#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bg4 h SER 3 N 0.00 1.02 -3.47 0.00 0.87 -2.03 -3.40 113.55 106.54 1bg4 h SER 3 Ca 0.00 0.01 -0.61 0.00 -1.23 0.00 0.00 61.79 59.96 1bg4 h SER 3 Cb 0.00 -0.21 -0.13 0.00 -0.44 0.00 0.00 62.40 61.63 1bg4 h SER 3 CO 0.00 0.65 -0.39 -0.69 -0.53 0.00 0.00 176.83 175.87 1bg4 s VAL 4 N -6.01 5.31 -0.29 2.23 1.01 -1.26 -5.06 120.40 116.33 1bg4 s VAL 4 Ca -0.12 0.39 -0.19 0.00 0.00 0.00 0.00 61.98 62.06 1bg4 s VAL 4 Cb 0.20 -3.58 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 1bg4 s VAL 4 CO 0.81 0.34 0.57 -0.55 0.00 0.00 0.00 175.10 176.27 1bg4 s SER 5 N 0.87 6.46 0.46 3.32 0.15 -1.26 -4.94 113.70 118.75 1bg4 s SER 5 Ca 0.12 0.44 0.22 0.00 0.70 0.00 0.00 55.95 57.44 1bg4 s SER 5 Cb -0.13 -2.30 1.09 0.00 -1.71 0.00 0.00 66.02 62.96 1bg4 s SER 5 CO 0.05 -0.39 1.93 0.16 1.20 0.00 0.00 173.24 176.19 1bg4 h ILE 6 N 5.48 0.76 -0.32 6.45 3.07 -1.91 -1.83 117.51 129.20 1bg4 h ILE 6 Ca -0.28 -0.93 -0.11 0.00 1.55 0.00 0.00 64.86 65.10 1bg4 h ILE 6 Cb 1.13 1.57 -0.01 0.00 -0.27 0.00 0.00 36.82 39.24 1bg4 h ILE 6 CO 0.76 0.22 -0.21 -0.78 -1.05 0.00 0.00 178.15 177.09 1bg4 h ASP 7 N 0.00 0.74 -0.53 2.16 3.58 -1.75 0.01 116.42 120.63 1bg4 h ASP 7 Ca -0.00 -0.43 -0.03 0.00 0.42 0.00 0.00 57.03 56.99 1bg4 h ASP 7 Cb 0.55 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 41.37 1bg4 h ASP 7 CO 0.03 1.01 0.21 0.00 -2.88 0.00 0.00 179.24 177.62 1bg4 h ALA 8 N 0.75 0.69 -0.33 -0.78 0.00 -1.69 -0.38 119.26 117.52 1bg4 h ALA 8 Ca 0.07 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1bg4 h ALA 8 Cb 0.76 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1bg4 h ALA 8 CO 0.06 0.30 -0.20 0.87 0.00 0.00 0.00 179.25 180.28 1bg4 h LYS 9 N 0.72 0.63 -0.37 0.00 1.79 -1.23 -2.37 116.57 115.74 1bg4 h LYS 9 Ca 0.18 -0.23 -0.10 0.00 -2.18 0.00 0.00 60.65 58.32 1bg4 h LYS 9 Cb 0.20 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 1bg4 h LYS 9 CO -0.01 0.79 -0.15 0.35 -1.08 0.00 0.00 179.45 179.35 1bg4 h PHE 10 N 0.56 0.87 -0.39 -1.35 3.57 -0.63 -2.96 116.94 116.61 1bg4 h PHE 10 Ca 0.09 -0.21 -0.02 0.00 3.53 0.00 0.00 57.97 61.35 1bg4 h PHE 10 Cb 0.66 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 1bg4 h PHE 10 CO 0.03 0.93 0.13 0.87 -2.23 0.00 0.00 178.31 178.04 1bg4 h LYS 11 N 0.55 0.55 0.00 1.11 1.57 -0.91 -1.70 116.57 117.74 1bg4 h LYS 11 Ca 0.09 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1bg4 h LYS 11 Cb 0.69 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.90 1bg4 h LYS 11 CO 0.05 0.47 -0.01 0.00 -0.57 0.00 0.00 179.45 179.39 1bg4 h ALA 12 N 1.61 1.15 -0.44 3.86 0.00 -1.25 -0.53 119.26 123.65 1bg4 h ALA 12 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1bg4 h ALA 12 Cb 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1bg4 h ALA 12 CO -0.01 0.01 0.00 0.72 0.00 0.00 0.00 179.25 179.97 1bg4 n HIS 13 N -3.31 0.73 -0.49 0.00 8.25 -0.65 -4.90 115.22 114.84 1bg4 n HIS 13 Ca -0.03 -0.33 0.00 0.00 -0.26 0.00 0.00 57.72 57.11 1bg4 n HIS 13 Cb 0.11 -0.06 0.00 0.00 1.12 0.00 0.00 29.99 31.15 1bg4 n HIS 13 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1bg4 n GLY 14 N 1.07 0.75 3.90 -1.41 0.00 -0.21 -5.07 105.19 104.22 1bg4 n GLY 14 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 1bg4 n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bg4 s LYS 15 N -0.51 3.61 0.11 1.61 -0.14 -1.19 -5.01 119.74 118.22 1bg4 s LYS 15 Ca 0.00 0.30 -0.01 0.00 -1.36 0.00 0.00 55.97 54.90 1bg4 s LYS 15 Cb 0.00 -2.36 -0.17 0.00 -1.68 0.00 0.00 37.83 33.62 1bg4 s LYS 15 CO 0.00 -0.18 1.24 0.87 -0.76 0.00 0.00 175.35 176.52 1bg4 h LYS 16 N 0.47 0.25 -1.38 1.68 1.57 -1.12 -3.37 116.57 114.66 1bg4 h LYS 16 Ca -0.47 -0.35 0.30 0.00 -1.87 0.00 0.00 60.65 58.27 1bg4 h LYS 16 Cb 1.20 0.12 -0.16 0.00 0.08 0.00 0.00 32.23 33.47 1bg4 h LYS 16 CO 0.62 1.11 0.85 1.52 -0.57 0.00 0.00 179.45 182.98 1bg4 s TYR 17 N -2.91 -0.07 -0.25 -1.35 -0.85 -1.22 -4.93 117.35 105.77 1bg4 s TYR 17 Ca -0.03 0.00 -0.02 0.00 -0.52 0.00 0.00 57.07 56.50 1bg4 s TYR 17 Cb 0.08 0.53 0.08 0.00 0.38 0.00 0.00 41.96 43.03 1bg4 s TYR 17 CO 0.86 -0.20 0.08 -1.17 -1.52 0.00 0.00 175.55 173.60 1bg4 s LEU 18 N -2.57 1.40 0.00 -3.49 0.20 -1.26 -2.78 118.68 110.18 1bg4 s LEU 18 Ca 0.12 -1.20 0.00 0.00 0.69 0.00 0.00 54.13 53.74 1bg4 s LEU 18 Cb 0.02 -0.63 0.00 0.00 -0.43 0.00 0.00 46.19 45.15 1bg4 s LEU 18 CO -0.04 -0.37 0.00 0.61 -0.29 0.00 0.00 176.35 176.25 1bg4 n GLY 19 N 5.03 4.72 0.00 7.98 0.00 0.96 -1.68 105.19 122.20 1bg4 n GLY 19 Ca -0.06 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.84 1bg4 n GLY 19 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1bg4 n THR 20 N -0.15 0.00 -4.48 2.61 5.66 -0.35 -0.84 114.28 116.72 1bg4 n THR 20 Ca 0.00 0.00 -0.23 0.00 -3.05 0.00 0.00 64.05 60.77 1bg4 n THR 20 Cb 0.00 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 68.67 1bg4 n THR 20 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 1bg4 s ILE 21 N -2.59 1.67 0.11 1.09 -4.36 -1.23 -1.81 121.20 114.08 1bg4 s ILE 21 Ca 0.00 -2.08 -0.25 0.00 -0.26 0.00 0.00 60.65 58.07 1bg4 s ILE 21 Cb 0.00 -2.67 0.08 0.00 1.25 0.00 0.00 42.46 41.12 1bg4 s ILE 21 CO 0.00 -0.15 1.12 -0.83 0.24 0.00 0.00 174.94 175.32 1bg4 s GLY 22 N -3.53 -0.02 -0.09 6.27 0.00 -0.96 -4.73 107.32 104.27 1bg4 s GLY 22 Ca 0.33 -0.11 -0.33 0.00 0.00 0.00 0.00 44.72 44.61 1bg4 s GLY 22 CO 0.15 2.87 1.39 0.99 0.00 0.00 0.00 173.10 178.49 1bg4 s ASP 23 N -3.44 -0.02 0.26 1.64 1.01 -1.26 -1.68 116.67 113.18 1bg4 s ASP 23 Ca 0.22 -0.04 -0.08 0.00 0.71 0.00 0.00 52.55 53.36 1bg4 s ASP 23 Cb -0.01 0.06 0.44 0.00 1.01 0.00 0.00 42.92 44.41 1bg4 s ASP 23 CO 0.03 -0.11 1.60 -0.61 0.21 0.00 0.00 175.17 176.29 1bg4 h GLN 24 N 2.00 0.02 0.94 8.23 4.15 -1.94 -2.03 115.11 126.48 1bg4 h GLN 24 Ca -0.30 -0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.08 1bg4 h GLN 24 Cb 1.19 -0.01 0.01 0.00 0.21 0.00 0.00 27.48 28.88 1bg4 h GLN 24 CO 0.28 0.02 -0.49 -0.92 -1.93 0.00 0.00 178.83 175.79 1bg4 h TYR 25 N 0.02 -1.27 0.00 3.99 3.20 -1.97 -2.36 116.97 118.59 1bg4 h TYR 25 Ca 0.44 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.27 1bg4 h TYR 25 Cb 0.73 0.43 -0.00 0.00 1.54 0.00 0.00 36.73 39.43 1bg4 h TYR 25 CO -0.58 -0.76 -0.08 1.79 -1.64 0.00 0.00 178.16 176.88 1bg4 h THR 26 N -1.31 0.46 -0.00 1.81 1.35 -1.91 0.13 112.91 113.45 1bg4 h THR 26 Ca -0.13 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 1bg4 h THR 26 Cb 1.01 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 68.69 1bg4 h THR 26 CO 0.19 0.08 -0.02 0.18 -0.25 0.00 0.00 175.52 175.70 1bg4 n LEU 27 N -3.59 0.02 0.00 3.87 4.77 -0.79 -4.02 117.00 117.27 1bg4 n LEU 27 Ca -0.02 0.47 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 1bg4 n LEU 27 Cb 0.20 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 1bg4 n LEU 27 CO 0.28 0.00 0.05 0.35 -1.33 0.00 0.00 177.39 176.75 1bg4 n THR 28 N -1.49 0.00 0.29 -5.08 -2.24 -0.52 -4.54 114.28 100.70 1bg4 n THR 28 Ca 0.07 -0.25 0.16 0.00 -2.27 0.00 0.00 64.05 61.76 1bg4 n THR 28 Cb 0.34 1.21 0.91 0.00 -2.10 0.00 0.00 70.33 70.68 1bg4 n THR 28 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1bg4 h LYS 29 N 0.00 0.00 0.00 -0.78 2.10 -0.92 -3.46 116.57 113.51 1bg4 h LYS 29 Ca 0.00 0.00 0.04 0.00 -2.00 0.00 0.00 60.65 58.69 1bg4 h LYS 29 Cb 0.10 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.43 1bg4 h LYS 29 CO 0.00 0.04 0.37 0.27 -2.00 0.00 0.00 179.45 178.13 1bg4 n ASN 30 N -3.52 -1.90 -0.01 7.07 0.23 -1.26 -5.07 115.26 110.80 1bg4 n ASN 30 Ca -0.02 -2.20 -0.09 0.00 -0.53 0.00 0.00 54.58 51.73 1bg4 n ASN 30 Cb 0.15 3.13 -0.14 0.00 -2.08 0.00 0.00 39.78 40.85 1bg4 n ASN 30 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 1bg4 h THR 31 N 1.90 0.90 -0.46 5.53 1.35 -1.95 -3.40 112.91 116.79 1bg4 h THR 31 Ca -0.28 -2.74 -0.12 0.00 -0.55 0.00 0.00 66.41 62.72 1bg4 h THR 31 Cb 1.12 2.46 -0.02 0.00 -1.73 0.00 0.00 68.15 69.98 1bg4 h THR 31 CO 0.37 0.54 -0.18 0.11 -0.25 0.00 0.00 175.52 176.11 1bg4 h LYS 32 N 0.00 0.89 0.51 4.72 1.57 -1.97 -2.99 116.57 119.31 1bg4 h LYS 32 Ca -0.27 -0.35 -0.03 0.00 -1.87 0.00 0.00 60.65 58.14 1bg4 h LYS 32 Cb 2.00 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 34.27 1bg4 h LYS 32 CO 0.08 0.99 -0.25 -0.97 -0.57 0.00 0.00 179.45 178.74 1bg4 h ASN 33 N 0.78 -0.59 0.11 0.86 -1.24 -1.87 0.12 115.58 113.75 1bg4 h ASN 33 Ca 0.11 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 57.07 1bg4 h ASN 33 Cb 0.71 0.15 -0.01 0.00 0.73 0.00 0.00 38.32 39.91 1bg4 h ASN 33 CO 0.05 -0.39 -0.17 1.55 -1.29 0.00 0.00 177.43 177.18 1bg4 h PRO 34 N -0.73 0.14 -0.56 6.67 0.13 -1.78 -1.84 132.00 134.03 1bg4 h PRO 34 Ca -0.07 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 64.96 1bg4 h PRO 34 Cb 0.55 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.64 1bg4 h PRO 34 CO 0.12 0.32 0.09 0.00 -0.23 0.00 0.00 178.00 178.29 1bg4 h ALA 35 N 1.69 0.74 -0.47 -0.56 0.00 -1.33 -1.39 119.26 117.95 1bg4 h ALA 35 Ca 0.03 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 1bg4 h ALA 35 Cb 0.39 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1bg4 h ALA 35 CO 0.03 0.49 0.12 0.82 0.00 0.00 0.00 179.25 180.70 1bg4 h ILE 36 N 0.82 1.23 -0.28 0.00 2.04 -0.38 -1.37 117.51 119.58 1bg4 h ILE 36 Ca 0.17 -0.81 0.01 0.00 1.00 0.00 0.00 64.86 65.23 1bg4 h ILE 36 Cb 0.41 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 1bg4 h ILE 36 CO 0.01 0.29 0.16 0.40 0.00 0.00 0.00 178.15 179.01 1bg4 h ILE 37 N 0.63 1.03 -0.27 -0.67 2.04 -1.12 0.53 117.51 119.68 1bg4 h ILE 37 Ca 0.15 -0.11 -0.12 0.00 1.00 0.00 0.00 64.86 65.78 1bg4 h ILE 37 Cb 0.31 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 1bg4 h ILE 37 CO 0.00 0.06 -0.33 0.11 0.00 0.00 0.00 178.15 177.99 1bg4 h LYS 38 N 0.33 0.57 0.11 2.37 1.57 -1.15 -2.91 116.57 117.46 1bg4 h LYS 38 Ca 0.11 -0.26 -0.31 0.00 -1.87 0.00 0.00 60.65 58.32 1bg4 h LYS 38 Cb 0.00 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1bg4 h LYS 38 CO -0.06 0.83 -1.59 0.00 -0.57 0.00 0.00 179.45 178.06 1bg4 h ALA 39 N 1.15 0.34 -0.00 3.86 0.00 -1.09 -3.42 119.26 120.09 1bg4 h ALA 39 Ca 0.06 -1.17 0.00 0.00 0.00 0.00 0.00 54.91 53.79 1bg4 h ALA 39 Cb 0.81 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1bg4 h ALA 39 CO 0.07 1.20 -0.24 -0.25 0.00 0.00 0.00 179.25 180.03 1bg4 n ASP 40 N -3.42 0.81 -4.28 0.00 8.00 0.16 -4.63 116.55 113.19 1bg4 n ASP 40 Ca -0.18 -0.91 -0.23 0.00 0.71 0.00 0.00 54.79 54.18 1bg4 n ASP 40 Cb 1.04 0.66 -0.12 0.00 -0.02 0.00 0.00 41.12 42.68 1bg4 n ASP 40 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1bg4 s PHE 41 N -1.37 1.74 -0.28 1.24 0.08 -1.10 -2.70 117.98 115.58 1bg4 s PHE 41 Ca 0.05 -0.43 0.06 0.00 0.12 0.00 0.00 56.93 56.73 1bg4 s PHE 41 Cb 0.06 -0.94 0.14 0.00 -0.57 0.00 0.00 43.02 41.71 1bg4 s PHE 41 CO 0.24 0.21 1.11 0.41 -0.10 0.00 0.00 175.22 177.09 1bg4 n GLY 42 N 0.97 3.17 3.37 4.36 0.00 -0.67 -4.69 105.19 111.70 1bg4 n GLY 42 Ca -0.19 -0.27 -0.14 0.00 0.00 0.00 0.00 46.02 45.42 1bg4 n GLY 42 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1bg4 s GLN 43 N -1.27 0.95 0.00 1.61 -0.44 -1.26 -1.63 119.66 117.62 1bg4 s GLN 43 Ca 0.12 -0.17 0.01 0.00 -2.50 0.00 0.00 55.36 52.82 1bg4 s GLN 43 Cb 0.08 0.43 -0.00 0.00 -1.64 0.00 0.00 33.01 31.88 1bg4 s GLN 43 CO 0.05 -0.32 -0.04 -0.51 0.50 0.00 0.00 175.29 174.97 1bg4 s LEU 44 N -1.73 2.03 -0.08 3.68 1.43 0.48 -1.21 118.68 123.29 1bg4 s LEU 44 Ca -0.08 -0.11 0.05 0.00 -1.03 0.00 0.00 54.13 52.96 1bg4 s LEU 44 Cb -0.01 -0.17 -0.00 0.00 0.03 0.00 0.00 46.19 46.03 1bg4 s LEU 44 CO 0.01 0.01 -0.23 -0.89 0.23 0.00 0.00 176.35 175.48 1bg4 s THR 45 N -0.22 1.99 0.05 5.49 2.01 -0.75 -1.60 115.64 122.61 1bg4 s THR 45 Ca -0.00 -1.00 -0.31 0.00 0.31 0.00 0.00 61.69 60.70 1bg4 s THR 45 Cb -0.02 -1.71 -0.06 0.00 0.01 0.00 0.00 72.50 70.72 1bg4 s THR 45 CO -0.00 0.55 1.38 -2.16 -0.69 0.00 0.00 174.62 173.70 1bg4 s PRO 46 N 0.18 4.31 0.35 4.92 0.04 -1.26 -2.27 135.00 141.27 1bg4 s PRO 46 Ca -0.13 2.00 0.03 0.00 0.04 0.00 0.00 61.00 62.93 1bg4 s PRO 46 Cb -0.16 -3.43 0.64 0.00 0.04 0.00 0.00 34.50 31.58 1bg4 s PRO 46 CO 0.07 -0.50 1.98 1.49 0.04 0.00 0.00 177.00 180.08 1bg4 h GLU 47 N 7.38 0.74 0.00 4.56 4.81 -1.69 -3.42 114.58 126.96 1bg4 h GLU 47 Ca -0.40 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1bg4 h GLU 47 Cb 1.19 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1bg4 h GLU 47 CO 0.88 0.55 0.00 0.09 -0.73 0.00 0.00 179.01 179.80 1bg4 n ASN 48 N -4.40 0.00 0.27 1.04 3.02 -1.26 -4.96 115.26 108.96 1bg4 n ASN 48 Ca 0.05 0.00 0.18 0.00 -0.03 0.00 0.00 54.58 54.78 1bg4 n ASN 48 Cb 0.09 0.00 0.91 0.00 -0.61 0.00 0.00 39.78 40.18 1bg4 n ASN 48 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1bg4 h SER 49 N 0.00 0.00 -0.03 6.41 4.64 -1.89 -2.28 113.55 120.40 1bg4 h SER 49 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1bg4 h SER 49 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1bg4 h SER 49 CO 0.00 0.00 -0.03 0.23 -0.87 0.00 0.00 176.83 176.16 1bg4 n MET 50 N -3.33 2.24 -1.25 4.77 2.81 -1.26 -4.11 117.12 116.99 1bg4 n MET 50 Ca -0.00 -1.84 -0.30 0.00 -1.81 0.00 0.00 57.70 53.75 1bg4 n MET 50 Cb 0.31 -1.46 0.11 0.00 -0.71 0.00 0.00 33.22 31.46 1bg4 n MET 50 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1bg4 s LYS 51 N -2.03 1.83 0.22 0.03 1.02 -0.86 -3.90 119.74 116.05 1bg4 s LYS 51 Ca 0.28 1.00 -0.09 0.00 0.02 0.00 0.00 55.97 57.18 1bg4 s LYS 51 Cb 0.20 -1.86 0.25 0.00 -0.52 0.00 0.00 37.83 35.89 1bg4 s LYS 51 CO 0.32 -1.89 1.83 2.35 -0.92 0.00 0.00 175.35 177.04 1bg4 h TRP 52 N -1.30 0.80 -0.22 3.18 2.91 -1.74 -1.14 115.95 118.43 1bg4 h TRP 52 Ca -0.46 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 59.57 1bg4 h TRP 52 Cb 1.25 -0.25 -0.01 0.00 -0.51 0.00 0.00 29.16 29.64 1bg4 h TRP 52 CO 0.51 0.41 0.10 0.38 -1.03 0.00 0.00 178.44 178.81 1bg4 h ASP 53 N 0.81 0.27 0.86 2.65 2.03 -1.54 -1.14 116.42 120.36 1bg4 h ASP 53 Ca 0.31 -0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.59 1bg4 h ASP 53 Cb 0.13 -0.07 0.00 0.00 -0.83 0.00 0.00 39.33 38.56 1bg4 h ASP 53 CO -0.16 0.25 -0.84 0.00 -1.03 0.00 0.00 179.24 177.46 1bg4 h ALA 54 N 1.80 0.51 0.00 4.15 0.00 -1.66 -3.34 119.26 120.72 1bg4 h ALA 54 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.73 1bg4 h ALA 54 Cb 0.06 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1bg4 h ALA 54 CO -0.01 0.00 -1.96 0.25 0.00 0.00 0.00 179.25 177.53 1bg4 n THR 55 N -2.33 0.96 -3.24 0.00 -2.24 -0.50 -4.52 114.28 102.42 1bg4 n THR 55 Ca 0.02 -0.56 -0.25 0.00 -2.27 0.00 0.00 64.05 60.99 1bg4 n THR 55 Cb 0.49 -0.70 -0.08 0.00 -2.10 0.00 0.00 70.33 67.94 1bg4 n THR 55 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1bg4 n GLU 56 N -2.59 0.63 0.26 -0.78 2.13 -0.45 -0.86 120.64 118.99 1bg4 n GLU 56 Ca -0.24 -3.24 0.10 0.00 0.66 0.00 0.00 57.16 54.44 1bg4 n GLU 56 Cb 0.94 -1.33 0.70 0.00 0.27 0.00 0.00 31.44 32.01 1bg4 n GLU 56 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 1bg4 h PRO 57 N 4.35 0.00 -5.11 5.31 0.13 -1.68 -3.43 132.00 131.57 1bg4 h PRO 57 Ca 0.11 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.88 1bg4 h PRO 57 Cb 0.88 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 31.82 1bg4 h PRO 57 CO 0.45 0.07 -0.75 -0.80 -0.23 0.00 0.00 178.00 176.74 1bg4 s ASN 58 N -6.62 1.54 -0.25 1.44 0.01 -1.25 -4.90 114.94 104.91 1bg4 s ASN 58 Ca -0.04 -0.71 -0.35 0.00 -0.71 0.00 0.00 52.86 51.04 1bg4 s ASN 58 Cb 0.15 -0.02 -0.12 0.00 0.41 0.00 0.00 41.25 41.68 1bg4 s ASN 58 CO 0.63 -0.17 2.02 -1.14 -1.51 0.00 0.00 177.10 176.92 1bg4 n ARG 59 N 0.91 1.48 -0.99 -0.60 0.63 -1.26 -1.13 116.66 115.70 1bg4 n ARG 59 Ca -0.18 0.48 0.00 0.00 -0.92 0.00 0.00 57.85 57.23 1bg4 n ARG 59 Cb 0.56 -2.51 0.00 0.00 0.45 0.00 0.00 32.46 30.96 1bg4 n ARG 59 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1bg4 n GLY 60 N 5.42 0.32 3.12 5.14 0.00 -1.26 -4.99 105.19 112.94 1bg4 n GLY 60 Ca 0.32 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.01 1bg4 n GLY 60 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bg4 s GLN 61 N -0.76 2.50 -0.01 1.61 -0.21 -0.28 -5.11 119.66 117.41 1bg4 s GLN 61 Ca 0.00 -1.18 -0.02 0.00 0.02 0.00 0.00 55.36 54.18 1bg4 s GLN 61 Cb 0.00 -2.90 -0.04 0.00 1.00 0.00 0.00 33.01 31.07 1bg4 s GLN 61 CO 0.00 -0.49 0.16 -0.06 -2.12 0.00 0.00 175.29 172.78 1bg4 s PHE 62 N 1.20 3.49 -0.29 0.91 0.40 -1.26 -3.59 117.98 118.83 1bg4 s PHE 62 Ca -0.04 0.32 0.00 0.00 -0.60 0.00 0.00 56.93 56.61 1bg4 s PHE 62 Cb -0.18 -1.81 0.09 0.00 0.51 0.00 0.00 43.02 41.63 1bg4 s PHE 62 CO -0.06 0.63 0.06 0.95 0.70 0.00 0.00 175.22 177.49 1bg4 s THR 63 N -1.30 1.26 -0.80 0.64 -4.23 -0.04 -4.98 115.64 106.20 1bg4 s THR 63 Ca 0.26 -1.50 0.15 0.00 -1.18 0.00 0.00 61.69 59.42 1bg4 s THR 63 Cb -0.12 -1.86 0.49 0.00 1.34 0.00 0.00 72.50 72.35 1bg4 s THR 63 CO 0.18 -0.52 1.41 0.49 -0.54 0.00 0.00 174.62 175.64 1bg4 n PHE 64 N 4.70 0.88 0.11 3.99 3.72 -1.26 -4.26 117.46 125.33 1bg4 n PHE 64 Ca -0.03 -0.64 -0.12 0.00 -0.05 0.00 0.00 57.45 56.61 1bg4 n PHE 64 Cb 0.43 -0.16 -0.06 0.00 -0.94 0.00 0.00 39.48 38.74 1bg4 n PHE 64 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1bg4 h SER 65 N 2.56 -0.41 -0.53 4.37 0.87 -1.95 0.44 113.55 118.90 1bg4 h SER 65 Ca 0.00 0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.54 1bg4 h SER 65 Cb 1.13 0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 63.22 1bg4 h SER 65 CO 0.12 -0.22 0.07 1.23 -0.53 0.00 0.00 176.83 177.50 1bg4 h GLY 66 N -0.31 0.96 1.47 5.77 0.00 -1.89 -2.08 103.07 106.98 1bg4 h GLY 66 Ca 0.01 -0.65 -0.13 0.00 0.00 0.00 0.00 47.33 46.57 1bg4 h GLY 66 CO -0.06 0.60 -0.36 1.48 0.00 0.00 0.00 176.54 178.20 1bg4 h SER 67 N 0.77 0.61 -0.55 0.19 4.64 -1.68 -2.52 113.55 115.01 1bg4 h SER 67 Ca 0.16 -0.26 0.01 0.00 -0.47 0.00 0.00 61.79 61.24 1bg4 h SER 67 Cb 0.42 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.31 1bg4 h SER 67 CO 0.01 0.92 0.35 0.44 -0.87 0.00 0.00 176.83 177.68 1bg4 h ASP 68 N 0.49 0.60 -0.20 4.97 3.32 -0.75 -0.90 116.42 123.96 1bg4 h ASP 68 Ca 0.05 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1bg4 h ASP 68 Cb 0.85 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 1bg4 h ASP 68 CO 0.07 0.43 0.13 0.22 -1.72 0.00 0.00 179.24 178.37 1bg4 h TYR 69 N 0.71 0.25 -0.07 4.55 3.20 -1.10 0.58 116.97 125.10 1bg4 h TYR 69 Ca 0.21 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.08 1bg4 h TYR 69 Cb -0.04 -0.08 -0.00 0.00 1.54 0.00 0.00 36.73 38.14 1bg4 h TYR 69 CO -0.05 0.18 0.03 1.25 -1.64 0.00 0.00 178.16 177.93 1bg4 h LEU 70 N 0.26 0.09 -0.43 2.82 7.12 -1.20 -0.28 115.31 123.69 1bg4 h LEU 70 Ca 0.07 -0.12 0.01 0.00 0.13 0.00 0.00 57.88 57.97 1bg4 h LEU 70 Cb -0.01 -0.02 -0.03 0.00 -0.53 0.00 0.00 40.66 40.07 1bg4 h LEU 70 CO -0.01 0.18 0.27 0.58 -0.13 0.00 0.00 178.44 179.33 1bg4 h VAL 71 N -0.02 1.07 -0.55 1.05 2.07 -1.06 -0.95 116.25 117.87 1bg4 h VAL 71 Ca 0.02 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.31 1bg4 h VAL 71 Cb 0.12 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 1bg4 h VAL 71 CO -0.00 0.10 0.13 0.78 0.02 0.00 0.00 177.57 178.60 1bg4 h ASN 72 N 0.54 0.78 -0.04 0.57 2.35 -0.76 0.35 115.58 119.37 1bg4 h ASN 72 Ca 0.17 -0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 1bg4 h ASN 72 Cb -0.02 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.15 1bg4 h ASN 72 CO -0.06 0.77 -0.01 0.15 -1.65 0.00 0.00 177.43 176.63 1bg4 h PHE 73 N 0.81 0.09 0.30 1.19 3.57 -0.59 -0.44 116.94 121.87 1bg4 h PHE 73 Ca 0.18 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.66 1bg4 h PHE 73 Cb 0.30 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 1bg4 h PHE 73 CO 0.02 0.41 -0.26 0.00 -2.23 0.00 0.00 178.31 176.25 1bg4 h ALA 74 N 0.67 -0.56 -0.78 2.41 0.00 -1.00 -2.29 119.26 117.70 1bg4 h ALA 74 Ca 0.01 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1bg4 h ALA 74 Cb 0.38 0.35 -0.05 0.00 0.00 0.00 0.00 17.79 18.47 1bg4 h ALA 74 CO 0.00 -0.84 0.49 0.37 0.00 0.00 0.00 179.25 179.27 1bg4 h GLN 75 N -0.57 0.92 0.00 0.00 -0.00 -0.97 -0.77 115.11 113.72 1bg4 h GLN 75 Ca -0.02 -0.06 0.00 0.00 -0.00 0.00 0.00 58.65 58.58 1bg4 h GLN 75 Cb 0.51 -0.21 0.00 0.00 0.00 0.00 0.00 27.48 27.78 1bg4 h GLN 75 CO -0.02 0.61 0.00 0.43 0.00 0.00 0.00 178.83 179.84 1bg4 n SER 76 N -4.62 0.14 -0.67 -0.69 7.64 -0.17 -3.11 113.62 112.13 1bg4 n SER 76 Ca 0.10 0.54 0.06 0.00 1.01 0.00 0.00 58.87 60.57 1bg4 n SER 76 Cb 0.11 -0.56 0.14 0.00 -1.01 0.00 0.00 64.21 62.89 1bg4 n SER 76 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1bg4 n ASN 77 N -1.65 1.56 -2.51 6.43 3.02 -0.52 -5.00 115.26 116.58 1bg4 n ASN 77 Ca 0.03 -3.20 -0.21 0.00 -0.03 0.00 0.00 54.58 51.17 1bg4 n ASN 77 Cb 0.17 -0.44 -0.00 0.00 -0.61 0.00 0.00 39.78 38.90 1bg4 n ASN 77 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bg4 n GLY 78 N -0.76 -0.50 3.70 7.41 0.00 -1.00 -4.99 105.19 109.04 1bg4 n GLY 78 Ca 0.14 0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 1bg4 n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bg4 s LYS 79 N -5.16 3.68 0.69 1.61 -0.14 -0.41 -4.91 119.74 115.10 1bg4 s LYS 79 Ca 0.05 -0.31 -0.14 0.00 -1.36 0.00 0.00 55.97 54.21 1bg4 s LYS 79 Cb -0.02 -3.13 0.02 0.00 -1.68 0.00 0.00 37.83 33.01 1bg4 s LYS 79 CO 0.06 0.47 1.12 -0.51 -0.76 0.00 0.00 175.35 175.73 1bg4 s LEU 80 N -0.17 3.32 -0.04 3.17 1.43 -0.64 -4.24 118.68 121.50 1bg4 s LEU 80 Ca 0.08 2.03 0.05 0.00 -1.03 0.00 0.00 54.13 55.25 1bg4 s LEU 80 Cb -0.12 -4.55 -0.00 0.00 0.03 0.00 0.00 46.19 41.54 1bg4 s LEU 80 CO 0.01 -1.80 -0.18 -0.63 0.23 0.00 0.00 176.35 173.98 1bg4 s ILE 81 N -2.37 1.49 -0.31 -0.59 1.01 -1.26 -0.38 121.20 118.78 1bg4 s ILE 81 Ca 0.67 -0.75 -0.05 0.00 0.00 0.00 0.00 60.65 60.52 1bg4 s ILE 81 Cb -0.21 -1.27 0.03 0.00 0.01 0.00 0.00 42.46 41.02 1bg4 s ILE 81 CO 0.44 0.43 0.05 -0.13 0.00 0.00 0.00 174.94 175.73 1bg4 s ARG 82 N 0.00 2.75 0.30 2.79 0.52 -0.63 -1.23 118.95 123.46 1bg4 s ARG 82 Ca -0.03 -1.07 -0.29 0.00 -0.52 0.00 0.00 55.73 53.81 1bg4 s ARG 82 Cb -0.11 -3.31 -0.10 0.00 0.52 0.00 0.00 34.95 31.94 1bg4 s ARG 82 CO 0.02 -0.56 1.30 0.20 0.02 0.00 0.00 175.30 176.28 1bg4 s GLY 83 N 1.39 2.87 -0.23 -3.53 0.00 0.82 -4.13 107.32 104.51 1bg4 s GLY 83 Ca -0.01 1.21 -0.15 0.00 0.00 0.00 0.00 44.72 45.77 1bg4 s GLY 83 CO 0.01 1.92 0.57 -1.58 0.00 0.00 0.00 173.10 174.03 1bg4 s HIS 84 N -0.86 -0.81 0.11 1.90 5.04 -1.26 -0.81 115.29 118.60 1bg4 s HIS 84 Ca 0.50 1.71 0.05 0.00 -1.54 0.00 0.00 55.06 55.78 1bg4 s HIS 84 Cb -0.39 0.41 -0.04 0.00 0.04 0.00 0.00 32.58 32.61 1bg4 s HIS 84 CO 0.49 -0.41 -0.12 -0.08 -2.34 0.00 0.00 174.74 172.28 1bg4 s THR 85 N 1.21 1.09 0.01 0.89 -1.32 -1.25 -3.58 115.64 112.68 1bg4 s THR 85 Ca -0.07 -1.66 -0.19 0.00 -1.21 0.00 0.00 61.69 58.56 1bg4 s THR 85 Cb -0.06 -1.42 -0.28 0.00 -1.51 0.00 0.00 72.50 69.24 1bg4 s THR 85 CO -0.12 -0.50 1.04 -0.07 -2.21 0.00 0.00 174.62 172.76 1bg4 h LEU 86 N 3.56 0.64 -7.70 9.08 3.38 -1.41 -3.38 115.31 119.48 1bg4 h LEU 86 Ca -0.38 -0.84 -0.53 0.00 0.09 0.00 0.00 57.88 56.21 1bg4 h LEU 86 Cb 1.19 -0.20 -0.37 0.00 0.09 0.00 0.00 40.66 41.37 1bg4 h LEU 86 CO 0.52 1.42 -0.80 -0.69 0.09 0.00 0.00 178.44 178.97 1bg4 s VAL 87 N -2.89 1.05 -0.16 1.22 1.01 -0.25 -4.84 120.40 115.54 1bg4 s VAL 87 Ca -0.12 -0.32 -0.26 0.00 0.00 0.00 0.00 61.98 61.28 1bg4 s VAL 87 Cb 0.03 -1.07 0.07 0.00 0.00 0.00 0.00 36.38 35.41 1bg4 s VAL 87 CO 0.87 0.36 0.66 0.86 0.00 0.00 0.00 175.10 177.85 1bg4 s TRP 88 N 1.70 -0.69 -0.22 5.22 -0.00 -1.26 -1.20 118.94 122.49 1bg4 s TRP 88 Ca 0.05 1.47 0.25 0.00 -0.00 0.00 0.00 56.10 57.86 1bg4 s TRP 88 Cb -0.13 0.31 0.64 0.00 -0.00 0.00 0.00 33.47 34.29 1bg4 s TRP 88 CO -0.08 -0.47 1.71 1.12 -0.00 0.00 0.00 176.95 179.23 1bg4 h HIS 89 N 4.15 0.00 -2.70 5.86 2.07 -1.90 -3.43 115.15 119.20 1bg4 h HIS 89 Ca -0.28 0.00 -0.52 0.00 -2.85 0.00 0.00 60.37 56.72 1bg4 h HIS 89 Cb 1.15 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.12 1bg4 h HIS 89 CO 0.39 0.07 -0.35 -1.12 -3.07 0.00 0.00 177.93 173.85 1bg4 s SER 90 N -6.10 6.36 -1.54 3.10 0.01 -1.26 -4.38 113.70 109.89 1bg4 s SER 90 Ca 0.05 0.32 -0.13 0.00 1.31 0.00 0.00 55.95 57.51 1bg4 s SER 90 Cb 0.07 -1.98 0.09 0.00 0.21 0.00 0.00 66.02 64.41 1bg4 s SER 90 CO 0.64 -0.06 0.87 0.00 0.41 0.00 0.00 173.24 175.10 1bg4 n GLN 91 N -0.89 -4.77 -4.59 12.44 6.02 -1.26 -4.89 117.38 119.43 1bg4 n GLN 91 Ca -0.06 0.53 -0.33 0.00 -0.01 0.00 0.00 57.00 57.13 1bg4 n GLN 91 Cb 0.55 -5.30 -0.15 0.00 1.02 0.00 0.00 30.24 26.36 1bg4 n GLN 91 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1bg4 s LEU 92 N -7.20 2.68 0.53 1.08 2.96 -1.26 -1.44 118.68 116.02 1bg4 s LEU 92 Ca 0.57 -0.37 -0.22 0.00 -0.22 0.00 0.00 54.13 53.88 1bg4 s LEU 92 Cb -0.29 -1.61 -0.06 0.00 0.50 0.00 0.00 46.19 44.72 1bg4 s LEU 92 CO 0.86 0.12 1.32 -2.65 -1.32 0.00 0.00 176.35 174.67 1bg4 n PRO 93 N 3.83 1.70 0.22 0.98 -0.02 -1.26 -4.85 135.00 135.59 1bg4 n PRO 93 Ca -0.18 0.62 0.13 0.00 -2.02 0.00 0.00 63.50 62.05 1bg4 n PRO 93 Cb 0.52 -2.51 0.75 0.00 -0.02 0.00 0.00 33.50 32.24 1bg4 n PRO 93 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1bg4 h GLY 94 N 1.51 0.00 2.00 -1.23 0.00 -1.99 -1.26 103.07 102.10 1bg4 h GLY 94 Ca -0.50 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.81 1bg4 h GLY 94 CO 0.57 0.00 -0.10 0.11 0.00 0.00 0.00 176.54 177.13 1bg4 h TRP 95 N 0.00 0.00 0.00 5.60 5.08 -1.90 -2.07 115.95 122.66 1bg4 h TRP 95 Ca 0.06 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 59.95 1bg4 h TRP 95 Cb 0.26 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.41 1bg4 h TRP 95 CO 0.00 0.10 -0.44 0.28 -1.28 0.00 0.00 178.44 177.09 1bg4 h VAL 96 N 0.00 1.49 0.00 0.12 2.07 -1.59 -3.36 116.25 114.98 1bg4 h VAL 96 Ca -0.00 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 65.23 1bg4 h VAL 96 Cb 0.20 2.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.96 1bg4 h VAL 96 CO 0.01 0.51 0.00 0.77 0.02 0.00 0.00 177.57 178.88 1bg4 h SER 97 N -0.99 0.00 0.18 0.57 4.64 -1.39 -2.14 113.55 114.41 1bg4 h SER 97 Ca -0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 1bg4 h SER 97 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1bg4 h SER 97 CO -0.07 0.00 -0.27 -1.54 -0.87 0.00 0.00 176.83 174.08 1bg4 n SER 98 N -2.52 1.23 -4.73 4.97 3.41 -0.79 -4.89 113.62 110.30 1bg4 n SER 98 Ca -0.00 -1.04 -0.41 0.00 -0.26 0.00 0.00 58.87 57.15 1bg4 n SER 98 Cb 0.15 0.17 -0.03 0.00 -0.26 0.00 0.00 64.21 64.25 1bg4 n SER 98 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1bg4 s ILE 99 N -2.45 3.51 -0.06 -1.33 1.01 -0.81 -4.93 121.20 116.14 1bg4 s ILE 99 Ca 0.25 1.21 0.03 0.00 0.00 0.00 0.00 60.65 62.13 1bg4 s ILE 99 Cb 0.19 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.85 1bg4 s ILE 99 CO 0.51 0.16 0.08 0.35 0.00 0.00 0.00 174.94 176.05 1bg4 n THR 100 N 2.91 0.00 -3.16 2.92 -2.24 -1.26 -4.96 114.28 108.49 1bg4 n THR 100 Ca 0.06 -0.23 -0.39 0.00 -2.27 0.00 0.00 64.05 61.22 1bg4 n THR 100 Cb 0.44 0.68 -0.06 0.00 -2.10 0.00 0.00 70.33 69.30 1bg4 n THR 100 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1bg4 s ASP 101 N -1.84 6.75 0.11 3.42 2.15 -1.26 -4.94 116.67 121.06 1bg4 s ASP 101 Ca -0.00 0.91 -0.30 0.00 0.43 0.00 0.00 52.55 53.59 1bg4 s ASP 101 Cb 0.02 -2.34 -0.09 0.00 -0.30 0.00 0.00 42.92 40.21 1bg4 s ASP 101 CO 0.11 -0.15 1.60 0.50 -0.17 0.00 0.00 175.17 177.06 1bg4 h LYS 102 N 7.09 -0.58 -0.35 4.34 3.64 -1.95 -1.15 116.57 127.60 1bg4 h LYS 102 Ca -0.37 0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.03 1bg4 h LYS 102 Cb 1.17 0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 33.10 1bg4 h LYS 102 CO 0.76 -0.39 0.11 -0.91 -2.27 0.00 0.00 179.45 176.76 1bg4 h ASN 103 N -0.60 0.46 -0.31 4.20 2.35 -1.94 -0.44 115.58 119.30 1bg4 h ASN 103 Ca 0.03 -0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.68 1bg4 h ASN 103 Cb 0.63 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 1bg4 h ASN 103 CO -0.22 0.44 -0.01 0.74 -1.65 0.00 0.00 177.43 176.73 1bg4 h THR 104 N 0.50 1.26 -0.41 2.81 2.02 -1.91 -1.17 112.91 116.02 1bg4 h THR 104 Ca 0.12 -0.96 -0.08 0.00 0.77 0.00 0.00 66.41 66.26 1bg4 h THR 104 Cb 0.15 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.82 1bg4 h THR 104 CO -0.01 0.31 -0.07 0.25 0.37 0.00 0.00 175.52 176.38 1bg4 h LEU 105 N 0.34 0.68 -0.42 2.58 5.85 -0.54 -1.45 115.31 122.35 1bg4 h LEU 105 Ca 0.09 -0.18 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 1bg4 h LEU 105 Cb 0.45 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1bg4 h LEU 105 CO 0.02 0.79 0.14 0.40 -0.34 0.00 0.00 178.44 179.44 1bg4 h ILE 106 N 0.65 1.21 -0.61 4.05 2.04 -0.94 0.45 117.51 124.36 1bg4 h ILE 106 Ca 0.12 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.27 1bg4 h ILE 106 Cb 0.50 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 1bg4 h ILE 106 CO 0.03 0.25 0.35 -1.28 0.00 0.00 0.00 178.15 177.50 1bg4 h SER 107 N 0.53 0.74 -0.25 1.72 0.87 -0.83 -0.38 113.55 115.95 1bg4 h SER 107 Ca 0.14 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 1bg4 h SER 107 Cb 0.25 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 1bg4 h SER 107 CO -0.01 0.60 0.10 0.58 -0.53 0.00 0.00 176.83 177.58 1bg4 h VAL 108 N 0.82 1.17 -0.28 2.23 2.07 -1.04 -1.31 116.25 119.92 1bg4 h VAL 108 Ca 0.22 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.23 1bg4 h VAL 108 Cb 0.00 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1bg4 h VAL 108 CO -0.04 0.17 0.17 0.25 0.02 0.00 0.00 177.57 178.14 1bg4 h LEU 109 N 0.26 0.27 -0.75 2.57 5.85 -0.62 -0.33 115.31 122.56 1bg4 h LEU 109 Ca 0.08 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.73 1bg4 h LEU 109 Cb 0.18 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 1bg4 h LEU 109 CO -0.01 0.20 0.07 0.11 -0.34 0.00 0.00 178.44 178.47 1bg4 h LYS 110 N 0.34 1.02 -0.36 1.25 1.57 -0.96 -1.62 116.57 117.81 1bg4 h LYS 110 Ca 0.11 -0.28 -0.13 0.00 -1.87 0.00 0.00 60.65 58.48 1bg4 h LYS 110 Cb -0.01 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1bg4 h LYS 110 CO -0.05 0.96 -0.29 -0.97 -0.57 0.00 0.00 179.45 178.53 1bg4 h ASN 111 N 0.95 0.79 0.03 0.86 -1.24 -0.93 0.58 115.58 116.61 1bg4 h ASN 111 Ca 0.18 -0.31 -0.00 0.00 0.71 0.00 0.00 56.30 56.88 1bg4 h ASN 111 Cb 0.46 -0.22 0.00 0.00 0.73 0.00 0.00 38.32 39.29 1bg4 h ASN 111 CO 0.02 1.03 -0.01 -0.74 -1.29 0.00 0.00 177.43 176.43 1bg4 h HIS 112 N 0.65 -0.03 -0.02 0.67 2.76 -0.80 -0.64 115.15 117.75 1bg4 h HIS 112 Ca 0.08 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.26 1bg4 h HIS 112 Cb 0.81 0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.77 1bg4 h HIS 112 CO 0.04 0.20 -0.03 0.82 -1.30 0.00 0.00 177.93 177.66 1bg4 h ILE 113 N -0.27 0.91 -0.14 6.26 2.04 -1.20 -2.04 117.51 123.08 1bg4 h ILE 113 Ca -0.00 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.87 1bg4 h ILE 113 Cb 0.25 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1bg4 h ILE 113 CO 0.01 0.00 0.06 0.74 0.00 0.00 0.00 178.15 178.96 1bg4 h THR 114 N -0.05 0.99 -0.21 -0.27 2.02 -0.84 -0.98 112.91 113.57 1bg4 h THR 114 Ca 0.02 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 1bg4 h THR 114 Cb 0.07 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1bg4 h THR 114 CO -0.05 0.02 0.06 0.74 0.37 0.00 0.00 175.52 176.67 1bg4 h THR 115 N 0.14 1.19 -0.22 3.16 2.02 -1.04 -0.55 112.91 117.61 1bg4 h THR 115 Ca 0.06 -0.61 -0.03 0.00 0.77 0.00 0.00 66.41 66.60 1bg4 h THR 115 Cb 0.02 1.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 1bg4 h THR 115 CO -0.05 0.19 0.02 0.58 0.37 0.00 0.00 175.52 176.63 1bg4 h VAL 116 N 0.16 1.24 -0.45 3.16 2.07 -1.32 -2.65 116.25 118.45 1bg4 h VAL 116 Ca 0.07 -0.82 -0.10 0.00 0.82 0.00 0.00 66.70 66.67 1bg4 h VAL 116 Cb 0.24 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 1bg4 h VAL 116 CO -0.00 0.25 -0.12 0.24 0.02 0.00 0.00 177.57 177.96 1bg4 h MET 117 N 0.15 0.82 -0.64 1.57 2.07 -1.16 -2.95 114.93 114.79 1bg4 h MET 117 Ca 0.06 -0.29 -0.04 0.00 -2.07 0.00 0.00 59.70 57.36 1bg4 h MET 117 Cb 0.36 -0.06 -0.03 0.00 -1.87 0.00 0.00 31.60 30.00 1bg4 h MET 117 CO 0.01 0.90 0.23 1.15 1.07 0.00 0.00 176.91 180.27 1bg4 h THR 118 N 0.74 1.23 -0.01 2.22 2.02 -1.05 -0.64 112.91 117.42 1bg4 h THR 118 Ca 0.12 -0.77 -0.03 0.00 0.77 0.00 0.00 66.41 66.51 1bg4 h THR 118 Cb 0.62 0.50 -0.00 0.00 -1.74 0.00 0.00 68.15 67.52 1bg4 h THR 118 CO 0.04 0.30 -0.11 -0.09 0.37 0.00 0.00 175.52 176.03 1bg4 h ARG 119 N 0.94 0.02 -0.10 6.66 2.43 -1.29 -2.62 114.38 120.41 1bg4 h ARG 119 Ca 0.21 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 1bg4 h ARG 119 Cb 0.23 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1bg4 h ARG 119 CO -0.01 0.13 -0.09 0.66 -1.51 0.00 0.00 179.97 179.15 1bg4 n TYR 120 N -4.40 0.35 -1.67 2.20 4.01 -1.01 -5.05 117.16 111.60 1bg4 n TYR 120 Ca -0.02 -1.11 -0.51 0.00 -0.16 0.00 0.00 57.90 56.09 1bg4 n TYR 120 Cb 0.19 -0.24 -0.06 0.00 -0.31 0.00 0.00 39.34 38.92 1bg4 n TYR 120 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1bg4 n LYS 121 N -1.13 1.68 0.00 -0.72 4.81 -0.28 -0.97 118.16 121.55 1bg4 n LYS 121 Ca 0.20 0.61 0.00 0.00 -0.87 0.00 0.00 58.31 58.25 1bg4 n LYS 121 Cb 0.75 -2.36 0.00 0.00 0.02 0.00 0.00 35.03 33.45 1bg4 n LYS 121 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1bg4 n GLY 122 N 3.73 2.10 0.41 3.14 0.00 -1.26 -4.84 105.19 108.48 1bg4 n GLY 122 Ca 0.21 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.34 1bg4 n GLY 122 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bg4 n LYS 123 N -2.00 1.15 -3.83 1.61 5.02 -0.14 -4.93 118.16 115.04 1bg4 n LYS 123 Ca 0.00 -0.84 -0.36 0.00 -2.02 0.00 0.00 58.31 55.09 1bg4 n LYS 123 Cb 0.00 -1.45 -0.12 0.00 -0.02 0.00 0.00 35.03 33.44 1bg4 n LYS 123 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1bg4 s ILE 124 N -2.46 4.47 0.01 -0.18 -1.09 -1.23 -4.51 121.20 116.20 1bg4 s ILE 124 Ca 0.16 -0.13 -0.25 0.00 -2.23 0.00 0.00 60.65 58.21 1bg4 s ILE 124 Cb 0.17 -3.07 -0.18 0.00 -1.58 0.00 0.00 42.46 37.80 1bg4 s ILE 124 CO 0.59 0.36 1.34 0.22 -1.23 0.00 0.00 174.94 176.22 1bg4 h TYR 125 N 7.85 -0.14 -3.39 3.97 3.20 -1.53 -3.38 116.97 123.55 1bg4 h TYR 125 Ca -0.37 -0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.35 1bg4 h TYR 125 Cb 1.18 0.05 -0.22 0.00 1.54 0.00 0.00 36.73 39.27 1bg4 h TYR 125 CO 0.65 0.20 -0.46 0.00 -1.64 0.00 0.00 178.16 176.91 1bg4 s ALA 126 N -4.82 -0.43 -0.10 1.82 0.00 -1.19 -1.26 121.76 115.79 1bg4 s ALA 126 Ca -0.15 0.08 0.03 0.00 0.00 0.00 0.00 51.96 51.92 1bg4 s ALA 126 Cb 0.03 0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.14 1bg4 s ALA 126 CO 0.62 -0.19 -0.18 -1.58 0.00 0.00 0.00 175.76 174.43 1bg4 s TRP 127 N -1.04 2.66 -0.98 0.00 0.52 -0.03 -0.13 118.94 119.93 1bg4 s TRP 127 Ca -0.11 -0.70 -0.22 0.00 0.02 0.00 0.00 56.10 55.09 1bg4 s TRP 127 Cb -0.06 -1.73 0.08 0.00 -1.15 0.00 0.00 33.47 30.60 1bg4 s TRP 127 CO 0.02 -0.22 1.33 -0.51 0.02 0.00 0.00 176.95 177.59 1bg4 s ASP 128 N 0.11 6.53 0.04 2.95 1.01 0.01 -0.98 116.67 126.34 1bg4 s ASP 128 Ca -0.09 -1.63 -0.25 0.00 0.71 0.00 0.00 52.55 51.29 1bg4 s ASP 128 Cb -0.15 -2.51 -0.17 0.00 1.01 0.00 0.00 42.92 41.09 1bg4 s ASP 128 CO 0.06 -1.36 1.50 0.58 0.21 0.00 0.00 175.17 176.15 1bg4 h VAL 129 N 6.45 0.97 -4.07 -1.27 2.07 -1.44 -1.77 116.25 117.19 1bg4 h VAL 129 Ca 0.17 -0.43 -0.69 0.00 0.82 0.00 0.00 66.70 66.58 1bg4 h VAL 129 Cb 1.02 1.24 -0.28 0.00 -1.52 0.00 0.00 31.29 31.75 1bg4 h VAL 129 CO 1.32 0.10 -0.84 -0.76 0.02 0.00 0.00 177.57 177.41 1bg4 s LEU 130 N -9.78 2.35 -0.06 2.57 1.43 -1.18 -1.09 118.68 112.93 1bg4 s LEU 130 Ca -0.14 -0.38 0.03 0.00 -1.03 0.00 0.00 54.13 52.60 1bg4 s LEU 130 Cb 0.04 -1.45 0.01 0.00 0.03 0.00 0.00 46.19 44.82 1bg4 s LEU 130 CO 0.64 0.28 -0.13 0.21 0.23 0.00 0.00 176.35 177.58 1bg4 s ASN 131 N -0.39 1.87 -1.30 2.29 2.47 -0.34 -0.94 114.94 118.60 1bg4 s ASN 131 Ca 0.03 -0.31 -0.09 0.00 0.42 0.00 0.00 52.86 52.91 1bg4 s ASN 131 Cb -0.12 -0.80 -0.00 0.00 -1.45 0.00 0.00 41.25 38.88 1bg4 s ASN 131 CO 0.02 0.06 0.56 -0.62 -3.72 0.00 0.00 177.10 173.40 1bg4 n GLU 132 N 3.68 -2.44 -0.13 0.43 1.02 0.01 -4.53 120.64 118.67 1bg4 n GLU 132 Ca -0.22 0.40 0.10 0.00 -0.02 0.00 0.00 57.16 57.42 1bg4 n GLU 132 Cb 0.52 -4.27 0.30 0.00 -0.02 0.00 0.00 31.44 27.96 1bg4 n GLU 132 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1bg4 n ILE 133 N -4.37 0.35 -4.69 -3.67 -5.35 -1.26 -4.88 119.36 95.48 1bg4 n ILE 133 Ca -0.23 -0.46 -0.32 0.00 -0.27 0.00 0.00 62.75 61.48 1bg4 n ILE 133 Cb 0.65 0.42 -0.12 0.00 -1.74 0.00 0.00 39.64 38.85 1bg4 n ILE 133 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1bg4 s PHE 134 N -1.65 2.66 0.65 4.28 0.08 -1.26 -0.40 117.98 122.34 1bg4 s PHE 134 Ca 0.32 -0.19 -0.10 0.00 0.12 0.00 0.00 56.93 57.08 1bg4 s PHE 134 Cb 0.17 -1.54 -0.01 0.00 -0.57 0.00 0.00 43.02 41.07 1bg4 s PHE 134 CO 0.25 0.25 1.03 -0.80 -0.10 0.00 0.00 175.22 175.85 1bg4 s ASN 135 N -1.22 5.76 0.52 1.36 0.01 0.78 -4.71 114.94 117.43 1bg4 s ASN 135 Ca 0.14 1.14 0.17 0.00 -0.71 0.00 0.00 52.86 53.61 1bg4 s ASN 135 Cb -0.11 -2.08 1.28 0.00 0.41 0.00 0.00 41.25 40.75 1bg4 s ASN 135 CO 0.04 -1.10 2.12 -0.33 -1.51 0.00 0.00 177.10 176.32 1bg4 h GLU 136 N -0.42 0.03 0.00 -0.60 4.39 -1.98 -1.44 114.58 114.56 1bg4 h GLU 136 Ca -0.45 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.25 1bg4 h GLU 136 Cb 1.23 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.88 1bg4 h GLU 136 CO 0.63 0.02 0.00 -0.40 -1.16 0.00 0.00 179.01 178.09 1bg4 n ASP 137 N -4.51 0.00 0.00 1.42 5.75 -1.26 -2.17 116.55 115.78 1bg4 n ASP 137 Ca -0.00 -0.92 0.00 0.00 -0.01 0.00 0.00 54.79 53.86 1bg4 n ASP 137 Cb 0.19 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.28 1bg4 n ASP 137 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1bg4 n GLY 138 N 0.85 0.52 3.89 6.12 0.00 -0.54 -4.64 105.19 111.39 1bg4 n GLY 138 Ca 0.22 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.95 1bg4 n GLY 138 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bg4 s SER 139 N -2.44 5.84 0.16 1.61 1.04 -1.26 -4.61 113.70 114.04 1bg4 s SER 139 Ca 0.00 1.12 -0.30 0.00 0.48 0.00 0.00 55.95 57.25 1bg4 s SER 139 Cb 0.00 -2.10 -0.08 0.00 0.10 0.00 0.00 66.02 63.94 1bg4 s SER 139 CO 0.00 -1.03 1.17 -0.76 0.98 0.00 0.00 173.24 173.60 1bg4 s LEU 140 N -5.15 4.45 0.20 2.42 1.43 -1.26 -0.16 118.68 120.61 1bg4 s LEU 140 Ca 0.55 2.15 -0.31 0.00 -1.03 0.00 0.00 54.13 55.50 1bg4 s LEU 140 Cb -0.11 -3.60 -0.09 0.00 0.03 0.00 0.00 46.19 42.42 1bg4 s LEU 140 CO 0.50 -0.34 1.42 -0.60 0.23 0.00 0.00 176.35 177.56 1bg4 s ARG 141 N -0.08 4.30 -1.53 1.70 3.52 0.47 -4.69 118.95 122.63 1bg4 s ARG 141 Ca 0.53 2.21 -0.11 0.00 -0.13 0.00 0.00 55.73 58.23 1bg4 s ARG 141 Cb -0.31 -3.16 -0.02 0.00 -1.56 0.00 0.00 34.95 29.90 1bg4 s ARG 141 CO 0.35 -0.41 2.65 0.09 -0.81 0.00 0.00 175.30 177.16 1bg4 n ASN 142 N 3.00 7.19 -4.25 -2.12 3.02 -1.26 -4.63 115.26 116.21 1bg4 n ASN 142 Ca 0.09 -2.73 -0.30 0.00 -0.03 0.00 0.00 54.58 51.61 1bg4 n ASN 142 Cb 0.41 -1.56 0.17 0.00 -0.61 0.00 0.00 39.78 38.19 1bg4 n ASN 142 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1bg4 s SER 143 N 2.18 3.18 0.34 6.41 1.04 -1.26 -4.73 113.70 120.87 1bg4 s SER 143 Ca 0.60 0.40 0.02 0.00 0.48 0.00 0.00 55.95 57.45 1bg4 s SER 143 Cb 0.17 -0.54 0.62 0.00 0.10 0.00 0.00 66.02 66.36 1bg4 s SER 143 CO -0.07 -2.70 1.98 1.62 0.98 0.00 0.00 173.24 175.05 1bg4 h VAL 144 N -1.62 1.17 -0.30 5.02 3.04 -1.92 0.81 116.25 122.45 1bg4 h VAL 144 Ca -0.45 -0.39 -0.01 0.00 -1.01 0.00 0.00 66.70 64.84 1bg4 h VAL 144 Cb 1.26 0.35 -0.01 0.00 -2.01 0.00 0.00 31.29 30.88 1bg4 h VAL 144 CO 0.43 0.18 0.14 -0.26 -1.01 0.00 0.00 177.57 177.05 1bg4 h PHE 145 N 0.81 0.44 -0.25 3.17 0.04 -1.94 0.53 116.94 119.74 1bg4 h PHE 145 Ca 0.21 -0.02 -0.12 0.00 2.80 0.00 0.00 57.97 60.84 1bg4 h PHE 145 Cb -0.02 -0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.00 1bg4 h PHE 145 CO 0.00 0.40 -0.31 -0.92 -0.60 0.00 0.00 178.31 176.88 1bg4 h TYR 146 N 0.35 0.79 -0.46 -0.55 3.20 -1.71 -0.21 116.97 118.38 1bg4 h TYR 146 Ca 0.10 -0.25 -0.04 0.00 3.14 0.00 0.00 58.73 61.68 1bg4 h TYR 146 Cb 0.14 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 1bg4 h TYR 146 CO -0.02 0.99 0.15 -0.91 -1.64 0.00 0.00 178.16 176.74 1bg4 h ASN 147 N 0.36 0.66 0.05 -2.11 2.35 -0.73 -1.20 115.58 114.97 1bg4 h ASN 147 Ca 0.03 -0.20 -0.20 0.00 -0.55 0.00 0.00 56.30 55.38 1bg4 h ASN 147 Cb 0.89 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 39.07 1bg4 h ASN 147 CO 0.07 0.68 -1.04 0.58 -1.65 0.00 0.00 177.43 176.08 1bg4 h VAL 148 N 0.60 1.16 0.04 2.81 2.07 -0.93 -3.41 116.25 118.60 1bg4 h VAL 148 Ca 0.15 -2.31 -0.32 0.00 0.82 0.00 0.00 66.70 65.04 1bg4 h VAL 148 Cb 0.26 2.68 -0.04 0.00 -1.52 0.00 0.00 31.29 32.67 1bg4 h VAL 148 CO -0.01 0.54 -1.86 -0.38 0.02 0.00 0.00 177.57 175.89 1bg4 n ILE 149 N -4.26 1.66 -0.37 4.57 5.41 -0.11 -4.48 119.36 121.78 1bg4 n ILE 149 Ca -0.24 -0.75 0.00 0.00 1.00 0.00 0.00 62.75 62.76 1bg4 n ILE 149 Cb 0.73 -1.25 0.00 0.00 -0.71 0.00 0.00 39.64 38.40 1bg4 n ILE 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1bg4 n GLY 150 N 1.73 -3.17 0.34 7.39 0.00 -0.45 -4.44 105.19 106.58 1bg4 n GLY 150 Ca -0.23 -1.90 0.18 0.00 0.00 0.00 0.00 46.02 44.07 1bg4 n GLY 150 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1bg4 h GLU 151 N 0.00 0.00 0.00 1.61 4.81 -1.89 -1.68 114.58 117.43 1bg4 h GLU 151 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1bg4 h GLU 151 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1bg4 h GLU 151 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 179.01 174.81 1bg4 n ASP 152 N -3.35 0.55 0.24 1.04 2.03 -1.26 -1.73 116.55 114.06 1bg4 n ASP 152 Ca 0.00 0.73 0.09 0.00 0.52 0.00 0.00 54.79 56.14 1bg4 n ASP 152 Cb 0.32 -0.81 0.62 0.00 -0.72 0.00 0.00 41.12 40.52 1bg4 n ASP 152 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 1bg4 h TYR 153 N 0.00 0.00 -0.01 -0.67 -0.00 -1.57 -1.16 116.97 113.56 1bg4 h TYR 153 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 58.73 1bg4 h TYR 153 Cb 0.06 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.79 1bg4 h TYR 153 CO 0.00 0.17 0.00 0.28 -0.00 0.00 0.00 178.16 178.61 1bg4 h VAL 154 N 0.00 1.20 -0.21 -0.90 2.07 -1.59 -0.67 116.25 116.15 1bg4 h VAL 154 Ca -0.00 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 66.91 1bg4 h VAL 154 Cb 0.37 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 1bg4 h VAL 154 CO 0.02 0.16 0.09 -0.09 0.02 0.00 0.00 177.57 177.77 1bg4 h ARG 155 N -0.23 0.31 -0.59 1.57 2.43 -1.61 -2.36 114.38 113.90 1bg4 h ARG 155 Ca 0.00 -0.05 0.07 0.00 -0.81 0.00 0.00 59.98 59.19 1bg4 h ARG 155 Cb 0.26 -0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.70 1bg4 h ARG 155 CO 0.00 0.35 0.29 0.82 -1.51 0.00 0.00 179.97 179.91 1bg4 h ILE 156 N 0.20 0.90 0.11 1.20 2.04 -1.15 -0.15 117.51 120.65 1bg4 h ILE 156 Ca 0.07 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 1bg4 h ILE 156 Cb 0.15 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 36.55 1bg4 h ILE 156 CO -0.01 0.10 -0.05 0.00 0.00 0.00 0.00 178.15 178.19 1bg4 h ALA 157 N 1.34 -0.14 -0.32 1.87 0.00 -0.97 -1.98 119.26 119.06 1bg4 h ALA 157 Ca 0.27 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1bg4 h ALA 157 Cb 0.23 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1bg4 h ALA 157 CO -0.21 -0.50 0.08 0.74 0.00 0.00 0.00 179.25 179.36 1bg4 h PHE 158 N -0.31 0.54 -0.82 0.00 0.04 -1.23 -1.24 116.94 113.91 1bg4 h PHE 158 Ca -0.01 -0.06 -0.02 0.00 2.80 0.00 0.00 57.97 60.67 1bg4 h PHE 158 Cb 0.25 -0.15 -0.04 0.00 2.20 0.00 0.00 35.95 38.21 1bg4 h PHE 158 CO -0.02 0.56 0.44 0.93 -0.60 0.00 0.00 178.31 179.62 1bg4 h GLU 159 N 0.36 1.16 -0.25 1.51 5.08 -1.05 0.51 114.58 121.90 1bg4 h GLU 159 Ca 0.10 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1bg4 h GLU 159 Cb 0.29 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1bg4 h GLU 159 CO 0.00 0.86 0.06 1.15 -1.00 0.00 0.00 179.01 180.08 1bg4 h THR 160 N 1.15 1.21 -0.43 1.13 2.02 -1.24 -1.79 112.91 114.96 1bg4 h THR 160 Ca 0.29 -0.69 0.02 0.00 0.77 0.00 0.00 66.41 66.80 1bg4 h THR 160 Cb 0.05 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.63 1bg4 h THR 160 CO -0.04 0.22 0.25 0.00 0.37 0.00 0.00 175.52 176.32 1bg4 h ALA 161 N 0.88 0.54 -0.71 6.16 0.00 -0.89 -1.21 119.26 124.04 1bg4 h ALA 161 Ca 0.08 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.02 1bg4 h ALA 161 Cb 0.28 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1bg4 h ALA 161 CO 0.00 -0.07 0.44 -0.09 0.00 0.00 0.00 179.25 179.53 1bg4 h ARG 162 N 0.51 0.82 -0.39 0.00 9.65 -0.75 -1.82 114.38 122.41 1bg4 h ARG 162 Ca 0.17 -0.05 -0.14 0.00 -1.10 0.00 0.00 59.98 58.86 1bg4 h ARG 162 Cb 0.01 -0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 28.39 1bg4 h ARG 162 CO -0.08 0.54 -0.32 1.03 2.80 0.00 0.00 179.97 183.95 1bg4 h SER 163 N 0.85 0.90 -0.20 -3.80 0.87 -0.86 -2.84 113.55 108.47 1bg4 h SER 163 Ca 0.29 -0.38 -0.09 0.00 -1.23 0.00 0.00 61.79 60.39 1bg4 h SER 163 Cb 0.06 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 61.76 1bg4 h SER 163 CO -0.12 1.14 -0.21 0.58 -0.53 0.00 0.00 176.83 177.68 1bg4 h VAL 164 N 0.73 1.33 -2.49 2.23 2.07 -0.90 -3.40 116.25 115.81 1bg4 h VAL 164 Ca 0.08 -1.39 -0.57 0.00 0.82 0.00 0.00 66.70 65.64 1bg4 h VAL 164 Cb 0.88 1.77 -0.38 0.00 -1.52 0.00 0.00 31.29 32.03 1bg4 h VAL 164 CO 0.08 0.42 -0.87 -0.62 0.02 0.00 0.00 177.57 176.60 1bg4 s ASP 165 N -6.32 2.51 0.01 0.57 -1.08 -0.72 -4.87 116.67 106.78 1bg4 s ASP 165 Ca -0.13 -2.34 0.10 0.00 -0.52 0.00 0.00 52.55 49.65 1bg4 s ASP 165 Cb 0.07 -0.34 0.42 0.00 -1.46 0.00 0.00 42.92 41.61 1bg4 s ASP 165 CO 0.79 -0.28 1.31 -0.81 0.52 0.00 0.00 175.17 176.70 1bg4 n PRO 166 N 3.79 0.01 0.15 4.34 -0.04 -1.07 -2.38 135.00 139.80 1bg4 n PRO 166 Ca 0.16 0.35 0.04 0.00 -0.04 0.00 0.00 63.50 64.01 1bg4 n PRO 166 Cb 0.40 -1.52 0.04 0.00 -0.04 0.00 0.00 33.50 32.38 1bg4 n PRO 166 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 1bg4 h ASN 167 N 0.00 0.00 -3.60 3.54 -1.24 -1.94 -3.46 115.58 108.89 1bg4 h ASN 167 Ca 0.00 0.00 -0.51 0.00 0.71 0.00 0.00 56.30 56.50 1bg4 h ASN 167 Cb 0.16 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.18 1bg4 h ASN 167 CO 0.00 0.43 0.14 0.00 -1.29 0.00 0.00 177.43 176.71 1bg4 s ALA 168 N -2.99 3.40 -0.06 1.57 0.00 -1.00 -4.93 121.76 117.74 1bg4 s ALA 168 Ca 0.04 0.22 -0.30 0.00 0.00 0.00 0.00 51.96 51.92 1bg4 s ALA 168 Cb 0.07 -2.87 -0.02 0.00 0.00 0.00 0.00 23.12 20.30 1bg4 s ALA 168 CO 0.74 0.31 0.99 0.15 0.00 0.00 0.00 175.76 177.94 1bg4 s LYS 169 N -1.91 4.48 -0.29 0.00 -0.14 -0.39 -4.92 119.74 116.57 1bg4 s LYS 169 Ca 0.43 1.39 -0.13 0.00 -1.36 0.00 0.00 55.97 56.29 1bg4 s LYS 169 Cb -0.17 -3.51 -0.04 0.00 -1.68 0.00 0.00 37.83 32.43 1bg4 s LYS 169 CO 0.22 -0.19 0.30 -0.51 -0.76 0.00 0.00 175.35 174.40 1bg4 s LEU 170 N 1.56 4.13 0.15 3.17 1.43 -1.26 -0.85 118.68 127.00 1bg4 s LEU 170 Ca 0.50 0.05 0.09 0.00 -1.03 0.00 0.00 54.13 53.73 1bg4 s LEU 170 Cb -0.19 -2.29 -0.04 0.00 0.03 0.00 0.00 46.19 43.70 1bg4 s LEU 170 CO 0.22 -0.17 -0.11 -0.31 0.23 0.00 0.00 176.35 176.21 1bg4 s TYR 171 N 1.93 2.63 -0.16 0.29 1.51 -0.15 -0.50 117.35 122.90 1bg4 s TYR 171 Ca 0.11 -0.22 -0.01 0.00 -1.01 0.00 0.00 57.07 55.94 1bg4 s TYR 171 Cb -0.16 -1.32 -0.01 0.00 -0.11 0.00 0.00 41.96 40.36 1bg4 s TYR 171 CO 0.11 0.47 -0.10 -1.50 -1.11 0.00 0.00 175.55 173.42 1bg4 s ILE 172 N -1.51 3.15 0.05 2.71 2.07 -0.88 -1.15 121.20 125.65 1bg4 s ILE 172 Ca 0.23 -0.60 0.08 0.00 -1.41 0.00 0.00 60.65 58.94 1bg4 s ILE 172 Cb -0.10 -2.36 -0.03 0.00 0.13 0.00 0.00 42.46 40.10 1bg4 s ILE 172 CO 0.14 0.49 -0.21 0.21 -1.91 0.00 0.00 174.94 173.66 1bg4 s ASN 173 N 0.74 3.57 0.13 4.50 2.47 -0.12 -0.34 114.94 125.90 1bg4 s ASN 173 Ca -0.04 -0.49 -0.24 0.00 0.42 0.00 0.00 52.86 52.50 1bg4 s ASN 173 Cb -0.15 -0.49 0.07 0.00 -1.45 0.00 0.00 41.25 39.23 1bg4 s ASN 173 CO 0.02 0.25 0.65 -0.62 -3.72 0.00 0.00 177.10 173.68 1bg4 s ASP 174 N -1.39 -0.53 0.39 -4.21 -1.08 -0.56 -0.81 116.67 108.48 1bg4 s ASP 174 Ca 0.14 -0.01 0.08 0.00 -0.52 0.00 0.00 52.55 52.23 1bg4 s ASP 174 Cb -0.10 0.56 -0.02 0.00 -1.46 0.00 0.00 42.92 41.90 1bg4 s ASP 174 CO 0.04 -0.91 0.39 -0.72 0.52 0.00 0.00 175.17 174.49 1bg4 s TYR 175 N -3.64 2.79 -1.28 -5.34 1.13 -1.26 -0.74 117.35 109.01 1bg4 s TYR 175 Ca 0.02 -0.42 -0.01 0.00 -1.41 0.00 0.00 57.07 55.25 1bg4 s TYR 175 Cb -0.01 -2.10 0.00 0.00 -1.10 0.00 0.00 41.96 38.75 1bg4 s TYR 175 CO -0.12 -0.09 0.10 0.09 -2.51 0.00 0.00 175.55 173.02 1bg4 n ASN 176 N -1.56 -4.70 -2.73 -0.18 3.02 -1.26 -4.89 115.26 102.96 1bg4 n ASN 176 Ca 0.03 -0.06 -0.34 0.00 -0.03 0.00 0.00 54.58 54.17 1bg4 n ASN 176 Cb 0.61 -3.77 0.02 0.00 -0.61 0.00 0.00 39.78 36.03 1bg4 n ASN 176 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1bg4 n LEU 177 N -2.39 6.34 -0.88 3.41 4.77 -1.26 -4.54 117.00 122.44 1bg4 n LEU 177 Ca -0.16 -5.00 0.11 0.00 -0.03 0.00 0.00 56.01 50.93 1bg4 n LEU 177 Cb 0.63 -0.81 0.09 0.00 -2.33 0.00 0.00 43.42 41.00 1bg4 n LEU 177 CO 0.24 1.96 0.60 0.47 -1.33 0.00 0.00 177.39 179.33 1bg4 n ASP 178 N -0.52 2.84 -3.66 -1.43 8.00 -1.26 -4.77 116.55 115.76 1bg4 n ASP 178 Ca 0.48 -1.92 -0.14 0.00 0.71 0.00 0.00 54.79 53.92 1bg4 n ASP 178 Cb 0.41 0.01 -0.08 0.00 -0.02 0.00 0.00 41.12 41.45 1bg4 n ASP 178 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1bg4 s SER 179 N -1.87 -0.62 0.52 -2.24 1.04 -1.26 -3.54 113.70 105.73 1bg4 s SER 179 Ca 0.26 1.13 -0.22 0.00 0.48 0.00 0.00 55.95 57.60 1bg4 s SER 179 Cb 0.19 1.14 -0.06 0.00 0.10 0.00 0.00 66.02 67.39 1bg4 s SER 179 CO 0.28 -0.26 1.35 0.00 0.98 0.00 0.00 173.24 175.59 1bg4 s ALA 180 N 0.11 2.89 0.00 5.32 0.00 -1.26 -2.80 121.76 126.02 1bg4 s ALA 180 Ca -0.02 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.25 1bg4 s ALA 180 Cb -0.04 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.53 1bg4 s ALA 180 CO 0.02 -1.27 0.00 0.41 0.00 0.00 0.00 175.76 174.92 1bg4 n GLY 181 N 0.68 2.68 3.77 0.00 0.00 -1.26 -4.96 105.19 106.09 1bg4 n GLY 181 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 1bg4 n GLY 181 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1bg4 s TYR 182 N -2.16 2.84 0.29 1.61 5.04 -1.12 -4.84 117.35 119.01 1bg4 s TYR 182 Ca 0.00 1.39 0.04 0.00 -2.44 0.00 0.00 57.07 56.05 1bg4 s TYR 182 Cb 0.00 -3.71 0.65 0.00 0.35 0.00 0.00 41.96 39.25 1bg4 s TYR 182 CO 0.00 -2.14 1.80 0.66 -1.34 0.00 0.00 175.55 174.53 1bg4 h SER 183 N 2.84 0.85 -0.14 4.32 4.64 -1.91 -1.29 113.55 122.87 1bg4 h SER 183 Ca -0.50 0.07 -0.12 0.00 -0.47 0.00 0.00 61.79 60.78 1bg4 h SER 183 Cb 1.24 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 1bg4 h SER 183 CO 0.63 0.37 -0.31 0.50 -0.87 0.00 0.00 176.83 177.15 1bg4 h LYS 184 N 0.87 0.63 -0.22 4.77 3.64 -1.70 -1.03 116.57 123.52 1bg4 h LYS 184 Ca 0.54 -0.28 -0.03 0.00 -1.27 0.00 0.00 60.65 59.61 1bg4 h LYS 184 Cb 0.71 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.50 1bg4 h LYS 184 CO -0.33 0.86 0.02 0.28 -2.27 0.00 0.00 179.45 178.02 1bg4 h VAL 185 N 0.53 1.24 -0.83 2.00 2.07 -1.52 -1.67 116.25 118.07 1bg4 h VAL 185 Ca 0.06 -0.80 0.01 0.00 0.82 0.00 0.00 66.70 66.80 1bg4 h VAL 185 Cb 0.80 1.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.87 1bg4 h VAL 185 CO 0.07 0.25 0.55 0.78 0.02 0.00 0.00 177.57 179.23 1bg4 h ASN 186 N 0.16 0.94 -0.62 0.57 2.35 -1.08 -1.55 115.58 116.35 1bg4 h ASN 186 Ca 0.07 -0.02 -0.10 0.00 -0.55 0.00 0.00 56.30 55.70 1bg4 h ASN 186 Cb 0.35 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 1bg4 h ASN 186 CO 0.01 0.68 0.01 1.23 -1.65 0.00 0.00 177.43 177.70 1bg4 h GLY 187 N 1.11 1.17 0.96 2.83 0.00 -1.09 -1.68 103.07 106.38 1bg4 h GLY 187 Ca 0.31 -0.86 -0.00 0.00 0.00 0.00 0.00 47.33 46.78 1bg4 h GLY 187 CO -0.07 0.79 -0.03 1.98 0.00 0.00 0.00 176.54 179.21 1bg4 h MET 188 N 0.99 -0.07 -0.07 4.80 1.85 -0.86 -1.81 114.93 119.77 1bg4 h MET 188 Ca 0.18 0.00 0.01 0.00 -0.61 0.00 0.00 59.70 59.28 1bg4 h MET 188 Cb 0.56 0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.59 1bg4 h MET 188 CO 0.03 -0.01 -0.00 0.28 -0.40 0.00 0.00 176.91 176.81 1bg4 h VAL 189 N -0.11 0.95 -0.66 -5.77 2.07 -1.21 -1.03 116.25 110.49 1bg4 h VAL 189 Ca -0.01 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 1bg4 h VAL 189 Cb 0.09 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 1bg4 h VAL 189 CO 0.01 0.00 0.29 0.77 0.02 0.00 0.00 177.57 178.67 1bg4 h SER 190 N 0.02 0.89 -0.20 0.57 4.64 -1.28 -1.18 113.55 117.02 1bg4 h SER 190 Ca 0.03 -0.15 -0.05 0.00 -0.47 0.00 0.00 61.79 61.15 1bg4 h SER 190 Cb 0.04 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 1bg4 h SER 190 CO -0.06 0.80 -0.06 0.45 -0.87 0.00 0.00 176.83 177.09 1bg4 h HIS 191 N 0.93 0.45 -0.65 4.77 3.86 -1.23 -2.31 115.15 120.97 1bg4 h HIS 191 Ca 0.22 -0.10 -0.03 0.00 -1.16 0.00 0.00 60.37 59.30 1bg4 h HIS 191 Cb 0.16 -0.11 -0.03 0.00 1.06 0.00 0.00 27.41 28.49 1bg4 h HIS 191 CO 0.01 0.66 0.27 0.28 0.86 0.00 0.00 177.93 180.01 1bg4 h VAL 192 N 0.11 1.22 -0.36 2.45 2.07 -1.07 0.99 116.25 121.67 1bg4 h VAL 192 Ca 0.05 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.88 1bg4 h VAL 192 Cb 0.52 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1bg4 h VAL 192 CO 0.02 0.28 0.22 0.11 0.02 0.00 0.00 177.57 178.21 1bg4 h LYS 193 N 0.93 0.49 -0.28 1.57 1.57 -1.16 0.36 116.57 120.05 1bg4 h LYS 193 Ca 0.22 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1bg4 h LYS 193 Cb 0.16 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1bg4 h LYS 193 CO -0.02 0.37 0.14 -0.22 -0.57 0.00 0.00 179.45 179.15 1bg4 h LYS 194 N 0.47 0.41 -0.61 3.15 3.64 -0.82 -1.04 116.57 121.76 1bg4 h LYS 194 Ca 0.13 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.42 1bg4 h LYS 194 Cb 0.01 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1bg4 h LYS 194 CO -0.02 0.38 0.26 -1.49 -2.27 0.00 0.00 179.45 176.31 1bg4 h TRP 195 N 0.33 0.91 -0.54 1.91 6.55 -0.54 -1.08 115.95 123.49 1bg4 h TRP 195 Ca 0.10 -0.06 -0.07 0.00 0.95 0.00 0.00 58.89 59.81 1bg4 h TRP 195 Cb 0.10 -0.28 -0.02 0.00 -0.86 0.00 0.00 29.16 28.11 1bg4 h TRP 195 CO -0.02 0.71 0.07 -0.07 -1.05 0.00 0.00 178.44 178.08 1bg4 h LEU 196 N 0.84 0.86 -1.78 -4.49 3.38 -0.83 -1.04 115.31 112.25 1bg4 h LEU 196 Ca 0.21 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1bg4 h LEU 196 Cb 0.17 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1bg4 h LEU 196 CO -0.02 0.91 -0.13 0.00 0.09 0.00 0.00 178.44 179.29 1bg4 h ALA 197 N 0.98 1.69 -0.00 1.53 0.00 -0.87 -0.61 119.26 121.98 1bg4 h ALA 197 Ca 0.16 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1bg4 h ALA 197 Cb 0.43 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1bg4 h ALA 197 CO 0.01 0.17 -0.02 0.00 0.00 0.00 0.00 179.25 179.41 1bg4 n ALA 198 N -2.47 2.66 -0.50 0.00 0.00 -0.44 -4.92 120.51 114.84 1bg4 n ALA 198 Ca -0.03 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1bg4 n ALA 198 Cb 0.21 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.26 1bg4 n ALA 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bg4 n GLY 199 N 1.11 0.75 3.70 0.00 0.00 -0.24 -5.04 105.19 105.47 1bg4 n GLY 199 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1bg4 n GLY 199 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bg4 s ILE 200 N -2.02 4.26 -1.23 -0.61 1.01 -0.47 -4.94 121.20 117.20 1bg4 s ILE 200 Ca 0.00 1.61 -0.21 0.00 0.00 0.00 0.00 60.65 62.05 1bg4 s ILE 200 Cb 0.00 -4.03 -0.01 0.00 0.01 0.00 0.00 42.46 38.43 1bg4 s ILE 200 CO 0.00 0.07 1.83 -2.16 0.00 0.00 0.00 174.94 174.68 1bg4 s PRO 201 N 1.57 3.24 -0.41 2.79 0.04 -1.26 -4.38 135.00 136.59 1bg4 s PRO 201 Ca 0.56 -1.54 -0.08 0.00 0.04 0.00 0.00 61.00 59.98 1bg4 s PRO 201 Cb -0.26 -5.38 0.08 0.00 0.04 0.00 0.00 34.50 28.97 1bg4 s PRO 201 CO 0.26 -3.10 0.23 0.42 0.04 0.00 0.00 177.00 174.84 1bg4 s ILE 202 N 7.61 4.03 0.14 0.56 1.01 -1.26 -4.78 121.20 128.51 1bg4 s ILE 202 Ca 0.61 -1.45 0.04 0.00 0.00 0.00 0.00 60.65 59.85 1bg4 s ILE 202 Cb 0.01 -3.48 -0.19 0.00 0.01 0.00 0.00 42.46 38.82 1bg4 s ILE 202 CO 0.10 -0.48 1.32 0.44 0.00 0.00 0.00 174.94 176.31 1bg4 h ASP 203 N 8.33 0.15 -5.15 3.58 3.32 -1.15 -3.42 116.42 122.09 1bg4 h ASP 203 Ca -0.22 -0.15 -0.05 0.00 0.02 0.00 0.00 57.03 56.64 1bg4 h ASP 203 Cb 1.08 -0.05 -0.11 0.00 0.22 0.00 0.00 39.33 40.47 1bg4 h ASP 203 CO 0.73 1.03 -0.09 -0.83 -1.72 0.00 0.00 179.24 178.36 1bg4 s GLY 204 N -4.62 0.15 -0.14 2.75 0.00 -0.63 -1.80 107.32 103.03 1bg4 s GLY 204 Ca -0.01 -0.50 0.01 0.00 0.00 0.00 0.00 44.72 44.22 1bg4 s GLY 204 CO 0.83 -0.47 -0.17 -0.42 0.00 0.00 0.00 173.10 172.86 1bg4 s ILE 205 N -3.92 2.51 -0.19 0.90 1.01 -1.06 -2.06 121.20 118.39 1bg4 s ILE 205 Ca 0.13 -0.83 -0.09 0.00 0.00 0.00 0.00 60.65 59.87 1bg4 s ILE 205 Cb 0.00 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1bg4 s ILE 205 CO -0.01 0.53 0.09 -0.83 0.00 0.00 0.00 174.94 174.72 1bg4 s GLY 206 N 0.73 1.97 -0.32 6.18 0.00 0.54 -1.89 107.32 114.52 1bg4 s GLY 206 Ca -0.07 -0.72 -0.05 0.00 0.00 0.00 0.00 44.72 43.88 1bg4 s GLY 206 CO 0.01 0.09 0.06 -0.45 0.00 0.00 0.00 173.10 172.81 1bg4 s SER 207 N 0.34 5.13 0.17 1.64 0.15 -0.10 -1.50 113.70 119.53 1bg4 s SER 207 Ca 0.05 -1.17 -0.18 0.00 0.70 0.00 0.00 55.95 55.35 1bg4 s SER 207 Cb -0.12 -1.81 0.09 0.00 -1.71 0.00 0.00 66.02 62.48 1bg4 s SER 207 CO -0.01 -0.29 1.66 1.56 1.20 0.00 0.00 173.24 177.36 1bg4 h GLN 208 N 8.13 -0.05 -4.56 5.44 4.20 -1.23 -1.36 115.11 125.68 1bg4 h GLN 208 Ca -0.23 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.27 1bg4 h GLN 208 Cb 1.08 0.01 0.12 0.00 0.30 0.00 0.00 27.48 28.99 1bg4 h GLN 208 CO 0.57 -0.03 -0.55 2.41 -0.67 0.00 0.00 178.83 180.57 1bg4 n THR 209 N -5.33 -4.84 -3.04 -0.54 -1.04 -1.26 -1.20 114.28 97.03 1bg4 n THR 209 Ca 0.02 -0.51 -0.44 0.00 -2.04 0.00 0.00 64.05 61.08 1bg4 n THR 209 Cb 0.24 -4.56 -0.05 0.00 -1.82 0.00 0.00 70.33 64.14 1bg4 n THR 209 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1bg4 s HIS 210 N -3.25 2.91 0.20 -1.42 3.76 -1.26 -2.86 115.29 113.36 1bg4 s HIS 210 Ca 0.09 -0.74 0.06 0.00 -0.15 0.00 0.00 55.06 54.32 1bg4 s HIS 210 Cb -0.01 -4.01 -0.04 0.00 1.11 0.00 0.00 32.58 29.63 1bg4 s HIS 210 CO 0.51 -1.35 0.13 -0.51 -0.85 0.00 0.00 174.74 172.66 1bg4 s LEU 211 N 3.11 3.71 0.53 0.89 1.43 0.18 -4.89 118.68 123.65 1bg4 s LEU 211 Ca 0.16 -0.23 0.04 0.00 -1.03 0.00 0.00 54.13 53.07 1bg4 s LEU 211 Cb -0.21 -2.30 0.04 0.00 0.03 0.00 0.00 46.19 43.75 1bg4 s LEU 211 CO 0.09 0.04 0.74 -0.83 0.23 0.00 0.00 176.35 176.62 1bg4 s GLY 212 N -3.33 1.85 0.36 -3.19 0.00 -1.26 -1.29 107.32 100.46 1bg4 s GLY 212 Ca 0.31 -1.56 -0.28 0.00 0.00 0.00 0.00 44.72 43.19 1bg4 s GLY 212 CO 0.23 -1.25 1.38 0.00 0.00 0.00 0.00 173.10 173.46 1bg4 s ALA 213 N -2.68 3.50 0.00 3.20 0.00 -1.23 -2.71 121.76 121.85 1bg4 s ALA 213 Ca 0.58 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.94 1bg4 s ALA 213 Cb -0.09 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.49 1bg4 s ALA 213 CO 0.38 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.70 1bg4 n GLY 214 N 0.64 1.67 0.23 0.00 0.00 -1.26 -4.90 105.19 101.57 1bg4 n GLY 214 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.17 1bg4 n GLY 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bg4 n ALA 215 N 0.58 2.79 -0.24 4.61 0.00 -1.10 -4.35 120.51 122.79 1bg4 n ALA 215 Ca 0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 53.44 53.07 1bg4 n ALA 215 Cb 0.00 -1.25 0.17 0.00 0.00 0.00 0.00 19.45 18.36 1bg4 n ALA 215 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1bg4 h GLY 216 N 4.93 1.14 2.00 0.00 0.00 -1.81 -3.02 103.07 106.31 1bg4 h GLY 216 Ca 0.00 -0.52 -0.00 0.00 0.00 0.00 0.00 47.33 46.81 1bg4 h GLY 216 CO 0.00 0.50 -0.00 1.48 0.00 0.00 0.00 176.54 178.52 1bg4 h SER 217 N 1.07 0.00 1.47 0.19 4.64 -1.85 -2.53 113.55 116.54 1bg4 h SER 217 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 1bg4 h SER 217 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1bg4 h SER 217 CO -0.04 0.00 -0.09 0.00 -0.87 0.00 0.00 176.83 175.83 1bg4 h ALA 218 N 2.00 0.94 -0.77 5.18 0.00 -1.79 -3.35 119.26 121.47 1bg4 h ALA 218 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1bg4 h ALA 218 Cb 0.27 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1bg4 h ALA 218 CO 0.00 0.00 0.37 0.28 0.00 0.00 0.00 179.25 179.90 1bg4 h VAL 219 N 0.00 1.24 -0.35 0.00 2.07 -1.49 -2.88 116.25 114.83 1bg4 h VAL 219 Ca 0.00 -0.67 0.07 0.00 0.82 0.00 0.00 66.70 66.92 1bg4 h VAL 219 Cb 0.78 0.25 -0.06 0.00 -1.52 0.00 0.00 31.29 30.75 1bg4 h VAL 219 CO 0.00 0.29 -0.04 0.00 0.02 0.00 0.00 177.57 177.84 1bg4 h ALA 220 N 1.32 0.28 -0.54 1.67 0.00 -1.77 -1.00 119.26 119.21 1bg4 h ALA 220 Ca 0.27 0.12 -0.07 0.00 0.00 0.00 0.00 54.91 55.22 1bg4 h ALA 220 Cb 0.10 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1bg4 h ALA 220 CO -0.03 -0.43 0.06 0.78 0.00 0.00 0.00 179.25 179.63 1bg4 h GLY 221 N 0.05 0.93 0.98 0.00 0.00 -1.79 -1.88 103.07 101.36 1bg4 h GLY 221 Ca 0.17 -0.60 0.01 0.00 0.00 0.00 0.00 47.33 46.91 1bg4 h GLY 221 CO -0.32 0.55 0.29 0.00 0.00 0.00 0.00 176.54 177.07 1bg4 h ALA 222 N 1.25 0.57 -0.58 3.60 0.00 -1.14 0.28 119.26 123.23 1bg4 h ALA 222 Ca 0.17 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1bg4 h ALA 222 Cb 0.40 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1bg4 h ALA 222 CO 0.01 0.01 0.14 -0.07 0.00 0.00 0.00 179.25 179.34 1bg4 h LEU 223 N 0.60 0.84 -0.41 0.00 3.38 -0.86 -0.01 115.31 118.83 1bg4 h LEU 223 Ca 0.17 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1bg4 h LEU 223 Cb -0.06 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1bg4 h LEU 223 CO -0.04 0.82 0.17 0.78 0.09 0.00 0.00 178.44 180.26 1bg4 h ASN 224 N 0.86 0.56 -0.52 -0.43 2.35 -0.75 -0.42 115.58 117.22 1bg4 h ASN 224 Ca 0.19 -0.16 -0.03 0.00 -0.55 0.00 0.00 56.30 55.75 1bg4 h ASN 224 Cb 0.31 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 1bg4 h ASN 224 CO -0.00 0.57 0.23 0.00 -1.65 0.00 0.00 177.43 176.57 1bg4 h ALA 225 N 1.02 0.68 0.00 -0.83 0.00 -0.51 -2.54 119.26 117.07 1bg4 h ALA 225 Ca 0.14 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1bg4 h ALA 225 Cb 0.17 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1bg4 h ALA 225 CO -0.01 0.27 -0.17 -0.07 0.00 0.00 0.00 179.25 179.26 1bg4 h LEU 226 N 0.70 0.00 -2.05 0.00 3.38 -0.71 -1.77 115.31 114.85 1bg4 h LEU 226 Ca 0.18 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1bg4 h LEU 226 Cb 0.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1bg4 h LEU 226 CO -0.02 0.17 -0.04 0.00 0.09 0.00 0.00 178.44 178.65 1bg4 h ALA 227 N 1.83 1.79 0.00 1.53 0.00 -0.63 -1.99 119.26 121.78 1bg4 h ALA 227 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1bg4 h ALA 227 Cb 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1bg4 h ALA 227 CO 0.02 0.05 0.00 0.43 0.00 0.00 0.00 179.25 179.75 1bg4 n SER 228 N -4.28 0.00 0.25 0.00 7.64 -0.67 -2.76 113.62 113.80 1bg4 n SER 228 Ca -0.03 0.22 0.12 0.00 1.01 0.00 0.00 58.87 60.20 1bg4 n SER 228 Cb 0.12 -0.38 0.65 0.00 -1.01 0.00 0.00 64.21 63.59 1bg4 n SER 228 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bg4 h ALA 229 N 2.79 1.15 0.00 -0.43 0.00 -1.50 -3.47 119.26 117.79 1bg4 h ALA 229 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1bg4 h ALA 229 Cb 0.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1bg4 h ALA 229 CO 0.00 0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.84 1bg4 n GLY 230 N -0.33 0.82 3.82 0.00 0.00 -1.11 -3.82 105.19 104.56 1bg4 n GLY 230 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 1bg4 n GLY 230 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bg4 s THR 231 N -2.11 4.08 0.28 2.61 -4.23 -1.26 -4.95 115.64 110.06 1bg4 s THR 231 Ca 0.00 0.92 -0.02 0.00 -1.18 0.00 0.00 61.69 61.41 1bg4 s THR 231 Cb 0.00 -3.50 0.27 0.00 1.34 0.00 0.00 72.50 70.61 1bg4 s THR 231 CO 0.00 -0.65 1.92 0.50 -0.54 0.00 0.00 174.62 175.85 1bg4 h LYS 232 N 0.32 1.13 -3.83 3.99 3.64 -1.73 -3.46 116.57 116.62 1bg4 h LYS 232 Ca -0.46 -0.07 -0.12 0.00 -1.27 0.00 0.00 60.65 58.73 1bg4 h LYS 232 Cb 1.21 -0.25 -0.09 0.00 -0.41 0.00 0.00 32.23 32.68 1bg4 h LYS 232 CO 0.59 0.75 -0.17 -1.83 -2.27 0.00 0.00 179.45 176.51 1bg4 s GLU 233 N -5.99 1.62 0.13 1.90 -1.05 -0.74 -4.84 118.70 109.73 1bg4 s GLU 233 Ca -0.12 -1.41 -0.06 0.00 -0.15 0.00 0.00 54.97 53.23 1bg4 s GLU 233 Cb 0.19 0.45 -0.02 0.00 -0.44 0.00 0.00 34.13 34.31 1bg4 s GLU 233 CO 0.81 -0.66 0.17 0.96 0.95 0.00 0.00 175.26 177.48 1bg4 s ILE 234 N -3.75 0.10 -0.03 1.83 -4.36 0.20 -2.56 121.20 112.63 1bg4 s ILE 234 Ca 0.26 -1.57 -0.27 0.00 -0.26 0.00 0.00 60.65 58.80 1bg4 s ILE 234 Cb 0.00 -1.82 0.06 0.00 1.25 0.00 0.00 42.46 41.95 1bg4 s ILE 234 CO 0.12 -0.46 0.60 0.00 0.24 0.00 0.00 174.94 175.45 1bg4 s ALA 235 N -3.98 -1.56 -0.35 2.27 0.00 -0.79 -1.64 121.76 115.70 1bg4 s ALA 235 Ca 0.17 1.07 -0.21 0.00 0.00 0.00 0.00 51.96 52.99 1bg4 s ALA 235 Cb 0.05 0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.25 1bg4 s ALA 235 CO -0.02 -0.38 0.67 0.42 0.00 0.00 0.00 175.76 176.45 1bg4 s ILE 236 N -1.40 4.86 -0.14 0.00 1.01 -0.87 -0.92 121.20 123.73 1bg4 s ILE 236 Ca -0.11 0.66 0.18 0.00 0.00 0.00 0.00 60.65 61.39 1bg4 s ILE 236 Cb -0.01 -4.10 -0.25 0.00 0.01 0.00 0.00 42.46 38.11 1bg4 s ILE 236 CO 0.07 -0.33 0.30 0.35 0.00 0.00 0.00 174.94 175.33 1bg4 n THR 237 N 5.61 1.14 -2.89 2.92 -2.24 -0.51 -0.82 114.28 117.48 1bg4 n THR 237 Ca -0.00 -0.77 -0.13 0.00 -2.27 0.00 0.00 64.05 60.88 1bg4 n THR 237 Cb 0.48 -0.47 0.01 0.00 -2.10 0.00 0.00 70.33 68.26 1bg4 n THR 237 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1bg4 n GLU 238 N -2.71 1.06 -2.06 -0.78 1.02 -0.34 -4.43 120.64 112.41 1bg4 n GLU 238 Ca -0.23 -3.13 -0.42 0.00 -0.02 0.00 0.00 57.16 53.36 1bg4 n GLU 238 Cb 1.00 -1.35 -0.03 0.00 -0.02 0.00 0.00 31.44 31.04 1bg4 n GLU 238 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1bg4 s LEU 239 N -2.78 4.35 -0.22 -4.62 2.96 -0.03 -4.23 118.68 114.12 1bg4 s LEU 239 Ca 0.32 2.37 -0.26 0.00 -0.22 0.00 0.00 54.13 56.33 1bg4 s LEU 239 Cb 0.40 -3.57 0.07 0.00 0.50 0.00 0.00 46.19 43.59 1bg4 s LEU 239 CO -0.03 -0.78 0.72 1.51 -1.32 0.00 0.00 176.35 176.46 1bg4 s ASP 240 N 1.80 -0.72 -0.09 3.68 1.47 -1.14 -0.70 116.67 120.97 1bg4 s ASP 240 Ca 0.68 1.26 -0.01 0.00 1.18 0.00 0.00 52.55 55.66 1bg4 s ASP 240 Cb -0.37 1.23 0.03 0.00 -0.34 0.00 0.00 42.92 43.46 1bg4 s ASP 240 CO 0.30 -0.33 -0.01 -0.63 0.68 0.00 0.00 175.17 175.17 1bg4 s ILE 241 N -0.00 0.54 -0.06 2.11 1.01 -0.91 -0.64 121.20 123.25 1bg4 s ILE 241 Ca -0.02 -0.03 -0.36 0.00 0.00 0.00 0.00 60.65 60.23 1bg4 s ILE 241 Cb -0.04 -0.69 -0.14 0.00 0.01 0.00 0.00 42.46 41.60 1bg4 s ILE 241 CO 0.03 0.25 1.68 0.00 0.00 0.00 0.00 174.94 176.90 1bg4 n ALA 242 N 5.09 0.33 0.00 9.38 0.00 -0.41 -0.42 120.51 134.48 1bg4 n ALA 242 Ca -0.08 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1bg4 n ALA 242 Cb 0.50 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.64 1bg4 n ALA 242 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bg4 n GLY 243 N 3.78 3.22 4.20 0.00 0.00 -0.23 -3.48 105.19 112.68 1bg4 n GLY 243 Ca 0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 1bg4 n GLY 243 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bg4 n ALA 244 N -1.03 -1.35 -1.75 4.61 0.00 0.44 -4.92 120.51 116.51 1bg4 n ALA 244 Ca 0.00 -0.04 -0.36 0.00 0.00 0.00 0.00 53.44 53.04 1bg4 n ALA 244 Cb 0.00 -3.24 0.03 0.00 0.00 0.00 0.00 19.45 16.24 1bg4 n ALA 244 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1bg4 s SER 245 N -3.43 5.29 0.20 0.00 1.04 -1.26 -4.34 113.70 111.19 1bg4 s SER 245 Ca 0.65 2.42 -0.10 0.00 0.48 0.00 0.00 55.95 59.41 1bg4 s SER 245 Cb -0.35 -2.60 0.12 0.00 0.10 0.00 0.00 66.02 63.28 1bg4 s SER 245 CO 0.92 -1.53 1.76 0.28 0.98 0.00 0.00 173.24 175.66 1bg4 h SER 246 N 1.06 0.97 -0.20 7.02 0.02 -1.91 -2.14 113.55 118.37 1bg4 h SER 246 Ca -0.50 -0.16 0.03 0.00 -0.84 0.00 0.00 61.79 60.31 1bg4 h SER 246 Cb 1.29 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 63.55 1bg4 h SER 246 CO 0.56 0.87 0.01 0.74 -1.14 0.00 0.00 176.83 177.87 1bg4 h THR 247 N 1.01 0.88 0.07 -2.27 2.02 -1.98 0.61 112.91 113.25 1bg4 h THR 247 Ca 0.24 -0.03 -0.00 0.00 0.77 0.00 0.00 66.41 67.39 1bg4 h THR 247 Cb 0.19 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 1bg4 h THR 247 CO -0.02 0.02 -0.03 0.44 0.37 0.00 0.00 175.52 176.29 1bg4 h ASP 248 N 0.08 -0.08 -0.72 4.18 3.32 -1.90 -0.26 116.42 121.06 1bg4 h ASP 248 Ca 0.09 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.07 1bg4 h ASP 248 Cb 0.11 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 1bg4 h ASP 248 CO -0.14 -0.05 0.17 1.88 -1.72 0.00 0.00 179.24 179.38 1bg4 h TYR 249 N -0.10 1.20 -0.50 4.55 0.05 -1.25 -1.84 116.97 119.09 1bg4 h TYR 249 Ca -0.01 -0.14 -0.13 0.00 0.05 0.00 0.00 58.73 58.50 1bg4 h TYR 249 Cb 0.08 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 37.46 1bg4 h TYR 249 CO -0.07 0.97 -0.19 0.28 -1.05 0.00 0.00 178.16 178.10 1bg4 h VAL 250 N 1.09 1.27 -0.86 -2.88 2.07 -0.78 -1.41 116.25 114.74 1bg4 h VAL 250 Ca 0.23 -1.36 0.02 0.00 0.82 0.00 0.00 66.70 66.41 1bg4 h VAL 250 Cb 0.38 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.18 1bg4 h VAL 250 CO 0.00 0.47 0.56 0.78 0.02 0.00 0.00 177.57 179.40 1bg4 h ASN 251 N 0.88 0.95 -0.28 0.57 -0.26 -0.78 0.56 115.58 117.22 1bg4 h ASN 251 Ca 0.12 -0.01 -0.14 0.00 -0.56 0.00 0.00 56.30 55.71 1bg4 h ASN 251 Cb 0.77 -0.22 -0.00 0.00 -1.06 0.00 0.00 38.32 37.81 1bg4 h ASN 251 CO 0.06 0.66 -0.36 0.58 -1.06 0.00 0.00 177.43 177.32 1bg4 h VAL 252 N 1.11 1.30 -0.65 2.81 2.07 -1.15 -1.37 116.25 120.38 1bg4 h VAL 252 Ca 0.33 -1.54 -0.00 0.00 0.82 0.00 0.00 66.70 66.30 1bg4 h VAL 252 Cb -0.05 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 1bg4 h VAL 252 CO -0.10 0.49 0.39 0.58 0.02 0.00 0.00 177.57 178.95 1bg4 h VAL 253 N 0.47 1.19 -0.14 2.57 2.07 -0.90 -2.12 116.25 119.38 1bg4 h VAL 253 Ca 0.03 -0.43 -0.08 0.00 0.82 0.00 0.00 66.70 67.04 1bg4 h VAL 253 Cb 0.94 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1bg4 h VAL 253 CO 0.08 0.20 -0.28 0.78 0.02 0.00 0.00 177.57 178.38 1bg4 h ASN 254 N 0.88 0.27 -0.38 0.57 2.35 -0.83 -1.03 115.58 117.40 1bg4 h ASN 254 Ca 0.23 -0.09 0.01 0.00 -0.55 0.00 0.00 56.30 55.91 1bg4 h ASN 254 Cb -0.02 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 1bg4 h ASN 254 CO -0.04 0.55 0.23 0.00 -1.65 0.00 0.00 177.43 176.51 1bg4 h ALA 255 N 1.48 0.48 -0.14 -0.83 0.00 -0.58 -1.04 119.26 118.62 1bg4 h ALA 255 Ca 0.04 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1bg4 h ALA 255 Cb 0.62 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1bg4 h ALA 255 CO 0.04 -0.11 -0.17 0.00 0.00 0.00 0.00 179.25 179.01 1bg4 h LEU 257 N -0.02 0.42 -1.38 0.00 5.85 -0.94 -1.80 115.31 117.44 1bg4 h LEU 257 Ca 0.02 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1bg4 h LEU 257 Cb 0.71 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.79 1bg4 h LEU 257 CO 0.04 0.16 0.00 0.59 -0.34 0.00 0.00 178.44 178.89 1bg4 n ASN 258 N -4.93 2.01 -4.10 1.25 3.02 -0.41 -4.75 115.26 107.35 1bg4 n ASN 258 Ca 0.16 -2.01 -0.33 0.00 -0.03 0.00 0.00 54.58 52.38 1bg4 n ASN 258 Cb 0.44 -0.25 -0.16 0.00 -0.61 0.00 0.00 39.78 39.20 1bg4 n ASN 258 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1bg4 s GLN 259 N -1.51 2.67 0.29 3.52 2.00 -0.68 -5.03 119.66 120.93 1bg4 s GLN 259 Ca 0.25 -1.02 0.03 0.00 -2.00 0.00 0.00 55.36 52.62 1bg4 s GLN 259 Cb 0.13 -2.68 0.65 0.00 0.80 0.00 0.00 33.01 31.91 1bg4 s GLN 259 CO 0.17 -0.35 1.79 0.00 -0.50 0.00 0.00 175.29 176.40 1bg4 h ALA 260 N 7.88 1.56 0.00 1.58 0.00 -1.85 -2.62 119.26 125.81 1bg4 h ALA 260 Ca -0.35 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1bg4 h ALA 260 Cb 1.10 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1bg4 h ALA 260 CO 0.57 0.04 0.00 0.87 0.00 0.00 0.00 179.25 180.73 1bg4 h LYS 261 N 0.82 0.00 -6.57 0.00 1.57 -1.91 -3.43 116.57 107.05 1bg4 h LYS 261 Ca 0.54 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.76 1bg4 h LYS 261 Cb 0.73 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.97 1bg4 h LYS 261 CO -0.34 0.00 1.03 0.00 -0.57 0.00 0.00 179.45 179.57 1bg4 n VAL 263 N 6.95 0.35 0.00 0.00 0.24 -0.65 -4.88 118.33 120.34 1bg4 n VAL 263 Ca 0.14 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 62.21 1bg4 n VAL 263 Cb 0.49 -0.21 0.00 0.00 -1.47 0.00 0.00 33.84 32.65 1bg4 n VAL 263 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bg4 n GLY 264 N 1.36 -0.28 3.06 7.63 0.00 -1.26 -0.50 105.19 115.19 1bg4 n GLY 264 Ca 0.04 -1.04 -0.22 0.00 0.00 0.00 0.00 46.02 44.80 1bg4 n GLY 264 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bg4 s ILE 265 N -2.00 0.98 -0.17 -0.61 1.01 -1.12 -2.05 121.20 117.25 1bg4 s ILE 265 Ca 0.00 -0.50 0.01 0.00 0.00 0.00 0.00 60.65 60.15 1bg4 s ILE 265 Cb 0.00 -0.84 0.01 0.00 0.01 0.00 0.00 42.46 41.65 1bg4 s ILE 265 CO 0.00 0.29 -0.19 -0.89 0.00 0.00 0.00 174.94 174.15 1bg4 s THR 266 N -0.10 2.21 -0.08 2.92 2.01 -0.01 -0.03 115.64 122.57 1bg4 s THR 266 Ca 0.01 -0.90 -0.22 0.00 0.31 0.00 0.00 61.69 60.90 1bg4 s THR 266 Cb -0.07 -1.92 -0.04 0.00 0.01 0.00 0.00 72.50 70.48 1bg4 s THR 266 CO 0.00 0.53 0.63 -0.69 -0.69 0.00 0.00 174.62 174.40 1bg4 s VAL 267 N 1.16 5.08 -1.27 3.82 1.01 -0.02 -0.86 120.40 129.32 1bg4 s VAL 267 Ca 0.01 1.29 -0.13 0.00 0.00 0.00 0.00 61.98 63.15 1bg4 s VAL 267 Cb -0.14 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 1bg4 s VAL 267 CO -0.09 0.29 2.35 1.87 0.00 0.00 0.00 175.10 179.52 1bg4 n TRP 268 N 3.67 2.50 0.00 5.22 -0.00 0.12 -3.55 117.44 125.41 1bg4 n TRP 268 Ca -0.03 -2.59 0.00 0.00 -0.00 0.00 0.00 57.50 54.88 1bg4 n TRP 268 Cb 0.51 -2.21 0.00 0.00 -0.00 0.00 0.00 31.31 29.62 1bg4 n TRP 268 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1bg4 n GLY 269 N 3.98 3.50 0.09 5.87 0.00 -1.26 -4.75 105.19 112.63 1bg4 n GLY 269 Ca 0.57 -1.83 -0.07 0.00 0.00 0.00 0.00 46.02 44.69 1bg4 n GLY 269 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1bg4 n VAL 270 N -1.41 1.20 -4.66 1.61 0.31 -1.26 -4.70 118.33 109.42 1bg4 n VAL 270 Ca 0.00 0.21 -0.32 0.00 -0.01 0.00 0.00 64.34 64.22 1bg4 n VAL 270 Cb 0.00 -2.17 -0.12 0.00 -0.91 0.00 0.00 33.84 30.64 1bg4 n VAL 270 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1bg4 s ALA 271 N -2.91 2.82 0.27 3.52 0.00 -1.26 -2.46 121.76 121.74 1bg4 s ALA 271 Ca -0.23 -1.03 -0.03 0.00 0.00 0.00 0.00 51.96 50.68 1bg4 s ALA 271 Cb 0.03 -1.01 0.56 0.00 0.00 0.00 0.00 23.12 22.70 1bg4 s ALA 271 CO 0.34 0.58 1.45 -0.25 0.00 0.00 0.00 175.76 177.88 1bg4 n ASP 272 N 1.87 -0.23 0.16 0.00 8.00 0.05 -0.52 116.55 125.89 1bg4 n ASP 272 Ca -0.16 1.59 0.16 0.00 0.71 0.00 0.00 54.79 57.08 1bg4 n ASP 272 Cb 0.52 -0.53 0.76 0.00 -0.02 0.00 0.00 41.12 41.85 1bg4 n ASP 272 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1bg4 h PRO 273 N 0.00 0.00 -0.26 -0.24 0.13 -1.86 -1.43 132.00 128.34 1bg4 h PRO 273 Ca 0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.63 1bg4 h PRO 273 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1bg4 h PRO 273 CO -0.92 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 176.60 1bg4 n ASP 274 N -4.11 2.34 -4.77 1.44 8.00 0.32 -4.90 116.55 114.88 1bg4 n ASP 274 Ca 0.03 -1.83 -0.38 0.00 0.71 0.00 0.00 54.79 53.31 1bg4 n ASP 274 Cb 0.35 -0.17 -0.05 0.00 -0.02 0.00 0.00 41.12 41.23 1bg4 n ASP 274 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1bg4 s SER 275 N -1.50 7.30 0.03 -2.24 0.15 -0.54 -4.91 113.70 111.98 1bg4 s SER 275 Ca 0.34 2.00 0.16 0.00 0.70 0.00 0.00 55.95 59.15 1bg4 s SER 275 Cb 0.19 -2.60 0.66 0.00 -1.71 0.00 0.00 66.02 62.56 1bg4 s SER 275 CO 0.28 -0.10 1.50 -2.67 1.20 0.00 0.00 173.24 173.44 1bg4 n TRP 276 N 0.83 0.09 -2.22 3.44 4.27 -1.26 -1.71 117.44 120.87 1bg4 n TRP 276 Ca 0.01 0.03 -0.15 0.00 -3.89 0.00 0.00 57.50 53.50 1bg4 n TRP 276 Cb 0.48 -0.56 0.04 0.00 -1.36 0.00 0.00 31.31 29.91 1bg4 n TRP 276 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 1bg4 n ARG 277 N -1.58 2.90 -0.29 -2.67 1.74 -1.26 -4.93 116.66 110.56 1bg4 n ARG 277 Ca 0.03 -3.88 0.24 0.00 -0.77 0.00 0.00 57.85 53.46 1bg4 n ARG 277 Cb 0.18 -2.00 0.55 0.00 -1.02 0.00 0.00 32.46 30.16 1bg4 n ARG 277 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1bg4 h SER 278 N 2.19 0.36 0.32 0.55 4.64 -1.53 0.66 113.55 120.73 1bg4 h SER 278 Ca 0.20 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1bg4 h SER 278 Cb 1.44 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.53 1bg4 h SER 278 CO 0.54 0.09 0.00 0.77 -0.87 0.00 0.00 176.83 177.36 1bg4 h SER 279 N 0.33 0.00 -0.24 4.97 4.64 -1.89 -1.16 113.55 120.20 1bg4 h SER 279 Ca 0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 1bg4 h SER 279 Cb 1.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.61 1bg4 h SER 279 CO -0.22 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.20 1bg4 n SER 280 N -2.58 3.23 -3.92 4.97 3.41 0.22 -4.99 113.62 113.97 1bg4 n SER 280 Ca -0.01 -1.98 -0.35 0.00 -0.26 0.00 0.00 58.87 56.26 1bg4 n SER 280 Cb 0.13 -0.15 0.01 0.00 -0.26 0.00 0.00 64.21 63.94 1bg4 n SER 280 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1bg4 n SER 281 N 1.40 -3.81 -0.93 4.04 7.64 -0.44 -1.06 113.62 120.46 1bg4 n SER 281 Ca 0.17 -1.07 0.09 0.00 1.01 0.00 0.00 58.87 59.08 1bg4 n SER 281 Cb 0.60 -1.39 0.24 0.00 -1.01 0.00 0.00 64.21 62.65 1bg4 n SER 281 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1bg4 n PRO 282 N -3.87 2.18 -3.78 1.43 -0.04 -1.26 -3.52 135.00 126.14 1bg4 n PRO 282 Ca -0.16 -1.82 -0.26 0.00 -0.04 0.00 0.00 63.50 61.22 1bg4 n PRO 282 Cb 0.53 -1.41 0.01 0.00 -0.04 0.00 0.00 33.50 32.59 1bg4 n PRO 282 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1bg4 s LEU 283 N -1.11 2.66 0.16 1.53 1.43 -1.26 -2.15 118.68 119.94 1bg4 s LEU 283 Ca 0.35 -1.25 0.24 0.00 -1.03 0.00 0.00 54.13 52.44 1bg4 s LEU 283 Cb 0.18 -1.14 0.36 0.00 0.03 0.00 0.00 46.19 45.63 1bg4 s LEU 283 CO 0.25 -1.22 1.36 -0.07 0.23 0.00 0.00 176.35 176.90 1bg4 h LEU 284 N 0.60 0.00 -8.69 1.79 3.38 -1.87 -3.46 115.31 107.06 1bg4 h LEU 284 Ca -0.35 -0.15 -0.66 0.00 0.09 0.00 0.00 57.88 56.82 1bg4 h LEU 284 Cb 1.31 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 41.80 1bg4 h LEU 284 CO 0.54 0.07 -0.87 -0.36 0.09 0.00 0.00 178.44 177.91 1bg4 s PHE 285 N -3.19 2.17 0.00 1.13 0.40 -1.03 -0.30 117.98 117.17 1bg4 s PHE 285 Ca 0.06 -0.40 0.00 0.00 -0.60 0.00 0.00 56.93 55.99 1bg4 s PHE 285 Cb 0.12 -1.30 0.00 0.00 0.51 0.00 0.00 43.02 42.36 1bg4 s PHE 285 CO 0.71 0.12 0.00 -0.40 0.70 0.00 0.00 175.22 176.35 1bg4 n ASP 286 N 1.77 0.00 0.26 1.36 5.68 0.15 -0.77 116.55 125.00 1bg4 n ASP 286 Ca -0.17 -0.91 0.17 0.00 -0.50 0.00 0.00 54.79 53.39 1bg4 n ASP 286 Cb 0.52 0.00 0.87 0.00 -1.14 0.00 0.00 41.12 41.37 1bg4 n ASP 286 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1bg4 h GLY 287 N 0.00 0.00 -2.64 6.12 0.00 -1.94 0.13 103.07 104.73 1bg4 h GLY 287 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1bg4 h GLY 287 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.24 1bg4 n ASN 288 N -2.77 3.86 -3.45 0.19 3.02 -1.26 -4.93 115.26 109.93 1bg4 n ASN 288 Ca -0.01 -2.00 -0.24 0.00 -0.03 0.00 0.00 54.58 52.30 1bg4 n ASN 288 Cb 0.12 -0.44 0.06 0.00 -0.61 0.00 0.00 39.78 38.92 1bg4 n ASN 288 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1bg4 n TYR 289 N 1.64 -2.57 -4.32 3.10 4.02 0.44 -5.01 117.16 114.45 1bg4 n TYR 289 Ca 0.24 0.86 -0.31 0.00 -0.01 0.00 0.00 57.90 58.68 1bg4 n TYR 289 Cb 0.62 -4.79 -0.10 0.00 -0.02 0.00 0.00 39.34 35.05 1bg4 n TYR 289 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 1bg4 s ASN 290 N -3.13 4.48 0.27 7.72 0.01 -1.26 -4.83 114.94 118.20 1bg4 s ASN 290 Ca 0.51 -0.30 -0.31 0.00 -0.71 0.00 0.00 52.86 52.05 1bg4 s ASN 290 Cb -0.23 -0.93 -0.12 0.00 0.41 0.00 0.00 41.25 40.39 1bg4 s ASN 290 CO 0.63 0.21 1.63 -2.84 -1.51 0.00 0.00 177.10 175.23 1bg4 s PRO 291 N -1.93 4.12 0.83 -0.60 0.02 -1.26 -0.67 135.00 135.50 1bg4 s PRO 291 Ca 0.20 2.59 -0.06 0.00 0.02 0.00 0.00 61.00 63.75 1bg4 s PRO 291 Cb -0.11 -3.04 0.17 0.00 0.02 0.00 0.00 34.50 31.54 1bg4 s PRO 291 CO 0.12 -0.67 1.13 0.15 -0.33 0.00 0.00 177.00 177.40 1bg4 s LYS 292 N 0.01 1.17 0.17 5.54 1.02 0.59 -4.83 119.74 123.42 1bg4 s LYS 292 Ca 0.67 -0.95 -0.14 0.00 0.02 0.00 0.00 55.97 55.56 1bg4 s LYS 292 Cb -0.48 -2.15 0.09 0.00 -0.52 0.00 0.00 37.83 34.76 1bg4 s LYS 292 CO 0.43 -1.89 1.81 0.00 -0.92 0.00 0.00 175.35 174.78 1bg4 h ALA 293 N -0.99 0.63 -0.69 5.17 0.00 -1.90 -2.46 119.26 119.03 1bg4 h ALA 293 Ca -0.38 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 54.62 1bg4 h ALA 293 Cb 1.25 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 1bg4 h ALA 293 CO 0.37 -0.01 0.45 0.00 0.00 0.00 0.00 179.25 180.06 1bg4 h ALA 294 N 1.22 1.92 -0.28 0.00 0.00 -1.89 0.14 119.26 120.37 1bg4 h ALA 294 Ca 0.20 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1bg4 h ALA 294 Cb 0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1bg4 h ALA 294 CO -0.09 -0.06 0.08 -0.92 0.00 0.00 0.00 179.25 178.25 1bg4 h TYR 295 N 0.54 0.47 -0.46 0.00 5.03 -1.66 -0.93 116.97 119.96 1bg4 h TYR 295 Ca 0.32 -0.05 -0.11 0.00 2.58 0.00 0.00 58.73 61.46 1bg4 h TYR 295 Cb 0.52 -0.13 -0.02 0.00 1.55 0.00 0.00 36.73 38.65 1bg4 h TYR 295 CO -0.00 0.51 -0.17 -0.91 -1.32 0.00 0.00 178.16 176.27 1bg4 h ASN 296 N 0.29 0.89 -0.36 -2.11 2.35 -1.27 -1.50 115.58 113.88 1bg4 h ASN 296 Ca 0.09 -0.31 0.03 0.00 -0.55 0.00 0.00 56.30 55.56 1bg4 h ASN 296 Cb 0.27 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.36 1bg4 h ASN 296 CO -0.00 1.05 0.16 0.00 -1.65 0.00 0.00 177.43 176.99 1bg4 h ALA 297 N 1.02 0.44 -0.57 -0.83 0.00 -0.79 0.08 119.26 118.61 1bg4 h ALA 297 Ca 0.11 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1bg4 h ALA 297 Cb 0.70 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1bg4 h ALA 297 CO 0.05 -0.21 0.32 0.82 0.00 0.00 0.00 179.25 180.23 1bg4 h ILE 298 N 0.34 1.19 -0.76 0.00 2.04 -0.95 -0.90 117.51 118.46 1bg4 h ILE 298 Ca 0.16 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.54 1bg4 h ILE 298 Cb 0.09 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 36.58 1bg4 h ILE 298 CO -0.12 0.20 0.43 0.00 0.00 0.00 0.00 178.15 178.66 1bg4 h ALA 299 N 1.15 1.32 0.00 1.87 0.00 -0.55 -2.23 119.26 120.81 1bg4 h ALA 299 Ca 0.20 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1bg4 h ALA 299 Cb 0.04 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.52 1bg4 h ALA 299 CO -0.03 0.56 -0.20 0.09 0.00 0.00 0.00 179.25 179.67 1bg4 n ASN 300 N -4.36 0.81 -0.02 0.00 5.03 -0.05 -3.26 115.26 113.40 1bg4 n ASN 300 Ca 0.08 0.44 0.13 0.00 0.87 0.00 0.00 54.58 56.09 1bg4 n ASN 300 Cb 0.09 -0.51 0.39 0.00 -1.02 0.00 0.00 39.78 38.73 1bg4 n ASN 300 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1bg4 n ALA 301 N -1.81 3.12 0.54 5.41 0.00 -0.38 -5.09 120.51 122.31 1bg4 n ALA 301 Ca 0.05 -0.27 0.06 0.00 0.00 0.00 0.00 53.44 53.28 1bg4 n ALA 301 Cb 0.44 -1.24 0.05 0.00 0.00 0.00 0.00 19.45 18.70 1bg4 n ALA 301 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78