#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 0.04 -0.18 1.47 -1.32 -1.26 -5.14 115.64 109.25 3ij6 s THR 3 Ca 0.00 -0.37 -0.26 0.00 -1.21 0.00 0.00 61.69 59.85 3ij6 s THR 3 Cb 0.00 -0.54 -0.01 0.00 -1.51 0.00 0.00 72.50 70.44 3ij6 s THR 3 CO 0.00 -0.20 0.88 -0.54 -2.21 0.00 0.00 174.62 172.55 3ij6 s LYS 4 N -0.92 4.29 -0.44 7.08 1.02 0.10 -4.45 119.74 126.43 3ij6 s LYS 4 Ca -0.10 1.10 -0.12 0.00 0.02 0.00 0.00 55.97 56.86 3ij6 s LYS 4 Cb -0.05 -3.59 0.07 0.00 -0.52 0.00 0.00 37.83 33.74 3ij6 s LYS 4 CO 0.03 -0.40 0.31 0.42 -0.92 0.00 0.00 175.35 174.79 3ij6 s ILE 5 N 2.40 4.77 -0.75 2.17 -1.09 0.51 -0.74 121.20 128.47 3ij6 s ILE 5 Ca 0.40 -1.14 -0.26 0.00 -2.23 0.00 0.00 60.65 57.42 3ij6 s ILE 5 Cb -0.16 -3.84 -0.01 0.00 -1.58 0.00 0.00 42.46 36.87 3ij6 s ILE 5 CO 0.11 -0.49 1.70 -0.62 -1.23 0.00 0.00 174.94 174.41 3ij6 s ASP 6 N 2.23 5.58 0.09 3.58 -1.08 0.41 -4.52 116.67 122.96 3ij6 s ASP 6 Ca 0.03 -0.26 0.22 0.00 -0.52 0.00 0.00 52.55 52.02 3ij6 s ASP 6 Cb -0.23 -2.55 0.88 0.00 -1.46 0.00 0.00 42.92 39.57 3ij6 s ASP 6 CO 0.05 -2.24 1.68 0.00 0.52 0.00 0.00 175.17 175.18 3ij6 n ALA 7 N 11.83 1.92 -3.41 3.66 0.00 -0.40 0.29 120.51 134.39 3ij6 n ALA 7 Ca 0.22 -0.03 -0.27 0.00 0.00 0.00 0.00 53.44 53.37 3ij6 n ALA 7 Cb 0.50 -1.36 -0.11 0.00 0.00 0.00 0.00 19.45 18.48 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 -3.09 0.68 0.23 0.00 6.04 -1.26 -4.67 117.35 115.27 3ij6 s TYR 8 Ca 0.09 -1.76 0.10 0.00 0.04 0.00 0.00 57.07 55.54 3ij6 s TYR 8 Cb 0.12 -0.83 -0.05 0.00 -1.04 0.00 0.00 41.96 40.17 3ij6 s TYR 8 CO 0.41 -0.85 -0.19 0.00 -1.54 0.00 0.00 175.55 173.37 3ij6 s ALA 9 N 0.75 2.41 0.17 3.97 0.00 -0.81 -1.38 121.76 126.87 3ij6 s ALA 9 Ca 0.23 -1.72 0.11 0.00 0.00 0.00 0.00 51.96 50.59 3ij6 s ALA 9 Cb -0.12 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.74 3ij6 s ALA 9 CO -0.07 0.25 -0.24 -1.01 0.00 0.00 0.00 175.76 174.69 3ij6 s HIS 10 N -2.38 2.24 0.02 0.00 0.09 0.16 -1.72 115.29 113.69 3ij6 s HIS 10 Ca 0.24 -0.38 -0.09 0.00 -0.00 0.00 0.00 55.06 54.84 3ij6 s HIS 10 Cb -0.05 -1.14 0.00 0.00 -0.00 0.00 0.00 32.58 31.39 3ij6 s HIS 10 CO 0.11 0.43 0.17 -1.50 -0.00 0.00 0.00 174.74 173.94 3ij6 s ILE 11 N -1.50 0.10 -0.47 0.60 2.07 0.00 -4.38 121.20 117.62 3ij6 s ILE 11 Ca 0.18 -0.81 0.04 0.00 -1.41 0.00 0.00 60.65 58.64 3ij6 s ILE 11 Cb -0.08 -0.71 0.12 0.00 0.13 0.00 0.00 42.46 41.92 3ij6 s ILE 11 CO 0.08 -0.45 0.22 -0.76 -1.91 0.00 0.00 174.94 172.12 3ij6 s LEU 12 N -1.77 4.09 0.25 8.50 1.02 -0.36 -2.09 118.68 128.32 3ij6 s LEU 12 Ca -0.09 -2.78 -0.31 0.00 0.02 0.00 0.00 54.13 50.97 3ij6 s LEU 12 Cb -0.04 -1.53 -0.12 0.00 0.02 0.00 0.00 46.19 44.52 3ij6 s LEU 12 CO -0.01 -0.27 1.56 -2.65 0.02 0.00 0.00 176.35 175.00 3ij6 n PRO 13 N 3.41 2.47 -0.28 1.29 -0.02 -1.26 -4.50 135.00 136.11 3ij6 n PRO 13 Ca 0.05 0.88 -0.03 0.00 -2.02 0.00 0.00 63.50 62.38 3ij6 n PRO 13 Cb 0.34 -2.64 0.09 0.00 -0.02 0.00 0.00 33.50 31.27 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 4.99 1.00 -0.43 3.55 0.00 -1.95 -0.22 119.26 126.20 3ij6 h ALA 14 Ca -0.46 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.28 3ij6 h ALA 14 Cb 1.24 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3ij6 h ALA 14 CO 0.81 0.32 -0.28 0.87 0.00 0.00 0.00 179.25 180.97 3ij6 h LYS 15 N 0.97 0.96 -0.25 0.00 1.57 -1.97 -0.67 116.57 117.19 3ij6 h LYS 15 Ca 0.30 -0.45 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 3ij6 h LYS 15 Cb -0.02 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 3ij6 h LYS 15 CO -0.10 1.12 -0.05 -0.92 -0.57 0.00 0.00 179.45 178.92 3ij6 h TYR 16 N 0.80 0.52 -0.38 -1.35 3.20 -1.86 -0.60 116.97 117.30 3ij6 h TYR 16 Ca 0.09 -0.11 0.04 0.00 3.14 0.00 0.00 58.73 61.89 3ij6 h TYR 16 Cb 0.87 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.97 3ij6 h TYR 16 CO 0.06 0.68 0.14 -0.92 -1.64 0.00 0.00 178.16 176.48 3ij6 h TYR 17 N 0.21 0.25 0.00 -3.82 3.20 -1.00 0.65 116.97 116.46 3ij6 h TYR 17 Ca 0.06 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.91 3ij6 h TYR 17 Cb 0.51 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.72 3ij6 h TYR 17 CO 0.05 0.10 -0.22 1.96 -1.64 0.00 0.00 178.16 178.41 3ij6 h GLN 18 N 0.30 0.00 -0.23 1.82 1.08 -1.04 -1.01 115.11 116.02 3ij6 h GLN 18 Ca 0.17 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.19 3ij6 h GLN 18 Cb 0.15 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.57 3ij6 h GLN 18 CO -0.17 0.22 -0.58 0.87 -0.95 0.00 0.00 178.83 178.22 3ij6 h LYS 19 N 0.00 0.75 0.00 1.46 1.57 -0.55 -3.08 116.57 116.72 3ij6 h LYS 19 Ca -0.00 -0.49 -0.10 0.00 -1.87 0.00 0.00 60.65 58.19 3ij6 h LYS 19 Cb 0.43 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 3ij6 h LYS 19 CO 0.03 1.11 -0.48 0.52 -0.57 0.00 0.00 179.45 180.07 3ij6 h MET 20 N 0.56 0.00 -0.25 3.15 2.86 -0.37 -2.82 114.93 118.07 3ij6 h MET 20 Ca 0.00 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.54 3ij6 h MET 20 Cb 1.17 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.81 3ij6 h MET 20 CO 0.12 0.48 -0.28 -0.07 1.06 0.00 0.00 176.91 178.21 3ij6 h LEU 21 N 0.00 0.50 -1.39 1.22 3.38 -1.24 -1.41 115.31 116.36 3ij6 h LEU 21 Ca -0.00 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 3ij6 h LEU 21 Cb 1.00 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 3ij6 h LEU 21 CO 0.06 0.77 -0.18 0.28 0.09 0.00 0.00 178.44 179.46 3ij6 h SER 22 N 0.43 0.00 0.00 -0.43 0.02 -1.41 -1.82 113.55 110.35 3ij6 h SER 22 Ca 0.06 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3ij6 h SER 22 Cb 0.72 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.26 3ij6 h SER 22 CO 0.06 0.18 -0.00 0.58 -1.14 0.00 0.00 176.83 176.51 3ij6 h VAL 23 N 0.00 1.71 -2.84 2.27 2.07 -1.26 -3.44 116.25 114.76 3ij6 h VAL 23 Ca -0.00 -2.19 -0.41 0.00 0.82 0.00 0.00 66.70 64.91 3ij6 h VAL 23 Cb 0.61 3.19 -0.39 0.00 -1.52 0.00 0.00 31.29 33.17 3ij6 h VAL 23 CO 0.02 0.56 -0.71 -0.70 0.02 0.00 0.00 177.57 176.77 3ij6 s GLU 24 N -2.41 0.12 0.00 1.57 2.12 -0.56 -5.01 118.70 114.53 3ij6 s GLU 24 Ca -0.18 -0.02 0.20 0.00 0.36 0.00 0.00 54.97 55.33 3ij6 s GLU 24 Cb -0.02 -1.55 1.10 0.00 0.26 0.00 0.00 34.13 33.92 3ij6 s GLU 24 CO 0.67 -0.70 1.60 -2.30 -0.54 0.00 0.00 175.26 174.00 3ij6 n PRO 25 N 5.29 0.47 -0.04 4.30 -0.02 -0.69 -2.91 135.00 141.39 3ij6 n PRO 25 Ca -0.06 0.05 0.12 0.00 -2.02 0.00 0.00 63.50 61.59 3ij6 n PRO 25 Cb 0.49 -1.50 0.47 0.00 -0.02 0.00 0.00 33.50 32.93 3ij6 n PRO 25 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3ij6 n ASN 26 N -1.14 1.45 -0.26 2.55 3.02 -1.26 -4.41 115.26 115.21 3ij6 n ASN 26 Ca 0.12 -1.58 -0.04 0.00 -0.03 0.00 0.00 54.58 53.05 3ij6 n ASN 26 Cb 0.11 -0.05 0.07 0.00 -0.61 0.00 0.00 39.78 39.30 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 2.06 1.14 0.00 2.41 2.04 -1.90 -2.15 117.51 121.11 3ij6 h ILE 27 Ca 0.00 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.54 3ij6 h ILE 27 Cb 0.45 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 3ij6 h ILE 27 CO 0.00 0.17 0.00 -0.65 0.00 0.00 0.00 178.15 177.67 3ij6 h PRO 28 N 0.94 0.00 0.22 2.37 0.11 -1.85 -0.80 132.00 133.00 3ij6 h PRO 28 Ca 0.28 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 66.08 3ij6 h PRO 28 Cb -0.05 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.09 3ij6 h PRO 28 CO -0.08 0.00 -1.39 -0.91 -0.21 0.00 0.00 178.00 175.40 3ij6 h ASN 29 N 0.00 0.72 1.34 -2.05 -0.26 -1.76 -3.37 115.58 110.20 3ij6 h ASN 29 Ca 0.00 -0.93 -0.02 0.00 -0.56 0.00 0.00 56.30 54.80 3ij6 h ASN 29 Cb 0.14 -0.24 -0.00 0.00 -1.06 0.00 0.00 38.32 37.16 3ij6 h ASN 29 CO 0.00 1.66 -0.08 0.24 -1.06 0.00 0.00 177.43 178.20 3ij6 h MET 30 N 0.02 0.00 -4.29 0.81 2.86 -0.75 -3.42 114.93 110.16 3ij6 h MET 30 Ca -0.25 0.00 -0.58 0.00 -2.06 0.00 0.00 59.70 56.80 3ij6 h MET 30 Cb 2.04 0.00 -0.38 0.00 0.06 0.00 0.00 31.60 33.32 3ij6 h MET 30 CO 0.23 0.08 -0.79 -0.06 1.06 0.00 0.00 176.91 177.42 3ij6 s PHE 31 N -3.48 2.06 -0.32 -0.22 0.08 -0.37 -5.02 117.98 110.71 3ij6 s PHE 31 Ca 0.03 -1.41 0.27 0.00 0.12 0.00 0.00 56.93 55.94 3ij6 s PHE 31 Cb 0.08 -1.46 0.75 0.00 -0.57 0.00 0.00 43.02 41.82 3ij6 s PHE 31 CO 0.61 -0.70 1.75 -1.00 -0.10 0.00 0.00 175.22 175.79 3ij6 h PRO 32 N 8.04 0.00 -0.00 0.24 0.13 -1.83 -3.28 132.00 135.29 3ij6 h PRO 32 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 3ij6 h PRO 32 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3ij6 h PRO 32 CO 0.42 0.00 -0.00 1.97 -0.23 0.00 0.00 178.00 180.16 3ij6 n PHE 33 N -2.93 0.00 0.14 1.56 1.16 -1.26 -3.35 117.46 112.78 3ij6 n PHE 33 Ca 0.03 0.00 0.04 0.00 -1.87 0.00 0.00 57.45 55.65 3ij6 n PHE 33 Cb 0.43 -0.04 0.47 0.00 -1.61 0.00 0.00 39.48 38.73 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 0.20 1.11 -1.05 1.97 5.03 -1.92 -2.73 117.51 120.12 3ij6 h ILE 34 Ca 0.00 -0.45 0.28 0.00 -0.12 0.00 0.00 64.86 64.57 3ij6 h ILE 34 Cb 0.09 1.02 -0.11 0.00 -3.03 0.00 0.00 36.82 34.78 3ij6 h ILE 34 CO 0.00 0.15 0.65 0.50 -0.68 0.00 0.00 178.15 178.76 3ij6 h LYS 35 N 0.22 0.42 -6.31 2.37 1.63 -1.85 -3.41 116.57 109.63 3ij6 h LYS 35 Ca 0.05 -0.03 -0.57 0.00 -0.85 0.00 0.00 60.65 59.26 3ij6 h LYS 35 Cb 0.18 -0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 31.69 3ij6 h LYS 35 CO 0.00 0.28 1.16 0.42 -3.45 0.00 0.00 179.45 177.86 3ij6 s ILE 36 N -5.60 3.66 0.10 2.00 1.01 -1.03 -4.90 121.20 116.43 3ij6 s ILE 36 Ca -0.09 0.72 -0.19 0.00 0.00 0.00 0.00 60.65 61.08 3ij6 s ILE 36 Cb 0.27 -3.76 -0.07 0.00 0.01 0.00 0.00 42.46 38.91 3ij6 s ILE 36 CO 0.80 -0.39 1.60 0.11 0.00 0.00 0.00 174.94 177.05 3ij6 h LYS 37 N 11.36 0.39 0.00 2.79 1.57 -1.88 -2.71 116.57 128.09 3ij6 h LYS 37 Ca -0.33 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 3ij6 h LYS 37 Cb 1.15 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.41 3ij6 h LYS 37 CO 1.02 0.48 0.00 1.79 -0.57 0.00 0.00 179.45 182.17 3ij6 h THR 38 N 0.23 0.00 -0.02 -0.16 1.35 -1.79 0.81 112.91 113.32 3ij6 h THR 38 Ca 0.08 -0.12 -0.21 0.00 -0.55 0.00 0.00 66.41 65.61 3ij6 h THR 38 Cb 0.26 0.85 -0.00 0.00 -1.73 0.00 0.00 68.15 67.53 3ij6 h THR 38 CO -0.00 0.00 -0.86 0.25 -0.25 0.00 0.00 175.52 174.65 3ij6 h LEU 39 N 0.00 0.48 0.00 3.87 5.85 -1.82 -3.39 115.31 120.31 3ij6 h LEU 39 Ca 0.00 -0.36 -0.37 0.00 0.84 0.00 0.00 57.88 57.99 3ij6 h LEU 39 Cb 0.15 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 40.97 3ij6 h LEU 39 CO 0.00 1.14 -2.37 0.23 -0.34 0.00 0.00 178.44 177.10 3ij6 n MET 40 N -3.76 0.68 -4.01 1.25 2.81 -0.62 -1.23 117.12 112.24 3ij6 n MET 40 Ca -0.05 0.05 -0.33 0.00 -1.81 0.00 0.00 57.70 55.56 3ij6 n MET 40 Cb 0.79 -1.54 -0.15 0.00 -0.71 0.00 0.00 33.22 31.62 3ij6 n MET 40 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3ij6 s ASP 41 N -5.82 4.60 0.16 7.83 -1.08 0.18 -4.57 116.67 117.96 3ij6 s ASP 41 Ca -0.17 -1.35 -0.13 0.00 -0.52 0.00 0.00 52.55 50.39 3ij6 s ASP 41 Cb 0.07 -1.61 0.05 0.00 -1.46 0.00 0.00 42.92 39.98 3ij6 s ASP 41 CO 0.77 -0.21 1.73 0.25 0.52 0.00 0.00 175.17 178.22 3ij6 h LEU 42 N 7.85 0.73 -0.96 -1.34 5.85 -1.86 -1.13 115.31 124.46 3ij6 h LEU 42 Ca -0.20 -0.16 -0.07 0.00 0.84 0.00 0.00 57.88 58.30 3ij6 h LEU 42 Cb 1.05 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 3ij6 h LEU 42 CO 0.49 0.69 0.02 -2.24 -0.34 0.00 0.00 178.44 177.05 3ij6 h ASP 43 N 0.73 0.73 -0.07 1.25 -0.00 -1.96 -0.58 116.42 116.52 3ij6 h ASP 43 Ca 0.18 -0.17 0.02 0.00 -0.00 0.00 0.00 57.03 57.06 3ij6 h ASP 43 Cb 0.17 -0.19 -0.02 0.00 -0.00 0.00 0.00 39.33 39.29 3ij6 h ASP 43 CO -0.02 0.79 -0.04 -0.08 -0.00 0.00 0.00 179.24 179.89 3ij6 h GLU 44 N 0.72 -0.04 -0.52 4.15 4.57 -1.81 0.10 114.58 121.75 3ij6 h GLU 44 Ca 0.14 0.00 0.08 0.00 -1.18 0.00 0.00 59.36 58.41 3ij6 h GLU 44 Cb 0.42 0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 28.95 3ij6 h GLU 44 CO 0.02 -0.02 0.16 -0.09 -1.18 0.00 0.00 179.01 177.89 3ij6 h ARG 45 N -0.04 0.31 -0.15 1.92 2.43 -0.79 -0.36 114.38 117.71 3ij6 h ARG 45 Ca 0.04 -0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 59.03 3ij6 h ARG 45 Cb 0.10 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 3ij6 h ARG 45 CO -0.10 0.20 -0.58 -0.07 -1.51 0.00 0.00 179.97 177.91 3ij6 h LEU 46 N 0.32 0.54 0.10 3.80 3.38 -0.92 -2.46 115.31 120.07 3ij6 h LEU 46 Ca 0.26 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3ij6 h LEU 46 Cb 0.32 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3ij6 h LEU 46 CO -0.29 1.00 -0.05 0.74 0.09 0.00 0.00 178.44 179.93 3ij6 h THR 47 N 0.36 1.08 -0.71 0.22 2.02 -0.46 -3.20 112.91 112.23 3ij6 h THR 47 Ca -0.00 -0.78 -0.41 0.00 0.77 0.00 0.00 66.41 65.99 3ij6 h THR 47 Cb 1.12 1.57 -0.21 0.00 -1.74 0.00 0.00 68.15 68.89 3ij6 h THR 47 CO 0.11 0.19 0.52 0.29 0.37 0.00 0.00 175.52 176.99 3ij6 n LYS 48 N -4.98 1.99 -1.68 6.66 5.02 -0.17 -4.97 118.16 120.02 3ij6 n LYS 48 Ca -0.09 -2.20 -0.45 0.00 -2.02 0.00 0.00 58.31 53.56 3ij6 n LYS 48 Cb 0.22 -1.86 -0.04 0.00 -0.02 0.00 0.00 35.03 33.33 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 -0.52 2.46 0.13 2.13 -0.00 -0.93 -4.68 117.44 116.03 3ij6 n TRP 49 Ca 0.43 0.05 -0.01 0.00 -0.00 0.00 0.00 57.50 57.97 3ij6 n TRP 49 Cb 1.09 -2.64 0.22 0.00 -0.00 0.00 0.00 31.31 29.98 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 7.51 0.12 -2.43 5.87 0.13 -1.85 -3.44 132.00 137.91 3ij6 h PRO 50 Ca -0.46 -0.06 -0.07 0.00 -0.87 0.00 0.00 66.00 64.54 3ij6 h PRO 50 Cb 1.24 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.13 3ij6 h PRO 50 CO 0.93 0.59 -0.20 0.34 -0.23 0.00 0.00 178.00 179.42 3ij6 s ASP 51 N -6.89 -0.65 0.21 1.44 -1.08 -1.26 -4.89 116.67 103.56 3ij6 s ASP 51 Ca -0.03 1.10 0.24 0.00 -0.52 0.00 0.00 52.55 53.34 3ij6 s ASP 51 Cb 0.13 1.02 0.91 0.00 -1.46 0.00 0.00 42.92 43.52 3ij6 s ASP 51 CO 0.76 -0.21 1.73 0.00 0.52 0.00 0.00 175.17 177.97 3ij6 n GLN 52 N 4.36 0.19 -0.21 4.34 1.13 -1.26 -1.91 117.38 124.02 3ij6 n GLN 52 Ca -0.21 0.32 0.08 0.00 -1.94 0.00 0.00 57.00 55.24 3ij6 n GLN 52 Cb 0.56 -1.80 0.21 0.00 0.11 0.00 0.00 30.24 29.32 3ij6 n GLN 52 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 3ij6 n ASN 53 N -2.16 2.36 -4.50 1.08 5.15 -1.26 -4.86 115.26 111.07 3ij6 n ASN 53 Ca 0.04 -1.98 -0.34 0.00 -0.60 0.00 0.00 54.58 51.70 3ij6 n ASN 53 Cb 0.30 -0.28 -0.12 0.00 -0.53 0.00 0.00 39.78 39.15 3ij6 n ASN 53 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3ij6 s THR 54 N -1.44 3.89 0.06 -0.44 2.01 -0.80 -0.72 115.64 118.19 3ij6 s THR 54 Ca 0.30 -0.36 0.04 0.00 0.31 0.00 0.00 61.69 61.98 3ij6 s THR 54 Cb 0.16 -2.70 -0.04 0.00 0.01 0.00 0.00 72.50 69.93 3ij6 s THR 54 CO 0.21 0.50 -0.02 -0.54 -0.69 0.00 0.00 174.62 174.08 3ij6 s LYS 55 N 0.29 2.55 0.02 4.92 1.02 0.08 -4.85 119.74 123.77 3ij6 s LYS 55 Ca -0.03 -0.79 0.03 0.00 0.02 0.00 0.00 55.97 55.20 3ij6 s LYS 55 Cb -0.14 -2.53 -0.04 0.00 -0.52 0.00 0.00 37.83 34.60 3ij6 s LYS 55 CO 0.03 0.57 -0.05 -0.65 -0.92 0.00 0.00 175.35 174.33 3ij6 s GLN 56 N -1.97 2.57 -0.30 1.68 -0.21 -0.04 -0.44 119.66 120.96 3ij6 s GLN 56 Ca 0.22 -0.73 -0.12 0.00 0.02 0.00 0.00 55.36 54.75 3ij6 s GLN 56 Cb -0.11 -2.53 -0.04 0.00 1.00 0.00 0.00 33.01 31.33 3ij6 s GLN 56 CO 0.14 0.59 0.23 0.08 -2.12 0.00 0.00 175.29 174.21 3ij6 s VAL 57 N -1.06 5.28 -0.13 1.09 1.01 0.14 -1.14 120.40 125.59 3ij6 s VAL 57 Ca 0.19 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.22 3ij6 s VAL 57 Cb -0.11 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 3ij6 s VAL 57 CO 0.10 0.16 0.08 0.27 0.00 0.00 0.00 175.10 175.71 3ij6 s ILE 58 N 1.80 5.00 0.12 2.22 -4.36 -0.83 -1.92 121.20 123.22 3ij6 s ILE 58 Ca 0.08 0.02 0.02 0.00 -0.26 0.00 0.00 60.65 60.51 3ij6 s ILE 58 Cb -0.16 -3.18 -0.04 0.00 1.25 0.00 0.00 42.46 40.32 3ij6 s ILE 58 CO 0.11 0.56 -0.06 -0.94 0.24 0.00 0.00 174.94 174.85 3ij6 s SER 59 N -0.54 1.25 0.29 4.36 1.04 -0.70 -0.16 113.70 119.24 3ij6 s SER 59 Ca 0.11 -1.04 -0.29 0.00 0.48 0.00 0.00 55.95 55.21 3ij6 s SER 59 Cb -0.12 0.08 -0.10 0.00 0.10 0.00 0.00 66.02 65.99 3ij6 s SER 59 CO 0.02 -0.47 1.16 -0.76 0.98 0.00 0.00 173.24 174.17 3ij6 s LEU 60 N -3.09 4.52 0.83 2.42 1.43 -1.26 -0.82 118.68 122.72 3ij6 s LEU 60 Ca 0.15 2.37 -0.11 0.00 -1.03 0.00 0.00 54.13 55.51 3ij6 s LEU 60 Cb 0.05 -3.63 0.10 0.00 0.03 0.00 0.00 46.19 42.74 3ij6 s LEU 60 CO -0.02 -0.25 1.13 0.00 0.23 0.00 0.00 176.35 177.43 3ij6 s ALA 61 N -1.09 1.87 -1.26 4.21 0.00 -0.89 -4.77 121.76 119.82 3ij6 s ALA 61 Ca 0.46 0.49 -0.16 0.00 0.00 0.00 0.00 51.96 52.74 3ij6 s ALA 61 Cb -0.34 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.39 3ij6 s ALA 61 CO 0.44 -2.25 2.13 -1.71 0.00 0.00 0.00 175.76 174.37 3ij6 n ASN 62 N -3.77 3.49 -3.90 0.00 2.85 -1.26 -4.60 115.26 108.07 3ij6 n ASN 62 Ca 0.11 -2.79 -0.30 0.00 -0.11 0.00 0.00 54.58 51.48 3ij6 n ASN 62 Cb 0.52 -1.50 -0.14 0.00 1.24 0.00 0.00 39.78 39.90 3ij6 n ASN 62 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 3ij6 s ILE 63 N 3.77 2.13 -0.13 -1.44 1.01 -1.26 -5.12 121.20 120.17 3ij6 s ILE 63 Ca 0.50 -2.79 -0.07 0.00 0.00 0.00 0.00 60.65 58.29 3ij6 s ILE 63 Cb 0.14 -2.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.06 3ij6 s ILE 63 CO -0.03 -0.76 0.14 -0.44 0.00 0.00 0.00 174.94 173.84 3ij6 s SER 64 N 0.27 6.34 0.52 3.58 0.01 -1.26 -5.01 113.70 118.15 3ij6 s SER 64 Ca 0.15 0.44 0.19 0.00 1.31 0.00 0.00 55.95 58.03 3ij6 s SER 64 Cb -0.23 -2.06 1.30 0.00 0.21 0.00 0.00 66.02 65.24 3ij6 s SER 64 CO -0.04 0.38 2.10 -0.65 0.41 0.00 0.00 173.24 175.45 3ij6 h PRO 65 N 5.16 0.02 -0.01 12.44 0.11 -1.94 -2.53 132.00 145.26 3ij6 h PRO 65 Ca -0.53 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3ij6 h PRO 65 Cb 1.22 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 3ij6 h PRO 65 CO 0.60 0.01 0.04 1.05 -0.21 0.00 0.00 178.00 179.49 3ij6 h GLU 66 N 0.02 0.00 -0.00 1.05 4.11 -1.89 -0.67 114.58 117.19 3ij6 h GLU 66 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.51 3ij6 h GLU 66 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3ij6 h GLU 66 CO -0.00 0.00 -0.34 -0.25 0.07 0.00 0.00 179.01 178.48 3ij6 n ASP 67 N -3.25 0.55 0.00 3.06 8.00 -0.95 -4.51 116.55 119.45 3ij6 n ASP 67 Ca -0.03 -0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.14 3ij6 n ASP 67 Cb 0.11 0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 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 -1.25 0.00 -4.48 1.24 3.72 -0.46 -5.11 117.46 111.12 3ij6 n PHE 68 Ca 0.08 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.25 3ij6 n PHE 68 Cb 0.33 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.78 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 -1.51 0.82 1.10 4.37 -4.23 -0.39 -5.03 115.64 110.78 3ij6 s THR 69 Ca 0.00 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.35 3ij6 s THR 69 Cb 0.00 -2.53 0.24 0.00 1.34 0.00 0.00 72.50 71.55 3ij6 s THR 69 CO 0.00 0.00 1.11 1.51 -0.54 0.00 0.00 174.62 176.70 3ij6 s ASP 70 N -3.55 1.78 0.21 3.99 1.47 -1.26 -4.73 116.67 114.58 3ij6 s ASP 70 Ca 0.29 0.86 -0.10 0.00 1.18 0.00 0.00 52.55 54.78 3ij6 s ASP 70 Cb 0.05 -1.29 0.18 0.00 -0.34 0.00 0.00 42.92 41.52 3ij6 s ASP 70 CO 0.15 -3.62 1.86 -1.28 0.68 0.00 0.00 175.17 172.96 3ij6 h SER 71 N -2.23 0.79 -0.15 2.11 0.87 -1.98 -1.72 113.55 111.24 3ij6 h SER 71 Ca -0.50 -0.01 -0.14 0.00 -1.23 0.00 0.00 61.79 59.92 3ij6 h SER 71 Cb 1.31 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 3ij6 h SER 71 CO 0.46 0.56 -0.45 0.50 -0.53 0.00 0.00 176.83 177.37 3ij6 h LYS 72 N 0.94 0.57 -0.25 2.24 3.64 -1.93 -2.62 116.57 119.15 3ij6 h LYS 72 Ca 0.28 -0.41 -0.13 0.00 -1.27 0.00 0.00 60.65 59.12 3ij6 h LYS 72 Cb -0.04 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 3ij6 h LYS 72 CO -0.09 1.03 -0.39 1.15 -2.27 0.00 0.00 179.45 178.88 3ij6 h THR 73 N 0.20 1.30 -0.50 1.00 2.02 -1.92 -2.53 112.91 112.48 3ij6 h THR 73 Ca -0.01 -1.56 -0.01 0.00 0.77 0.00 0.00 66.41 65.60 3ij6 h THR 73 Cb 1.07 1.54 -0.02 0.00 -1.74 0.00 0.00 68.15 68.99 3ij6 h THR 73 CO 0.10 0.49 0.27 -1.28 0.37 0.00 0.00 175.52 175.47 3ij6 h SER 74 N 0.48 0.63 -0.77 4.18 0.87 -1.35 -0.14 113.55 117.45 3ij6 h SER 74 Ca 0.04 -0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.50 3ij6 h SER 74 Cb 0.90 -0.16 -0.04 0.00 -0.44 0.00 0.00 62.40 62.66 3ij6 h SER 74 CO 0.08 0.55 0.46 0.00 -0.53 0.00 0.00 176.83 177.39 3ij6 h ALA 75 N 1.11 0.98 -0.49 6.23 0.00 -1.29 -0.66 119.26 125.14 3ij6 h ALA 75 Ca 0.18 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3ij6 h ALA 75 Cb 0.06 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3ij6 h ALA 75 CO -0.03 0.46 -0.01 0.93 0.00 0.00 0.00 179.25 180.60 3ij6 h GLU 76 N 1.06 0.87 -0.30 0.00 5.08 -1.26 -1.99 114.58 118.03 3ij6 h GLU 76 Ca 0.28 -0.28 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 3ij6 h GLU 76 Cb -0.03 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 3ij6 h GLU 76 CO -0.05 0.92 -0.28 -0.07 -1.00 0.00 0.00 179.01 178.53 3ij6 h LEU 77 N 0.73 0.63 -0.18 1.33 3.38 -0.77 -2.02 115.31 118.41 3ij6 h LEU 77 Ca 0.14 -0.24 -0.14 0.00 0.09 0.00 0.00 57.88 57.74 3ij6 h LEU 77 Cb 0.53 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3ij6 h LEU 77 CO 0.03 0.88 -0.42 0.00 0.09 0.00 0.00 178.44 179.02 3ij6 h GLN 79 N 0.28 0.37 -0.92 0.00 4.15 -1.32 0.12 115.11 117.78 3ij6 h GLN 79 Ca -0.00 -0.02 0.02 0.00 0.77 0.00 0.00 58.65 59.41 3ij6 h GLN 79 Cb 1.03 -0.08 -0.05 0.00 0.21 0.00 0.00 27.48 28.59 3ij6 h GLN 79 CO 0.09 0.24 0.61 1.03 -1.93 0.00 0.00 178.83 178.88 3ij6 h SER 80 N 0.38 1.05 -0.30 -0.69 0.87 -1.35 -0.78 113.55 112.73 3ij6 h SER 80 Ca 0.19 -0.02 -0.05 0.00 -1.23 0.00 0.00 61.79 60.67 3ij6 h SER 80 Cb 0.12 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 3ij6 h SER 80 CO -0.15 0.75 -0.03 0.00 -0.53 0.00 0.00 176.83 176.87 3ij6 h ALA 81 N 1.35 0.41 -0.87 6.23 0.00 -0.67 -1.60 119.26 124.11 3ij6 h ALA 81 Ca 0.35 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3ij6 h ALA 81 Cb -0.11 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 3ij6 h ALA 81 CO -0.09 0.19 0.57 -0.91 0.00 0.00 0.00 179.25 179.01 3ij6 h ASN 82 N 0.33 0.99 -0.51 0.00 2.35 -0.63 0.75 115.58 118.86 3ij6 h ASN 82 Ca 0.08 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.79 3ij6 h ASN 82 Cb 0.48 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 3ij6 h ASN 82 CO 0.02 0.71 0.25 -0.08 -1.65 0.00 0.00 177.43 176.69 3ij6 h GLU 83 N 1.17 0.73 -0.57 0.81 4.81 -1.07 0.68 114.58 121.15 3ij6 h GLU 83 Ca 0.32 -0.10 -0.08 0.00 -0.13 0.00 0.00 59.36 59.37 3ij6 h GLU 83 Cb -0.12 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.10 3ij6 h GLU 83 CO -0.07 0.60 0.05 1.49 -0.73 0.00 0.00 179.01 180.35 3ij6 h GLU 84 N 0.68 0.98 -0.48 1.92 4.81 -1.01 -1.42 114.58 120.06 3ij6 h GLU 84 Ca 0.18 -0.29 -0.04 0.00 -0.13 0.00 0.00 59.36 59.08 3ij6 h GLU 84 Cb 0.11 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 3ij6 h GLU 84 CO -0.02 0.95 0.15 -0.07 -0.73 0.00 0.00 179.01 179.29 3ij6 h LEU 85 N 0.87 0.71 -0.65 1.64 3.38 -0.60 -1.32 115.31 119.34 3ij6 h LEU 85 Ca 0.17 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 57.94 3ij6 h LEU 85 Cb 0.48 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 3ij6 h LEU 85 CO 0.02 0.73 0.42 -1.28 0.09 0.00 0.00 178.44 178.42 3ij6 h SER 86 N 0.65 0.71 -0.82 -0.43 0.87 -0.77 -2.78 113.55 110.98 3ij6 h SER 86 Ca 0.16 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.70 3ij6 h SER 86 Cb 0.28 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 62.03 3ij6 h SER 86 CO -0.00 0.51 0.49 -1.13 -0.53 0.00 0.00 176.83 176.16 3ij6 h ASN 87 N 0.84 0.99 -0.89 6.23 -1.24 -0.97 -2.25 115.58 118.29 3ij6 h ASN 87 Ca 0.25 -0.07 0.04 0.00 0.71 0.00 0.00 56.30 57.23 3ij6 h ASN 87 Cb -0.05 -0.25 -0.05 0.00 0.73 0.00 0.00 38.32 38.69 3ij6 h ASN 87 CO -0.07 0.77 0.58 -0.07 -1.29 0.00 0.00 177.43 177.35 3ij6 h LEU 88 N 1.13 0.94 -0.09 0.34 3.38 -0.97 0.22 115.31 120.25 3ij6 h LEU 88 Ca 0.29 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.21 3ij6 h LEU 88 Cb -0.03 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 3ij6 h LEU 88 CO -0.05 0.64 -0.11 0.58 0.09 0.00 0.00 178.44 179.59 3ij6 h VAL 89 N 1.08 1.37 -0.53 1.22 2.07 -1.39 -2.45 116.25 117.62 3ij6 h VAL 89 Ca 0.36 -1.30 0.08 0.00 0.82 0.00 0.00 66.70 66.67 3ij6 h VAL 89 Cb 0.07 2.02 -0.07 0.00 -1.52 0.00 0.00 31.29 31.79 3ij6 h VAL 89 CO -0.11 0.37 0.16 -0.78 0.02 0.00 0.00 177.57 177.22 3ij6 h ASP 90 N -0.19 0.11 1.21 0.57 3.58 -1.06 -3.02 116.42 117.62 3ij6 h ASP 90 Ca 0.01 0.08 -0.09 0.00 0.42 0.00 0.00 57.03 57.46 3ij6 h ASP 90 Cb 0.64 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.76 3ij6 h ASP 90 CO 0.03 0.08 -0.41 1.56 -2.88 0.00 0.00 179.24 177.62 3ij6 h GLN 91 N 0.31 0.00 -2.07 0.28 1.08 -0.61 -3.37 115.11 110.74 3ij6 h GLN 91 Ca 0.26 0.00 -0.56 0.00 -1.45 0.00 0.00 58.65 56.91 3ij6 h GLN 91 Cb 0.33 0.00 -0.40 0.00 -0.05 0.00 0.00 27.48 27.36 3ij6 h GLN 91 CO -0.30 0.41 -0.97 0.72 -0.95 0.00 0.00 178.83 177.74 3ij6 n HIS 92 N -3.34 1.04 1.39 2.96 8.25 -0.92 -4.96 115.22 119.63 3ij6 n HIS 92 Ca 0.01 -3.78 0.14 0.00 -0.26 0.00 0.00 57.72 53.83 3ij6 n HIS 92 Cb 0.61 -0.42 0.73 0.00 1.12 0.00 0.00 29.99 32.03 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 0.91 0.46 0.00 -0.41 -0.05 -1.15 -1.19 135.00 133.57 3ij6 n PRO 93 Ca 0.25 0.02 0.12 0.00 -0.05 0.00 0.00 63.50 63.84 3ij6 n PRO 93 Cb 0.52 -1.50 0.26 0.00 -0.05 0.00 0.00 33.50 32.72 3ij6 n PRO 93 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 3ij6 n GLY 94 N 1.08 -0.64 0.04 0.55 0.00 -1.26 -4.44 105.19 100.52 3ij6 n GLY 94 Ca 0.14 -0.45 -0.04 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.75 0.15 -3.89 1.61 4.76 -0.73 -4.76 118.16 114.56 3ij6 n LYS 95 Ca 0.10 0.04 -0.35 0.00 -2.87 0.00 0.00 58.31 55.22 3ij6 n LYS 95 Cb 0.37 -1.12 -0.14 0.00 -1.84 0.00 0.00 35.03 32.30 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 3.15 0.37 2.13 0.08 -0.33 -0.86 117.98 120.40 3ij6 s PHE 96 Ca -0.08 -1.52 0.10 0.00 0.12 0.00 0.00 56.93 55.55 3ij6 s PHE 96 Cb 0.02 -2.13 0.71 0.00 -0.57 0.00 0.00 43.02 41.05 3ij6 s PHE 96 CO 0.14 -0.72 1.85 0.00 -0.10 0.00 0.00 175.22 176.39 3ij6 h ALA 97 N 8.07 1.40 0.00 5.36 0.00 -1.42 -3.42 119.26 129.25 3ij6 h ALA 97 Ca -0.29 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.35 3ij6 h ALA 97 Cb 1.10 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3ij6 h ALA 97 CO 0.57 0.42 0.00 0.41 0.00 0.00 0.00 179.25 180.65 3ij6 n GLY 98 N -0.64 -0.52 3.26 0.00 0.00 -1.25 -5.01 105.19 101.03 3ij6 n GLY 98 Ca -0.01 -0.96 -0.21 0.00 0.00 0.00 0.00 46.02 44.83 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 1.63 -0.21 4.61 0.00 0.37 -1.97 121.76 124.19 3ij6 s ALA 99 Ca 0.00 -1.23 -0.05 0.00 0.00 0.00 0.00 51.96 50.67 3ij6 s ALA 99 Cb 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 22.93 3ij6 s ALA 99 CO 0.00 0.25 0.00 0.08 0.00 0.00 0.00 175.76 176.09 3ij6 s VAL 100 N -1.51 3.89 0.38 0.00 1.01 0.78 -0.05 120.40 124.90 3ij6 s VAL 100 Ca 0.06 -0.33 -0.24 0.00 0.00 0.00 0.00 61.98 61.47 3ij6 s VAL 100 Cb -0.08 -2.77 -0.09 0.00 0.00 0.00 0.00 36.38 33.43 3ij6 s VAL 100 CO 0.04 0.41 1.03 0.00 0.00 0.00 0.00 175.10 176.58 3ij6 s ALA 101 N 1.22 3.12 0.15 5.51 0.00 0.54 -4.36 121.76 127.93 3ij6 s ALA 101 Ca 0.03 0.66 -0.24 0.00 0.00 0.00 0.00 51.96 52.41 3ij6 s ALA 101 Cb -0.15 -3.25 -0.08 0.00 0.00 0.00 0.00 23.12 19.64 3ij6 s ALA 101 CO 0.01 -0.12 0.74 -1.50 0.00 0.00 0.00 175.76 174.89 3ij6 s ILE 102 N -1.66 4.43 -0.10 0.00 2.07 -1.26 -0.64 121.20 124.04 3ij6 s ILE 102 Ca 0.56 1.62 -0.02 0.00 -1.41 0.00 0.00 60.65 61.41 3ij6 s ILE 102 Cb -0.21 -4.10 -0.03 0.00 0.13 0.00 0.00 42.46 38.25 3ij6 s ILE 102 CO 0.27 0.53 -0.03 -0.76 -1.91 0.00 0.00 174.94 173.03 3ij6 s LEU 103 N -1.15 3.34 -1.03 8.50 1.43 -1.26 -4.87 118.68 123.64 3ij6 s LEU 103 Ca 0.35 0.00 -0.19 0.00 -1.03 0.00 0.00 54.13 53.26 3ij6 s LEU 103 Cb -0.23 -1.77 0.11 0.00 0.03 0.00 0.00 46.19 44.33 3ij6 s LEU 103 CO 0.25 0.31 1.33 -2.16 0.23 0.00 0.00 176.35 176.31 3ij6 s PRO 104 N -0.45 3.71 0.12 1.29 0.04 -1.26 -4.86 135.00 133.58 3ij6 s PRO 104 Ca 0.07 -1.71 0.24 0.00 0.04 0.00 0.00 61.00 59.65 3ij6 s PRO 104 Cb -0.12 -5.14 0.94 0.00 0.04 0.00 0.00 34.50 30.22 3ij6 s PRO 104 CO 0.02 -1.95 1.76 -1.33 0.04 0.00 0.00 177.00 175.53 3ij6 n MET 105 N 7.32 0.12 -0.00 4.56 2.81 -1.26 -0.21 117.12 130.46 3ij6 n MET 105 Ca 0.31 0.20 0.12 0.00 -1.81 0.00 0.00 57.70 56.51 3ij6 n MET 105 Cb 0.48 -1.67 0.69 0.00 -0.71 0.00 0.00 33.22 32.01 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 -1.89 0.05 -3.41 7.83 6.94 -1.26 -4.50 115.26 119.01 3ij6 n ASN 106 Ca 0.05 -1.28 -0.27 0.00 -0.02 0.00 0.00 54.58 53.06 3ij6 n ASN 106 Cb 0.32 -0.00 -0.11 0.00 -2.36 0.00 0.00 39.78 37.63 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 -1.73 2.11 0.14 0.53 3.84 0.70 -4.62 114.94 115.91 3ij6 s ASN 107 Ca 0.35 -2.55 -0.15 0.00 0.21 0.00 0.00 52.86 50.72 3ij6 s ASN 107 Cb 0.16 -0.33 0.00 0.00 -0.55 0.00 0.00 41.25 40.53 3ij6 s ASN 107 CO 0.27 -0.24 1.68 0.40 -2.79 0.00 0.00 177.10 176.42 3ij6 h ILE 108 N 4.84 1.20 -0.27 -5.21 1.08 -1.79 0.49 117.51 117.86 3ij6 h ILE 108 Ca 0.15 -0.64 0.06 0.00 -0.39 0.00 0.00 64.86 64.05 3ij6 h ILE 108 Cb 0.95 0.83 -0.06 0.00 -3.07 0.00 0.00 36.82 35.46 3ij6 h ILE 108 CO 0.30 0.23 -0.16 -0.08 -0.69 0.00 0.00 178.15 177.75 3ij6 h GLU 109 N 0.54 -0.13 -0.60 2.37 4.81 -1.96 -0.38 114.58 119.23 3ij6 h GLU 109 Ca 0.14 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.30 3ij6 h GLU 109 Cb 0.21 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 3ij6 h GLU 109 CO -0.01 -0.09 0.04 1.03 -0.73 0.00 0.00 179.01 179.25 3ij6 h SER 110 N -0.14 0.98 -0.88 1.04 0.87 -1.72 -2.07 113.55 111.63 3ij6 h SER 110 Ca 0.14 -0.25 -0.01 0.00 -1.23 0.00 0.00 61.79 60.44 3ij6 h SER 110 Cb 0.36 -0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 62.01 3ij6 h SER 110 CO -0.35 1.01 0.51 0.00 -0.53 0.00 0.00 176.83 177.47 3ij6 h ALA 111 N 1.09 1.24 -0.92 6.23 0.00 -0.53 -1.04 119.26 125.33 3ij6 h ALA 111 Ca 0.18 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3ij6 h ALA 111 Cb 0.49 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 3ij6 h ALA 111 CO 0.02 0.64 0.53 0.00 0.00 0.00 0.00 179.25 180.44 3ij6 h LYS 113 N 1.28 0.80 -0.35 0.00 1.79 -0.74 -2.12 116.57 117.24 3ij6 h LYS 113 Ca 0.33 -0.17 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 3ij6 h LYS 113 Cb -0.01 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 30.50 3ij6 h LYS 113 CO -0.06 0.73 0.23 0.28 -1.08 0.00 0.00 179.45 179.55 3ij6 h VAL 114 N 0.77 1.10 -0.62 0.50 2.07 -0.93 -0.44 116.25 118.69 3ij6 h VAL 114 Ca 0.17 -0.20 0.04 0.00 0.82 0.00 0.00 66.70 67.52 3ij6 h VAL 114 Cb 0.31 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 3ij6 h VAL 114 CO 0.00 0.10 0.37 0.40 0.02 0.00 0.00 177.57 178.46 3ij6 h ILE 115 N 0.47 1.03 -0.12 4.57 1.08 -1.18 -2.29 117.51 121.08 3ij6 h ILE 115 Ca 0.13 -0.24 -0.07 0.00 -0.39 0.00 0.00 64.86 64.28 3ij6 h ILE 115 Cb -0.03 0.26 -0.01 0.00 -3.07 0.00 0.00 36.82 33.96 3ij6 h ILE 115 CO -0.03 0.13 -0.25 0.28 -0.69 0.00 0.00 178.15 177.59 3ij6 h SER 116 N 0.71 0.20 1.14 1.72 0.02 -1.09 -2.98 113.55 113.28 3ij6 h SER 116 Ca 0.26 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 3ij6 h SER 116 Cb 0.08 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.56 3ij6 h SER 116 CO -0.13 0.46 0.00 -1.54 -1.14 0.00 0.00 176.83 174.48 3ij6 n SER 117 N -4.17 0.60 0.08 3.07 3.41 -0.20 -3.47 113.62 112.94 3ij6 n SER 117 Ca -0.01 0.58 -0.04 0.00 -0.26 0.00 0.00 58.87 59.15 3ij6 n SER 117 Cb 0.35 -0.73 0.17 0.00 -0.26 0.00 0.00 64.21 63.74 3ij6 n SER 117 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 3ij6 h ILE 118 N 0.00 1.34 0.00 -1.33 2.04 -1.33 -2.60 117.51 115.62 3ij6 h ILE 118 Ca 0.00 -1.72 -0.06 0.00 1.00 0.00 0.00 64.86 64.08 3ij6 h ILE 118 Cb 0.57 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.46 3ij6 h ILE 118 CO 0.00 0.51 -0.29 0.11 0.00 0.00 0.00 178.15 178.48 3ij6 h LYS 119 N 0.20 0.00 -0.06 2.37 1.57 -1.73 -3.15 116.57 115.77 3ij6 h LYS 119 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3ij6 h LYS 119 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.25 3ij6 h LYS 119 CO 0.08 0.29 0.00 -0.25 -0.57 0.00 0.00 179.45 179.00 3ij6 n ASP 120 N -3.81 1.66 -3.69 0.86 8.00 -0.99 -4.79 116.55 113.79 3ij6 n ASP 120 Ca -0.01 -1.59 -0.23 0.00 0.71 0.00 0.00 54.79 53.67 3ij6 n ASP 120 Cb 0.38 -0.03 -0.18 0.00 -0.02 0.00 0.00 41.12 41.27 3ij6 n ASP 120 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3ij6 s ASP 121 N -1.88 1.65 0.41 -2.24 3.68 -1.17 -5.03 116.67 112.09 3ij6 s ASP 121 Ca 0.36 -0.18 0.12 0.00 2.13 0.00 0.00 52.55 54.97 3ij6 s ASP 121 Cb 0.20 -0.27 0.85 0.00 -1.45 0.00 0.00 42.92 42.25 3ij6 s ASP 121 CO 0.31 -0.26 1.93 -0.33 0.13 0.00 0.00 175.17 176.95 3ij6 h GLU 122 N 8.39 0.13 0.00 4.34 4.39 -1.87 -3.03 114.58 126.94 3ij6 h GLU 122 Ca -0.15 -0.03 -0.09 0.00 0.34 0.00 0.00 59.36 59.43 3ij6 h GLU 122 Cb 1.13 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.75 3ij6 h GLU 122 CO 0.22 0.31 -0.44 -0.91 -1.16 0.00 0.00 179.01 177.02 3ij6 h ASN 123 N 0.12 0.00 -3.58 1.42 2.35 -1.92 -3.43 115.58 110.55 3ij6 h ASN 123 Ca 0.02 0.00 -0.62 0.00 -0.55 0.00 0.00 56.30 55.16 3ij6 h ASN 123 Cb 0.38 0.00 -0.13 0.00 0.05 0.00 0.00 38.32 38.63 3ij6 h ASN 123 CO 0.03 0.44 0.00 -0.76 -1.65 0.00 0.00 177.43 175.49 3ij6 s LEU 124 N -6.68 4.06 -0.04 1.61 1.43 -1.15 -0.48 118.68 117.44 3ij6 s LEU 124 Ca 0.02 0.52 0.10 0.00 -1.03 0.00 0.00 54.13 53.75 3ij6 s LEU 124 Cb 0.09 -2.68 -0.16 0.00 0.03 0.00 0.00 46.19 43.47 3ij6 s LEU 124 CO 0.72 -0.31 0.19 0.52 0.23 0.00 0.00 176.35 177.70 3ij6 n VAL 125 N 5.18 0.17 -3.16 -1.59 0.31 0.93 -4.81 118.33 115.37 3ij6 n VAL 125 Ca -0.04 -0.29 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 3ij6 n VAL 125 Cb 0.50 0.01 0.00 0.00 -0.91 0.00 0.00 33.84 33.43 3ij6 n VAL 125 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3ij6 n GLY 126 N 2.00 1.44 3.28 2.92 0.00 -1.23 -4.55 105.19 109.06 3ij6 n GLY 126 Ca -0.06 -0.84 -0.21 0.00 0.00 0.00 0.00 46.02 44.92 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 -1.00 1.72 -0.20 4.61 0.00 -1.09 -0.34 121.76 125.46 3ij6 s ALA 127 Ca 0.00 -1.31 -0.08 0.00 0.00 0.00 0.00 51.96 50.57 3ij6 s ALA 127 Cb 0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 3ij6 s ALA 127 CO 0.00 0.24 0.09 -1.14 0.00 0.00 0.00 175.76 174.95 3ij6 s GLN 128 N -2.36 4.01 0.23 0.00 0.74 0.19 -0.86 119.66 121.62 3ij6 s GLN 128 Ca 0.09 -0.32 0.09 0.00 0.05 0.00 0.00 55.36 55.27 3ij6 s GLN 128 Cb -0.07 -3.32 -0.04 0.00 1.10 0.00 0.00 33.01 30.67 3ij6 s GLN 128 CO 0.04 0.20 0.01 0.96 -0.55 0.00 0.00 175.29 175.95 3ij6 s ILE 129 N 0.60 3.60 0.30 -2.34 -4.36 0.70 -4.28 121.20 115.42 3ij6 s ILE 129 Ca 0.05 -1.71 0.10 0.00 -0.26 0.00 0.00 60.65 58.82 3ij6 s ILE 129 Cb -0.13 -2.89 -0.05 0.00 1.25 0.00 0.00 42.46 40.65 3ij6 s ILE 129 CO 0.01 -0.28 -0.05 -0.36 0.24 0.00 0.00 174.94 174.49 3ij6 s PHE 130 N -2.10 2.51 0.34 1.37 0.08 -1.26 -0.76 117.98 118.16 3ij6 s PHE 130 Ca 0.30 -0.35 0.07 0.00 0.12 0.00 0.00 56.93 57.07 3ij6 s PHE 130 Cb -0.07 -1.27 0.62 0.00 -0.57 0.00 0.00 43.02 41.73 3ij6 s PHE 130 CO 0.20 0.59 1.82 1.79 -0.10 0.00 0.00 175.22 179.51 3ij6 h THR 131 N 1.96 1.24 -3.99 0.64 1.35 -1.57 -3.41 112.91 109.14 3ij6 h THR 131 Ca -0.42 -1.10 -0.39 0.00 -0.55 0.00 0.00 66.41 63.95 3ij6 h THR 131 Cb 1.25 1.38 -0.29 0.00 -1.73 0.00 0.00 68.15 68.76 3ij6 h THR 131 CO 0.63 0.34 -0.78 -0.13 -0.25 0.00 0.00 175.52 175.33 3ij6 s ARG 132 N -4.51 0.70 -0.15 4.72 0.52 -1.26 -1.59 118.95 117.39 3ij6 s ARG 132 Ca -0.05 -0.30 0.02 0.00 -0.52 0.00 0.00 55.73 54.88 3ij6 s ARG 132 Cb 0.15 -0.68 0.01 0.00 0.52 0.00 0.00 34.95 34.95 3ij6 s ARG 132 CO 0.75 0.17 -0.21 -1.01 0.02 0.00 0.00 175.30 175.02 3ij6 s HIS 133 N -0.15 2.66 -1.45 -0.53 3.76 -0.35 -4.78 115.29 114.46 3ij6 s HIS 133 Ca 0.02 -1.40 -0.09 0.00 -0.15 0.00 0.00 55.06 53.45 3ij6 s HIS 133 Cb -0.04 -1.82 0.03 0.00 1.11 0.00 0.00 32.58 31.86 3ij6 s HIS 133 CO -0.00 -0.65 0.91 1.28 -0.85 0.00 0.00 174.74 175.42 3ij6 n LEU 134 N 4.21 -2.83 0.00 0.89 4.77 -1.26 -1.92 117.00 120.86 3ij6 n LEU 134 Ca -0.20 -0.51 0.00 0.00 -0.03 0.00 0.00 56.01 55.27 3ij6 n LEU 134 Cb 0.51 -2.83 0.00 0.00 -2.33 0.00 0.00 43.42 38.77 3ij6 n LEU 134 CO 0.27 0.44 0.00 0.61 -1.33 0.00 0.00 177.39 177.38 3ij6 n GLY 135 N -1.72 0.44 3.57 -0.72 0.00 -1.26 -5.04 105.19 100.46 3ij6 n GLY 135 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.33 2.02 0.58 1.61 1.02 -0.81 -5.12 119.74 118.72 3ij6 s LYS 136 Ca 0.00 -1.47 -0.19 0.00 0.02 0.00 0.00 55.97 54.34 3ij6 s LYS 136 Cb 0.00 -2.04 -0.04 0.00 -0.52 0.00 0.00 37.83 35.22 3ij6 s LYS 136 CO 0.00 0.38 1.16 0.45 -0.92 0.00 0.00 175.35 176.42 3ij6 s SER 137 N -3.32 5.42 0.54 2.83 0.15 -1.26 -1.20 113.70 116.85 3ij6 s SER 137 Ca 0.28 2.24 0.26 0.00 0.70 0.00 0.00 55.95 59.44 3ij6 s SER 137 Cb -0.07 -2.58 1.43 0.00 -1.71 0.00 0.00 66.02 63.09 3ij6 s SER 137 CO 0.17 -1.43 1.99 -0.29 1.20 0.00 0.00 173.24 174.88 3ij6 h ILE 138 N 0.93 0.67 -0.00 6.45 6.09 -1.51 -1.69 117.51 128.44 3ij6 h ILE 138 Ca -0.50 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 62.99 3ij6 h ILE 138 Cb 1.27 0.72 0.00 0.00 0.47 0.00 0.00 36.82 39.29 3ij6 h ILE 138 CO 0.56 0.00 -0.04 0.00 -3.07 0.00 0.00 178.15 175.59 3ij6 n ALA 139 N -2.60 2.55 -1.68 0.18 0.00 -1.26 -4.67 120.51 113.03 3ij6 n ALA 139 Ca 0.10 -0.16 -0.41 0.00 0.00 0.00 0.00 53.44 52.97 3ij6 n ALA 139 Cb 0.61 -1.44 0.02 0.00 0.00 0.00 0.00 19.45 18.64 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 -1.29 2.12 0.12 0.00 2.03 -0.64 -4.88 116.55 114.01 3ij6 n ASP 140 Ca 0.12 1.05 0.17 0.00 0.52 0.00 0.00 54.79 56.65 3ij6 n ASP 140 Cb 0.28 -1.46 0.72 0.00 -0.72 0.00 0.00 41.12 39.93 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 1.76 0.00 -0.96 -0.67 2.10 -1.89 -2.15 116.57 114.75 3ij6 h LYS 141 Ca -0.47 0.00 0.21 0.00 -2.00 0.00 0.00 60.65 58.38 3ij6 h LYS 141 Cb 1.31 0.00 -0.08 0.00 -0.90 0.00 0.00 32.23 32.56 3ij6 h LYS 141 CO 0.58 0.00 0.62 1.49 -2.00 0.00 0.00 179.45 180.14 3ij6 h GLU 142 N 0.00 0.51 -0.01 0.07 4.81 -1.94 -2.88 114.58 115.14 3ij6 h GLU 142 Ca 0.15 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3ij6 h GLU 142 Cb 0.65 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.91 3ij6 h GLU 142 CO -0.00 0.33 -0.31 1.19 -0.73 0.00 0.00 179.01 179.50 3ij6 n PHE 143 N -4.60 0.00 -0.32 0.92 3.72 -0.82 -4.59 117.46 111.77 3ij6 n PHE 143 Ca 0.21 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.65 3ij6 n PHE 143 Cb 0.68 0.00 0.18 0.00 -0.94 0.00 0.00 39.48 39.40 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 1.62 0.89 -0.86 -1.08 9.65 -1.43 -2.01 114.38 121.17 3ij6 h ARG 144 Ca 0.00 -0.05 0.12 0.00 -1.10 0.00 0.00 59.98 58.94 3ij6 h ARG 144 Cb 0.50 -0.20 -0.06 0.00 -1.39 0.00 0.00 29.97 28.81 3ij6 h ARG 144 CO 0.00 0.59 0.55 -1.35 2.80 0.00 0.00 179.97 182.57 3ij6 h PRO 145 N 0.92 0.72 -0.32 0.20 0.11 -1.81 0.19 132.00 132.01 3ij6 h PRO 145 Ca 0.43 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.44 3ij6 h PRO 145 Cb 0.34 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.28 3ij6 h PRO 145 CO -0.23 0.48 0.00 0.28 -0.21 0.00 0.00 178.00 178.32 3ij6 h VAL 146 N 0.74 1.26 -0.67 3.15 2.07 -1.70 0.52 116.25 121.61 3ij6 h VAL 146 Ca 0.41 -0.94 -0.06 0.00 0.82 0.00 0.00 66.70 66.93 3ij6 h VAL 146 Cb 0.56 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 3ij6 h VAL 146 CO -0.18 0.31 0.19 -0.07 0.02 0.00 0.00 177.57 177.85 3ij6 h LEU 147 N 0.36 0.98 -0.73 2.57 3.38 -1.13 -2.24 115.31 118.50 3ij6 h LEU 147 Ca 0.09 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 3ij6 h LEU 147 Cb 0.44 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3ij6 h LEU 147 CO 0.02 0.92 0.14 0.00 0.09 0.00 0.00 178.44 179.61 3ij6 h ALA 148 N 1.21 0.95 -0.60 1.53 0.00 -0.29 -2.12 119.26 119.94 3ij6 h ALA 148 Ca 0.22 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 3ij6 h ALA 148 Cb 0.31 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3ij6 h ALA 148 CO -0.01 0.66 0.22 0.37 0.00 0.00 0.00 179.25 180.50 3ij6 h GLN 149 N 1.04 0.91 -0.43 0.00 5.75 -0.71 -0.45 115.11 121.22 3ij6 h GLN 149 Ca 0.21 -0.18 -0.06 0.00 -0.15 0.00 0.00 58.65 58.48 3ij6 h GLN 149 Cb 0.40 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.79 3ij6 h GLN 149 CO 0.01 0.79 0.04 0.00 -2.65 0.00 0.00 178.83 177.01 3ij6 h ALA 150 N 1.07 1.25 -0.02 3.38 0.00 -1.21 -0.30 119.26 123.44 3ij6 h ALA 150 Ca 0.20 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ij6 h ALA 150 Cb 0.24 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 3ij6 h ALA 150 CO -0.01 0.50 -0.00 0.00 0.00 0.00 0.00 179.25 179.74 3ij6 h ALA 151 N 1.39 0.03 -0.33 0.00 0.00 -1.15 0.88 119.26 120.08 3ij6 h ALA 151 Ca 0.14 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.90 3ij6 h ALA 151 Cb 0.35 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 3ij6 h ALA 151 CO 0.01 -0.28 0.07 -0.22 0.00 0.00 0.00 179.25 178.83 3ij6 h LYS 152 N -0.32 0.18 -0.08 0.00 3.64 -0.80 -2.88 116.57 116.31 3ij6 h LYS 152 Ca 0.01 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3ij6 h LYS 152 Cb 0.38 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 3ij6 h LYS 152 CO 0.00 0.12 0.00 1.28 -2.27 0.00 0.00 179.45 178.58 3ij6 n LEU 153 N -5.08 1.60 -2.68 5.20 4.77 -0.15 -4.95 117.00 115.70 3ij6 n LEU 153 Ca 0.01 -0.60 -0.20 0.00 -0.03 0.00 0.00 56.01 55.19 3ij6 n LEU 153 Cb 0.14 -0.05 0.03 0.00 -2.33 0.00 0.00 43.42 41.22 3ij6 n LEU 153 CO 0.25 0.30 -0.01 1.41 -1.33 0.00 0.00 177.39 178.01 3ij6 n HIS 154 N 0.26 -1.72 -2.97 -1.77 8.25 -0.65 -5.00 115.22 111.62 3ij6 n HIS 154 Ca 0.18 0.45 -0.41 0.00 -0.26 0.00 0.00 57.72 57.67 3ij6 n HIS 154 Cb 0.35 -4.12 -0.05 0.00 1.12 0.00 0.00 29.99 27.29 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 -3.11 4.89 0.32 1.59 1.01 0.21 -4.77 120.40 120.55 3ij6 s VAL 155 Ca 0.26 1.42 -0.28 0.00 0.00 0.00 0.00 61.98 63.37 3ij6 s VAL 155 Cb -0.11 -4.05 -0.10 0.00 0.00 0.00 0.00 36.38 32.12 3ij6 s VAL 155 CO 0.32 -0.04 1.19 -2.16 0.00 0.00 0.00 175.10 174.41 3ij6 s PRO 156 N 2.71 4.42 -0.10 2.72 0.04 -1.26 -4.59 135.00 138.93 3ij6 s PRO 156 Ca 0.32 1.96 -0.01 0.00 0.04 0.00 0.00 61.00 63.31 3ij6 s PRO 156 Cb -0.15 -3.04 -0.03 0.00 0.04 0.00 0.00 34.50 31.32 3ij6 s PRO 156 CO 0.08 -0.04 -0.07 -0.51 0.04 0.00 0.00 177.00 176.50 3ij6 s LEU 157 N -1.79 3.14 -0.22 -3.56 1.43 0.27 -2.66 118.68 115.29 3ij6 s LEU 157 Ca 0.49 -0.09 -0.18 0.00 -1.03 0.00 0.00 54.13 53.32 3ij6 s LEU 157 Cb -0.34 -1.71 -0.03 0.00 0.03 0.00 0.00 46.19 44.14 3ij6 s LEU 157 CO 0.45 0.28 0.50 0.26 0.23 0.00 0.00 176.35 178.07 3ij6 s TRP 158 N -0.34 3.34 -0.21 0.29 0.23 -0.04 0.89 118.94 123.10 3ij6 s TRP 158 Ca 0.05 0.71 -0.07 0.00 -2.03 0.00 0.00 56.10 54.75 3ij6 s TRP 158 Cb -0.12 -2.66 -0.04 0.00 0.03 0.00 0.00 33.47 30.68 3ij6 s TRP 158 CO 0.02 -0.14 0.06 1.41 0.96 0.00 0.00 176.95 179.27 3ij6 s MET 159 N 1.78 3.83 0.03 4.98 -2.45 0.11 -0.22 119.30 127.36 3ij6 s MET 159 Ca 0.22 -0.41 0.09 0.00 -1.25 0.00 0.00 55.69 54.34 3ij6 s MET 159 Cb -0.15 -3.26 -0.03 0.00 1.25 0.00 0.00 34.83 32.64 3ij6 s MET 159 CO 0.09 0.07 -0.26 -1.58 1.05 0.00 0.00 175.02 174.39 3ij6 s HIS 160 N 0.92 2.34 0.48 4.11 2.46 0.06 -2.88 115.29 122.79 3ij6 s HIS 160 Ca 0.04 -0.41 -0.20 0.00 0.47 0.00 0.00 55.06 54.96 3ij6 s HIS 160 Cb -0.14 -1.43 -0.09 0.00 -0.13 0.00 0.00 32.58 30.80 3ij6 s HIS 160 CO 0.03 0.09 1.03 -1.25 -2.47 0.00 0.00 174.74 172.17 3ij6 s PRO 161 N -1.08 3.85 0.04 2.88 0.04 -1.26 -1.44 135.00 138.03 3ij6 s PRO 161 Ca 0.11 1.33 0.04 0.00 0.04 0.00 0.00 61.00 62.52 3ij6 s PRO 161 Cb -0.10 -2.10 -0.02 0.00 0.04 0.00 0.00 34.50 32.31 3ij6 s PRO 161 CO 0.01 -0.39 -0.11 0.54 0.04 0.00 0.00 177.00 177.09 3ij6 s VAL 162 N -2.01 0.87 0.30 -0.36 0.11 -1.26 -4.84 120.40 113.21 3ij6 s VAL 162 Ca 0.67 -1.01 -0.30 0.00 -2.93 0.00 0.00 61.98 58.41 3ij6 s VAL 162 Cb -0.15 -0.83 -0.12 0.00 -1.53 0.00 0.00 36.38 33.74 3ij6 s VAL 162 CO 0.19 -0.15 1.51 0.49 -3.33 0.00 0.00 175.10 173.81 3ij6 n PHE 163 N 1.75 2.65 -3.05 1.54 3.72 -1.26 -4.83 117.46 117.98 3ij6 n PHE 163 Ca -0.20 0.35 -0.43 0.00 -0.05 0.00 0.00 57.45 57.13 3ij6 n PHE 163 Cb 0.55 -2.54 -0.06 0.00 -0.94 0.00 0.00 39.48 36.49 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 0.29 6.38 0.56 4.37 -1.08 -1.26 -4.95 116.67 120.98 3ij6 s ASP 164 Ca 0.63 -0.17 0.34 0.00 -0.52 0.00 0.00 52.55 52.82 3ij6 s ASP 164 Cb -0.54 -2.35 1.60 0.00 -1.46 0.00 0.00 42.92 40.18 3ij6 s ASP 164 CO 0.52 -0.81 2.09 0.00 0.52 0.00 0.00 175.17 177.49 3ij6 h ALA 165 N 8.85 1.08 0.00 3.66 0.00 -2.01 -2.05 119.26 128.79 3ij6 h ALA 165 Ca -0.25 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 3ij6 h ALA 165 Cb 1.09 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 3ij6 h ALA 165 CO 0.91 0.07 -0.04 0.00 0.00 0.00 0.00 179.25 180.19 3ij6 h ARG 166 N 0.00 0.00 -5.27 0.00 3.08 -2.00 -3.42 114.38 106.76 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 0.36 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.29 3ij6 h ARG 166 CO 0.01 0.04 -0.39 0.15 -1.07 0.00 0.00 179.97 178.71 3ij6 s LYS 167 N -4.28 4.15 0.76 0.04 1.02 -0.77 -5.08 119.74 115.57 3ij6 s LYS 167 Ca -0.04 -0.08 -0.11 0.00 0.02 0.00 0.00 55.97 55.77 3ij6 s LYS 167 Cb 0.13 -3.50 0.05 0.00 -0.52 0.00 0.00 37.83 33.99 3ij6 s LYS 167 CO 0.52 0.10 1.08 -2.14 -0.92 0.00 0.00 175.35 173.99 3ij6 s PRO 168 N 0.92 2.41 -1.62 -1.68 0.02 -1.26 -4.07 135.00 129.71 3ij6 s PRO 168 Ca 0.12 0.99 -0.04 0.00 0.02 0.00 0.00 61.00 62.10 3ij6 s PRO 168 Cb -0.13 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.46 3ij6 s PRO 168 CO 0.04 -1.49 0.46 -0.25 -0.33 0.00 0.00 177.00 175.44 3ij6 n ASP 169 N -3.40 -6.11 -4.77 2.53 8.00 -1.26 -4.98 116.55 106.57 3ij6 n ASP 169 Ca 0.08 -0.22 -0.41 0.00 0.71 0.00 0.00 54.79 54.95 3ij6 n ASP 169 Cb 0.54 -4.97 -0.00 0.00 -0.02 0.00 0.00 41.12 36.66 3ij6 n ASP 169 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3ij6 n ASN 170 N -2.41 3.85 -3.83 -2.24 3.02 -1.26 -4.95 115.26 107.45 3ij6 n ASN 170 Ca -0.15 1.21 -0.09 0.00 -0.03 0.00 0.00 54.58 55.51 3ij6 n ASN 170 Cb 0.64 -1.62 -0.05 0.00 -0.61 0.00 0.00 39.78 38.14 3ij6 n ASN 170 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3ij6 s ASN 171 N 0.06 -0.15 0.23 6.41 2.20 -1.26 -5.04 114.94 117.39 3ij6 s ASN 171 Ca 0.56 -0.63 0.25 0.00 -0.94 0.00 0.00 52.86 52.10 3ij6 s ASN 171 Cb -0.48 0.53 0.86 0.00 -2.00 0.00 0.00 41.25 40.16 3ij6 s ASN 171 CO 0.59 -1.00 1.76 0.18 -2.94 0.00 0.00 177.10 175.69 3ij6 n LEU 172 N -0.30 0.78 -0.02 3.54 4.77 -1.26 -2.88 117.00 121.63 3ij6 n LEU 172 Ca -0.09 0.60 -0.11 0.00 -0.03 0.00 0.00 56.01 56.38 3ij6 n LEU 172 Cb 0.63 -0.39 -0.09 0.00 -2.33 0.00 0.00 43.42 41.23 3ij6 n LEU 172 CO 0.20 -0.29 0.38 0.58 -1.33 0.00 0.00 177.39 176.93 3ij6 h VAL 173 N 0.00 1.23 0.00 4.08 2.07 -2.00 -3.45 116.25 118.18 3ij6 h VAL 173 Ca 0.00 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 65.88 3ij6 h VAL 173 Cb 0.64 2.20 0.00 0.00 -1.52 0.00 0.00 31.29 32.60 3ij6 h VAL 173 CO 0.00 0.37 -0.61 0.49 0.02 0.00 0.00 177.57 177.84 3ij6 n PHE 174 N -4.76 0.00 -0.01 1.57 3.72 -1.25 -4.88 117.46 111.84 3ij6 n PHE 174 Ca -0.08 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.21 3ij6 n PHE 174 Cb 0.32 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.80 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 0.14 -0.54 4.37 0.02 -1.83 -2.48 113.55 113.22 3ij6 h SER 175 Ca 0.00 -0.09 0.10 0.00 -0.84 0.00 0.00 61.79 60.96 3ij6 h SER 175 Cb 0.15 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 3ij6 h SER 175 CO 0.00 0.19 0.37 -0.50 -1.14 0.00 0.00 176.83 175.75 3ij6 h TRP 176 N 0.07 0.31 0.00 3.45 6.55 -1.90 -0.25 115.95 124.19 3ij6 h TRP 176 Ca 0.04 0.01 -0.18 0.00 0.95 0.00 0.00 58.89 59.71 3ij6 h TRP 176 Cb 0.09 -0.10 -0.03 0.00 -0.86 0.00 0.00 29.16 28.26 3ij6 h TRP 176 CO -0.04 0.15 -0.88 0.93 -1.05 0.00 0.00 178.44 177.54 3ij6 h GLU 177 N 0.29 0.00 -0.44 0.49 3.07 -1.84 -1.06 114.58 115.09 3ij6 h GLU 177 Ca 0.25 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 59.02 3ij6 h GLU 177 Cb 0.61 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.51 3ij6 h GLU 177 CO -0.06 0.80 -0.08 -0.92 -1.40 0.00 0.00 179.01 177.35 3ij6 h TYR 178 N 0.00 0.94 -0.87 4.33 3.20 -0.88 -2.35 116.97 121.35 3ij6 h TYR 178 Ca -0.02 -0.19 -0.01 0.00 3.14 0.00 0.00 58.73 61.64 3ij6 h TYR 178 Cb 1.66 -0.23 -0.04 0.00 1.54 0.00 0.00 36.73 39.65 3ij6 h TYR 178 CO 0.00 0.93 0.50 0.93 -1.64 0.00 0.00 178.16 178.88 3ij6 h GLU 179 N 0.67 1.19 -0.79 1.82 4.39 -0.87 0.42 114.58 121.41 3ij6 h GLU 179 Ca 0.11 -0.12 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 3ij6 h GLU 179 Cb 0.62 -0.24 -0.04 0.00 -0.10 0.00 0.00 28.75 28.99 3ij6 h GLU 179 CO 0.04 0.85 0.36 -0.07 -1.16 0.00 0.00 179.01 179.03 3ij6 h LEU 180 N 1.20 1.05 -0.16 1.33 3.38 -1.07 -2.05 115.31 118.99 3ij6 h LEU 180 Ca 0.31 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 58.06 3ij6 h LEU 180 Cb -0.02 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 3ij6 h LEU 180 CO -0.05 0.90 -0.17 0.28 0.09 0.00 0.00 178.44 179.48 3ij6 h SER 181 N 1.12 0.43 -0.55 -0.43 0.02 -0.81 -2.29 113.55 111.04 3ij6 h SER 181 Ca 0.27 -0.49 0.11 0.00 -0.84 0.00 0.00 61.79 60.84 3ij6 h SER 181 Cb 0.15 -0.12 -0.09 0.00 0.14 0.00 0.00 62.40 62.48 3ij6 h SER 181 CO -0.03 0.83 -0.00 1.56 -1.14 0.00 0.00 176.83 178.05 3ij6 h GLN 182 N 0.03 0.11 -0.48 3.45 1.08 -0.90 -1.33 115.11 117.07 3ij6 h GLN 182 Ca 0.02 -0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.17 3ij6 h GLN 182 Cb 0.72 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.10 3ij6 h GLN 182 CO 0.04 0.07 0.10 0.00 -0.95 0.00 0.00 178.83 178.10 3ij6 h ALA 183 N 1.49 0.63 -0.50 3.87 0.00 -1.23 0.31 119.26 123.83 3ij6 h ALA 183 Ca 0.28 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.98 3ij6 h ALA 183 Cb 0.43 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3ij6 h ALA 183 CO -0.46 0.33 0.32 0.52 0.00 0.00 0.00 179.25 179.96 3ij6 h MET 184 N 0.65 0.63 -0.37 0.00 2.86 -1.20 0.30 114.93 117.81 3ij6 h MET 184 Ca 0.15 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.73 3ij6 h MET 184 Cb 0.35 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.85 3ij6 h MET 184 CO 0.00 0.42 0.15 1.25 1.06 0.00 0.00 176.91 179.79 3ij6 h LEU 185 N 0.65 0.51 -0.61 1.22 5.85 -0.96 0.41 115.31 122.38 3ij6 h LEU 185 Ca 0.19 -0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 3ij6 h LEU 185 Cb -0.06 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 3ij6 h LEU 185 CO -0.05 0.54 0.31 1.56 -0.34 0.00 0.00 178.44 180.46 3ij6 h GLN 186 N 0.45 0.87 -0.06 1.25 4.20 -0.79 0.04 115.11 121.09 3ij6 h GLN 186 Ca 0.12 -0.12 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 3ij6 h GLN 186 Cb 0.19 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.80 3ij6 h GLN 186 CO -0.01 0.69 0.02 -0.07 -0.67 0.00 0.00 178.83 178.79 3ij6 h LEU 187 N 0.84 0.08 0.08 1.46 3.38 -0.74 -2.30 115.31 118.12 3ij6 h LEU 187 Ca 0.21 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 58.03 3ij6 h LEU 187 Cb 0.09 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3ij6 h LEU 187 CO -0.03 0.22 -0.14 0.58 0.09 0.00 0.00 178.44 179.16 3ij6 h VAL 188 N -0.06 0.67 0.00 1.22 2.07 -0.76 -2.69 116.25 116.70 3ij6 h VAL 188 Ca 0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 3ij6 h VAL 188 Cb 0.16 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 3ij6 h VAL 188 CO -0.00 0.00 0.00 0.06 0.02 0.00 0.00 177.57 177.65 3ij6 h GLN 189 N -0.28 0.00 -0.56 1.57 3.07 -1.04 -1.75 115.11 116.12 3ij6 h GLN 189 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.76 3ij6 h GLN 189 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.85 3ij6 h GLN 189 CO -0.08 0.00 0.00 -1.13 0.09 0.00 0.00 178.83 177.71 3ij6 n SER 190 N -2.89 2.30 -2.07 0.06 3.41 -0.87 -4.93 113.62 108.63 3ij6 n SER 190 Ca 0.01 -2.19 -0.17 0.00 -0.26 0.00 0.00 58.87 56.27 3ij6 n SER 190 Cb 0.30 -0.39 0.01 0.00 -0.26 0.00 0.00 64.21 63.87 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 0.34 -4.94 0.00 4.04 8.00 -0.66 -4.94 116.55 118.39 3ij6 n ASP 191 Ca 0.11 -0.10 -0.12 0.00 0.71 0.00 0.00 54.79 55.39 3ij6 n ASP 191 Cb 0.45 -3.94 -0.06 0.00 -0.02 0.00 0.00 41.12 37.54 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 -0.46 0.08 -0.19 0.64 5.85 -1.64 -1.54 115.31 118.06 3ij6 h LEU 192 Ca -0.40 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.22 3ij6 h LEU 192 Cb 1.28 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.29 3ij6 h LEU 192 CO 0.45 0.16 -0.08 0.49 -0.34 0.00 0.00 178.44 179.12 3ij6 n PHE 193 N -4.99 0.00 0.09 1.25 3.72 -1.26 -0.37 117.46 115.90 3ij6 n PHE 193 Ca -0.06 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.12 3ij6 n PHE 193 Cb 0.08 -0.18 -0.14 0.00 -0.94 0.00 0.00 39.48 38.29 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 0.47 0.46 0.13 -1.08 1.08 -1.79 -3.00 115.11 111.38 3ij6 h GLN 194 Ca 0.00 -0.72 -0.29 0.00 -1.45 0.00 0.00 58.65 56.19 3ij6 h GLN 194 Cb 0.32 0.26 0.02 0.00 -0.05 0.00 0.00 27.48 28.03 3ij6 h GLN 194 CO 0.00 1.33 -1.25 -0.44 -0.95 0.00 0.00 178.83 177.52 3ij6 h ASP 195 N -0.04 0.71 -2.27 1.46 3.32 -1.22 -3.41 116.42 114.98 3ij6 h ASP 195 Ca -0.19 -0.69 -0.58 0.00 0.02 0.00 0.00 57.03 55.59 3ij6 h ASP 195 Cb 1.85 -0.23 -0.40 0.00 0.22 0.00 0.00 39.33 40.77 3ij6 h ASP 195 CO 0.21 1.51 -0.89 -1.22 -1.72 0.00 0.00 179.24 177.13 3ij6 n TYR 196 N -3.71 0.87 0.22 4.55 4.01 0.51 -4.97 117.16 118.65 3ij6 n TYR 196 Ca -0.12 -3.73 0.16 0.00 -0.16 0.00 0.00 57.90 54.05 3ij6 n TYR 196 Cb 1.00 -0.29 0.82 0.00 -0.31 0.00 0.00 39.34 40.56 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 4.61 0.00 -0.01 -0.72 0.13 -1.74 -2.72 132.00 131.55 3ij6 h PRO 197 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3ij6 h PRO 197 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3ij6 h PRO 197 CO 0.56 0.00 -0.14 0.27 -0.23 0.00 0.00 178.00 178.46 3ij6 n ASN 198 N -3.94 0.77 -4.74 1.44 6.94 -1.26 -4.91 115.26 109.56 3ij6 n ASN 198 Ca 0.00 -0.82 -0.42 0.00 -0.02 0.00 0.00 54.58 53.32 3ij6 n ASN 198 Cb 0.25 0.01 -0.02 0.00 -2.36 0.00 0.00 39.78 37.66 3ij6 n ASN 198 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3ij6 s LEU 199 N -2.40 4.36 -0.27 -4.53 2.96 -1.02 -4.98 118.68 112.80 3ij6 s LEU 199 Ca 0.30 2.88 -0.06 0.00 -0.22 0.00 0.00 54.13 57.03 3ij6 s LEU 199 Cb 0.20 -3.62 -0.00 0.00 0.50 0.00 0.00 46.19 43.26 3ij6 s LEU 199 CO 0.47 -0.90 0.05 -0.54 -1.32 0.00 0.00 176.35 174.10 3ij6 s LYS 200 N 0.02 3.29 -0.12 1.98 1.02 -1.26 -4.95 119.74 119.72 3ij6 s LYS 200 Ca 0.66 -0.71 0.03 0.00 0.02 0.00 0.00 55.97 55.97 3ij6 s LYS 200 Cb -0.47 -3.27 0.01 0.00 -0.52 0.00 0.00 37.83 33.57 3ij6 s LYS 200 CO 0.43 -0.32 -0.23 0.42 -0.92 0.00 0.00 175.35 174.72 3ij6 s ILE 201 N 1.52 2.05 -0.33 2.17 1.01 -1.26 -0.57 121.20 125.79 3ij6 s ILE 201 Ca 0.04 -0.99 -0.16 0.00 0.00 0.00 0.00 60.65 59.54 3ij6 s ILE 201 Cb -0.16 -1.79 -0.01 0.00 0.01 0.00 0.00 42.46 40.50 3ij6 s ILE 201 CO 0.01 0.55 0.39 -0.22 0.00 0.00 0.00 174.94 175.67 3ij6 s LEU 202 N 0.59 4.36 -0.24 2.97 2.96 0.26 -1.03 118.68 128.55 3ij6 s LEU 202 Ca -0.13 -0.11 -0.13 0.00 -0.22 0.00 0.00 54.13 53.54 3ij6 s LEU 202 Cb -0.17 -2.39 -0.04 0.00 0.50 0.00 0.00 46.19 44.09 3ij6 s LEU 202 CO 0.03 -0.34 0.29 -0.69 -1.32 0.00 0.00 176.35 174.33 3ij6 s VAL 203 N 2.09 5.26 0.54 1.68 1.01 0.11 0.05 120.40 131.14 3ij6 s VAL 203 Ca 0.13 0.44 -0.20 0.00 0.00 0.00 0.00 61.98 62.35 3ij6 s VAL 203 Cb -0.16 -3.62 -0.07 0.00 0.00 0.00 0.00 36.38 32.53 3ij6 s VAL 203 CO 0.12 0.26 1.02 1.57 0.00 0.00 0.00 175.10 178.06 3ij6 n HIS 204 N 4.70 1.07 -3.11 5.22 -0.00 -1.14 -1.57 115.22 120.39 3ij6 n HIS 204 Ca -0.11 0.47 -0.14 0.00 0.46 0.00 0.00 57.72 58.40 3ij6 n HIS 204 Cb 0.51 -2.19 0.06 0.00 -0.12 0.00 0.00 29.99 28.26 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 -1.28 -1.74 -2.39 1.57 8.25 -1.26 -3.69 115.22 114.69 3ij6 n HIS 205 Ca 0.12 0.69 -0.18 0.00 -0.26 0.00 0.00 57.72 58.08 3ij6 n HIS 205 Cb 0.45 -4.07 -0.01 0.00 1.12 0.00 0.00 29.99 27.47 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 -3.61 -0.66 -0.89 -1.41 0.00 -0.83 -1.24 120.51 111.87 3ij6 n ALA 206 Ca -0.13 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3ij6 n ALA 206 Cb 0.59 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 18.07 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 -0.93 0.53 7.00 0.00 0.00 -1.24 -4.74 105.19 105.81 3ij6 n GLY 207 Ca -0.21 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.61 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 0.68 0.00 1.29 4.61 0.00 -0.37 -2.35 120.51 124.37 3ij6 n ALA 208 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 3ij6 n ALA 208 Cb 0.00 0.00 0.49 0.00 0.00 0.00 0.00 19.45 19.94 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 10.24 0.63 0.03 0.00 2.81 -1.26 -4.43 117.12 125.14 3ij6 n MET 209 Ca 0.00 -0.29 -0.13 0.00 -1.81 0.00 0.00 57.70 55.47 3ij6 n MET 209 Cb 0.00 -1.49 -0.09 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 0.70 1.17 -0.99 2.03 2.07 -1.82 -2.52 116.25 116.90 3ij6 h VAL 210 Ca 0.00 -0.78 0.06 0.00 0.82 0.00 0.00 66.70 66.80 3ij6 h VAL 210 Cb 0.43 1.68 -0.06 0.00 -1.52 0.00 0.00 31.29 31.82 3ij6 h VAL 210 CO 0.00 0.20 0.64 -0.65 0.02 0.00 0.00 177.57 177.77 3ij6 h PRO 211 N -0.42 1.15 -0.12 1.57 0.11 -1.78 -0.23 132.00 132.28 3ij6 h PRO 211 Ca -0.01 -0.07 -0.14 0.00 0.11 0.00 0.00 66.00 65.89 3ij6 h PRO 211 Cb 0.38 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 31.22 3ij6 h PRO 211 CO 0.01 0.76 -0.55 0.35 -0.21 0.00 0.00 178.00 178.36 3ij6 h PHE 212 N 1.18 0.44 -0.29 0.65 3.57 -1.84 -3.32 116.94 117.34 3ij6 h PHE 212 Ca 0.42 -0.16 -0.12 0.00 3.53 0.00 0.00 57.97 61.65 3ij6 h PHE 212 Cb 0.12 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 38.71 3ij6 h PHE 212 CO -0.00 0.83 -0.07 1.19 -2.23 0.00 0.00 178.31 178.02 3ij6 n PHE 213 N -3.93 0.93 0.27 0.41 3.72 -0.95 -4.62 117.46 113.29 3ij6 n PHE 213 Ca -0.02 -1.37 0.11 0.00 -0.05 0.00 0.00 57.45 56.11 3ij6 n PHE 213 Cb 0.59 -0.41 0.75 0.00 -0.94 0.00 0.00 39.48 39.46 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 1.13 0.00 -0.62 4.37 4.64 -1.14 -2.40 113.55 119.53 3ij6 h SER 214 Ca 0.14 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.42 3ij6 h SER 214 Cb 1.53 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.59 3ij6 h SER 214 CO 0.30 0.00 0.24 1.23 -0.87 0.00 0.00 176.83 177.74 3ij6 h GLY 215 N 0.00 1.03 0.60 -0.77 0.00 -1.87 -1.69 103.07 100.37 3ij6 h GLY 215 Ca 0.01 -0.55 -0.00 0.00 0.00 0.00 0.00 47.33 46.79 3ij6 h GLY 215 CO -0.00 0.52 -0.01 3.21 0.00 0.00 0.00 176.54 180.26 3ij6 h ARG 216 N 0.94 -0.03 -0.55 4.80 3.08 -1.80 -3.03 114.38 117.79 3ij6 h ARG 216 Ca 0.22 0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.38 3ij6 h ARG 216 Cb 0.21 0.01 -0.11 0.00 0.08 0.00 0.00 29.97 30.16 3ij6 h ARG 216 CO -0.02 0.37 -0.15 0.82 -1.07 0.00 0.00 179.97 179.92 3ij6 h ILE 217 N -0.43 0.43 0.00 2.04 2.04 -1.38 0.14 117.51 120.34 3ij6 h ILE 217 Ca -0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 3ij6 h ILE 217 Cb 0.41 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 36.92 3ij6 h ILE 217 CO 0.01 0.00 -0.05 0.44 0.00 0.00 0.00 178.15 178.54 3ij6 h ASP 218 N -0.02 0.00 0.00 1.72 3.32 -1.35 -0.59 116.42 119.49 3ij6 h ASP 218 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 3ij6 h ASP 218 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 3ij6 h ASP 218 CO -0.57 0.05 -1.31 1.41 -1.72 0.00 0.00 179.24 177.10 3ij6 n HIS 219 N -4.13 0.00 -0.10 4.55 8.25 -0.66 -4.54 115.22 118.59 3ij6 n HIS 219 Ca -0.03 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.21 3ij6 n HIS 219 Cb 0.14 -0.20 -0.12 0.00 1.12 0.00 0.00 29.99 30.92 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 -1.76 1.57 -3.30 1.59 5.41 0.40 -4.99 119.36 118.28 3ij6 n ILE 220 Ca -0.00 -0.48 -0.28 0.00 1.00 0.00 0.00 62.75 62.99 3ij6 n ILE 220 Cb 0.36 -1.68 -0.03 0.00 -0.71 0.00 0.00 39.64 37.58 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 -7.05 4.03 0.94 1.39 1.02 -0.24 -5.09 118.68 113.69 3ij6 s LEU 221 Ca -0.33 0.72 -0.12 0.00 0.02 0.00 0.00 54.13 54.42 3ij6 s LEU 221 Cb 0.10 -3.55 0.16 0.00 0.02 0.00 0.00 46.19 42.91 3ij6 s LEU 221 CO 0.61 -0.22 1.12 1.51 0.02 0.00 0.00 176.35 179.38 3ij6 s ASP 222 N -3.24 3.17 0.16 2.29 -4.77 -1.26 -4.69 116.67 108.33 3ij6 s ASP 222 Ca 0.44 1.05 -0.23 0.00 -3.30 0.00 0.00 52.55 50.51 3ij6 s ASP 222 Cb -0.11 -1.67 0.06 0.00 -1.09 0.00 0.00 42.92 40.11 3ij6 s ASP 222 CO 0.31 -2.78 1.59 -0.08 0.70 0.00 0.00 175.17 174.91 3ij6 h GLU 223 N -1.65 -0.25 -0.71 2.11 4.57 -1.97 -0.58 114.58 116.10 3ij6 h GLU 223 Ca -0.52 0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 57.65 3ij6 h GLU 223 Cb 1.33 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.94 3ij6 h GLU 223 CO 0.60 -0.17 0.35 0.87 -1.18 0.00 0.00 179.01 179.48 3ij6 h LYS 224 N -0.26 1.02 0.13 1.92 1.57 -1.99 -2.20 116.57 116.76 3ij6 h LYS 224 Ca 0.17 -0.15 -0.28 0.00 -1.87 0.00 0.00 60.65 58.53 3ij6 h LYS 224 Cb 0.55 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.68 3ij6 h LYS 224 CO -0.55 0.80 -1.27 0.45 -0.57 0.00 0.00 179.45 178.31 3ij6 h HIS 225 N 1.00 0.50 -0.45 -1.35 3.86 -1.87 -2.77 115.15 114.06 3ij6 h HIS 225 Ca 0.25 -0.36 0.02 0.00 -1.16 0.00 0.00 60.37 59.11 3ij6 h HIS 225 Cb 0.11 -0.02 -0.03 0.00 1.06 0.00 0.00 27.41 28.53 3ij6 h HIS 225 CO 0.01 1.29 0.27 0.00 0.86 0.00 0.00 177.93 180.36 3ij6 h ALA 226 N 0.57 0.57 0.00 2.45 0.00 -1.04 -2.73 119.26 119.07 3ij6 h ALA 226 Ca -0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3ij6 h ALA 226 Cb 1.98 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.64 3ij6 h ALA 226 CO 0.20 -0.04 0.00 1.96 0.00 0.00 0.00 179.25 181.37 3ij6 h GLN 227 N 0.54 0.00 0.00 0.00 1.08 -1.44 -3.00 115.11 112.29 3ij6 h GLN 227 Ca 0.18 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.36 3ij6 h GLN 227 Cb 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3ij6 h GLN 227 CO -0.08 0.00 -0.10 -0.44 -0.95 0.00 0.00 178.83 177.27 3ij6 h ASP 228 N 0.00 0.00 0.66 1.46 3.32 -1.18 -2.42 116.42 118.27 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 0.62 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.17 3ij6 h ASP 228 CO 0.00 0.10 -0.01 -0.26 -1.72 0.00 0.00 179.24 177.34 3ij6 h PHE 229 N 0.00 0.00 0.00 4.55 0.04 -1.58 -2.72 116.94 117.24 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 0.47 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.62 3ij6 h PHE 229 CO 0.00 0.01 -0.02 1.63 -0.60 0.00 0.00 178.31 179.33 3ij6 n LYS 230 N -3.13 0.03 0.19 1.51 5.02 -0.91 -3.71 118.16 117.16 3ij6 n LYS 230 Ca -0.01 0.02 0.07 0.00 -2.02 0.00 0.00 58.31 56.38 3ij6 n LYS 230 Cb 0.23 -1.53 0.31 0.00 -0.02 0.00 0.00 35.03 34.02 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 0.00 0.00 -7.02 1.97 1.79 -1.63 -3.46 116.57 108.22 3ij6 h LYS 231 Ca 0.00 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.94 3ij6 h LYS 231 Cb 0.53 0.00 0.10 0.00 -1.58 0.00 0.00 32.23 31.27 3ij6 h LYS 231 CO 0.00 0.33 0.55 -0.06 -1.08 0.00 0.00 179.45 179.19 3ij6 s PHE 232 N -3.45 2.60 0.07 -1.35 0.08 -1.24 -4.76 117.98 109.93 3ij6 s PHE 232 Ca 0.01 1.45 -0.03 0.00 0.12 0.00 0.00 56.93 58.49 3ij6 s PHE 232 Cb 0.10 -3.60 -0.05 0.00 -0.57 0.00 0.00 43.02 38.90 3ij6 s PHE 232 CO 0.68 -2.19 0.26 0.71 -0.10 0.00 0.00 175.22 174.58 3ij6 s TYR 233 N -1.41 3.52 0.11 0.36 2.02 -0.19 -4.95 117.35 116.81 3ij6 s TYR 233 Ca 0.66 0.39 0.07 0.00 -0.37 0.00 0.00 57.07 57.83 3ij6 s TYR 233 Cb -0.35 -1.87 -0.03 0.00 -0.40 0.00 0.00 41.96 39.31 3ij6 s TYR 233 CO 0.42 0.56 -0.17 0.14 -1.57 0.00 0.00 175.55 174.93 3ij6 s VAL 234 N -1.50 1.48 0.35 0.71 -7.23 0.13 0.07 120.40 114.41 3ij6 s VAL 234 Ca 0.35 -1.57 -0.01 0.00 -1.81 0.00 0.00 61.98 58.94 3ij6 s VAL 234 Cb -0.13 -1.46 0.07 0.00 0.56 0.00 0.00 36.38 35.42 3ij6 s VAL 234 CO 0.24 -0.22 0.47 -0.90 -0.31 0.00 0.00 175.10 174.39 3ij6 n ASP 235 N 0.91 0.54 -0.92 4.85 5.68 -0.61 -0.45 116.55 126.55 3ij6 n ASP 235 Ca -0.18 -1.48 0.08 0.00 -0.50 0.00 0.00 54.79 52.71 3ij6 n ASP 235 Cb 0.55 -0.32 0.26 0.00 -1.14 0.00 0.00 41.12 40.47 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 -2.15 2.31 -1.82 2.12 -2.24 -0.52 -1.96 114.28 110.02 3ij6 n THR 236 Ca 0.07 -1.91 -0.42 0.00 -2.27 0.00 0.00 64.05 59.52 3ij6 n THR 236 Cb 0.27 -0.26 -0.01 0.00 -2.10 0.00 0.00 70.33 68.23 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 -0.53 4.76 -1.55 6.98 0.00 -1.13 -4.29 120.51 124.75 3ij6 n ALA 237 Ca 0.22 -3.77 0.05 0.00 0.00 0.00 0.00 53.44 49.94 3ij6 n ALA 237 Cb 0.91 -3.56 0.07 0.00 0.00 0.00 0.00 19.45 16.87 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 5.55 0.97 -3.53 0.00 -5.35 -1.26 -4.03 119.36 111.70 3ij6 n ILE 238 Ca 0.51 -1.20 -0.20 0.00 -0.27 0.00 0.00 62.75 61.59 3ij6 n ILE 238 Cb 0.41 0.14 0.08 0.00 -1.74 0.00 0.00 39.64 38.52 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 -0.71 -3.68 0.00 7.28 4.77 -1.26 -4.62 117.00 118.78 3ij6 n LEU 239 Ca 0.08 -0.63 0.00 0.00 -0.03 0.00 0.00 56.01 55.44 3ij6 n LEU 239 Cb 0.68 -3.02 0.00 0.00 -2.33 0.00 0.00 43.42 38.75 3ij6 n LEU 239 CO 0.00 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 3ij6 n GLY 240 N -1.47 0.50 3.03 -0.72 0.00 -1.26 -4.88 105.19 100.39 3ij6 n GLY 240 Ca -0.19 -1.47 -0.05 0.00 0.00 0.00 0.00 46.02 44.31 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 -7.66 0.03 1.61 2.85 -1.26 -4.74 115.26 106.09 3ij6 n ASN 241 Ca 0.00 0.11 -0.10 0.00 -0.11 0.00 0.00 54.58 54.48 3ij6 n ASN 241 Cb 0.00 -5.06 -0.04 0.00 1.24 0.00 0.00 39.78 35.92 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 1.06 0.59 0.00 -0.44 2.02 -1.97 -1.94 112.91 112.23 3ij6 h THR 242 Ca -0.05 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 3ij6 h THR 242 Cb 1.03 0.59 -0.00 0.00 -1.74 0.00 0.00 68.15 68.03 3ij6 h THR 242 CO 0.26 0.00 -0.11 1.55 0.37 0.00 0.00 175.52 177.59 3ij6 h PRO 243 N -0.24 0.00 -0.18 6.66 0.13 -1.92 -0.51 132.00 135.94 3ij6 h PRO 243 Ca 0.07 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 65.00 3ij6 h PRO 243 Cb 0.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.47 3ij6 h PRO 243 CO -0.20 0.11 -0.69 0.00 -0.23 0.00 0.00 178.00 177.00 3ij6 h ALA 244 N 1.89 0.44 -0.46 -0.56 0.00 -1.84 -0.89 119.26 117.83 3ij6 h ALA 244 Ca -0.00 -0.57 -0.04 0.00 0.00 0.00 0.00 54.91 54.30 3ij6 h ALA 244 Cb 0.29 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3ij6 h ALA 244 CO 0.01 0.70 0.12 -0.07 0.00 0.00 0.00 179.25 180.01 3ij6 h LEU 245 N 0.53 0.64 -0.16 0.00 3.38 -0.81 -1.57 115.31 117.32 3ij6 h LEU 245 Ca -0.02 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 3ij6 h LEU 245 Cb 1.29 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 3ij6 h LEU 245 CO 0.14 0.64 0.03 -0.61 0.09 0.00 0.00 178.44 178.72 3ij6 h GLN 246 N 0.68 0.27 -0.58 1.13 5.75 -0.92 -2.18 115.11 119.26 3ij6 h GLN 246 Ca 0.15 -0.07 0.12 0.00 -0.15 0.00 0.00 58.65 58.70 3ij6 h GLN 246 Cb 0.25 -0.03 -0.09 0.00 1.07 0.00 0.00 27.48 28.68 3ij6 h GLN 246 CO -0.00 0.44 0.03 1.25 -2.65 0.00 0.00 178.83 177.90 3ij6 h LEU 247 N 0.05 -0.20 -0.99 -2.39 5.85 -1.07 -0.03 115.31 116.53 3ij6 h LEU 247 Ca 0.05 0.13 0.08 0.00 0.84 0.00 0.00 57.88 58.98 3ij6 h LEU 247 Cb 0.30 0.23 -0.07 0.00 0.37 0.00 0.00 40.66 41.49 3ij6 h LEU 247 CO 0.00 -0.08 0.63 0.00 -0.34 0.00 0.00 178.44 178.66 3ij6 h ALA 248 N 1.51 1.40 -0.50 1.25 0.00 -1.12 -1.52 119.26 120.27 3ij6 h ALA 248 Ca 0.30 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.08 3ij6 h ALA 248 Cb 0.47 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3ij6 h ALA 248 CO -0.47 0.38 -0.14 0.82 0.00 0.00 0.00 179.25 179.84 3ij6 h ILE 249 N 1.12 1.27 -0.73 0.00 2.04 -0.73 -0.19 117.51 120.28 3ij6 h ILE 249 Ca 0.44 -1.29 0.02 0.00 1.00 0.00 0.00 64.86 65.03 3ij6 h ILE 249 Cb 0.24 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.34 3ij6 h ILE 249 CO -0.19 0.45 0.48 0.44 0.00 0.00 0.00 178.15 179.33 3ij6 h ASP 250 N 0.83 0.80 0.00 1.72 3.32 -0.31 0.13 116.42 122.92 3ij6 h ASP 250 Ca 0.12 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.13 3ij6 h ASP 250 Cb 0.71 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 40.06 3ij6 h ASP 250 CO 0.05 0.56 -0.19 0.22 -1.72 0.00 0.00 179.24 178.16 3ij6 h TYR 251 N 0.94 0.00 0.00 4.55 3.20 -1.16 -3.40 116.97 121.10 3ij6 h TYR 251 Ca 0.28 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 62.04 3ij6 h TYR 251 Cb -0.02 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 3ij6 h TYR 251 CO -0.00 0.70 -0.64 1.88 -1.64 0.00 0.00 178.16 178.46 3ij6 h TYR 252 N -1.00 0.00 0.00 -3.82 0.05 -1.05 -3.48 116.97 107.67 3ij6 h TYR 252 Ca -0.04 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.74 3ij6 h TYR 252 Cb 0.71 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.45 3ij6 h TYR 252 CO 0.14 0.51 0.00 0.41 -1.05 0.00 0.00 178.16 178.17 3ij6 n GLY 253 N 1.25 -0.67 0.32 3.88 0.00 0.45 -4.52 105.19 105.90 3ij6 n GLY 253 Ca 0.00 -1.52 0.10 0.00 0.00 0.00 0.00 46.02 44.61 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 0.96 0.00 -0.61 6.09 -1.93 -2.70 117.51 119.32 3ij6 h ILE 254 Ca 0.00 -0.09 0.00 0.00 -1.37 0.00 0.00 64.86 63.40 3ij6 h ILE 254 Cb 0.00 0.68 0.00 0.00 0.47 0.00 0.00 36.82 37.97 3ij6 h ILE 254 CO 0.00 0.05 0.00 0.47 -3.07 0.00 0.00 178.15 175.60 3ij6 n ASP 255 N -4.48 0.00 -0.53 2.19 8.00 -1.26 -3.11 116.55 117.36 3ij6 n ASP 255 Ca 0.04 -0.29 0.06 0.00 0.71 0.00 0.00 54.79 55.32 3ij6 n ASP 255 Cb 0.23 -0.21 0.07 0.00 -0.02 0.00 0.00 41.12 41.19 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 -1.21 0.06 -3.96 1.24 8.25 -1.02 -4.89 115.22 113.69 3ij6 n HIS 256 Ca 0.15 -0.06 -0.35 0.00 -0.26 0.00 0.00 57.72 57.20 3ij6 n HIS 256 Cb 0.18 -0.00 -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 -1.04 3.12 -0.03 1.59 1.01 -1.18 0.20 120.40 124.07 3ij6 s VAL 257 Ca 0.16 -0.58 0.07 0.00 0.00 0.00 0.00 61.98 61.63 3ij6 s VAL 257 Cb 0.11 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 3ij6 s VAL 257 CO 0.16 0.45 -0.24 -0.76 0.00 0.00 0.00 175.10 174.70 3ij6 s LEU 258 N 1.43 2.05 0.19 3.92 1.02 0.40 -4.20 118.68 123.49 3ij6 s LEU 258 Ca 0.05 -0.46 -0.33 0.00 0.02 0.00 0.00 54.13 53.41 3ij6 s LEU 258 Cb -0.14 -1.29 -0.14 0.00 0.02 0.00 0.00 46.19 44.65 3ij6 s LEU 258 CO -0.05 0.28 1.52 0.33 0.02 0.00 0.00 176.35 178.45 3ij6 n PHE 259 N 2.65 2.27 -3.58 0.29 7.35 0.76 -1.43 117.46 125.77 3ij6 n PHE 259 Ca -0.16 0.32 -0.13 0.00 -0.76 0.00 0.00 57.45 56.72 3ij6 n PHE 259 Cb 0.52 -2.52 -0.06 0.00 0.35 0.00 0.00 39.48 37.77 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 0.68 -0.38 0.00 7.13 0.00 -1.26 -1.27 107.32 112.21 3ij6 s GLY 260 Ca 0.74 1.95 0.00 0.00 0.00 0.00 0.00 44.72 47.42 3ij6 s GLY 260 CO 0.42 1.30 0.00 -1.30 0.00 0.00 0.00 173.10 173.52 3ij6 n THR 261 N 1.42 0.00 -2.27 0.90 -2.24 -1.22 -2.82 114.28 108.05 3ij6 n THR 261 Ca -0.14 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.52 3ij6 n THR 261 Cb 0.57 0.16 -0.00 0.00 -2.10 0.00 0.00 70.33 68.95 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 -1.34 -3.77 -4.77 3.42 2.03 -0.48 -4.39 116.55 107.25 3ij6 n ASP 262 Ca 0.00 -0.03 -0.40 0.00 0.52 0.00 0.00 54.79 54.89 3ij6 n ASP 262 Cb 0.08 -2.96 0.01 0.00 -0.72 0.00 0.00 41.12 37.54 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 -2.61 3.21 -1.81 -1.67 0.00 -1.25 -1.30 121.76 116.32 3ij6 s ALA 263 Ca 0.02 1.37 0.15 0.00 0.00 0.00 0.00 51.96 53.50 3ij6 s ALA 263 Cb -0.01 -3.55 0.47 0.00 0.00 0.00 0.00 23.12 20.03 3ij6 s ALA 263 CO 0.02 -1.08 1.38 -0.35 0.00 0.00 0.00 175.76 175.73 3ij6 n PRO 264 N -0.17 2.37 -1.03 0.00 -0.04 -1.26 0.36 135.00 135.23 3ij6 n PRO 264 Ca 0.05 -1.89 -0.30 0.00 -0.04 0.00 0.00 63.50 61.32 3ij6 n PRO 264 Cb 0.43 -1.48 0.14 0.00 -0.04 0.00 0.00 33.50 32.56 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 -1.42 2.12 0.00 0.54 0.08 -0.42 -2.02 117.98 116.86 3ij6 s PHE 265 Ca 0.35 1.46 0.00 0.00 0.12 0.00 0.00 56.93 58.86 3ij6 s PHE 265 Cb 0.19 -3.16 0.00 0.00 -0.57 0.00 0.00 43.02 39.48 3ij6 s PHE 265 CO 0.22 -2.48 0.00 0.00 -0.10 0.00 0.00 175.22 172.85 3ij6 n ALA 266 N -3.98 0.00 -3.64 5.36 0.00 -1.26 -4.22 120.51 112.77 3ij6 n ALA 266 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.17 3ij6 n ALA 266 Cb 0.54 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.85 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 3.02 0.33 0.00 1.01 -1.26 -5.03 120.40 118.48 3ij6 s VAL 267 Ca 0.00 -1.05 -0.26 0.00 0.00 0.00 0.00 61.98 60.67 3ij6 s VAL 267 Cb 0.00 -2.57 -0.10 0.00 0.00 0.00 0.00 36.38 33.71 3ij6 s VAL 267 CO 0.00 0.13 0.96 -0.04 0.00 0.00 0.00 175.10 176.15 3ij6 s MET 268 N 1.33 4.54 0.05 2.72 1.00 -1.26 0.09 119.30 127.77 3ij6 s MET 268 Ca -0.00 1.37 0.24 0.00 0.00 0.00 0.00 55.69 57.29 3ij6 s MET 268 Cb -0.17 -2.79 0.30 0.00 0.00 0.00 0.00 34.83 32.18 3ij6 s MET 268 CO -0.03 0.23 1.26 -0.35 0.00 0.00 0.00 175.02 176.13 3ij6 n PRO 269 N 0.51 0.17 -0.35 2.03 -0.04 -1.26 -4.81 135.00 131.25 3ij6 n PRO 269 Ca 0.02 0.03 0.03 0.00 -0.04 0.00 0.00 63.50 63.54 3ij6 n PRO 269 Cb 0.50 -1.58 0.05 0.00 -0.04 0.00 0.00 33.50 32.42 3ij6 n PRO 269 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3ij6 n SER 270 N -1.82 0.80 0.00 3.54 7.64 -1.10 -4.52 113.62 118.16 3ij6 n SER 270 Ca 0.04 -2.37 0.00 0.00 1.01 0.00 0.00 58.87 57.55 3ij6 n SER 270 Cb 0.40 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 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 -0.49 -0.06 2.12 0.23 0.00 0.11 -4.56 105.19 102.55 3ij6 n GLY 271 Ca 0.05 -1.93 -0.24 0.00 0.00 0.00 0.00 46.02 43.90 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 0.40 5.52 -0.21 4.61 0.00 -1.26 -4.62 120.51 124.96 3ij6 n ALA 272 Ca 0.00 -2.69 0.01 0.00 0.00 0.00 0.00 53.44 50.76 3ij6 n ALA 272 Cb 0.00 -1.50 0.11 0.00 0.00 0.00 0.00 19.45 18.06 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 1.27 -0.14 0.15 0.00 1.82 -1.89 -2.34 116.42 115.29 3ij6 h ASP 273 Ca 0.54 0.14 -0.01 0.00 -0.39 0.00 0.00 57.03 57.31 3ij6 h ASP 273 Cb 1.88 0.22 0.00 0.00 0.68 0.00 0.00 39.33 42.11 3ij6 h ASP 273 CO 1.13 -0.06 -0.07 -0.61 -1.61 0.00 0.00 179.24 178.01 3ij6 h GLN 274 N 0.19 -0.19 -0.04 0.28 4.15 -1.90 -1.49 115.11 116.11 3ij6 h GLN 274 Ca 0.33 0.01 -0.09 0.00 0.77 0.00 0.00 58.65 59.67 3ij6 h GLN 274 Cb 0.53 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.25 3ij6 h GLN 274 CO -0.48 0.10 -0.41 -0.84 -1.93 0.00 0.00 178.83 175.27 3ij6 h ILE 275 N -0.49 1.30 0.02 2.39 3.07 -1.91 -1.89 117.51 120.01 3ij6 h ILE 275 Ca -0.02 -1.47 -0.20 0.00 1.55 0.00 0.00 64.86 64.72 3ij6 h ILE 275 Cb 0.38 1.74 0.02 0.00 -0.27 0.00 0.00 36.82 38.68 3ij6 h ILE 275 CO 0.03 0.43 -0.80 0.40 -1.05 0.00 0.00 178.15 177.16 3ij6 h ILE 276 N 0.08 1.37 -0.61 0.16 2.04 -1.43 -2.39 117.51 116.73 3ij6 h ILE 276 Ca 0.01 -2.19 0.02 0.00 1.00 0.00 0.00 64.86 63.70 3ij6 h ILE 276 Cb 0.77 2.57 -0.04 0.00 -0.74 0.00 0.00 36.82 39.38 3ij6 h ILE 276 CO 0.06 0.65 0.38 0.74 0.00 0.00 0.00 178.15 179.98 3ij6 h THR 277 N 0.07 1.09 -0.96 -0.27 2.02 -1.19 -1.00 112.91 112.67 3ij6 h THR 277 Ca -0.10 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.81 3ij6 h THR 277 Cb 1.50 0.26 -0.05 0.00 -1.74 0.00 0.00 68.15 68.13 3ij6 h THR 277 CO 0.16 0.14 0.61 -0.61 0.37 0.00 0.00 175.52 176.18 3ij6 h GLN 278 N 0.76 1.29 -0.03 6.66 5.75 -1.40 -1.41 115.11 126.73 3ij6 h GLN 278 Ca 0.24 -0.10 -0.13 0.00 -0.15 0.00 0.00 58.65 58.51 3ij6 h GLN 278 Cb -0.01 -0.28 -0.01 0.00 1.07 0.00 0.00 27.48 28.25 3ij6 h GLN 278 CO -0.09 0.88 -0.59 0.00 -2.65 0.00 0.00 178.83 176.38 3ij6 h ALA 279 N 1.35 0.95 -0.07 3.38 0.00 -0.81 -1.06 119.26 123.00 3ij6 h ALA 279 Ca 0.35 -0.53 -0.23 0.00 0.00 0.00 0.00 54.91 54.50 3ij6 h ALA 279 Cb -0.10 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.61 3ij6 h ALA 279 CO -0.07 0.73 -0.85 0.82 0.00 0.00 0.00 179.25 179.88 3ij6 h ILE 280 N 0.08 1.30 -0.01 0.00 2.04 -1.10 -3.24 117.51 116.59 3ij6 h ILE 280 Ca -0.01 -2.08 -0.04 0.00 1.00 0.00 0.00 64.86 63.74 3ij6 h ILE 280 Cb 1.06 2.22 -0.01 0.00 -0.74 0.00 0.00 36.82 39.35 3ij6 h ILE 280 CO 0.08 0.64 -0.19 0.78 0.00 0.00 0.00 178.15 179.47 3ij6 h ASN 281 N 0.39 0.01 0.25 1.72 2.35 -1.08 -2.50 115.58 116.72 3ij6 h ASN 281 Ca -0.09 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 3ij6 h ASN 281 Cb 1.50 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.86 3ij6 h ASN 281 CO 0.17 0.20 0.00 0.47 -1.65 0.00 0.00 177.43 176.62 3ij6 n ASP 282 N -4.31 0.00 -4.76 5.81 8.00 -0.42 -4.87 116.55 116.00 3ij6 n ASP 282 Ca -0.02 -0.56 -0.40 0.00 0.71 0.00 0.00 54.79 54.51 3ij6 n ASP 282 Cb 0.26 -0.13 -0.03 0.00 -0.02 0.00 0.00 41.12 41.19 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 -2.26 4.46 -1.07 0.64 1.43 -0.94 -4.94 118.68 116.00 3ij6 s LEU 283 Ca 0.37 2.43 -0.07 0.00 -1.03 0.00 0.00 54.13 55.83 3ij6 s LEU 283 Cb 0.20 -3.69 -0.05 0.00 0.03 0.00 0.00 46.19 42.68 3ij6 s LEU 283 CO 0.39 -0.35 2.92 0.41 0.23 0.00 0.00 176.35 179.94 3ij6 n THR 284 N 0.90 4.18 -4.50 5.49 -1.04 -1.26 -4.87 114.28 113.18 3ij6 n THR 284 Ca -0.00 -2.89 -0.24 0.00 -2.04 0.00 0.00 64.05 58.88 3ij6 n THR 284 Cb 0.44 -2.21 -0.11 0.00 -1.82 0.00 0.00 70.33 66.63 3ij6 n THR 284 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 3ij6 s ILE 285 N 0.46 1.55 0.95 12.58 -4.36 -1.26 -5.16 121.20 125.97 3ij6 s ILE 285 Ca 0.64 -2.02 -0.12 0.00 -0.26 0.00 0.00 60.65 58.88 3ij6 s ILE 285 Cb 0.24 -2.81 0.16 0.00 1.25 0.00 0.00 42.46 41.30 3ij6 s ILE 285 CO -0.08 -0.05 1.10 -0.94 0.24 0.00 0.00 174.94 175.21 3ij6 s SER 286 N -3.56 3.04 0.21 4.36 1.04 -1.26 -4.87 113.70 112.66 3ij6 s SER 286 Ca 0.35 1.17 0.07 0.00 0.48 0.00 0.00 55.95 58.01 3ij6 s SER 286 Cb 0.08 -1.82 0.15 0.00 0.10 0.00 0.00 66.02 64.54 3ij6 s SER 286 CO 0.16 -2.87 1.49 0.44 0.98 0.00 0.00 173.24 173.44 3ij6 h ASP 287 N -1.71 0.12 -0.50 7.02 3.32 -1.98 -1.75 116.42 120.94 3ij6 h ASP 287 Ca -0.53 -0.09 0.01 0.00 0.02 0.00 0.00 57.03 56.45 3ij6 h ASP 287 Cb 1.32 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.81 3ij6 h ASP 287 CO 0.58 0.82 0.31 0.50 -1.72 0.00 0.00 179.24 179.74 3ij6 h LYS 288 N 0.06 0.62 -0.59 3.56 3.64 -1.99 -0.97 116.57 120.91 3ij6 h LYS 288 Ca -0.02 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.26 3ij6 h LYS 288 Cb 1.31 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.97 3ij6 h LYS 288 CO 0.10 0.41 0.11 -0.44 -2.27 0.00 0.00 179.45 177.36 3ij6 h ASP 289 N 0.64 0.93 -0.37 4.20 3.32 -1.88 -0.89 116.42 122.37 3ij6 h ASP 289 Ca 0.19 -0.25 -0.06 0.00 0.02 0.00 0.00 57.03 56.93 3ij6 h ASP 289 Cb -0.03 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 3ij6 h ASP 289 CO -0.07 0.95 0.03 0.11 -1.72 0.00 0.00 179.24 178.54 3ij6 h LYS 290 N 0.88 0.73 -0.28 3.56 1.57 -1.22 -2.35 116.57 119.45 3ij6 h LYS 290 Ca 0.18 -0.17 -0.13 0.00 -1.87 0.00 0.00 60.65 58.66 3ij6 h LYS 290 Cb 0.41 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 3ij6 h LYS 290 CO 0.01 0.72 -0.36 0.37 -0.57 0.00 0.00 179.45 179.62 3ij6 h GLN 291 N 0.69 0.63 0.09 3.15 4.15 -0.84 -0.14 115.11 122.84 3ij6 h GLN 291 Ca 0.14 -0.30 0.01 0.00 0.77 0.00 0.00 58.65 59.28 3ij6 h GLN 291 Cb 0.38 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.04 3ij6 h GLN 291 CO 0.01 0.89 -0.17 0.87 -1.93 0.00 0.00 178.83 178.50 3ij6 h LYS 292 N 0.53 -0.32 0.04 1.69 1.57 -0.96 0.10 116.57 119.22 3ij6 h LYS 292 Ca 0.05 0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.86 3ij6 h LYS 292 Cb 0.86 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.23 3ij6 h LYS 292 CO 0.07 -0.21 -0.06 0.82 -0.57 0.00 0.00 179.45 179.50 3ij6 h ILE 293 N -0.33 0.85 0.00 1.86 2.04 -1.19 -0.34 117.51 120.40 3ij6 h ILE 293 Ca 0.03 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.79 3ij6 h ILE 293 Cb 0.36 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 3ij6 h ILE 293 CO -0.10 0.00 -0.47 -0.26 0.00 0.00 0.00 178.15 177.31 3ij6 h PHE 294 N -0.13 0.00 0.00 1.37 0.04 -1.02 0.22 116.94 117.42 3ij6 h PHE 294 Ca 0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.78 3ij6 h PHE 294 Cb 0.14 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.29 3ij6 h PHE 294 CO -0.11 0.47 0.00 1.58 -0.60 0.00 0.00 178.31 179.65 3ij6 n HIS 295 N -3.85 -2.33 -0.17 -0.55 -0.00 0.21 -0.36 115.22 108.17 3ij6 n HIS 295 Ca -0.01 0.46 -0.08 0.00 0.46 0.00 0.00 57.72 58.54 3ij6 n HIS 295 Cb 0.51 0.80 0.06 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 0.96 -0.53 0.26 3.32 -0.73 -3.16 116.42 116.55 3ij6 h ASP 296 Ca 0.00 -0.29 -0.05 0.00 0.02 0.00 0.00 57.03 56.71 3ij6 h ASP 296 Cb 0.00 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.26 3ij6 h ASP 296 CO 0.00 1.05 0.17 0.78 -1.72 0.00 0.00 179.24 179.52 3ij6 h ASN 297 N 0.88 0.80 -0.38 6.45 2.35 -1.32 -2.00 115.58 122.36 3ij6 h ASN 297 Ca 0.15 -0.13 0.07 0.00 -0.55 0.00 0.00 56.30 55.83 3ij6 h ASN 297 Cb 0.61 -0.21 -0.06 0.00 0.05 0.00 0.00 38.32 38.71 3ij6 h ASN 297 CO 0.04 0.77 0.01 0.22 -1.65 0.00 0.00 177.43 176.81 3ij6 h TYR 298 N 0.84 -0.00 -0.13 1.19 3.20 -1.77 -0.99 116.97 119.31 3ij6 h TYR 298 Ca 0.19 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.95 3ij6 h TYR 298 Cb 0.26 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 3ij6 h TYR 298 CO 0.02 -0.06 -0.52 1.88 -1.64 0.00 0.00 178.16 177.84 3ij6 h TYR 299 N 0.11 0.43 -0.52 -3.82 0.05 -1.53 -2.07 116.97 109.63 3ij6 h TYR 299 Ca 0.19 -0.14 0.00 0.00 0.05 0.00 0.00 58.73 58.82 3ij6 h TYR 299 Cb 0.26 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 37.89 3ij6 h TYR 299 CO -0.25 0.80 0.33 0.77 -1.05 0.00 0.00 178.16 178.76 3ij6 h SER 300 N 0.27 0.60 -0.58 3.88 0.02 -1.25 -2.73 113.55 113.77 3ij6 h SER 300 Ca 0.01 -0.03 0.01 0.00 -0.84 0.00 0.00 61.79 60.94 3ij6 h SER 300 Cb 1.00 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.36 3ij6 h SER 300 CO 0.09 0.45 0.38 0.25 -1.14 0.00 0.00 176.83 176.86 3ij6 h LEU 301 N 0.70 0.65 -0.05 5.07 5.85 -0.61 -3.09 115.31 123.84 3ij6 h LEU 301 Ca 0.19 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.90 3ij6 h LEU 301 Cb -0.06 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.81 3ij6 h LEU 301 CO -0.04 0.47 -0.40 2.30 -0.34 0.00 0.00 178.44 180.43 3ij6 n ILE 302 N -4.70 0.00 -1.65 4.05 -5.35 -0.83 -4.68 119.36 106.20 3ij6 n ILE 302 Ca 0.04 -0.01 -0.45 0.00 -0.27 0.00 0.00 62.75 62.06 3ij6 n ILE 302 Cb 0.03 0.15 -0.03 0.00 -1.74 0.00 0.00 39.64 38.05 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 -1.42 1.87 0.00 6.28 5.02 -1.03 -4.96 118.16 123.93 3ij6 n LYS 303 Ca 0.07 0.67 0.07 0.00 -2.02 0.00 0.00 58.31 57.09 3ij6 n LYS 303 Cb 0.33 -2.27 0.06 0.00 -0.02 0.00 0.00 35.03 33.13 3ij6 n LYS 303 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97