#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j08 h LEU 3 N 0.00 0.13 -9.16 0.99 4.07 -2.00 -3.42 115.31 105.92 1j08 h LEU 3 Ca 0.00 -0.02 -0.67 0.00 0.08 0.00 0.00 57.88 57.27 1j08 h LEU 3 Cb 0.00 -0.03 -0.17 0.00 1.08 0.00 0.00 40.66 41.54 1j08 h LEU 3 CO 0.00 0.25 -0.63 -0.63 -1.08 0.00 0.00 178.44 176.35 1j08 s ILE 4 N -4.81 4.22 0.58 1.22 1.01 -1.26 -5.11 121.20 117.05 1j08 s ILE 4 Ca -0.05 -0.27 -0.11 0.00 0.00 0.00 0.00 60.65 60.22 1j08 s ILE 4 Cb 0.16 -2.79 -0.05 0.00 0.01 0.00 0.00 42.46 39.79 1j08 s ILE 4 CO 0.71 0.57 0.99 -0.94 0.00 0.00 0.00 174.94 176.27 1j08 s SER 5 N -0.51 6.31 0.26 3.58 1.04 -1.26 -4.89 113.70 118.23 1j08 s SER 5 Ca 0.09 1.38 -0.02 0.00 0.48 0.00 0.00 55.95 57.88 1j08 s SER 5 Cb -0.12 -2.45 0.46 0.00 0.10 0.00 0.00 66.02 64.01 1j08 s SER 5 CO 0.02 -0.78 1.82 -0.33 0.98 0.00 0.00 173.24 174.96 1j08 h GLU 6 N 0.00 0.87 -0.48 4.02 3.07 -1.99 -1.41 114.58 118.67 1j08 h GLU 6 Ca -0.45 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.36 1j08 h GLU 6 Cb 1.19 -0.20 -0.02 0.00 -0.84 0.00 0.00 28.75 28.88 1j08 h GLU 6 CO 0.62 0.58 0.31 0.93 -1.40 0.00 0.00 179.01 180.04 1j08 h GLU 7 N 0.90 0.64 -0.34 2.33 5.08 -1.99 -1.81 114.58 119.38 1j08 h GLU 7 Ca 0.44 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.70 1j08 h GLU 7 Cb 0.40 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1j08 h GLU 7 CO -0.25 0.44 0.01 -0.44 -1.00 0.00 0.00 179.01 177.77 1j08 h ASP 8 N 0.64 0.58 -0.98 1.42 3.32 -1.78 -0.87 116.42 118.76 1j08 h ASP 8 Ca 0.17 -0.30 0.08 0.00 0.02 0.00 0.00 57.03 57.01 1j08 h ASP 8 Cb -0.05 -0.16 -0.07 0.00 0.22 0.00 0.00 39.33 39.28 1j08 h ASP 8 CO -0.04 0.74 0.63 0.11 -1.72 0.00 0.00 179.24 178.96 1j08 h LYS 9 N 0.41 1.04 -0.15 3.56 1.57 -1.11 0.59 116.57 122.49 1j08 h LYS 9 Ca 0.10 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1j08 h LYS 9 Cb 0.43 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 1j08 h LYS 9 CO 0.02 0.69 0.03 -0.09 -0.57 0.00 0.00 179.45 179.53 1j08 h ARG 10 N 1.08 0.24 -0.07 3.15 2.43 -1.02 -0.94 114.38 119.24 1j08 h ARG 10 Ca 0.44 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.57 1j08 h ARG 10 Cb 0.28 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1j08 h ARG 10 CO -0.19 0.40 -0.04 0.82 -1.51 0.00 0.00 179.97 179.45 1j08 h ILE 11 N 0.03 0.88 -0.75 1.20 1.08 0.13 -1.39 117.51 118.69 1j08 h ILE 11 Ca 0.05 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.58 1j08 h ILE 11 Cb 0.27 0.88 -0.06 0.00 -3.07 0.00 0.00 36.82 34.84 1j08 h ILE 11 CO 0.00 0.00 0.43 0.40 -0.69 0.00 0.00 178.15 178.29 1j08 h ILE 12 N -0.04 0.96 -0.37 -0.67 2.04 0.24 0.24 117.51 119.92 1j08 h ILE 12 Ca 0.04 -0.26 -0.05 0.00 1.00 0.00 0.00 64.86 65.59 1j08 h ILE 12 Cb 0.10 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 1j08 h ILE 12 CO -0.09 0.14 0.03 0.11 0.00 0.00 0.00 178.15 178.33 1j08 h LYS 13 N 0.77 0.64 -0.07 2.37 1.57 -0.88 -0.90 116.57 120.06 1j08 h LYS 13 Ca 0.34 -0.19 -0.07 0.00 -1.87 0.00 0.00 60.65 58.86 1j08 h LYS 13 Cb 0.23 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1j08 h LYS 13 CO -0.20 0.72 -0.24 1.49 -0.57 0.00 0.00 179.45 180.65 1j08 h GLU 14 N 0.46 0.29 0.00 3.15 4.57 -0.79 -0.98 114.58 121.29 1j08 h GLU 14 Ca 0.11 -0.22 -0.19 0.00 -1.18 0.00 0.00 59.36 57.88 1j08 h GLU 14 Cb 0.42 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.02 1j08 h GLU 14 CO 0.01 0.84 -0.96 0.93 -1.18 0.00 0.00 179.01 178.66 1j08 h GLU 15 N -0.20 0.00 0.00 1.92 4.39 -0.61 -3.41 114.58 116.67 1j08 h GLU 15 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1j08 h GLU 15 Cb 0.87 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.52 1j08 h GLU 15 CO 0.05 0.84 0.00 1.19 -1.16 0.00 0.00 179.01 179.94 1j08 n PHE 16 N -3.29 0.00 0.21 4.33 3.01 -0.38 -4.83 117.46 116.50 1j08 n PHE 16 Ca -0.01 0.00 0.17 0.00 1.01 0.00 0.00 57.45 58.62 1j08 n PHE 16 Cb 0.90 0.00 0.83 0.00 -0.01 0.00 0.00 39.48 41.20 1j08 n PHE 16 CO 0.00 0.00 0.00 0.74 1.01 0.00 0.00 176.76 178.51 1j08 h PHE 17 N 0.00 0.00 0.00 1.38 0.04 -1.54 -0.32 116.94 116.51 1j08 h PHE 17 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1j08 h PHE 17 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1j08 h PHE 17 CO 0.00 0.00 0.00 0.66 -0.60 0.00 0.00 178.31 178.37 1j08 h SER 18 N 0.00 0.00 0.02 2.17 4.64 -1.40 -1.06 113.55 117.92 1j08 h SER 18 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1j08 h SER 18 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1j08 h SER 18 CO -0.00 0.00 -0.12 0.29 -0.87 0.00 0.00 176.83 176.13 1j08 n LYS 19 N -2.58 1.71 -2.00 4.77 5.02 -0.13 -4.97 118.16 119.99 1j08 n LYS 19 Ca -0.01 -1.26 -0.36 0.00 -2.02 0.00 0.00 58.31 54.66 1j08 n LYS 19 Cb 0.13 -1.47 0.03 0.00 -0.02 0.00 0.00 35.03 33.70 1j08 n LYS 19 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1j08 s MET 20 N -2.16 3.02 0.02 1.97 -1.94 -0.40 -4.89 119.30 114.93 1j08 s MET 20 Ca 0.29 1.87 0.00 0.00 -1.71 0.00 0.00 55.69 56.14 1j08 s MET 20 Cb 0.20 -1.99 0.00 0.00 2.01 0.00 0.00 34.83 35.05 1j08 s MET 20 CO 0.39 -1.18 0.00 0.28 -0.01 0.00 0.00 175.02 174.50 1j08 n VAL 21 N -1.48 0.23 -3.30 -6.03 0.31 -1.26 -5.02 118.33 101.78 1j08 n VAL 21 Ca 0.13 0.08 -0.32 0.00 -0.01 0.00 0.00 64.34 64.21 1j08 n VAL 21 Cb 0.49 -1.04 -0.06 0.00 -0.91 0.00 0.00 33.84 32.33 1j08 n VAL 21 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1j08 s ASN 22 N -5.12 6.70 0.53 4.52 0.01 -0.73 -5.02 114.94 115.83 1j08 s ASN 22 Ca 0.00 1.07 -0.22 0.00 -0.71 0.00 0.00 52.86 53.01 1j08 s ASN 22 Cb 0.00 -2.29 -0.05 0.00 0.41 0.00 0.00 41.25 39.32 1j08 s ASN 22 CO 0.00 -0.11 1.30 -2.16 -1.51 0.00 0.00 177.10 174.62 1j08 s PRO 23 N -2.82 3.25 -0.05 -0.60 0.04 -1.26 -4.60 135.00 128.96 1j08 s PRO 23 Ca 0.49 2.09 0.06 0.00 0.04 0.00 0.00 61.00 63.68 1j08 s PRO 23 Cb -0.11 -2.25 -0.01 0.00 0.04 0.00 0.00 34.50 32.17 1j08 s PRO 23 CO 0.20 -1.06 -0.23 0.08 0.04 0.00 0.00 177.00 176.03 1j08 s VAL 24 N -1.38 1.88 -0.19 -0.36 1.01 0.79 0.01 120.40 122.16 1j08 s VAL 24 Ca 0.71 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.71 1j08 s VAL 24 Cb -0.37 -1.59 0.02 0.00 0.00 0.00 0.00 36.38 34.45 1j08 s VAL 24 CO 0.43 0.53 -0.19 -0.75 0.00 0.00 0.00 175.10 175.12 1j08 s LYS 25 N -0.22 2.96 -0.48 2.72 2.20 -0.25 -1.36 119.74 125.32 1j08 s LYS 25 Ca -0.01 -0.85 -0.24 0.00 -0.36 0.00 0.00 55.97 54.51 1j08 s LYS 25 Cb -0.12 -2.61 0.03 0.00 -1.51 0.00 0.00 37.83 33.62 1j08 s LYS 25 CO 0.02 -0.23 0.86 -0.51 -0.36 0.00 0.00 175.35 175.13 1j08 s LEU 26 N 1.29 4.16 -0.39 5.43 1.43 0.60 -1.97 118.68 129.22 1j08 s LEU 26 Ca 0.04 -0.10 -0.16 0.00 -1.03 0.00 0.00 54.13 52.88 1j08 s LEU 26 Cb -0.13 -3.00 0.01 0.00 0.03 0.00 0.00 46.19 43.09 1j08 s LEU 26 CO -0.12 -1.02 0.37 -0.63 0.23 0.00 0.00 176.35 175.17 1j08 s ILE 27 N 3.56 5.17 -0.23 -0.59 1.01 -0.85 -1.49 121.20 127.80 1j08 s ILE 27 Ca 0.32 -0.30 -0.07 0.00 0.00 0.00 0.00 60.65 60.60 1j08 s ILE 27 Cb -0.12 -3.92 -0.03 0.00 0.01 0.00 0.00 42.46 38.40 1j08 s ILE 27 CO 0.23 -0.27 0.06 -0.69 0.00 0.00 0.00 174.94 174.28 1j08 s VAL 28 N 1.96 4.42 -0.24 2.92 1.01 -0.41 -1.30 120.40 128.75 1j08 s VAL 28 Ca 0.10 -0.14 -0.09 0.00 0.00 0.00 0.00 61.98 61.84 1j08 s VAL 28 Cb -0.17 -3.04 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 1j08 s VAL 28 CO 0.12 0.38 0.12 -0.36 0.00 0.00 0.00 175.10 175.36 1j08 s PHE 29 N 1.23 3.21 -0.06 5.22 0.40 0.14 0.55 117.98 128.68 1j08 s PHE 29 Ca 0.05 -0.01 0.01 0.00 -0.60 0.00 0.00 56.93 56.38 1j08 s PHE 29 Cb -0.14 -2.25 0.02 0.00 0.51 0.00 0.00 43.02 41.15 1j08 s PHE 29 CO 0.03 -0.09 -0.07 0.42 0.70 0.00 0.00 175.22 176.21 1j08 s ILE 30 N 1.26 0.80 0.00 0.64 1.01 -0.61 -1.79 121.20 122.52 1j08 s ILE 30 Ca 0.06 -0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.45 1j08 s ILE 30 Cb -0.14 -0.78 0.00 0.00 0.01 0.00 0.00 42.46 41.54 1j08 s ILE 30 CO 0.05 0.29 0.00 0.61 0.00 0.00 0.00 174.94 175.89 1j08 n GLY 31 N 4.09 4.81 0.01 6.18 0.00 -1.26 -1.09 105.19 117.92 1j08 n GLY 31 Ca -0.22 -1.63 0.11 0.00 0.00 0.00 0.00 46.02 44.27 1j08 n GLY 31 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j08 n LYS 32 N 0.00 0.47 -0.83 1.61 4.76 -1.26 -4.91 118.16 118.00 1j08 n LYS 32 Ca 0.00 -0.14 -0.33 0.00 -2.87 0.00 0.00 58.31 54.97 1j08 n LYS 32 Cb 0.00 -1.52 0.11 0.00 -1.84 0.00 0.00 35.03 31.78 1j08 n LYS 32 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1j08 n GLU 33 N -2.05 -0.25 -1.70 1.97 0.00 -1.26 -4.78 120.64 112.59 1j08 n GLU 33 Ca -0.02 -0.04 -0.43 0.00 0.00 0.00 0.00 57.16 56.68 1j08 n GLU 33 Cb 0.50 -1.74 -0.03 0.00 0.00 0.00 0.00 31.44 30.17 1j08 n GLU 33 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 1j08 s HIS 34 N -2.34 1.31 -0.37 -1.84 5.65 -1.26 -4.89 115.29 111.56 1j08 s HIS 34 Ca 0.55 0.52 0.02 0.00 0.25 0.00 0.00 55.06 56.40 1j08 s HIS 34 Cb -0.21 -3.98 0.15 0.00 -1.18 0.00 0.00 32.58 27.36 1j08 s HIS 34 CO 0.70 -3.90 0.35 0.00 -0.65 0.00 0.00 174.74 171.23 1j08 h GLN 36 N 7.07 0.18 -0.27 0.00 4.15 -1.99 -3.09 115.11 121.15 1j08 h GLN 36 Ca 0.05 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.45 1j08 h GLN 36 Cb 1.04 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.70 1j08 h GLN 36 CO 0.21 0.20 0.00 0.66 -1.93 0.00 0.00 178.83 177.98 1j08 n TYR 37 N -4.42 0.92 -0.17 3.99 4.01 -1.26 -4.68 117.16 115.54 1j08 n TYR 37 Ca -0.01 -0.84 0.10 0.00 -0.16 0.00 0.00 57.90 56.99 1j08 n TYR 37 Cb 0.15 -0.29 0.41 0.00 -0.31 0.00 0.00 39.34 39.31 1j08 n TYR 37 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1j08 h ASP 39 N 0.61 0.21 0.79 0.00 5.19 -1.85 -1.79 116.42 119.58 1j08 h ASP 39 Ca 0.34 -0.06 -0.09 0.00 -0.62 0.00 0.00 57.03 56.60 1j08 h ASP 39 Cb 0.51 -0.06 -0.01 0.00 0.18 0.00 0.00 39.33 39.95 1j08 h ASP 39 CO -0.12 0.45 -0.44 1.56 -3.12 0.00 0.00 179.24 177.57 1j08 h GLN 40 N 0.20 0.00 -0.41 3.56 7.50 -1.50 -1.49 115.11 122.98 1j08 h GLN 40 Ca 0.04 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 59.11 1j08 h GLN 40 Cb 0.51 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.03 1j08 h GLN 40 CO 0.04 0.44 -0.06 1.25 -1.50 0.00 0.00 178.83 179.00 1j08 h LEU 41 N 0.00 0.76 -0.48 1.46 5.85 -0.99 0.59 115.31 122.49 1j08 h LEU 41 Ca -0.00 -0.34 -0.06 0.00 0.84 0.00 0.00 57.88 58.32 1j08 h LEU 41 Cb 0.96 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 1j08 h LEU 41 CO 0.06 0.92 0.07 0.11 -0.34 0.00 0.00 178.44 179.26 1j08 h LYS 42 N 0.58 0.80 -0.33 1.25 1.57 -1.23 -2.34 116.57 116.87 1j08 h LYS 42 Ca 0.11 -0.22 -0.09 0.00 -1.87 0.00 0.00 60.65 58.58 1j08 h LYS 42 Cb 0.57 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 1j08 h LYS 42 CO 0.03 0.81 -0.15 1.96 -0.57 0.00 0.00 179.45 181.53 1j08 h GLN 43 N 0.68 0.59 -0.25 3.15 4.20 -1.15 -2.12 115.11 120.21 1j08 h GLN 43 Ca 0.15 -0.19 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 1j08 h GLN 43 Cb 0.40 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 1j08 h GLN 43 CO 0.01 0.72 0.04 1.25 -0.67 0.00 0.00 178.83 180.18 1j08 h LEU 44 N 0.54 0.39 -0.99 1.46 5.85 -0.61 -1.28 115.31 120.67 1j08 h LEU 44 Ca 0.09 -0.26 -0.09 0.00 0.84 0.00 0.00 57.88 58.46 1j08 h LEU 44 Cb 0.57 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1j08 h LEU 44 CO 0.04 0.56 -0.24 -0.37 -0.34 0.00 0.00 178.44 178.08 1j08 h VAL 45 N 0.21 1.26 -0.11 1.05 -1.51 -1.32 -2.00 116.25 113.83 1j08 h VAL 45 Ca 0.07 -1.23 -0.01 0.00 -1.23 0.00 0.00 66.70 64.30 1j08 h VAL 45 Cb 0.33 1.35 -0.00 0.00 -2.13 0.00 0.00 31.29 30.83 1j08 h VAL 45 CO 0.01 0.39 0.02 -0.61 -1.23 0.00 0.00 177.57 176.14 1j08 h GLN 46 N 0.40 0.19 -0.58 5.19 4.15 -1.24 -0.64 115.11 122.57 1j08 h GLN 46 Ca 0.06 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.44 1j08 h GLN 46 Cb 0.64 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.28 1j08 h GLN 46 CO 0.05 0.38 0.38 0.93 -1.93 0.00 0.00 178.83 178.64 1j08 h GLU 47 N -0.04 0.74 -0.27 1.69 5.08 -1.05 -1.73 114.58 119.01 1j08 h GLU 47 Ca 0.03 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1j08 h GLU 47 Cb 0.29 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1j08 h GLU 47 CO 0.00 0.49 0.07 -0.07 -1.00 0.00 0.00 179.01 178.50 1j08 h LEU 48 N 0.76 0.40 -1.92 1.33 3.38 -1.32 -2.94 115.31 115.00 1j08 h LEU 48 Ca 0.22 -0.23 0.08 0.00 0.09 0.00 0.00 57.88 58.05 1j08 h LEU 48 Cb -0.06 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1j08 h LEU 48 CO -0.06 0.52 0.24 0.28 0.09 0.00 0.00 178.44 179.51 1j08 h SER 49 N 0.26 0.08 0.93 -0.43 0.02 -0.79 -0.57 113.55 113.05 1j08 h SER 49 Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1j08 h SER 49 Cb 0.28 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.80 1j08 h SER 49 CO 0.00 0.05 0.00 -0.62 -1.14 0.00 0.00 176.83 175.12 1j08 n GLU 50 N -4.46 0.14 0.13 3.45 1.02 -0.68 -3.37 120.64 116.88 1j08 n GLU 50 Ca 0.05 0.26 0.13 0.00 -0.02 0.00 0.00 57.16 57.58 1j08 n GLU 50 Cb 0.35 -1.72 0.42 0.00 -0.02 0.00 0.00 31.44 30.48 1j08 n GLU 50 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1j08 h LEU 51 N 0.00 0.00 -7.01 -4.62 3.38 -1.14 -3.46 115.31 102.47 1j08 h LEU 51 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1j08 h LEU 51 Cb 0.47 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.01 1j08 h LEU 51 CO 0.00 0.00 0.15 0.28 0.09 0.00 0.00 178.44 178.96 1j08 s THR 52 N -3.20 0.00 -2.00 0.22 -1.32 -1.22 -4.97 115.64 103.15 1j08 s THR 52 Ca 0.08 -0.00 0.11 0.00 -1.21 0.00 0.00 61.69 60.66 1j08 s THR 52 Cb 0.11 -0.99 0.30 0.00 -1.51 0.00 0.00 72.50 70.41 1j08 s THR 52 CO 0.55 -0.00 1.26 -0.90 -2.21 0.00 0.00 174.62 173.32 1j08 n ASP 53 N 1.78 0.00 -0.47 8.08 5.68 -1.26 -2.20 116.55 128.15 1j08 n ASP 53 Ca -0.17 -1.29 0.10 0.00 -0.50 0.00 0.00 54.79 52.93 1j08 n ASP 53 Cb 0.56 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.54 1j08 n ASP 53 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1j08 n LYS 54 N -0.70 1.39 -4.95 0.11 5.02 -1.26 -4.92 118.16 112.85 1j08 n LYS 54 Ca 0.08 -0.97 -0.28 0.00 -2.02 0.00 0.00 58.31 55.12 1j08 n LYS 54 Cb 0.04 -1.41 -0.17 0.00 -0.02 0.00 0.00 35.03 33.47 1j08 n LYS 54 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1j08 s LEU 55 N -2.31 1.92 0.23 -0.35 2.96 -0.94 -0.15 118.68 120.05 1j08 s LEU 55 Ca 0.17 -0.43 -0.02 0.00 -0.22 0.00 0.00 54.13 53.64 1j08 s LEU 55 Cb 0.16 -1.13 -0.03 0.00 0.50 0.00 0.00 46.19 45.69 1j08 s LEU 55 CO 0.51 0.14 0.22 -0.94 -1.32 0.00 0.00 176.35 174.96 1j08 s SER 56 N 0.26 0.35 0.18 3.68 1.04 -0.47 -4.66 113.70 114.08 1j08 s SER 56 Ca -0.11 -1.37 -0.09 0.00 0.48 0.00 0.00 55.95 54.85 1j08 s SER 56 Cb -0.15 0.45 -0.01 0.00 0.10 0.00 0.00 66.02 66.41 1j08 s SER 56 CO 0.05 -0.94 0.30 -0.72 0.98 0.00 0.00 173.24 172.91 1j08 s TYR 57 N -3.99 0.43 -0.15 5.02 1.13 -1.26 -0.29 117.35 118.24 1j08 s TYR 57 Ca 0.36 -0.79 -0.06 0.00 -1.41 0.00 0.00 57.07 55.17 1j08 s TYR 57 Cb 0.05 -0.05 0.07 0.00 -1.10 0.00 0.00 41.96 40.93 1j08 s TYR 57 CO 0.14 -0.75 0.33 -2.00 -2.51 0.00 0.00 175.55 170.75 1j08 s GLU 58 N -3.99 0.25 -0.37 -3.49 2.12 -0.55 -4.91 118.70 107.77 1j08 s GLU 58 Ca 0.19 0.78 -0.22 0.00 0.36 0.00 0.00 54.97 56.08 1j08 s GLU 58 Cb 0.03 0.04 0.01 0.00 0.26 0.00 0.00 34.13 34.46 1j08 s GLU 58 CO 0.02 -0.22 0.70 0.42 -0.54 0.00 0.00 175.26 175.64 1j08 s ILE 59 N 2.00 4.81 -0.10 -3.70 -1.09 -1.26 -1.29 121.20 120.59 1j08 s ILE 59 Ca -0.04 0.67 -0.11 0.00 -2.23 0.00 0.00 60.65 58.94 1j08 s ILE 59 Cb -0.11 -4.15 -0.05 0.00 -1.58 0.00 0.00 42.46 36.58 1j08 s ILE 59 CO -0.10 -0.39 0.26 -0.69 -1.23 0.00 0.00 174.94 172.79 1j08 s VAL 60 N 2.89 5.30 -0.64 2.92 1.01 0.19 -4.98 120.40 127.09 1j08 s VAL 60 Ca 0.27 0.49 -0.25 0.00 0.00 0.00 0.00 61.98 62.50 1j08 s VAL 60 Cb -0.14 -3.56 0.05 0.00 0.00 0.00 0.00 36.38 32.73 1j08 s VAL 60 CO 0.16 0.54 1.06 -0.62 0.00 0.00 0.00 175.10 176.24 1j08 s ASP 61 N -0.60 6.25 0.58 3.32 -1.08 -1.26 -1.57 116.67 122.31 1j08 s ASP 61 Ca 0.18 -0.55 0.35 0.00 -0.52 0.00 0.00 52.55 52.01 1j08 s ASP 61 Cb -0.14 -2.47 1.78 0.00 -1.46 0.00 0.00 42.92 40.63 1j08 s ASP 61 CO 0.07 -1.48 2.16 0.15 0.52 0.00 0.00 175.17 176.59 1j08 h PHE 62 N 9.60 0.00 -0.34 -5.34 3.57 -1.41 -3.04 116.94 119.98 1j08 h PHE 62 Ca -0.27 0.00 -0.19 0.00 3.53 0.00 0.00 57.97 61.04 1j08 h PHE 62 Cb 1.06 0.00 -0.10 0.00 2.79 0.00 0.00 35.95 39.70 1j08 h PHE 62 CO 1.00 0.04 0.24 -0.25 -2.23 0.00 0.00 178.31 177.12 1j08 n ASP 63 N -3.33 4.15 -4.06 0.41 8.00 -1.26 -4.28 116.55 116.18 1j08 n ASP 63 Ca -0.02 -2.64 -0.07 0.00 0.71 0.00 0.00 54.79 52.77 1j08 n ASP 63 Cb 0.19 -0.76 -0.10 0.00 -0.02 0.00 0.00 41.12 40.43 1j08 n ASP 63 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1j08 s THR 64 N -1.27 0.20 0.29 -3.53 -4.23 -1.15 -5.04 115.64 100.92 1j08 s THR 64 Ca 0.20 -1.67 -0.01 0.00 -1.18 0.00 0.00 61.69 59.03 1j08 s THR 64 Cb 0.16 -1.36 0.16 0.00 1.34 0.00 0.00 72.50 72.80 1j08 s THR 64 CO 0.02 -0.92 1.84 1.55 -0.54 0.00 0.00 174.62 176.57 1j08 h PRO 65 N 3.30 0.80 -0.50 3.99 0.13 -1.89 -0.37 132.00 137.47 1j08 h PRO 65 Ca -0.34 -0.16 -0.12 0.00 -0.87 0.00 0.00 66.00 64.51 1j08 h PRO 65 Cb 1.15 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 1j08 h PRO 65 CO 0.63 0.72 -0.17 0.93 -0.23 0.00 0.00 178.00 179.87 1j08 h GLU 66 N 0.78 1.00 -0.68 0.86 4.39 -1.97 -1.79 114.58 117.18 1j08 h GLU 66 Ca 0.17 -0.40 -0.07 0.00 0.34 0.00 0.00 59.36 59.40 1j08 h GLU 66 Cb 0.27 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.85 1j08 h GLU 66 CO -0.00 1.08 0.13 0.78 -1.16 0.00 0.00 179.01 179.84 1j08 h GLY 67 N 0.90 1.18 1.74 -3.84 0.00 -1.57 -1.98 103.07 99.50 1j08 h GLY 67 Ca 0.12 -0.76 -0.14 0.00 0.00 0.00 0.00 47.33 46.55 1j08 h GLY 67 CO 0.06 0.71 -0.54 0.50 0.00 0.00 0.00 176.54 177.27 1j08 h LYS 68 N 1.03 0.28 -0.33 4.80 1.57 -0.94 -0.29 116.57 122.69 1j08 h LYS 68 Ca 0.21 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1j08 h LYS 68 Cb 0.41 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 1j08 h LYS 68 CO 0.01 0.75 0.02 1.49 -0.57 0.00 0.00 179.45 181.15 1j08 h GLU 69 N 0.22 0.57 -0.49 3.15 4.81 -1.12 -0.48 114.58 121.24 1j08 h GLU 69 Ca 0.00 -0.17 -0.04 0.00 -0.13 0.00 0.00 59.36 59.03 1j08 h GLU 69 Cb 1.02 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.32 1j08 h GLU 69 CO 0.09 0.68 0.17 1.25 -0.73 0.00 0.00 179.01 180.46 1j08 h LEU 70 N 0.38 0.70 -0.90 1.64 5.85 -1.21 -2.21 115.31 119.56 1j08 h LEU 70 Ca 0.10 -0.19 0.06 0.00 0.84 0.00 0.00 57.88 58.69 1j08 h LEU 70 Cb 0.40 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.19 1j08 h LEU 70 CO 0.01 0.70 0.57 0.00 -0.34 0.00 0.00 178.44 179.38 1j08 h ALA 71 N 1.02 1.25 -0.67 1.25 0.00 -0.79 -1.87 119.26 119.45 1j08 h ALA 71 Ca 0.16 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 1j08 h ALA 71 Cb 0.24 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1j08 h ALA 71 CO -0.01 0.32 0.11 1.49 0.00 0.00 0.00 179.25 181.17 1j08 h GLU 72 N 1.03 1.12 -0.49 0.00 4.81 -0.74 0.15 114.58 120.46 1j08 h GLU 72 Ca 0.39 -0.30 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1j08 h GLU 72 Cb 0.18 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 1j08 h GLU 72 CO -0.18 1.02 0.30 0.87 -0.73 0.00 0.00 179.01 180.29 1j08 h LYS 73 N 1.04 0.66 -0.63 1.92 1.57 -0.75 -1.64 116.57 118.74 1j08 h LYS 73 Ca 0.21 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1j08 h LYS 73 Cb 0.44 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1j08 h LYS 73 CO 0.01 0.46 0.00 0.66 -0.57 0.00 0.00 179.45 180.01 1j08 n TYR 74 N -4.44 1.25 -3.81 -1.35 4.01 -0.89 -4.94 117.16 107.00 1j08 n TYR 74 Ca 0.04 -0.50 -0.25 0.00 -0.16 0.00 0.00 57.90 57.03 1j08 n TYR 74 Cb 0.07 -0.22 0.03 0.00 -0.31 0.00 0.00 39.34 38.91 1j08 n TYR 74 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1j08 n ARG 75 N 0.90 -5.07 -3.84 -0.72 1.74 -0.62 -4.98 116.66 104.07 1j08 n ARG 75 Ca 0.21 0.60 -0.36 0.00 -0.77 0.00 0.00 57.85 57.53 1j08 n ARG 75 Cb 0.76 -5.27 -0.13 0.00 -1.02 0.00 0.00 32.46 26.81 1j08 n ARG 75 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1j08 s ILE 76 N -3.54 3.83 -2.61 0.55 -1.09 0.46 -5.00 121.20 113.82 1j08 s ILE 76 Ca 0.28 -0.33 0.21 0.00 -2.23 0.00 0.00 60.65 58.57 1j08 s ILE 76 Cb -0.14 -2.77 0.16 0.00 -1.58 0.00 0.00 42.46 38.13 1j08 s ILE 76 CO 0.82 0.38 1.16 -0.90 -1.23 0.00 0.00 174.94 175.18 1j08 n ASP 77 N 4.84 2.73 -3.55 3.58 5.75 -1.26 -4.31 116.55 124.34 1j08 n ASP 77 Ca -0.17 -1.87 -0.08 0.00 -0.01 0.00 0.00 54.79 52.66 1j08 n ASP 77 Cb 0.51 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.59 1j08 n ASP 77 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1j08 s ARG 78 N -1.75 0.95 0.20 0.11 1.70 -1.26 -5.17 118.95 113.73 1j08 s ARG 78 Ca 0.24 -0.39 0.10 0.00 -0.47 0.00 0.00 55.73 55.21 1j08 s ARG 78 Cb 0.17 0.40 -0.04 0.00 -0.57 0.00 0.00 34.95 34.91 1j08 s ARG 78 CO 0.26 -0.42 -0.20 0.00 -1.08 0.00 0.00 175.30 173.87 1j08 s ALA 79 N -3.22 2.31 0.39 7.88 0.00 -1.26 -4.20 121.76 123.66 1j08 s ALA 79 Ca 0.06 -1.64 -0.24 0.00 0.00 0.00 0.00 51.96 50.14 1j08 s ALA 79 Cb -0.01 -0.22 -0.10 0.00 0.00 0.00 0.00 23.12 22.79 1j08 s ALA 79 CO -0.07 0.27 0.98 -1.25 0.00 0.00 0.00 175.76 175.69 1j08 s PRO 80 N -3.05 4.32 -0.07 0.00 0.04 -1.26 -4.87 135.00 130.10 1j08 s PRO 80 Ca 0.21 1.31 -0.15 0.00 0.04 0.00 0.00 61.00 62.42 1j08 s PRO 80 Cb -0.05 -2.50 0.03 0.00 0.04 0.00 0.00 34.50 32.02 1j08 s PRO 80 CO 0.09 0.03 0.36 0.00 0.04 0.00 0.00 177.00 177.53 1j08 s ALA 81 N -1.82 -0.90 -0.08 8.56 0.00 -0.74 -3.13 121.76 123.65 1j08 s ALA 81 Ca 0.57 0.71 0.02 0.00 0.00 0.00 0.00 51.96 53.26 1j08 s ALA 81 Cb -0.16 -0.24 0.02 0.00 0.00 0.00 0.00 23.12 22.73 1j08 s ALA 81 CO 0.21 -0.23 -0.11 0.99 0.00 0.00 0.00 175.76 176.62 1j08 s THR 82 N -0.63 1.10 -0.15 0.00 2.01 0.55 0.29 115.64 118.82 1j08 s THR 82 Ca -0.07 -0.43 -0.01 0.00 0.31 0.00 0.00 61.69 61.49 1j08 s THR 82 Cb -0.04 -1.04 -0.01 0.00 0.01 0.00 0.00 72.50 71.42 1j08 s THR 82 CO 0.03 0.36 -0.12 0.28 -0.69 0.00 0.00 174.62 174.47 1j08 s THR 83 N 0.93 3.05 -0.56 -0.82 -1.32 -0.42 -0.34 115.64 116.16 1j08 s THR 83 Ca -0.10 -0.65 -0.21 0.00 -1.21 0.00 0.00 61.69 59.53 1j08 s THR 83 Cb -0.15 -2.30 0.07 0.00 -1.51 0.00 0.00 72.50 68.61 1j08 s THR 83 CO 0.01 0.51 0.78 -0.63 -2.21 0.00 0.00 174.62 173.07 1j08 s ILE 84 N 0.56 4.64 0.13 5.08 1.01 -0.00 -2.00 121.20 130.63 1j08 s ILE 84 Ca -0.08 -0.38 0.03 0.00 0.00 0.00 0.00 60.65 60.22 1j08 s ILE 84 Cb -0.16 -4.47 -0.04 0.00 0.01 0.00 0.00 42.46 37.81 1j08 s ILE 84 CO 0.03 -1.06 0.22 0.42 0.00 0.00 0.00 174.94 174.55 1j08 s THR 85 N 3.22 5.07 -0.73 2.92 -4.23 -0.83 -4.37 115.64 116.69 1j08 s THR 85 Ca 0.19 -0.74 -0.17 0.00 -1.18 0.00 0.00 61.69 59.79 1j08 s THR 85 Cb -0.18 -3.57 0.14 0.00 1.34 0.00 0.00 72.50 70.23 1j08 s THR 85 CO 0.12 -0.04 0.81 -1.58 -0.54 0.00 0.00 174.62 173.39 1j08 s GLN 86 N -3.02 3.31 -1.51 3.99 0.74 -0.77 -1.09 119.66 121.32 1j08 s GLN 86 Ca 0.33 -1.73 -0.12 0.00 0.05 0.00 0.00 55.36 53.89 1j08 s GLN 86 Cb -0.11 -4.46 0.07 0.00 1.10 0.00 0.00 33.01 29.62 1j08 s GLN 86 CO 0.27 -1.52 0.93 -3.47 -0.55 0.00 0.00 175.29 170.95 1j08 n ASP 87 N 5.73 -4.19 0.00 6.67 2.03 0.10 -1.56 116.55 125.33 1j08 n ASP 87 Ca 0.04 -0.80 0.00 0.00 0.52 0.00 0.00 54.79 54.55 1j08 n ASP 87 Cb 0.45 -3.86 0.00 0.00 -0.72 0.00 0.00 41.12 36.99 1j08 n ASP 87 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1j08 n GLY 88 N -1.68 3.12 3.71 0.27 0.00 -1.26 -4.97 105.19 104.38 1j08 n GLY 88 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1j08 n GLY 88 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1j08 s LYS 89 N -0.85 4.47 -0.17 1.61 2.20 -0.60 -4.95 119.74 121.44 1j08 s LYS 89 Ca 0.00 1.69 -0.29 0.00 -0.36 0.00 0.00 55.97 57.00 1j08 s LYS 89 Cb 0.00 -3.37 -0.01 0.00 -1.51 0.00 0.00 37.83 32.93 1j08 s LYS 89 CO 0.00 -0.20 1.28 0.34 -0.36 0.00 0.00 175.35 176.42 1j08 s ASP 90 N 1.01 6.91 0.00 1.43 -1.08 -1.26 -1.84 116.67 121.84 1j08 s ASP 90 Ca 0.57 1.68 0.11 0.00 -0.52 0.00 0.00 52.55 54.39 1j08 s ASP 90 Cb -0.27 -2.54 0.28 0.00 -1.46 0.00 0.00 42.92 38.92 1j08 s ASP 90 CO 0.29 -0.79 1.20 0.49 0.52 0.00 0.00 175.17 176.87 1j08 n PHE 91 N 6.72 0.40 -1.24 -5.34 3.01 -1.26 -4.97 117.46 114.78 1j08 n PHE 91 Ca 0.14 -0.43 -0.08 0.00 1.01 0.00 0.00 57.45 58.09 1j08 n PHE 91 Cb 0.45 -0.02 -0.04 0.00 -0.01 0.00 0.00 39.48 39.86 1j08 n PHE 91 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1j08 n GLY 92 N 0.53 1.01 3.29 1.37 0.00 -1.26 -3.90 105.19 106.23 1j08 n GLY 92 Ca 0.11 -0.58 -0.43 0.00 0.00 0.00 0.00 46.02 45.11 1j08 n GLY 92 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j08 s VAL 93 N -2.28 4.78 0.10 1.61 1.01 -1.26 -0.08 120.40 124.29 1j08 s VAL 93 Ca 0.00 -1.46 0.06 0.00 0.00 0.00 0.00 61.98 60.58 1j08 s VAL 93 Cb 0.00 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 1j08 s VAL 93 CO 0.00 -0.72 -0.15 -0.13 0.00 0.00 0.00 175.10 174.10 1j08 s ARG 94 N 1.52 0.97 -0.12 2.72 3.00 -0.69 -0.82 118.95 125.53 1j08 s ARG 94 Ca 0.04 -1.14 0.01 0.00 0.00 0.00 0.00 55.73 54.64 1j08 s ARG 94 Cb -0.27 -0.95 0.02 0.00 0.00 0.00 0.00 34.95 33.75 1j08 s ARG 94 CO 0.03 0.20 -0.14 0.71 0.00 0.00 0.00 175.30 176.10 1j08 s TYR 95 N -1.71 1.93 -0.49 -0.53 1.51 0.54 -1.86 117.35 116.73 1j08 s TYR 95 Ca 0.05 -0.95 -0.10 0.00 -1.01 0.00 0.00 57.07 55.06 1j08 s TYR 95 Cb -0.07 -1.42 0.12 0.00 -0.11 0.00 0.00 41.96 40.48 1j08 s TYR 95 CO 0.03 -0.52 0.38 -0.06 -1.11 0.00 0.00 175.55 174.27 1j08 s PHE 96 N 1.18 3.40 0.00 2.71 0.40 0.13 -0.33 117.98 125.46 1j08 s PHE 96 Ca -0.03 -1.79 0.00 0.00 -0.60 0.00 0.00 56.93 54.52 1j08 s PHE 96 Cb -0.14 -3.56 0.00 0.00 0.51 0.00 0.00 43.02 39.83 1j08 s PHE 96 CO -0.04 -1.00 0.00 0.41 0.70 0.00 0.00 175.22 175.29 1j08 n GLY 97 N 4.94 1.19 3.78 4.36 0.00 -1.18 -1.01 105.19 117.27 1j08 n GLY 97 Ca -0.08 -2.25 -0.39 0.00 0.00 0.00 0.00 46.02 43.29 1j08 n GLY 97 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1j08 s ILE 98 N -1.25 4.45 -1.55 -0.61 2.07 -1.26 -4.85 121.20 118.19 1j08 s ILE 98 Ca 0.00 1.60 -0.10 0.00 -1.41 0.00 0.00 60.65 60.74 1j08 s ILE 98 Cb 0.00 -4.09 -0.03 0.00 0.13 0.00 0.00 42.46 38.47 1j08 s ILE 98 CO 0.00 0.53 2.77 -2.65 -1.91 0.00 0.00 174.94 173.68 1j08 n PRO 99 N 1.61 3.78 -2.25 3.50 -0.02 -1.26 -4.95 135.00 135.41 1j08 n PRO 99 Ca -0.07 -2.49 -0.26 0.00 -2.02 0.00 0.00 63.50 58.66 1j08 n PRO 99 Cb 0.49 -2.82 0.08 0.00 -0.02 0.00 0.00 33.50 31.23 1j08 n PRO 99 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1j08 s ALA 100 N 1.64 3.18 0.00 3.55 0.00 -1.26 -2.28 121.76 126.58 1j08 s ALA 100 Ca 0.64 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 51.54 1j08 s ALA 100 Cb 0.17 -2.52 0.00 0.00 0.00 0.00 0.00 23.12 20.78 1j08 s ALA 100 CO -0.07 -1.39 0.00 0.41 0.00 0.00 0.00 175.76 174.71 1j08 n GLY 101 N -2.95 2.92 0.04 0.00 0.00 -1.26 -1.76 105.19 102.17 1j08 n GLY 101 Ca 0.09 -0.22 0.06 0.00 0.00 0.00 0.00 46.02 45.95 1j08 n GLY 101 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1j08 n HIS 102 N 14.00 0.21 0.80 1.61 8.25 -0.48 -1.79 115.22 137.82 1j08 n HIS 102 Ca 0.00 0.10 0.13 0.00 -0.26 0.00 0.00 57.72 57.69 1j08 n HIS 102 Cb 0.00 -0.65 0.43 0.00 1.12 0.00 0.00 29.99 30.89 1j08 n HIS 102 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1j08 n GLU 103 N -1.70 0.14 -0.02 -0.41 -0.58 -0.72 -4.04 120.64 113.30 1j08 n GLU 103 Ca 0.01 0.09 -0.12 0.00 -0.42 0.00 0.00 57.16 56.73 1j08 n GLU 103 Cb 0.10 -1.64 -0.07 0.00 -0.57 0.00 0.00 31.44 29.26 1j08 n GLU 103 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 1j08 h PHE 104 N 0.00 0.17 -0.60 -0.32 3.57 -0.92 -2.32 116.94 116.53 1j08 h PHE 104 Ca 0.00 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.45 1j08 h PHE 104 Cb 0.62 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 1j08 h PHE 104 CO 0.00 0.36 0.25 0.00 -2.23 0.00 0.00 178.31 176.68 1j08 h ALA 105 N 0.79 1.31 -0.62 2.41 0.00 -1.78 -1.69 119.26 119.69 1j08 h ALA 105 Ca 0.03 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1j08 h ALA 105 Cb 0.28 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1j08 h ALA 105 CO 0.00 0.52 0.23 0.00 0.00 0.00 0.00 179.25 180.00 1j08 h ALA 106 N 1.42 1.24 -0.59 0.00 0.00 -1.70 -0.63 119.26 119.00 1j08 h ALA 106 Ca 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1j08 h ALA 106 Cb 0.15 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1j08 h ALA 106 CO -0.02 0.55 0.31 0.35 0.00 0.00 0.00 179.25 180.44 1j08 h PHE 107 N 0.89 0.82 -0.57 0.00 3.57 -0.76 -0.84 116.94 120.06 1j08 h PHE 107 Ca 0.21 -0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.63 1j08 h PHE 107 Cb 0.20 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 1j08 h PHE 107 CO 0.01 0.61 0.16 -0.07 -2.23 0.00 0.00 178.31 176.79 1j08 h LEU 108 N 0.79 0.85 -0.61 0.59 3.38 -0.73 -2.14 115.31 117.44 1j08 h LEU 108 Ca 0.20 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1j08 h LEU 108 Cb 0.08 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1j08 h LEU 108 CO -0.03 0.85 0.10 -0.33 0.09 0.00 0.00 178.44 179.11 1j08 h GLU 109 N 0.81 1.02 -0.80 1.13 5.08 -0.86 -2.73 114.58 118.22 1j08 h GLU 109 Ca 0.18 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1j08 h GLU 109 Cb 0.31 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 1j08 h GLU 109 CO -0.00 0.95 0.46 -0.44 -1.00 0.00 0.00 179.01 178.98 1j08 h ASP 110 N 0.93 0.98 -0.75 1.42 3.32 -0.97 -0.29 116.42 121.06 1j08 h ASP 110 Ca 0.19 -0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.18 1j08 h ASP 110 Cb 0.43 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.69 1j08 h ASP 110 CO 0.01 0.77 0.50 0.40 -1.72 0.00 0.00 179.24 179.20 1j08 h ILE 111 N 1.11 1.19 -0.22 0.35 2.04 -1.10 -0.18 117.51 120.70 1j08 h ILE 111 Ca 0.29 -0.35 -0.07 0.00 1.00 0.00 0.00 64.86 65.73 1j08 h ILE 111 Cb -0.01 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.15 1j08 h ILE 111 CO -0.05 0.18 -0.14 0.58 0.00 0.00 0.00 178.15 178.72 1j08 h VAL 112 N 1.01 1.31 -0.84 1.67 2.07 -1.09 -1.45 116.25 118.93 1j08 h VAL 112 Ca 0.28 -1.25 -0.03 0.00 0.82 0.00 0.00 66.70 66.52 1j08 h VAL 112 Cb -0.11 1.66 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 1j08 h VAL 112 CO -0.06 0.38 0.40 0.44 0.02 0.00 0.00 177.57 178.75 1j08 h ASP 113 N 0.18 1.10 0.30 0.57 5.19 -0.85 -1.68 116.42 121.24 1j08 h ASP 113 Ca 0.04 -0.14 -0.14 0.00 -0.62 0.00 0.00 57.03 56.18 1j08 h ASP 113 Cb 0.66 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.87 1j08 h ASP 113 CO 0.04 0.93 -0.56 0.58 -3.12 0.00 0.00 179.24 177.11 1j08 h VAL 114 N 1.20 1.36 -0.61 -1.35 2.07 -1.02 0.61 116.25 118.51 1j08 h VAL 114 Ca 0.29 -1.87 -0.03 0.00 0.82 0.00 0.00 66.70 65.91 1j08 h VAL 114 Cb 0.12 1.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.78 1j08 h VAL 114 CO -0.04 0.56 0.25 -1.28 0.02 0.00 0.00 177.57 177.08 1j08 h SER 115 N 0.21 0.83 1.32 0.57 0.87 -0.72 -2.72 113.55 113.91 1j08 h SER 115 Ca 0.00 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.40 1j08 h SER 115 Cb 1.05 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.79 1j08 h SER 115 CO 0.09 0.77 -0.68 0.11 -0.53 0.00 0.00 176.83 176.59 1j08 h LYS 116 N 0.84 0.00 -3.92 2.24 1.57 -1.21 -1.95 116.57 114.15 1j08 h LYS 116 Ca 0.20 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.70 1j08 h LYS 116 Cb 0.19 0.00 0.08 0.00 0.08 0.00 0.00 32.23 32.57 1j08 h LYS 116 CO -0.02 0.00 -0.45 0.41 -0.57 0.00 0.00 179.45 178.82 1j08 n GLY 117 N 1.15 -0.12 3.19 3.86 0.00 0.20 -4.98 105.19 108.51 1j08 n GLY 117 Ca 0.01 -0.08 -0.09 0.00 0.00 0.00 0.00 46.02 45.86 1j08 n GLY 117 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1j08 s ASP 118 N -3.05 0.25 0.23 1.61 3.68 -0.72 -4.91 116.67 113.75 1j08 s ASP 118 Ca 0.33 -1.10 -0.03 0.00 2.13 0.00 0.00 52.55 53.88 1j08 s ASP 118 Cb -0.15 0.33 -0.03 0.00 -1.45 0.00 0.00 42.92 41.62 1j08 s ASP 118 CO 0.41 -0.76 0.23 0.42 0.13 0.00 0.00 175.17 175.59 1j08 s THR 119 N -4.02 0.00 -0.53 1.71 -4.23 -1.26 -4.65 115.64 102.65 1j08 s THR 119 Ca 0.21 -1.87 0.16 0.00 -1.18 0.00 0.00 61.69 59.01 1j08 s THR 119 Cb 0.06 -2.45 0.63 0.00 1.34 0.00 0.00 72.50 72.08 1j08 s THR 119 CO 0.00 0.00 1.54 -0.90 -0.54 0.00 0.00 174.62 174.72 1j08 n ASP 120 N -0.45 4.46 -4.65 3.99 5.75 -1.26 -5.01 116.55 119.39 1j08 n ASP 120 Ca 0.02 -2.72 -0.35 0.00 -0.01 0.00 0.00 54.79 51.73 1j08 n ASP 120 Cb 0.65 -0.55 0.10 0.00 -1.03 0.00 0.00 41.12 40.29 1j08 n ASP 120 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1j08 n LEU 121 N 0.32 3.95 -4.77 -2.12 4.77 -1.26 -4.94 117.00 112.94 1j08 n LEU 121 Ca 0.23 0.64 -0.36 0.00 -0.03 0.00 0.00 56.01 56.49 1j08 n LEU 121 Cb 0.91 -1.45 -0.00 0.00 -2.33 0.00 0.00 43.42 40.55 1j08 n LEU 121 CO 0.21 -1.87 0.81 -0.04 -1.33 0.00 0.00 177.39 175.16 1j08 s MET 122 N -3.63 3.57 0.30 3.23 -1.94 -1.26 -4.82 119.30 114.74 1j08 s MET 122 Ca 0.74 1.70 0.05 0.00 -1.71 0.00 0.00 55.69 56.47 1j08 s MET 122 Cb -0.32 -2.22 0.75 0.00 2.01 0.00 0.00 34.83 35.05 1j08 s MET 122 CO 0.50 -0.69 1.72 0.37 -0.01 0.00 0.00 175.02 176.90 1j08 h GLN 123 N 1.65 0.48 -0.81 2.03 5.75 -1.99 0.70 115.11 122.91 1j08 h GLN 123 Ca -0.50 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 57.94 1j08 h GLN 123 Cb 1.25 -0.11 -0.04 0.00 1.07 0.00 0.00 27.48 29.66 1j08 h GLN 123 CO 0.59 0.32 0.38 0.38 -2.65 0.00 0.00 178.83 177.84 1j08 h ASP 124 N 0.49 1.06 -0.32 -0.69 2.03 -2.00 -0.92 116.42 116.07 1j08 h ASP 124 Ca 0.57 -0.13 -0.04 0.00 -0.73 0.00 0.00 57.03 56.71 1j08 h ASP 124 Cb 1.06 -0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 39.27 1j08 h ASP 124 CO -0.49 0.89 0.04 0.28 -1.03 0.00 0.00 179.24 178.94 1j08 h SER 125 N 1.15 0.52 -0.55 4.15 0.02 -1.26 -2.25 113.55 115.34 1j08 h SER 125 Ca 0.28 -0.27 0.04 0.00 -0.84 0.00 0.00 61.79 60.99 1j08 h SER 125 Cb 0.12 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.48 1j08 h SER 125 CO -0.03 0.66 0.31 0.11 -1.14 0.00 0.00 176.83 176.73 1j08 h LYS 126 N 0.37 0.58 0.18 3.45 1.57 -0.89 0.28 116.57 122.11 1j08 h LYS 126 Ca 0.10 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1j08 h LYS 126 Cb 0.37 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1j08 h LYS 126 CO 0.01 0.38 -0.20 1.49 -0.57 0.00 0.00 179.45 180.57 1j08 h GLU 127 N 0.60 -0.40 -0.48 3.15 4.57 -1.07 -0.73 114.58 120.22 1j08 h GLU 127 Ca 0.23 0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.41 1j08 h GLU 127 Cb 0.08 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 1j08 h GLU 127 CO -0.13 -0.27 0.20 0.93 -1.18 0.00 0.00 179.01 178.56 1j08 h GLU 128 N -0.42 0.72 -0.47 1.92 4.39 -1.16 -3.08 114.58 116.48 1j08 h GLU 128 Ca 0.00 -0.13 -0.06 0.00 0.34 0.00 0.00 59.36 59.52 1j08 h GLU 128 Cb 0.40 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.91 1j08 h GLU 128 CO -0.06 0.64 0.04 0.28 -1.16 0.00 0.00 179.01 178.75 1j08 h VAL 129 N 0.63 1.23 0.00 3.13 2.07 -0.81 -2.45 116.25 120.05 1j08 h VAL 129 Ca 0.16 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1j08 h VAL 129 Cb 0.19 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1j08 h VAL 129 CO -0.01 0.33 0.00 0.77 0.02 0.00 0.00 177.57 178.67 1j08 h SER 130 N 0.72 0.00 1.13 0.57 4.64 -1.04 -2.39 113.55 117.18 1j08 h SER 130 Ca 0.15 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.32 1j08 h SER 130 Cb 0.39 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 1j08 h SER 130 CO 0.01 0.00 -0.91 0.11 -0.87 0.00 0.00 176.83 175.17 1j08 h LYS 131 N 0.00 0.00 -6.23 4.77 1.57 -1.44 -3.46 116.57 111.78 1j08 h LYS 131 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 1j08 h LYS 131 Cb 0.23 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.56 1j08 h LYS 131 CO 0.00 0.53 1.20 -0.89 -0.57 0.00 0.00 179.45 179.72 1j08 n ILE 132 N -3.14 0.56 -0.65 1.86 5.41 -0.90 -4.86 119.36 117.64 1j08 n ILE 132 Ca -0.03 -0.17 0.03 0.00 1.00 0.00 0.00 62.75 63.58 1j08 n ILE 132 Cb 0.82 -2.02 0.04 0.00 -0.71 0.00 0.00 39.64 37.77 1j08 n ILE 132 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1j08 n ASP 133 N 7.68 1.57 -4.76 4.38 2.03 -1.26 -4.83 116.55 121.36 1j08 n ASP 133 Ca 0.25 -2.13 -0.24 0.00 0.52 0.00 0.00 54.79 53.18 1j08 n ASP 133 Cb 0.33 -0.14 -0.06 0.00 -0.72 0.00 0.00 41.12 40.53 1j08 n ASP 133 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1j08 s LYS 134 N -1.24 2.74 -0.19 -0.67 1.02 -1.26 -5.04 119.74 115.10 1j08 s LYS 134 Ca 0.09 -1.04 -0.29 0.00 0.02 0.00 0.00 55.97 54.75 1j08 s LYS 134 Cb 0.08 -2.51 -0.03 0.00 -0.52 0.00 0.00 37.83 34.85 1j08 s LYS 134 CO 0.01 0.44 1.67 -0.51 -0.92 0.00 0.00 175.35 176.04 1j08 s ASP 135 N -3.38 6.36 -0.06 2.83 1.01 -1.26 -4.73 116.67 117.43 1j08 s ASP 135 Ca 0.31 1.76 0.05 0.00 0.71 0.00 0.00 52.55 55.38 1j08 s ASP 135 Cb -0.09 -2.53 -0.01 0.00 1.01 0.00 0.00 42.92 41.31 1j08 s ASP 135 CO 0.23 -1.25 -0.23 -0.69 0.21 0.00 0.00 175.17 173.43 1j08 s VAL 136 N 5.23 1.92 -0.15 -1.27 1.01 -0.65 0.59 120.40 127.08 1j08 s VAL 136 Ca 0.74 -0.98 -0.00 0.00 0.00 0.00 0.00 61.98 61.74 1j08 s VAL 136 Cb -0.27 -1.63 0.03 0.00 0.00 0.00 0.00 36.38 34.50 1j08 s VAL 136 CO 0.30 0.53 -0.09 -0.60 0.00 0.00 0.00 175.10 175.25 1j08 s ARG 137 N -0.02 1.75 -0.26 2.72 3.52 -0.41 -0.75 118.95 125.50 1j08 s ARG 137 Ca -0.07 -0.47 -0.08 0.00 -0.13 0.00 0.00 55.73 54.98 1j08 s ARG 137 Cb -0.14 -1.92 -0.03 0.00 -1.56 0.00 0.00 34.95 31.30 1j08 s ARG 137 CO 0.04 -0.32 0.10 0.42 -0.81 0.00 0.00 175.30 174.73 1j08 s ILE 138 N 1.60 4.54 -0.19 4.11 1.01 0.40 -0.50 121.20 132.17 1j08 s ILE 138 Ca 0.03 -0.13 -0.09 0.00 0.00 0.00 0.00 60.65 60.46 1j08 s ILE 138 Cb -0.14 -3.15 -0.05 0.00 0.01 0.00 0.00 42.46 39.13 1j08 s ILE 138 CO -0.09 0.29 0.11 -0.76 0.00 0.00 0.00 174.94 174.49 1j08 s LEU 139 N 1.64 4.08 -0.36 2.97 1.43 0.83 -0.17 118.68 129.10 1j08 s LEU 139 Ca 0.06 0.19 0.02 0.00 -1.03 0.00 0.00 54.13 53.38 1j08 s LEU 139 Cb -0.15 -2.04 0.11 0.00 0.03 0.00 0.00 46.19 44.13 1j08 s LEU 139 CO 0.05 0.19 0.11 -0.63 0.23 0.00 0.00 176.35 176.31 1j08 s ILE 140 N 0.27 1.81 -0.04 -0.59 1.09 -0.42 -0.66 121.20 122.66 1j08 s ILE 140 Ca 0.07 -2.21 -0.30 0.00 -1.10 0.00 0.00 60.65 57.11 1j08 s ILE 140 Cb -0.11 -2.33 -0.03 0.00 -1.06 0.00 0.00 42.46 38.92 1j08 s ILE 140 CO -0.01 -0.68 1.14 -0.36 -0.10 0.00 0.00 174.94 174.93 1j08 s PHE 141 N 0.91 3.35 0.21 3.97 0.08 0.04 -0.85 117.98 125.69 1j08 s PHE 141 Ca 0.12 1.36 -0.01 0.00 0.12 0.00 0.00 56.93 58.53 1j08 s PHE 141 Cb -0.20 -3.34 -0.04 0.00 -0.57 0.00 0.00 43.02 38.87 1j08 s PHE 141 CO -0.11 -0.94 0.13 0.14 -0.10 0.00 0.00 175.22 174.34 1j08 s VAL 142 N 1.83 0.03 0.13 -0.44 -7.23 0.16 -2.09 120.40 112.79 1j08 s VAL 142 Ca 0.54 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.76 1j08 s VAL 142 Cb -0.24 -2.51 -0.04 0.00 0.56 0.00 0.00 36.38 34.15 1j08 s VAL 142 CO 0.23 0.00 -0.11 0.42 -0.31 0.00 0.00 175.10 175.33 1j08 s THR 143 N -4.11 1.16 0.20 5.32 -4.23 -1.26 -0.84 115.64 111.87 1j08 s THR 143 Ca 0.39 -1.90 -0.10 0.00 -1.18 0.00 0.00 61.69 58.90 1j08 s THR 143 Cb 0.07 -1.67 0.12 0.00 1.34 0.00 0.00 72.50 72.36 1j08 s THR 143 CO 0.13 -0.64 1.78 -0.65 -0.54 0.00 0.00 174.62 174.70 1j08 h PRO 144 N 3.10 0.53 -0.00 3.99 0.11 -1.96 -3.02 132.00 134.74 1j08 h PRO 144 Ca -0.37 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1j08 h PRO 144 Cb 1.19 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1j08 h PRO 144 CO 0.58 0.35 -0.00 0.25 -0.21 0.00 0.00 178.00 178.97 1j08 n THR 145 N -4.88 0.00 -2.53 -1.15 -2.24 -1.26 -1.39 114.28 100.83 1j08 n THR 145 Ca 0.07 -0.08 -0.42 0.00 -2.27 0.00 0.00 64.05 61.36 1j08 n THR 145 Cb 0.20 -0.18 -0.03 0.00 -2.10 0.00 0.00 70.33 68.22 1j08 n THR 145 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j08 h PRO 147 N 10.03 0.00 0.00 0.00 0.13 -1.90 -3.12 132.00 137.14 1j08 h PRO 147 Ca -0.26 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.82 1j08 h PRO 147 Cb 1.06 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 1j08 h PRO 147 CO 1.20 0.11 -1.37 0.66 -0.23 0.00 0.00 178.00 178.37 1j08 n TYR 148 N -3.47 0.71 -0.33 1.56 4.01 -1.26 -4.35 117.16 114.03 1j08 n TYR 148 Ca -0.01 0.21 0.10 0.00 -0.16 0.00 0.00 57.90 58.04 1j08 n TYR 148 Cb 0.26 -0.88 0.27 0.00 -0.31 0.00 0.00 39.34 38.68 1j08 n TYR 148 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1j08 h PRO 150 N 0.72 0.64 -0.52 0.00 0.11 -1.76 -1.34 132.00 129.86 1j08 h PRO 150 Ca 0.52 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.57 1j08 h PRO 150 Cb 0.75 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.69 1j08 h PRO 150 CO -0.36 0.42 0.23 -0.07 -0.21 0.00 0.00 178.00 178.01 1j08 h LEU 151 N 0.66 0.66 0.05 2.35 3.38 -1.60 0.29 115.31 121.09 1j08 h LEU 151 Ca 0.27 -0.06 -0.26 0.00 0.09 0.00 0.00 57.88 57.92 1j08 h LEU 151 Cb 0.24 -0.17 0.02 0.00 0.09 0.00 0.00 40.66 40.85 1j08 h LEU 151 CO -0.08 0.57 -1.04 0.00 0.09 0.00 0.00 178.44 177.98 1j08 h ALA 152 N 1.53 0.06 -0.15 1.53 0.00 -1.31 -2.18 119.26 118.74 1j08 h ALA 152 Ca 0.18 -0.70 0.01 0.00 0.00 0.00 0.00 54.91 54.40 1j08 h ALA 152 Cb 0.10 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1j08 h ALA 152 CO -0.02 0.62 0.07 0.28 0.00 0.00 0.00 179.25 180.19 1j08 h VAL 153 N 0.24 0.99 -0.82 0.00 2.07 -0.89 -2.17 116.25 115.66 1j08 h VAL 153 Ca -0.14 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1j08 h VAL 153 Cb 1.71 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 32.28 1j08 h VAL 153 CO 0.20 0.03 0.44 0.03 0.02 0.00 0.00 177.57 178.29 1j08 h ARG 154 N 0.15 1.15 -0.03 1.57 2.47 -0.47 -1.82 114.38 117.40 1j08 h ARG 154 Ca 0.06 -0.14 -0.00 0.00 -1.26 0.00 0.00 59.98 58.64 1j08 h ARG 154 Cb 0.01 -0.22 -0.00 0.00 -1.65 0.00 0.00 29.97 28.11 1j08 h ARG 154 CO -0.04 0.85 0.02 1.98 0.56 0.00 0.00 179.97 183.34 1j08 h MET 155 N 1.15 0.04 -0.74 0.04 4.05 -1.14 -0.12 114.93 118.20 1j08 h MET 155 Ca 0.29 -0.00 0.04 0.00 -0.28 0.00 0.00 59.70 59.74 1j08 h MET 155 Cb 0.04 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 30.78 1j08 h MET 155 CO -0.05 0.07 0.46 0.00 0.23 0.00 0.00 176.91 177.63 1j08 h ALA 156 N 0.96 0.98 -0.28 0.39 0.00 -1.23 -1.83 119.26 118.26 1j08 h ALA 156 Ca 0.01 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1j08 h ALA 156 Cb 0.04 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1j08 h ALA 156 CO -0.00 0.24 -0.16 0.45 0.00 0.00 0.00 179.25 179.78 1j08 h HIS 157 N 0.89 0.52 -0.25 0.00 -0.00 -1.00 -1.30 115.15 114.02 1j08 h HIS 157 Ca 0.30 -0.09 -0.10 0.00 -0.00 0.00 0.00 60.37 60.49 1j08 h HIS 157 Cb 0.05 -0.14 -0.01 0.00 -0.00 0.00 0.00 27.41 27.31 1j08 h HIS 157 CO -0.04 0.62 -0.26 0.87 -0.00 0.00 0.00 177.93 179.11 1j08 h LYS 158 N 0.44 0.49 -0.61 2.45 1.57 -0.42 0.08 116.57 120.57 1j08 h LYS 158 Ca 0.08 -0.19 -0.08 0.00 -1.87 0.00 0.00 60.65 58.59 1j08 h LYS 158 Cb 0.53 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 1j08 h LYS 158 CO 0.03 0.72 0.09 0.74 -0.57 0.00 0.00 179.45 180.46 1j08 h PHE 159 N 0.43 1.09 -0.41 -1.35 0.04 -0.66 -0.86 116.94 115.21 1j08 h PHE 159 Ca 0.06 -0.16 -0.11 0.00 2.80 0.00 0.00 57.97 60.56 1j08 h PHE 159 Cb 0.69 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.53 1j08 h PHE 159 CO 0.02 0.93 -0.20 0.00 -0.60 0.00 0.00 178.31 178.47 1j08 h ALA 160 N 1.02 0.87 -0.28 2.45 0.00 -0.76 -2.08 119.26 120.48 1j08 h ALA 160 Ca 0.18 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 1j08 h ALA 160 Cb 0.44 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1j08 h ALA 160 CO 0.01 0.63 -0.12 0.82 0.00 0.00 0.00 179.25 180.59 1j08 h ILE 161 N 0.71 1.29 -0.78 0.00 2.04 -0.76 -2.26 117.51 117.76 1j08 h ILE 161 Ca 0.10 -1.21 -0.05 0.00 1.00 0.00 0.00 64.86 64.70 1j08 h ILE 161 Cb 0.72 1.48 -0.03 0.00 -0.74 0.00 0.00 36.82 38.25 1j08 h ILE 161 CO 0.06 0.38 0.28 -0.33 0.00 0.00 0.00 178.15 178.54 1j08 h GLU 162 N 0.33 1.19 -0.37 2.37 4.39 -1.10 -1.06 114.58 120.33 1j08 h GLU 162 Ca 0.06 -0.24 -0.09 0.00 0.34 0.00 0.00 59.36 59.44 1j08 h GLU 162 Cb 0.64 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 29.09 1j08 h GLU 162 CO 0.04 0.98 -0.13 -0.97 -1.16 0.00 0.00 179.01 177.77 1j08 h ASN 163 N 1.15 0.64 0.10 1.42 -0.73 -1.36 0.59 115.58 117.39 1j08 h ASN 163 Ca 0.26 -0.18 -0.00 0.00 1.87 0.00 0.00 56.30 58.24 1j08 h ASN 163 Cb 0.26 -0.17 0.00 0.00 0.27 0.00 0.00 38.32 38.68 1j08 h ASN 163 CO -0.01 0.79 -0.05 0.74 -0.37 0.00 0.00 177.43 178.53 1j08 h THR 164 N 0.59 1.06 -0.33 -3.57 2.02 -1.07 -1.45 112.91 110.16 1j08 h THR 164 Ca 0.10 -0.63 0.10 0.00 0.77 0.00 0.00 66.41 66.75 1j08 h THR 164 Cb 0.56 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.43 1j08 h THR 164 CO 0.04 0.15 0.24 0.50 0.37 0.00 0.00 175.52 176.82 1j08 h LYS 165 N -0.43 0.00 0.00 6.66 3.64 -0.97 0.38 116.57 125.85 1j08 h LYS 165 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1j08 h LYS 165 Cb 0.35 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1j08 h LYS 165 CO 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.20 1j08 n ALA 166 N -2.60 2.33 -0.84 5.00 0.00 0.18 -4.87 120.51 119.70 1j08 n ALA 166 Ca 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1j08 n ALA 166 Cb 0.41 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1j08 n ALA 166 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j08 n GLY 167 N 0.82 0.54 0.13 0.00 0.00 0.13 -4.93 105.19 101.89 1j08 n GLY 167 Ca 0.14 -0.34 -0.29 0.00 0.00 0.00 0.00 46.02 45.54 1j08 n GLY 167 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j08 n LYS 168 N -2.84 0.59 -3.52 1.61 4.76 -0.62 -5.01 118.16 113.12 1j08 n LYS 168 Ca 0.00 0.32 -0.26 0.00 -2.87 0.00 0.00 58.31 55.50 1j08 n LYS 168 Cb 0.00 -1.54 0.03 0.00 -1.84 0.00 0.00 35.03 31.69 1j08 n LYS 168 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1j08 n GLY 169 N 1.28 -0.51 0.50 0.72 0.00 -0.76 -4.90 105.19 101.52 1j08 n GLY 169 Ca -0.51 0.17 0.06 0.00 0.00 0.00 0.00 46.02 45.74 1j08 n GLY 169 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j08 n LYS 170 N -4.43 1.12 -3.83 1.61 5.02 -1.26 -4.95 118.16 111.44 1j08 n LYS 170 Ca -0.01 -1.39 -0.36 0.00 -2.02 0.00 0.00 58.31 54.53 1j08 n LYS 170 Cb 0.56 -1.23 -0.12 0.00 -0.02 0.00 0.00 35.03 34.22 1j08 n LYS 170 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1j08 s ILE 171 N -0.95 4.42 -0.19 -0.18 1.01 -1.26 -1.63 121.20 122.41 1j08 s ILE 171 Ca 0.16 -0.14 -0.07 0.00 0.00 0.00 0.00 60.65 60.60 1j08 s ILE 171 Cb 0.10 -3.05 -0.04 0.00 0.01 0.00 0.00 42.46 39.49 1j08 s ILE 171 CO 0.15 0.36 0.04 -0.76 0.00 0.00 0.00 174.94 174.73 1j08 s LEU 172 N 1.34 3.62 -0.35 2.97 1.43 0.07 -4.51 118.68 123.25 1j08 s LEU 172 Ca 0.05 -0.02 -0.08 0.00 -1.03 0.00 0.00 54.13 53.06 1j08 s LEU 172 Cb -0.15 -1.92 0.04 0.00 0.03 0.00 0.00 46.19 44.19 1j08 s LEU 172 CO 0.04 0.14 0.13 -0.83 0.23 0.00 0.00 176.35 176.05 1j08 s GLY 173 N 0.59 1.87 -0.34 -3.19 0.00 0.88 -0.45 107.32 106.67 1j08 s GLY 173 Ca 0.02 -1.74 0.00 0.00 0.00 0.00 0.00 44.72 43.00 1j08 s GLY 173 CO 0.02 0.79 0.07 0.99 0.00 0.00 0.00 173.10 174.97 1j08 s ASP 174 N 1.44 4.92 0.10 1.64 1.11 0.76 -1.70 116.67 124.94 1j08 s ASP 174 Ca -0.01 -1.82 -0.31 0.00 0.18 0.00 0.00 52.55 50.60 1j08 s ASP 174 Cb -0.19 -1.70 -0.07 0.00 1.07 0.00 0.00 42.92 42.03 1j08 s ASP 174 CO 0.04 -0.38 1.24 -0.32 1.18 0.00 0.00 175.17 176.93 1j08 s MET 175 N 1.08 4.42 -0.19 8.23 -2.45 -0.78 -1.30 119.30 128.30 1j08 s MET 175 Ca 0.04 1.86 0.01 0.00 -1.25 0.00 0.00 55.69 56.35 1j08 s MET 175 Cb -0.21 -3.30 0.04 0.00 1.25 0.00 0.00 34.83 32.61 1j08 s MET 175 CO -0.05 -0.27 -0.13 0.08 1.05 0.00 0.00 175.02 175.71 1j08 s VAL 176 N 0.87 1.77 -0.66 10.11 1.01 -0.03 0.18 120.40 133.66 1j08 s VAL 176 Ca 0.59 -1.01 -0.27 0.00 0.00 0.00 0.00 61.98 61.29 1j08 s VAL 176 Cb -0.32 -1.77 0.01 0.00 0.00 0.00 0.00 36.38 34.31 1j08 s VAL 176 CO 0.31 0.27 1.44 -0.70 0.00 0.00 0.00 175.10 176.42 1j08 s GLU 177 N 1.36 3.10 0.38 2.72 -6.30 -0.18 -0.66 118.70 119.12 1j08 s GLU 177 Ca 0.00 0.14 0.15 0.00 -2.50 0.00 0.00 54.97 52.77 1j08 s GLU 177 Cb -0.15 -4.21 1.01 0.00 0.00 0.00 0.00 34.13 30.78 1j08 s GLU 177 CO -0.09 -2.21 1.80 0.00 0.02 0.00 0.00 175.26 174.78 1j08 h ALA 178 N 11.38 2.09 -0.14 6.30 0.00 -1.29 -0.03 119.26 137.58 1j08 h ALA 178 Ca -0.27 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.58 1j08 h ALA 178 Cb 1.09 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1j08 h ALA 178 CO 1.24 -0.45 -0.41 0.82 0.00 0.00 0.00 179.25 180.44 1j08 h ILE 179 N 0.49 1.31 0.00 0.00 1.08 -1.90 -2.94 117.51 115.55 1j08 h ILE 179 Ca 0.55 -1.55 -0.19 0.00 -0.39 0.00 0.00 64.86 63.28 1j08 h ILE 179 Cb 1.25 1.66 -0.03 0.00 -3.07 0.00 0.00 36.82 36.64 1j08 h ILE 179 CO -0.28 0.47 -0.91 -0.08 -0.69 0.00 0.00 178.15 176.66 1j08 h GLU 180 N 0.26 0.00 -2.25 2.37 4.57 -1.43 -3.36 114.58 114.74 1j08 h GLU 180 Ca 0.02 0.00 -0.61 0.00 -1.18 0.00 0.00 59.36 57.59 1j08 h GLU 180 Cb 0.84 0.00 -0.41 0.00 -0.16 0.00 0.00 28.75 29.02 1j08 h GLU 180 CO 0.07 0.91 -0.52 0.66 -1.18 0.00 0.00 179.01 178.95 1j08 n TYR 181 N -3.43 3.68 -0.22 0.92 4.01 -0.43 -4.93 117.16 116.76 1j08 n TYR 181 Ca -0.00 -4.03 -0.01 0.00 -0.16 0.00 0.00 57.90 53.70 1j08 n TYR 181 Cb 0.87 -0.58 0.10 0.00 -0.31 0.00 0.00 39.34 39.42 1j08 n TYR 181 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1j08 h PRO 182 N 3.96 0.58 -0.56 -0.72 0.13 -1.69 0.14 132.00 133.83 1j08 h PRO 182 Ca 0.19 -0.03 -0.08 0.00 -0.87 0.00 0.00 66.00 65.21 1j08 h PRO 182 Cb 0.62 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.60 1j08 h PRO 182 CO 0.86 0.38 0.06 0.93 -0.23 0.00 0.00 178.00 180.00 1j08 h GLU 183 N 0.60 0.96 -0.43 0.86 3.07 -1.92 0.33 114.58 118.06 1j08 h GLU 183 Ca 0.30 -0.28 -0.06 0.00 -0.50 0.00 0.00 59.36 58.82 1j08 h GLU 183 Cb 0.25 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.04 1j08 h GLU 183 CO -0.22 0.93 0.01 2.35 -1.40 0.00 0.00 179.01 180.69 1j08 h TRP 184 N 0.85 0.81 -0.56 4.33 7.01 -1.87 -0.35 115.95 126.16 1j08 h TRP 184 Ca 0.17 -0.13 -0.04 0.00 2.11 0.00 0.00 58.89 60.99 1j08 h TRP 184 Cb 0.46 -0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 27.29 1j08 h TRP 184 CO 0.03 0.80 0.19 0.00 -2.79 0.00 0.00 178.44 176.67 1j08 h ALA 185 N 0.90 0.74 -0.81 2.65 0.00 -0.77 -2.56 119.26 119.41 1j08 h ALA 185 Ca 0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1j08 h ALA 185 Cb 0.47 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1j08 h ALA 185 CO 0.02 0.38 0.47 -0.44 0.00 0.00 0.00 179.25 179.69 1j08 h ASP 186 N 0.78 0.99 -0.73 0.00 3.45 -0.07 -1.53 116.42 119.32 1j08 h ASP 186 Ca 0.18 -0.07 0.08 0.00 0.43 0.00 0.00 57.03 57.66 1j08 h ASP 186 Cb 0.26 -0.25 -0.05 0.00 -0.56 0.00 0.00 39.33 38.73 1j08 h ASP 186 CO -0.01 0.78 0.48 -0.61 -1.57 0.00 0.00 179.24 178.30 1j08 h GLN 187 N 1.13 0.66 -0.60 3.56 4.15 -0.64 -1.71 115.11 121.65 1j08 h GLN 187 Ca 0.29 -0.04 -0.25 0.00 0.77 0.00 0.00 58.65 59.42 1j08 h GLN 187 Cb -0.02 -0.15 -0.15 0.00 0.21 0.00 0.00 27.48 27.38 1j08 h GLN 187 CO -0.05 0.43 0.21 0.66 -1.93 0.00 0.00 178.83 178.15 1j08 n TYR 188 N -4.49 1.92 -4.28 3.99 4.01 -0.87 -4.95 117.16 112.48 1j08 n TYR 188 Ca 0.11 -1.46 -0.31 0.00 -0.16 0.00 0.00 57.90 56.08 1j08 n TYR 188 Cb 0.29 -0.63 -0.09 0.00 -0.31 0.00 0.00 39.34 38.60 1j08 n TYR 188 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1j08 n ASN 189 N -0.80 0.59 -4.73 7.72 3.02 -0.64 -4.88 115.26 115.54 1j08 n ASN 189 Ca 0.40 -1.26 -0.41 0.00 -0.03 0.00 0.00 54.58 53.28 1j08 n ASN 189 Cb 1.27 -1.71 -0.04 0.00 -0.61 0.00 0.00 39.78 38.69 1j08 n ASN 189 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1j08 s VAL 190 N -4.31 4.44 0.00 2.41 1.01 -0.63 -4.87 120.40 118.45 1j08 s VAL 190 Ca 0.03 1.99 0.00 0.00 0.00 0.00 0.00 61.98 64.00 1j08 s VAL 190 Cb -0.01 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 32.09 1j08 s VAL 190 CO 0.99 0.29 0.00 0.80 0.00 0.00 0.00 175.10 177.18 1j08 n MET 191 N 2.90 0.00 -2.63 2.72 1.56 -1.26 -4.84 117.12 115.57 1j08 n MET 191 Ca 0.03 0.00 -0.38 0.00 -0.27 0.00 0.00 57.70 57.08 1j08 n MET 191 Cb 0.49 0.00 -0.05 0.00 2.15 0.00 0.00 33.22 35.81 1j08 n MET 191 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1j08 s ALA 192 N -1.85 3.24 0.16 -5.12 0.00 -1.26 -5.06 121.76 111.88 1j08 s ALA 192 Ca 0.00 0.68 0.09 0.00 0.00 0.00 0.00 51.96 52.73 1j08 s ALA 192 Cb 0.00 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 1j08 s ALA 192 CO 0.00 -0.01 -0.20 0.14 0.00 0.00 0.00 175.76 175.69 1j08 s VAL 193 N -1.44 1.96 0.40 0.00 -7.23 -1.26 -4.22 120.40 108.61 1j08 s VAL 193 Ca 0.49 -1.89 -0.20 0.00 -1.81 0.00 0.00 61.98 58.57 1j08 s VAL 193 Cb -0.24 -1.88 -0.11 0.00 0.56 0.00 0.00 36.38 34.71 1j08 s VAL 193 CO 0.30 -0.21 0.91 -2.16 -0.31 0.00 0.00 175.10 173.63 1j08 s PRO 194 N -2.62 4.21 -0.18 4.82 0.04 -1.26 -4.72 135.00 135.29 1j08 s PRO 194 Ca 0.16 1.05 0.01 0.00 0.04 0.00 0.00 61.00 62.26 1j08 s PRO 194 Cb -0.07 -2.27 0.02 0.00 0.04 0.00 0.00 34.50 32.23 1j08 s PRO 194 CO 0.07 0.02 -0.18 0.21 0.04 0.00 0.00 177.00 177.16 1j08 s LYS 195 N -3.07 2.82 -0.12 4.56 2.20 -0.89 -0.69 119.74 124.55 1j08 s LYS 195 Ca 0.60 -0.84 -0.08 0.00 -0.36 0.00 0.00 55.97 55.28 1j08 s LYS 195 Cb -0.10 -2.53 -0.04 0.00 -1.51 0.00 0.00 37.83 33.64 1j08 s LYS 195 CO 0.14 -0.25 0.17 0.42 -0.36 0.00 0.00 175.35 175.48 1j08 s ILE 196 N 1.30 5.44 -0.10 5.43 1.09 -0.13 -0.78 121.20 133.46 1j08 s ILE 196 Ca 0.04 0.29 0.00 0.00 -1.10 0.00 0.00 60.65 59.88 1j08 s ILE 196 Cb -0.14 -3.45 0.02 0.00 -1.06 0.00 0.00 42.46 37.83 1j08 s ILE 196 CO -0.12 0.58 -0.09 -0.69 -0.10 0.00 0.00 174.94 174.53 1j08 s VAL 197 N -0.80 1.03 -0.27 2.92 1.01 0.16 -1.62 120.40 122.83 1j08 s VAL 197 Ca 0.15 -0.33 -0.05 0.00 0.00 0.00 0.00 61.98 61.75 1j08 s VAL 197 Cb -0.12 -1.02 0.01 0.00 0.00 0.00 0.00 36.38 35.25 1j08 s VAL 197 CO 0.04 0.36 0.02 -0.63 0.00 0.00 0.00 175.10 174.89 1j08 s ILE 198 N 1.40 3.56 0.10 2.22 1.01 0.20 -0.12 121.20 129.56 1j08 s ILE 198 Ca -0.01 -0.76 0.03 0.00 0.00 0.00 0.00 60.65 59.91 1j08 s ILE 198 Cb -0.13 -2.80 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 1j08 s ILE 198 CO -0.05 0.16 0.10 -1.10 0.00 0.00 0.00 174.94 174.06 1j08 s GLN 199 N 1.44 2.92 -0.05 2.79 -0.21 0.34 -0.65 119.66 126.25 1j08 s GLN 199 Ca 0.02 -0.71 -0.00 0.00 0.02 0.00 0.00 55.36 54.69 1j08 s GLN 199 Cb -0.17 -2.73 0.03 0.00 1.00 0.00 0.00 33.01 31.14 1j08 s GLN 199 CO -0.00 0.55 -0.01 0.08 -2.12 0.00 0.00 175.29 173.79 1j08 s VAL 200 N -1.48 0.35 -1.61 1.09 1.01 -0.56 -1.29 120.40 117.91 1j08 s VAL 200 Ca 0.30 0.06 -0.00 0.00 0.00 0.00 0.00 61.98 62.34 1j08 s VAL 200 Cb -0.12 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.80 1j08 s VAL 200 CO 0.23 0.22 0.02 0.59 0.00 0.00 0.00 175.10 176.15 1j08 n ASN 201 N 4.60 -5.46 0.00 3.32 5.03 0.20 -1.63 115.26 121.32 1j08 n ASN 201 Ca -0.17 0.02 0.00 0.00 0.87 0.00 0.00 54.58 55.31 1j08 n ASN 201 Cb 0.50 -4.56 0.00 0.00 -1.02 0.00 0.00 39.78 34.71 1j08 n ASN 201 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1j08 n GLY 202 N -0.98 0.76 3.39 7.41 0.00 -1.26 -5.04 105.19 109.46 1j08 n GLY 202 Ca -0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 1j08 n GLY 202 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j08 s GLU 203 N -0.23 2.71 0.27 1.61 0.41 -0.64 -5.08 118.70 117.74 1j08 s GLU 203 Ca 0.00 -0.76 -0.30 0.00 -0.41 0.00 0.00 54.97 53.50 1j08 s GLU 203 Cb 0.00 -2.37 -0.11 0.00 -1.78 0.00 0.00 34.13 29.87 1j08 s GLU 203 CO 0.00 0.46 1.55 -0.51 -0.49 0.00 0.00 175.26 176.27 1j08 s ASP 204 N -0.32 6.48 0.00 -0.19 1.01 -1.26 -1.50 116.67 120.88 1j08 s ASP 204 Ca 0.02 2.83 0.00 0.00 0.71 0.00 0.00 52.55 56.12 1j08 s ASP 204 Cb -0.13 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.18 1j08 s ASP 204 CO 0.02 -0.84 0.00 0.29 0.21 0.00 0.00 175.17 174.85 1j08 n LYS 205 N 2.42 0.00 -4.23 8.23 4.76 0.17 -4.90 118.16 124.62 1j08 n LYS 205 Ca 0.08 0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.36 1j08 n LYS 205 Cb 0.38 -0.42 -0.14 0.00 -1.84 0.00 0.00 35.03 33.02 1j08 n LYS 205 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1j08 s VAL 206 N -1.98 0.66 -0.02 -0.18 1.01 -0.95 -4.94 120.40 114.00 1j08 s VAL 206 Ca 0.00 -0.63 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 1j08 s VAL 206 Cb 0.00 -0.61 0.01 0.00 0.00 0.00 0.00 36.38 35.77 1j08 s VAL 206 CO 0.00 -0.01 0.05 -1.10 0.00 0.00 0.00 175.10 174.04 1j08 s GLN 207 N -0.71 0.06 0.29 2.72 -0.21 -1.26 0.58 119.66 121.13 1j08 s GLN 207 Ca -0.01 0.07 -0.20 0.00 0.02 0.00 0.00 55.36 55.24 1j08 s GLN 207 Cb -0.06 0.03 0.03 0.00 1.00 0.00 0.00 33.01 34.01 1j08 s GLN 207 CO 0.00 -0.01 0.74 -0.59 -2.12 0.00 0.00 175.29 173.32 1j08 s PHE 208 N 0.03 -0.13 0.08 0.91 -0.71 -0.64 -5.01 117.98 112.51 1j08 s PHE 208 Ca -0.00 -0.36 0.09 0.00 -1.04 0.00 0.00 56.93 55.62 1j08 s PHE 208 Cb -0.00 0.73 -0.03 0.00 -1.21 0.00 0.00 43.02 42.51 1j08 s PHE 208 CO 0.00 -1.29 -0.23 -1.21 -1.34 0.00 0.00 175.22 171.15 1j08 s GLU 209 N -3.61 1.39 0.00 1.99 2.02 -1.26 -0.95 118.70 118.28 1j08 s GLU 209 Ca 0.12 -1.13 0.00 0.00 0.02 0.00 0.00 54.97 53.97 1j08 s GLU 209 Cb -0.06 -1.66 0.00 0.00 0.10 0.00 0.00 34.13 32.52 1j08 s GLU 209 CO 0.08 0.41 0.00 0.41 0.02 0.00 0.00 175.26 176.17 1j08 n GLY 210 N 1.39 2.03 3.56 -1.39 0.00 0.13 -4.84 105.19 106.08 1j08 n GLY 210 Ca -0.18 -1.78 -0.43 0.00 0.00 0.00 0.00 46.02 43.64 1j08 n GLY 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j08 s ALA 211 N -2.39 3.21 0.31 4.61 0.00 -1.26 -4.83 121.76 121.41 1j08 s ALA 211 Ca 0.00 -2.76 -0.29 0.00 0.00 0.00 0.00 51.96 48.90 1j08 s ALA 211 Cb 0.00 -4.54 -0.11 0.00 0.00 0.00 0.00 23.12 18.47 1j08 s ALA 211 CO 0.00 -3.33 1.52 0.71 0.00 0.00 0.00 175.76 174.66 1j08 s TYR 212 N 4.13 2.78 0.89 0.00 1.51 -1.26 -4.93 117.35 120.47 1j08 s TYR 212 Ca 0.50 0.96 -0.10 0.00 -1.01 0.00 0.00 57.07 57.42 1j08 s TYR 212 Cb 0.02 -3.99 0.13 0.00 -0.11 0.00 0.00 41.96 38.02 1j08 s TYR 212 CO 0.01 -3.16 1.15 -2.14 -1.11 0.00 0.00 175.55 170.30 1j08 s PRO 213 N -0.95 1.15 0.15 -1.71 0.02 -1.26 -4.43 135.00 127.97 1j08 s PRO 213 Ca 0.59 1.55 -0.29 0.00 0.02 0.00 0.00 61.00 62.86 1j08 s PRO 213 Cb -0.46 -1.74 -0.07 0.00 0.02 0.00 0.00 34.50 32.25 1j08 s PRO 213 CO 0.51 -2.53 1.51 -1.91 -0.33 0.00 0.00 177.00 174.25 1j08 n GLU 214 N -4.10 -0.42 -0.19 5.54 2.13 -1.26 -0.95 120.64 121.40 1j08 n GLU 214 Ca 0.12 1.48 -0.00 0.00 0.66 0.00 0.00 57.16 59.42 1j08 n GLU 214 Cb 0.52 -2.18 0.09 0.00 0.27 0.00 0.00 31.44 30.14 1j08 n GLU 214 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1j08 h LYS 215 N 0.00 0.26 -0.37 5.31 1.79 -1.99 0.71 116.57 122.28 1j08 h LYS 215 Ca 0.15 -0.02 -0.09 0.00 -2.18 0.00 0.00 60.65 58.52 1j08 h LYS 215 Cb 0.39 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.97 1j08 h LYS 215 CO -0.89 0.17 -0.11 0.52 -1.08 0.00 0.00 179.45 178.06 1j08 h MET 216 N 0.27 0.72 -0.28 3.15 2.86 -1.69 -1.71 114.93 118.25 1j08 h MET 216 Ca 0.29 -0.29 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1j08 h MET 216 Cb 0.41 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 1j08 h MET 216 CO -0.36 0.88 0.18 0.35 1.06 0.00 0.00 176.91 179.02 1j08 h PHE 217 N 0.52 0.33 -1.00 -0.22 3.04 -0.59 -2.06 116.94 116.96 1j08 h PHE 217 Ca 0.09 0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.10 1j08 h PHE 217 Cb 0.63 -0.11 -0.06 0.00 2.56 0.00 0.00 35.95 38.97 1j08 h PHE 217 CO 0.05 0.20 0.65 1.25 -2.02 0.00 0.00 178.31 178.44 1j08 h LEU 218 N 0.36 1.05 -0.72 0.59 5.85 -0.75 -2.08 115.31 119.61 1j08 h LEU 218 Ca 0.11 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.79 1j08 h LEU 218 Cb -0.02 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 1j08 h LEU 218 CO -0.04 0.69 0.28 -0.33 -0.34 0.00 0.00 178.44 178.70 1j08 h GLU 219 N 1.20 1.08 -0.72 1.25 5.08 -0.72 -0.65 114.58 121.09 1j08 h GLU 219 Ca 0.42 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.54 1j08 h GLU 219 Cb 0.10 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 1j08 h GLU 219 CO -0.15 0.89 0.33 0.87 -1.00 0.00 0.00 179.01 179.95 1j08 h LYS 220 N 1.03 1.05 -0.26 2.33 1.79 -0.84 0.15 116.57 121.82 1j08 h LYS 220 Ca 0.24 -0.17 -0.01 0.00 -2.18 0.00 0.00 60.65 58.53 1j08 h LYS 220 Cb 0.23 -0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 30.68 1j08 h LYS 220 CO -0.02 0.84 0.13 1.25 -1.08 0.00 0.00 179.45 180.57 1j08 h LEU 221 N 1.02 0.34 -1.08 2.94 5.85 -0.96 -0.59 115.31 122.83 1j08 h LEU 221 Ca 0.25 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 1j08 h LEU 221 Cb 0.15 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 1j08 h LEU 221 CO -0.03 0.35 0.17 -0.07 -0.34 0.00 0.00 178.44 178.53 1j08 h LEU 222 N 0.30 0.76 -0.91 2.25 3.38 -0.80 -2.18 115.31 118.11 1j08 h LEU 222 Ca 0.09 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1j08 h LEU 222 Cb 0.10 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1j08 h LEU 222 CO -0.01 0.72 0.16 -1.28 0.09 0.00 0.00 178.44 178.12 1j08 h SER 223 N 0.81 0.90 -0.25 -0.43 0.87 -0.25 -2.43 113.55 112.77 1j08 h SER 223 Ca 0.18 -0.17 -0.02 0.00 -1.23 0.00 0.00 61.79 60.55 1j08 h SER 223 Cb 0.24 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 1j08 h SER 223 CO -0.01 0.87 0.10 0.00 -0.53 0.00 0.00 176.83 177.27 1j08 h ALA 224 N 1.25 1.61 -0.01 6.23 0.00 -0.47 -0.32 119.26 127.54 1j08 h ALA 224 Ca 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1j08 h ALA 224 Cb 0.32 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1j08 h ALA 224 CO -0.00 0.30 -0.08 1.28 0.00 0.00 0.00 179.25 180.76 1j08 n LEU 225 N -4.39 0.80 0.00 0.00 4.77 -0.97 -4.91 117.00 112.30 1j08 n LEU 225 Ca 0.01 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1j08 n LEU 225 Cb 0.15 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1j08 n LEU 225 CO 0.37 0.14 0.00 -1.20 -1.33 0.00 0.00 177.39 175.36