#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j08 n LEU 3 N 0.00 0.51 -4.35 0.99 7.94 -1.26 -5.06 117.00 115.76 1j08 n LEU 3 Ca 0.00 0.00 -0.33 0.00 -1.11 0.00 0.00 56.01 54.57 1j08 n LEU 3 Cb 0.00 0.00 -0.15 0.00 0.53 0.00 0.00 43.42 43.80 1j08 n LEU 3 CO 0.00 0.08 -0.47 -0.63 -1.11 0.00 0.00 177.39 175.26 1j08 s ILE 4 N -1.27 2.84 1.09 1.96 1.01 -1.26 -5.12 121.20 120.44 1j08 s ILE 4 Ca 0.00 -0.75 -0.15 0.00 0.00 0.00 0.00 60.65 59.75 1j08 s ILE 4 Cb 0.00 -2.16 0.23 0.00 0.01 0.00 0.00 42.46 40.54 1j08 s ILE 4 CO 0.00 0.54 1.10 -0.94 0.00 0.00 0.00 174.94 175.64 1j08 s SER 5 N 0.21 1.86 0.10 3.58 1.04 -1.26 -4.86 113.70 114.37 1j08 s SER 5 Ca -0.10 0.92 -0.14 0.00 0.48 0.00 0.00 55.95 57.11 1j08 s SER 5 Cb -0.16 -1.40 -0.11 0.00 0.10 0.00 0.00 66.02 64.45 1j08 s SER 5 CO 0.06 -3.57 1.37 -0.33 0.98 0.00 0.00 173.24 171.74 1j08 h GLU 6 N -2.20 0.73 -0.43 4.02 4.39 -2.00 -2.45 114.58 116.65 1j08 h GLU 6 Ca -0.51 -0.46 -0.04 0.00 0.34 0.00 0.00 59.36 58.70 1j08 h GLU 6 Cb 1.32 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 30.00 1j08 h GLU 6 CO 0.48 1.08 0.10 0.93 -1.16 0.00 0.00 179.01 180.44 1j08 h GLU 7 N 0.46 0.63 0.01 2.33 5.08 -2.00 -2.72 114.58 118.37 1j08 h GLU 7 Ca 0.01 -0.11 -0.23 0.00 -1.00 0.00 0.00 59.36 58.04 1j08 h GLU 7 Cb 1.04 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1j08 h GLU 7 CO 0.10 0.58 -0.96 -0.44 -1.00 0.00 0.00 179.01 177.30 1j08 h ASP 8 N 0.62 0.49 -0.28 1.42 3.32 -1.93 -2.51 116.42 117.55 1j08 h ASP 8 Ca 0.14 -0.40 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 1j08 h ASP 8 Cb 0.24 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1j08 h ASP 8 CO -0.00 1.21 0.14 0.11 -1.72 0.00 0.00 179.24 178.98 1j08 h LYS 9 N 0.20 0.45 -0.19 3.56 1.57 -1.21 0.23 116.57 121.18 1j08 h LYS 9 Ca -0.08 -0.05 -0.19 0.00 -1.87 0.00 0.00 60.65 58.46 1j08 h LYS 9 Cb 1.60 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 33.82 1j08 h LYS 9 CO 0.16 0.36 -0.64 -0.09 -0.57 0.00 0.00 179.45 178.68 1j08 h ARG 10 N 0.45 0.76 -0.51 3.15 2.43 -1.41 -1.84 114.38 117.41 1j08 h ARG 10 Ca 0.11 -0.57 -0.06 0.00 -0.81 0.00 0.00 59.98 58.66 1j08 h ARG 10 Cb 0.07 0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 1j08 h ARG 10 CO -0.01 1.19 0.10 0.82 -1.51 0.00 0.00 179.97 180.55 1j08 h ILE 11 N 0.49 1.25 0.09 1.20 1.08 -0.89 -1.40 117.51 119.33 1j08 h ILE 11 Ca -0.03 -0.90 -0.00 0.00 -0.39 0.00 0.00 64.86 63.54 1j08 h ILE 11 Cb 1.26 0.85 0.00 0.00 -3.07 0.00 0.00 36.82 35.86 1j08 h ILE 11 CO 0.13 0.32 -0.04 0.40 -0.69 0.00 0.00 178.15 178.27 1j08 h ILE 12 N 0.72 0.95 -0.24 -0.67 2.04 -0.55 0.25 117.51 120.01 1j08 h ILE 12 Ca 0.16 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1j08 h ILE 12 Cb 0.37 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1j08 h ILE 12 CO 0.01 0.04 0.14 0.11 0.00 0.00 0.00 178.15 178.44 1j08 h LYS 13 N -0.19 0.32 0.11 2.37 1.57 -1.27 0.08 116.57 119.56 1j08 h LYS 13 Ca -0.01 -0.03 -0.27 0.00 -1.87 0.00 0.00 60.65 58.46 1j08 h LYS 13 Cb 0.16 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.41 1j08 h LYS 13 CO 0.02 0.27 -1.19 0.93 -0.57 0.00 0.00 179.45 178.92 1j08 h GLU 14 N 0.28 0.42 0.18 3.15 5.08 -1.25 0.75 114.58 123.21 1j08 h GLU 14 Ca 0.08 -0.60 -0.29 0.00 -1.00 0.00 0.00 59.36 57.55 1j08 h GLU 14 Cb 0.04 0.20 0.02 0.00 0.50 0.00 0.00 28.75 29.51 1j08 h GLU 14 CO -0.01 1.25 -1.38 0.93 -1.00 0.00 0.00 179.01 178.79 1j08 h GLU 15 N 0.17 0.39 0.00 2.33 4.39 -0.54 -3.42 114.58 117.90 1j08 h GLU 15 Ca -0.15 -0.66 0.00 0.00 0.34 0.00 0.00 59.36 58.89 1j08 h GLU 15 Cb 1.87 0.25 0.00 0.00 -0.10 0.00 0.00 28.75 30.77 1j08 h GLU 15 CO 0.21 1.32 0.00 1.19 -1.16 0.00 0.00 179.01 180.57 1j08 n PHE 16 N -3.83 0.00 -0.39 4.33 3.01 -0.09 -4.74 117.46 115.75 1j08 n PHE 16 Ca -0.20 0.00 0.39 0.00 1.01 0.00 0.00 57.45 58.65 1j08 n PHE 16 Cb 0.99 0.00 0.76 0.00 -0.01 0.00 0.00 39.48 41.22 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 -1.00 -1.37 0.33 116.94 116.28 1j08 h PHE 17 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1j08 h PHE 17 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 1j08 h PHE 17 CO 0.00 0.00 0.00 0.66 -1.61 0.00 0.00 178.31 177.36 1j08 h SER 18 N 0.00 0.00 0.60 2.17 4.64 -1.05 -2.57 113.55 117.34 1j08 h SER 18 Ca 0.63 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.95 1j08 h SER 18 Cb 2.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.65 1j08 h SER 18 CO -0.01 0.00 -0.44 0.29 -0.87 0.00 0.00 176.83 175.80 1j08 n LYS 19 N -2.97 0.03 -1.15 4.77 4.01 0.12 -4.96 118.16 118.02 1j08 n LYS 19 Ca 0.00 0.01 -0.34 0.00 -0.51 0.00 0.00 58.31 57.47 1j08 n LYS 19 Cb 0.26 -1.52 0.12 0.00 -0.51 0.00 0.00 35.03 33.38 1j08 n LYS 19 CO 0.00 0.00 0.00 -1.33 -1.11 0.00 0.00 177.40 174.96 1j08 n MET 20 N -1.56 0.23 0.00 1.97 2.81 -0.97 -4.94 117.12 114.66 1j08 n MET 20 Ca 0.05 0.15 0.00 0.00 -1.81 0.00 0.00 57.70 56.09 1j08 n MET 20 Cb 0.35 -2.33 0.00 0.00 -0.71 0.00 0.00 33.22 30.52 1j08 n MET 20 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1j08 n VAL 21 N -3.11 0.00 -2.67 2.03 0.31 -1.26 -5.04 118.33 108.59 1j08 n VAL 21 Ca 0.13 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.13 1j08 n VAL 21 Cb 0.50 -0.42 -0.06 0.00 -0.91 0.00 0.00 33.84 32.96 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 0.33 6.77 0.65 4.52 0.01 -0.88 -5.02 114.94 121.32 1j08 s ASN 22 Ca 0.00 1.69 -0.17 0.00 -0.71 0.00 0.00 52.86 53.67 1j08 s ASN 22 Cb 0.00 -2.53 -0.00 0.00 0.41 0.00 0.00 41.25 39.12 1j08 s ASN 22 CO 0.00 -0.48 1.19 -2.16 -1.51 0.00 0.00 177.10 174.14 1j08 s PRO 23 N -3.42 2.64 -0.02 -0.60 0.04 -1.26 -4.64 135.00 127.72 1j08 s PRO 23 Ca 0.62 1.74 0.05 0.00 0.04 0.00 0.00 61.00 63.45 1j08 s PRO 23 Cb -0.10 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.53 1j08 s PRO 23 CO 0.19 -1.45 -0.18 0.08 0.04 0.00 0.00 177.00 175.68 1j08 s VAL 24 N -1.85 1.43 -0.14 -0.36 1.01 0.12 -1.22 120.40 119.39 1j08 s VAL 24 Ca 0.75 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.98 1j08 s VAL 24 Cb -0.28 -1.20 0.02 0.00 0.00 0.00 0.00 36.38 34.91 1j08 s VAL 24 CO 0.39 0.41 -0.17 -0.75 0.00 0.00 0.00 175.10 174.98 1j08 s LYS 25 N -0.29 2.51 -0.58 2.72 2.20 0.62 -1.11 119.74 125.81 1j08 s LYS 25 Ca 0.04 -0.65 -0.22 0.00 -0.36 0.00 0.00 55.97 54.78 1j08 s LYS 25 Cb -0.08 -2.18 0.06 0.00 -1.51 0.00 0.00 37.83 34.13 1j08 s LYS 25 CO 0.00 -0.14 0.84 -0.51 -0.36 0.00 0.00 175.35 175.18 1j08 s LEU 26 N 1.19 4.61 -0.42 5.43 1.43 0.47 -2.01 118.68 129.38 1j08 s LEU 26 Ca -0.01 -0.87 -0.20 0.00 -1.03 0.00 0.00 54.13 52.02 1j08 s LEU 26 Cb -0.14 -2.51 0.02 0.00 0.03 0.00 0.00 46.19 43.59 1j08 s LEU 26 CO -0.07 -1.20 0.61 -0.63 0.23 0.00 0.00 176.35 175.28 1j08 s ILE 27 N 3.47 4.88 -0.17 -0.59 1.01 -0.90 -1.48 121.20 127.43 1j08 s ILE 27 Ca 0.21 0.13 -0.06 0.00 0.00 0.00 0.00 60.65 60.93 1j08 s ILE 27 Cb -0.17 -4.15 -0.03 0.00 0.01 0.00 0.00 42.46 38.11 1j08 s ILE 27 CO 0.12 -0.51 0.02 -0.69 0.00 0.00 0.00 174.94 173.88 1j08 s VAL 28 N 2.69 4.34 -0.16 2.92 1.01 0.10 -1.60 120.40 129.70 1j08 s VAL 28 Ca 0.21 -0.19 -0.04 0.00 0.00 0.00 0.00 61.98 61.96 1j08 s VAL 28 Cb -0.15 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 1j08 s VAL 28 CO 0.17 0.47 -0.03 -0.36 0.00 0.00 0.00 175.10 175.36 1j08 s PHE 29 N 0.46 3.04 -0.01 5.22 0.40 0.29 0.12 117.98 127.50 1j08 s PHE 29 Ca 0.00 -0.28 0.02 0.00 -0.60 0.00 0.00 56.93 56.06 1j08 s PHE 29 Cb -0.13 -1.98 -0.00 0.00 0.51 0.00 0.00 43.02 41.41 1j08 s PHE 29 CO 0.02 -0.04 -0.06 0.42 0.70 0.00 0.00 175.22 176.25 1j08 s ILE 30 N 0.42 0.49 0.48 0.64 1.01 -0.02 -2.04 121.20 122.18 1j08 s ILE 30 Ca -0.03 -0.26 0.02 0.00 0.00 0.00 0.00 60.65 60.38 1j08 s ILE 30 Cb -0.14 -0.42 -0.02 0.00 0.01 0.00 0.00 42.46 41.89 1j08 s ILE 30 CO 0.03 0.14 0.04 -0.83 0.00 0.00 0.00 174.94 174.32 1j08 s GLY 31 N -0.12 2.89 0.00 6.18 0.00 -1.26 -1.02 107.32 113.98 1j08 s GLY 31 Ca 0.02 -0.70 0.27 0.00 0.00 0.00 0.00 44.72 44.31 1j08 s GLY 31 CO -0.00 -2.09 1.65 0.28 0.00 0.00 0.00 173.10 172.94 1j08 n LYS 32 N -1.15 0.37 -0.14 2.90 4.76 -1.26 -4.86 118.16 118.78 1j08 n LYS 32 Ca -0.15 -0.17 -0.18 0.00 -2.87 0.00 0.00 58.31 54.93 1j08 n LYS 32 Cb 0.66 -1.50 0.18 0.00 -1.84 0.00 0.00 35.03 32.53 1j08 n LYS 32 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1j08 n GLU 33 N -1.16 -3.74 -1.89 1.97 -0.58 -1.26 -4.77 120.64 109.21 1j08 n GLU 33 Ca 0.10 -0.88 -0.34 0.00 -0.42 0.00 0.00 57.16 55.61 1j08 n GLU 33 Cb 0.32 -1.14 -0.04 0.00 -0.57 0.00 0.00 31.44 30.02 1j08 n GLU 33 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1j08 s HIS 34 N -1.67 1.50 -0.45 -0.32 5.04 -1.26 -4.87 115.29 113.26 1j08 s HIS 34 Ca 0.40 1.04 0.02 0.00 -1.54 0.00 0.00 55.06 54.99 1j08 s HIS 34 Cb -0.07 -3.91 0.14 0.00 0.04 0.00 0.00 32.58 28.78 1j08 s HIS 34 CO 0.34 -2.22 0.26 0.00 -2.34 0.00 0.00 174.74 170.78 1j08 h GLN 36 N 6.56 0.11 -0.07 0.00 4.15 -1.94 -3.05 115.11 120.88 1j08 h GLN 36 Ca 0.03 -0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.37 1j08 h GLN 36 Cb 0.92 -0.02 -0.09 0.00 0.21 0.00 0.00 27.48 28.49 1j08 h GLN 36 CO 0.48 0.07 -0.60 0.66 -1.93 0.00 0.00 178.83 177.51 1j08 n TYR 37 N -4.40 0.26 0.14 3.99 4.01 -1.26 -4.78 117.16 115.11 1j08 n TYR 37 Ca 0.11 -1.46 -0.01 0.00 -0.16 0.00 0.00 57.90 56.39 1j08 n TYR 37 Cb 0.59 -0.25 0.25 0.00 -0.31 0.00 0.00 39.34 39.62 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 0.08 0.70 0.08 0.00 3.32 -1.86 -2.69 116.42 116.06 1j08 h ASP 39 Ca 0.00 -0.54 -0.07 0.00 0.02 0.00 0.00 57.03 56.45 1j08 h ASP 39 Cb 0.86 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 1j08 h ASP 39 CO 0.07 1.11 -0.21 1.56 -1.72 0.00 0.00 179.24 180.05 1j08 h GLN 40 N 0.33 0.24 -0.03 3.56 7.50 -1.90 -1.50 115.11 123.31 1j08 h GLN 40 Ca 0.01 -0.07 -0.00 0.00 0.50 0.00 0.00 58.65 59.09 1j08 h GLN 40 Cb 0.98 -0.03 -0.00 0.00 0.05 0.00 0.00 27.48 28.48 1j08 h GLN 40 CO 0.09 0.45 0.01 1.25 -1.50 0.00 0.00 178.83 179.13 1j08 h LEU 41 N 0.22 0.04 -0.39 1.46 5.85 -1.25 0.19 115.31 121.43 1j08 h LEU 41 Ca 0.04 -0.10 0.01 0.00 0.84 0.00 0.00 57.88 58.66 1j08 h LEU 41 Cb 0.50 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 1j08 h LEU 41 CO 0.03 0.13 0.25 0.11 -0.34 0.00 0.00 178.44 178.63 1j08 h LYS 42 N -0.06 0.50 -0.53 1.25 1.57 -1.19 -2.20 116.57 115.91 1j08 h LYS 42 Ca 0.01 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.82 1j08 h LYS 42 Cb 0.10 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.25 1j08 h LYS 42 CO -0.00 0.33 0.24 0.37 -0.57 0.00 0.00 179.45 179.82 1j08 h GLN 43 N 0.52 0.45 0.67 3.15 4.15 -1.08 -1.90 115.11 121.06 1j08 h GLN 43 Ca 0.15 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.51 1j08 h GLN 43 Cb -0.05 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.53 1j08 h GLN 43 CO -0.04 0.30 -0.45 1.25 -1.93 0.00 0.00 178.83 177.95 1j08 h LEU 44 N 0.46 -1.17 -2.16 -2.39 5.85 -0.48 0.43 115.31 115.85 1j08 h LEU 44 Ca 0.25 0.07 0.05 0.00 0.84 0.00 0.00 57.88 59.09 1j08 h LEU 44 Cb 0.21 0.35 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1j08 h LEU 44 CO -0.20 -0.68 0.14 -0.37 -0.34 0.00 0.00 178.44 176.99 1j08 h VAL 45 N -1.07 0.69 0.35 1.05 -1.51 -1.30 -0.73 116.25 113.74 1j08 h VAL 45 Ca -0.08 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.37 1j08 h VAL 45 Cb 0.88 0.89 0.00 0.00 -2.13 0.00 0.00 31.29 30.93 1j08 h VAL 45 CO 0.06 0.00 -0.17 1.56 -1.23 0.00 0.00 177.57 177.79 1j08 h GLN 46 N 0.00 -0.46 -0.80 5.19 4.20 -0.82 -2.42 115.11 120.02 1j08 h GLN 46 Ca 0.08 0.03 0.12 0.00 0.06 0.00 0.00 58.65 58.94 1j08 h GLN 46 Cb 0.37 0.10 -0.06 0.00 0.30 0.00 0.00 27.48 28.19 1j08 h GLN 46 CO -0.00 -0.18 0.52 0.93 -0.67 0.00 0.00 178.83 179.43 1j08 h GLU 47 N -1.03 0.63 -0.10 1.46 5.08 -0.40 -1.21 114.58 119.01 1j08 h GLU 47 Ca -0.05 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.12 1j08 h GLU 47 Cb 0.49 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1j08 h GLU 47 CO 0.08 0.42 -0.60 -0.07 -1.00 0.00 0.00 179.01 177.83 1j08 h LEU 48 N 0.65 0.39 -1.12 1.33 3.38 -1.21 -3.06 115.31 115.67 1j08 h LEU 48 Ca 0.38 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1j08 h LEU 48 Cb 0.58 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1j08 h LEU 48 CO -0.15 0.90 0.00 0.28 0.09 0.00 0.00 178.44 179.56 1j08 h SER 49 N 0.26 0.00 0.06 -0.43 0.02 -0.69 -2.32 113.55 110.44 1j08 h SER 49 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1j08 h SER 49 Cb 1.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.66 1j08 h SER 49 CO 0.10 0.00 -0.06 -0.62 -1.14 0.00 0.00 176.83 175.11 1j08 n GLU 50 N -2.54 1.38 0.00 3.45 1.02 -1.12 -3.78 120.64 119.05 1j08 n GLU 50 Ca 0.01 -0.74 0.12 0.00 -0.02 0.00 0.00 57.16 56.54 1j08 n GLU 50 Cb 0.22 -1.48 0.28 0.00 -0.02 0.00 0.00 31.44 30.44 1j08 n GLU 50 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1j08 n LEU 51 N -0.17 0.56 -3.57 -4.62 4.77 -0.87 -4.94 117.00 108.16 1j08 n LEU 51 Ca 0.18 -0.02 -0.09 0.00 -0.03 0.00 0.00 56.01 56.04 1j08 n LEU 51 Cb 0.33 -0.24 -0.04 0.00 -2.33 0.00 0.00 43.42 41.13 1j08 n LEU 51 CO 0.19 0.13 0.81 0.28 -1.33 0.00 0.00 177.39 177.47 1j08 s THR 52 N -2.92 0.00 -0.95 -5.08 -1.32 -1.25 -4.90 115.64 99.22 1j08 s THR 52 Ca 0.13 0.00 0.28 0.00 -1.21 0.00 0.00 61.69 60.89 1j08 s THR 52 Cb 0.18 -1.00 0.20 0.00 -1.51 0.00 0.00 72.50 70.37 1j08 s THR 52 CO 0.67 0.00 1.81 -0.90 -2.21 0.00 0.00 174.62 173.99 1j08 n ASP 53 N 0.54 0.20 -0.01 8.08 5.68 -1.26 -3.41 116.55 126.37 1j08 n ASP 53 Ca -0.08 0.39 0.14 0.00 -0.50 0.00 0.00 54.79 54.73 1j08 n ASP 53 Cb 0.58 -0.40 0.54 0.00 -1.14 0.00 0.00 41.12 40.70 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 -1.62 0.11 -4.84 0.11 5.02 -1.26 -4.77 118.16 110.90 1j08 n LYS 54 Ca 0.06 -0.03 -0.33 0.00 -2.02 0.00 0.00 58.31 56.00 1j08 n LYS 54 Cb 0.35 -1.50 -0.16 0.00 -0.02 0.00 0.00 35.03 33.71 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 -2.91 2.40 0.22 -0.35 2.96 -1.22 0.16 118.68 119.94 1j08 s LEU 55 Ca 0.16 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 53.62 1j08 s LEU 55 Cb 0.19 -1.52 -0.05 0.00 0.50 0.00 0.00 46.19 45.31 1j08 s LEU 55 CO 0.56 0.14 0.04 -0.94 -1.32 0.00 0.00 176.35 174.83 1j08 s SER 56 N 0.51 1.25 0.25 3.68 1.04 -0.27 -4.69 113.70 115.47 1j08 s SER 56 Ca -0.12 -1.27 0.02 0.00 0.48 0.00 0.00 55.95 55.07 1j08 s SER 56 Cb -0.16 0.13 -0.04 0.00 0.10 0.00 0.00 66.02 66.05 1j08 s SER 56 CO 0.05 -0.64 0.19 -0.72 0.98 0.00 0.00 173.24 173.10 1j08 s TYR 57 N -3.68 1.39 -0.25 5.02 1.13 -1.26 -0.39 117.35 119.31 1j08 s TYR 57 Ca 0.30 -1.49 -0.11 0.00 -1.41 0.00 0.00 57.07 54.37 1j08 s TYR 57 Cb 0.07 -0.62 0.09 0.00 -1.10 0.00 0.00 41.96 40.40 1j08 s TYR 57 CO 0.09 -0.73 0.56 -2.00 -2.51 0.00 0.00 175.55 170.96 1j08 s GLU 58 N -3.89 0.52 -0.28 -3.49 2.12 -0.55 -4.88 118.70 108.27 1j08 s GLU 58 Ca 0.40 1.16 -0.14 0.00 0.36 0.00 0.00 54.97 56.75 1j08 s GLU 58 Cb 0.05 0.35 -0.04 0.00 0.26 0.00 0.00 34.13 34.76 1j08 s GLU 58 CO 0.18 -0.19 0.34 0.42 -0.54 0.00 0.00 175.26 175.47 1j08 s ILE 59 N 2.15 5.20 -0.13 -3.70 -1.09 -1.26 -0.72 121.20 121.65 1j08 s ILE 59 Ca -0.07 0.43 -0.03 0.00 -2.23 0.00 0.00 60.65 58.75 1j08 s ILE 59 Cb -0.09 -3.68 -0.03 0.00 -1.58 0.00 0.00 42.46 37.08 1j08 s ILE 59 CO -0.17 0.14 -0.04 -0.69 -1.23 0.00 0.00 174.94 172.96 1j08 s VAL 60 N 2.00 3.92 -0.78 2.92 1.01 0.32 -4.98 120.40 124.82 1j08 s VAL 60 Ca 0.13 -0.36 -0.23 0.00 0.00 0.00 0.00 61.98 61.51 1j08 s VAL 60 Cb -0.16 -2.69 0.06 0.00 0.00 0.00 0.00 36.38 33.60 1j08 s VAL 60 CO 0.10 0.53 1.16 -0.62 0.00 0.00 0.00 175.10 176.27 1j08 s ASP 61 N -0.02 6.28 0.59 3.32 -1.08 -1.26 -0.84 116.67 123.67 1j08 s ASP 61 Ca 0.01 -1.05 0.29 0.00 -0.52 0.00 0.00 52.55 51.28 1j08 s ASP 61 Cb -0.13 -2.48 1.55 0.00 -1.46 0.00 0.00 42.92 40.40 1j08 s ASP 61 CO 0.03 -1.52 1.98 0.15 0.52 0.00 0.00 175.17 176.33 1j08 h PHE 62 N 9.64 0.00 0.00 -5.34 3.57 -1.41 -2.47 116.94 120.94 1j08 h PHE 62 Ca -0.15 0.00 -0.19 0.00 3.53 0.00 0.00 57.97 61.16 1j08 h PHE 62 Cb 1.05 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.77 1j08 h PHE 62 CO 1.09 0.00 -0.86 -0.44 -2.23 0.00 0.00 178.31 175.87 1j08 h ASP 63 N 0.00 0.21 -4.10 0.41 3.32 -1.90 -3.37 116.42 110.99 1j08 h ASP 63 Ca 0.16 -0.17 -0.48 0.00 0.02 0.00 0.00 57.03 56.55 1j08 h ASP 63 Cb 0.88 -0.06 0.05 0.00 0.22 0.00 0.00 39.33 40.42 1j08 h ASP 63 CO -0.00 0.97 0.40 0.42 -1.72 0.00 0.00 179.24 179.31 1j08 s THR 64 N -3.21 3.58 0.35 0.35 -4.23 -0.93 -4.89 115.64 106.67 1j08 s THR 64 Ca -0.02 0.93 0.03 0.00 -1.18 0.00 0.00 61.69 61.44 1j08 s THR 64 Cb 0.10 -3.37 0.26 0.00 1.34 0.00 0.00 72.50 70.83 1j08 s THR 64 CO 0.82 -0.26 2.00 1.55 -0.54 0.00 0.00 174.62 178.19 1j08 h PRO 65 N 1.20 0.80 -0.56 3.99 0.13 -1.88 -1.18 132.00 134.49 1j08 h PRO 65 Ca -0.49 -0.06 -0.03 0.00 -0.87 0.00 0.00 66.00 64.56 1j08 h PRO 65 Cb 1.23 -0.18 -0.03 0.00 0.13 0.00 0.00 31.00 32.16 1j08 h PRO 65 CO 0.58 0.54 0.24 1.49 -0.23 0.00 0.00 178.00 180.62 1j08 h GLU 66 N 0.82 0.83 -0.62 0.86 4.57 -1.92 -1.98 114.58 117.14 1j08 h GLU 66 Ca 0.22 -0.14 -0.06 0.00 -1.18 0.00 0.00 59.36 58.20 1j08 h GLU 66 Cb -0.07 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.36 1j08 h GLU 66 CO -0.04 0.70 0.14 0.78 -1.18 0.00 0.00 179.01 179.41 1j08 h GLY 67 N 0.77 1.07 1.28 1.92 0.00 -1.48 -2.84 103.07 103.80 1j08 h GLY 67 Ca 0.19 -0.68 -0.04 0.00 0.00 0.00 0.00 47.33 46.80 1j08 h GLY 67 CO -0.02 0.63 0.21 0.50 0.00 0.00 0.00 176.54 177.87 1j08 h LYS 68 N 0.91 0.91 -0.83 4.80 1.57 -0.99 0.52 116.57 123.47 1j08 h LYS 68 Ca 0.19 -0.16 0.03 0.00 -1.87 0.00 0.00 60.65 58.84 1j08 h LYS 68 Cb 0.37 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.48 1j08 h LYS 68 CO 0.00 0.77 0.53 0.93 -0.57 0.00 0.00 179.45 181.11 1j08 h GLU 69 N 0.89 1.02 -0.40 3.15 5.08 -1.21 0.27 114.58 123.38 1j08 h GLU 69 Ca 0.20 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.36 1j08 h GLU 69 Cb 0.22 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1j08 h GLU 69 CO -0.01 0.68 -0.29 1.25 -1.00 0.00 0.00 179.01 179.63 1j08 h LEU 70 N 1.05 0.95 -0.03 1.33 5.85 -1.02 -2.13 115.31 121.32 1j08 h LEU 70 Ca 0.32 -0.44 0.01 0.00 0.84 0.00 0.00 57.88 58.62 1j08 h LEU 70 Cb -0.02 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 1j08 h LEU 70 CO -0.10 1.18 -0.03 0.00 -0.34 0.00 0.00 178.44 179.15 1j08 h ALA 71 N 0.80 -0.00 -0.84 1.25 0.00 0.87 -2.31 119.26 119.03 1j08 h ALA 71 Ca 0.08 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.08 1j08 h ALA 71 Cb 0.87 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.65 1j08 h ALA 71 CO 0.08 -0.51 0.50 1.49 0.00 0.00 0.00 179.25 180.80 1j08 h GLU 72 N -0.04 0.84 0.00 0.00 4.81 -0.40 0.21 114.58 120.01 1j08 h GLU 72 Ca 0.02 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.16 1j08 h GLU 72 Cb 0.07 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1j08 h GLU 72 CO -0.05 0.56 -0.18 0.87 -0.73 0.00 0.00 179.01 179.47 1j08 h LYS 73 N 0.87 0.00 -0.66 1.92 1.57 -0.97 -2.20 116.57 117.10 1j08 h LYS 73 Ca 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 1j08 h LYS 73 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1j08 h LYS 73 CO -0.21 0.18 0.00 0.66 -0.57 0.00 0.00 179.45 179.51 1j08 n TYR 74 N -4.22 0.88 -3.58 -1.35 4.01 -0.54 -4.97 117.16 107.39 1j08 n TYR 74 Ca -0.02 -0.49 -0.20 0.00 -0.16 0.00 0.00 57.90 57.03 1j08 n TYR 74 Cb 0.25 -0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.34 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 1.47 -5.99 -3.89 -0.72 1.74 -0.09 -4.99 116.66 104.19 1j08 n ARG 75 Ca 0.22 0.74 -0.35 0.00 -0.77 0.00 0.00 57.85 57.69 1j08 n ARG 75 Cb 0.59 -5.57 -0.14 0.00 -1.02 0.00 0.00 32.46 26.32 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 -3.48 3.49 -1.22 0.55 -1.09 -0.34 -4.99 121.20 114.13 1j08 s ILE 76 Ca 0.09 -0.46 0.19 0.00 -2.23 0.00 0.00 60.65 58.25 1j08 s ILE 76 Cb -0.04 -2.60 -0.14 0.00 -1.58 0.00 0.00 42.46 38.10 1j08 s ILE 76 CO 0.77 0.41 0.88 -0.90 -1.23 0.00 0.00 174.94 174.86 1j08 n ASP 77 N 4.81 1.23 -3.61 3.58 5.75 -1.26 -4.32 116.55 122.73 1j08 n ASP 77 Ca -0.18 -1.12 -0.11 0.00 -0.01 0.00 0.00 54.79 53.38 1j08 n ASP 77 Cb 0.51 0.82 -0.04 0.00 -1.03 0.00 0.00 41.12 41.39 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 -2.62 1.20 0.13 0.11 1.70 -1.26 -5.17 118.95 113.04 1j08 s ARG 78 Ca 0.10 -0.69 0.07 0.00 -0.47 0.00 0.00 55.73 54.74 1j08 s ARG 78 Cb 0.15 0.51 -0.04 0.00 -0.57 0.00 0.00 34.95 35.01 1j08 s ARG 78 CO 0.69 -0.50 -0.16 0.00 -1.08 0.00 0.00 175.30 174.25 1j08 s ALA 79 N -3.81 1.67 0.39 7.88 0.00 -1.26 -4.17 121.76 122.45 1j08 s ALA 79 Ca 0.04 -1.32 -0.25 0.00 0.00 0.00 0.00 51.96 50.43 1j08 s ALA 79 Cb 0.00 -0.13 -0.09 0.00 0.00 0.00 0.00 23.12 22.90 1j08 s ALA 79 CO -0.10 0.19 1.11 -1.25 0.00 0.00 0.00 175.76 175.71 1j08 s PRO 80 N -2.51 4.16 -0.09 0.00 0.04 -1.26 -4.79 135.00 130.54 1j08 s PRO 80 Ca 0.10 1.69 -0.14 0.00 0.04 0.00 0.00 61.00 62.69 1j08 s PRO 80 Cb -0.06 -2.67 0.03 0.00 0.04 0.00 0.00 34.50 31.84 1j08 s PRO 80 CO 0.04 -0.19 0.35 0.00 0.04 0.00 0.00 177.00 177.24 1j08 s ALA 81 N -1.49 -0.87 -0.09 8.56 0.00 -0.87 -2.95 121.76 124.06 1j08 s ALA 81 Ca 0.56 0.78 0.01 0.00 0.00 0.00 0.00 51.96 53.31 1j08 s ALA 81 Cb -0.27 -0.35 0.02 0.00 0.00 0.00 0.00 23.12 22.51 1j08 s ALA 81 CO 0.34 -0.20 -0.10 0.99 0.00 0.00 0.00 175.76 176.79 1j08 s THR 82 N -0.35 1.05 -0.16 0.00 2.01 0.97 -0.55 115.64 118.62 1j08 s THR 82 Ca -0.05 -0.37 -0.01 0.00 0.31 0.00 0.00 61.69 61.57 1j08 s THR 82 Cb -0.03 -1.01 -0.01 0.00 0.01 0.00 0.00 72.50 71.45 1j08 s THR 82 CO 0.02 0.35 -0.10 0.28 -0.69 0.00 0.00 174.62 174.48 1j08 s THR 83 N 1.15 3.20 -0.73 -0.82 -1.32 -0.63 -0.43 115.64 116.06 1j08 s THR 83 Ca -0.06 -0.59 -0.20 0.00 -1.21 0.00 0.00 61.69 59.63 1j08 s THR 83 Cb -0.14 -2.38 0.11 0.00 -1.51 0.00 0.00 72.50 68.58 1j08 s THR 83 CO -0.02 0.50 0.91 -0.63 -2.21 0.00 0.00 174.62 173.17 1j08 s ILE 84 N 0.65 4.70 0.07 5.08 1.01 0.14 -2.11 121.20 130.73 1j08 s ILE 84 Ca -0.06 -1.08 0.00 0.00 0.00 0.00 0.00 60.65 59.51 1j08 s ILE 84 Cb -0.15 -4.64 -0.04 0.00 0.01 0.00 0.00 42.46 37.64 1j08 s ILE 84 CO 0.03 -1.34 0.22 0.42 0.00 0.00 0.00 174.94 174.27 1j08 s THR 85 N 2.93 5.38 -0.70 2.92 -4.23 -0.85 -4.43 115.64 116.66 1j08 s THR 85 Ca 0.21 -0.41 -0.22 0.00 -1.18 0.00 0.00 61.69 60.09 1j08 s THR 85 Cb -0.15 -3.64 0.08 0.00 1.34 0.00 0.00 72.50 70.13 1j08 s THR 85 CO 0.02 0.12 0.99 -1.58 -0.54 0.00 0.00 174.62 173.63 1j08 s GLN 86 N -2.57 3.17 -1.51 3.99 0.74 -0.64 -0.28 119.66 122.57 1j08 s GLN 86 Ca 0.35 -0.95 -0.03 0.00 0.05 0.00 0.00 55.36 54.78 1j08 s GLN 86 Cb -0.13 -4.33 0.03 0.00 1.10 0.00 0.00 33.01 29.68 1j08 s GLN 86 CO 0.28 -1.82 0.34 -3.47 -0.55 0.00 0.00 175.29 170.08 1j08 n ASP 87 N 7.59 -0.35 0.00 6.67 2.03 -0.36 -0.73 116.55 131.39 1j08 n ASP 87 Ca -0.00 -1.10 0.00 0.00 0.52 0.00 0.00 54.79 54.21 1j08 n ASP 87 Cb 0.46 -2.52 0.00 0.00 -0.72 0.00 0.00 41.12 38.34 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 -2.06 3.02 3.65 0.27 0.00 -1.26 -4.99 105.19 103.82 1j08 n GLY 88 Ca -0.25 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.34 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 -0.18 4.08 0.06 1.61 2.20 0.09 -4.93 119.74 122.66 1j08 s LYS 89 Ca 0.00 1.87 -0.31 0.00 -0.36 0.00 0.00 55.97 57.18 1j08 s LYS 89 Cb 0.00 -3.94 -0.08 0.00 -1.51 0.00 0.00 37.83 32.31 1j08 s LYS 89 CO 0.00 -0.94 1.61 0.34 -0.36 0.00 0.00 175.35 176.00 1j08 s ASP 90 N 3.20 6.65 0.00 1.43 -1.08 -1.26 -1.62 116.67 123.99 1j08 s ASP 90 Ca 0.67 2.42 0.07 0.00 -0.52 0.00 0.00 52.55 55.19 1j08 s ASP 90 Cb -0.27 -2.56 0.13 0.00 -1.46 0.00 0.00 42.92 38.76 1j08 s ASP 90 CO 0.25 -0.86 0.98 0.49 0.52 0.00 0.00 175.17 176.55 1j08 n PHE 91 N 5.54 0.17 -1.81 -5.34 3.01 -1.26 -4.98 117.46 112.78 1j08 n PHE 91 Ca 0.15 -0.29 -0.11 0.00 1.01 0.00 0.00 57.45 58.21 1j08 n PHE 91 Cb 0.41 -0.02 -0.02 0.00 -0.01 0.00 0.00 39.48 39.83 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 0.24 0.51 3.20 1.37 0.00 -1.26 -3.95 105.19 105.29 1j08 n GLY 92 Ca 0.06 -0.46 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.49 4.04 0.18 1.61 1.01 -1.26 -0.48 120.40 123.00 1j08 s VAL 93 Ca 0.00 -1.81 0.08 0.00 0.00 0.00 0.00 61.98 60.25 1j08 s VAL 93 Cb 0.00 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 1j08 s VAL 93 CO 0.00 -0.74 -0.15 -0.13 0.00 0.00 0.00 175.10 174.08 1j08 s ARG 94 N 1.32 1.25 -0.09 2.72 3.00 -0.89 -0.69 118.95 125.58 1j08 s ARG 94 Ca 0.06 -1.47 -0.01 0.00 0.00 0.00 0.00 55.73 54.31 1j08 s ARG 94 Cb -0.25 -1.14 0.03 0.00 0.00 0.00 0.00 34.95 33.58 1j08 s ARG 94 CO -0.01 0.21 -0.04 0.71 0.00 0.00 0.00 175.30 176.17 1j08 s TYR 95 N -2.55 1.06 -0.51 -0.53 1.51 0.43 -2.01 117.35 114.74 1j08 s TYR 95 Ca 0.18 -0.44 -0.12 0.00 -1.01 0.00 0.00 57.07 55.67 1j08 s TYR 95 Cb -0.03 -1.01 0.13 0.00 -0.11 0.00 0.00 41.96 40.94 1j08 s TYR 95 CO 0.06 -0.42 0.42 -0.06 -1.11 0.00 0.00 175.55 174.45 1j08 s PHE 96 N 1.83 3.35 0.00 2.71 0.40 0.46 -0.02 117.98 126.71 1j08 s PHE 96 Ca 0.05 -1.62 0.00 0.00 -0.60 0.00 0.00 56.93 54.76 1j08 s PHE 96 Cb -0.12 -3.64 0.00 0.00 0.51 0.00 0.00 43.02 39.77 1j08 s PHE 96 CO -0.07 -1.01 0.00 0.41 0.70 0.00 0.00 175.22 175.26 1j08 n GLY 97 N 5.04 2.16 3.74 4.36 0.00 -1.15 -1.63 105.19 117.71 1j08 n GLY 97 Ca -0.10 -2.17 -0.40 0.00 0.00 0.00 0.00 46.02 43.34 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 -1.81 4.26 -1.31 -0.61 2.07 -1.26 -4.85 121.20 117.69 1j08 s ILE 98 Ca 0.00 2.08 -0.09 0.00 -1.41 0.00 0.00 60.65 61.23 1j08 s ILE 98 Cb 0.00 -4.32 -0.07 0.00 0.13 0.00 0.00 42.46 38.19 1j08 s ILE 98 CO 0.00 0.41 2.57 -2.65 -1.91 0.00 0.00 174.94 173.36 1j08 n PRO 99 N 2.09 2.96 -2.36 3.50 -0.02 -1.26 -4.93 135.00 134.98 1j08 n PRO 99 Ca -0.00 -1.90 -0.24 0.00 -2.02 0.00 0.00 63.50 59.34 1j08 n PRO 99 Cb 0.48 -2.67 0.06 0.00 -0.02 0.00 0.00 33.50 31.34 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 2.77 3.42 0.00 3.55 0.00 -1.26 -2.33 121.76 127.91 1j08 s ALA 100 Ca 0.56 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 51.46 1j08 s ALA 100 Cb 0.15 -2.42 0.00 0.00 0.00 0.00 0.00 23.12 20.85 1j08 s ALA 100 CO -0.05 -1.10 0.00 0.41 0.00 0.00 0.00 175.76 175.02 1j08 n GLY 101 N -2.71 3.28 0.28 0.00 0.00 -1.26 -1.84 105.19 102.93 1j08 n GLY 101 Ca 0.08 -0.22 0.18 0.00 0.00 0.00 0.00 46.02 46.06 1j08 n GLY 101 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1j08 h HIS 102 N 0.00 0.00 0.00 1.61 3.86 -1.53 -2.39 115.15 116.69 1j08 h HIS 102 Ca 0.00 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.18 1j08 h HIS 102 Cb 0.00 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.47 1j08 h HIS 102 CO 0.00 0.00 -0.14 0.93 0.86 0.00 0.00 177.93 179.58 1j08 h GLU 103 N 0.00 0.00 -0.53 2.45 4.39 -1.58 -3.27 114.58 116.03 1j08 h GLU 103 Ca 0.00 0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.76 1j08 h GLU 103 Cb 0.24 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.84 1j08 h GLU 103 CO 0.00 0.14 0.24 0.35 -1.16 0.00 0.00 179.01 178.58 1j08 h PHE 104 N 0.00 0.43 -0.70 4.33 3.57 -1.02 -1.37 116.94 122.18 1j08 h PHE 104 Ca -0.00 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 1j08 h PHE 104 Cb 0.73 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.33 1j08 h PHE 104 CO 0.00 0.18 0.29 0.00 -2.23 0.00 0.00 178.31 176.55 1j08 h ALA 105 N 1.32 0.90 -0.83 2.41 0.00 -1.77 -1.79 119.26 119.50 1j08 h ALA 105 Ca 0.25 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1j08 h ALA 105 Cb 0.22 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 1j08 h ALA 105 CO -0.21 0.51 0.54 0.00 0.00 0.00 0.00 179.25 180.08 1j08 h ALA 106 N 1.14 1.10 0.05 0.00 0.00 -1.57 -0.05 119.26 119.94 1j08 h ALA 106 Ca 0.23 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1j08 h ALA 106 Cb 0.18 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1j08 h ALA 106 CO -0.02 0.36 -0.10 0.35 0.00 0.00 0.00 179.25 179.84 1j08 h PHE 107 N 1.04 -0.26 -0.89 0.00 3.57 -0.67 0.37 116.94 120.09 1j08 h PHE 107 Ca 0.33 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.86 1j08 h PHE 107 Cb 0.01 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 38.81 1j08 h PHE 107 CO -0.02 -0.16 0.58 -0.07 -2.23 0.00 0.00 178.31 176.41 1j08 h LEU 108 N -0.20 0.99 -0.87 0.59 3.38 -0.76 -1.56 115.31 116.87 1j08 h LEU 108 Ca 0.02 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1j08 h LEU 108 Cb 0.22 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1j08 h LEU 108 CO -0.06 0.69 -0.16 -0.33 0.09 0.00 0.00 178.44 178.67 1j08 h GLU 109 N 1.16 0.66 -0.10 1.13 5.08 -0.62 -2.61 114.58 119.27 1j08 h GLU 109 Ca 0.34 -0.23 -0.10 0.00 -1.00 0.00 0.00 59.36 58.38 1j08 h GLU 109 Cb -0.05 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1j08 h GLU 109 CO -0.10 0.79 -0.39 -0.44 -1.00 0.00 0.00 179.01 177.87 1j08 h ASP 110 N 0.59 0.22 -0.40 1.42 3.32 -0.23 -0.87 116.42 120.46 1j08 h ASP 110 Ca 0.10 -0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1j08 h ASP 110 Cb 0.61 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 1j08 h ASP 110 CO 0.04 0.60 0.12 0.40 -1.72 0.00 0.00 179.24 178.68 1j08 h ILE 111 N 0.18 1.22 -0.42 0.35 2.04 -0.95 0.49 117.51 120.41 1j08 h ILE 111 Ca 0.02 -0.73 -0.10 0.00 1.00 0.00 0.00 64.86 65.05 1j08 h ILE 111 Cb 0.78 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 1j08 h ILE 111 CO 0.06 0.26 -0.12 0.58 0.00 0.00 0.00 178.15 178.92 1j08 h VAL 112 N 0.51 1.28 -0.45 1.67 2.07 -1.26 -1.06 116.25 119.00 1j08 h VAL 112 Ca 0.13 -1.24 -0.09 0.00 0.82 0.00 0.00 66.70 66.32 1j08 h VAL 112 Cb 0.27 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 1j08 h VAL 112 CO -0.00 0.42 -0.09 0.44 0.02 0.00 0.00 177.57 178.36 1j08 h ASP 113 N 0.65 0.79 0.89 0.57 5.19 -1.00 -0.35 116.42 123.16 1j08 h ASP 113 Ca 0.10 -0.23 -0.13 0.00 -0.62 0.00 0.00 57.03 56.16 1j08 h ASP 113 Cb 0.66 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 39.94 1j08 h ASP 113 CO 0.05 0.91 -0.61 0.58 -3.12 0.00 0.00 179.24 177.04 1j08 h VAL 114 N 0.73 1.26 -0.46 -1.35 2.07 -0.86 0.46 116.25 118.09 1j08 h VAL 114 Ca 0.13 -2.24 -0.11 0.00 0.82 0.00 0.00 66.70 65.29 1j08 h VAL 114 Cb 0.57 2.27 -0.02 0.00 -1.52 0.00 0.00 31.29 32.59 1j08 h VAL 114 CO 0.03 0.60 -0.17 -1.28 0.02 0.00 0.00 177.57 176.78 1j08 h SER 115 N 0.00 0.89 0.63 0.57 0.87 -0.66 -3.12 113.55 112.73 1j08 h SER 115 Ca -0.01 -0.31 -0.27 0.00 -1.23 0.00 0.00 61.79 59.97 1j08 h SER 115 Cb 1.22 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.91 1j08 h SER 115 CO 0.08 1.05 -1.47 0.11 -0.53 0.00 0.00 176.83 176.07 1j08 h LYS 116 N 0.78 0.06 -0.51 2.24 1.57 -0.91 -2.35 116.57 117.45 1j08 h LYS 116 Ca 0.11 -0.10 -0.11 0.00 -1.87 0.00 0.00 60.65 58.68 1j08 h LYS 116 Cb 0.70 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.02 1j08 h LYS 116 CO 0.05 0.79 -0.12 0.41 -0.57 0.00 0.00 179.45 180.01 1j08 n GLY 117 N 1.53 0.51 3.22 3.86 0.00 0.16 -4.96 105.19 109.50 1j08 n GLY 117 Ca -0.12 -0.74 -0.09 0.00 0.00 0.00 0.00 46.02 45.07 1j08 n GLY 117 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1j08 s ASP 118 N -2.85 0.21 0.24 1.61 1.01 -1.19 -4.88 116.67 110.82 1j08 s ASP 118 Ca 0.00 -1.04 0.01 0.00 0.71 0.00 0.00 52.55 52.24 1j08 s ASP 118 Cb 0.00 0.34 -0.04 0.00 1.01 0.00 0.00 42.92 44.23 1j08 s ASP 118 CO 0.00 -0.78 0.16 0.42 0.21 0.00 0.00 175.17 175.18 1j08 s THR 119 N -4.00 0.08 -0.25 -1.27 -4.23 -1.26 -4.79 115.64 99.93 1j08 s THR 119 Ca 0.19 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 58.84 1j08 s THR 119 Cb 0.06 -2.51 0.74 0.00 1.34 0.00 0.00 72.50 72.12 1j08 s THR 119 CO -0.01 0.00 1.69 -0.90 -0.54 0.00 0.00 174.62 174.86 1j08 n ASP 120 N -0.63 5.08 -4.67 3.99 5.68 -1.26 -4.99 116.55 119.76 1j08 n ASP 120 Ca 0.03 -3.04 -0.30 0.00 -0.50 0.00 0.00 54.79 50.98 1j08 n ASP 120 Cb 0.65 -0.67 0.16 0.00 -1.14 0.00 0.00 41.12 40.13 1j08 n ASP 120 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1j08 s LEU 121 N -2.85 2.37 0.38 -2.12 1.43 -1.26 -4.94 118.68 111.69 1j08 s LEU 121 Ca 0.52 1.84 -0.27 0.00 -1.03 0.00 0.00 54.13 55.19 1j08 s LEU 121 Cb 0.41 -4.20 -0.09 0.00 0.03 0.00 0.00 46.19 42.34 1j08 s LEU 121 CO 0.13 -3.02 1.31 -0.04 0.23 0.00 0.00 176.35 174.97 1j08 s MET 122 N -4.72 4.09 0.35 1.70 -1.94 -1.26 -4.84 119.30 112.68 1j08 s MET 122 Ca 0.65 2.19 0.10 0.00 -1.71 0.00 0.00 55.69 56.92 1j08 s MET 122 Cb -0.21 -2.86 0.84 0.00 2.01 0.00 0.00 34.83 34.61 1j08 s MET 122 CO 0.59 -0.40 1.84 0.37 -0.01 0.00 0.00 175.02 177.40 1j08 h GLN 123 N 2.90 0.65 -0.79 2.03 5.75 -1.99 0.14 115.11 123.81 1j08 h GLN 123 Ca -0.49 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 57.95 1j08 h GLN 123 Cb 1.24 -0.15 -0.04 0.00 1.07 0.00 0.00 27.48 29.60 1j08 h GLN 123 CO 0.63 0.43 0.44 0.22 -2.65 0.00 0.00 178.83 177.91 1j08 h ASP 124 N 0.67 0.97 -0.38 -0.69 1.82 -2.00 -1.26 116.42 115.56 1j08 h ASP 124 Ca 0.49 -0.07 -0.11 0.00 -0.39 0.00 0.00 57.03 56.95 1j08 h ASP 124 Cb 0.86 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 40.61 1j08 h ASP 124 CO -0.25 0.77 -0.21 0.28 -1.61 0.00 0.00 179.24 178.23 1j08 h SER 125 N 1.10 0.84 -0.82 2.28 0.02 -1.12 -1.99 113.55 113.86 1j08 h SER 125 Ca 0.28 -0.41 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 1j08 h SER 125 Cb 0.01 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 62.28 1j08 h SER 125 CO -0.05 1.07 0.49 0.11 -1.14 0.00 0.00 176.83 177.31 1j08 h LYS 126 N 0.61 1.13 -0.37 3.45 1.57 -0.82 -0.20 116.57 121.94 1j08 h LYS 126 Ca 0.08 -0.11 -0.15 0.00 -1.87 0.00 0.00 60.65 58.60 1j08 h LYS 126 Cb 0.76 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1j08 h LYS 126 CO 0.06 0.80 -0.36 0.93 -0.57 0.00 0.00 179.45 180.31 1j08 h GLU 127 N 1.15 0.90 -0.24 3.15 5.08 -1.11 -1.44 114.58 122.07 1j08 h GLU 127 Ca 0.30 -0.47 -0.03 0.00 -1.00 0.00 0.00 59.36 58.15 1j08 h GLU 127 Cb -0.03 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1j08 h GLU 127 CO -0.05 1.12 0.01 0.93 -1.00 0.00 0.00 179.01 180.02 1j08 h GLU 128 N 0.71 0.41 -0.01 2.33 4.39 -0.96 -3.08 114.58 118.38 1j08 h GLU 128 Ca 0.06 -0.12 -0.07 0.00 0.34 0.00 0.00 59.36 59.57 1j08 h GLU 128 Cb 0.95 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.55 1j08 h GLU 128 CO 0.09 0.57 -0.32 0.28 -1.16 0.00 0.00 179.01 178.48 1j08 h VAL 129 N 0.20 1.23 0.00 3.13 2.07 -1.05 -2.45 116.25 119.38 1j08 h VAL 129 Ca 0.07 -1.10 0.00 0.00 0.82 0.00 0.00 66.70 66.48 1j08 h VAL 129 Cb 0.38 1.59 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 1j08 h VAL 129 CO 0.01 0.32 0.00 -1.54 0.02 0.00 0.00 177.57 176.38 1j08 n SER 130 N -4.16 0.41 0.03 0.57 3.41 -0.54 -2.22 113.62 111.12 1j08 n SER 130 Ca -0.02 0.59 0.11 0.00 -0.26 0.00 0.00 58.87 59.29 1j08 n SER 130 Cb 0.36 -0.68 -0.01 0.00 -0.26 0.00 0.00 64.21 63.62 1j08 n SER 130 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1j08 n LYS 131 N -1.94 0.37 -1.67 4.33 5.02 -0.92 -4.86 118.16 118.49 1j08 n LYS 131 Ca 0.03 -0.01 -0.42 0.00 -2.02 0.00 0.00 58.31 55.89 1j08 n LYS 131 Cb 0.23 -1.61 -0.03 0.00 -0.02 0.00 0.00 35.03 33.60 1j08 n LYS 131 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1j08 s ILE 132 N -3.26 3.02 -0.08 -0.18 1.01 -0.94 -4.85 121.20 115.92 1j08 s ILE 132 Ca 0.02 0.02 0.12 0.00 0.00 0.00 0.00 60.65 60.81 1j08 s ILE 132 Cb 0.14 -3.02 0.18 0.00 0.01 0.00 0.00 42.46 39.77 1j08 s ILE 132 CO 0.81 -0.00 1.08 -0.67 0.00 0.00 0.00 174.94 176.16 1j08 n ASP 133 N 8.01 1.97 -4.58 3.58 2.03 -1.26 -4.83 116.55 121.47 1j08 n ASP 133 Ca 0.21 -2.66 -0.27 0.00 0.52 0.00 0.00 54.79 52.59 1j08 n ASP 133 Cb 0.42 -0.29 -0.09 0.00 -0.72 0.00 0.00 41.12 40.43 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 -2.06 2.10 -0.18 -0.67 1.02 -1.26 -5.06 119.74 113.62 1j08 s LYS 134 Ca 0.20 -1.19 -0.29 0.00 0.02 0.00 0.00 55.97 54.71 1j08 s LYS 134 Cb 0.18 -2.21 -0.04 0.00 -0.52 0.00 0.00 37.83 35.24 1j08 s LYS 134 CO 0.02 0.45 1.74 -0.51 -0.92 0.00 0.00 175.35 176.13 1j08 s ASP 135 N -2.68 6.27 -0.03 2.83 1.01 -1.26 -4.66 116.67 118.14 1j08 s ASP 135 Ca 0.24 1.80 0.07 0.00 0.71 0.00 0.00 52.55 55.37 1j08 s ASP 135 Cb -0.09 -2.53 -0.02 0.00 1.01 0.00 0.00 42.92 41.29 1j08 s ASP 135 CO 0.15 -1.32 -0.25 -0.69 0.21 0.00 0.00 175.17 173.27 1j08 s VAL 136 N 5.50 2.09 -0.15 -1.27 1.01 0.40 -1.04 120.40 126.93 1j08 s VAL 136 Ca 0.77 -1.08 -0.01 0.00 0.00 0.00 0.00 61.98 61.66 1j08 s VAL 136 Cb -0.28 -1.73 0.04 0.00 0.00 0.00 0.00 36.38 34.41 1j08 s VAL 136 CO 0.31 0.58 -0.03 -0.60 0.00 0.00 0.00 175.10 175.36 1j08 s ARG 137 N -0.46 1.20 -0.29 2.72 3.52 -0.41 -0.05 118.95 125.19 1j08 s ARG 137 Ca 0.05 -0.36 -0.09 0.00 -0.13 0.00 0.00 55.73 55.20 1j08 s ARG 137 Cb -0.11 -1.79 -0.02 0.00 -1.56 0.00 0.00 34.95 31.47 1j08 s ARG 137 CO 0.01 -0.42 0.13 0.42 -0.81 0.00 0.00 175.30 174.63 1j08 s ILE 138 N 1.73 4.55 -0.18 4.11 1.01 0.82 -0.25 121.20 132.99 1j08 s ILE 138 Ca 0.02 -0.29 -0.10 0.00 0.00 0.00 0.00 60.65 60.27 1j08 s ILE 138 Cb -0.15 -3.24 -0.05 0.00 0.01 0.00 0.00 42.46 39.03 1j08 s ILE 138 CO -0.07 0.17 0.15 -0.76 0.00 0.00 0.00 174.94 174.43 1j08 s LEU 139 N 1.62 4.24 -0.33 2.97 1.43 0.12 0.08 118.68 128.81 1j08 s LEU 139 Ca 0.05 0.30 0.02 0.00 -1.03 0.00 0.00 54.13 53.47 1j08 s LEU 139 Cb -0.16 -2.11 0.10 0.00 0.03 0.00 0.00 46.19 44.04 1j08 s LEU 139 CO 0.06 0.21 0.08 -0.63 0.23 0.00 0.00 176.35 176.30 1j08 s ILE 140 N 0.13 1.70 -0.03 -0.59 1.09 -0.12 -0.46 121.20 122.92 1j08 s ILE 140 Ca 0.10 -1.99 -0.30 0.00 -1.10 0.00 0.00 60.65 57.36 1j08 s ILE 140 Cb -0.11 -2.26 -0.03 0.00 -1.06 0.00 0.00 42.46 38.99 1j08 s ILE 140 CO -0.00 -0.64 1.11 -0.36 -0.10 0.00 0.00 174.94 174.94 1j08 s PHE 141 N 1.15 3.42 0.27 3.97 0.08 0.20 -0.25 117.98 126.82 1j08 s PHE 141 Ca 0.11 1.42 -0.01 0.00 0.12 0.00 0.00 56.93 58.56 1j08 s PHE 141 Cb -0.19 -3.31 -0.02 0.00 -0.57 0.00 0.00 43.02 38.93 1j08 s PHE 141 CO -0.15 -0.80 0.29 0.14 -0.10 0.00 0.00 175.22 174.61 1j08 s VAL 142 N 1.63 0.00 0.13 -0.44 -7.23 0.82 -2.40 120.40 112.91 1j08 s VAL 142 Ca 0.54 -1.82 0.04 0.00 -1.81 0.00 0.00 61.98 58.93 1j08 s VAL 142 Cb -0.24 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.18 1j08 s VAL 142 CO 0.24 0.00 -0.10 0.42 -0.31 0.00 0.00 175.10 175.35 1j08 s THR 143 N -3.75 1.06 0.42 5.32 -4.23 -1.26 -0.32 115.64 112.88 1j08 s THR 143 Ca 0.35 -1.91 0.12 0.00 -1.18 0.00 0.00 61.69 59.07 1j08 s THR 143 Cb 0.03 -1.67 0.18 0.00 1.34 0.00 0.00 72.50 72.38 1j08 s THR 143 CO 0.17 -0.69 1.97 -0.65 -0.54 0.00 0.00 174.62 174.88 1j08 h PRO 144 N 3.07 0.14 -0.00 3.99 0.11 -1.95 -3.01 132.00 134.34 1j08 h PRO 144 Ca -0.37 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1j08 h PRO 144 Cb 1.19 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1j08 h PRO 144 CO 0.60 0.27 -0.20 0.25 -0.21 0.00 0.00 178.00 178.71 1j08 n THR 145 N -4.32 0.00 -2.45 -1.15 -2.24 -1.26 -1.44 114.28 101.42 1j08 n THR 145 Ca -0.01 -0.07 -0.43 0.00 -2.27 0.00 0.00 64.05 61.27 1j08 n THR 145 Cb 0.24 0.06 -0.02 0.00 -2.10 0.00 0.00 70.33 68.51 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 10.04 0.29 -0.01 0.00 0.13 -1.90 -3.24 132.00 137.30 1j08 h PRO 147 Ca -0.26 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1j08 h PRO 147 Cb 1.09 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1j08 h PRO 147 CO 1.10 0.48 -0.69 0.66 -0.23 0.00 0.00 178.00 179.32 1j08 n TYR 148 N -4.20 0.00 -0.26 1.56 4.01 -1.26 -4.38 117.16 112.63 1j08 n TYR 148 Ca -0.01 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.83 1j08 n TYR 148 Cb 0.33 -0.02 0.36 0.00 -0.31 0.00 0.00 39.34 39.70 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 0.74 0.51 -0.48 0.00 0.11 -1.79 -2.09 132.00 128.99 1j08 h PRO 150 Ca 0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.50 1j08 h PRO 150 Cb 0.59 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.56 1j08 h PRO 150 CO -0.18 0.34 0.32 -0.07 -0.21 0.00 0.00 178.00 178.19 1j08 h LEU 151 N 0.52 0.56 -0.37 2.35 3.38 -1.66 0.30 115.31 120.39 1j08 h LEU 151 Ca 0.30 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 58.14 1j08 h LEU 151 Cb 0.48 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1j08 h LEU 151 CO -0.09 0.41 -0.20 0.00 0.09 0.00 0.00 178.44 178.65 1j08 h ALA 152 N 1.17 0.52 -0.41 1.53 0.00 -1.49 -1.60 119.26 118.98 1j08 h ALA 152 Ca 0.18 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1j08 h ALA 152 Cb -0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1j08 h ALA 152 CO -0.04 0.47 0.26 0.28 0.00 0.00 0.00 179.25 180.22 1j08 h VAL 153 N 0.58 1.12 -0.42 0.00 2.07 -1.21 -2.36 116.25 116.03 1j08 h VAL 153 Ca 0.08 -0.25 -0.06 0.00 0.82 0.00 0.00 66.70 67.29 1j08 h VAL 153 Cb 0.75 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 1j08 h VAL 153 CO 0.06 0.12 0.01 0.03 0.02 0.00 0.00 177.57 177.80 1j08 h ARG 154 N 0.54 0.67 -0.12 1.57 2.47 -0.85 -0.98 114.38 117.68 1j08 h ARG 154 Ca 0.15 -0.16 -0.01 0.00 -1.26 0.00 0.00 59.98 58.70 1j08 h ARG 154 Cb -0.03 -0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 28.19 1j08 h ARG 154 CO -0.03 0.68 0.03 1.98 0.56 0.00 0.00 179.97 183.19 1j08 h MET 155 N 0.63 0.19 -0.44 0.04 4.05 -0.98 -1.19 114.93 117.24 1j08 h MET 155 Ca 0.13 -0.05 -0.07 0.00 -0.28 0.00 0.00 59.70 59.44 1j08 h MET 155 Cb 0.38 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.14 1j08 h MET 155 CO 0.01 0.36 -0.01 0.00 0.23 0.00 0.00 176.91 177.50 1j08 h ALA 156 N 0.82 1.16 -0.07 0.39 0.00 -1.28 -2.21 119.26 118.06 1j08 h ALA 156 Ca 0.04 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.57 1j08 h ALA 156 Cb 0.25 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1j08 h ALA 156 CO 0.00 0.54 -0.49 0.45 0.00 0.00 0.00 179.25 179.76 1j08 h HIS 157 N 0.68 0.22 -0.16 0.00 -0.00 -1.00 -1.67 115.15 113.21 1j08 h HIS 157 Ca 0.13 -0.07 -0.15 0.00 -0.00 0.00 0.00 60.37 60.28 1j08 h HIS 157 Cb 0.44 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 27.79 1j08 h HIS 157 CO 0.02 0.63 -0.55 0.87 -0.00 0.00 0.00 177.93 178.90 1j08 h LYS 158 N 0.14 0.47 -0.36 2.45 1.57 -0.94 -0.97 116.57 118.94 1j08 h LYS 158 Ca 0.01 -0.30 -0.03 0.00 -1.87 0.00 0.00 60.65 58.46 1j08 h LYS 158 Cb 0.91 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.24 1j08 h LYS 158 CO 0.07 0.90 0.10 0.74 -0.57 0.00 0.00 179.45 180.69 1j08 h PHE 159 N 0.36 0.60 -0.07 -1.35 0.04 -1.14 -0.82 116.94 114.57 1j08 h PHE 159 Ca 0.01 -0.07 0.03 0.00 2.80 0.00 0.00 57.97 60.74 1j08 h PHE 159 Cb 1.08 -0.17 -0.03 0.00 2.20 0.00 0.00 35.95 39.02 1j08 h PHE 159 CO 0.04 0.59 -0.12 0.00 -0.60 0.00 0.00 178.31 178.22 1j08 h ALA 160 N 0.94 -0.08 -0.11 2.45 0.00 -1.09 -0.45 119.26 120.92 1j08 h ALA 160 Ca 0.12 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1j08 h ALA 160 Cb 0.29 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1j08 h ALA 160 CO -0.00 -0.59 -0.00 0.82 0.00 0.00 0.00 179.25 179.47 1j08 h ILE 161 N -0.17 0.92 -0.71 0.00 2.04 -0.98 -0.74 117.51 117.86 1j08 h ILE 161 Ca 0.07 -0.01 -0.00 0.00 1.00 0.00 0.00 64.86 65.91 1j08 h ILE 161 Cb 0.27 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1j08 h ILE 161 CO -0.17 0.01 0.42 -0.33 0.00 0.00 0.00 178.15 178.08 1j08 h GLU 162 N 0.04 0.95 0.00 2.37 4.39 -0.97 -0.42 114.58 120.94 1j08 h GLU 162 Ca 0.05 -0.08 -0.09 0.00 0.34 0.00 0.00 59.36 59.58 1j08 h GLU 162 Cb 0.06 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.50 1j08 h GLU 162 CO -0.09 0.67 -0.41 -0.97 -1.16 0.00 0.00 179.01 177.04 1j08 h ASN 163 N 0.97 0.00 -0.06 1.42 -0.73 -0.63 -1.54 115.58 115.01 1j08 h ASN 163 Ca 0.25 0.00 -0.13 0.00 1.87 0.00 0.00 56.30 58.29 1j08 h ASN 163 Cb -0.04 0.00 0.01 0.00 0.27 0.00 0.00 38.32 38.56 1j08 h ASN 163 CO -0.05 0.41 -0.47 0.74 -0.37 0.00 0.00 177.43 177.69 1j08 h THR 164 N 0.00 1.40 0.00 -3.57 2.02 -0.33 0.30 112.91 112.74 1j08 h THR 164 Ca -0.00 -1.87 -0.02 0.00 0.77 0.00 0.00 66.41 65.28 1j08 h THR 164 Cb 0.87 2.36 -0.00 0.00 -1.74 0.00 0.00 68.15 69.64 1j08 h THR 164 CO 0.05 0.55 -0.10 0.50 0.37 0.00 0.00 175.52 176.90 1j08 h LYS 165 N -0.04 0.00 0.00 6.66 3.64 -0.92 -1.04 116.57 124.87 1j08 h LYS 165 Ca -0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1j08 h LYS 165 Cb 1.14 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1j08 h LYS 165 CO 0.10 0.10 0.00 0.00 -2.27 0.00 0.00 179.45 177.37 1j08 n ALA 166 N -2.28 2.27 -0.35 5.00 0.00 -0.59 -4.88 120.51 119.68 1j08 n ALA 166 Ca -0.02 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1j08 n ALA 166 Cb 0.21 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.23 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 1.13 0.81 0.05 0.00 0.00 -0.39 -4.95 105.19 101.85 1j08 n GLY 167 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.10 1j08 n GLY 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1j08 h LYS 168 N 3.97 0.00 -5.54 1.61 1.79 -1.59 -3.49 116.57 113.32 1j08 h LYS 168 Ca 0.00 0.00 -0.39 0.00 -2.18 0.00 0.00 60.65 58.08 1j08 h LYS 168 Cb 0.00 0.00 0.13 0.00 -1.58 0.00 0.00 32.23 30.78 1j08 h LYS 168 CO 0.00 0.00 -0.65 0.41 -1.08 0.00 0.00 179.45 178.13 1j08 n GLY 169 N 1.74 -0.50 0.32 3.86 0.00 0.05 -4.91 105.19 105.75 1j08 n GLY 169 Ca -0.02 0.21 0.07 0.00 0.00 0.00 0.00 46.02 46.28 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 -4.76 1.80 -3.51 1.61 5.02 -1.26 -4.95 118.16 112.10 1j08 n LYS 170 Ca -0.00 -0.75 -0.38 0.00 -2.02 0.00 0.00 58.31 55.15 1j08 n LYS 170 Cb 0.56 -1.20 -0.09 0.00 -0.02 0.00 0.00 35.03 34.28 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 -1.65 5.26 -0.27 -0.18 1.01 -1.26 -0.45 121.20 123.65 1j08 s ILE 171 Ca 0.12 0.40 -0.07 0.00 0.00 0.00 0.00 60.65 61.10 1j08 s ILE 171 Cb 0.11 -3.61 -0.01 0.00 0.01 0.00 0.00 42.46 38.96 1j08 s ILE 171 CO 0.33 0.25 0.07 -0.76 0.00 0.00 0.00 174.94 174.83 1j08 s LEU 172 N 1.58 3.61 -0.45 2.97 1.43 0.93 -4.51 118.68 124.23 1j08 s LEU 172 Ca 0.12 -0.48 -0.16 0.00 -1.03 0.00 0.00 54.13 52.59 1j08 s LEU 172 Cb -0.15 -1.89 0.05 0.00 0.03 0.00 0.00 46.19 44.23 1j08 s LEU 172 CO 0.08 -0.12 0.38 -0.83 0.23 0.00 0.00 176.35 176.10 1j08 s GLY 173 N 1.55 2.02 -0.36 -3.19 0.00 0.37 -0.13 107.32 107.58 1j08 s GLY 173 Ca 0.04 -1.96 -0.04 0.00 0.00 0.00 0.00 44.72 42.76 1j08 s GLY 173 CO 0.03 1.04 0.12 0.99 0.00 0.00 0.00 173.10 175.28 1j08 s ASP 174 N 2.30 5.22 0.08 1.64 1.11 0.11 -2.08 116.67 125.04 1j08 s ASP 174 Ca 0.05 -1.48 -0.30 0.00 0.18 0.00 0.00 52.55 51.00 1j08 s ASP 174 Cb -0.22 -1.83 -0.06 0.00 1.07 0.00 0.00 42.92 41.88 1j08 s ASP 174 CO 0.08 -0.40 1.15 -0.32 1.18 0.00 0.00 175.17 176.86 1j08 s MET 175 N 1.29 4.48 -0.22 8.23 -2.45 -0.85 -0.95 119.30 128.83 1j08 s MET 175 Ca 0.01 1.71 0.01 0.00 -1.25 0.00 0.00 55.69 56.17 1j08 s MET 175 Cb -0.21 -3.35 0.05 0.00 1.25 0.00 0.00 34.83 32.57 1j08 s MET 175 CO -0.00 -0.17 -0.09 0.08 1.05 0.00 0.00 175.02 175.89 1j08 s VAL 176 N 0.80 1.67 -0.67 10.11 1.01 0.66 -0.41 120.40 133.58 1j08 s VAL 176 Ca 0.56 -1.14 -0.27 0.00 0.00 0.00 0.00 61.98 61.13 1j08 s VAL 176 Cb -0.28 -1.80 0.03 0.00 0.00 0.00 0.00 36.38 34.32 1j08 s VAL 176 CO 0.30 0.07 1.30 -0.70 0.00 0.00 0.00 175.10 176.07 1j08 s GLU 177 N 1.36 3.27 0.45 2.72 -6.30 -0.64 -0.13 118.70 119.43 1j08 s GLU 177 Ca -0.03 0.02 0.21 0.00 -2.50 0.00 0.00 54.97 52.66 1j08 s GLU 177 Cb -0.17 -4.14 1.18 0.00 0.00 0.00 0.00 34.13 31.00 1j08 s GLU 177 CO -0.07 -2.02 1.88 0.00 0.02 0.00 0.00 175.26 175.06 1j08 h ALA 178 N 10.24 2.34 -0.35 6.30 0.00 -0.95 -0.79 119.26 136.05 1j08 h ALA 178 Ca -0.27 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.52 1j08 h ALA 178 Cb 1.06 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1j08 h ALA 178 CO 1.24 -0.61 -0.31 0.82 0.00 0.00 0.00 179.25 180.39 1j08 h ILE 179 N 0.30 1.28 0.00 0.00 2.04 -1.91 -1.92 117.51 117.30 1j08 h ILE 179 Ca 0.44 -1.45 -0.08 0.00 1.00 0.00 0.00 64.86 64.77 1j08 h ILE 179 Cb 1.24 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 1j08 h ILE 179 CO -0.13 0.48 -0.42 -0.08 0.00 0.00 0.00 178.15 178.00 1j08 h GLU 180 N 0.64 0.00 -2.24 2.37 4.57 -1.72 -3.36 114.58 114.84 1j08 h GLU 180 Ca 0.07 0.00 -0.58 0.00 -1.18 0.00 0.00 59.36 57.68 1j08 h GLU 180 Cb 0.83 0.00 -0.42 0.00 -0.16 0.00 0.00 28.75 29.01 1j08 h GLU 180 CO 0.07 0.38 -0.71 0.66 -1.18 0.00 0.00 179.01 178.24 1j08 n TYR 181 N -3.19 3.50 -0.32 0.92 4.01 -0.39 -4.93 117.16 116.77 1j08 n TYR 181 Ca 0.02 -3.99 -0.04 0.00 -0.16 0.00 0.00 57.90 53.73 1j08 n TYR 181 Cb 0.69 -0.49 0.08 0.00 -0.31 0.00 0.00 39.34 39.32 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 3.11 1.18 -0.38 -0.72 0.13 -1.52 -1.45 132.00 132.35 1j08 h PRO 182 Ca 0.13 -0.12 -0.02 0.00 -0.87 0.00 0.00 66.00 65.12 1j08 h PRO 182 Cb 0.58 -0.24 -0.02 0.00 0.13 0.00 0.00 31.00 31.45 1j08 h PRO 182 CO 0.78 0.85 0.15 0.93 -0.23 0.00 0.00 178.00 180.47 1j08 h GLU 183 N 1.19 0.57 -0.56 0.86 3.07 -1.92 0.49 114.58 118.29 1j08 h GLU 183 Ca 0.30 -0.11 -0.00 0.00 -0.50 0.00 0.00 59.36 59.06 1j08 h GLU 183 Cb -0.01 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 27.78 1j08 h GLU 183 CO -0.05 0.55 0.35 2.35 -1.40 0.00 0.00 179.01 180.81 1j08 h TRP 184 N 0.47 0.73 -0.60 4.33 2.91 -1.91 0.41 115.95 122.29 1j08 h TRP 184 Ca 0.13 0.00 -0.07 0.00 1.13 0.00 0.00 58.89 60.08 1j08 h TRP 184 Cb 0.20 -0.24 -0.02 0.00 -0.51 0.00 0.00 29.16 28.58 1j08 h TRP 184 CO 0.00 0.49 0.11 0.00 -1.03 0.00 0.00 178.44 178.01 1j08 h ALA 185 N 1.18 0.80 -0.69 2.65 0.00 -0.97 -2.64 119.26 119.58 1j08 h ALA 185 Ca 0.20 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1j08 h ALA 185 Cb -0.03 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1j08 h ALA 185 CO -0.04 0.55 0.44 0.22 0.00 0.00 0.00 179.25 180.42 1j08 h ASP 186 N 0.90 0.81 -0.87 0.00 -0.00 0.66 -0.98 116.42 116.93 1j08 h ASP 186 Ca 0.19 -0.03 0.13 0.00 -0.00 0.00 0.00 57.03 57.32 1j08 h ASP 186 Cb 0.41 -0.20 -0.07 0.00 -0.00 0.00 0.00 39.33 39.47 1j08 h ASP 186 CO 0.01 0.60 0.56 -0.61 -0.00 0.00 0.00 179.24 179.80 1j08 h GLN 187 N 0.94 0.69 -0.57 0.28 4.15 -0.56 0.04 115.11 120.08 1j08 h GLN 187 Ca 0.25 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.63 1j08 h GLN 187 Cb -0.08 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.45 1j08 h GLN 187 CO -0.05 0.46 0.00 0.66 -1.93 0.00 0.00 178.83 177.96 1j08 n TYR 188 N -4.55 1.23 -3.96 3.99 4.01 -0.63 -4.96 117.16 112.30 1j08 n TYR 188 Ca 0.16 -0.61 -0.26 0.00 -0.16 0.00 0.00 57.90 57.03 1j08 n TYR 188 Cb 0.43 -0.20 -0.02 0.00 -0.31 0.00 0.00 39.34 39.24 1j08 n TYR 188 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1j08 n ASN 189 N 0.91 -0.52 -4.67 7.72 4.05 -0.00 -4.85 115.26 117.90 1j08 n ASN 189 Ca 0.23 -1.03 -0.42 0.00 0.45 0.00 0.00 54.58 53.81 1j08 n ASN 189 Cb 0.80 -2.96 -0.03 0.00 1.23 0.00 0.00 39.78 38.83 1j08 n ASN 189 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1j08 s VAL 190 N -3.96 3.62 0.00 3.44 1.01 -0.48 -4.88 120.40 119.16 1j08 s VAL 190 Ca 0.03 0.84 0.00 0.00 0.00 0.00 0.00 61.98 62.86 1j08 s VAL 190 Cb -0.01 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.82 1j08 s VAL 190 CO 0.90 -0.05 0.00 0.23 0.00 0.00 0.00 175.10 176.17 1j08 n MET 191 N 6.60 0.00 -3.03 2.72 2.81 -1.26 -4.90 117.12 120.06 1j08 n MET 191 Ca 0.16 0.00 -0.37 0.00 -1.81 0.00 0.00 57.70 55.68 1j08 n MET 191 Cb 0.43 0.00 -0.06 0.00 -0.71 0.00 0.00 33.22 32.88 1j08 n MET 191 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1j08 s ALA 192 N -2.46 3.39 0.25 3.04 0.00 -1.26 -5.07 121.76 119.64 1j08 s ALA 192 Ca 0.00 0.26 0.11 0.00 0.00 0.00 0.00 51.96 52.33 1j08 s ALA 192 Cb 0.00 -2.90 -0.05 0.00 0.00 0.00 0.00 23.12 20.17 1j08 s ALA 192 CO 0.00 0.30 -0.15 0.14 0.00 0.00 0.00 175.76 176.05 1j08 s VAL 193 N -1.46 2.77 0.31 0.00 -7.23 -1.26 -4.21 120.40 109.32 1j08 s VAL 193 Ca 0.43 -2.13 -0.24 0.00 -1.81 0.00 0.00 61.98 58.23 1j08 s VAL 193 Cb -0.18 -2.43 -0.10 0.00 0.56 0.00 0.00 36.38 34.23 1j08 s VAL 193 CO 0.22 -0.30 0.89 -2.16 -0.31 0.00 0.00 175.10 173.44 1j08 s PRO 194 N -3.31 4.47 -0.16 4.82 0.04 -1.26 -4.76 135.00 134.84 1j08 s PRO 194 Ca 0.28 1.20 -0.01 0.00 0.04 0.00 0.00 61.00 62.50 1j08 s PRO 194 Cb -0.06 -2.76 -0.01 0.00 0.04 0.00 0.00 34.50 31.71 1j08 s PRO 194 CO 0.15 0.28 -0.10 0.21 0.04 0.00 0.00 177.00 177.58 1j08 s LYS 195 N -2.15 3.40 -0.13 4.56 2.20 -1.01 -0.69 119.74 125.92 1j08 s LYS 195 Ca 0.50 -0.66 -0.02 0.00 -0.36 0.00 0.00 55.97 55.43 1j08 s LYS 195 Cb -0.17 -2.76 -0.03 0.00 -1.51 0.00 0.00 37.83 33.36 1j08 s LYS 195 CO 0.22 0.09 -0.05 0.42 -0.36 0.00 0.00 175.35 175.67 1j08 s ILE 196 N 0.70 3.82 -0.10 5.43 1.09 0.51 -0.62 121.20 132.02 1j08 s ILE 196 Ca -0.05 -0.40 0.03 0.00 -1.10 0.00 0.00 60.65 59.13 1j08 s ILE 196 Cb -0.15 -2.64 0.01 0.00 -1.06 0.00 0.00 42.46 38.62 1j08 s ILE 196 CO 0.02 0.53 -0.18 -0.69 -0.10 0.00 0.00 174.94 174.52 1j08 s VAL 197 N -0.03 1.66 -0.24 2.92 1.01 0.39 -1.88 120.40 124.23 1j08 s VAL 197 Ca 0.01 -0.77 -0.04 0.00 0.00 0.00 0.00 61.98 61.18 1j08 s VAL 197 Cb -0.13 -1.47 0.00 0.00 0.00 0.00 0.00 36.38 34.78 1j08 s VAL 197 CO 0.03 0.47 -0.02 -0.63 0.00 0.00 0.00 175.10 174.95 1j08 s ILE 198 N 0.64 3.39 -0.06 2.22 1.01 -0.49 0.11 121.20 128.02 1j08 s ILE 198 Ca -0.13 -0.64 -0.01 0.00 0.00 0.00 0.00 60.65 59.87 1j08 s ILE 198 Cb -0.16 -2.62 -0.03 0.00 0.01 0.00 0.00 42.46 39.65 1j08 s ILE 198 CO 0.04 0.31 0.01 -1.10 0.00 0.00 0.00 174.94 174.20 1j08 s GLN 199 N 1.45 2.96 -0.14 2.79 -0.21 0.65 -1.54 119.66 125.63 1j08 s GLN 199 Ca 0.04 -0.45 0.01 0.00 0.02 0.00 0.00 55.36 54.98 1j08 s GLN 199 Cb -0.15 -2.78 0.02 0.00 1.00 0.00 0.00 33.01 31.09 1j08 s GLN 199 CO -0.02 0.68 -0.16 0.08 -2.12 0.00 0.00 175.29 173.75 1j08 s VAL 200 N -0.97 1.64 -2.14 1.09 1.01 -0.61 -1.28 120.40 119.14 1j08 s VAL 200 Ca 0.16 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.44 1j08 s VAL 200 Cb -0.11 -1.51 0.00 0.00 0.00 0.00 0.00 36.38 34.76 1j08 s VAL 200 CO 0.05 0.47 0.00 0.59 0.00 0.00 0.00 175.10 176.21 1j08 n ASN 201 N 4.49 -5.55 0.00 3.32 3.02 -0.21 -2.10 115.26 118.22 1j08 n ASN 201 Ca -0.18 0.43 0.00 0.00 -0.03 0.00 0.00 54.58 54.80 1j08 n ASN 201 Cb 0.51 -4.86 0.00 0.00 -0.61 0.00 0.00 39.78 34.82 1j08 n ASN 201 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1j08 n GLY 202 N -0.49 0.25 3.40 7.41 0.00 -1.26 -5.08 105.19 109.42 1j08 n GLY 202 Ca -0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 1j08 n GLY 202 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1j08 s GLU 203 N -0.99 2.19 0.08 1.61 -1.05 -0.89 -5.04 118.70 114.61 1j08 s GLU 203 Ca 0.00 -0.89 -0.31 0.00 -0.15 0.00 0.00 54.97 53.63 1j08 s GLU 203 Cb 0.00 -2.17 -0.09 0.00 -0.44 0.00 0.00 34.13 31.43 1j08 s GLU 203 CO 0.00 0.57 1.76 -0.51 0.95 0.00 0.00 175.26 178.03 1j08 s ASP 204 N -0.89 6.51 -0.05 0.83 1.01 -1.26 -1.57 116.67 121.25 1j08 s ASP 204 Ca 0.12 2.61 0.04 0.00 0.71 0.00 0.00 52.55 56.02 1j08 s ASP 204 Cb -0.10 -2.56 -0.06 0.00 1.01 0.00 0.00 42.92 41.21 1j08 s ASP 204 CO 0.01 -0.96 0.00 0.29 0.21 0.00 0.00 175.17 174.73 1j08 n LYS 205 N 5.95 2.61 -3.81 8.23 4.76 -0.59 -4.94 118.16 130.36 1j08 n LYS 205 Ca 0.17 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.49 1j08 n LYS 205 Cb 0.40 -1.13 -0.09 0.00 -1.84 0.00 0.00 35.03 32.36 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 -2.13 0.07 -0.02 -0.18 1.01 -1.17 -4.92 120.40 113.06 1j08 s VAL 206 Ca -0.04 -0.57 -0.04 0.00 0.00 0.00 0.00 61.98 61.34 1j08 s VAL 206 Cb 0.02 -0.52 0.00 0.00 0.00 0.00 0.00 36.38 35.88 1j08 s VAL 206 CO 0.20 -0.31 0.08 -1.10 0.00 0.00 0.00 175.10 173.97 1j08 s GLN 207 N -1.33 0.21 0.17 2.72 -0.21 -1.26 -1.40 119.66 118.56 1j08 s GLN 207 Ca -0.14 -0.07 -0.24 0.00 0.02 0.00 0.00 55.36 54.94 1j08 s GLN 207 Cb -0.06 0.09 0.06 0.00 1.00 0.00 0.00 33.01 34.09 1j08 s GLN 207 CO 0.03 -0.04 0.74 -0.59 -2.12 0.00 0.00 175.29 173.31 1j08 s PHE 208 N -0.42 -0.34 0.04 0.91 -0.71 -0.79 -5.02 117.98 111.65 1j08 s PHE 208 Ca -0.05 0.05 0.06 0.00 -1.04 0.00 0.00 56.93 55.95 1j08 s PHE 208 Cb -0.03 0.61 -0.02 0.00 -1.21 0.00 0.00 43.02 42.37 1j08 s PHE 208 CO 0.00 -0.92 -0.18 -1.21 -1.34 0.00 0.00 175.22 171.57 1j08 s GLU 209 N -3.63 1.23 0.00 1.99 2.02 -1.26 -0.37 118.70 118.69 1j08 s GLU 209 Ca 0.06 -0.85 0.00 0.00 0.02 0.00 0.00 54.97 54.20 1j08 s GLU 209 Cb -0.03 -1.30 0.00 0.00 0.10 0.00 0.00 34.13 32.90 1j08 s GLU 209 CO -0.04 0.33 0.00 0.41 0.02 0.00 0.00 175.26 175.98 1j08 n GLY 210 N 1.93 0.98 3.44 -1.39 0.00 0.13 -4.83 105.19 105.44 1j08 n GLY 210 Ca -0.17 -2.08 -0.44 0.00 0.00 0.00 0.00 46.02 43.32 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 -1.49 3.65 0.27 4.61 0.00 -1.26 -4.80 121.76 122.75 1j08 s ALA 211 Ca 0.00 -3.02 -0.29 0.00 0.00 0.00 0.00 51.96 48.65 1j08 s ALA 211 Cb 0.00 -3.99 -0.10 0.00 0.00 0.00 0.00 23.12 19.03 1j08 s ALA 211 CO 0.00 -2.83 1.27 0.71 0.00 0.00 0.00 175.76 174.92 1j08 s TYR 212 N 1.99 3.22 0.91 0.00 1.51 -1.26 -4.99 117.35 118.72 1j08 s TYR 212 Ca 0.34 1.39 -0.10 0.00 -1.01 0.00 0.00 57.07 57.68 1j08 s TYR 212 Cb -0.05 -3.59 0.14 0.00 -0.11 0.00 0.00 41.96 38.36 1j08 s TYR 212 CO -0.07 -1.65 1.15 -2.30 -1.11 0.00 0.00 175.55 171.57 1j08 n PRO 213 N 1.54 -0.40 -0.06 -1.71 -0.02 -1.26 -4.53 135.00 128.56 1j08 n PRO 213 Ca 0.02 -0.05 -0.14 0.00 -2.02 0.00 0.00 63.50 61.31 1j08 n PRO 213 Cb 0.43 -2.38 -0.09 0.00 -0.02 0.00 0.00 33.50 31.43 1j08 n PRO 213 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1j08 h GLU 214 N -1.80 -0.48 -0.52 -0.52 4.81 -1.99 0.17 114.58 114.26 1j08 h GLU 214 Ca -0.43 0.03 0.10 0.00 -0.13 0.00 0.00 59.36 58.93 1j08 h GLU 214 Cb 1.27 0.11 -0.08 0.00 0.63 0.00 0.00 28.75 30.68 1j08 h GLU 214 CO 0.41 -0.32 0.05 0.87 -0.73 0.00 0.00 179.01 179.29 1j08 h LYS 215 N -0.50 0.16 -0.21 1.92 1.79 -1.99 -0.87 116.57 116.87 1j08 h LYS 215 Ca 0.06 -0.01 -0.15 0.00 -2.18 0.00 0.00 60.65 58.37 1j08 h LYS 215 Cb 0.64 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.25 1j08 h LYS 215 CO -0.49 0.11 -0.49 0.52 -1.08 0.00 0.00 179.45 178.01 1j08 h MET 216 N 0.17 0.57 -0.53 3.15 2.86 -1.80 -0.07 114.93 119.28 1j08 h MET 216 Ca 0.27 -0.33 -0.05 0.00 -2.06 0.00 0.00 59.70 57.53 1j08 h MET 216 Cb 0.39 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 1j08 h MET 216 CO -0.40 0.93 0.15 0.35 1.06 0.00 0.00 176.91 179.00 1j08 h PHE 217 N 0.45 0.86 -0.71 -0.22 3.04 -0.19 -0.95 116.94 119.23 1j08 h PHE 217 Ca 0.02 -0.09 -0.06 0.00 3.98 0.00 0.00 57.97 61.81 1j08 h PHE 217 Cb 1.02 -0.25 -0.03 0.00 2.56 0.00 0.00 35.95 39.25 1j08 h PHE 217 CO 0.04 0.75 0.19 1.25 -2.02 0.00 0.00 178.31 178.52 1j08 h LEU 218 N 0.73 1.06 -1.10 0.59 5.85 -1.06 -2.03 115.31 119.34 1j08 h LEU 218 Ca 0.17 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 1j08 h LEU 218 Cb 0.30 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 1j08 h LEU 218 CO -0.00 1.00 0.50 -0.08 -0.34 0.00 0.00 178.44 179.52 1j08 h GLU 219 N 1.07 1.11 -0.33 1.25 4.22 -0.54 0.69 114.58 122.05 1j08 h GLU 219 Ca 0.23 -0.10 -0.05 0.00 0.08 0.00 0.00 59.36 59.52 1j08 h GLU 219 Cb 0.34 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1j08 h GLU 219 CO -0.00 0.77 0.02 0.87 -2.18 0.00 0.00 179.01 178.49 1j08 h LYS 220 N 1.13 0.57 0.01 1.92 1.79 -0.71 -1.82 116.57 119.46 1j08 h LYS 220 Ca 0.30 -0.17 -0.00 0.00 -2.18 0.00 0.00 60.65 58.60 1j08 h LYS 220 Cb -0.05 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.54 1j08 h LYS 220 CO -0.06 0.68 -0.00 1.25 -1.08 0.00 0.00 179.45 180.24 1j08 h LEU 221 N 0.38 -0.01 -1.44 2.94 5.85 -0.70 -1.20 115.31 121.14 1j08 h LEU 221 Ca 0.10 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 1j08 h LEU 221 Cb 0.41 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 1j08 h LEU 221 CO 0.01 0.02 -0.13 -0.07 -0.34 0.00 0.00 178.44 177.94 1j08 h LEU 222 N -0.04 0.20 -0.38 2.25 3.38 -0.87 -2.03 115.31 117.82 1j08 h LEU 222 Ca -0.00 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 1j08 h LEU 222 Cb 0.04 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1j08 h LEU 222 CO 0.00 0.35 -0.32 0.77 0.09 0.00 0.00 178.44 179.33 1j08 h SER 223 N 0.20 0.95 -0.11 -0.43 4.64 -1.03 -2.58 113.55 115.19 1j08 h SER 223 Ca 0.04 -0.45 0.03 0.00 -0.47 0.00 0.00 61.79 60.94 1j08 h SER 223 Cb 0.36 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1j08 h SER 223 CO 0.02 1.20 0.08 0.00 -0.87 0.00 0.00 176.83 177.26 1j08 h ALA 224 N 0.78 2.06 -0.10 5.18 0.00 -0.53 0.38 119.26 127.04 1j08 h ALA 224 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1j08 h ALA 224 Cb 0.91 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1j08 h ALA 224 CO 0.08 -0.09 0.00 1.28 0.00 0.00 0.00 179.25 180.52 1j08 n LEU 225 N -4.51 0.66 0.00 0.00 4.77 -0.91 -4.87 117.00 112.14 1j08 n LEU 225 Ca -0.01 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.67 1j08 n LEU 225 Cb 0.17 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1j08 n LEU 225 CO 0.35 0.15 0.00 -1.20 -1.33 0.00 0.00 177.39 175.36