#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ij6 s THR 3 N 0.00 4.88 -0.06 -5.08 -1.32 -1.26 -4.87 115.64 107.92 3ij6 s THR 3 Ca 0.00 1.97 -0.08 0.00 -1.21 0.00 0.00 61.69 62.37 3ij6 s THR 3 Cb 0.00 -4.28 -0.04 0.00 -1.51 0.00 0.00 72.50 66.67 3ij6 s THR 3 CO 0.00 0.14 0.22 -0.54 -2.21 0.00 0.00 174.62 172.23 3ij6 s LYS 4 N 1.19 3.55 -0.31 7.08 1.02 0.14 -4.64 119.74 127.77 3ij6 s LYS 4 Ca 0.49 -0.04 -0.04 0.00 0.02 0.00 0.00 55.97 56.40 3ij6 s LYS 4 Cb -0.20 -3.16 0.04 0.00 -0.52 0.00 0.00 37.83 33.98 3ij6 s LYS 4 CO 0.25 0.73 0.04 0.42 -0.92 0.00 0.00 175.35 175.86 3ij6 s ILE 5 N -1.12 3.37 -0.73 2.17 -1.09 0.11 -0.86 121.20 123.05 3ij6 s ILE 5 Ca 0.20 -1.18 -0.26 0.00 -2.23 0.00 0.00 60.65 57.19 3ij6 s ILE 5 Cb -0.13 -2.88 0.04 0.00 -1.58 0.00 0.00 42.46 37.91 3ij6 s ILE 5 CO 0.09 -0.08 1.20 -0.62 -1.23 0.00 0.00 174.94 174.31 3ij6 s ASP 6 N 1.34 6.18 0.00 3.58 2.15 0.17 -4.51 116.67 125.57 3ij6 s ASP 6 Ca -0.03 -0.63 0.29 0.00 0.43 0.00 0.00 52.55 52.61 3ij6 s ASP 6 Cb -0.19 -2.52 1.33 0.00 -0.30 0.00 0.00 42.92 41.24 3ij6 s ASP 6 CO 0.00 -1.72 1.97 0.00 -0.17 0.00 0.00 175.17 175.25 3ij6 n ALA 7 N 8.91 2.37 -3.38 3.66 0.00 -0.75 -0.28 120.51 131.05 3ij6 n ALA 7 Ca 0.02 -0.11 -0.26 0.00 0.00 0.00 0.00 53.44 53.09 3ij6 n ALA 7 Cb 0.48 -1.47 -0.10 0.00 0.00 0.00 0.00 19.45 18.36 3ij6 n ALA 7 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3ij6 s TYR 8 N -2.85 0.84 0.19 0.00 6.04 -1.26 -4.68 117.35 115.62 3ij6 s TYR 8 Ca 0.19 -2.04 0.10 0.00 0.04 0.00 0.00 57.07 55.36 3ij6 s TYR 8 Cb 0.19 -0.84 -0.04 0.00 -1.04 0.00 0.00 41.96 40.23 3ij6 s TYR 8 CO 0.50 -0.85 -0.20 0.00 -1.54 0.00 0.00 175.55 173.46 3ij6 s ALA 9 N 0.38 2.25 0.22 3.97 0.00 -1.05 -0.35 121.76 127.18 3ij6 s ALA 9 Ca 0.29 -1.60 0.10 0.00 0.00 0.00 0.00 51.96 50.75 3ij6 s ALA 9 Cb -0.03 -0.23 -0.04 0.00 0.00 0.00 0.00 23.12 22.82 3ij6 s ALA 9 CO -0.14 0.28 -0.13 -1.01 0.00 0.00 0.00 175.76 174.76 3ij6 s HIS 10 N -2.08 2.50 -0.06 0.00 0.09 0.15 -1.93 115.29 113.98 3ij6 s HIS 10 Ca 0.20 -0.27 -0.19 0.00 -0.00 0.00 0.00 55.06 54.79 3ij6 s HIS 10 Cb -0.06 -1.17 0.04 0.00 -0.00 0.00 0.00 32.58 31.39 3ij6 s HIS 10 CO 0.09 0.58 0.44 -1.50 -0.00 0.00 0.00 174.74 174.34 3ij6 s ILE 11 N -2.01 0.03 -0.46 0.60 2.07 0.06 -4.50 121.20 116.98 3ij6 s ILE 11 Ca 0.27 -0.25 0.04 0.00 -1.41 0.00 0.00 60.65 59.29 3ij6 s ILE 11 Cb -0.07 -0.72 0.12 0.00 0.13 0.00 0.00 42.46 41.92 3ij6 s ILE 11 CO 0.15 -0.14 0.20 -0.76 -1.91 0.00 0.00 174.94 172.48 3ij6 s LEU 12 N -0.96 4.23 0.18 8.50 1.02 0.80 -2.88 118.68 129.58 3ij6 s LEU 12 Ca -0.10 -2.72 -0.33 0.00 0.02 0.00 0.00 54.13 51.00 3ij6 s LEU 12 Cb -0.03 -1.56 -0.13 0.00 0.02 0.00 0.00 46.19 44.48 3ij6 s LEU 12 CO 0.05 -0.28 1.67 -2.65 0.02 0.00 0.00 176.35 175.16 3ij6 n PRO 13 N 3.49 2.51 -0.20 1.29 -0.02 -1.26 -4.22 135.00 136.59 3ij6 n PRO 13 Ca 0.05 0.90 -0.04 0.00 -2.02 0.00 0.00 63.50 62.40 3ij6 n PRO 13 Cb 0.35 -2.72 0.03 0.00 -0.02 0.00 0.00 33.50 31.14 3ij6 n PRO 13 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ij6 h ALA 14 N 6.50 0.11 -0.39 3.55 0.00 -1.95 -0.86 119.26 126.22 3ij6 h ALA 14 Ca -0.44 0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 3ij6 h ALA 14 Cb 1.23 0.67 -0.02 0.00 0.00 0.00 0.00 17.79 19.67 3ij6 h ALA 14 CO 0.93 -0.59 -0.08 0.87 0.00 0.00 0.00 179.25 180.37 3ij6 h LYS 15 N -0.12 0.67 -0.34 0.00 1.57 -1.95 -2.11 116.57 114.30 3ij6 h LYS 15 Ca 0.25 -0.20 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 3ij6 h LYS 15 Cb 0.53 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 3ij6 h LYS 15 CO -0.66 0.75 -0.06 -0.92 -0.57 0.00 0.00 179.45 177.99 3ij6 h TYR 16 N 0.62 0.71 -0.72 -1.35 3.20 -1.74 -2.27 116.97 115.42 3ij6 h TYR 16 Ca 0.11 -0.14 -0.05 0.00 3.14 0.00 0.00 58.73 61.78 3ij6 h TYR 16 Cb 0.51 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 3ij6 h TYR 16 CO 0.02 0.79 0.24 -0.92 -1.64 0.00 0.00 178.16 176.65 3ij6 h TYR 17 N 0.42 1.15 -0.32 -3.82 3.20 -1.00 -1.52 116.97 115.08 3ij6 h TYR 17 Ca 0.09 -0.11 -0.09 0.00 3.14 0.00 0.00 58.73 61.75 3ij6 h TYR 17 Cb 0.54 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 3ij6 h TYR 17 CO 0.05 0.91 -0.19 1.96 -1.64 0.00 0.00 178.16 179.24 3ij6 h GLN 18 N 1.06 0.60 -0.55 1.82 1.08 -1.39 -0.99 115.11 116.75 3ij6 h GLN 18 Ca 0.23 -0.21 -0.04 0.00 -1.45 0.00 0.00 58.65 57.18 3ij6 h GLN 18 Cb 0.29 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.65 3ij6 h GLN 18 CO -0.01 0.76 0.17 0.87 -0.95 0.00 0.00 178.83 179.67 3ij6 h LYS 19 N 0.54 0.82 0.00 1.46 1.57 -1.13 -2.97 116.57 116.86 3ij6 h LYS 19 Ca 0.08 -0.15 -0.15 0.00 -1.87 0.00 0.00 60.65 58.57 3ij6 h LYS 19 Cb 0.63 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 3ij6 h LYS 19 CO 0.04 0.71 -0.72 0.52 -0.57 0.00 0.00 179.45 179.44 3ij6 h MET 20 N 0.80 0.00 -0.37 3.15 2.86 -0.72 -3.16 114.93 117.49 3ij6 h MET 20 Ca 0.18 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.74 3ij6 h MET 20 Cb 0.24 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.88 3ij6 h MET 20 CO -0.01 0.72 -0.10 -0.07 1.06 0.00 0.00 176.91 178.51 3ij6 h LEU 21 N 0.00 0.63 -1.47 1.22 3.38 -1.06 -0.22 115.31 117.79 3ij6 h LEU 21 Ca -0.01 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 3ij6 h LEU 21 Cb 1.35 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 3ij6 h LEU 21 CO 0.09 0.76 -0.22 0.28 0.09 0.00 0.00 178.44 179.44 3ij6 h SER 22 N 0.59 0.00 0.00 -0.43 0.02 -1.50 -2.94 113.55 109.29 3ij6 h SER 22 Ca 0.11 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 3ij6 h SER 22 Cb 0.52 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.06 3ij6 h SER 22 CO 0.03 0.22 -0.08 0.58 -1.14 0.00 0.00 176.83 176.44 3ij6 h VAL 23 N 0.00 1.72 -3.16 2.27 2.07 -1.41 -3.45 116.25 114.29 3ij6 h VAL 23 Ca -0.00 -2.33 -0.49 0.00 0.82 0.00 0.00 66.70 64.70 3ij6 h VAL 23 Cb 0.57 3.29 -0.40 0.00 -1.52 0.00 0.00 31.29 33.23 3ij6 h VAL 23 CO 0.03 0.58 -0.76 -0.70 0.02 0.00 0.00 177.57 176.75 3ij6 s GLU 24 N -2.22 0.38 0.44 1.57 2.56 -0.14 -5.00 118.70 116.29 3ij6 s GLU 24 Ca -0.19 -0.28 0.30 0.00 0.00 0.00 0.00 54.97 54.79 3ij6 s GLU 24 Cb -0.02 -1.97 1.20 0.00 2.00 0.00 0.00 34.13 35.34 3ij6 s GLU 24 CO 0.68 -0.67 1.88 -1.35 -0.56 0.00 0.00 175.26 175.24 3ij6 h PRO 25 N 8.32 0.00 0.00 4.30 0.11 -1.79 -3.05 132.00 139.89 3ij6 h PRO 25 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 3ij6 h PRO 25 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3ij6 h PRO 25 CO 0.32 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.20 3ij6 n ASN 26 N -2.77 0.00 0.02 -2.05 3.02 -1.26 -4.31 115.26 107.91 3ij6 n ASN 26 Ca 0.01 -1.44 -0.11 0.00 -0.03 0.00 0.00 54.58 53.01 3ij6 n ASN 26 Cb 0.28 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.39 3ij6 n ASN 26 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 3ij6 h ILE 27 N 0.00 1.01 0.00 2.41 2.04 -1.91 0.16 117.51 121.21 3ij6 h ILE 27 Ca 0.00 -0.02 -0.04 0.00 1.00 0.00 0.00 64.86 65.80 3ij6 h ILE 27 Cb 0.00 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 3ij6 h ILE 27 CO 0.00 0.01 -0.19 -0.65 0.00 0.00 0.00 178.15 177.32 3ij6 h PRO 28 N 0.07 0.00 -0.03 2.37 0.11 -1.80 -0.61 132.00 132.10 3ij6 h PRO 28 Ca 0.02 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.11 3ij6 h PRO 28 Cb -0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3ij6 h PRO 28 CO -0.01 0.19 -0.07 -0.91 -0.21 0.00 0.00 178.00 176.99 3ij6 h ASN 29 N 0.00 0.12 0.42 -2.05 4.21 -1.77 -3.34 115.58 113.17 3ij6 h ASN 29 Ca -0.00 -0.57 -0.19 0.00 1.21 0.00 0.00 56.30 56.74 3ij6 h ASN 29 Cb 0.52 -0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.68 3ij6 h ASN 29 CO 0.02 0.67 -0.81 0.24 -1.29 0.00 0.00 177.43 176.27 3ij6 h MET 30 N -0.42 0.29 -4.53 0.81 2.86 -0.90 -3.41 114.93 109.62 3ij6 h MET 30 Ca 0.00 -0.27 -0.70 0.00 -2.06 0.00 0.00 59.70 56.66 3ij6 h MET 30 Cb 0.65 0.07 -0.31 0.00 0.06 0.00 0.00 31.60 32.07 3ij6 h MET 30 CO 0.02 0.95 -0.54 -0.06 1.06 0.00 0.00 176.91 178.33 3ij6 s PHE 31 N -3.41 3.40 0.12 -0.22 0.08 -0.24 -4.97 117.98 112.73 3ij6 s PHE 31 Ca -0.04 -1.86 0.24 0.00 0.12 0.00 0.00 56.93 55.38 3ij6 s PHE 31 Cb 0.10 -2.84 0.89 0.00 -0.57 0.00 0.00 43.02 40.60 3ij6 s PHE 31 CO 0.83 -0.87 1.81 -1.00 -0.10 0.00 0.00 175.22 175.89 3ij6 h PRO 32 N 8.21 0.00 0.00 0.24 0.13 -1.81 -3.22 132.00 135.55 3ij6 h PRO 32 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 3ij6 h PRO 32 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 3ij6 h PRO 32 CO 0.69 0.23 0.00 1.97 -0.23 0.00 0.00 178.00 180.66 3ij6 n PHE 33 N -3.38 0.00 0.24 1.56 1.16 -1.26 -3.18 117.46 112.60 3ij6 n PHE 33 Ca 0.00 0.00 0.08 0.00 -1.87 0.00 0.00 57.45 55.66 3ij6 n PHE 33 Cb 0.44 0.00 0.59 0.00 -1.61 0.00 0.00 39.48 38.90 3ij6 n PHE 33 CO 0.00 0.00 0.00 0.82 -1.87 0.00 0.00 176.76 175.71 3ij6 h ILE 34 N 0.00 0.97 0.00 1.97 5.03 -1.89 -2.90 117.51 120.69 3ij6 h ILE 34 Ca 0.00 -0.47 -0.00 0.00 -0.12 0.00 0.00 64.86 64.27 3ij6 h ILE 34 Cb 0.00 1.26 -0.00 0.00 -3.03 0.00 0.00 36.82 35.05 3ij6 h ILE 34 CO 0.00 0.13 -0.02 0.07 -0.68 0.00 0.00 178.15 177.65 3ij6 h LYS 35 N 0.00 0.00 -6.14 2.37 2.10 -1.85 -3.40 116.57 109.64 3ij6 h LYS 35 Ca -0.00 0.00 -0.54 0.00 -2.00 0.00 0.00 60.65 58.11 3ij6 h LYS 35 Cb 0.25 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.55 3ij6 h LYS 35 CO 0.02 0.02 1.30 0.42 -2.00 0.00 0.00 179.45 179.20 3ij6 s ILE 36 N -4.08 3.45 0.10 0.07 1.01 -1.10 -4.88 121.20 115.78 3ij6 s ILE 36 Ca -0.03 0.38 0.20 0.00 0.00 0.00 0.00 60.65 61.20 3ij6 s ILE 36 Cb 0.12 -3.84 0.16 0.00 0.01 0.00 0.00 42.46 38.92 3ij6 s ILE 36 CO 0.48 -0.68 1.72 0.07 0.00 0.00 0.00 174.94 176.53 3ij6 h LYS 37 N 13.77 0.00 0.00 2.79 2.10 -1.90 -2.70 116.57 130.64 3ij6 h LYS 37 Ca -0.29 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.36 3ij6 h LYS 37 Cb 1.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 3ij6 h LYS 37 CO 1.13 0.33 0.00 1.79 -2.00 0.00 0.00 179.45 180.71 3ij6 h THR 38 N 0.00 0.00 0.00 0.07 1.35 -1.82 -1.97 112.91 110.54 3ij6 h THR 38 Ca -0.00 -0.30 -0.24 0.00 -0.55 0.00 0.00 66.41 65.31 3ij6 h THR 38 Cb 0.92 1.10 0.01 0.00 -1.73 0.00 0.00 68.15 68.44 3ij6 h THR 38 CO 0.04 0.00 -0.99 0.25 -0.25 0.00 0.00 175.52 174.57 3ij6 h LEU 39 N 0.00 0.69 0.00 3.87 5.85 -1.82 -3.40 115.31 120.50 3ij6 h LEU 39 Ca 0.00 -0.56 0.00 0.00 0.84 0.00 0.00 57.88 58.16 3ij6 h LEU 39 Cb 0.41 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.22 3ij6 h LEU 39 CO 0.00 1.36 -0.96 1.15 -0.34 0.00 0.00 178.44 179.65 3ij6 n MET 40 N -3.79 1.55 -3.77 1.25 0.00 -1.19 -0.14 117.12 111.03 3ij6 n MET 40 Ca -0.09 -0.03 -0.37 0.00 0.00 0.00 0.00 57.70 57.21 3ij6 n MET 40 Cb 0.86 -1.01 -0.12 0.00 0.00 0.00 0.00 33.22 32.94 3ij6 n MET 40 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 3ij6 s ASP 41 N -2.27 5.26 0.15 3.17 3.68 -0.75 -4.17 116.67 121.74 3ij6 s ASP 41 Ca -0.01 -1.20 -0.14 0.00 2.13 0.00 0.00 52.55 53.33 3ij6 s ASP 41 Cb 0.03 -1.85 0.02 0.00 -1.45 0.00 0.00 42.92 39.68 3ij6 s ASP 41 CO 0.20 -0.33 1.67 0.25 0.13 0.00 0.00 175.17 177.09 3ij6 h LEU 42 N 8.19 0.69 -1.20 -1.34 5.85 -1.88 -2.13 115.31 123.49 3ij6 h LEU 42 Ca -0.23 -0.21 -0.06 0.00 0.84 0.00 0.00 57.88 58.23 3ij6 h LEU 42 Cb 1.08 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 3ij6 h LEU 42 CO 0.60 0.71 -0.12 -2.24 -0.34 0.00 0.00 178.44 177.05 3ij6 h ASP 43 N 0.63 0.39 -0.34 1.25 3.04 -1.95 -1.37 116.42 118.06 3ij6 h ASP 43 Ca 0.15 -0.09 -0.01 0.00 -3.24 0.00 0.00 57.03 53.84 3ij6 h ASP 43 Cb 0.27 -0.10 -0.02 0.00 -1.04 0.00 0.00 39.33 38.44 3ij6 h ASP 43 CO -0.00 0.55 0.15 -0.08 -2.04 0.00 0.00 179.24 177.82 3ij6 h GLU 44 N 0.38 0.50 -0.52 4.15 4.57 -1.79 -0.35 114.58 121.51 3ij6 h GLU 44 Ca 0.07 -0.08 0.03 0.00 -1.18 0.00 0.00 59.36 58.20 3ij6 h GLU 44 Cb 0.45 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.92 3ij6 h GLU 44 CO 0.03 0.47 0.29 -0.09 -1.18 0.00 0.00 179.01 178.53 3ij6 h ARG 45 N 0.41 0.56 -0.06 1.92 2.43 -0.92 -1.07 114.38 117.65 3ij6 h ARG 45 Ca 0.12 -0.03 -0.21 0.00 -0.81 0.00 0.00 59.98 59.04 3ij6 h ARG 45 Cb 0.14 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 3ij6 h ARG 45 CO -0.01 0.37 -0.84 -0.07 -1.51 0.00 0.00 179.97 177.91 3ij6 h LEU 46 N 0.58 0.65 -0.27 3.80 3.38 -1.16 -1.46 115.31 120.83 3ij6 h LEU 46 Ca 0.21 -0.47 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 3ij6 h LEU 46 Cb 0.06 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3ij6 h LEU 46 CO -0.11 1.24 0.10 0.74 0.09 0.00 0.00 178.44 180.50 3ij6 h THR 47 N 0.34 1.19 -0.45 0.22 2.02 -0.97 -3.09 112.91 112.17 3ij6 h THR 47 Ca -0.06 -0.58 0.00 0.00 0.77 0.00 0.00 66.41 66.54 3ij6 h THR 47 Cb 1.45 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.92 3ij6 h THR 47 CO 0.15 0.19 0.00 0.29 0.37 0.00 0.00 175.52 176.53 3ij6 n LYS 48 N -4.74 3.95 -1.60 6.66 5.02 -0.41 -4.99 118.16 122.04 3ij6 n LYS 48 Ca -0.03 -2.41 -0.54 0.00 -2.02 0.00 0.00 58.31 53.31 3ij6 n LYS 48 Cb 0.15 -2.07 -0.06 0.00 -0.02 0.00 0.00 35.03 33.02 3ij6 n LYS 48 CO 0.00 0.00 0.00 1.87 -0.52 0.00 0.00 177.40 178.75 3ij6 n TRP 49 N 0.50 1.52 -0.23 2.13 -0.00 -0.55 -4.72 117.44 116.09 3ij6 n TRP 49 Ca 0.21 0.67 -0.06 0.00 -0.00 0.00 0.00 57.50 58.33 3ij6 n TRP 49 Cb 0.97 -2.33 0.09 0.00 -0.00 0.00 0.00 31.31 30.03 3ij6 n TRP 49 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 3ij6 h PRO 50 N 4.85 1.07 -2.55 5.87 0.13 -1.85 -3.44 132.00 136.08 3ij6 h PRO 50 Ca -0.48 -0.24 -0.10 0.00 -0.87 0.00 0.00 66.00 64.31 3ij6 h PRO 50 Cb 1.34 -0.15 -0.26 0.00 0.13 0.00 0.00 31.00 32.06 3ij6 h PRO 50 CO 0.80 0.94 -0.27 0.34 -0.23 0.00 0.00 178.00 179.58 3ij6 s ASP 51 N -6.48 -0.53 0.52 1.44 -1.08 -1.26 -4.94 116.67 104.33 3ij6 s ASP 51 Ca -0.11 0.98 0.25 0.00 -0.52 0.00 0.00 52.55 53.14 3ij6 s ASP 51 Cb 0.15 0.92 1.41 0.00 -1.46 0.00 0.00 42.92 43.94 3ij6 s ASP 51 CO 0.84 -0.20 2.08 0.06 0.52 0.00 0.00 175.17 178.46 3ij6 h GLN 52 N 7.25 0.00 -0.65 4.34 -0.00 -2.02 -2.11 115.11 121.93 3ij6 h GLN 52 Ca -0.33 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.32 3ij6 h GLN 52 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.66 3ij6 h GLN 52 CO 0.26 0.12 0.00 0.09 -0.00 0.00 0.00 178.83 179.29 3ij6 n ASN 53 N -3.79 4.60 -4.43 0.06 5.03 -1.26 -4.88 115.26 110.59 3ij6 n ASN 53 Ca -0.02 -2.62 -0.33 0.00 0.87 0.00 0.00 54.58 52.48 3ij6 n ASN 53 Cb 0.22 -0.61 -0.13 0.00 -1.02 0.00 0.00 39.78 38.24 3ij6 n ASN 53 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 3ij6 s THR 54 N -2.20 3.32 0.06 3.41 2.01 -0.79 0.27 115.64 121.71 3ij6 s THR 54 Ca 0.44 -0.57 0.04 0.00 0.31 0.00 0.00 61.69 61.91 3ij6 s THR 54 Cb 0.32 -2.40 -0.04 0.00 0.01 0.00 0.00 72.50 70.39 3ij6 s THR 54 CO 0.16 0.53 -0.02 -0.54 -0.69 0.00 0.00 174.62 174.06 3ij6 s LYS 55 N 0.17 2.55 -0.06 4.92 1.02 -0.04 -4.87 119.74 123.42 3ij6 s LYS 55 Ca -0.05 -0.80 0.01 0.00 0.02 0.00 0.00 55.97 55.15 3ij6 s LYS 55 Cb -0.15 -2.53 -0.03 0.00 -0.52 0.00 0.00 37.83 34.60 3ij6 s LYS 55 CO 0.04 0.56 -0.06 -0.65 -0.92 0.00 0.00 175.35 174.32 3ij6 s GLN 56 N -2.01 2.76 -0.23 1.68 -0.21 -0.04 -0.66 119.66 120.95 3ij6 s GLN 56 Ca 0.23 -0.54 -0.15 0.00 0.02 0.00 0.00 55.36 54.91 3ij6 s GLN 56 Cb -0.11 -2.61 -0.04 0.00 1.00 0.00 0.00 33.01 31.25 3ij6 s GLN 56 CO 0.15 0.66 0.36 0.08 -2.12 0.00 0.00 175.29 174.42 3ij6 s VAL 57 N -0.83 5.20 -0.13 1.09 1.01 0.62 -1.08 120.40 126.28 3ij6 s VAL 57 Ca 0.13 0.60 -0.03 0.00 0.00 0.00 0.00 61.98 62.68 3ij6 s VAL 57 Cb -0.11 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 3ij6 s VAL 57 CO 0.02 0.22 -0.03 0.27 0.00 0.00 0.00 175.10 175.58 3ij6 s ILE 58 N 1.59 3.95 0.20 2.22 -4.36 -0.55 -2.53 121.20 121.71 3ij6 s ILE 58 Ca 0.16 -0.35 0.08 0.00 -0.26 0.00 0.00 60.65 60.28 3ij6 s ILE 58 Cb -0.15 -2.70 -0.05 0.00 1.25 0.00 0.00 42.46 40.81 3ij6 s ILE 58 CO 0.08 0.52 -0.15 -0.94 0.24 0.00 0.00 174.94 174.70 3ij6 s SER 59 N 0.02 2.58 0.39 4.36 1.04 -0.81 -0.15 113.70 121.12 3ij6 s SER 59 Ca 0.01 -0.99 -0.26 0.00 0.48 0.00 0.00 55.95 55.19 3ij6 s SER 59 Cb -0.13 -0.14 -0.09 0.00 0.10 0.00 0.00 66.02 65.76 3ij6 s SER 59 CO 0.03 -0.15 1.16 -0.76 0.98 0.00 0.00 173.24 174.50 3ij6 s LEU 60 N -3.20 4.23 0.73 2.42 1.43 -1.26 -0.76 118.68 122.27 3ij6 s LEU 60 Ca 0.21 2.33 -0.13 0.00 -1.03 0.00 0.00 54.13 55.51 3ij6 s LEU 60 Cb -0.02 -3.98 0.04 0.00 0.03 0.00 0.00 46.19 42.26 3ij6 s LEU 60 CO 0.07 -0.61 1.11 0.00 0.23 0.00 0.00 176.35 177.15 3ij6 s ALA 61 N -1.40 2.30 -0.90 4.21 0.00 -1.14 -4.77 121.76 120.07 3ij6 s ALA 61 Ca 0.56 0.45 -0.13 0.00 0.00 0.00 0.00 51.96 52.83 3ij6 s ALA 61 Cb -0.30 -3.31 -0.09 0.00 0.00 0.00 0.00 23.12 19.41 3ij6 s ALA 61 CO 0.39 -1.61 2.05 -1.71 0.00 0.00 0.00 175.76 174.88 3ij6 n ASN 62 N -3.02 3.91 -4.01 0.00 5.15 -1.26 -4.63 115.26 111.40 3ij6 n ASN 62 Ca 0.10 -2.51 -0.31 0.00 -0.60 0.00 0.00 54.58 51.26 3ij6 n ASN 62 Cb 0.52 -1.14 -0.15 0.00 -0.53 0.00 0.00 39.78 38.49 3ij6 n ASN 62 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3ij6 s ILE 63 N 4.06 2.40 -0.05 -1.44 1.01 -1.26 -5.11 121.20 120.81 3ij6 s ILE 63 Ca 0.48 -2.54 0.05 0.00 0.00 0.00 0.00 60.65 58.64 3ij6 s ILE 63 Cb 0.12 -2.74 -0.02 0.00 0.01 0.00 0.00 42.46 39.83 3ij6 s ILE 63 CO 0.03 -0.65 -0.21 -0.44 0.00 0.00 0.00 174.94 173.67 3ij6 s SER 64 N 0.69 3.43 0.51 3.58 0.01 -1.26 -5.03 113.70 115.63 3ij6 s SER 64 Ca 0.12 -0.39 0.23 0.00 1.31 0.00 0.00 55.95 57.22 3ij6 s SER 64 Cb -0.21 -0.75 1.32 0.00 0.21 0.00 0.00 66.02 66.60 3ij6 s SER 64 CO -0.06 0.29 2.00 -0.65 0.41 0.00 0.00 173.24 175.23 3ij6 h PRO 65 N 5.72 0.07 0.00 12.44 0.11 -1.94 -2.41 132.00 145.98 3ij6 h PRO 65 Ca -0.39 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 3ij6 h PRO 65 Cb 1.15 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3ij6 h PRO 65 CO 0.49 0.05 0.00 1.05 -0.21 0.00 0.00 178.00 179.38 3ij6 h GLU 66 N 0.08 0.00 0.00 1.05 4.11 -1.91 0.12 114.58 118.02 3ij6 h GLU 66 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.68 3ij6 h GLU 66 Cb 0.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.14 3ij6 h GLU 66 CO -0.02 0.00 -0.68 -0.25 0.07 0.00 0.00 179.01 178.13 3ij6 n ASP 67 N -2.50 0.63 0.00 3.06 8.00 -0.91 -4.55 116.55 120.28 3ij6 n ASP 67 Ca 0.00 -0.38 0.00 0.00 0.71 0.00 0.00 54.79 55.12 3ij6 n ASP 67 Cb 0.18 0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.75 3ij6 n ASP 67 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3ij6 n PHE 68 N -1.59 0.00 -4.36 1.24 3.72 -0.92 -5.11 117.46 110.44 3ij6 n PHE 68 Ca 0.05 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.19 3ij6 n PHE 68 Cb 0.35 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.80 3ij6 n PHE 68 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3ij6 s THR 69 N -1.66 2.35 0.95 4.37 -4.23 0.37 -5.09 115.64 112.70 3ij6 s THR 69 Ca 0.00 -1.91 -0.13 0.00 -1.18 0.00 0.00 61.69 58.47 3ij6 s THR 69 Cb 0.00 -2.90 0.16 0.00 1.34 0.00 0.00 72.50 71.10 3ij6 s THR 69 CO 0.00 -0.09 1.13 1.51 -0.54 0.00 0.00 174.62 176.63 3ij6 s ASP 70 N -3.76 3.18 0.38 3.99 1.47 -1.26 -4.62 116.67 116.05 3ij6 s ASP 70 Ca 0.37 0.96 0.07 0.00 1.18 0.00 0.00 52.55 55.12 3ij6 s ASP 70 Cb 0.04 -1.52 0.79 0.00 -0.34 0.00 0.00 42.92 41.89 3ij6 s ASP 70 CO 0.20 -2.76 1.99 0.77 0.68 0.00 0.00 175.17 176.05 3ij6 h SER 71 N -1.64 0.59 0.10 2.11 4.64 -1.96 -0.47 113.55 116.91 3ij6 h SER 71 Ca -0.51 -0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.80 3ij6 h SER 71 Cb 1.33 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3ij6 h SER 71 CO 0.59 0.40 -0.05 0.50 -0.87 0.00 0.00 176.83 177.40 3ij6 h LYS 72 N 0.68 -0.13 -0.65 4.77 3.64 -1.93 -2.61 116.57 120.34 3ij6 h LYS 72 Ca 0.26 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.63 3ij6 h LYS 72 Cb 0.17 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.99 3ij6 h LYS 72 CO -0.07 0.36 0.36 1.15 -2.27 0.00 0.00 179.45 178.97 3ij6 h THR 73 N -0.72 1.20 0.04 1.00 2.02 -1.90 -2.33 112.91 112.22 3ij6 h THR 73 Ca -0.01 -0.49 -0.00 0.00 0.77 0.00 0.00 66.41 66.67 3ij6 h THR 73 Cb 0.55 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 3ij6 h THR 73 CO 0.02 0.22 -0.02 -1.28 0.37 0.00 0.00 175.52 174.83 3ij6 h SER 74 N 0.91 -0.05 -0.67 4.18 0.87 -1.17 -0.80 113.55 116.83 3ij6 h SER 74 Ca 0.23 -0.23 0.08 0.00 -1.23 0.00 0.00 61.79 60.64 3ij6 h SER 74 Cb 0.02 0.01 -0.07 0.00 -0.44 0.00 0.00 62.40 61.93 3ij6 h SER 74 CO -0.04 0.21 0.33 0.00 -0.53 0.00 0.00 176.83 176.80 3ij6 h ALA 75 N 0.64 0.91 -0.44 6.23 0.00 -1.36 0.71 119.26 125.96 3ij6 h ALA 75 Ca -0.01 0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.97 3ij6 h ALA 75 Cb 0.28 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3ij6 h ALA 75 CO 0.01 -0.05 0.26 0.93 0.00 0.00 0.00 179.25 180.40 3ij6 h GLU 76 N 0.58 0.51 -0.16 0.00 5.08 -1.32 -2.08 114.58 117.20 3ij6 h GLU 76 Ca 0.32 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.49 3ij6 h GLU 76 Cb 0.31 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 3ij6 h GLU 76 CO -0.25 0.34 -0.58 -0.07 -1.00 0.00 0.00 179.01 177.45 3ij6 h LEU 77 N 0.53 0.57 -0.41 1.33 3.38 -0.39 -2.23 115.31 118.08 3ij6 h LEU 77 Ca 0.17 -0.31 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 3ij6 h LEU 77 Cb 0.00 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3ij6 h LEU 77 CO -0.07 1.02 0.07 0.00 0.09 0.00 0.00 178.44 179.55 3ij6 h GLN 79 N 0.54 0.82 -0.15 0.00 4.15 -1.31 0.69 115.11 119.84 3ij6 h GLN 79 Ca 0.13 -0.05 -0.10 0.00 0.77 0.00 0.00 58.65 59.40 3ij6 h GLN 79 Cb 0.36 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 3ij6 h GLN 79 CO 0.01 0.54 -0.34 0.77 -1.93 0.00 0.00 178.83 177.88 3ij6 h SER 80 N 0.84 0.31 -0.07 -0.69 0.02 -1.31 -1.95 113.55 110.70 3ij6 h SER 80 Ca 0.31 -0.11 -0.06 0.00 -0.84 0.00 0.00 61.79 61.09 3ij6 h SER 80 Cb 0.10 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.55 3ij6 h SER 80 CO -0.14 0.63 -0.18 0.00 -1.14 0.00 0.00 176.83 176.00 3ij6 h ALA 81 N 1.39 0.11 -0.94 3.77 0.00 -0.63 -2.38 119.26 120.58 3ij6 h ALA 81 Ca 0.03 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.58 3ij6 h ALA 81 Cb 0.72 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 3ij6 h ALA 81 CO 0.05 0.05 0.63 -0.91 0.00 0.00 0.00 179.25 179.07 3ij6 h ASN 82 N -0.26 1.08 -0.62 0.00 2.35 -0.86 0.28 115.58 117.55 3ij6 h ASN 82 Ca -0.00 -0.03 -0.09 0.00 -0.55 0.00 0.00 56.30 55.63 3ij6 h ASN 82 Cb 0.79 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.87 3ij6 h ASN 82 CO 0.04 0.79 0.05 -0.33 -1.65 0.00 0.00 177.43 176.32 3ij6 h GLU 83 N 1.28 1.05 -0.20 0.81 5.08 -1.41 0.18 114.58 121.38 3ij6 h GLU 83 Ca 0.35 -0.31 -0.12 0.00 -1.00 0.00 0.00 59.36 58.28 3ij6 h GLU 83 Cb -0.15 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 28.98 3ij6 h GLU 83 CO -0.07 1.01 -0.37 1.49 -1.00 0.00 0.00 179.01 180.06 3ij6 h GLU 84 N 0.96 0.44 0.01 2.33 4.81 -0.87 -0.11 114.58 122.15 3ij6 h GLU 84 Ca 0.18 -0.21 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3ij6 h GLU 84 Cb 0.50 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.87 3ij6 h GLU 84 CO 0.02 0.75 -0.00 -0.07 -0.73 0.00 0.00 179.01 178.98 3ij6 h LEU 85 N 0.37 -0.01 -0.54 1.64 3.38 -0.25 -1.12 115.31 118.79 3ij6 h LEU 85 Ca 0.04 -0.24 0.08 0.00 0.09 0.00 0.00 57.88 57.85 3ij6 h LEU 85 Cb 0.83 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.51 3ij6 h LEU 85 CO 0.07 0.23 0.17 -1.28 0.09 0.00 0.00 178.44 177.72 3ij6 h SER 86 N -0.25 0.14 -0.62 -0.43 0.87 -0.57 -2.47 113.55 110.22 3ij6 h SER 86 Ca -0.00 0.08 0.05 0.00 -1.23 0.00 0.00 61.79 60.68 3ij6 h SER 86 Cb 0.24 0.07 -0.05 0.00 -0.44 0.00 0.00 62.40 62.23 3ij6 h SER 86 CO 0.00 0.10 0.35 -1.13 -0.53 0.00 0.00 176.83 175.62 3ij6 h ASN 87 N 0.33 0.54 -0.63 6.23 -1.24 -0.90 -1.78 115.58 118.13 3ij6 h ASN 87 Ca 0.27 0.02 0.03 0.00 0.71 0.00 0.00 56.30 57.33 3ij6 h ASN 87 Cb 0.32 -0.09 -0.04 0.00 0.73 0.00 0.00 38.32 39.25 3ij6 h ASN 87 CO -0.29 0.36 0.42 -0.07 -1.29 0.00 0.00 177.43 176.56 3ij6 h LEU 88 N 0.67 0.65 -0.00 0.34 4.07 -0.74 0.12 115.31 120.41 3ij6 h LEU 88 Ca 0.27 -0.01 -0.04 0.00 0.08 0.00 0.00 57.88 58.18 3ij6 h LEU 88 Cb 0.12 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 41.72 3ij6 h LEU 88 CO -0.15 0.45 -0.17 0.58 -1.08 0.00 0.00 178.44 178.06 3ij6 h VAL 89 N 0.75 1.57 -0.41 1.22 2.07 -1.25 -2.05 116.25 118.15 3ij6 h VAL 89 Ca 0.25 -1.91 0.06 0.00 0.82 0.00 0.00 66.70 65.92 3ij6 h VAL 89 Cb 0.08 2.80 -0.05 0.00 -1.52 0.00 0.00 31.29 32.59 3ij6 h VAL 89 CO -0.07 0.51 0.12 -0.78 0.02 0.00 0.00 177.57 177.37 3ij6 h ASP 90 N -0.59 0.08 1.27 0.57 3.58 -1.10 -2.83 116.42 117.41 3ij6 h ASP 90 Ca -0.02 0.06 -0.07 0.00 0.42 0.00 0.00 57.03 57.42 3ij6 h ASP 90 Cb 0.93 0.06 -0.01 0.00 1.72 0.00 0.00 39.33 42.04 3ij6 h ASP 90 CO 0.03 0.08 -0.31 1.56 -2.88 0.00 0.00 179.24 177.72 3ij6 h GLN 91 N 0.26 0.00 -2.10 0.28 1.08 -0.84 -3.36 115.11 110.43 3ij6 h GLN 91 Ca 0.20 0.00 -0.57 0.00 -1.45 0.00 0.00 58.65 56.82 3ij6 h GLN 91 Cb 0.21 0.00 -0.41 0.00 -0.05 0.00 0.00 27.48 27.24 3ij6 h GLN 91 CO -0.23 0.31 -0.87 0.72 -0.95 0.00 0.00 178.83 177.82 3ij6 n HIS 92 N -3.29 1.65 0.83 2.96 8.25 -0.77 -4.97 115.22 119.88 3ij6 n HIS 92 Ca 0.01 -3.86 0.12 0.00 -0.26 0.00 0.00 57.72 53.73 3ij6 n HIS 92 Cb 0.56 -0.45 0.51 0.00 1.12 0.00 0.00 29.99 31.74 3ij6 n HIS 92 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 3ij6 n PRO 93 N 0.98 0.00 0.00 -0.41 -0.04 -1.09 -1.54 135.00 132.90 3ij6 n PRO 93 Ca 0.26 0.09 0.13 0.00 -0.04 0.00 0.00 63.50 63.93 3ij6 n PRO 93 Cb 0.48 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.75 3ij6 n PRO 93 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ij6 n GLY 94 N 0.99 0.09 0.55 0.55 0.00 -1.26 -4.34 105.19 101.76 3ij6 n GLY 94 Ca 0.06 -0.52 -0.06 0.00 0.00 0.00 0.00 46.02 45.50 3ij6 n GLY 94 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ij6 n LYS 95 N 0.22 0.14 -3.72 1.61 4.76 -0.94 -4.83 118.16 115.40 3ij6 n LYS 95 Ca 0.15 0.05 -0.37 0.00 -2.87 0.00 0.00 58.31 55.27 3ij6 n LYS 95 Cb 0.43 -0.86 -0.12 0.00 -1.84 0.00 0.00 35.03 32.64 3ij6 n LYS 95 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 3ij6 s PHE 96 N -2.12 3.13 0.13 2.13 0.08 -0.59 -0.86 117.98 119.89 3ij6 s PHE 96 Ca -0.09 -0.61 0.21 0.00 0.12 0.00 0.00 56.93 56.57 3ij6 s PHE 96 Cb 0.03 -2.29 0.78 0.00 -0.57 0.00 0.00 43.02 40.98 3ij6 s PHE 96 CO 0.12 -0.44 1.77 0.00 -0.10 0.00 0.00 175.22 176.57 3ij6 h ALA 97 N 8.28 1.00 0.00 5.36 0.00 -1.39 -3.42 119.26 129.09 3ij6 h ALA 97 Ca -0.34 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.30 3ij6 h ALA 97 Cb 1.15 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3ij6 h ALA 97 CO 0.60 0.37 0.00 0.41 0.00 0.00 0.00 179.25 180.62 3ij6 n GLY 98 N 0.23 0.02 3.24 0.00 0.00 -1.24 -4.99 105.19 102.45 3ij6 n GLY 98 Ca 0.00 -1.06 -0.21 0.00 0.00 0.00 0.00 46.02 44.75 3ij6 n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ij6 s ALA 99 N -2.00 1.54 -0.23 4.61 0.00 0.31 -1.49 121.76 124.51 3ij6 s ALA 99 Ca 0.00 -1.20 -0.06 0.00 0.00 0.00 0.00 51.96 50.70 3ij6 s ALA 99 Cb 0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.94 3ij6 s ALA 99 CO 0.00 0.23 0.03 0.08 0.00 0.00 0.00 175.76 176.10 3ij6 s VAL 100 N -1.50 4.08 0.46 0.00 1.01 0.79 -1.07 120.40 124.17 3ij6 s VAL 100 Ca 0.05 -0.26 -0.22 0.00 0.00 0.00 0.00 61.98 61.55 3ij6 s VAL 100 Cb -0.08 -2.88 -0.08 0.00 0.00 0.00 0.00 36.38 33.33 3ij6 s VAL 100 CO 0.04 0.38 1.08 0.00 0.00 0.00 0.00 175.10 176.59 3ij6 s ALA 101 N 1.39 2.94 0.07 5.51 0.00 0.26 -4.37 121.76 127.56 3ij6 s ALA 101 Ca 0.05 0.73 -0.20 0.00 0.00 0.00 0.00 51.96 52.54 3ij6 s ALA 101 Cb -0.15 -3.30 -0.07 0.00 0.00 0.00 0.00 23.12 19.61 3ij6 s ALA 101 CO 0.02 -0.41 0.58 -1.50 0.00 0.00 0.00 175.76 174.45 3ij6 s ILE 102 N -1.76 4.74 -0.15 0.00 2.07 -1.26 -0.50 121.20 124.35 3ij6 s ILE 102 Ca 0.64 1.24 -0.04 0.00 -1.41 0.00 0.00 60.65 61.08 3ij6 s ILE 102 Cb -0.22 -3.91 -0.03 0.00 0.13 0.00 0.00 42.46 38.43 3ij6 s ILE 102 CO 0.26 0.54 -0.01 -0.76 -1.91 0.00 0.00 174.94 173.06 3ij6 s LEU 103 N -1.00 3.42 -0.75 8.50 1.43 -1.26 -4.86 118.68 124.16 3ij6 s LEU 103 Ca 0.29 -0.03 -0.24 0.00 -1.03 0.00 0.00 54.13 53.12 3ij6 s LEU 103 Cb -0.19 -1.82 0.05 0.00 0.03 0.00 0.00 46.19 44.26 3ij6 s LEU 103 CO 0.19 0.21 1.17 -2.16 0.23 0.00 0.00 176.35 176.00 3ij6 s PRO 104 N 0.10 3.23 0.03 1.29 0.04 -1.26 -4.84 135.00 133.58 3ij6 s PRO 104 Ca 0.01 -0.66 0.28 0.00 0.04 0.00 0.00 61.00 60.67 3ij6 s PRO 104 Cb -0.13 -4.38 1.16 0.00 0.04 0.00 0.00 34.50 31.19 3ij6 s PRO 104 CO 0.02 -2.01 1.89 -1.33 0.04 0.00 0.00 177.00 175.62 3ij6 n MET 105 N 8.51 0.03 0.00 4.56 2.81 -1.26 -0.84 117.12 130.93 3ij6 n MET 105 Ca 0.05 0.04 0.15 0.00 -1.81 0.00 0.00 57.70 56.13 3ij6 n MET 105 Cb 0.48 -1.54 0.79 0.00 -0.71 0.00 0.00 33.22 32.24 3ij6 n MET 105 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 3ij6 n ASN 106 N -1.60 0.00 -3.71 7.83 6.94 -1.26 -4.47 115.26 118.99 3ij6 n ASN 106 Ca 0.07 -0.27 -0.29 0.00 -0.02 0.00 0.00 54.58 54.06 3ij6 n ASN 106 Cb 0.34 -0.24 -0.13 0.00 -2.36 0.00 0.00 39.78 37.39 3ij6 n ASN 106 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 3ij6 s ASN 107 N -2.48 3.60 0.19 0.53 3.84 -0.02 -4.65 114.94 115.95 3ij6 s ASN 107 Ca 0.32 -2.76 -0.10 0.00 0.21 0.00 0.00 52.86 50.52 3ij6 s ASN 107 Cb 0.21 -1.05 0.11 0.00 -0.55 0.00 0.00 41.25 39.96 3ij6 s ASN 107 CO 0.45 -0.24 1.75 0.40 -2.79 0.00 0.00 177.10 176.66 3ij6 h ILE 108 N 5.15 1.24 -0.25 -5.21 1.08 -1.78 0.28 117.51 118.01 3ij6 h ILE 108 Ca 0.02 -0.73 0.05 0.00 -0.39 0.00 0.00 64.86 63.81 3ij6 h ILE 108 Cb 0.91 0.47 -0.05 0.00 -3.07 0.00 0.00 36.82 35.08 3ij6 h ILE 108 CO 0.50 0.29 -0.09 -0.08 -0.69 0.00 0.00 178.15 178.08 3ij6 h GLU 109 N 0.94 -0.04 -0.30 2.37 4.81 -1.94 0.29 114.58 120.71 3ij6 h GLU 109 Ca 0.22 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.35 3ij6 h GLU 109 Cb 0.19 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 3ij6 h GLU 109 CO -0.02 -0.03 -0.27 1.03 -0.73 0.00 0.00 179.01 178.99 3ij6 h SER 110 N -0.04 0.62 -0.36 1.04 0.87 -1.75 -2.50 113.55 111.43 3ij6 h SER 110 Ca 0.13 -0.23 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 3ij6 h SER 110 Cb 0.24 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 3ij6 h SER 110 CO -0.28 0.87 0.23 0.00 -0.53 0.00 0.00 176.83 177.12 3ij6 h ALA 111 N 1.17 0.46 -0.94 6.23 0.00 0.07 -1.18 119.26 125.08 3ij6 h ALA 111 Ca 0.07 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.97 3ij6 h ALA 111 Cb 0.74 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 3ij6 h ALA 111 CO 0.06 -0.06 0.61 0.00 0.00 0.00 0.00 179.25 179.87 3ij6 h LYS 113 N 1.19 0.86 -0.37 0.00 1.79 -0.96 -1.74 116.57 117.33 3ij6 h LYS 113 Ca 0.37 -0.18 -0.02 0.00 -2.18 0.00 0.00 60.65 58.64 3ij6 h LYS 113 Cb -0.01 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 30.49 3ij6 h LYS 113 CO -0.11 0.77 0.14 0.28 -1.08 0.00 0.00 179.45 179.45 3ij6 h VAL 114 N 0.83 1.20 -0.52 0.50 2.07 -0.71 0.98 116.25 120.59 3ij6 h VAL 114 Ca 0.18 -0.63 0.03 0.00 0.82 0.00 0.00 66.70 67.10 3ij6 h VAL 114 Cb 0.30 0.92 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 3ij6 h VAL 114 CO -0.00 0.22 0.29 0.40 0.02 0.00 0.00 177.57 178.51 3ij6 h ILE 115 N 0.45 1.02 -0.79 4.57 1.08 -1.14 -1.72 117.51 120.98 3ij6 h ILE 115 Ca 0.12 -0.20 0.04 0.00 -0.39 0.00 0.00 64.86 64.43 3ij6 h ILE 115 Cb 0.21 0.39 -0.05 0.00 -3.07 0.00 0.00 36.82 34.30 3ij6 h ILE 115 CO -0.01 0.11 0.50 0.28 -0.69 0.00 0.00 178.15 178.34 3ij6 h SER 116 N 0.58 0.81 0.28 1.72 0.02 -1.11 -2.87 113.55 112.98 3ij6 h SER 116 Ca 0.22 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.16 3ij6 h SER 116 Cb 0.07 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.43 3ij6 h SER 116 CO -0.12 0.55 -0.05 0.77 -1.14 0.00 0.00 176.83 176.84 3ij6 h SER 117 N 0.96 0.00 -0.19 3.07 4.64 0.10 -3.02 113.55 119.11 3ij6 h SER 117 Ca 0.32 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.57 3ij6 h SER 117 Cb 0.05 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.12 3ij6 h SER 117 CO -0.13 0.05 -0.09 0.40 -0.87 0.00 0.00 176.83 176.20 3ij6 h ILE 118 N 0.00 1.23 -0.32 0.95 2.04 -1.22 -1.67 117.51 118.52 3ij6 h ILE 118 Ca -0.00 -0.98 -0.08 0.00 1.00 0.00 0.00 64.86 64.79 3ij6 h ILE 118 Cb 0.21 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 3ij6 h ILE 118 CO 0.01 0.33 -0.14 0.11 0.00 0.00 0.00 178.15 178.45 3ij6 h LYS 119 N 0.51 0.57 0.00 2.37 1.57 -1.69 -3.13 116.57 116.77 3ij6 h LYS 119 Ca 0.10 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3ij6 h LYS 119 Cb 0.47 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.72 3ij6 h LYS 119 CO 0.03 0.70 0.00 -0.44 -0.57 0.00 0.00 179.45 179.16 3ij6 h ASP 120 N 0.52 0.00 -3.18 0.86 3.32 -1.42 -3.43 116.42 113.08 3ij6 h ASP 120 Ca 0.09 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.55 3ij6 h ASP 120 Cb 0.55 0.00 -0.36 0.00 0.22 0.00 0.00 39.33 39.74 3ij6 h ASP 120 CO 0.04 0.00 -0.82 -0.62 -1.72 0.00 0.00 179.24 176.11 3ij6 s ASP 121 N -5.13 2.69 0.45 6.45 3.68 -0.96 -5.02 116.67 118.83 3ij6 s ASP 121 Ca 0.05 -0.51 0.16 0.00 2.13 0.00 0.00 52.55 54.38 3ij6 s ASP 121 Cb 0.09 -1.10 1.03 0.00 -1.45 0.00 0.00 42.92 41.48 3ij6 s ASP 121 CO 0.53 -0.09 1.97 -0.33 0.13 0.00 0.00 175.17 177.38 3ij6 h GLU 122 N 8.07 0.00 0.00 4.34 4.39 -1.84 -3.09 114.58 126.44 3ij6 h GLU 122 Ca -0.34 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.31 3ij6 h GLU 122 Cb 1.13 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.77 3ij6 h GLU 122 CO 0.49 0.21 -0.21 -0.91 -1.16 0.00 0.00 179.01 177.43 3ij6 h ASN 123 N 0.00 0.00 -3.51 1.42 2.35 -1.92 -3.43 115.58 110.49 3ij6 h ASN 123 Ca -0.00 0.00 -0.61 0.00 -0.55 0.00 0.00 56.30 55.14 3ij6 h ASN 123 Cb 0.40 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 38.65 3ij6 h ASN 123 CO 0.03 0.21 -0.23 -0.76 -1.65 0.00 0.00 177.43 175.03 3ij6 s LEU 124 N -6.34 4.14 0.00 1.61 1.43 -1.17 -0.53 118.68 117.82 3ij6 s LEU 124 Ca 0.05 0.46 0.09 0.00 -1.03 0.00 0.00 54.13 53.70 3ij6 s LEU 124 Cb 0.06 -2.47 -0.01 0.00 0.03 0.00 0.00 46.19 43.80 3ij6 s LEU 124 CO 0.69 -0.08 0.57 1.33 0.23 0.00 0.00 176.35 179.10 3ij6 n VAL 125 N 4.42 0.00 -1.38 -1.59 0.24 -0.23 -4.85 118.33 114.94 3ij6 n VAL 125 Ca -0.09 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 61.81 3ij6 n VAL 125 Cb 0.51 1.10 0.00 0.00 -1.47 0.00 0.00 33.84 33.98 3ij6 n VAL 125 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ij6 n GLY 126 N 0.87 -1.29 3.29 7.63 0.00 -1.25 -4.50 105.19 109.94 3ij6 n GLY 126 Ca 0.04 -0.96 -0.22 0.00 0.00 0.00 0.00 46.02 44.87 3ij6 n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ij6 s ALA 127 N -1.56 1.83 -0.21 4.61 0.00 -1.09 -0.57 121.76 124.76 3ij6 s ALA 127 Ca 0.00 -1.33 -0.10 0.00 0.00 0.00 0.00 51.96 50.53 3ij6 s ALA 127 Cb 0.00 -0.20 -0.05 0.00 0.00 0.00 0.00 23.12 22.87 3ij6 s ALA 127 CO 0.00 0.28 0.15 -1.14 0.00 0.00 0.00 175.76 175.05 3ij6 s GLN 128 N -2.29 4.15 0.18 0.00 0.74 0.34 -1.08 119.66 121.70 3ij6 s GLN 128 Ca 0.10 -0.23 0.08 0.00 0.05 0.00 0.00 55.36 55.36 3ij6 s GLN 128 Cb -0.08 -3.46 -0.04 0.00 1.10 0.00 0.00 33.01 30.53 3ij6 s GLN 128 CO 0.05 0.22 -0.05 0.96 -0.55 0.00 0.00 175.29 175.91 3ij6 s ILE 129 N 0.60 3.42 0.28 -2.34 -4.36 0.09 -4.30 121.20 114.60 3ij6 s ILE 129 Ca 0.08 -1.56 0.09 0.00 -0.26 0.00 0.00 60.65 59.00 3ij6 s ILE 129 Cb -0.12 -2.71 -0.04 0.00 1.25 0.00 0.00 42.46 40.84 3ij6 s ILE 129 CO 0.00 -0.11 0.05 -0.36 0.24 0.00 0.00 174.94 174.76 3ij6 s PHE 130 N -1.72 2.74 0.32 1.37 0.08 -1.26 -1.50 117.98 118.01 3ij6 s PHE 130 Ca 0.26 -0.25 0.03 0.00 0.12 0.00 0.00 56.93 57.09 3ij6 s PHE 130 Cb -0.09 -1.31 0.56 0.00 -0.57 0.00 0.00 43.02 41.61 3ij6 s PHE 130 CO 0.17 0.55 1.88 1.79 -0.10 0.00 0.00 175.22 179.51 3ij6 h THR 131 N 1.78 1.20 -4.10 0.64 1.35 -1.73 -3.41 112.91 108.64 3ij6 h THR 131 Ca -0.44 -0.70 -0.47 0.00 -0.55 0.00 0.00 66.41 64.25 3ij6 h THR 131 Cb 1.25 0.76 -0.26 0.00 -1.73 0.00 0.00 68.15 68.16 3ij6 h THR 131 CO 0.61 0.26 -0.80 -0.13 -0.25 0.00 0.00 175.52 175.21 3ij6 s ARG 132 N -5.16 1.03 -0.05 4.72 0.52 -1.26 -1.73 118.95 117.02 3ij6 s ARG 132 Ca -0.09 -0.69 0.03 0.00 -0.52 0.00 0.00 55.73 54.46 3ij6 s ARG 132 Cb 0.16 -1.03 0.01 0.00 0.52 0.00 0.00 34.95 34.61 3ij6 s ARG 132 CO 0.77 0.26 -0.12 -1.01 0.02 0.00 0.00 175.30 175.23 3ij6 s HIS 133 N -0.69 1.30 -1.74 -0.53 3.76 0.21 -4.83 115.29 112.78 3ij6 s HIS 133 Ca 0.03 -0.42 0.00 0.00 -0.15 0.00 0.00 55.06 54.52 3ij6 s HIS 133 Cb -0.07 -0.94 0.00 0.00 1.11 0.00 0.00 32.58 32.67 3ij6 s HIS 133 CO 0.01 -0.20 0.00 1.28 -0.85 0.00 0.00 174.74 174.98 3ij6 n LEU 134 N 3.58 -1.89 -0.83 0.89 4.77 -1.26 -0.97 117.00 121.29 3ij6 n LEU 134 Ca -0.21 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.68 3ij6 n LEU 134 Cb 0.52 -2.89 -0.03 0.00 -2.33 0.00 0.00 43.42 38.69 3ij6 n LEU 134 CO 0.25 -0.22 -0.10 0.61 -1.33 0.00 0.00 177.39 176.60 3ij6 n GLY 135 N -1.00 0.80 3.34 -0.72 0.00 -1.26 -5.04 105.19 101.32 3ij6 n GLY 135 Ca -0.24 -0.57 -0.24 0.00 0.00 0.00 0.00 46.02 44.98 3ij6 n GLY 135 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ij6 s LYS 136 N -3.27 1.29 0.48 1.61 1.02 -0.14 -5.12 119.74 115.61 3ij6 s LYS 136 Ca 0.00 -1.37 -0.24 0.00 0.02 0.00 0.00 55.97 54.37 3ij6 s LYS 136 Cb 0.00 -1.47 -0.07 0.00 -0.52 0.00 0.00 37.83 35.77 3ij6 s LYS 136 CO 0.00 0.31 1.43 0.45 -0.92 0.00 0.00 175.35 176.62 3ij6 s SER 137 N -2.48 5.66 0.60 2.83 0.15 -1.26 -0.62 113.70 118.59 3ij6 s SER 137 Ca 0.15 2.91 0.30 0.00 0.70 0.00 0.00 55.95 60.01 3ij6 s SER 137 Cb -0.07 -2.65 1.69 0.00 -1.71 0.00 0.00 66.02 63.28 3ij6 s SER 137 CO 0.07 -1.32 2.07 -0.29 1.20 0.00 0.00 173.24 174.97 3ij6 h ILE 138 N 2.06 0.36 0.00 6.45 6.09 -1.57 -0.17 117.51 130.73 3ij6 h ILE 138 Ca -0.51 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 62.98 3ij6 h ILE 138 Cb 1.28 0.80 0.00 0.00 0.47 0.00 0.00 36.82 39.37 3ij6 h ILE 138 CO 0.60 0.00 0.00 0.00 -3.07 0.00 0.00 178.15 175.68 3ij6 n ALA 139 N -2.26 2.27 -1.65 0.18 0.00 -1.26 -4.71 120.51 113.08 3ij6 n ALA 139 Ca 0.02 -0.11 -0.43 0.00 0.00 0.00 0.00 53.44 52.92 3ij6 n ALA 139 Cb 0.35 -1.43 -0.00 0.00 0.00 0.00 0.00 19.45 18.37 3ij6 n ALA 139 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3ij6 n ASP 140 N -1.40 2.02 0.07 0.00 2.03 -0.08 -4.86 116.55 114.33 3ij6 n ASP 140 Ca 0.09 1.16 0.15 0.00 0.52 0.00 0.00 54.79 56.71 3ij6 n ASP 140 Cb 0.26 -1.40 0.65 0.00 -0.72 0.00 0.00 41.12 39.91 3ij6 n ASP 140 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 3ij6 h LYS 141 N 2.14 0.06 -1.00 -0.67 2.10 -1.90 -1.78 116.57 115.51 3ij6 h LYS 141 Ca -0.44 -0.00 0.08 0.00 -2.00 0.00 0.00 60.65 58.28 3ij6 h LYS 141 Cb 1.31 -0.01 -0.07 0.00 -0.90 0.00 0.00 32.23 32.56 3ij6 h LYS 141 CO 0.61 0.04 0.64 1.49 -2.00 0.00 0.00 179.45 180.23 3ij6 h GLU 142 N 0.06 1.10 0.00 0.07 4.81 -1.95 -2.51 114.58 116.15 3ij6 h GLU 142 Ca 0.17 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 3ij6 h GLU 142 Cb 0.61 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.75 3ij6 h GLU 142 CO -0.01 0.72 -0.51 1.19 -0.73 0.00 0.00 179.01 179.68 3ij6 n PHE 143 N -4.52 0.13 -0.35 0.92 3.72 -0.68 -4.39 117.46 112.30 3ij6 n PHE 143 Ca 0.16 0.04 0.05 0.00 -0.05 0.00 0.00 57.45 57.65 3ij6 n PHE 143 Cb 0.22 -0.37 0.22 0.00 -0.94 0.00 0.00 39.48 38.62 3ij6 n PHE 143 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 3ij6 h ARG 144 N 0.00 1.03 -0.11 -1.08 9.65 -1.36 -1.81 114.38 120.70 3ij6 h ARG 144 Ca 0.00 -0.06 0.03 0.00 -1.10 0.00 0.00 59.98 58.85 3ij6 h ARG 144 Cb 0.56 -0.23 -0.00 0.00 -1.39 0.00 0.00 29.97 28.91 3ij6 h ARG 144 CO 0.00 0.68 0.10 -1.35 2.80 0.00 0.00 179.97 182.20 3ij6 h PRO 145 N 1.06 0.00 -0.13 0.20 0.11 -1.77 0.17 132.00 131.65 3ij6 h PRO 145 Ca 0.44 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 66.35 3ij6 h PRO 145 Cb 0.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.42 3ij6 h PRO 145 CO -0.20 0.00 -0.73 0.28 -0.21 0.00 0.00 178.00 177.14 3ij6 h VAL 146 N 0.00 1.32 -0.18 3.15 2.07 -1.64 -1.27 116.25 119.70 3ij6 h VAL 146 Ca 0.05 -2.01 -0.19 0.00 0.82 0.00 0.00 66.70 65.37 3ij6 h VAL 146 Cb 0.25 2.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 3ij6 h VAL 146 CO -0.00 0.62 -0.66 -0.07 0.02 0.00 0.00 177.57 177.49 3ij6 h LEU 147 N 0.44 0.80 -0.79 2.57 3.38 -1.26 -2.64 115.31 117.81 3ij6 h LEU 147 Ca -0.04 -0.48 -0.00 0.00 0.09 0.00 0.00 57.88 57.46 3ij6 h LEU 147 Cb 1.33 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.81 3ij6 h LEU 147 CO 0.14 1.25 0.49 0.00 0.09 0.00 0.00 178.44 180.41 3ij6 h ALA 148 N 0.75 1.00 -0.37 1.53 0.00 -0.98 -1.50 119.26 119.70 3ij6 h ALA 148 Ca -0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3ij6 h ALA 148 Cb 1.25 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 3ij6 h ALA 148 CO 0.13 0.45 0.17 0.37 0.00 0.00 0.00 179.25 180.37 3ij6 h GLN 149 N 1.07 0.53 -0.49 0.00 5.75 -1.16 -0.22 115.11 120.59 3ij6 h GLN 149 Ca 0.28 -0.08 -0.04 0.00 -0.15 0.00 0.00 58.65 58.67 3ij6 h GLN 149 Cb -0.07 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.36 3ij6 h GLN 149 CO -0.06 0.47 0.14 0.00 -2.65 0.00 0.00 178.83 176.74 3ij6 h ALA 150 N 1.03 1.33 -0.01 3.38 0.00 -1.27 0.13 119.26 123.84 3ij6 h ALA 150 Ca 0.13 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3ij6 h ALA 150 Cb 0.12 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3ij6 h ALA 150 CO -0.02 0.48 -0.00 0.00 0.00 0.00 0.00 179.25 179.72 3ij6 h ALA 151 N 1.44 0.01 -0.44 0.00 0.00 -1.09 0.91 119.26 120.08 3ij6 h ALA 151 Ca 0.16 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.98 3ij6 h ALA 151 Cb 0.23 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 3ij6 h ALA 151 CO -0.01 -0.32 0.07 -0.22 0.00 0.00 0.00 179.25 178.78 3ij6 h LYS 152 N -0.32 0.19 -0.13 0.00 3.64 -0.67 -2.67 116.57 116.61 3ij6 h LYS 152 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3ij6 h LYS 152 Cb 0.34 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 3ij6 h LYS 152 CO 0.00 0.13 0.00 1.28 -2.27 0.00 0.00 179.45 178.59 3ij6 n LEU 153 N -5.12 1.70 -3.30 5.20 4.77 0.41 -4.92 117.00 115.73 3ij6 n LEU 153 Ca 0.04 -0.68 -0.24 0.00 -0.03 0.00 0.00 56.01 55.10 3ij6 n LEU 153 Cb 0.21 -0.08 0.03 0.00 -2.33 0.00 0.00 43.42 41.25 3ij6 n LEU 153 CO 0.21 0.34 0.05 1.41 -1.33 0.00 0.00 177.39 178.06 3ij6 n HIS 154 N 0.34 -2.13 -3.05 -1.77 8.25 -0.62 -4.98 115.22 111.25 3ij6 n HIS 154 Ca 0.17 0.64 -0.40 0.00 -0.26 0.00 0.00 57.72 57.86 3ij6 n HIS 154 Cb 0.35 -4.20 -0.05 0.00 1.12 0.00 0.00 29.99 27.20 3ij6 n HIS 154 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3ij6 s VAL 155 N -3.17 4.98 0.40 1.59 1.01 0.22 -4.66 120.40 120.78 3ij6 s VAL 155 Ca 0.42 1.33 -0.23 0.00 0.00 0.00 0.00 61.98 63.50 3ij6 s VAL 155 Cb -0.20 -4.01 -0.10 0.00 0.00 0.00 0.00 36.38 32.08 3ij6 s VAL 155 CO 0.51 0.10 0.97 -2.16 0.00 0.00 0.00 175.10 174.52 3ij6 s PRO 156 N 1.91 4.27 -0.10 2.72 0.04 -1.26 -4.53 135.00 138.05 3ij6 s PRO 156 Ca 0.32 1.25 0.02 0.00 0.04 0.00 0.00 61.00 62.63 3ij6 s PRO 156 Cb -0.16 -2.38 -0.01 0.00 0.04 0.00 0.00 34.50 31.99 3ij6 s PRO 156 CO 0.11 -0.01 -0.17 -0.51 0.04 0.00 0.00 177.00 176.47 3ij6 s LEU 157 N -2.86 2.54 -0.26 -3.56 1.43 -0.10 -2.68 118.68 113.20 3ij6 s LEU 157 Ca 0.59 -0.36 -0.21 0.00 -1.03 0.00 0.00 54.13 53.13 3ij6 s LEU 157 Cb -0.14 -1.54 -0.02 0.00 0.03 0.00 0.00 46.19 44.53 3ij6 s LEU 157 CO 0.18 0.22 0.64 0.26 0.23 0.00 0.00 176.35 177.88 3ij6 s TRP 158 N 0.03 3.27 -0.23 0.29 0.51 -0.24 0.43 118.94 123.00 3ij6 s TRP 158 Ca -0.06 0.80 -0.09 0.00 -2.12 0.00 0.00 56.10 54.63 3ij6 s TRP 158 Cb -0.15 -2.88 -0.04 0.00 -0.81 0.00 0.00 33.47 29.59 3ij6 s TRP 158 CO 0.05 -0.36 0.12 1.41 -0.51 0.00 0.00 176.95 177.66 3ij6 s MET 159 N 2.55 3.95 -0.01 4.98 1.75 0.14 -0.73 119.30 131.93 3ij6 s MET 159 Ca 0.27 -0.34 0.08 0.00 -1.25 0.00 0.00 55.69 54.45 3ij6 s MET 159 Cb -0.15 -3.42 -0.02 0.00 2.84 0.00 0.00 34.83 34.08 3ij6 s MET 159 CO 0.09 0.05 -0.24 -1.58 -0.65 0.00 0.00 175.02 172.69 3ij6 s HIS 160 N 1.04 2.15 0.47 4.11 2.46 -0.56 -2.62 115.29 122.34 3ij6 s HIS 160 Ca 0.06 -0.41 -0.20 0.00 0.47 0.00 0.00 55.06 54.99 3ij6 s HIS 160 Cb -0.14 -1.37 -0.09 0.00 -0.13 0.00 0.00 32.58 30.85 3ij6 s HIS 160 CO 0.04 -0.01 0.98 -1.25 -2.47 0.00 0.00 174.74 172.04 3ij6 s PRO 161 N -0.70 4.02 0.02 2.88 0.04 -1.26 -1.98 135.00 138.01 3ij6 s PRO 161 Ca 0.09 1.16 0.02 0.00 0.04 0.00 0.00 61.00 62.32 3ij6 s PRO 161 Cb -0.09 -2.14 -0.01 0.00 0.04 0.00 0.00 34.50 32.29 3ij6 s PRO 161 CO -0.00 -0.22 -0.08 0.54 0.04 0.00 0.00 177.00 177.28 3ij6 s VAL 162 N -2.22 0.60 0.23 -0.36 0.11 -1.26 -4.85 120.40 112.65 3ij6 s VAL 162 Ca 0.63 -0.62 -0.31 0.00 -2.93 0.00 0.00 61.98 58.75 3ij6 s VAL 162 Cb -0.11 -0.56 -0.13 0.00 -1.53 0.00 0.00 36.38 34.04 3ij6 s VAL 162 CO 0.19 -0.03 1.41 0.49 -3.33 0.00 0.00 175.10 173.83 3ij6 n PHE 163 N 2.34 2.15 -3.04 1.54 3.72 -1.26 -4.77 117.46 118.13 3ij6 n PHE 163 Ca -0.17 0.43 -0.43 0.00 -0.05 0.00 0.00 57.45 57.24 3ij6 n PHE 163 Cb 0.56 -2.46 -0.06 0.00 -0.94 0.00 0.00 39.48 36.58 3ij6 n PHE 163 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3ij6 s ASP 164 N 0.31 6.38 0.56 4.37 2.15 -1.26 -4.95 116.67 124.23 3ij6 s ASP 164 Ca 0.69 -0.17 0.34 0.00 0.43 0.00 0.00 52.55 53.84 3ij6 s ASP 164 Cb -0.66 -2.35 1.50 0.00 -0.30 0.00 0.00 42.92 41.12 3ij6 s ASP 164 CO 0.49 -0.82 2.04 0.00 -0.17 0.00 0.00 175.17 176.71 3ij6 h ALA 165 N 8.86 1.01 0.00 3.66 0.00 -2.00 -2.22 119.26 128.57 3ij6 h ALA 165 Ca -0.25 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 3ij6 h ALA 165 Cb 1.09 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 3ij6 h ALA 165 CO 0.92 0.02 -0.04 0.00 0.00 0.00 0.00 179.25 180.15 3ij6 h ARG 166 N 0.00 0.00 -5.28 0.00 3.08 -2.00 -3.42 114.38 106.75 3ij6 h ARG 166 Ca -0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 3ij6 h ARG 166 Cb 0.45 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.37 3ij6 h ARG 166 CO 0.00 0.04 -0.27 0.15 -1.07 0.00 0.00 179.97 178.83 3ij6 s LYS 167 N -3.95 4.11 0.75 0.04 1.02 -0.84 -5.08 119.74 115.78 3ij6 s LYS 167 Ca -0.02 0.06 -0.12 0.00 0.02 0.00 0.00 55.97 55.92 3ij6 s LYS 167 Cb 0.11 -3.57 0.04 0.00 -0.52 0.00 0.00 37.83 33.90 3ij6 s LYS 167 CO 0.52 -0.08 1.10 -2.14 -0.92 0.00 0.00 175.35 173.83 3ij6 s PRO 168 N 1.46 2.34 -1.05 -1.68 0.02 -1.26 -4.17 135.00 130.66 3ij6 s PRO 168 Ca 0.16 1.26 -0.01 0.00 0.02 0.00 0.00 61.00 62.42 3ij6 s PRO 168 Cb -0.15 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.47 3ij6 s PRO 168 CO 0.08 -1.59 0.15 -0.25 -0.33 0.00 0.00 177.00 175.06 3ij6 n ASP 169 N -3.24 -4.19 -4.73 2.53 8.00 -1.26 -5.00 116.55 108.67 3ij6 n ASP 169 Ca 0.10 -0.08 -0.42 0.00 0.71 0.00 0.00 54.79 55.10 3ij6 n ASP 169 Cb 0.53 -3.26 -0.03 0.00 -0.02 0.00 0.00 41.12 38.34 3ij6 n ASP 169 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3ij6 s ASN 170 N -2.58 6.43 0.23 -2.24 0.01 -1.26 -4.95 114.94 110.59 3ij6 s ASN 170 Ca 0.08 2.82 -0.02 0.00 -0.71 0.00 0.00 52.86 55.03 3ij6 s ASN 170 Cb -0.03 -2.61 -0.03 0.00 0.41 0.00 0.00 41.25 38.99 3ij6 s ASN 170 CO 0.09 -0.92 0.21 0.54 -1.51 0.00 0.00 177.10 175.52 3ij6 s ASN 171 N 1.01 0.31 0.00 -1.22 2.20 -1.26 -5.05 114.94 110.93 3ij6 s ASN 171 Ca 0.71 -1.36 0.29 0.00 -0.94 0.00 0.00 52.86 51.55 3ij6 s ASN 171 Cb -0.48 0.44 1.21 0.00 -2.00 0.00 0.00 41.25 40.43 3ij6 s ASN 171 CO 0.35 -0.93 1.87 0.18 -2.94 0.00 0.00 177.10 175.64 3ij6 n LEU 172 N -0.34 0.21 -0.04 3.54 4.77 -1.26 -3.25 117.00 120.64 3ij6 n LEU 172 Ca 0.02 0.22 -0.20 0.00 -0.03 0.00 0.00 56.01 56.03 3ij6 n LEU 172 Cb 0.65 -0.31 -0.13 0.00 -2.33 0.00 0.00 43.42 41.30 3ij6 n LEU 172 CO 0.31 0.04 -0.25 0.58 -1.33 0.00 0.00 177.39 176.75 3ij6 h VAL 173 N 0.18 1.19 0.00 4.08 2.07 -1.99 -3.45 116.25 118.33 3ij6 h VAL 173 Ca 0.00 -2.33 0.00 0.00 0.82 0.00 0.00 66.70 65.19 3ij6 h VAL 173 Cb 0.40 2.75 0.00 0.00 -1.52 0.00 0.00 31.29 32.92 3ij6 h VAL 173 CO 0.00 0.57 -0.68 0.49 0.02 0.00 0.00 177.57 177.98 3ij6 n PHE 174 N -4.23 0.00 0.01 1.57 3.72 -1.26 -4.84 117.46 112.43 3ij6 n PHE 174 Ca -0.23 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.13 3ij6 n PHE 174 Cb 0.74 0.00 0.18 0.00 -0.94 0.00 0.00 39.48 39.46 3ij6 n PHE 174 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3ij6 h SER 175 N 0.00 0.51 -0.04 4.37 0.02 -1.85 -2.62 113.55 113.94 3ij6 h SER 175 Ca 0.00 -0.18 -0.11 0.00 -0.84 0.00 0.00 61.79 60.66 3ij6 h SER 175 Cb 0.31 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 3ij6 h SER 175 CO 0.00 0.77 -0.33 -0.50 -1.14 0.00 0.00 176.83 175.63 3ij6 h TRP 176 N 0.44 0.59 -0.27 3.45 6.55 -1.89 -2.19 115.95 122.64 3ij6 h TRP 176 Ca 0.06 -0.15 -0.15 0.00 0.95 0.00 0.00 58.89 59.60 3ij6 h TRP 176 Cb 0.71 -0.14 -0.01 0.00 -0.86 0.00 0.00 29.16 28.86 3ij6 h TRP 176 CO 0.02 0.78 -0.45 0.93 -1.05 0.00 0.00 178.44 178.68 3ij6 h GLU 177 N 0.44 0.68 -0.81 0.49 4.39 -1.81 -1.96 114.58 116.01 3ij6 h GLU 177 Ca 0.05 -0.38 -0.05 0.00 0.34 0.00 0.00 59.36 59.33 3ij6 h GLU 177 Cb 0.78 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.42 3ij6 h GLU 177 CO 0.06 0.99 0.32 -0.92 -1.16 0.00 0.00 179.01 178.31 3ij6 h TYR 178 N 0.55 1.23 -0.42 4.33 3.20 -1.37 -2.53 116.97 121.95 3ij6 h TYR 178 Ca 0.04 -0.09 -0.10 0.00 3.14 0.00 0.00 58.73 61.72 3ij6 h TYR 178 Cb 0.99 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 38.88 3ij6 h TYR 178 CO 0.05 0.92 -0.13 0.93 -1.64 0.00 0.00 178.16 178.29 3ij6 h GLU 179 N 1.17 0.77 -0.72 1.82 4.39 -1.10 0.61 114.58 121.51 3ij6 h GLU 179 Ca 0.27 -0.26 -0.06 0.00 0.34 0.00 0.00 59.36 59.64 3ij6 h GLU 179 Cb 0.22 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.78 3ij6 h GLU 179 CO -0.02 0.86 0.21 -0.07 -1.16 0.00 0.00 179.01 178.84 3ij6 h LEU 180 N 0.69 1.06 -0.31 1.33 3.38 -1.26 -0.98 115.31 119.22 3ij6 h LEU 180 Ca 0.11 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 3ij6 h LEU 180 Cb 0.62 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3ij6 h LEU 180 CO 0.04 1.00 -0.15 0.28 0.09 0.00 0.00 178.44 179.69 3ij6 h SER 181 N 1.07 0.68 -0.03 -0.43 0.02 -1.11 -1.00 113.55 112.75 3ij6 h SER 181 Ca 0.23 -0.41 0.02 0.00 -0.84 0.00 0.00 61.79 60.80 3ij6 h SER 181 Cb 0.32 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.64 3ij6 h SER 181 CO -0.01 0.94 -0.12 1.56 -1.14 0.00 0.00 176.83 178.06 3ij6 h GLN 182 N 0.42 -0.19 -0.49 3.45 1.08 -0.80 -2.16 115.11 116.42 3ij6 h GLN 182 Ca 0.07 0.01 0.08 0.00 -1.45 0.00 0.00 58.65 57.36 3ij6 h GLN 182 Cb 0.68 0.04 -0.07 0.00 -0.05 0.00 0.00 27.48 28.09 3ij6 h GLN 182 CO 0.05 -0.13 0.09 0.00 -0.95 0.00 0.00 178.83 177.89 3ij6 h ALA 183 N 0.79 0.54 -0.29 3.87 0.00 -1.01 0.16 119.26 123.32 3ij6 h ALA 183 Ca 0.06 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3ij6 h ALA 183 Cb 0.27 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3ij6 h ALA 183 CO -0.15 -0.31 0.16 0.52 0.00 0.00 0.00 179.25 179.47 3ij6 h MET 184 N 0.23 0.41 -0.05 0.00 2.86 -1.10 -0.91 114.93 116.37 3ij6 h MET 184 Ca 0.24 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 3ij6 h MET 184 Cb 0.32 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.90 3ij6 h MET 184 CO -0.32 0.35 0.03 1.25 1.06 0.00 0.00 176.91 179.27 3ij6 h LEU 185 N 0.36 0.05 -1.22 1.22 5.85 -0.87 0.23 115.31 120.93 3ij6 h LEU 185 Ca 0.10 -0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.89 3ij6 h LEU 185 Cb 0.06 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.01 3ij6 h LEU 185 CO -0.02 0.05 0.56 1.56 -0.34 0.00 0.00 178.44 180.26 3ij6 h GLN 186 N 0.05 0.87 -0.06 1.25 4.20 -0.60 0.23 115.11 121.05 3ij6 h GLN 186 Ca 0.02 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 3ij6 h GLN 186 Cb 0.01 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 27.59 3ij6 h GLN 186 CO -0.00 0.57 -0.11 -0.07 -0.67 0.00 0.00 178.83 178.55 3ij6 h LEU 187 N 0.89 0.19 -0.44 1.46 3.38 -0.82 -2.63 115.31 117.35 3ij6 h LEU 187 Ca 0.39 -0.56 0.03 0.00 0.09 0.00 0.00 57.88 57.83 3ij6 h LEU 187 Cb 0.34 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 3ij6 h LEU 187 CO -0.16 0.72 0.24 0.58 0.09 0.00 0.00 178.44 179.91 3ij6 h VAL 188 N -0.33 1.00 0.00 1.22 2.07 -0.72 -2.37 116.25 117.12 3ij6 h VAL 188 Ca 0.00 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.36 3ij6 h VAL 188 Cb 0.69 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 3ij6 h VAL 188 CO 0.02 0.09 0.00 0.00 0.02 0.00 0.00 177.57 177.70 3ij6 n GLN 189 N -4.88 0.17 -0.64 1.57 1.13 0.05 -1.90 117.38 112.87 3ij6 n GLN 189 Ca 0.02 0.24 0.08 0.00 -1.94 0.00 0.00 57.00 55.40 3ij6 n GLN 189 Cb 0.09 -1.74 0.34 0.00 0.11 0.00 0.00 30.24 29.04 3ij6 n GLN 189 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 3ij6 n SER 190 N -2.03 4.65 -3.18 1.08 3.41 -0.99 -4.96 113.62 111.60 3ij6 n SER 190 Ca 0.05 -2.54 -0.20 0.00 -0.26 0.00 0.00 58.87 55.92 3ij6 n SER 190 Cb 0.32 -0.59 0.07 0.00 -0.26 0.00 0.00 64.21 63.76 3ij6 n SER 190 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3ij6 n ASP 191 N 0.88 -5.06 -0.02 4.04 8.00 -0.80 -4.95 116.55 118.64 3ij6 n ASP 191 Ca 0.24 -0.48 -0.12 0.00 0.71 0.00 0.00 54.79 55.13 3ij6 n ASP 191 Cb 0.91 -4.47 -0.08 0.00 -0.02 0.00 0.00 41.12 37.47 3ij6 n ASP 191 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3ij6 h LEU 192 N -2.22 0.14 -0.29 0.64 5.85 -1.60 -2.37 115.31 115.46 3ij6 h LEU 192 Ca -0.50 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 57.86 3ij6 h LEU 192 Cb 1.32 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.31 3ij6 h LEU 192 CO 0.48 0.47 -0.13 0.49 -0.34 0.00 0.00 178.44 179.40 3ij6 n PHE 193 N -4.81 0.00 0.05 1.25 3.72 -1.26 0.12 117.46 116.53 3ij6 n PHE 193 Ca -0.07 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.12 3ij6 n PHE 193 Cb 0.22 -0.17 -0.15 0.00 -0.94 0.00 0.00 39.48 38.45 3ij6 n PHE 193 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 3ij6 h GLN 194 N 0.70 0.32 -0.03 -1.08 1.08 -1.90 -2.77 115.11 111.42 3ij6 h GLN 194 Ca 0.00 -0.54 -0.24 0.00 -1.45 0.00 0.00 58.65 56.41 3ij6 h GLN 194 Cb 0.38 0.20 0.02 0.00 -0.05 0.00 0.00 27.48 28.03 3ij6 h GLN 194 CO 0.00 1.26 -0.93 -0.44 -0.95 0.00 0.00 178.83 177.77 3ij6 h ASP 195 N -0.31 0.88 -2.11 1.46 3.32 -1.42 -3.40 116.42 114.84 3ij6 h ASP 195 Ca -0.18 -0.72 -0.58 0.00 0.02 0.00 0.00 57.03 55.58 3ij6 h ASP 195 Cb 1.71 -0.27 -0.41 0.00 0.22 0.00 0.00 39.33 40.59 3ij6 h ASP 195 CO 0.15 1.47 -0.83 -1.22 -1.72 0.00 0.00 179.24 177.09 3ij6 n TYR 196 N -3.92 1.88 0.32 4.55 4.01 0.12 -4.96 117.16 119.15 3ij6 n TYR 196 Ca -0.10 -3.89 0.19 0.00 -0.16 0.00 0.00 57.90 53.94 3ij6 n TYR 196 Cb 0.83 -0.46 1.05 0.00 -0.31 0.00 0.00 39.34 40.44 3ij6 n TYR 196 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3ij6 h PRO 197 N 4.02 0.00 -0.07 -0.72 0.13 -1.69 -2.50 132.00 131.16 3ij6 h PRO 197 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3ij6 h PRO 197 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 3ij6 h PRO 197 CO 0.67 0.01 0.00 0.27 -0.23 0.00 0.00 178.00 178.72 3ij6 n ASN 198 N -3.36 1.80 -4.73 1.44 0.23 -1.26 -4.92 115.26 104.47 3ij6 n ASN 198 Ca -0.03 -1.63 -0.42 0.00 -0.53 0.00 0.00 54.58 51.97 3ij6 n ASN 198 Cb 0.11 -0.04 -0.03 0.00 -2.08 0.00 0.00 39.78 37.74 3ij6 n ASN 198 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 3ij6 s LEU 199 N -1.87 4.37 -0.27 -4.53 2.96 -0.94 -4.99 118.68 113.40 3ij6 s LEU 199 Ca 0.35 2.63 -0.06 0.00 -0.22 0.00 0.00 54.13 56.84 3ij6 s LEU 199 Cb 0.20 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 43.29 3ij6 s LEU 199 CO 0.31 -0.79 0.05 -0.54 -1.32 0.00 0.00 176.35 174.06 3ij6 s LYS 200 N 0.68 3.20 -0.12 1.98 1.02 -1.26 -4.94 119.74 120.29 3ij6 s LYS 200 Ca 0.67 -0.77 0.02 0.00 0.02 0.00 0.00 55.97 55.90 3ij6 s LYS 200 Cb -0.43 -3.29 0.01 0.00 -0.52 0.00 0.00 37.83 33.60 3ij6 s LYS 200 CO 0.35 -0.37 -0.17 0.42 -0.92 0.00 0.00 175.35 174.66 3ij6 s ILE 201 N 1.50 1.68 -0.22 2.17 1.01 -1.26 -0.92 121.20 125.16 3ij6 s ILE 201 Ca 0.03 -0.75 -0.18 0.00 0.00 0.00 0.00 60.65 59.76 3ij6 s ILE 201 Cb -0.16 -1.52 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 3ij6 s ILE 201 CO 0.01 0.48 0.52 -0.22 0.00 0.00 0.00 174.94 175.73 3ij6 s LEU 202 N 1.00 4.11 -0.23 2.97 2.96 0.17 -1.25 118.68 128.41 3ij6 s LEU 202 Ca -0.05 0.62 -0.09 0.00 -0.22 0.00 0.00 54.13 54.39 3ij6 s LEU 202 Cb -0.15 -2.69 -0.04 0.00 0.50 0.00 0.00 46.19 43.81 3ij6 s LEU 202 CO -0.03 -0.22 0.10 -0.69 -1.32 0.00 0.00 176.35 174.19 3ij6 s VAL 203 N 1.88 4.85 0.65 1.68 1.01 0.86 0.23 120.40 131.57 3ij6 s VAL 203 Ca 0.23 0.00 -0.18 0.00 0.00 0.00 0.00 61.98 62.03 3ij6 s VAL 203 Cb -0.15 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 3ij6 s VAL 203 CO 0.09 0.37 1.20 1.57 0.00 0.00 0.00 175.10 178.33 3ij6 n HIS 204 N 4.30 1.59 -3.45 5.22 -0.00 -1.08 -1.44 115.22 120.37 3ij6 n HIS 204 Ca -0.16 0.42 -0.21 0.00 0.46 0.00 0.00 57.72 58.24 3ij6 n HIS 204 Cb 0.52 -2.22 0.07 0.00 -0.12 0.00 0.00 29.99 28.24 3ij6 n HIS 204 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 3ij6 n HIS 205 N -2.00 -2.49 -2.19 1.57 8.25 -1.26 -3.76 115.22 113.34 3ij6 n HIS 205 Ca 0.15 0.89 -0.18 0.00 -0.26 0.00 0.00 57.72 58.32 3ij6 n HIS 205 Cb 0.48 -4.56 -0.02 0.00 1.12 0.00 0.00 29.99 27.01 3ij6 n HIS 205 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3ij6 n ALA 206 N -4.63 -0.48 -0.82 -1.41 0.00 -1.04 -1.32 120.51 110.82 3ij6 n ALA 206 Ca -0.01 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.60 3ij6 n ALA 206 Cb 0.56 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 18.08 3ij6 n ALA 206 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ij6 n GLY 207 N -0.97 0.56 7.00 0.00 0.00 -1.25 -4.76 105.19 105.77 3ij6 n GLY 207 Ca -0.21 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.56 3ij6 n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ij6 n ALA 208 N 0.46 0.00 1.14 4.61 0.00 -0.43 -1.70 120.51 124.59 3ij6 n ALA 208 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.57 3ij6 n ALA 208 Cb 0.00 0.00 0.65 0.00 0.00 0.00 0.00 19.45 20.10 3ij6 n ALA 208 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3ij6 n MET 209 N 14.00 0.21 0.22 0.00 2.81 -1.26 -4.38 117.12 128.71 3ij6 n MET 209 Ca 0.00 0.03 -0.15 0.00 -1.81 0.00 0.00 57.70 55.76 3ij6 n MET 209 Cb 0.00 -1.50 -0.08 0.00 -0.71 0.00 0.00 33.22 30.93 3ij6 n MET 209 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3ij6 h VAL 210 N 0.00 0.62 -0.37 2.03 2.07 -1.67 -1.76 116.25 117.16 3ij6 h VAL 210 Ca 0.00 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.39 3ij6 h VAL 210 Cb 0.36 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 3ij6 h VAL 210 CO 0.00 0.03 0.25 -0.65 0.02 0.00 0.00 177.57 177.22 3ij6 h PRO 211 N -0.61 0.42 0.04 1.57 0.11 -1.78 -0.21 132.00 131.54 3ij6 h PRO 211 Ca -0.05 -0.03 -0.26 0.00 0.11 0.00 0.00 66.00 65.77 3ij6 h PRO 211 Cb 0.45 -0.09 0.02 0.00 0.11 0.00 0.00 31.00 31.48 3ij6 h PRO 211 CO 0.09 0.28 -1.08 0.35 -0.21 0.00 0.00 178.00 177.43 3ij6 h PHE 212 N 0.43 0.84 -0.50 0.65 3.57 -1.82 -3.35 116.94 116.77 3ij6 h PHE 212 Ca 0.15 -0.49 -0.26 0.00 3.53 0.00 0.00 57.97 60.90 3ij6 h PHE 212 Cb 0.06 -0.08 -0.16 0.00 2.79 0.00 0.00 35.95 38.56 3ij6 h PHE 212 CO -0.00 1.32 0.05 1.19 -2.23 0.00 0.00 178.31 178.65 3ij6 n PHE 213 N -3.77 1.54 0.04 0.41 3.72 -0.67 -4.65 117.46 114.08 3ij6 n PHE 213 Ca -0.10 -1.71 0.02 0.00 -0.05 0.00 0.00 57.45 55.61 3ij6 n PHE 213 Cb 0.91 -0.60 0.36 0.00 -0.94 0.00 0.00 39.48 39.21 3ij6 n PHE 213 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3ij6 h SER 214 N 1.05 0.40 -0.80 4.37 4.64 -1.18 -2.41 113.55 119.62 3ij6 h SER 214 Ca 0.31 -0.06 0.08 0.00 -0.47 0.00 0.00 61.79 61.65 3ij6 h SER 214 Cb 1.87 -0.10 -0.06 0.00 -0.31 0.00 0.00 62.40 63.79 3ij6 h SER 214 CO 0.56 0.45 0.47 1.23 -0.87 0.00 0.00 176.83 178.67 3ij6 h GLY 215 N 0.72 1.22 1.00 -0.77 0.00 -1.87 0.92 103.07 104.29 3ij6 h GLY 215 Ca 0.10 -0.33 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 3ij6 h GLY 215 CO 0.00 0.18 0.32 3.21 0.00 0.00 0.00 176.54 180.26 3ij6 h ARG 216 N 0.83 0.92 0.08 4.80 3.08 -1.82 -2.47 114.38 119.79 3ij6 h ARG 216 Ca 0.37 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 60.28 3ij6 h ARG 216 Cb 0.26 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3ij6 h ARG 216 CO -0.21 0.73 -0.04 0.82 -1.07 0.00 0.00 179.97 180.20 3ij6 h ILE 217 N 0.89 0.97 0.00 2.04 2.04 -0.90 -2.22 117.51 120.33 3ij6 h ILE 217 Ca 0.22 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.89 3ij6 h ILE 217 Cb 0.10 1.08 -0.00 0.00 -0.74 0.00 0.00 36.82 37.26 3ij6 h ILE 217 CO -0.03 0.04 -0.10 0.44 0.00 0.00 0.00 178.15 178.50 3ij6 h ASP 218 N -0.18 0.00 0.16 1.72 3.32 -0.80 -1.31 116.42 119.33 3ij6 h ASP 218 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3ij6 h ASP 218 Cb 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 3ij6 h ASP 218 CO 0.02 0.10 -0.80 1.41 -1.72 0.00 0.00 179.24 178.25 3ij6 n HIS 219 N -4.02 0.00 -0.10 4.55 8.25 -0.94 -4.48 115.22 118.49 3ij6 n HIS 219 Ca -0.02 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.28 3ij6 n HIS 219 Cb 0.19 -0.08 -0.08 0.00 1.12 0.00 0.00 29.99 31.13 3ij6 n HIS 219 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 3ij6 n ILE 220 N -1.40 1.09 -3.61 1.59 5.41 -0.84 -5.02 119.36 116.57 3ij6 n ILE 220 Ca 0.05 -0.38 -0.31 0.00 1.00 0.00 0.00 62.75 63.11 3ij6 n ILE 220 Cb 0.34 -1.33 -0.04 0.00 -0.71 0.00 0.00 39.64 37.89 3ij6 n ILE 220 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3ij6 s LEU 221 N -6.37 4.23 1.17 1.39 1.02 -0.52 -5.09 118.68 114.50 3ij6 s LEU 221 Ca -0.26 0.61 -0.13 0.00 0.02 0.00 0.00 54.13 54.37 3ij6 s LEU 221 Cb 0.08 -3.35 0.29 0.00 0.02 0.00 0.00 46.19 43.22 3ij6 s LEU 221 CO 0.42 -0.00 1.03 1.51 0.02 0.00 0.00 176.35 179.32 3ij6 s ASP 222 N -2.61 0.96 0.16 2.29 1.47 -1.26 -4.61 116.67 113.08 3ij6 s ASP 222 Ca 0.42 1.49 -0.17 0.00 1.18 0.00 0.00 52.55 55.47 3ij6 s ASP 222 Cb -0.12 -2.28 0.08 0.00 -0.34 0.00 0.00 42.92 40.27 3ij6 s ASP 222 CO 0.25 -4.21 1.67 -0.08 0.68 0.00 0.00 175.17 173.49 3ij6 h GLU 223 N -2.63 0.01 -0.23 2.11 4.57 -1.98 -1.33 114.58 115.10 3ij6 h GLU 223 Ca -0.62 -0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 57.45 3ij6 h GLU 223 Cb 1.34 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.91 3ij6 h GLU 223 CO 0.51 0.00 -0.33 1.57 -1.18 0.00 0.00 179.01 179.58 3ij6 h LYS 224 N 0.01 0.49 0.14 1.92 2.10 -1.99 -2.13 116.57 117.10 3ij6 h LYS 224 Ca 0.18 -0.21 -0.31 0.00 -2.00 0.00 0.00 60.65 58.31 3ij6 h LYS 224 Cb 0.28 -0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 31.59 3ij6 h LYS 224 CO -0.38 0.76 -1.56 0.45 -2.00 0.00 0.00 179.45 176.72 3ij6 h HIS 225 N 0.42 0.52 -0.41 0.07 3.86 -1.87 -2.63 115.15 115.11 3ij6 h HIS 225 Ca 0.05 -0.38 0.04 0.00 -1.16 0.00 0.00 60.37 58.92 3ij6 h HIS 225 Cb 0.78 -0.02 -0.04 0.00 1.06 0.00 0.00 27.41 29.19 3ij6 h HIS 225 CO 0.03 1.43 0.19 0.00 0.86 0.00 0.00 177.93 180.44 3ij6 h ALA 226 N 0.42 0.50 0.00 2.45 0.00 -1.24 -2.80 119.26 118.59 3ij6 h ALA 226 Ca -0.26 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 3ij6 h ALA 226 Cb 2.04 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.79 3ij6 h ALA 226 CO 0.17 -0.18 -0.10 1.96 0.00 0.00 0.00 179.25 181.10 3ij6 h GLN 227 N 0.38 0.00 0.00 0.00 1.08 -1.45 -2.93 115.11 112.20 3ij6 h GLN 227 Ca 0.18 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.37 3ij6 h GLN 227 Cb 0.11 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.54 3ij6 h GLN 227 CO -0.14 0.10 -0.03 -0.44 -0.95 0.00 0.00 178.83 177.37 3ij6 h ASP 228 N 0.00 0.00 0.69 1.46 3.32 -1.18 -2.33 116.42 118.38 3ij6 h ASP 228 Ca -0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 3ij6 h ASP 228 Cb 0.75 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.30 3ij6 h ASP 228 CO 0.01 0.03 -0.02 -0.26 -1.72 0.00 0.00 179.24 177.29 3ij6 h PHE 229 N 0.00 0.00 -0.00 4.55 0.04 -1.57 -2.20 116.94 117.76 3ij6 h PHE 229 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3ij6 h PHE 229 Cb 0.09 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.24 3ij6 h PHE 229 CO 0.00 0.02 -0.05 1.63 -0.60 0.00 0.00 178.31 179.31 3ij6 n LYS 230 N -3.14 0.06 0.22 1.51 5.02 -0.88 -3.50 118.16 117.46 3ij6 n LYS 230 Ca -0.01 -0.01 0.14 0.00 -2.02 0.00 0.00 58.31 56.42 3ij6 n LYS 230 Cb 0.24 -1.50 0.38 0.00 -0.02 0.00 0.00 35.03 34.13 3ij6 n LYS 230 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 3ij6 h LYS 231 N 0.01 0.00 -7.10 1.97 1.79 -1.54 -3.46 116.57 108.25 3ij6 h LYS 231 Ca 0.00 0.00 -0.49 0.00 -2.18 0.00 0.00 60.65 57.98 3ij6 h LYS 231 Cb 0.47 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 31.19 3ij6 h LYS 231 CO 0.00 0.00 0.41 -0.06 -1.08 0.00 0.00 179.45 178.72 3ij6 s PHE 232 N -3.34 2.75 0.09 -1.35 0.08 -1.23 -4.72 117.98 110.26 3ij6 s PHE 232 Ca 0.06 1.55 0.02 0.00 0.12 0.00 0.00 56.93 58.67 3ij6 s PHE 232 Cb 0.07 -3.22 -0.04 0.00 -0.57 0.00 0.00 43.02 39.27 3ij6 s PHE 232 CO 0.60 -1.40 0.17 0.71 -0.10 0.00 0.00 175.22 175.20 3ij6 s TYR 233 N -1.91 3.38 0.14 0.36 2.02 -0.38 -4.96 117.35 116.00 3ij6 s TYR 233 Ca 0.71 0.16 0.07 0.00 -0.37 0.00 0.00 57.07 57.63 3ij6 s TYR 233 Cb -0.21 -1.68 -0.04 0.00 -0.40 0.00 0.00 41.96 39.62 3ij6 s TYR 233 CO 0.27 0.55 -0.16 0.14 -1.57 0.00 0.00 175.55 174.79 3ij6 s VAL 234 N -1.53 1.54 0.50 0.71 -7.23 0.14 -0.10 120.40 114.44 3ij6 s VAL 234 Ca 0.33 -1.80 0.02 0.00 -1.81 0.00 0.00 61.98 58.72 3ij6 s VAL 234 Cb -0.12 -1.66 0.10 0.00 0.56 0.00 0.00 36.38 35.25 3ij6 s VAL 234 CO 0.26 -0.37 0.69 -0.90 -0.31 0.00 0.00 175.10 174.47 3ij6 n ASP 235 N 0.44 1.12 -1.43 4.85 5.68 -0.52 -0.94 116.55 125.75 3ij6 n ASP 235 Ca -0.15 -1.90 -0.05 0.00 -0.50 0.00 0.00 54.79 52.19 3ij6 n ASP 235 Cb 0.57 -0.43 0.23 0.00 -1.14 0.00 0.00 41.12 40.35 3ij6 n ASP 235 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3ij6 n THR 236 N -2.32 2.67 -1.95 2.12 -2.24 -0.47 -2.50 114.28 109.59 3ij6 n THR 236 Ca 0.12 -2.21 -0.42 0.00 -2.27 0.00 0.00 64.05 59.27 3ij6 n THR 236 Cb 0.43 -0.34 -0.00 0.00 -2.10 0.00 0.00 70.33 68.32 3ij6 n THR 236 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ij6 n ALA 237 N -0.81 5.72 -1.98 6.98 0.00 -1.15 -4.37 120.51 124.91 3ij6 n ALA 237 Ca 0.36 -4.04 0.05 0.00 0.00 0.00 0.00 53.44 49.81 3ij6 n ALA 237 Cb 1.18 -3.26 0.09 0.00 0.00 0.00 0.00 19.45 17.46 3ij6 n ALA 237 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3ij6 n ILE 238 N 4.06 0.94 -3.49 0.00 -5.35 -1.26 -4.10 119.36 110.16 3ij6 n ILE 238 Ca 0.50 -1.76 -0.21 0.00 -0.27 0.00 0.00 62.75 61.01 3ij6 n ILE 238 Cb 0.36 0.38 0.08 0.00 -1.74 0.00 0.00 39.64 38.72 3ij6 n ILE 238 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3ij6 n LEU 239 N -0.32 -3.51 0.00 7.28 4.77 -1.26 -4.58 117.00 119.38 3ij6 n LEU 239 Ca 0.11 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.55 3ij6 n LEU 239 Cb 0.88 -2.93 0.00 0.00 -2.33 0.00 0.00 43.42 39.04 3ij6 n LEU 239 CO -0.03 0.55 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 3ij6 n GLY 240 N -1.71 0.57 2.92 -0.72 0.00 -1.26 -4.89 105.19 100.10 3ij6 n GLY 240 Ca -0.07 -1.54 -0.02 0.00 0.00 0.00 0.00 46.02 44.39 3ij6 n GLY 240 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3ij6 n ASN 241 N 0.00 -7.53 -0.01 1.61 2.85 -1.26 -4.74 115.26 106.17 3ij6 n ASN 241 Ca 0.00 0.10 -0.10 0.00 -0.11 0.00 0.00 54.58 54.47 3ij6 n ASN 241 Cb 0.00 -5.11 -0.03 0.00 1.24 0.00 0.00 39.78 35.88 3ij6 n ASN 241 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 3ij6 h THR 242 N 0.84 0.35 0.00 -0.44 2.02 -1.97 -1.77 112.91 111.95 3ij6 h THR 242 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 3ij6 h THR 242 Cb 0.98 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 67.74 3ij6 h THR 242 CO 0.26 0.00 -0.10 1.55 0.37 0.00 0.00 175.52 177.60 3ij6 h PRO 243 N -0.34 0.00 -0.16 6.66 0.13 -1.93 -0.02 132.00 136.34 3ij6 h PRO 243 Ca 0.11 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.12 3ij6 h PRO 243 Cb 0.50 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.63 3ij6 h PRO 243 CO -0.35 0.10 -0.35 0.00 -0.23 0.00 0.00 178.00 177.17 3ij6 h ALA 244 N 1.90 0.26 -0.93 -0.56 0.00 -1.85 -1.18 119.26 116.91 3ij6 h ALA 244 Ca -0.00 -0.43 0.11 0.00 0.00 0.00 0.00 54.91 54.58 3ij6 h ALA 244 Cb 0.39 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 3ij6 h ALA 244 CO 0.01 0.33 0.59 -0.07 0.00 0.00 0.00 179.25 180.12 3ij6 h LEU 245 N 0.17 0.82 -0.49 0.00 3.38 -0.83 -1.28 115.31 117.08 3ij6 h LEU 245 Ca 0.00 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3ij6 h LEU 245 Cb 0.95 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 3ij6 h LEU 245 CO 0.08 0.46 0.19 -0.61 0.09 0.00 0.00 178.44 178.65 3ij6 h GLN 246 N 0.90 0.74 -0.87 1.13 5.75 -0.84 -1.76 115.11 120.15 3ij6 h GLN 246 Ca 0.44 -0.14 0.06 0.00 -0.15 0.00 0.00 58.65 58.87 3ij6 h GLN 246 Cb 0.47 -0.12 -0.06 0.00 1.07 0.00 0.00 27.48 28.84 3ij6 h GLN 246 CO -0.20 0.66 0.54 1.25 -2.65 0.00 0.00 178.83 178.43 3ij6 h LEU 247 N 0.65 0.86 -0.71 -2.39 5.85 -0.60 0.06 115.31 119.03 3ij6 h LEU 247 Ca 0.16 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.80 3ij6 h LEU 247 Cb 0.21 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 3ij6 h LEU 247 CO -0.01 0.55 -0.13 0.00 -0.34 0.00 0.00 178.44 178.50 3ij6 h ALA 248 N 1.41 0.90 -0.50 1.25 0.00 -1.03 -2.04 119.26 119.25 3ij6 h ALA 248 Ca 0.38 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3ij6 h ALA 248 Cb 0.17 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3ij6 h ALA 248 CO -0.17 0.63 -0.04 0.82 0.00 0.00 0.00 179.25 180.49 3ij6 h ILE 249 N 0.77 1.27 -0.99 0.00 2.04 -0.60 -0.10 117.51 119.89 3ij6 h ILE 249 Ca 0.12 -1.14 0.05 0.00 1.00 0.00 0.00 64.86 64.89 3ij6 h ILE 249 Cb 0.64 0.99 -0.06 0.00 -0.74 0.00 0.00 36.82 37.66 3ij6 h ILE 249 CO 0.04 0.40 0.64 0.44 0.00 0.00 0.00 178.15 179.68 3ij6 h ASP 250 N 0.77 1.05 0.00 1.72 3.32 -0.86 0.22 116.42 122.63 3ij6 h ASP 250 Ca 0.14 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 3ij6 h ASP 250 Cb 0.57 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.89 3ij6 h ASP 250 CO 0.03 0.69 -0.05 0.22 -1.72 0.00 0.00 179.24 178.42 3ij6 h TYR 251 N 1.20 0.00 0.00 4.55 3.20 -1.18 -3.38 116.97 121.35 3ij6 h TYR 251 Ca 0.41 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.28 3ij6 h TYR 251 Cb 0.09 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.36 3ij6 h TYR 251 CO -0.00 0.88 -0.76 1.88 -1.64 0.00 0.00 178.16 178.52 3ij6 h TYR 252 N -1.00 0.00 0.00 -3.82 0.05 -1.06 -3.48 116.97 107.66 3ij6 h TYR 252 Ca -0.01 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.77 3ij6 h TYR 252 Cb 0.87 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.61 3ij6 h TYR 252 CO 0.23 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.75 3ij6 n GLY 253 N 1.17 -2.02 0.25 3.88 0.00 0.76 -4.51 105.19 104.71 3ij6 n GLY 253 Ca 0.01 -1.41 0.06 0.00 0.00 0.00 0.00 46.02 44.68 3ij6 n GLY 253 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3ij6 h ILE 254 N 0.00 1.06 0.00 -0.61 6.09 -1.93 -2.43 117.51 119.70 3ij6 h ILE 254 Ca 0.00 -0.27 0.00 0.00 -1.37 0.00 0.00 64.86 63.22 3ij6 h ILE 254 Cb 0.00 1.08 0.00 0.00 0.47 0.00 0.00 36.82 38.37 3ij6 h ILE 254 CO 0.00 0.08 0.00 0.47 -3.07 0.00 0.00 178.15 175.63 3ij6 n ASP 255 N -4.45 0.09 -0.37 2.19 8.00 -1.26 -3.16 116.55 117.59 3ij6 n ASP 255 Ca -0.02 0.52 0.04 0.00 0.71 0.00 0.00 54.79 56.04 3ij6 n ASP 255 Cb 0.15 -0.54 0.05 0.00 -0.02 0.00 0.00 41.12 40.76 3ij6 n ASP 255 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3ij6 n HIS 256 N -1.61 0.09 -3.92 1.24 8.25 -0.91 -4.87 115.22 113.49 3ij6 n HIS 256 Ca 0.03 -0.13 -0.35 0.00 -0.26 0.00 0.00 57.72 57.02 3ij6 n HIS 256 Cb 0.17 -0.01 -0.14 0.00 1.12 0.00 0.00 29.99 31.14 3ij6 n HIS 256 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3ij6 s VAL 257 N -0.77 3.15 -0.06 1.59 1.01 -1.19 0.25 120.40 124.39 3ij6 s VAL 257 Ca 0.12 -0.76 0.06 0.00 0.00 0.00 0.00 61.98 61.39 3ij6 s VAL 257 Cb 0.07 -2.52 -0.01 0.00 0.00 0.00 0.00 36.38 33.92 3ij6 s VAL 257 CO 0.11 0.30 -0.24 -0.76 0.00 0.00 0.00 175.10 174.50 3ij6 s LEU 258 N 1.41 2.06 0.15 3.92 1.02 -0.12 -4.19 118.68 122.92 3ij6 s LEU 258 Ca 0.03 -0.51 -0.34 0.00 0.02 0.00 0.00 54.13 53.33 3ij6 s LEU 258 Cb -0.15 -1.35 -0.15 0.00 0.02 0.00 0.00 46.19 44.55 3ij6 s LEU 258 CO -0.04 0.23 1.49 0.33 0.02 0.00 0.00 176.35 178.38 3ij6 n PHE 259 N 3.04 2.03 -3.55 0.29 7.35 -0.01 -1.37 117.46 125.23 3ij6 n PHE 259 Ca -0.18 0.40 -0.17 0.00 -0.76 0.00 0.00 57.45 56.74 3ij6 n PHE 259 Cb 0.52 -2.47 -0.06 0.00 0.35 0.00 0.00 39.48 37.82 3ij6 n PHE 259 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 3ij6 s GLY 260 N 0.72 -0.56 -0.03 7.13 0.00 -1.26 -1.80 107.32 111.52 3ij6 s GLY 260 Ca 0.80 1.48 0.03 0.00 0.00 0.00 0.00 44.72 47.03 3ij6 s GLY 260 CO 0.42 1.15 0.02 -1.30 0.00 0.00 0.00 173.10 173.39 3ij6 n THR 261 N 1.38 0.19 -1.89 0.90 -2.24 -1.21 -2.92 114.28 108.48 3ij6 n THR 261 Ca -0.18 -0.13 -0.09 0.00 -2.27 0.00 0.00 64.05 61.38 3ij6 n THR 261 Cb 0.56 -0.69 -0.01 0.00 -2.10 0.00 0.00 70.33 68.09 3ij6 n THR 261 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3ij6 n ASP 262 N -2.04 -3.33 -4.76 3.42 2.03 0.52 -4.58 116.55 107.80 3ij6 n ASP 262 Ca -0.05 0.06 -0.39 0.00 0.52 0.00 0.00 54.79 54.93 3ij6 n ASP 262 Cb 0.52 -2.32 0.01 0.00 -0.72 0.00 0.00 41.12 38.61 3ij6 n ASP 262 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3ij6 s ALA 263 N -2.40 3.09 -0.40 -1.67 0.00 -1.24 -1.43 121.76 117.71 3ij6 s ALA 263 Ca 0.00 1.22 0.10 0.00 0.00 0.00 0.00 51.96 53.29 3ij6 s ALA 263 Cb 0.00 -3.50 0.64 0.00 0.00 0.00 0.00 23.12 20.27 3ij6 s ALA 263 CO 0.00 -0.97 1.52 -0.35 0.00 0.00 0.00 175.76 175.95 3ij6 n PRO 264 N -0.33 3.91 -1.30 0.00 -0.04 -1.26 0.35 135.00 136.32 3ij6 n PRO 264 Ca 0.06 -2.50 -0.31 0.00 -0.04 0.00 0.00 63.50 60.72 3ij6 n PRO 264 Cb 0.45 -2.10 0.09 0.00 -0.04 0.00 0.00 33.50 31.90 3ij6 n PRO 264 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3ij6 s PHE 265 N -2.43 2.64 0.00 0.54 0.08 -0.52 -3.33 117.98 114.97 3ij6 s PHE 265 Ca 0.44 1.52 0.00 0.00 0.12 0.00 0.00 56.93 59.00 3ij6 s PHE 265 Cb 0.34 -3.03 0.00 0.00 -0.57 0.00 0.00 43.02 39.76 3ij6 s PHE 265 CO 0.12 -1.75 0.00 0.00 -0.10 0.00 0.00 175.22 173.49 3ij6 n ALA 266 N -3.49 0.00 -3.81 5.36 0.00 -1.26 -4.32 120.51 112.99 3ij6 n ALA 266 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.19 3ij6 n ALA 266 Cb 0.53 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.83 3ij6 n ALA 266 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3ij6 s VAL 267 N 0.00 2.69 0.32 0.00 1.01 -1.26 -5.04 120.40 118.12 3ij6 s VAL 267 Ca 0.00 -0.97 -0.21 0.00 0.00 0.00 0.00 61.98 60.80 3ij6 s VAL 267 Cb 0.00 -2.31 -0.10 0.00 0.00 0.00 0.00 36.38 33.98 3ij6 s VAL 267 CO 0.00 0.30 0.85 -0.04 0.00 0.00 0.00 175.10 176.21 3ij6 s MET 268 N 1.32 4.32 0.12 2.72 1.00 -1.26 -0.89 119.30 126.62 3ij6 s MET 268 Ca 0.02 1.05 0.24 0.00 0.00 0.00 0.00 55.69 56.99 3ij6 s MET 268 Cb -0.16 -2.62 0.22 0.00 0.00 0.00 0.00 34.83 32.27 3ij6 s MET 268 CO -0.06 0.22 1.20 -1.00 0.00 0.00 0.00 175.02 175.38 3ij6 h PRO 269 N 2.80 0.00 0.00 2.03 0.13 -1.94 -3.45 132.00 131.58 3ij6 h PRO 269 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3ij6 h PRO 269 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3ij6 h PRO 269 CO 0.64 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.84 3ij6 n SER 270 N -2.18 0.87 0.00 1.44 7.64 -1.19 -4.57 113.62 115.62 3ij6 n SER 270 Ca 0.02 -1.43 0.00 0.00 1.01 0.00 0.00 58.87 58.48 3ij6 n SER 270 Cb 0.46 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.66 3ij6 n SER 270 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ij6 n GLY 271 N -0.21 1.28 1.77 0.23 0.00 -0.07 -4.47 105.19 103.72 3ij6 n GLY 271 Ca 0.00 -2.13 -0.10 0.00 0.00 0.00 0.00 46.02 43.79 3ij6 n GLY 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ij6 n ALA 272 N 0.50 4.36 -0.28 4.61 0.00 -1.26 -4.62 120.51 123.82 3ij6 n ALA 272 Ca 0.00 -1.88 0.03 0.00 0.00 0.00 0.00 53.44 51.60 3ij6 n ALA 272 Cb 0.00 -1.25 0.11 0.00 0.00 0.00 0.00 19.45 18.31 3ij6 n ALA 272 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 3ij6 h ASP 273 N 1.43 -0.70 -0.26 0.00 1.82 -1.90 -2.16 116.42 114.66 3ij6 h ASP 273 Ca 0.31 0.24 -0.12 0.00 -0.39 0.00 0.00 57.03 57.07 3ij6 h ASP 273 Cb 2.11 0.49 -0.00 0.00 0.68 0.00 0.00 39.33 42.61 3ij6 h ASP 273 CO 0.66 -0.26 -0.32 -0.61 -1.61 0.00 0.00 179.24 177.10 3ij6 h GLN 274 N 0.01 0.67 -0.03 0.28 4.15 -1.92 0.12 115.11 118.39 3ij6 h GLN 274 Ca 0.40 -0.38 -0.14 0.00 0.77 0.00 0.00 58.65 59.30 3ij6 h GLN 274 Cb 0.63 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.34 3ij6 h GLN 274 CO -0.82 0.99 -0.61 -0.84 -1.93 0.00 0.00 178.83 175.62 3ij6 h ILE 275 N 0.39 1.42 0.02 2.39 3.07 -1.88 -1.90 117.51 121.01 3ij6 h ILE 275 Ca 0.03 -2.05 -0.23 0.00 1.55 0.00 0.00 64.86 64.16 3ij6 h ILE 275 Cb 0.90 2.08 0.02 0.00 -0.27 0.00 0.00 36.82 39.55 3ij6 h ILE 275 CO 0.08 0.59 -0.91 0.40 -1.05 0.00 0.00 178.15 177.26 3ij6 h ILE 276 N 0.08 1.34 -0.37 0.16 2.04 -1.35 -1.63 117.51 117.78 3ij6 h ILE 276 Ca -0.01 -2.22 0.00 0.00 1.00 0.00 0.00 64.86 63.63 3ij6 h ILE 276 Cb 1.10 2.52 -0.02 0.00 -0.74 0.00 0.00 36.82 39.68 3ij6 h ILE 276 CO 0.09 0.67 0.23 0.74 0.00 0.00 0.00 178.15 179.88 3ij6 h THR 277 N 0.19 1.11 -0.26 -0.27 2.02 -0.76 -2.03 112.91 112.92 3ij6 h THR 277 Ca -0.12 -0.24 0.03 0.00 0.77 0.00 0.00 66.41 66.85 3ij6 h THR 277 Cb 1.59 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 68.58 3ij6 h THR 277 CO 0.18 0.11 0.09 -0.61 0.37 0.00 0.00 175.52 175.66 3ij6 h GLN 278 N 0.49 0.20 -0.77 6.66 5.75 -1.39 -0.38 115.11 125.67 3ij6 h GLN 278 Ca 0.13 -0.01 0.12 0.00 -0.15 0.00 0.00 58.65 58.75 3ij6 h GLN 278 Cb -0.02 -0.04 -0.09 0.00 1.07 0.00 0.00 27.48 28.40 3ij6 h GLN 278 CO -0.03 0.13 0.36 0.00 -2.65 0.00 0.00 178.83 176.65 3ij6 h ALA 279 N 1.16 1.10 -0.27 3.38 0.00 -1.02 0.07 119.26 123.68 3ij6 h ALA 279 Ca 0.11 0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.95 3ij6 h ALA 279 Cb 0.08 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 3ij6 h ALA 279 CO -0.12 -0.11 -0.45 0.82 0.00 0.00 0.00 179.25 179.39 3ij6 h ILE 280 N 0.56 1.29 0.00 0.00 2.04 -1.09 -3.08 117.51 117.24 3ij6 h ILE 280 Ca 0.40 -1.64 -0.05 0.00 1.00 0.00 0.00 64.86 64.57 3ij6 h ILE 280 Cb 0.53 1.67 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 3ij6 h ILE 280 CO -0.34 0.53 -0.22 0.78 0.00 0.00 0.00 178.15 178.90 3ij6 h ASN 281 N 0.54 0.00 0.30 1.72 2.35 -0.56 -2.16 115.58 117.77 3ij6 h ASN 281 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3ij6 h ASN 281 Cb 1.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.42 3ij6 h ASN 281 CO 0.10 0.22 0.00 0.47 -1.65 0.00 0.00 177.43 176.58 3ij6 n ASP 282 N -4.23 0.00 -4.77 5.81 8.00 -0.03 -4.85 116.55 116.48 3ij6 n ASP 282 Ca -0.02 -0.54 -0.38 0.00 0.71 0.00 0.00 54.79 54.56 3ij6 n ASP 282 Cb 0.28 -0.15 -0.01 0.00 -0.02 0.00 0.00 41.12 41.22 3ij6 n ASP 282 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ij6 s LEU 283 N -2.30 4.11 -1.11 0.64 1.43 -0.81 -4.92 118.68 115.72 3ij6 s LEU 283 Ca 0.37 2.34 -0.05 0.00 -1.03 0.00 0.00 54.13 55.77 3ij6 s LEU 283 Cb 0.21 -4.12 0.14 0.00 0.03 0.00 0.00 46.19 42.45 3ij6 s LEU 283 CO 0.41 -0.80 2.39 0.35 0.23 0.00 0.00 176.35 178.94 3ij6 n THR 284 N -0.19 4.94 -4.49 5.49 -2.24 -1.26 -4.89 114.28 111.63 3ij6 n THR 284 Ca 0.06 -4.25 -0.23 0.00 -2.27 0.00 0.00 64.05 57.35 3ij6 n THR 284 Cb 0.47 -1.90 -0.11 0.00 -2.10 0.00 0.00 70.33 66.69 3ij6 n THR 284 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 3ij6 s ILE 285 N -1.81 1.44 0.86 2.28 -4.36 -1.26 -5.15 121.20 113.20 3ij6 s ILE 285 Ca 0.53 -2.01 -0.12 0.00 -0.26 0.00 0.00 60.65 58.80 3ij6 s ILE 285 Cb 0.23 -2.83 0.11 0.00 1.25 0.00 0.00 42.46 41.22 3ij6 s ILE 285 CO -0.13 -0.02 1.10 -0.94 0.24 0.00 0.00 174.94 175.18 3ij6 s SER 286 N -3.54 3.81 0.35 4.36 1.04 -1.26 -4.87 113.70 113.59 3ij6 s SER 286 Ca 0.36 1.40 0.10 0.00 0.48 0.00 0.00 55.95 58.28 3ij6 s SER 286 Cb 0.09 -2.09 0.65 0.00 0.10 0.00 0.00 66.02 64.77 3ij6 s SER 286 CO 0.16 -2.41 1.81 0.44 0.98 0.00 0.00 173.24 174.22 3ij6 h ASP 287 N -1.39 0.16 -0.48 7.02 3.32 -1.99 -1.83 116.42 121.23 3ij6 h ASP 287 Ca -0.49 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 56.49 3ij6 h ASP 287 Cb 1.28 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 3ij6 h ASP 287 CO 0.57 0.46 0.19 0.50 -1.72 0.00 0.00 179.24 179.24 3ij6 h LYS 288 N 0.14 0.71 -0.63 3.56 3.64 -1.98 0.58 116.57 122.59 3ij6 h LYS 288 Ca 0.02 -0.13 -0.06 0.00 -1.27 0.00 0.00 60.65 59.21 3ij6 h LYS 288 Cb 0.62 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 3ij6 h LYS 288 CO 0.04 0.64 0.16 -0.44 -2.27 0.00 0.00 179.45 177.59 3ij6 h ASP 289 N 0.63 0.95 -0.67 4.20 3.32 -1.86 0.67 116.42 123.67 3ij6 h ASP 289 Ca 0.16 -0.23 -0.08 0.00 0.02 0.00 0.00 57.03 56.90 3ij6 h ASP 289 Cb 0.19 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 3ij6 h ASP 289 CO -0.01 0.93 0.13 0.11 -1.72 0.00 0.00 179.24 178.68 3ij6 h LYS 290 N 0.93 1.10 -0.69 3.56 1.57 -1.23 -2.19 116.57 119.62 3ij6 h LYS 290 Ca 0.20 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 3ij6 h LYS 290 Cb 0.35 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 3ij6 h LYS 290 CO 0.00 1.00 0.40 0.37 -0.57 0.00 0.00 179.45 180.65 3ij6 h GLN 291 N 1.03 0.94 -0.28 3.15 4.15 -0.49 0.50 115.11 124.11 3ij6 h GLN 291 Ca 0.21 -0.09 0.04 0.00 0.77 0.00 0.00 58.65 59.57 3ij6 h GLN 291 Cb 0.42 -0.19 -0.04 0.00 0.21 0.00 0.00 27.48 27.88 3ij6 h GLN 291 CO 0.01 0.68 0.05 0.87 -1.93 0.00 0.00 178.83 178.51 3ij6 h LYS 292 N 0.94 0.15 0.47 1.69 1.57 -0.69 -0.10 116.57 120.60 3ij6 h LYS 292 Ca 0.25 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.99 3ij6 h LYS 292 Cb -0.01 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.28 3ij6 h LYS 292 CO -0.04 0.10 -0.23 0.82 -0.57 0.00 0.00 179.45 179.53 3ij6 h ILE 293 N 0.15 0.52 0.00 1.86 2.04 -1.10 0.66 117.51 121.64 3ij6 h ILE 293 Ca 0.13 -0.21 -0.04 0.00 1.00 0.00 0.00 64.86 65.74 3ij6 h ILE 293 Cb 0.14 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 3ij6 h ILE 293 CO -0.17 0.04 -0.17 -0.26 0.00 0.00 0.00 178.15 177.58 3ij6 h PHE 294 N -0.76 0.00 0.00 1.37 0.04 -0.88 0.01 116.94 116.72 3ij6 h PHE 294 Ca -0.06 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.71 3ij6 h PHE 294 Cb 0.55 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.70 3ij6 h PHE 294 CO -0.02 0.17 0.00 1.58 -0.60 0.00 0.00 178.31 179.45 3ij6 n HIS 295 N -4.11 -2.76 0.04 -0.55 -0.00 -0.11 0.05 115.22 107.79 3ij6 n HIS 295 Ca -0.02 0.58 -0.07 0.00 0.46 0.00 0.00 57.72 58.67 3ij6 n HIS 295 Cb 0.25 1.03 0.10 0.00 -0.12 0.00 0.00 29.99 31.24 3ij6 n HIS 295 CO 0.00 0.00 0.00 -0.44 0.46 0.00 0.00 176.34 176.36 3ij6 h ASP 296 N 0.00 0.46 -0.28 0.26 3.32 -1.04 -3.15 116.42 116.00 3ij6 h ASP 296 Ca 0.00 -0.24 -0.05 0.00 0.02 0.00 0.00 57.03 56.75 3ij6 h ASP 296 Cb 0.00 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 3ij6 h ASP 296 CO 0.00 0.92 0.01 0.78 -1.72 0.00 0.00 179.24 179.23 3ij6 h ASN 297 N 0.32 0.57 -0.09 6.45 2.35 -1.14 -1.69 115.58 122.35 3ij6 h ASN 297 Ca 0.01 -0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 3ij6 h ASN 297 Cb 1.06 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.28 3ij6 h ASN 297 CO 0.10 0.63 0.05 0.22 -1.65 0.00 0.00 177.43 176.77 3ij6 h TYR 298 N 0.57 0.09 -0.05 1.19 3.20 -1.77 0.75 116.97 120.95 3ij6 h TYR 298 Ca 0.12 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.89 3ij6 h TYR 298 Cb 0.35 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 3ij6 h TYR 298 CO 0.01 0.05 -0.43 1.88 -1.64 0.00 0.00 178.16 178.03 3ij6 h TYR 299 N 0.10 0.13 -0.37 -3.82 0.05 -1.56 -1.20 116.97 110.30 3ij6 h TYR 299 Ca 0.03 -0.04 -0.13 0.00 0.05 0.00 0.00 58.73 58.64 3ij6 h TYR 299 Cb -0.00 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 37.70 3ij6 h TYR 299 CO -0.08 0.53 -0.31 0.77 -1.05 0.00 0.00 178.16 178.02 3ij6 h SER 300 N 0.09 0.84 -0.67 3.88 0.02 -1.15 -2.78 113.55 113.78 3ij6 h SER 300 Ca 0.01 -0.34 -0.00 0.00 -0.84 0.00 0.00 61.79 60.61 3ij6 h SER 300 Cb 0.81 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.08 3ij6 h SER 300 CO 0.06 1.08 0.40 0.25 -1.14 0.00 0.00 176.83 177.49 3ij6 h LEU 301 N 0.68 0.80 0.00 5.07 5.85 -0.26 -3.19 115.31 124.27 3ij6 h LEU 301 Ca 0.08 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3ij6 h LEU 301 Cb 0.85 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.68 3ij6 h LEU 301 CO 0.07 0.62 -0.35 2.30 -0.34 0.00 0.00 178.44 180.75 3ij6 n ILE 302 N -4.57 0.24 -1.61 4.05 -5.35 -0.51 -4.67 119.36 106.94 3ij6 n ILE 302 Ca 0.05 -0.15 -0.61 0.00 -0.27 0.00 0.00 62.75 61.77 3ij6 n ILE 302 Cb 0.05 -0.19 -0.08 0.00 -1.74 0.00 0.00 39.64 37.68 3ij6 n ILE 302 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 3ij6 n LYS 303 N -1.86 0.20 0.00 6.28 5.02 -1.05 -4.94 118.16 121.81 3ij6 n LYS 303 Ca 0.05 0.07 0.14 0.00 -2.02 0.00 0.00 58.31 56.55 3ij6 n LYS 303 Cb 0.39 -1.60 0.45 0.00 -0.02 0.00 0.00 35.03 34.25 3ij6 n LYS 303 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27