 1bg0 h GLU 73 CO -0.08 0.20 0.62 0.77 -0.73 0.00 0.00 179.01 179.79 1bg0 h SER 74 N 0.31 0.81 -0.37 1.04 0.02 -1.85 0.59 113.55 114.10 1bg0 h SER 74 Ca 0.17 0.06 0.11 0.00 -0.84 0.00 0.00 61.79 61.29 1bg0 h SER 74 Cb 0.28 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1bg0 h SER 74 CO -0.04 0.37 0.34 1.88 -1.14 0.00 0.00 176.83 178.24 1bg0 h TYR 75 N 0.83 0.00 0.00 3.45 0.05 -1.61 -0.86 116.97 118.83 1bg0 h TYR 75 Ca 0.52 0.00 -0.29 0.00 0.05 0.00 0.00 58.73 59.01 1bg0 h TYR 75 Cb 0.72 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.41 1bg0 h TYR 75 CO -0.00 0.00 -2.10 0.54 -1.05 0.00 0.00 178.16 175.55 1bg0 n ARG 76 N -3.97 0.48 -0.28 4.88 1.74 -0.41 -3.51 116.66 115.58 1bg0 n ARG 76 Ca 0.06 0.11 0.02 0.00 -0.77 0.00 0.00 57.85 57.27 1bg0 n ARG 76 Cb 0.51 -1.38 0.15 0.00 -1.02 0.00 0.00 32.46 30.72 1bg0 n ARG 76 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1bg0 h THR 77 N -0.03 0.94 -0.73 0.55 2.02 -0.80 -0.42 112.91 114.44 1bg0 h THR 77 Ca -0.43 -0.27 -0.46 0.00 0.77 0.00 0.00 66.41 66.02 1bg0 h THR 77 Cb 1.66 0.08 -0.26 0.00 -1.74 0.00 0.00 68.15 67.89 1bg0 h THR 77 CO -0.08 0.15 0.16 0.49 0.37 0.00 0.00 175.52 176.61 1bg0 n PHE 78 N -4.73 2.38 -0.33 3.16 3.72 -0.34 -4.76 117.46 116.56 1bg0 n PHE 78 Ca 0.12 -2.18 0.05 0.00 -0.05 0.00 0.00 57.45 55.39 1bg0 n PHE 78 Cb 0.24 -0.81 0.20 0.00 -0.94 0.00 0.00 39.48 38.16 1bg0 n PHE 78 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1bg0 h GLY 79 N 1.52 1.46 1.56 1.37 0.00 -1.11 -1.57 103.07 106.30 1bg0 h GLY 79 Ca 0.44 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1bg0 h GLY 79 CO 0.93 0.15 0.21 -2.55 0.00 0.00 0.00 176.54 175.29 1bg0 h PRO 80 N 0.90 0.00 0.00 4.80 0.11 -1.86 0.12 132.00 136.07 1bg0 h PRO 80 Ca 0.44 0.00 -0.44 0.00 0.11 0.00 0.00 66.00 66.12 1bg0 h PRO 80 Cb 0.41 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 31.45 1bg0 h PRO 80 CO -0.25 0.00 -2.42 -0.11 -0.21 0.00 0.00 178.00 175.01 1bg0 n LEU 81 N -2.86 2.05 -0.14 2.35 7.94 -0.64 -4.45 117.00 121.24 1bg0 n LEU 81 Ca -0.02 0.30 -0.07 0.00 -1.11 0.00 0.00 56.01 55.11 1bg0 n LEU 81 Cb 0.26 -0.85 0.02 0.00 0.53 0.00 0.00 43.42 43.38 1bg0 n LEU 81 CO 0.15 0.59 1.04 -0.26 -1.11 0.00 0.00 177.39 177.79 1bg0 h PHE 82 N -0.90 0.51 0.06 1.96 0.04 -1.09 -3.06 116.94 114.47 1bg0 h PHE 82 Ca -0.66 0.01 0.03 0.00 2.80 0.00 0.00 57.97 60.15 1bg0 h PHE 82 Cb 1.62 -0.17 -0.05 0.00 2.20 0.00 0.00 35.95 39.55 1bg0 h PHE 82 CO -0.06 0.31 -0.40 -0.44 -0.60 0.00 0.00 178.31 177.12 1bg0 h ASP 83 N 0.55 -1.18 0.00 2.17 3.32 -1.02 0.34 116.42 120.60 1bg0 h ASP 83 Ca 0.17 0.14 -0.05 0.00 0.02 0.00 0.00 57.03 57.30 1bg0 h ASP 83 Cb -0.02 0.45 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 1bg0 h ASP 83 CO -0.06 -0.46 -0.14 1.55 -1.72 0.00 0.00 179.24 178.41 1bg0 h PRO 84 N -0.59 0.28 -0.35 3.56 0.13 -1.78 -0.03 132.00 133.23 1bg0 h PRO 84 Ca 0.04 -0.07 -0.15 0.00 -0.87 0.00 0.00 66.00 64.95 1bg0 h PRO 84 Cb 0.65 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.73 1bg0 h PRO 84 CO -0.27 0.43 -0.35 0.82 -0.23 0.00 0.00 178.00 178.39 1bg0 h ILE 85 N 0.27 1.28 -0.53 -3.56 2.04 -1.33 -1.00 117.51 114.68 1bg0 h ILE 85 Ca 0.05 -1.53 -0.12 0.00 1.00 0.00 0.00 64.86 64.27 1bg0 h ILE 85 Cb 0.41 1.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 1bg0 h ILE 85 CO 0.02 0.50 -0.12 0.40 0.00 0.00 0.00 178.15 178.95 1bg0 h ILE 86 N 0.65 1.27 -0.71 -0.67 2.04 -0.01 -1.14 117.51 118.94 1bg0 h ILE 86 Ca 0.05 -1.28 -0.05 0.00 1.00 0.00 0.00 64.86 64.59 1bg0 h ILE 86 Cb 0.94 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.98 1bg0 h ILE 86 CO 0.09 0.45 0.26 -0.78 0.00 0.00 0.00 178.15 178.17 1bg0 h ASP 87 N 0.89 1.00 0.63 1.72 3.58 -0.91 -2.08 116.42 121.26 1bg0 h ASP 87 Ca 0.14 -0.19 -0.03 0.00 0.42 0.00 0.00 57.03 57.37 1bg0 h ASP 87 Cb 0.69 -0.26 0.01 0.00 1.72 0.00 0.00 39.33 41.48 1bg0 h ASP 87 CO 0.05 0.92 -0.31 -0.78 -2.88 0.00 0.00 179.24 176.24 1bg0 h ASP 88 N 1.02 -0.72 -0.34 2.28 1.82 -0.97 0.13 116.42 119.65 1bg0 h ASP 88 Ca 0.23 0.01 0.04 0.00 -0.39 0.00 0.00 57.03 56.92 1bg0 h ASP 88 Cb 0.25 0.19 -0.04 0.00 0.68 0.00 0.00 39.33 40.40 1bg0 h ASP 88 CO -0.01 -0.34 0.09 0.22 -1.61 0.00 0.00 179.24 177.59 1bg0 h TYR 89 N -1.19 0.15 -0.01 0.28 3.20 -1.24 -2.73 116.97 115.43 1bg0 h TYR 89 Ca -0.09 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.80 1bg0 h TYR 89 Cb 0.67 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.92 1bg0 h TYR 89 CO 0.00 0.05 0.00 0.72 -1.64 0.00 0.00 178.16 177.29 1bg0 n HIS 90 N -5.06 0.01 -2.51 -3.82 8.25 -0.78 -4.75 115.22 106.55 1bg0 n HIS 90 Ca 0.01 -0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.33 1bg0 n HIS 90 Cb 0.14 -0.02 0.01 0.00 1.12 0.00 0.00 29.99 31.23 1bg0 n HIS 90 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1bg0 n GLY 91 N 0.40 -0.11 0.00 -1.41 0.00 -1.03 -4.81 105.19 98.23 1bg0 n GLY 91 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1bg0 n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bg0 n GLY 92 N -1.13 1.87 3.17 -0.02 0.00 0.46 -5.05 105.19 104.48 1bg0 n GLY 92 Ca -0.11 -0.95 0.03 0.00 0.00 0.00 0.00 46.02 44.99 1bg0 n GLY 92 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1bg0 s PHE 93 N 0.00 -1.79 0.84 1.61 5.36 -1.26 -4.92 117.98 117.82 1bg0 s PHE 93 Ca 0.00 0.73 -0.11 0.00 -0.96 0.00 0.00 56.93 56.59 1bg0 s PHE 93 Cb 0.00 0.32 0.09 0.00 -0.34 0.00 0.00 43.02 43.09 1bg0 s PHE 93 CO 0.00 -1.11 1.09 0.15 -1.46 0.00 0.00 175.22 173.89 1bg0 s LYS 94 N 2.42 1.75 0.53 10.12 1.02 -1.26 -4.32 119.74 129.99 1bg0 s LYS 94 Ca 0.13 0.83 0.17 0.00 0.02 0.00 0.00 55.97 57.12 1bg0 s LYS 94 Cb -0.07 -1.86 1.32 0.00 -0.52 0.00 0.00 37.83 36.69 1bg0 s LYS 94 CO -0.18 -1.90 2.16 -0.07 -0.92 0.00 0.00 175.35 174.43 1bg0 h LEU 95 N -1.30 0.00 0.00 3.17 -0.00 -2.02 -0.26 115.31 114.90 1bg0 h LEU 95 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.41 1bg0 h LEU 95 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.93 1bg0 h LEU 95 CO 0.55 0.00 -0.35 0.35 -0.00 0.00 0.00 178.44 179.00 1bg0 n THR 96 N -4.46 0.18 -2.18 0.22 -2.24 -1.26 -4.90 114.28 99.63 1bg0 n THR 96 Ca -0.03 -0.12 -0.34 0.00 -2.27 0.00 0.00 64.05 61.30 1bg0 n THR 96 Cb 0.09 -0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 1bg0 n THR 96 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1bg0 s ASP 97 N -3.55 5.81 -0.01 3.42 1.01 -0.11 -5.06 116.67 118.17 1bg0 s ASP 97 Ca 0.10 1.96 0.01 0.00 0.71 0.00 0.00 52.55 55.33 1bg0 s ASP 97 Cb 0.16 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.54 1bg0 s ASP 97 CO 0.65 -1.15 -0.03 -0.54 0.21 0.00 0.00 175.17 174.31 1bg0 s LYS 98 N -3.68 0.31 0.19 8.23 1.02 -1.26 -4.88 119.74 119.66 1bg0 s LYS 98 Ca 0.67 -0.09 -0.31 0.00 0.02 0.00 0.00 55.97 56.26 1bg0 s LYS 98 Cb -0.19 -0.33 -0.10 0.00 -0.52 0.00 0.00 37.83 36.69 1bg0 s LYS 98 CO 0.31 0.03 1.50 -1.58 -0.92 0.00 0.00 175.35 174.69 1bg0 s HIS 99 N 0.14 3.08 0.84 3.18 5.65 0.44 -4.91 115.29 123.72 1bg0 s HIS 99 Ca -0.01 0.81 -0.11 0.00 0.25 0.00 0.00 55.06 56.00 1bg0 s HIS 99 Cb -0.04 -3.85 0.10 0.00 -1.18 0.00 0.00 32.58 27.61 1bg0 s HIS 99 CO -0.00 -3.01 1.13 -1.25 -0.65 0.00 0.00 174.74 170.96 1bg0 s PRO 100 N 0.62 1.60 0.72 2.88 0.04 -1.26 -4.74 135.00 134.86 1bg0 s PRO 100 Ca 0.66 1.43 -0.16 0.00 0.04 0.00 0.00 61.00 62.96 1bg0 s PRO 100 Cb -0.42 -1.80 0.03 0.00 0.04 0.00 0.00 34.50 32.35 1bg0 s PRO 100 CO 0.35 -2.18 1.26 -2.30 0.04 0.00 0.00 177.00 174.17 1bg0 n PRO 101 N -3.81 0.73 -1.66 0.56 -0.02 -1.26 -4.88 135.00 124.66 1bg0 n PRO 101 Ca 0.11 0.31 -0.46 0.00 -2.02 0.00 0.00 63.50 61.44 1bg0 n PRO 101 Cb 0.52 -2.50 -0.04 0.00 -0.02 0.00 0.00 33.50 31.47 1bg0 n PRO 101 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1bg0 n LYS 102 N -2.49 1.96 -3.26 -0.52 0.00 -1.26 -4.88 118.16 107.72 1bg0 n LYS 102 Ca 0.15 0.70 -0.04 0.00 0.00 0.00 0.00 58.31 59.12 1bg0 n LYS 102 Cb 0.49 -2.40 -0.04 0.00 0.00 0.00 0.00 35.03 33.08 1bg0 n LYS 102 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 1bg0 s GLN 103 N 0.26 0.46 0.35 1.64 2.00 -1.26 -5.02 119.66 118.10 1bg0 s GLN 103 Ca 0.75 0.38 0.13 0.00 -2.00 0.00 0.00 55.36 54.62 1bg0 s GLN 103 Cb -0.70 -0.11 0.66 0.00 0.80 0.00 0.00 33.01 33.66 1bg0 s GLN 103 CO 0.44 -0.94 1.77 -1.49 -0.50 0.00 0.00 175.29 174.58 1bg0 h TRP 104 N 8.11 0.00 0.00 1.67 4.06 -1.93 -2.45 115.95 125.41 1bg0 h TRP 104 Ca -0.10 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.85 1bg0 h TRP 104 Cb 1.15 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.31 1bg0 h TRP 104 CO 0.23 0.42 0.00 0.41 -3.56 0.00 0.00 178.44 175.94 1bg0 n GLY 105 N -0.22 -2.29 3.55 1.49 0.00 -1.26 -3.91 105.19 102.55 1bg0 n GLY 105 Ca -0.02 -1.55 -0.40 0.00 0.00 0.00 0.00 46.02 44.05 1bg0 n GLY 105 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bg0 s ASP 106 N -2.75 6.23 0.54 1.61 2.15 -1.26 -4.86 116.67 118.33 1bg0 s ASP 106 Ca 0.00 -0.81 0.22 0.00 0.43 0.00 0.00 52.55 52.38 1bg0 s ASP 106 Cb 0.00 -2.56 1.40 0.00 -0.30 0.00 0.00 42.92 41.46 1bg0 s ASP 106 CO 0.00 -1.76 2.10 0.40 -0.17 0.00 0.00 175.17 175.74 1bg0 h ILE 107 N 6.40 0.81 0.00 4.11 2.04 -1.99 -1.30 117.51 127.58 1bg0 h ILE 107 Ca -0.08 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.78 1bg0 h ILE 107 Cb 1.04 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 1bg0 h ILE 107 CO 1.33 0.00 0.00 0.59 0.00 0.00 0.00 178.15 180.07 1bg0 n ASN 108 N -4.34 0.00 -0.14 1.72 4.13 -1.26 -1.21 115.26 114.16 1bg0 n ASN 108 Ca 0.02 0.49 0.13 0.00 1.68 0.00 0.00 54.58 56.89 1bg0 n ASN 108 Cb 0.29 -0.49 0.32 0.00 -1.54 0.00 0.00 39.78 38.36 1bg0 n ASN 108 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1bg0 n THR 109 N -1.49 0.00 -2.95 3.41 -2.24 -0.49 -4.87 114.28 105.65 1bg0 n THR 109 Ca 0.02 -0.07 -0.34 0.00 -2.27 0.00 0.00 64.05 61.39 1bg0 n THR 109 Cb 0.09 0.34 -0.07 0.00 -2.10 0.00 0.00 70.33 68.59 1bg0 n THR 109 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1bg0 s LEU 110 N -2.72 4.10 0.36 3.22 1.43 -0.35 -5.07 118.68 119.64 1bg0 s LEU 110 Ca 0.18 1.55 0.03 0.00 -1.03 0.00 0.00 54.13 54.87 1bg0 s LEU 110 Cb 0.18 -4.19 -0.04 0.00 0.03 0.00 0.00 46.19 42.18 1bg0 s LEU 110 CO 0.60 -0.21 0.12 0.68 0.23 0.00 0.00 176.35 177.76 1bg0 s VAL 111 N -1.94 0.67 -0.09 -1.59 -7.23 -1.26 -4.66 120.40 104.30 1bg0 s VAL 111 Ca 0.55 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.42 1bg0 s VAL 111 Cb -0.12 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.28 1bg0 s VAL 111 CO 0.17 0.00 1.21 -0.83 -0.31 0.00 0.00 175.10 175.34 1bg0 s GLY 112 N -3.51 1.97 0.49 2.32 0.00 -1.26 -3.53 107.32 103.80 1bg0 s GLY 112 Ca 0.30 0.56 0.28 0.00 0.00 0.00 0.00 44.72 45.87 1bg0 s GLY 112 CO 0.15 2.29 1.83 1.41 0.00 0.00 0.00 173.10 178.78 1bg0 h LEU 113 N 8.65 0.00 -5.11 0.66 3.38 -1.00 -3.40 115.31 118.49 1bg0 h LEU 113 Ca -0.32 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.41 1bg0 h LEU 113 Cb 1.14 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.72 1bg0 h LEU 113 CO 0.91 0.05 -0.55 -0.67 0.09 0.00 0.00 178.44 178.27 1bg0 n ASP 114 N -3.14 -2.74 -0.28 -0.43 2.03 -1.26 -4.82 116.55 105.91 1bg0 n ASP 114 Ca 0.02 -3.15 0.04 0.00 0.52 0.00 0.00 54.79 52.22 1bg0 n ASP 114 Cb 0.41 1.57 0.12 0.00 -0.72 0.00 0.00 41.12 42.50 1bg0 n ASP 114 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1bg0 h PRO 115 N 4.27 0.02 0.00 -0.67 0.11 -1.94 0.24 132.00 134.02 1bg0 h PRO 115 Ca -0.07 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.03 1bg0 h PRO 115 Cb 1.03 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 1bg0 h PRO 115 CO 0.27 0.01 -0.03 0.00 -0.21 0.00 0.00 178.00 178.04 1bg0 h ALA 116 N 1.81 1.05 -1.32 -0.75 0.00 -1.99 -3.47 119.26 114.59 1bg0 h ALA 116 Ca 0.41 -0.03 -0.25 0.00 0.00 0.00 0.00 54.91 55.04 1bg0 h ALA 116 Cb 0.66 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 1bg0 h ALA 116 CO -0.81 0.04 -0.29 0.41 0.00 0.00 0.00 179.25 178.60 1bg0 n GLY 117 N -0.47 0.42 0.01 0.00 0.00 0.85 -4.92 105.19 101.08 1bg0 n GLY 117 Ca -0.01 -0.40 0.11 0.00 0.00 0.00 0.00 46.02 45.72 1bg0 n GLY 117 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1bg0 n GLN 118 N -2.36 0.11 -0.01 1.61 1.13 -1.26 -4.68 117.38 111.90 1bg0 n GLN 118 Ca -0.14 -0.00 -0.05 0.00 -1.94 0.00 0.00 57.00 54.87 1bg0 n GLN 118 Cb 0.53 -1.53 -0.02 0.00 0.11 0.00 0.00 30.24 29.33 1bg0 n GLN 118 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1bg0 n PHE 119 N -1.67 0.00 -2.78 1.08 3.72 -1.26 -4.87 117.46 111.68 1bg0 n PHE 119 Ca 0.04 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.03 1bg0 n PHE 119 Cb 0.37 -0.19 -0.04 0.00 -0.94 0.00 0.00 39.48 38.68 1bg0 n PHE 119 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1bg0 s ILE 120 N -2.17 4.75 -0.21 4.37 1.01 -1.26 -0.85 121.20 126.84 1bg0 s ILE 120 Ca -0.09 1.95 -0.02 0.00 0.00 0.00 0.00 60.65 62.49 1bg0 s ILE 120 Cb 0.03 -4.27 -0.20 0.00 0.01 0.00 0.00 42.46 38.03 1bg0 s ILE 120 CO 0.11 0.24 -0.02 -0.38 0.00 0.00 0.00 174.94 174.90 1bg0 n ILE 121 N 3.40 1.59 -3.57 2.92 5.41 0.13 -4.58 119.36 124.67 1bg0 n ILE 121 Ca 0.03 -0.58 -0.17 0.00 1.00 0.00 0.00 62.75 63.03 1bg0 n ILE 121 Cb 0.50 -1.56 -0.07 0.00 -0.71 0.00 0.00 39.64 37.81 1bg0 n ILE 121 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1bg0 s SER 122 N -6.74 -0.57 0.00 4.38 1.04 -1.19 -0.48 113.70 110.14 1bg0 s SER 122 Ca -0.31 0.62 0.07 0.00 0.48 0.00 0.00 55.95 56.82 1bg0 s SER 122 Cb 0.08 0.53 -0.03 0.00 0.10 0.00 0.00 66.02 66.71 1bg0 s SER 122 CO 0.65 -0.56 -0.21 -0.89 0.98 0.00 0.00 173.24 173.21 1bg0 s THR 123 N -1.15 2.50 -0.09 2.02 2.01 -0.52 -0.77 115.64 119.64 1bg0 s THR 123 Ca -0.11 -1.09 -0.12 0.00 0.31 0.00 0.00 61.69 60.68 1bg0 s THR 123 Cb -0.01 -1.96 0.03 0.00 0.01 0.00 0.00 72.50 70.56 1bg0 s THR 123 CO 0.09 0.48 0.32 -0.60 -0.69 0.00 0.00 174.62 174.22 1bg0 s ARG 124 N -0.96 0.47 -0.03 4.92 3.52 -0.03 -2.03 118.95 124.80 1bg0 s ARG 124 Ca 0.12 0.24 0.00 0.00 -0.13 0.00 0.00 55.73 55.97 1bg0 s ARG 124 Cb -0.10 0.22 0.03 0.00 -1.56 0.00 0.00 34.95 33.53 1bg0 s ARG 124 CO 0.01 -0.09 -0.00 0.08 -0.81 0.00 0.00 175.30 174.49 1bg0 s VAL 125 N -0.31 0.22 0.11 7.11 1.01 -0.18 0.28 120.40 128.64 1bg0 s VAL 125 Ca -0.04 0.08 0.05 0.00 0.00 0.00 0.00 61.98 62.06 1bg0 s VAL 125 Cb -0.03 -0.31 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 1bg0 s VAL 125 CO 0.02 0.16 -0.12 0.00 0.00 0.00 0.00 175.10 175.16 1bg0 s ARG 126 N 1.11 0.95 0.16 2.72 1.04 -1.00 -1.71 118.95 122.21 1bg0 s ARG 126 Ca -0.09 -1.23 0.03 0.00 -1.04 0.00 0.00 55.73 53.41 1bg0 s ARG 126 Cb -0.13 -0.70 -0.05 0.00 -2.04 0.00 0.00 34.95 32.03 1bg0 s ARG 126 CO -0.02 0.12 -0.05 0.00 -0.04 0.00 0.00 175.30 175.31 1bg0 s GLY 128 N -3.17 0.92 0.01 0.00 0.00 -1.22 -0.80 107.32 103.06 1bg0 s GLY 128 Ca 0.19 -0.93 -0.02 0.00 0.00 0.00 0.00 44.72 43.96 1bg0 s GLY 128 CO 0.02 -0.89 0.03 0.50 0.00 0.00 0.00 173.10 172.76 1bg0 s ARG 129 N -1.22 0.31 -0.06 2.90 1.81 -0.74 -4.85 118.95 117.11 1bg0 s ARG 129 Ca 0.03 -0.43 0.05 0.00 -1.72 0.00 0.00 55.73 53.66 1bg0 s ARG 129 Cb -0.08 0.12 -0.02 0.00 -0.45 0.00 0.00 34.95 34.52 1bg0 s ARG 129 CO 0.02 -0.06 -0.20 -1.12 -0.68 0.00 0.00 175.30 173.26 1bg0 s SER 130 N -1.17 3.52 0.06 0.23 0.01 -1.25 -2.10 113.70 113.00 1bg0 s SER 130 Ca -0.13 -0.38 -0.30 0.00 1.31 0.00 0.00 55.95 56.45 1bg0 s SER 130 Cb -0.08 -0.88 -0.05 0.00 0.21 0.00 0.00 66.02 65.22 1bg0 s SER 130 CO -0.00 0.28 1.16 -0.76 0.41 0.00 0.00 173.24 174.32 1bg0 s LEU 131 N -0.34 4.38 0.20 2.44 1.43 -1.26 -0.67 118.68 124.86 1bg0 s LEU 131 Ca 0.02 1.97 -0.31 0.00 -1.03 0.00 0.00 54.13 54.78 1bg0 s LEU 131 Cb -0.12 -3.58 -0.10 0.00 0.03 0.00 0.00 46.19 42.41 1bg0 s LEU 131 CO 0.02 -0.41 1.53 -1.10 0.23 0.00 0.00 176.35 176.62 1bg0 s GLN 132 N 0.91 4.22 0.00 1.70 -0.21 -0.64 -2.28 119.66 123.37 1bg0 s GLN 132 Ca 0.57 2.36 0.00 0.00 0.02 0.00 0.00 55.36 58.31 1bg0 s GLN 132 Cb -0.28 -3.13 0.00 0.00 1.00 0.00 0.00 33.01 30.59 1bg0 s GLN 132 CO 0.30 -0.56 0.00 0.41 -2.12 0.00 0.00 175.29 173.32 1bg0 n GLY 133 N 3.23 3.01 3.44 3.09 0.00 -1.26 -5.01 105.19 111.69 1bg0 n GLY 133 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 1bg0 n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bg0 s TYR 134 N -2.68 2.78 1.02 1.61 1.51 -0.96 -5.13 117.35 115.49 1bg0 s TYR 134 Ca 0.00 -0.36 -0.17 0.00 -1.01 0.00 0.00 57.07 55.53 1bg0 s TYR 134 Cb 0.00 -1.74 0.23 0.00 -0.11 0.00 0.00 41.96 40.34 1bg0 s TYR 134 CO 0.00 0.02 1.31 -1.25 -1.11 0.00 0.00 175.55 174.51 1bg0 s PRO 135 N -0.22 0.20 0.75 -1.71 0.04 -1.26 -4.70 135.00 128.09 1bg0 s PRO 135 Ca 0.01 -0.42 -0.11 0.00 0.04 0.00 0.00 61.00 60.51 1bg0 s PRO 135 Cb -0.13 -1.80 0.04 0.00 0.04 0.00 0.00 34.50 32.65 1bg0 s PRO 135 CO 0.03 -2.71 1.09 -0.06 0.04 0.00 0.00 177.00 175.39 1bg0 s PHE 136 N -3.79 3.08 0.09 0.56 0.08 -1.06 -4.79 117.98 112.15 1bg0 s PHE 136 Ca 0.75 1.13 -0.10 0.00 0.12 0.00 0.00 56.93 58.84 1bg0 s PHE 136 Cb -0.04 -3.07 0.06 0.00 -0.57 0.00 0.00 43.02 39.40 1bg0 s PHE 136 CO 0.54 -1.45 0.67 0.09 -0.10 0.00 0.00 175.22 174.97 1bg0 n ASN 137 N -3.21 -0.34 0.19 1.36 3.02 -1.26 -1.29 115.26 113.72 1bg0 n ASN 137 Ca 0.07 0.76 0.18 0.00 -0.03 0.00 0.00 54.58 55.56 1bg0 n ASN 137 Cb 0.56 -0.15 0.81 0.00 -0.61 0.00 0.00 39.78 40.40 1bg0 n ASN 137 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1bg0 h PRO 138 N 0.00 0.00 -0.25 3.52 0.11 -1.79 -2.05 132.00 131.53 1bg0 h PRO 138 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1bg0 h PRO 138 Cb 0.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.34 1bg0 h PRO 138 CO -0.42 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.37 1bg0 s LEU 140 N -1.24 4.44 0.40 0.00 1.43 -0.77 -4.91 118.68 118.02 1bg0 s LEU 140 Ca 0.27 1.43 0.03 0.00 -1.03 0.00 0.00 54.13 54.83 1bg0 s LEU 140 Cb 0.16 -3.37 -0.01 0.00 0.03 0.00 0.00 46.19 43.00 1bg0 s LEU 140 CO 0.23 0.12 0.58 0.42 0.23 0.00 0.00 176.35 177.94 1bg0 s THR 141 N -1.35 4.09 0.38 5.49 -4.23 -1.26 -4.97 115.64 113.79 1bg0 s THR 141 Ca 0.38 -0.70 0.06 0.00 -1.18 0.00 0.00 61.69 60.25 1bg0 s THR 141 Cb -0.19 -3.47 0.28 0.00 1.34 0.00 0.00 72.50 70.46 1bg0 s THR 141 CO 0.22 -0.27 2.00 0.00 -0.54 0.00 0.00 174.62 176.03 1bg0 h ALA 142 N 0.61 1.68 -0.47 3.99 0.00 -1.98 -1.57 119.26 121.52 1bg0 h ALA 142 Ca -0.46 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.30 1bg0 h ALA 142 Cb 1.25 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1bg0 h ALA 142 CO 0.56 0.26 -0.17 1.49 0.00 0.00 0.00 179.25 181.38 1bg0 h GLU 143 N 0.71 0.92 -0.56 0.00 4.57 -1.99 -2.84 114.58 115.40 1bg0 h GLU 143 Ca 0.24 -0.36 -0.08 0.00 -1.18 0.00 0.00 59.36 57.98 1bg0 h GLU 143 Cb 0.08 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 1bg0 h GLU 143 CO -0.07 1.02 0.04 1.96 -1.18 0.00 0.00 179.01 180.78 1bg0 h GLN 144 N 0.81 0.92 -0.76 1.92 4.20 -1.69 -0.60 115.11 119.91 1bg0 h GLN 144 Ca 0.12 -0.25 0.01 0.00 0.06 0.00 0.00 58.65 58.59 1bg0 h GLN 144 Cb 0.72 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 1bg0 h GLN 144 CO 0.06 0.89 0.50 1.88 -0.67 0.00 0.00 178.83 181.48 1bg0 h TYR 145 N 0.86 0.94 -0.39 2.96 0.05 -1.25 0.30 116.97 120.44 1bg0 h TYR 145 Ca 0.17 0.02 -0.09 0.00 0.05 0.00 0.00 58.73 58.88 1bg0 h TYR 145 Cb 0.45 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 1bg0 h TYR 145 CO 0.03 0.57 -0.10 0.87 -1.05 0.00 0.00 178.16 178.48 1bg0 h LYS 146 N 1.00 0.75 -0.21 4.88 1.57 -1.23 -0.97 116.57 122.36 1bg0 h LYS 146 Ca 0.28 -0.29 0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1bg0 h LYS 146 Cb -0.08 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 1bg0 h LYS 146 CO -0.07 0.90 0.04 0.93 -0.57 0.00 0.00 179.45 180.68 1bg0 h GLU 147 N 0.56 0.12 -0.59 3.15 5.08 -0.61 -1.24 114.58 121.05 1bg0 h GLU 147 Ca 0.10 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1bg0 h GLU 147 Cb 0.63 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.82 1bg0 h GLU 147 CO 0.04 0.08 0.31 0.52 -1.00 0.00 0.00 179.01 178.96 1bg0 h MET 148 N 0.13 0.83 -0.73 2.33 2.86 -0.87 -1.56 114.93 117.92 1bg0 h MET 148 Ca 0.09 -0.11 0.02 0.00 -2.06 0.00 0.00 59.70 57.65 1bg0 h MET 148 Cb 0.09 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 31.55 1bg0 h MET 148 CO -0.12 0.65 0.47 1.49 1.06 0.00 0.00 176.91 180.46 1bg0 h GLU 149 N 0.80 0.91 -0.20 1.72 4.81 -0.78 -0.79 114.58 121.06 1bg0 h GLU 149 Ca 0.21 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.35 1bg0 h GLU 149 Cb 0.07 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 1bg0 h GLU 149 CO -0.03 0.60 0.00 1.49 -0.73 0.00 0.00 179.01 180.34 1bg0 h GLU 150 N 0.94 0.35 -0.13 1.92 4.22 -0.92 -0.71 114.58 120.26 1bg0 h GLU 150 Ca 0.28 -0.11 0.01 0.00 0.08 0.00 0.00 59.36 59.62 1bg0 h GLU 150 Cb -0.04 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1bg0 h GLU 150 CO -0.09 0.55 0.06 0.87 -2.18 0.00 0.00 179.01 178.22 1bg0 h LYS 151 N 0.11 0.12 0.17 1.92 1.57 -1.02 -0.81 116.57 118.62 1bg0 h LYS 151 Ca 0.06 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1bg0 h LYS 151 Cb 0.39 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1bg0 h LYS 151 CO 0.01 0.08 -0.08 0.28 -0.57 0.00 0.00 179.45 179.17 1bg0 h VAL 152 N 0.13 0.94 -0.85 0.50 2.07 -1.14 -1.84 116.25 116.06 1bg0 h VAL 152 Ca 0.05 -0.55 0.06 0.00 0.82 0.00 0.00 66.70 67.08 1bg0 h VAL 152 Cb 0.01 1.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.00 1bg0 h VAL 152 CO -0.04 0.13 0.52 0.77 0.02 0.00 0.00 177.57 178.97 1bg0 h SER 153 N -0.49 0.81 -0.27 0.57 4.64 -1.11 -0.01 113.55 117.69 1bg0 h SER 153 Ca -0.02 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1bg0 h SER 153 Cb 0.38 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1bg0 h SER 153 CO 0.04 0.52 0.14 0.28 -0.87 0.00 0.00 176.83 176.93 1bg0 h SER 154 N 0.95 0.35 -0.56 4.97 0.02 -1.11 -2.22 113.55 115.93 1bg0 h SER 154 Ca 0.37 -0.11 0.02 0.00 -0.84 0.00 0.00 61.79 61.24 1bg0 h SER 154 Cb 0.18 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.60 1bg0 h SER 154 CO -0.18 0.35 0.35 0.74 -1.14 0.00 0.00 176.83 176.95 1bg0 h THR 155 N 0.31 1.09 0.00 -2.27 2.02 -0.66 -2.02 112.91 111.39 1bg0 h THR 155 Ca 0.09 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 67.03 1bg0 h THR 155 Cb 0.09 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 66.83 1bg0 h THR 155 CO -0.01 0.13 0.00 -0.07 0.37 0.00 0.00 175.52 175.93 1bg0 h LEU 156 N 0.70 0.00 -0.57 2.58 3.38 -0.79 -1.86 115.31 118.74 1bg0 h LEU 156 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1bg0 h LEU 156 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1bg0 h LEU 156 CO -0.08 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.91 1bg0 n SER 157 N -2.39 0.75 -0.16 -0.43 3.41 -0.76 -2.15 113.62 111.89 1bg0 n SER 157 Ca 0.01 0.65 0.13 0.00 -0.26 0.00 0.00 58.87 59.41 1bg0 n SER 157 Cb 0.21 -0.82 0.42 0.00 -0.26 0.00 0.00 64.21 63.75 1bg0 n SER 157 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1bg0 n SER 158 N -2.29 0.75 -4.75 4.04 3.41 -0.70 -4.90 113.62 109.17 1bg0 n SER 158 Ca 0.03 -0.63 -0.41 0.00 -0.26 0.00 0.00 58.87 57.59 1bg0 n SER 158 Cb 0.28 0.08 -0.02 0.00 -0.26 0.00 0.00 64.21 64.30 1bg0 n SER 158 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1bg0 s MET 159 N -2.62 4.20 0.42 4.33 1.00 -0.91 -5.00 119.30 120.71 1bg0 s MET 159 Ca 0.22 2.44 0.07 0.00 0.00 0.00 0.00 55.69 58.42 1bg0 s MET 159 Cb 0.19 -3.05 -0.07 0.00 0.00 0.00 0.00 34.83 31.90 1bg0 s MET 159 CO 0.55 -0.50 0.03 -1.21 0.00 0.00 0.00 175.02 173.89 1bg0 s GLU 160 N -0.79 2.01 6.35 2.03 2.02 -1.26 -3.96 118.70 125.10 1bg0 s GLU 160 Ca 0.59 -2.10 0.00 0.00 0.02 0.00 0.00 54.97 53.48 1bg0 s GLU 160 Cb -0.45 -1.67 0.00 0.00 0.10 0.00 0.00 34.13 32.11 1bg0 s GLU 160 CO 0.49 -0.09 0.00 -0.25 0.02 0.00 0.00 175.26 175.43 1bg0 n ASP 161 N -1.03 0.00 0.22 -0.19 8.00 -1.26 -1.92 116.55 120.37 1bg0 n ASP 161 Ca -0.06 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.51 1bg0 n ASP 161 Cb 0.67 0.00 0.56 0.00 -0.02 0.00 0.00 41.12 42.32 1bg0 n ASP 161 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1bg0 h GLU 162 N 0.00 0.05 -0.00 -1.24 4.81 -2.05 -2.14 114.58 114.00 1bg0 h GLU 162 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1bg0 h GLU 162 Cb 0.00 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1bg0 h GLU 162 CO 0.00 0.12 -0.13 1.28 -0.73 0.00 0.00 179.01 179.55 1bg0 n LEU 163 N -4.44 0.26 -4.74 1.64 4.77 -0.81 -4.85 117.00 108.84 1bg0 n LEU 163 Ca -0.02 0.19 -0.42 0.00 -0.03 0.00 0.00 56.01 55.74 1bg0 n LEU 163 Cb 0.16 -0.30 -0.02 0.00 -2.33 0.00 0.00 43.42 40.93 1bg0 n LEU 163 CO 0.35 0.05 1.30 -0.75 -1.33 0.00 0.00 177.39 177.01 1bg0 s LYS 164 N -2.74 4.11 0.00 3.23 2.20 -0.81 -4.61 119.74 121.13 1bg0 s LYS 164 Ca 0.21 2.60 0.00 0.00 -0.36 0.00 0.00 55.97 58.43 1bg0 s LYS 164 Cb 0.19 -3.04 0.00 0.00 -1.51 0.00 0.00 37.83 33.48 1bg0 s LYS 164 CO 0.53 -0.68 0.00 0.41 -0.36 0.00 0.00 175.35 175.24 1bg0 n GLY 165 N 2.77 2.58 3.11 5.54 0.00 -1.26 -4.30 105.19 113.62 1bg0 n GLY 165 Ca 0.11 -0.84 -0.19 0.00 0.00 0.00 0.00 46.02 45.10 1bg0 n GLY 165 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bg0 s THR 166 N -2.95 0.96 -0.15 2.61 2.01 -1.05 -4.90 115.64 112.15 1bg0 s THR 166 Ca 0.00 -0.85 -0.16 0.00 0.31 0.00 0.00 61.69 60.99 1bg0 s THR 166 Cb 0.00 -0.87 -0.04 0.00 0.01 0.00 0.00 72.50 71.60 1bg0 s THR 166 CO 0.00 0.02 0.39 -0.47 -0.69 0.00 0.00 174.62 173.87 1bg0 s TYR 167 N -0.74 3.46 -0.34 4.92 5.04 -1.26 -2.13 117.35 126.30 1bg0 s TYR 167 Ca 0.01 0.71 0.00 0.00 -2.44 0.00 0.00 57.07 55.36 1bg0 s TYR 167 Cb -0.07 -2.47 0.08 0.00 0.35 0.00 0.00 41.96 39.85 1bg0 s TYR 167 CO 0.01 0.15 0.05 0.71 -1.34 0.00 0.00 175.55 175.13 1bg0 s TYR 168 N 0.74 3.51 0.45 4.97 2.02 1.00 -4.97 117.35 125.07 1bg0 s TYR 168 Ca 0.21 -2.44 -0.25 0.00 -0.37 0.00 0.00 57.07 54.22 1bg0 s TYR 168 Cb -0.14 -2.64 -0.08 0.00 -0.40 0.00 0.00 41.96 38.70 1bg0 s TYR 168 CO 0.07 -0.91 1.37 -2.14 -1.57 0.00 0.00 175.55 172.38 1bg0 s PRO 169 N 1.09 3.71 0.17 -1.71 0.02 -1.26 -1.11 135.00 135.90 1bg0 s PRO 169 Ca 0.03 2.30 -0.05 0.00 0.02 0.00 0.00 61.00 63.30 1bg0 s PRO 169 Cb -0.20 -2.63 0.03 0.00 0.02 0.00 0.00 34.50 31.72 1bg0 s PRO 169 CO -0.05 -0.75 1.44 1.25 -0.33 0.00 0.00 177.00 178.56 1bg0 h LEU 170 N 2.32 0.65 -9.15 -5.54 5.85 -1.11 -3.32 115.31 105.01 1bg0 h LEU 170 Ca -0.50 -0.39 -0.56 0.00 0.84 0.00 0.00 57.88 57.27 1bg0 h LEU 170 Cb 1.26 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.09 1bg0 h LEU 170 CO 0.61 1.13 1.12 -0.89 -0.34 0.00 0.00 178.44 180.07 1bg0 s THR 171 N -3.82 3.61 0.00 1.05 2.01 -1.26 -1.35 115.64 115.89 1bg0 s THR 171 Ca -0.07 0.71 0.00 0.00 0.31 0.00 0.00 61.69 62.64 1bg0 s THR 171 Cb 0.10 -3.55 0.00 0.00 0.01 0.00 0.00 72.50 69.07 1bg0 s THR 171 CO 0.85 -0.16 0.00 0.61 -0.69 0.00 0.00 174.62 175.24 1bg0 n GLY 172 N 4.43 1.65 3.72 4.40 0.00 -1.26 -5.04 105.19 113.08 1bg0 n GLY 172 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1bg0 n GLY 172 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1bg0 s MET 173 N -0.96 4.33 0.70 1.61 0.00 -0.45 -4.97 119.30 119.56 1bg0 s MET 173 Ca 0.00 2.08 -0.16 0.00 0.00 0.00 0.00 55.69 57.61 1bg0 s MET 173 Cb 0.00 -3.24 0.02 0.00 0.00 0.00 0.00 34.83 31.61 1bg0 s MET 173 CO 0.00 -0.42 1.25 -1.54 0.00 0.00 0.00 175.02 174.31 1bg0 s SER 174 N 1.01 4.29 0.25 1.11 1.04 -1.26 -4.83 113.70 115.32 1bg0 s SER 174 Ca 0.64 2.49 -0.05 0.00 0.48 0.00 0.00 55.95 59.51 1bg0 s SER 174 Cb -0.37 -2.60 0.28 0.00 0.10 0.00 0.00 66.02 63.43 1bg0 s SER 174 CO 0.31 -2.20 1.85 0.11 0.98 0.00 0.00 173.24 174.29 1bg0 h LYS 175 N 0.02 1.12 -0.19 4.02 1.79 -1.98 -1.94 116.57 119.41 1bg0 h LYS 175 Ca -0.49 -0.16 -0.00 0.00 -2.18 0.00 0.00 60.65 57.82 1bg0 h LYS 175 Cb 1.32 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 31.75 1bg0 h LYS 175 CO 0.51 0.86 0.10 0.00 -1.08 0.00 0.00 179.45 179.84 1bg0 h ALA 176 N 1.30 0.24 -0.39 3.86 0.00 -1.99 -1.24 119.26 121.04 1bg0 h ALA 176 Ca 0.27 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1bg0 h ALA 176 Cb 0.11 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1bg0 h ALA 176 CO -0.03 -0.23 0.15 1.15 0.00 0.00 0.00 179.25 180.28 1bg0 h THR 177 N 0.20 1.20 -0.33 0.00 2.02 -1.89 -1.04 112.91 113.07 1bg0 h THR 177 Ca 0.07 -0.61 0.02 0.00 0.77 0.00 0.00 66.41 66.65 1bg0 h THR 177 Cb 0.06 0.87 -0.03 0.00 -1.74 0.00 0.00 68.15 67.31 1bg0 h THR 177 CO -0.01 0.22 0.17 -0.61 0.37 0.00 0.00 175.52 175.66 1bg0 h GLN 178 N 0.49 0.35 -0.34 6.66 4.15 -1.22 -0.41 115.11 124.79 1bg0 h GLN 178 Ca 0.13 -0.02 -0.07 0.00 0.77 0.00 0.00 58.65 59.46 1bg0 h GLN 178 Cb 0.20 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.79 1bg0 h GLN 178 CO -0.01 0.23 -0.08 0.37 -1.93 0.00 0.00 178.83 177.41 1bg0 h GLN 179 N 0.36 0.57 -0.41 1.69 5.75 -1.10 -1.71 115.11 120.26 1bg0 h GLN 179 Ca 0.14 -0.15 -0.13 0.00 -0.15 0.00 0.00 58.65 58.35 1bg0 h GLN 179 Cb 0.03 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.51 1bg0 h GLN 179 CO -0.08 0.65 -0.26 0.37 -2.65 0.00 0.00 178.83 176.85 1bg0 h GLN 180 N 0.53 0.90 0.00 1.69 4.15 -0.70 0.30 115.11 121.99 1bg0 h GLN 180 Ca 0.10 -0.42 -0.05 0.00 0.77 0.00 0.00 58.65 59.05 1bg0 h GLN 180 Cb 0.46 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.13 1bg0 h GLN 180 CO 0.02 1.08 -0.25 -0.07 -1.93 0.00 0.00 178.83 177.68 1bg0 h LEU 181 N 0.72 0.00 0.08 -2.39 3.38 -0.76 0.43 115.31 116.78 1bg0 h LEU 181 Ca 0.08 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.93 1bg0 h LEU 181 Cb 0.84 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.61 1bg0 h LEU 181 CO 0.07 0.25 -0.54 0.40 0.09 0.00 0.00 178.44 178.71 1bg0 h ILE 182 N 0.00 1.58 -0.83 1.22 2.04 -1.08 0.88 117.51 121.31 1bg0 h ILE 182 Ca -0.00 -2.39 0.04 0.00 1.00 0.00 0.00 64.86 63.51 1bg0 h ILE 182 Cb 0.45 3.15 -0.05 0.00 -0.74 0.00 0.00 36.82 39.63 1bg0 h ILE 182 CO 0.03 0.66 0.55 0.44 0.00 0.00 0.00 178.15 179.83 1bg0 h ASP 183 N -0.51 0.87 0.00 1.72 3.32 -0.68 0.69 116.42 121.83 1bg0 h ASP 183 Ca -0.09 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.95 1bg0 h ASP 183 Cb 1.39 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1bg0 h ASP 183 CO 0.10 0.59 0.00 0.47 -1.72 0.00 0.00 179.24 178.68 1bg0 n ASP 184 N -4.46 0.00 -0.85 6.45 8.00 0.12 -4.88 116.55 120.93 1bg0 n ASP 184 Ca 0.11 -1.28 -0.11 0.00 0.71 0.00 0.00 54.79 54.22 1bg0 n ASP 184 Cb 0.14 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.19 1bg0 n ASP 184 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1bg0 n HIS 185 N -0.79 0.00 -0.11 1.24 8.25 0.23 -4.92 115.22 119.13 1bg0 n HIS 185 Ca 0.13 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.34 1bg0 n HIS 185 Cb 0.06 -2.11 -0.11 0.00 1.12 0.00 0.00 29.99 28.95 1bg0 n HIS 185 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1bg0 n PHE 186 N -2.66 0.60 -3.66 4.41 3.72 0.14 -4.98 117.46 115.03 1bg0 n PHE 186 Ca -0.11 0.23 -0.32 0.00 -0.05 0.00 0.00 57.45 57.19 1bg0 n PHE 186 Cb 0.37 -1.06 -0.05 0.00 -0.94 0.00 0.00 39.48 37.80 1bg0 n PHE 186 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1bg0 s LEU 187 N -7.54 4.29 0.62 4.37 2.96 -0.27 -4.99 118.68 118.11 1bg0 s LEU 187 Ca -0.32 0.63 -0.18 0.00 -0.22 0.00 0.00 54.13 54.04 1bg0 s LEU 187 Cb 0.09 -3.20 -0.02 0.00 0.50 0.00 0.00 46.19 43.56 1bg0 s LEU 187 CO 0.58 0.09 1.19 0.72 -1.32 0.00 0.00 176.35 177.61 1bg0 s PHE 188 N -1.58 2.38 0.70 5.38 -0.12 -1.26 -4.44 117.98 119.04 1bg0 s PHE 188 Ca 0.38 1.53 -0.11 0.00 -0.05 0.00 0.00 56.93 58.69 1bg0 s PHE 188 Cb -0.13 -3.43 0.01 0.00 -0.63 0.00 0.00 43.02 38.84 1bg0 s PHE 188 CO 0.23 -2.17 1.07 -1.59 -0.05 0.00 0.00 175.22 172.71 1bg0 s LYS 189 N -3.49 2.89 -0.07 1.99 -2.85 -1.26 -4.91 119.74 112.03 1bg0 s LYS 189 Ca 0.76 0.66 -0.01 0.00 -1.00 0.00 0.00 55.97 56.38 1bg0 s LYS 189 Cb -0.29 -2.01 -0.03 0.00 -2.06 0.00 0.00 37.83 33.44 1bg0 s LYS 189 CO 0.35 -1.06 -0.02 -2.00 0.10 0.00 0.00 175.35 172.72 1bg0 s GLU 190 N -5.21 2.90 -0.17 1.78 2.12 -1.26 -4.74 118.70 114.11 1bg0 s GLU 190 Ca 0.58 -0.47 -0.00 0.00 0.36 0.00 0.00 54.97 55.44 1bg0 s GLU 190 Cb -0.12 -2.72 0.00 0.00 0.26 0.00 0.00 34.13 31.54 1bg0 s GLU 190 CO 0.53 0.69 0.14 0.41 -0.54 0.00 0.00 175.26 176.49 1bg0 n GLY 191 N 2.09 0.33 3.65 -1.50 0.00 -1.26 -5.01 105.19 103.49 1bg0 n GLY 191 Ca -0.18 -0.40 -0.43 0.00 0.00 0.00 0.00 46.02 45.01 1bg0 n GLY 191 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bg0 s ASP 192 N -3.19 7.06 0.44 1.61 -1.08 -1.26 -4.93 116.67 115.31 1bg0 s ASP 192 Ca 0.00 1.30 0.10 0.00 -0.52 0.00 0.00 52.55 53.43 1bg0 s ASP 192 Cb -0.00 -2.54 0.97 0.00 -1.46 0.00 0.00 42.92 39.89 1bg0 s ASP 192 CO 0.10 -0.71 2.06 0.08 0.52 0.00 0.00 175.17 177.23 1bg0 h ARG 193 N 7.60 0.34 -0.14 4.34 0.11 -1.99 0.17 114.38 124.81 1bg0 h ARG 193 Ca -0.19 -0.03 -0.18 0.00 0.10 0.00 0.00 59.98 59.67 1bg0 h ARG 193 Cb 1.06 -0.07 -0.00 0.00 1.11 0.00 0.00 29.97 32.07 1bg0 h ARG 193 CO 0.99 0.26 -0.67 0.74 0.10 0.00 0.00 179.97 181.39 1bg0 h PHE 194 N 0.34 0.72 0.00 4.08 -1.00 -1.94 -2.83 116.94 116.33 1bg0 h PHE 194 Ca 0.09 -0.29 -0.26 0.00 2.81 0.00 0.00 57.97 60.31 1bg0 h PHE 194 Cb 0.02 -0.12 0.02 0.00 3.61 0.00 0.00 35.95 39.48 1bg0 h PHE 194 CO 0.00 1.06 -1.04 -0.07 -1.61 0.00 0.00 178.31 176.65 1bg0 h LEU 195 N 0.39 0.88 -0.02 1.54 3.38 -1.87 -3.21 115.31 116.40 1bg0 h LEU 195 Ca -0.02 -0.71 0.02 0.00 0.09 0.00 0.00 57.88 57.26 1bg0 h LEU 195 Cb 1.24 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 1bg0 h LEU 195 CO 0.12 1.51 -0.10 1.56 0.09 0.00 0.00 178.44 181.63 1bg0 h GLN 196 N 0.38 -0.15 0.00 1.13 4.20 -0.98 -1.73 115.11 117.96 1bg0 h GLN 196 Ca -0.13 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1bg0 h GLN 196 Cb 1.69 0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.51 1bg0 h GLN 196 CO 0.20 -0.10 0.00 1.79 -0.67 0.00 0.00 178.83 180.05 1bg0 h THR 197 N -0.15 0.00 -0.27 -0.54 1.35 -1.60 0.19 112.91 111.89 1bg0 h THR 197 Ca 0.05 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 65.75 1bg0 h THR 197 Cb 0.21 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.68 1bg0 h THR 197 CO -0.12 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.15 1bg0 n ALA 198 N -2.01 2.48 -3.66 6.62 0.00 -0.73 -4.02 120.51 119.21 1bg0 n ALA 198 Ca -0.01 -0.64 -0.24 0.00 0.00 0.00 0.00 53.44 52.55 1bg0 n ALA 198 Cb 0.14 -1.02 0.06 0.00 0.00 0.00 0.00 19.45 18.63 1bg0 n ALA 198 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1bg0 n ASN 199 N 0.58 -4.28 -0.81 0.00 3.02 0.66 -4.60 115.26 109.83 1bg0 n ASN 199 Ca 0.16 -0.66 0.09 0.00 -0.03 0.00 0.00 54.58 54.14 1bg0 n ASN 199 Cb 0.37 -4.63 0.14 0.00 -0.61 0.00 0.00 39.78 35.05 1bg0 n ASN 199 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bg0 n ALA 200 N -4.64 2.39 -0.96 5.41 0.00 -0.74 -3.42 120.51 118.55 1bg0 n ALA 200 Ca -0.09 -0.88 0.09 0.00 0.00 0.00 0.00 53.44 52.56 1bg0 n ALA 200 Cb 0.59 -0.62 0.13 0.00 0.00 0.00 0.00 19.45 19.55 1bg0 n ALA 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bg0 n ARG 202 N -1.33 2.09 -1.09 0.00 1.74 -1.26 -2.66 116.66 114.14 1bg0 n ARG 202 Ca 0.14 0.75 -0.03 0.00 -0.77 0.00 0.00 57.85 57.94 1bg0 n ARG 202 Cb 0.60 -2.61 -0.01 0.00 -1.02 0.00 0.00 32.46 29.42 1bg0 n ARG 202 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1bg0 n TYR 203 N -0.44 0.00 -1.67 -1.55 4.01 -1.26 -4.85 117.16 111.39 1bg0 n TYR 203 Ca 0.07 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.37 1bg0 n TYR 203 Cb 0.42 -1.49 -0.01 0.00 -0.31 0.00 0.00 39.34 37.95 1bg0 n TYR 203 CO 0.00 0.00 0.00 1.87 -0.46 0.00 0.00 176.86 178.27 1bg0 n TRP 204 N -2.45 2.07 -1.08 -0.72 -0.00 -1.09 0.00 117.44 114.18 1bg0 n TRP 204 Ca -0.03 0.55 -0.22 0.00 -0.00 0.00 0.00 57.50 57.80 1bg0 n TRP 204 Cb 0.33 -2.40 0.17 0.00 -0.00 0.00 0.00 31.31 29.42 1bg0 n TRP 204 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 1bg0 n PRO 205 N 1.00 2.23 -1.70 5.87 -0.04 -1.26 -5.11 135.00 135.99 1bg0 n PRO 205 Ca 0.07 -2.82 -0.42 0.00 -0.04 0.00 0.00 63.50 60.30 1bg0 n PRO 205 Cb 0.34 -2.11 -0.03 0.00 -0.04 0.00 0.00 33.50 31.66 1bg0 n PRO 205 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1bg0 s THR 206 N -3.07 2.61 0.00 0.52 2.01 0.10 -1.87 115.64 115.94 1bg0 s THR 206 Ca 0.53 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.56 1bg0 s THR 206 Cb 0.45 -3.02 0.00 0.00 0.01 0.00 0.00 72.50 69.94 1bg0 s THR 206 CO 0.10 -0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.64 1bg0 n GLY 207 N 4.31 0.89 3.91 4.40 0.00 -1.26 -4.76 105.19 112.69 1bg0 n GLY 207 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 1bg0 n GLY 207 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bg0 s ARG 208 N -0.08 3.53 0.00 1.61 3.00 -0.78 -4.41 118.95 121.83 1bg0 s ARG 208 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 55.73 55.45 1bg0 s ARG 208 Cb 0.00 -2.91 0.00 0.00 0.00 0.00 0.00 34.95 32.04 1bg0 s ARG 208 CO 0.00 0.49 0.00 0.41 0.00 0.00 0.00 175.30 176.20 1bg0 n GLY 209 N -0.08 -0.92 2.86 -3.53 0.00 -0.94 -0.56 105.19 102.03 1bg0 n GLY 209 Ca -0.04 -1.09 -0.16 0.00 0.00 0.00 0.00 46.02 44.73 1bg0 n GLY 209 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1bg0 s ILE 210 N -2.00 0.19 -0.09 -0.61 2.07 -0.27 -0.57 121.20 119.92 1bg0 s ILE 210 Ca 0.00 -0.01 -0.01 0.00 -1.41 0.00 0.00 60.65 59.22 1bg0 s ILE 210 Cb 0.00 -0.23 -0.03 0.00 0.13 0.00 0.00 42.46 42.33 1bg0 s ILE 210 CO 0.00 0.11 -0.03 0.12 -1.91 0.00 0.00 174.94 173.22 1bg0 s PHE 211 N 0.52 3.05 -0.15 3.50 2.19 -0.41 -0.00 117.98 126.69 1bg0 s PHE 211 Ca -0.05 0.03 -0.27 0.00 0.33 0.00 0.00 56.93 56.97 1bg0 s PHE 211 Cb -0.08 -1.80 0.07 0.00 -1.31 0.00 0.00 43.02 39.90 1bg0 s PHE 211 CO -0.01 0.31 0.67 -3.38 1.83 0.00 0.00 175.22 174.65 1bg0 s HIS 212 N -0.59 -0.69 0.81 10.12 -3.43 -0.90 -0.26 115.29 120.35 1bg0 s HIS 212 Ca 0.09 1.44 -0.11 0.00 -0.80 0.00 0.00 55.06 55.69 1bg0 s HIS 212 Cb -0.12 0.33 0.08 0.00 -1.43 0.00 0.00 32.58 31.44 1bg0 s HIS 212 CO 0.02 -0.49 1.09 0.54 -2.00 0.00 0.00 174.74 173.90 1bg0 s ASN 213 N -0.46 4.22 0.41 7.38 2.20 -0.82 -2.54 114.94 125.33 1bg0 s ASN 213 Ca -0.06 1.63 0.15 0.00 -0.94 0.00 0.00 52.86 53.64 1bg0 s ASN 213 Cb -0.02 -2.34 1.01 0.00 -2.00 0.00 0.00 41.25 37.90 1bg0 s ASN 213 CO 0.05 -2.18 1.88 0.44 -2.94 0.00 0.00 177.10 174.35 1bg0 h ASP 214 N -1.23 0.46 1.32 3.54 3.32 -1.92 -0.37 116.42 121.53 1bg0 h ASP 214 Ca -0.46 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 56.62 1bg0 h ASP 214 Cb 1.25 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 1bg0 h ASP 214 CO 0.54 0.21 -0.03 0.00 -1.72 0.00 0.00 179.24 178.24 1bg0 h ALA 215 N 1.62 0.99 -3.40 3.45 0.00 -1.94 -3.47 119.26 116.52 1bg0 h ALA 215 Ca 0.43 -0.03 -0.23 0.00 0.00 0.00 0.00 54.91 55.09 1bg0 h ALA 215 Cb 0.96 -0.00 0.06 0.00 0.00 0.00 0.00 17.79 18.81 1bg0 h ALA 215 CO -0.17 0.04 -0.37 1.63 0.00 0.00 0.00 179.25 180.38 1bg0 n LYS 216 N -3.12 -3.92 -0.01 0.00 5.02 -0.15 -4.91 118.16 111.06 1bg0 n LYS 216 Ca 0.02 0.49 0.08 0.00 -2.02 0.00 0.00 58.31 56.88 1bg0 n LYS 216 Cb 0.39 -4.48 -0.13 0.00 -0.02 0.00 0.00 35.03 30.79 1bg0 n LYS 216 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1bg0 n THR 217 N -3.94 0.01 -4.04 -0.18 -2.24 -1.26 -4.78 114.28 97.84 1bg0 n THR 217 Ca -0.02 -0.39 -0.27 0.00 -2.27 0.00 0.00 64.05 61.10 1bg0 n THR 217 Cb 0.55 0.11 -0.17 0.00 -2.10 0.00 0.00 70.33 68.72 1bg0 n THR 217 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1bg0 s PHE 218 N -3.17 1.62 0.05 4.78 5.36 -1.26 -1.20 117.98 124.16 1bg0 s PHE 218 Ca -0.06 -0.80 0.00 0.00 -0.96 0.00 0.00 56.93 55.11 1bg0 s PHE 218 Cb 0.11 -1.28 -0.03 0.00 -0.34 0.00 0.00 43.02 41.48 1bg0 s PHE 218 CO 0.71 -0.51 -0.04 -0.51 -1.46 0.00 0.00 175.22 173.40 1bg0 s LEU 219 N 1.50 2.38 -0.09 6.12 1.02 -0.07 -1.95 118.68 127.60 1bg0 s LEU 219 Ca 0.02 -0.78 -0.02 0.00 0.02 0.00 0.00 54.13 53.37 1bg0 s LEU 219 Cb -0.13 0.07 0.03 0.00 0.02 0.00 0.00 46.19 46.18 1bg0 s LEU 219 CO -0.07 -0.43 0.02 -0.69 0.02 0.00 0.00 176.35 175.21 1bg0 s VAL 220 N -2.74 0.29 -0.00 -1.59 1.01 0.65 0.28 120.40 118.29 1bg0 s VAL 220 Ca -0.02 0.07 -0.27 0.00 0.00 0.00 0.00 61.98 61.77 1bg0 s VAL 220 Cb -0.01 -0.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 1bg0 s VAL 220 CO -0.05 0.16 0.85 0.26 0.00 0.00 0.00 175.10 176.32 1bg0 s TRP 221 N 2.00 3.66 -0.23 5.22 0.51 0.15 -1.28 118.94 128.97 1bg0 s TRP 221 Ca 0.04 1.53 -0.05 0.00 -2.12 0.00 0.00 56.10 55.50 1bg0 s TRP 221 Cb -0.13 -2.96 -0.01 0.00 -0.81 0.00 0.00 33.47 29.56 1bg0 s TRP 221 CO -0.05 0.09 -0.01 0.08 -0.51 0.00 0.00 176.95 176.54 1bg0 s VAL 222 N 0.67 3.59 -1.17 4.03 1.01 0.26 -2.33 120.40 126.46 1bg0 s VAL 222 Ca 0.45 -0.46 -0.05 0.00 0.00 0.00 0.00 61.98 61.92 1bg0 s VAL 222 Cb -0.20 -2.67 0.01 0.00 0.00 0.00 0.00 36.38 33.52 1bg0 s VAL 222 CO 0.24 0.37 0.61 0.59 0.00 0.00 0.00 175.10 176.92 1bg0 n ASN 223 N 4.82 -5.22 0.00 3.32 3.02 -0.36 -2.21 115.26 118.62 1bg0 n ASN 223 Ca -0.17 -0.28 0.00 0.00 -0.03 0.00 0.00 54.58 54.09 1bg0 n ASN 223 Cb 0.51 -4.00 0.00 0.00 -0.61 0.00 0.00 39.78 35.68 1bg0 n ASN 223 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1bg0 n GLU 224 N -3.52 0.00 -0.24 3.52 2.13 -1.26 -4.78 120.64 116.49 1bg0 n GLU 224 Ca -0.06 0.00 -0.08 0.00 0.66 0.00 0.00 57.16 57.68 1bg0 n GLU 224 Cb 0.58 0.00 0.04 0.00 0.27 0.00 0.00 31.44 32.33 1bg0 n GLU 224 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1bg0 h GLU 225 N 0.00 1.05 -6.12 5.31 4.81 -1.95 -3.44 114.58 114.24 1bg0 h GLU 225 Ca 0.00 -0.24 -0.61 0.00 -0.13 0.00 0.00 59.36 58.38 1bg0 h GLU 225 Cb 0.00 -0.14 -0.14 0.00 0.63 0.00 0.00 28.75 29.10 1bg0 h GLU 225 CO 0.00 0.93 -0.74 -0.51 -0.73 0.00 0.00 179.01 177.96 1bg0 s ASP 226 N -6.35 3.61 0.24 1.04 1.01 -1.26 -4.63 116.67 110.33 1bg0 s ASP 226 Ca -0.12 -1.08 -0.05 0.00 0.71 0.00 0.00 52.55 52.01 1bg0 s ASP 226 Cb 0.14 -0.31 0.43 0.00 1.01 0.00 0.00 42.92 44.19 1bg0 s ASP 226 CO 0.83 -0.04 1.74 0.45 0.21 0.00 0.00 175.17 178.37 1bg0 h HIS 227 N 2.20 0.55 -3.83 4.23 3.86 -1.85 -3.29 115.15 117.02 1bg0 h HIS 227 Ca -0.41 0.03 -0.19 0.00 -1.16 0.00 0.00 60.37 58.65 1bg0 h HIS 227 Cb 1.26 -0.13 -0.24 0.00 1.06 0.00 0.00 27.41 29.36 1bg0 h HIS 227 CO 0.80 0.10 -0.69 -0.51 0.86 0.00 0.00 177.93 178.49 1bg0 s LEU 228 N -10.42 2.07 -0.19 2.43 1.02 -0.89 -1.23 118.68 111.47 1bg0 s LEU 228 Ca -0.12 -0.26 -0.02 0.00 0.02 0.00 0.00 54.13 53.74 1bg0 s LEU 228 Cb 0.20 0.12 0.06 0.00 0.02 0.00 0.00 46.19 46.58 1bg0 s LEU 228 CO 0.76 -0.18 0.02 -0.13 0.02 0.00 0.00 176.35 176.84 1bg0 s ARG 229 N -0.84 0.80 -0.27 1.70 1.81 -0.99 -1.79 118.95 119.38 1bg0 s ARG 229 Ca -0.09 -0.47 -0.16 0.00 -1.72 0.00 0.00 55.73 53.29 1bg0 s ARG 229 Cb -0.06 -2.11 -0.03 0.00 -0.45 0.00 0.00 34.95 32.30 1bg0 s ARG 229 CO -0.00 -0.61 0.44 0.42 -0.68 0.00 0.00 175.30 174.86 1bg0 s ILE 230 N 1.80 5.13 0.04 1.52 1.01 0.02 -0.67 121.20 130.04 1bg0 s ILE 230 Ca -0.01 0.71 0.09 0.00 0.00 0.00 0.00 60.65 61.43 1bg0 s ILE 230 Cb -0.17 -3.76 -0.03 0.00 0.01 0.00 0.00 42.46 38.51 1bg0 s ILE 230 CO -0.08 0.12 -0.25 -0.63 0.00 0.00 0.00 174.94 174.10 1bg0 s ILE 231 N 2.18 2.02 -0.06 2.92 1.01 0.14 -1.23 121.20 128.19 1bg0 s ILE 231 Ca 0.18 -1.31 0.00 0.00 0.00 0.00 0.00 60.65 59.52 1bg0 s ILE 231 Cb -0.16 -1.72 0.02 0.00 0.01 0.00 0.00 42.46 40.61 1bg0 s ILE 231 CO 0.10 0.36 -0.03 -0.55 0.00 0.00 0.00 174.94 174.82 1bg0 s SER 232 N -1.13 1.19 0.18 3.58 0.15 -0.70 -0.89 113.70 116.08 1bg0 s SER 232 Ca 0.11 -0.12 -0.22 0.00 0.70 0.00 0.00 55.95 56.42 1bg0 s SER 232 Cb -0.10 -0.46 0.06 0.00 -1.71 0.00 0.00 66.02 63.81 1bg0 s SER 232 CO 0.02 -0.10 0.59 0.00 1.20 0.00 0.00 173.24 174.94 1bg0 s MET 233 N 1.28 1.34 -0.17 5.44 0.23 -0.34 -1.01 119.30 126.06 1bg0 s MET 233 Ca -0.05 -0.60 -0.35 0.00 -1.03 0.00 0.00 55.69 53.66 1bg0 s MET 233 Cb -0.14 0.57 0.14 0.00 -1.53 0.00 0.00 34.83 33.87 1bg0 s MET 233 CO -0.02 -0.58 1.21 1.14 -2.03 0.00 0.00 175.02 174.73 1bg0 s GLN 234 N -3.79 0.33 0.77 3.16 -2.07 -0.86 -4.33 119.66 112.86 1bg0 s GLN 234 Ca 0.03 -0.13 -0.13 0.00 -1.82 0.00 0.00 55.36 53.32 1bg0 s GLN 234 Cb -0.01 0.15 0.06 0.00 -1.09 0.00 0.00 33.01 32.11 1bg0 s GLN 234 CO -0.09 -0.14 1.14 0.15 -1.32 0.00 0.00 175.29 175.02 1bg0 s LYS 235 N -2.44 2.07 0.43 9.60 -0.14 -1.26 -1.44 119.74 126.56 1bg0 s LYS 235 Ca 0.10 1.48 0.00 0.00 -1.36 0.00 0.00 55.97 56.18 1bg0 s LYS 235 Cb -0.01 -1.85 0.00 0.00 -1.68 0.00 0.00 37.83 34.29 1bg0 s LYS 235 CO -0.05 -1.83 0.00 0.41 -0.76 0.00 0.00 175.35 173.12 1bg0 n GLY 236 N -0.26 -2.32 1.38 -3.33 0.00 0.36 -4.69 105.19 96.33 1bg0 n GLY 236 Ca 0.11 -1.68 -0.09 0.00 0.00 0.00 0.00 46.02 44.36 1bg0 n GLY 236 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bg0 n GLY 237 N -0.22 5.60 3.56 -0.02 0.00 -1.26 -2.01 105.19 110.83 1bg0 n GLY 237 Ca 0.00 -1.97 -0.43 0.00 0.00 0.00 0.00 46.02 43.62 1bg0 n GLY 237 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1bg0 n ASP 238 N -0.87 4.97 -0.18 1.61 -0.08 -1.26 -0.22 116.55 120.52 1bg0 n ASP 238 Ca 0.31 -2.93 -0.00 0.00 -1.51 0.00 0.00 54.79 50.66 1bg0 n ASP 238 Cb 0.84 -1.72 0.24 0.00 2.34 0.00 0.00 41.12 42.82 1bg0 n ASP 238 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1bg0 h LEU 239 N 12.16 0.82 -0.23 -2.67 5.85 -1.92 -2.39 115.31 126.92 1bg0 h LEU 239 Ca 0.43 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 59.12 1bg0 h LEU 239 Cb 0.87 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 1bg0 h LEU 239 CO 1.44 0.64 0.11 0.50 -0.34 0.00 0.00 178.44 180.78 1bg0 h LYS 240 N 0.94 0.23 -0.32 1.25 3.64 -1.83 0.18 116.57 120.66 1bg0 h LYS 240 Ca 0.24 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.54 1bg0 h LYS 240 Cb -0.02 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1bg0 h LYS 240 CO -0.04 0.15 -0.08 1.15 -2.27 0.00 0.00 179.45 178.35 1bg0 h THR 241 N 0.23 1.28 -0.14 1.00 2.02 -1.92 -0.74 112.91 114.65 1bg0 h THR 241 Ca 0.10 -1.13 0.00 0.00 0.77 0.00 0.00 66.41 66.14 1bg0 h THR 241 Cb 0.03 1.37 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 1bg0 h THR 241 CO -0.07 0.37 0.09 0.58 0.37 0.00 0.00 175.52 176.85 1bg0 h VAL 242 N 0.39 1.05 -0.23 3.16 2.07 -1.24 -1.69 116.25 119.75 1bg0 h VAL 242 Ca 0.08 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 1bg0 h VAL 242 Cb 0.58 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1bg0 h VAL 242 CO 0.03 0.05 0.07 0.22 0.02 0.00 0.00 177.57 177.96 1bg0 h TYR 243 N 0.18 0.37 -0.78 1.57 3.20 -0.64 -2.14 116.97 118.73 1bg0 h TYR 243 Ca 0.05 -0.04 0.07 0.00 3.14 0.00 0.00 58.73 61.96 1bg0 h TYR 243 Cb -0.00 -0.11 -0.06 0.00 1.54 0.00 0.00 36.73 38.10 1bg0 h TYR 243 CO -0.06 0.42 0.45 -0.22 -1.64 0.00 0.00 178.16 177.11 1bg0 h LYS 244 N 0.20 0.78 -0.57 1.82 1.63 -1.04 0.51 116.57 119.90 1bg0 h LYS 244 Ca 0.07 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.81 1bg0 h LYS 244 Cb 0.23 -0.18 -0.03 0.00 -0.60 0.00 0.00 32.23 31.66 1bg0 h LYS 244 CO -0.00 0.52 0.28 -0.09 -3.45 0.00 0.00 179.45 176.70 1bg0 h ARG 245 N 0.81 0.82 0.19 1.90 2.43 -1.14 -1.12 114.38 118.27 1bg0 h ARG 245 Ca 0.35 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.39 1bg0 h ARG 245 Cb 0.24 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1bg0 h ARG 245 CO -0.20 0.67 -0.09 1.25 -1.51 0.00 0.00 179.97 180.09 1bg0 h LEU 246 N 0.77 -0.21 -0.50 3.80 5.85 -0.61 -1.47 115.31 122.95 1bg0 h LEU 246 Ca 0.20 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.99 1bg0 h LEU 246 Cb 0.11 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.12 1bg0 h LEU 246 CO -0.03 -0.12 0.05 0.58 -0.34 0.00 0.00 178.44 178.58 1bg0 h VAL 247 N -0.29 0.66 -0.16 1.05 2.07 -0.74 0.39 116.25 119.22 1bg0 h VAL 247 Ca -0.03 -0.06 0.03 0.00 0.82 0.00 0.00 66.70 67.47 1bg0 h VAL 247 Cb 0.22 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1bg0 h VAL 247 CO 0.04 0.03 -0.03 0.74 0.02 0.00 0.00 177.57 178.38 1bg0 h THR 248 N 0.17 0.85 -0.18 2.57 2.02 -0.97 -0.97 112.91 116.40 1bg0 h THR 248 Ca 0.25 -0.01 -0.00 0.00 0.77 0.00 0.00 66.41 67.42 1bg0 h THR 248 Cb 0.36 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 1bg0 h THR 248 CO -0.37 0.00 0.10 0.00 0.37 0.00 0.00 175.52 175.62 1bg0 h ALA 249 N 1.16 0.23 -0.21 6.16 0.00 -0.54 -2.10 119.26 123.96 1bg0 h ALA 249 Ca 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1bg0 h ALA 249 Cb 0.11 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1bg0 h ALA 249 CO -0.16 -0.24 0.11 0.28 0.00 0.00 0.00 179.25 179.24 1bg0 h VAL 250 N 0.19 1.13 -0.62 0.00 2.07 -0.83 -0.53 116.25 117.66 1bg0 h VAL 250 Ca 0.06 -0.37 0.07 0.00 0.82 0.00 0.00 66.70 67.29 1bg0 h VAL 250 Cb 0.06 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 30.76 1bg0 h VAL 250 CO -0.01 0.13 0.31 0.44 0.02 0.00 0.00 177.57 178.45 1bg0 h ASP 251 N 0.22 0.41 -0.19 0.57 3.32 -1.12 -0.28 116.42 119.36 1bg0 h ASP 251 Ca 0.07 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.11 1bg0 h ASP 251 Cb 0.11 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 1bg0 h ASP 251 CO -0.01 0.26 -0.10 -1.13 -1.72 0.00 0.00 179.24 176.54 1bg0 h ASN 252 N 0.56 0.41 -0.37 6.45 -1.24 -1.21 -2.95 115.58 117.23 1bg0 h ASN 252 Ca 0.29 -0.42 -0.05 0.00 0.71 0.00 0.00 56.30 56.83 1bg0 h ASN 252 Cb 0.25 -0.11 -0.02 0.00 0.73 0.00 0.00 38.32 39.17 1bg0 h ASN 252 CO -0.22 0.75 0.08 0.40 -1.29 0.00 0.00 177.43 177.15 1bg0 h ILE 253 N 0.08 1.21 0.00 2.57 2.04 -0.87 -2.56 117.51 119.98 1bg0 h ILE 253 Ca 0.04 -0.77 -0.07 0.00 1.00 0.00 0.00 64.86 65.06 1bg0 h ILE 253 Cb 0.60 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 1bg0 h ILE 253 CO 0.03 0.28 -0.33 -0.33 0.00 0.00 0.00 178.15 177.80 1bg0 h GLU 254 N 0.66 0.00 0.00 2.37 5.08 -1.03 0.90 114.58 122.56 1bg0 h GLU 254 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1bg0 h GLU 254 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1bg0 h GLU 254 CO 0.00 0.33 0.00 -1.13 -1.00 0.00 0.00 179.01 177.21 1bg0 n SER 255 N -3.81 0.44 -0.07 1.42 3.41 -0.97 -3.70 113.62 110.35 1bg0 n SER 255 Ca -0.01 0.58 -0.09 0.00 -0.26 0.00 0.00 58.87 59.09 1bg0 n SER 255 Cb 0.41 -0.68 -0.07 0.00 -0.26 0.00 0.00 64.21 63.60 1bg0 n SER 255 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1bg0 n LYS 256 N -1.96 0.83 -4.79 4.33 5.02 -0.77 -5.01 118.16 115.82 1bg0 n LYS 256 Ca 0.04 0.06 -0.33 0.00 -2.02 0.00 0.00 58.31 56.06 1bg0 n LYS 256 Cb 0.28 -1.29 -0.14 0.00 -0.02 0.00 0.00 35.03 33.86 1bg0 n LYS 256 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1bg0 s LEU 257 N -5.58 2.71 -0.29 -0.35 1.43 0.24 -5.09 118.68 111.75 1bg0 s LEU 257 Ca -0.16 -0.33 -0.29 0.00 -1.03 0.00 0.00 54.13 52.33 1bg0 s LEU 257 Cb 0.05 -1.61 -0.00 0.00 0.03 0.00 0.00 46.19 44.66 1bg0 s LEU 257 CO 0.36 0.17 1.31 -2.16 0.23 0.00 0.00 176.35 176.26 1bg0 s PRO 258 N 0.32 3.93 0.02 1.29 0.04 -1.26 -4.56 135.00 134.78 1bg0 s PRO 258 Ca -0.11 1.28 0.02 0.00 0.04 0.00 0.00 61.00 62.23 1bg0 s PRO 258 Cb -0.16 -3.88 -0.04 0.00 0.04 0.00 0.00 34.50 30.47 1bg0 s PRO 258 CO 0.06 -1.10 0.03 -0.06 0.04 0.00 0.00 177.00 175.96 1bg0 s PHE 259 N 4.35 3.12 -0.12 0.56 0.08 -1.26 -1.61 117.98 123.08 1bg0 s PHE 259 Ca 0.57 0.09 -0.29 0.00 0.12 0.00 0.00 56.93 57.41 1bg0 s PHE 259 Cb -0.17 -1.66 -0.03 0.00 -0.57 0.00 0.00 43.02 40.59 1bg0 s PHE 259 CO 0.23 0.49 1.38 -1.12 -0.10 0.00 0.00 175.22 176.10 1bg0 s SER 260 N -1.81 6.86 -0.02 1.36 0.01 0.15 -4.75 113.70 115.50 1bg0 s SER 260 Ca 0.22 1.87 0.05 0.00 1.31 0.00 0.00 55.95 59.41 1bg0 s SER 260 Cb -0.12 -2.54 -0.01 0.00 0.21 0.00 0.00 66.02 63.56 1bg0 s SER 260 CO 0.14 -0.80 -0.18 -2.28 0.41 0.00 0.00 173.24 170.52 1bg0 s HIS 261 N 3.59 1.68 -0.03 2.43 2.46 -1.26 -2.10 115.29 122.06 1bg0 s HIS 261 Ca 0.61 -0.36 0.04 0.00 0.47 0.00 0.00 55.06 55.82 1bg0 s HIS 261 Cb -0.26 -1.09 -0.03 0.00 -0.13 0.00 0.00 32.58 31.07 1bg0 s HIS 261 CO 0.20 -0.06 -0.14 0.34 -2.47 0.00 0.00 174.74 172.60 1bg0 s ASP 262 N -0.32 4.06 0.44 9.88 2.15 0.37 -4.94 116.67 128.31 1bg0 s ASP 262 Ca 0.04 -0.23 0.12 0.00 0.43 0.00 0.00 52.55 52.92 1bg0 s ASP 262 Cb -0.08 -0.83 1.01 0.00 -0.30 0.00 0.00 42.92 42.72 1bg0 s ASP 262 CO -0.00 0.32 2.02 -0.78 -0.17 0.00 0.00 175.17 176.56 1bg0 h ASP 263 N 5.09 0.35 0.00 -0.34 3.58 -1.96 -0.18 116.42 122.96 1bg0 h ASP 263 Ca -0.47 0.00 -0.32 0.00 0.42 0.00 0.00 57.03 56.66 1bg0 h ASP 263 Cb 1.15 -0.07 -0.06 0.00 1.72 0.00 0.00 39.33 42.07 1bg0 h ASP 263 CO 0.50 0.23 -2.21 -1.14 -2.88 0.00 0.00 179.24 173.74 1bg0 n ARG 264 N -4.47 0.53 -0.08 0.28 0.63 -1.26 -4.28 116.66 108.00 1bg0 n ARG 264 Ca 0.07 0.13 0.12 0.00 -0.92 0.00 0.00 57.85 57.24 1bg0 n ARG 264 Cb 0.26 -1.42 0.32 0.00 0.45 0.00 0.00 32.46 32.08 1bg0 n ARG 264 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1bg0 n PHE 265 N -3.17 0.21 -4.72 -0.14 3.72 -1.23 -0.42 117.46 111.72 1bg0 n PHE 265 Ca -0.38 -0.11 0.00 0.00 -0.05 0.00 0.00 57.45 56.91 1bg0 n PHE 265 Cb 0.89 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.43 1bg0 n PHE 265 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bg0 n GLY 266 N 1.27 1.98 3.71 1.37 0.00 -0.08 -0.60 105.19 112.84 1bg0 n GLY 266 Ca 0.17 -0.56 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 1bg0 n GLY 266 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bg0 s PHE 267 N 0.00 3.24 0.25 1.61 0.08 -1.04 0.14 117.98 122.25 1bg0 s PHE 267 Ca 0.00 1.01 -0.30 0.00 0.12 0.00 0.00 56.93 57.76 1bg0 s PHE 267 Cb 0.00 -3.62 -0.09 0.00 -0.57 0.00 0.00 43.02 38.74 1bg0 s PHE 267 CO 0.00 -2.16 0.94 -0.51 -0.10 0.00 0.00 175.22 173.39 1bg0 s LEU 268 N 1.25 4.63 0.20 -0.37 1.43 -0.89 -2.86 118.68 122.07 1bg0 s LEU 268 Ca 0.63 1.95 -0.01 0.00 -1.03 0.00 0.00 54.13 55.67 1bg0 s LEU 268 Cb -0.35 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.20 1bg0 s LEU 268 CO 0.30 0.14 0.12 0.42 0.23 0.00 0.00 176.35 177.56 1bg0 s THR 269 N -1.20 0.11 0.08 5.49 -4.23 -1.26 -3.82 115.64 110.80 1bg0 s THR 269 Ca 0.42 -1.99 -0.18 0.00 -1.18 0.00 0.00 61.69 58.76 1bg0 s THR 269 Cb -0.26 -2.48 -0.09 0.00 1.34 0.00 0.00 72.50 71.01 1bg0 s THR 269 CO 0.32 -0.04 1.45 0.15 -0.54 0.00 0.00 174.62 175.96 1bg0 h PHE 270 N 2.60 0.58 -2.73 3.99 3.57 -1.87 -3.44 116.94 119.65 1bg0 h PHE 270 Ca -0.36 -0.14 -0.66 0.00 3.53 0.00 0.00 57.97 60.34 1bg0 h PHE 270 Cb 1.24 -0.14 -0.08 0.00 2.79 0.00 0.00 35.95 39.77 1bg0 h PHE 270 CO 0.38 0.76 -0.48 0.00 -2.23 0.00 0.00 178.31 176.73 1bg0 h PRO 272 N 5.22 0.00 0.00 0.00 0.13 -1.84 -1.61 132.00 133.89 1bg0 h PRO 272 Ca -0.53 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1bg0 h PRO 272 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1bg0 h PRO 272 CO 0.61 0.00 0.00 1.79 -0.23 0.00 0.00 178.00 180.17 1bg0 h THR 273 N 0.00 0.00 -0.52 1.56 1.35 -1.94 -3.21 112.91 110.15 1bg0 h THR 273 Ca 0.00 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1bg0 h THR 273 Cb 0.00 1.40 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 1bg0 h THR 273 CO 0.00 0.00 0.00 0.59 -0.25 0.00 0.00 175.52 175.86 1bg0 n ASN 274 N -2.53 3.93 -4.18 5.36 3.02 -0.61 -4.57 115.26 115.69 1bg0 n ASN 274 Ca 0.03 -2.30 -0.30 0.00 -0.03 0.00 0.00 54.58 51.99 1bg0 n ASN 274 Cb 0.36 -0.45 0.20 0.00 -0.61 0.00 0.00 39.78 39.28 1bg0 n ASN 274 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1bg0 s LEU 275 N -1.55 1.47 0.00 3.41 1.43 -1.22 -3.24 118.68 118.99 1bg0 s LEU 275 Ca 0.41 0.69 0.00 0.00 -1.03 0.00 0.00 54.13 54.20 1bg0 s LEU 275 Cb 0.25 -2.66 0.00 0.00 0.03 0.00 0.00 46.19 43.81 1bg0 s LEU 275 CO 0.22 -3.41 0.00 0.61 0.23 0.00 0.00 176.35 173.99 1bg0 n GLY 276 N -1.78 1.41 0.13 -3.19 0.00 0.24 -2.43 105.19 99.57 1bg0 n GLY 276 Ca 0.11 0.14 0.02 0.00 0.00 0.00 0.00 46.02 46.29 1bg0 n GLY 276 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1bg0 h THR 277 N 0.00 0.91 -0.40 2.61 1.35 -1.35 -2.75 112.91 113.28 1bg0 h THR 277 Ca 0.00 -2.29 -0.17 0.00 -0.55 0.00 0.00 66.41 63.40 1bg0 h THR 277 Cb 0.00 2.44 -0.07 0.00 -1.73 0.00 0.00 68.15 68.79 1bg0 h THR 277 CO 0.00 0.52 -0.15 0.35 -0.25 0.00 0.00 175.52 175.98 1bg0 n THR 278 N -3.22 0.00 -3.33 6.82 -2.24 -1.02 -4.66 114.28 106.62 1bg0 n THR 278 Ca 0.01 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.41 1bg0 n THR 278 Cb 0.75 -1.34 -0.06 0.00 -2.10 0.00 0.00 70.33 67.58 1bg0 n THR 278 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1bg0 s MET 279 N -2.63 4.23 -0.32 -0.78 -2.45 -1.26 -3.39 119.30 112.70 1bg0 s MET 279 Ca 0.00 0.52 -0.01 0.00 -1.25 0.00 0.00 55.69 54.95 1bg0 s MET 279 Cb 0.00 -3.35 0.10 0.00 1.25 0.00 0.00 34.83 32.83 1bg0 s MET 279 CO 0.00 0.36 0.12 0.50 1.05 0.00 0.00 175.02 177.05 1bg0 s ARG 280 N -0.07 0.71 -0.20 4.11 3.52 -0.80 -4.73 118.95 121.49 1bg0 s ARG 280 Ca 0.27 -1.12 -0.17 0.00 -0.13 0.00 0.00 55.73 54.58 1bg0 s ARG 280 Cb -0.16 -1.91 -0.04 0.00 -1.56 0.00 0.00 34.95 31.28 1bg0 s ARG 280 CO 0.13 -1.02 0.45 0.00 -0.81 0.00 0.00 175.30 174.05 1bg0 s ALA 281 N 1.52 3.55 0.21 6.12 0.00 -1.26 -2.37 121.76 129.53 1bg0 s ALA 281 Ca 0.11 -0.48 -0.01 0.00 0.00 0.00 0.00 51.96 51.58 1bg0 s ALA 281 Cb -0.18 -2.71 -0.04 0.00 0.00 0.00 0.00 23.12 20.19 1bg0 s ALA 281 CO -0.23 -0.37 0.13 -1.54 0.00 0.00 0.00 175.76 173.75 1bg0 s SER 282 N 1.11 0.26 0.00 0.00 1.04 0.14 -2.87 113.70 113.38 1bg0 s SER 282 Ca 0.21 -1.39 -0.02 0.00 0.48 0.00 0.00 55.95 55.23 1bg0 s SER 282 Cb -0.15 0.36 -0.01 0.00 0.10 0.00 0.00 66.02 66.32 1bg0 s SER 282 CO 0.09 -0.83 0.04 0.68 0.98 0.00 0.00 173.24 174.19 1bg0 s VAL 283 N -4.12 0.07 -0.33 5.02 -7.23 -0.81 -0.85 120.40 112.16 1bg0 s VAL 283 Ca 0.39 -0.62 -0.14 0.00 -1.81 0.00 0.00 61.98 59.81 1bg0 s VAL 283 Cb 0.07 -0.26 -0.02 0.00 0.56 0.00 0.00 36.38 36.73 1bg0 s VAL 283 CO 0.12 -0.34 0.29 -1.00 -0.31 0.00 0.00 175.10 173.86 1bg0 s HIS 284 N -1.05 3.22 0.05 2.82 3.76 0.05 -1.81 115.29 122.33 1bg0 s HIS 284 Ca -0.11 -0.05 0.02 0.00 -0.15 0.00 0.00 55.06 54.76 1bg0 s HIS 284 Cb -0.07 -2.55 -0.03 0.00 1.11 0.00 0.00 32.58 31.05 1bg0 s HIS 284 CO -0.00 -0.35 -0.07 -1.50 -0.85 0.00 0.00 174.74 171.97 1bg0 s ILE 285 N 1.87 0.49 -0.18 0.60 2.07 0.08 0.21 121.20 126.34 1bg0 s ILE 285 Ca 0.09 -1.27 -0.03 0.00 -1.41 0.00 0.00 60.65 58.04 1bg0 s ILE 285 Cb -0.17 -0.83 -0.01 0.00 0.13 0.00 0.00 42.46 41.58 1bg0 s ILE 285 CO 0.11 -0.53 -0.07 -1.10 -1.91 0.00 0.00 174.94 171.44 1bg0 s GLN 286 N -2.15 3.44 -0.40 3.50 -0.21 -0.03 -1.06 119.66 122.75 1bg0 s GLN 286 Ca -0.06 -0.62 0.06 0.00 0.02 0.00 0.00 55.36 54.77 1bg0 s GLN 286 Cb -0.06 -2.87 0.22 0.00 1.00 0.00 0.00 33.01 31.30 1bg0 s GLN 286 CO -0.01 0.02 0.47 1.28 -2.12 0.00 0.00 175.29 174.93 1bg0 n LEU 287 N 4.14 -0.29 -0.29 2.90 4.77 -1.26 -4.66 117.00 122.31 1bg0 n LEU 287 Ca -0.18 -4.47 0.10 0.00 -0.03 0.00 0.00 56.01 51.43 1bg0 n LEU 287 Cb 0.52 0.62 0.26 0.00 -2.33 0.00 0.00 43.42 42.48 1bg0 n LEU 287 CO 0.30 1.98 1.03 1.55 -1.33 0.00 0.00 177.39 180.92 1bg0 h PRO 288 N 4.65 0.40 0.01 3.23 0.13 -1.96 0.32 132.00 138.78 1bg0 h PRO 288 Ca 0.14 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1bg0 h PRO 288 Cb 0.90 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1bg0 h PRO 288 CO 0.41 0.26 -0.00 0.87 -0.23 0.00 0.00 178.00 179.31 1bg0 h LYS 289 N 0.41 -0.01 0.00 0.86 1.57 -1.95 -2.13 116.57 115.31 1bg0 h LYS 289 Ca 0.51 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.20 1bg0 h LYS 289 Cb 0.90 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 1bg0 h LYS 289 CO -0.49 0.59 -0.41 -0.07 -0.57 0.00 0.00 179.45 178.50 1bg0 h LEU 290 N -0.62 0.00 0.00 2.94 3.38 -1.87 -3.06 115.31 116.09 1bg0 h LEU 290 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1bg0 h LEU 290 Cb 0.60 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1bg0 h LEU 290 CO 0.00 0.41 -0.53 0.00 0.09 0.00 0.00 178.44 178.40 1bg0 h ALA 291 N 1.59 0.69 -0.85 1.53 0.00 -0.41 -3.20 119.26 118.61 1bg0 h ALA 291 Ca -0.00 -0.44 0.19 0.00 0.00 0.00 0.00 54.91 54.65 1bg0 h ALA 291 Cb 0.76 -0.05 -0.16 0.00 0.00 0.00 0.00 17.79 18.34 1bg0 h ALA 291 CO 0.05 0.59 -0.14 1.17 0.00 0.00 0.00 179.25 180.92 1bg0 n LYS 292 N -3.19 -0.07 -3.85 0.00 3.00 -0.80 -1.92 118.16 111.33 1bg0 n LYS 292 Ca 0.01 1.31 -0.32 0.00 -0.00 0.00 0.00 58.31 59.32 1bg0 n LYS 292 Cb 0.73 -2.00 -0.12 0.00 0.00 0.00 0.00 35.03 33.64 1bg0 n LYS 292 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1bg0 s ASP 293 N -5.16 4.86 0.60 3.14 -1.08 -1.26 -4.96 116.67 112.82 1bg0 s ASP 293 Ca -0.12 -3.30 0.28 0.00 -0.52 0.00 0.00 52.55 48.89 1bg0 s ASP 293 Cb 0.24 -1.72 1.05 0.00 -1.46 0.00 0.00 42.92 41.03 1bg0 s ASP 293 CO 0.66 -0.21 1.42 -0.09 0.52 0.00 0.00 175.17 177.47 1bg0 h ARG 294 N 6.25 0.00 -0.37 4.34 2.43 -1.63 0.24 114.38 125.65 1bg0 h ARG 294 Ca 0.02 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.22 1bg0 h ARG 294 Cb 0.86 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.38 1bg0 h ARG 294 CO 0.72 0.00 0.19 0.87 -1.51 0.00 0.00 179.97 180.24 1bg0 h LYS 295 N 0.00 0.38 -0.12 0.20 1.57 -1.90 0.08 116.57 116.76 1bg0 h LYS 295 Ca 0.46 -0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 59.10 1bg0 h LYS 295 Cb 2.65 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 34.86 1bg0 h LYS 295 CO -0.00 0.25 -0.44 -0.39 -0.57 0.00 0.00 179.45 178.30 1bg0 h VAL 296 N 0.39 1.32 -0.01 0.50 -1.51 -0.80 0.68 116.25 116.82 1bg0 h VAL 296 Ca 0.15 -1.59 -0.00 0.00 -1.23 0.00 0.00 66.70 64.03 1bg0 h VAL 296 Cb 0.05 1.71 -0.00 0.00 -2.13 0.00 0.00 31.29 30.92 1bg0 h VAL 296 CO -0.10 0.48 0.00 0.25 -1.23 0.00 0.00 177.57 176.97 1bg0 h LEU 297 N 0.24 0.01 -0.93 4.19 5.85 -1.27 0.16 115.31 123.56 1bg0 h LEU 297 Ca 0.02 -0.13 -0.11 0.00 0.84 0.00 0.00 57.88 58.50 1bg0 h LEU 297 Cb 0.87 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.88 1bg0 h LEU 297 CO 0.07 0.14 -0.51 -0.33 -0.34 0.00 0.00 178.44 177.46 1bg0 h GLU 298 N -0.11 0.05 -0.16 1.25 5.08 -0.86 -1.20 114.58 118.62 1bg0 h GLU 298 Ca 0.00 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.16 1bg0 h GLU 298 Cb 0.13 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 1bg0 h GLU 298 CO -0.00 0.55 -0.62 -0.44 -1.00 0.00 0.00 179.01 177.50 1bg0 h ASP 299 N 0.04 0.63 -0.16 1.42 3.32 -0.62 -1.84 116.42 119.21 1bg0 h ASP 299 Ca -0.00 -0.36 -0.07 0.00 0.02 0.00 0.00 57.03 56.61 1bg0 h ASP 299 Cb 0.92 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 40.29 1bg0 h ASP 299 CO 0.07 1.10 -0.18 0.40 -1.72 0.00 0.00 179.24 178.90 1bg0 h ILE 300 N 0.41 1.35 -0.54 0.35 2.04 -0.50 -3.19 117.51 117.43 1bg0 h ILE 300 Ca -0.01 -1.37 0.02 0.00 1.00 0.00 0.00 64.86 64.51 1bg0 h ILE 300 Cb 1.18 1.87 -0.03 0.00 -0.74 0.00 0.00 36.82 39.10 1bg0 h ILE 300 CO 0.12 0.41 0.34 0.00 0.00 0.00 0.00 178.15 179.01 1bg0 h ALA 301 N 0.61 0.69 -0.23 1.87 0.00 -1.21 -2.59 119.26 118.40 1bg0 h ALA 301 Ca 0.02 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.96 1bg0 h ALA 301 Cb 0.73 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1bg0 h ALA 301 CO 0.04 0.07 0.16 0.66 0.00 0.00 0.00 179.25 180.18 1bg0 h SER 302 N 0.67 0.11 0.89 0.00 4.64 -1.35 0.34 113.55 118.84 1bg0 h SER 302 Ca 0.21 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.52 1bg0 h SER 302 Cb -0.01 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1bg0 h SER 302 CO -0.08 0.07 -0.06 0.11 -0.87 0.00 0.00 176.83 176.01 1bg0 h LYS 303 N 0.13 0.00 -0.69 4.77 1.57 -1.45 -1.74 116.57 119.16 1bg0 h LYS 303 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1bg0 h LYS 303 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1bg0 h LYS 303 CO -0.01 0.06 0.00 1.19 -0.57 0.00 0.00 179.45 180.11 1bg0 n PHE 304 N -3.20 0.92 -2.49 -1.35 3.72 -0.02 -4.94 117.46 110.11 1bg0 n PHE 304 Ca 0.00 -0.48 -0.15 0.00 -0.05 0.00 0.00 57.45 56.76 1bg0 n PHE 304 Cb 0.31 -0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.86 1bg0 n PHE 304 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1bg0 n ASN 305 N 1.58 -4.64 -4.73 4.37 5.03 -0.65 -4.81 115.26 111.41 1bg0 n ASN 305 Ca 0.23 -0.09 -0.26 0.00 0.87 0.00 0.00 54.58 55.34 1bg0 n ASN 305 Cb 0.61 -3.67 -0.06 0.00 -1.02 0.00 0.00 39.78 35.64 1bg0 n ASN 305 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1bg0 s LEU 306 N -4.54 3.53 0.05 3.41 1.43 -0.46 -1.37 118.68 120.74 1bg0 s LEU 306 Ca 0.09 -0.31 0.08 0.00 -1.03 0.00 0.00 54.13 52.96 1bg0 s LEU 306 Cb -0.04 -2.14 -0.03 0.00 0.03 0.00 0.00 46.19 44.00 1bg0 s LEU 306 CO 0.11 0.06 -0.21 -1.58 0.23 0.00 0.00 176.35 174.96 1bg0 s GLN 307 N -3.17 1.93 -0.17 1.70 0.74 0.19 -3.65 119.66 117.22 1bg0 s GLN 307 Ca 0.30 -1.06 -0.05 0.00 0.05 0.00 0.00 55.36 54.60 1bg0 s GLN 307 Cb -0.09 -2.11 -0.03 0.00 1.10 0.00 0.00 33.01 31.88 1bg0 s GLN 307 CO 0.21 0.52 -0.01 0.08 -0.55 0.00 0.00 175.29 175.54 1bg0 s VAL 308 N -0.92 4.01 0.27 1.34 1.01 -1.26 -1.69 120.40 123.16 1bg0 s VAL 308 Ca 0.14 -0.31 0.04 0.00 0.00 0.00 0.00 61.98 61.85 1bg0 s VAL 308 Cb -0.10 -2.78 -0.06 0.00 0.00 0.00 0.00 36.38 33.44 1bg0 s VAL 308 CO 0.05 0.47 0.01 -0.13 0.00 0.00 0.00 175.10 175.49 1bg0 s ARG 309 N 0.56 1.48 0.99 2.72 0.52 0.19 -4.98 118.95 120.43 1bg0 s ARG 309 Ca -0.02 -1.78 -0.14 0.00 -0.52 0.00 0.00 55.73 53.28 1bg0 s ARG 309 Cb -0.14 -0.80 0.18 0.00 0.52 0.00 0.00 34.95 34.71 1bg0 s ARG 309 CO 0.02 -0.10 1.16 0.20 0.02 0.00 0.00 175.30 176.60 1bg0 s GLY 310 N -3.39 1.61 0.44 -3.53 0.00 -0.92 -0.97 107.32 100.56 1bg0 s GLY 310 Ca 0.31 -0.71 0.13 0.00 0.00 0.00 0.00 44.72 44.46 1bg0 s GLY 310 CO 0.12 -0.05 2.00 -0.84 0.00 0.00 0.00 173.10 174.33 1bg0 h THR 311 N -1.77 1.12 -0.63 0.90 2.02 -1.55 -1.70 112.91 111.30 1bg0 h THR 311 Ca -0.49 -0.56 0.00 0.00 0.77 0.00 0.00 66.41 66.13 1bg0 h THR 311 Cb 1.31 1.24 0.00 0.00 -1.74 0.00 0.00 68.15 68.96 1bg0 h THR 311 CO 0.52 0.17 0.00 0.54 0.37 0.00 0.00 175.52 177.12 1bg0 n ARG 312 N -4.35 2.59 0.00 6.66 1.74 -1.26 -4.97 116.66 117.06 1bg0 n ARG 312 Ca -0.02 -2.32 0.00 0.00 -0.77 0.00 0.00 57.85 54.74 1bg0 n ARG 312 Cb 0.22 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 1bg0 n ARG 312 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bg0 n GLY 313 N 1.46 -0.51 3.70 -0.13 0.00 -0.64 -4.96 105.19 104.12 1bg0 n GLY 313 Ca 0.22 -2.23 -0.36 0.00 0.00 0.00 0.00 46.02 43.65 1bg0 n GLY 313 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1bg0 n GLU 314 N -0.15 0.68 -1.17 1.61 0.28 -1.26 -2.16 120.64 118.47 1bg0 n GLU 314 Ca 0.00 0.30 -0.06 0.00 -0.16 0.00 0.00 57.16 57.24 1bg0 n GLU 314 Cb 0.00 -2.45 -0.03 0.00 1.43 0.00 0.00 31.44 30.40 1bg0 n GLU 314 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1bg0 n HIS 315 N -2.52 0.00 -4.46 -1.84 8.25 -1.26 -4.87 115.22 108.53 1bg0 n HIS 315 Ca 0.15 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.38 1bg0 n HIS 315 Cb 0.49 -1.77 -0.10 0.00 1.12 0.00 0.00 29.99 29.73 1bg0 n HIS 315 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1bg0 s THR 316 N -1.86 1.84 0.52 1.59 -4.23 -1.11 -5.03 115.64 107.36 1bg0 s THR 316 Ca 0.00 -2.16 -0.02 0.00 -1.18 0.00 0.00 61.69 58.33 1bg0 s THR 316 Cb 0.00 -2.48 0.01 0.00 1.34 0.00 0.00 72.50 71.37 1bg0 s THR 316 CO 0.00 -0.29 0.78 -1.61 -0.54 0.00 0.00 174.62 172.96 1bg0 s GLU 317 N -3.68 2.90 0.25 3.99 0.41 -1.26 -2.75 118.70 118.56 1bg0 s GLU 317 Ca 0.30 -0.36 -0.22 0.00 -0.41 0.00 0.00 54.97 54.28 1bg0 s GLU 317 Cb 0.03 -2.43 -0.09 0.00 -1.78 0.00 0.00 34.13 29.86 1bg0 s GLU 317 CO 0.13 -0.52 0.80 -1.54 -0.49 0.00 0.00 175.26 173.64 1bg0 s SER 318 N -4.29 7.19 -0.10 -0.19 1.04 -1.26 -2.22 113.70 113.87 1bg0 s SER 318 Ca 0.52 1.58 0.03 0.00 0.48 0.00 0.00 55.95 58.56 1bg0 s SER 318 Cb -0.10 -2.48 -0.01 0.00 0.10 0.00 0.00 66.02 63.53 1bg0 s SER 318 CO 0.41 0.02 -0.19 -1.61 0.98 0.00 0.00 173.24 172.84 1bg0 s GLU 319 N -1.90 3.01 -1.66 4.02 2.02 -1.25 -4.65 118.70 118.29 1bg0 s GLU 319 Ca 0.44 -0.80 -0.00 0.00 0.02 0.00 0.00 54.97 54.63 1bg0 s GLU 319 Cb -0.18 -2.39 0.00 0.00 0.10 0.00 0.00 34.13 31.66 1bg0 s GLU 319 CO 0.23 0.28 0.01 0.41 0.02 0.00 0.00 175.26 176.20 1bg0 n GLY 320 N 3.28 -0.50 2.32 -1.39 0.00 -1.26 -1.64 105.19 106.01 1bg0 n GLY 320 Ca -0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.82 1bg0 n GLY 320 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bg0 n GLY 321 N -0.98 0.47 3.58 -0.02 0.00 -1.26 -5.00 105.19 101.97 1bg0 n GLY 321 Ca -0.23 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.22 1bg0 n GLY 321 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bg0 s VAL 322 N -1.79 5.07 0.12 1.61 1.01 -0.65 -4.30 120.40 121.47 1bg0 s VAL 322 Ca 0.00 0.45 0.06 0.00 0.00 0.00 0.00 61.98 62.49 1bg0 s VAL 322 Cb 0.00 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 1bg0 s VAL 322 CO 0.00 -0.09 0.01 -0.31 0.00 0.00 0.00 175.10 174.71 1bg0 s TYR 323 N 2.29 2.95 -0.38 5.22 1.51 -0.22 -3.81 117.35 124.90 1bg0 s TYR 323 Ca 0.18 -0.06 -0.14 0.00 -1.01 0.00 0.00 57.07 56.04 1bg0 s TYR 323 Cb -0.16 -1.48 0.01 0.00 -0.11 0.00 0.00 41.96 40.22 1bg0 s TYR 323 CO 0.12 0.49 0.27 0.34 -1.11 0.00 0.00 175.55 175.66 1bg0 s ASP 324 N -2.55 6.04 -0.11 2.29 -1.08 -0.15 -0.75 116.67 120.38 1bg0 s ASP 324 Ca 0.26 -0.74 0.04 0.00 -0.52 0.00 0.00 52.55 51.59 1bg0 s ASP 324 Cb -0.11 -2.14 0.00 0.00 -1.46 0.00 0.00 42.92 39.22 1bg0 s ASP 324 CO 0.19 -0.36 -0.23 -0.63 0.52 0.00 0.00 175.17 174.65 1bg0 s ILE 325 N 1.68 2.12 0.26 4.11 1.01 -0.75 0.52 121.20 130.15 1bg0 s ILE 325 Ca 0.05 -0.99 -0.09 0.00 0.00 0.00 0.00 60.65 59.61 1bg0 s ILE 325 Cb -0.18 -1.82 -0.01 0.00 0.01 0.00 0.00 42.46 40.46 1bg0 s ILE 325 CO 0.10 0.56 0.43 -0.94 0.00 0.00 0.00 174.94 175.08 1bg0 s SER 326 N 0.42 0.10 0.09 3.58 1.04 -0.68 -1.93 113.70 116.32 1bg0 s SER 326 Ca -0.17 -1.09 -0.31 0.00 0.48 0.00 0.00 55.95 54.86 1bg0 s SER 326 Cb -0.17 0.57 -0.07 0.00 0.10 0.00 0.00 66.02 66.45 1bg0 s SER 326 CO 0.07 -1.13 1.35 0.54 0.98 0.00 0.00 173.24 175.05 1bg0 s ASN 327 N -3.08 6.89 0.02 7.02 4.22 -1.14 0.54 114.94 129.41 1bg0 s ASN 327 Ca 0.26 2.23 -0.14 0.00 -2.14 0.00 0.00 52.86 53.07 1bg0 s ASN 327 Cb 0.00 -2.58 -0.34 0.00 1.28 0.00 0.00 41.25 39.61 1bg0 s ASN 327 CO 0.11 -0.62 0.94 0.50 -2.04 0.00 0.00 177.10 175.99 1bg0 h LYS 328 N 6.91 0.50 -6.81 3.55 3.64 -1.52 -3.44 116.57 119.40 1bg0 h LYS 328 Ca -0.42 -0.85 -0.49 0.00 -1.27 0.00 0.00 60.65 57.63 1bg0 h LYS 328 Cb 1.21 0.32 -0.01 0.00 -0.41 0.00 0.00 32.23 33.34 1bg0 h LYS 328 CO 0.86 1.40 0.39 1.03 -2.27 0.00 0.00 179.45 180.86 1bg0 s ARG 329 N -2.60 4.68 0.00 1.90 0.52 -1.26 -4.94 118.95 117.25 1bg0 s ARG 329 Ca -0.10 1.54 0.00 0.00 -0.52 0.00 0.00 55.73 56.65 1bg0 s ARG 329 Cb 0.05 -3.09 0.00 0.00 0.52 0.00 0.00 34.95 32.43 1bg0 s ARG 329 CO 0.92 0.32 0.00 0.54 0.02 0.00 0.00 175.30 177.11 1bg0 n ARG 330 N 1.07 4.60 -4.52 3.54 1.74 -1.26 -4.91 116.66 116.92 1bg0 n ARG 330 Ca -0.00 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.75 1bg0 n ARG 330 Cb 0.47 -0.58 -0.11 0.00 -1.02 0.00 0.00 32.46 31.22 1bg0 n ARG 330 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1bg0 s LEU 331 N -0.59 3.12 0.00 0.55 2.96 -1.24 -1.05 118.68 122.42 1bg0 s LEU 331 Ca 0.00 -0.14 0.00 0.00 -0.22 0.00 0.00 54.13 53.77 1bg0 s LEU 331 Cb 0.00 -1.76 0.00 0.00 0.50 0.00 0.00 46.19 44.93 1bg0 s LEU 331 CO 0.00 0.30 0.00 0.61 -1.32 0.00 0.00 176.35 175.94 1bg0 n GLY 332 N 1.71 0.74 3.22 7.98 0.00 -1.26 -4.91 105.19 112.67 1bg0 n GLY 332 Ca -0.16 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 1bg0 n GLY 332 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1bg0 s LEU 333 N 0.00 1.01 0.96 0.99 2.34 -1.26 -4.89 118.68 117.83 1bg0 s LEU 333 Ca 0.00 -0.11 -0.12 0.00 0.06 0.00 0.00 54.13 53.96 1bg0 s LEU 333 Cb 0.00 1.19 0.17 0.00 -0.56 0.00 0.00 46.19 46.98 1bg0 s LEU 333 CO 0.00 -0.51 1.11 0.42 -1.06 0.00 0.00 176.35 176.31 1bg0 s THR 334 N -1.93 2.08 0.32 5.48 -4.23 -1.26 -4.62 115.64 111.47 1bg0 s THR 334 Ca -0.10 0.03 0.00 0.00 -1.18 0.00 0.00 61.69 60.44 1bg0 s THR 334 Cb -0.03 -2.61 0.23 0.00 1.34 0.00 0.00 72.50 71.42 1bg0 s THR 334 CO 0.00 -0.03 1.95 -0.33 -0.54 0.00 0.00 174.62 175.66 1bg0 h GLU 335 N -1.74 0.90 -0.12 3.99 3.07 -1.87 -0.77 114.58 118.04 1bg0 h GLU 335 Ca -0.53 -0.09 -0.01 0.00 -0.50 0.00 0.00 59.36 58.23 1bg0 h GLU 335 Cb 1.33 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 29.05 1bg0 h GLU 335 CO 0.59 0.65 0.04 -0.92 -1.40 0.00 0.00 179.01 177.97 1bg0 h TYR 336 N 0.91 0.19 -0.40 4.33 3.20 -1.56 -1.64 116.97 122.00 1bg0 h TYR 336 Ca 0.23 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 1bg0 h TYR 336 Cb 0.01 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 1bg0 h TYR 336 CO 0.01 0.31 0.12 1.96 -1.64 0.00 0.00 178.16 178.92 1bg0 h GLN 337 N 0.01 0.58 0.24 1.82 4.20 -1.77 -0.16 115.11 120.04 1bg0 h GLN 337 Ca 0.04 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 1bg0 h GLN 337 Cb 0.21 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.89 1bg0 h GLN 337 CO -0.00 0.52 -0.12 0.00 -0.67 0.00 0.00 178.83 178.56 1bg0 h ALA 338 N 1.56 -0.32 -0.05 3.87 0.00 -0.88 -0.86 119.26 122.58 1bg0 h ALA 338 Ca 0.14 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1bg0 h ALA 338 Cb 0.19 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1bg0 h ALA 338 CO -0.01 -0.54 -0.23 -0.24 0.00 0.00 0.00 179.25 178.23 1bg0 h VAL 339 N -0.60 1.19 -0.37 0.00 3.04 -1.17 -2.47 116.25 115.87 1bg0 h VAL 339 Ca -0.03 -0.89 -0.11 0.00 -1.01 0.00 0.00 66.70 64.66 1bg0 h VAL 339 Cb 0.44 1.40 -0.01 0.00 -2.01 0.00 0.00 31.29 31.11 1bg0 h VAL 339 CO 0.05 0.26 -0.21 0.03 -1.01 0.00 0.00 177.57 176.69 1bg0 h ARG 340 N 0.08 0.71 -0.55 4.17 2.47 -0.83 -1.43 114.38 119.00 1bg0 h ARG 340 Ca 0.01 -0.28 -0.02 0.00 -1.26 0.00 0.00 59.98 58.44 1bg0 h ARG 340 Cb 0.45 -0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.70 1bg0 h ARG 340 CO 0.03 0.87 0.26 0.93 0.56 0.00 0.00 179.97 182.62 1bg0 h GLU 341 N 0.63 0.77 -0.02 0.04 5.08 -0.68 0.22 114.58 120.63 1bg0 h GLU 341 Ca 0.09 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1bg0 h GLU 341 Cb 0.70 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1bg0 h GLU 341 CO 0.05 0.60 -0.07 1.98 -1.00 0.00 0.00 179.01 180.58 1bg0 h MET 342 N 0.77 0.09 0.03 2.33 4.05 -1.41 -1.94 114.93 118.85 1bg0 h MET 342 Ca 0.19 -0.06 0.02 0.00 -0.28 0.00 0.00 59.70 59.57 1bg0 h MET 342 Cb 0.09 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.87 1bg0 h MET 342 CO -0.03 0.67 -0.14 0.37 0.23 0.00 0.00 176.91 178.02 1bg0 h GLN 343 N -0.48 -0.24 -0.28 0.39 4.15 -0.97 0.16 115.11 117.85 1bg0 h GLN 343 Ca -0.00 0.02 0.02 0.00 0.77 0.00 0.00 58.65 59.45 1bg0 h GLN 343 Cb 0.68 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.40 1bg0 h GLN 343 CO 0.01 -0.16 0.14 -0.44 -1.93 0.00 0.00 178.83 176.46 1bg0 h ASP 344 N -0.24 0.22 -0.31 -0.69 3.32 -0.64 -1.56 116.42 116.52 1bg0 h ASP 344 Ca 0.04 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.07 1bg0 h ASP 344 Cb 0.29 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 1bg0 h ASP 344 CO -0.11 0.17 0.09 1.23 -1.72 0.00 0.00 179.24 178.90 1bg0 h GLY 345 N 0.30 0.52 1.12 2.75 0.00 -1.15 -2.59 103.07 104.02 1bg0 h GLY 345 Ca 0.11 -0.31 -0.05 0.00 0.00 0.00 0.00 47.33 47.08 1bg0 h GLY 345 CO -0.07 0.29 0.25 -2.22 0.00 0.00 0.00 176.54 174.79 1bg0 h ILE 346 N 0.34 1.25 -0.76 2.60 1.08 -0.87 0.24 117.51 121.39 1bg0 h ILE 346 Ca 0.10 -0.85 -0.02 0.00 -0.39 0.00 0.00 64.86 63.70 1bg0 h ILE 346 Cb 0.25 0.42 -0.04 0.00 -3.07 0.00 0.00 36.82 34.39 1bg0 h ILE 346 CO -0.00 0.34 0.38 -0.07 -0.69 0.00 0.00 178.15 178.11 1bg0 h LEU 347 N 1.07 0.98 -0.25 1.44 3.38 -1.20 -1.60 115.31 119.14 1bg0 h LEU 347 Ca 0.24 -0.12 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 1bg0 h LEU 347 Cb 0.26 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1bg0 h LEU 347 CO -0.01 0.82 -0.41 -0.33 0.09 0.00 0.00 178.44 178.59 1bg0 h GLU 348 N 1.06 0.72 -0.16 1.13 4.39 -1.12 -2.44 114.58 118.15 1bg0 h GLU 348 Ca 0.26 -0.44 -0.02 0.00 0.34 0.00 0.00 59.36 59.50 1bg0 h GLU 348 Cb 0.09 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 1bg0 h GLU 348 CO -0.04 1.06 -0.00 0.52 -1.16 0.00 0.00 179.01 179.39 1bg0 h MET 349 N 0.44 0.23 -0.21 2.33 2.86 -0.78 0.10 114.93 119.91 1bg0 h MET 349 Ca 0.02 -0.03 -0.18 0.00 -2.06 0.00 0.00 59.70 57.45 1bg0 h MET 349 Cb 1.01 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.63 1bg0 h MET 349 CO 0.09 0.26 -0.59 0.82 1.06 0.00 0.00 176.91 178.55 1bg0 h ILE 350 N 0.23 1.31 -0.32 -1.22 2.04 -1.20 -0.79 117.51 117.56 1bg0 h ILE 350 Ca 0.06 -1.83 -0.03 0.00 1.00 0.00 0.00 64.86 64.06 1bg0 h ILE 350 Cb 0.17 1.78 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 1bg0 h ILE 350 CO 0.00 0.58 0.08 0.11 0.00 0.00 0.00 178.15 178.92 1bg0 h LYS 351 N 0.51 0.51 -0.91 2.37 1.57 -0.77 -1.68 116.57 118.17 1bg0 h LYS 351 Ca -0.00 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1bg0 h LYS 351 Cb 1.17 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 33.37 1bg0 h LYS 351 CO 0.12 0.57 0.54 0.52 -0.57 0.00 0.00 179.45 180.63 1bg0 h MET 352 N 0.36 1.24 -0.36 3.15 2.86 -0.74 -1.73 114.93 119.71 1bg0 h MET 352 Ca 0.10 -0.12 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 1bg0 h MET 352 Cb 0.29 -0.26 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 1bg0 h MET 352 CO 0.00 0.87 0.18 1.49 1.06 0.00 0.00 176.91 180.51 1bg0 h GLU 353 N 1.26 0.52 -0.06 1.72 4.57 -0.88 0.14 114.58 121.84 1bg0 h GLU 353 Ca 0.33 -0.07 -0.04 0.00 -1.18 0.00 0.00 59.36 58.39 1bg0 h GLU 353 Cb -0.04 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.44 1bg0 h GLU 353 CO -0.06 0.46 -0.14 0.87 -1.18 0.00 0.00 179.01 178.96 1bg0 h LYS 354 N 0.45 0.10 0.00 1.92 1.57 -0.86 -2.68 116.57 117.06 1bg0 h LYS 354 Ca 0.12 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1bg0 h LYS 354 Cb 0.11 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1bg0 h LYS 354 CO -0.02 0.24 -0.96 0.00 -0.57 0.00 0.00 179.45 178.15 1bg0 n ALA 355 N -2.50 2.77 -1.74 3.86 0.00 -0.69 -4.96 120.51 117.25 1bg0 n ALA 355 Ca -0.02 -0.28 -0.38 0.00 0.00 0.00 0.00 53.44 52.77 1bg0 n ALA 355 Cb 0.24 -1.09 0.05 0.00 0.00 0.00 0.00 19.45 18.65 1bg0 n ALA 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bg0 s ALA 356 N -3.30 2.64 -2.00 0.00 0.00 0.46 -5.08 121.76 114.48 1bg0 s ALA 356 Ca 0.01 1.29 0.17 0.00 0.00 0.00 0.00 51.96 53.44 1bg0 s ALA 356 Cb 0.11 -3.57 1.02 0.00 0.00 0.00 0.00 23.12 20.69 1bg0 s ALA 356 CO 0.78 -1.48 1.43 0.00 0.00 0.00 0.00 175.76 176.49