#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 0.83 -9.03 0.99 4.07 -2.00 -3.42 115.31 106.75 1j08 h LEU 3 Ca 0.00 -0.01 -0.67 0.00 0.08 0.00 0.00 57.88 57.29 1j08 h LEU 3 Cb 0.00 -0.19 -0.19 0.00 1.08 0.00 0.00 40.66 41.36 1j08 h LEU 3 CO 0.00 0.58 -0.67 -0.63 -1.08 0.00 0.00 178.44 176.63 1j08 s ILE 4 N -6.11 3.87 0.64 1.22 1.01 -1.26 -5.10 121.20 115.46 1j08 s ILE 4 Ca -0.13 -0.40 -0.15 0.00 0.00 0.00 0.00 60.65 59.98 1j08 s ILE 4 Cb 0.16 -2.63 -0.01 0.00 0.01 0.00 0.00 42.46 39.99 1j08 s ILE 4 CO 0.78 0.56 1.08 -0.94 0.00 0.00 0.00 174.94 176.42 1j08 s SER 5 N -0.36 5.44 0.27 3.58 1.04 -1.26 -4.84 113.70 117.57 1j08 s SER 5 Ca 0.06 1.86 -0.00 0.00 0.48 0.00 0.00 55.95 58.34 1j08 s SER 5 Cb -0.12 -2.53 0.52 0.00 0.10 0.00 0.00 66.02 63.98 1j08 s SER 5 CO 0.02 -1.40 1.82 -0.08 0.98 0.00 0.00 173.24 174.58 1j08 h GLU 6 N 0.09 0.86 0.25 4.02 4.81 -1.99 0.53 114.58 123.15 1j08 h GLU 6 Ca -0.46 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 1j08 h GLU 6 Cb 1.23 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1j08 h GLU 6 CO 0.56 0.57 -0.12 1.49 -0.73 0.00 0.00 179.01 180.78 1j08 h GLU 7 N 0.89 -0.32 -0.08 1.92 4.81 -2.00 -1.95 114.58 117.85 1j08 h GLU 7 Ca 0.47 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.72 1j08 h GLU 7 Cb 0.50 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 1j08 h GLU 7 CO -0.28 -0.06 0.01 -0.44 -0.73 0.00 0.00 179.01 177.51 1j08 h ASP 8 N -0.56 0.10 -0.28 1.04 3.32 -1.81 0.40 116.42 118.64 1j08 h ASP 8 Ca -0.03 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 1j08 h ASP 8 Cb 0.41 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 1j08 h ASP 8 CO 0.06 0.12 0.00 0.11 -1.72 0.00 0.00 179.24 177.81 1j08 h LYS 9 N 0.11 0.50 -0.50 3.56 1.57 -0.72 0.41 116.57 121.51 1j08 h LYS 9 Ca 0.03 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 1j08 h LYS 9 Cb 0.07 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 1j08 h LYS 9 CO 0.00 0.65 0.26 -0.09 -0.57 0.00 0.00 179.45 179.70 1j08 h ARG 10 N 0.29 0.70 -0.49 3.15 2.43 -0.50 -1.61 114.38 118.35 1j08 h ARG 10 Ca 0.08 -0.09 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1j08 h ARG 10 Cb 0.42 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 1j08 h ARG 10 CO 0.01 0.56 0.25 0.82 -1.51 0.00 0.00 179.97 180.10 1j08 h ILE 11 N 0.66 1.18 -0.43 1.20 1.08 -0.71 -1.04 117.51 119.45 1j08 h ILE 11 Ca 0.17 -0.51 0.05 0.00 -0.39 0.00 0.00 64.86 64.19 1j08 h ILE 11 Cb 0.07 0.62 -0.05 0.00 -3.07 0.00 0.00 36.82 34.40 1j08 h ILE 11 CO -0.03 0.20 0.17 0.40 -0.69 0.00 0.00 178.15 178.20 1j08 h ILE 12 N 0.65 0.89 -0.26 -0.67 2.04 0.16 0.56 117.51 120.88 1j08 h ILE 12 Ca 0.17 -0.12 -0.07 0.00 1.00 0.00 0.00 64.86 65.84 1j08 h ILE 12 Cb 0.10 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 1j08 h ILE 12 CO -0.02 0.06 -0.13 0.50 0.00 0.00 0.00 178.15 178.56 1j08 h LYS 13 N 0.35 0.44 0.08 2.37 3.64 -1.01 0.63 116.57 123.07 1j08 h LYS 13 Ca 0.20 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1j08 h LYS 13 Cb 0.17 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1j08 h LYS 13 CO -0.19 0.57 -0.04 1.49 -2.27 0.00 0.00 179.45 179.01 1j08 h GLU 14 N 0.40 -0.11 0.00 1.90 4.57 -0.09 -1.85 114.58 119.41 1j08 h GLU 14 Ca 0.08 0.01 -0.08 0.00 -1.18 0.00 0.00 59.36 58.18 1j08 h GLU 14 Cb 0.48 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.08 1j08 h GLU 14 CO 0.03 0.44 -0.38 0.93 -1.18 0.00 0.00 179.01 178.86 1j08 h GLU 15 N -0.82 0.00 0.00 1.92 5.08 0.07 -3.42 114.58 117.41 1j08 h GLU 15 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1j08 h GLU 15 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1j08 h GLU 15 CO 0.02 0.38 0.00 1.19 -1.00 0.00 0.00 179.01 179.59 1j08 n PHE 16 N -3.31 0.00 0.10 4.33 3.01 0.19 -4.88 117.46 116.91 1j08 n PHE 16 Ca 0.01 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.53 1j08 n PHE 16 Cb 0.60 0.09 0.32 0.00 -0.01 0.00 0.00 39.48 40.49 1j08 n PHE 16 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1j08 n PHE 17 N -2.28 0.39 0.32 1.38 3.72 -1.08 -0.93 117.46 118.99 1j08 n PHE 17 Ca 0.00 0.21 0.13 0.00 -0.05 0.00 0.00 57.45 57.73 1j08 n PHE 17 Cb 0.00 -0.74 0.29 0.00 -0.94 0.00 0.00 39.48 38.09 1j08 n PHE 17 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1j08 h SER 18 N 0.00 0.00 -0.13 4.37 4.64 -1.58 -2.97 113.55 117.88 1j08 h SER 18 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1j08 h SER 18 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1j08 h SER 18 CO 0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 1j08 n LYS 19 N -2.88 1.80 -2.28 4.77 5.02 -0.10 -4.94 118.16 119.54 1j08 n LYS 19 Ca 0.04 -1.18 -0.37 0.00 -2.02 0.00 0.00 58.31 54.77 1j08 n LYS 19 Cb 0.47 -1.43 -0.01 0.00 -0.02 0.00 0.00 35.03 34.04 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 -1.84 3.84 0.01 1.97 -1.94 -1.13 -4.84 119.30 115.37 1j08 s MET 20 Ca 0.34 1.78 -0.01 0.00 -1.71 0.00 0.00 55.69 56.09 1j08 s MET 20 Cb 0.19 -2.47 -0.00 0.00 2.01 0.00 0.00 34.83 34.56 1j08 s MET 20 CO 0.29 -0.48 -0.01 0.28 -0.01 0.00 0.00 175.02 175.08 1j08 n VAL 21 N -0.35 0.29 -3.41 -6.03 0.31 -1.26 -5.02 118.33 102.85 1j08 n VAL 21 Ca 0.07 0.14 -0.28 0.00 -0.01 0.00 0.00 64.34 64.25 1j08 n VAL 21 Cb 0.48 -1.22 -0.03 0.00 -0.91 0.00 0.00 33.84 32.16 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 -5.10 6.43 0.42 4.52 0.01 -0.84 -5.03 114.94 115.36 1j08 s ASN 22 Ca -0.01 0.65 -0.25 0.00 -0.71 0.00 0.00 52.86 52.55 1j08 s ASN 22 Cb 0.00 -2.12 -0.08 0.00 0.41 0.00 0.00 41.25 39.46 1j08 s ASN 22 CO 0.01 -0.16 1.18 -2.16 -1.51 0.00 0.00 177.10 174.46 1j08 s PRO 23 N -3.50 3.96 -0.06 -0.60 0.04 -1.26 -4.62 135.00 128.97 1j08 s PRO 23 Ca 0.43 1.85 0.05 0.00 0.04 0.00 0.00 61.00 63.36 1j08 s PRO 23 Cb -0.11 -2.61 -0.02 0.00 0.04 0.00 0.00 34.50 31.81 1j08 s PRO 23 CO 0.30 -0.40 -0.19 0.08 0.04 0.00 0.00 177.00 176.83 1j08 s VAL 24 N -1.43 2.64 -0.21 -0.36 1.01 0.37 -0.92 120.40 121.50 1j08 s VAL 24 Ca 0.59 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.72 1j08 s VAL 24 Cb -0.31 -2.01 0.04 0.00 0.00 0.00 0.00 36.38 34.10 1j08 s VAL 24 CO 0.38 0.58 -0.14 -0.75 0.00 0.00 0.00 175.10 175.17 1j08 s LYS 25 N -0.44 2.46 -0.38 2.72 2.20 -0.69 -0.73 119.74 124.87 1j08 s LYS 25 Ca 0.05 -0.97 -0.26 0.00 -0.36 0.00 0.00 55.97 54.42 1j08 s LYS 25 Cb -0.12 -2.59 0.02 0.00 -1.51 0.00 0.00 37.83 33.62 1j08 s LYS 25 CO 0.02 -0.38 0.96 -0.51 -0.36 0.00 0.00 175.35 175.07 1j08 s LEU 26 N 1.28 3.96 -0.43 5.43 1.43 0.62 -2.50 118.68 128.46 1j08 s LEU 26 Ca -0.01 0.57 -0.14 0.00 -1.03 0.00 0.00 54.13 53.52 1j08 s LEU 26 Cb -0.16 -3.31 0.04 0.00 0.03 0.00 0.00 46.19 42.80 1j08 s LEU 26 CO -0.09 -0.91 0.32 -0.63 0.23 0.00 0.00 176.35 175.27 1j08 s ILE 27 N 3.60 5.12 -0.21 -0.59 1.01 -0.93 -0.82 121.20 128.38 1j08 s ILE 27 Ca 0.40 -0.86 -0.10 0.00 0.00 0.00 0.00 60.65 60.08 1j08 s ILE 27 Cb -0.11 -3.94 -0.05 0.00 0.01 0.00 0.00 42.46 38.37 1j08 s ILE 27 CO 0.20 -0.41 0.14 -0.69 0.00 0.00 0.00 174.94 174.18 1j08 s VAL 28 N 1.64 5.40 -0.27 2.92 1.01 -0.61 -1.58 120.40 128.91 1j08 s VAL 28 Ca 0.04 0.19 -0.07 0.00 0.00 0.00 0.00 61.98 62.15 1j08 s VAL 28 Cb -0.21 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.69 1j08 s VAL 28 CO 0.08 0.42 0.06 -0.36 0.00 0.00 0.00 175.10 175.30 1j08 s PHE 29 N 0.50 3.10 0.06 5.22 0.40 0.13 0.13 117.98 127.52 1j08 s PHE 29 Ca 0.08 -0.79 0.09 0.00 -0.60 0.00 0.00 56.93 55.71 1j08 s PHE 29 Cb -0.12 -2.23 -0.03 0.00 0.51 0.00 0.00 43.02 41.15 1j08 s PHE 29 CO -0.01 -0.50 -0.25 0.42 0.70 0.00 0.00 175.22 175.58 1j08 s ILE 30 N 1.54 2.26 0.36 0.64 1.01 -0.08 -1.90 121.20 125.03 1j08 s ILE 30 Ca 0.04 -1.42 0.04 0.00 0.00 0.00 0.00 60.65 59.31 1j08 s ILE 30 Cb -0.16 -1.91 -0.06 0.00 0.01 0.00 0.00 42.46 40.34 1j08 s ILE 30 CO 0.02 0.32 0.06 -0.83 0.00 0.00 0.00 174.94 174.51 1j08 s GLY 31 N -1.40 2.28 -0.13 6.18 0.00 -1.26 0.37 107.32 113.36 1j08 s GLY 31 Ca 0.13 -1.84 0.03 0.00 0.00 0.00 0.00 44.72 43.04 1j08 s GLY 31 CO 0.03 -1.88 1.20 0.28 0.00 0.00 0.00 173.10 172.73 1j08 n LYS 32 N -0.80 1.79 0.00 2.90 4.76 -1.26 -4.84 118.16 120.71 1j08 n LYS 32 Ca -0.04 -1.10 0.00 0.00 -2.87 0.00 0.00 58.31 54.29 1j08 n LYS 32 Cb 0.66 -1.55 0.00 0.00 -1.84 0.00 0.00 35.03 32.30 1j08 n LYS 32 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1j08 n GLU 33 N 0.02 3.81 -2.61 1.97 0.00 -1.26 -5.04 120.64 117.53 1j08 n GLU 33 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 57.16 56.91 1j08 n GLU 33 Cb 0.81 0.00 -0.02 0.00 0.00 0.00 0.00 31.44 32.22 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 2.80 3.33 -0.36 4.31 5.04 -1.26 -4.93 115.29 124.21 1j08 s HIS 34 Ca 0.00 1.43 -0.05 0.00 -1.54 0.00 0.00 55.06 54.90 1j08 s HIS 34 Cb 0.00 -3.29 0.20 0.00 0.04 0.00 0.00 32.58 29.53 1j08 s HIS 34 CO 0.00 -0.64 0.98 0.00 -2.34 0.00 0.00 174.74 172.74 1j08 n GLN 36 N 3.28 0.99 -0.16 0.00 7.27 -1.26 -3.15 117.38 124.35 1j08 n GLN 36 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.17 1j08 n GLN 36 Cb 0.62 -1.49 0.00 0.00 2.41 0.00 0.00 30.24 31.79 1j08 n GLN 36 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1j08 n TYR 37 N 0.01 0.00 0.08 3.69 4.01 -1.26 -4.90 117.16 118.80 1j08 n TYR 37 Ca 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.70 1j08 n TYR 37 Cb 0.25 0.06 0.17 0.00 -0.31 0.00 0.00 39.34 39.51 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 0.20 0.55 -0.68 0.00 3.32 -1.90 -2.33 116.42 115.58 1j08 h ASP 39 Ca 0.01 -0.31 -0.08 0.00 0.02 0.00 0.00 57.03 56.67 1j08 h ASP 39 Cb 0.97 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.34 1j08 h ASP 39 CO 0.08 0.73 0.13 1.56 -1.72 0.00 0.00 179.24 180.02 1j08 h GLN 40 N 0.36 1.12 -0.45 3.56 4.20 -1.91 -1.51 115.11 120.48 1j08 h GLN 40 Ca 0.09 -0.29 0.07 0.00 0.06 0.00 0.00 58.65 58.59 1j08 h GLN 40 Cb 0.45 -0.14 -0.06 0.00 0.30 0.00 0.00 27.48 28.03 1j08 h GLN 40 CO 0.02 1.01 0.07 1.25 -0.67 0.00 0.00 178.83 180.51 1j08 h LEU 41 N 1.05 -0.03 -0.68 1.46 5.85 -1.13 0.62 115.31 122.45 1j08 h LEU 41 Ca 0.21 0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.97 1j08 h LEU 41 Cb 0.42 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 1j08 h LEU 41 CO 0.01 0.02 0.25 0.11 -0.34 0.00 0.00 178.44 178.48 1j08 h LYS 42 N 0.20 1.03 -0.70 1.25 1.57 -1.19 -1.16 116.57 117.58 1j08 h LYS 42 Ca 0.22 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1j08 h LYS 42 Cb 0.29 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 1j08 h LYS 42 CO -0.30 0.87 0.34 0.37 -0.57 0.00 0.00 179.45 180.16 1j08 h GLN 43 N 0.98 0.99 0.01 3.15 4.15 -0.11 -2.08 115.11 122.20 1j08 h GLN 43 Ca 0.22 -0.13 -0.00 0.00 0.77 0.00 0.00 58.65 59.51 1j08 h GLN 43 Cb 0.24 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 27.75 1j08 h GLN 43 CO -0.01 0.76 -0.01 1.25 -1.93 0.00 0.00 178.83 178.89 1j08 h LEU 44 N 0.99 -0.01 -1.98 -2.39 5.85 0.87 -1.64 115.31 117.00 1j08 h LEU 44 Ca 0.24 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 1j08 h LEU 44 Cb 0.09 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 1j08 h LEU 44 CO -0.03 0.28 -0.10 -0.37 -0.34 0.00 0.00 178.44 177.88 1j08 h VAL 45 N -0.31 0.59 0.02 1.05 -1.51 -1.09 -1.84 116.25 113.16 1j08 h VAL 45 Ca -0.00 -0.46 -0.00 0.00 -1.23 0.00 0.00 66.70 65.01 1j08 h VAL 45 Cb 0.30 1.29 0.00 0.00 -2.13 0.00 0.00 31.29 30.76 1j08 h VAL 45 CO 0.00 0.10 -0.01 -0.61 -1.23 0.00 0.00 177.57 175.82 1j08 h GLN 46 N 0.00 -0.03 -0.61 5.19 5.75 -1.22 -2.86 115.11 121.34 1j08 h GLN 46 Ca -0.00 0.00 0.05 0.00 -0.15 0.00 0.00 58.65 58.55 1j08 h GLN 46 Cb 0.28 0.01 -0.05 0.00 1.07 0.00 0.00 27.48 28.79 1j08 h GLN 46 CO 0.01 0.69 0.34 0.93 -2.65 0.00 0.00 178.83 178.15 1j08 h GLU 47 N -0.84 0.62 -0.57 1.69 5.08 -1.10 -1.80 114.58 117.68 1j08 h GLU 47 Ca -0.00 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1j08 h GLU 47 Cb 0.74 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.82 1j08 h GLU 47 CO 0.01 0.41 0.32 -0.07 -1.00 0.00 0.00 179.01 178.68 1j08 h LEU 48 N 0.64 0.68 -1.73 1.33 3.38 -1.44 -2.30 115.31 115.87 1j08 h LEU 48 Ca 0.26 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 1j08 h LEU 48 Cb 0.13 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1j08 h LEU 48 CO -0.15 0.54 -0.17 0.28 0.09 0.00 0.00 178.44 179.03 1j08 h SER 49 N 0.78 0.00 0.68 -0.43 0.02 -1.08 -2.37 113.55 111.15 1j08 h SER 49 Ca 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1j08 h SER 49 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1j08 h SER 49 CO -0.04 0.17 0.00 -0.62 -1.14 0.00 0.00 176.83 175.20 1j08 n GLU 50 N -3.80 0.28 0.00 3.45 1.02 -0.87 -3.36 120.64 117.36 1j08 n GLU 50 Ca -0.02 0.01 0.13 0.00 -0.02 0.00 0.00 57.16 57.27 1j08 n GLU 50 Cb 0.27 -1.50 0.43 0.00 -0.02 0.00 0.00 31.44 30.62 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 -1.35 1.26 -3.55 -4.62 4.77 -0.89 -4.95 117.00 107.66 1j08 n LEU 51 Ca 0.12 -0.37 -0.08 0.00 -0.03 0.00 0.00 56.01 55.64 1j08 n LEU 51 Cb 0.26 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 1j08 n LEU 51 CO 0.23 0.22 0.79 0.28 -1.33 0.00 0.00 177.39 177.59 1j08 s THR 52 N -2.29 0.00 -1.91 -5.08 -1.32 -1.22 -4.93 115.64 98.88 1j08 s THR 52 Ca 0.30 0.00 0.28 0.00 -1.21 0.00 0.00 61.69 61.06 1j08 s THR 52 Cb 0.20 -1.00 0.47 0.00 -1.51 0.00 0.00 72.50 70.66 1j08 s THR 52 CO 0.44 0.00 1.79 -0.90 -2.21 0.00 0.00 174.62 173.74 1j08 n ASP 53 N 0.10 0.82 -1.28 8.08 5.68 -1.26 -3.69 116.55 125.01 1j08 n ASP 53 Ca -0.07 -0.92 0.12 0.00 -0.50 0.00 0.00 54.79 53.41 1j08 n ASP 53 Cb 0.60 0.01 0.29 0.00 -1.14 0.00 0.00 41.12 40.87 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 -0.60 2.63 -3.86 0.11 5.02 -1.26 -4.89 118.16 115.30 1j08 n LYS 54 Ca 0.16 -2.51 -0.25 0.00 -2.02 0.00 0.00 58.31 53.69 1j08 n LYS 54 Cb 0.30 -1.55 -0.17 0.00 -0.02 0.00 0.00 35.03 33.59 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 -1.17 0.92 0.32 -0.35 2.96 -1.24 0.14 118.68 120.25 1j08 s LEU 55 Ca 0.45 -0.19 0.03 0.00 -0.22 0.00 0.00 54.13 54.20 1j08 s LEU 55 Cb 0.25 -0.64 -0.05 0.00 0.50 0.00 0.00 46.19 46.24 1j08 s LEU 55 CO 0.33 -0.15 0.08 -0.94 -1.32 0.00 0.00 176.35 174.35 1j08 s SER 56 N 1.78 2.17 0.08 3.68 1.04 0.09 -4.48 113.70 118.06 1j08 s SER 56 Ca 0.04 -1.43 -0.07 0.00 0.48 0.00 0.00 55.95 54.97 1j08 s SER 56 Cb -0.13 0.06 -0.01 0.00 0.10 0.00 0.00 66.02 66.05 1j08 s SER 56 CO -0.06 -0.69 0.15 -0.72 0.98 0.00 0.00 173.24 172.90 1j08 s TYR 57 N -3.39 0.21 -0.08 5.02 1.13 -1.26 -0.28 117.35 118.70 1j08 s TYR 57 Ca 0.35 -0.66 -0.03 0.00 -1.41 0.00 0.00 57.07 55.32 1j08 s TYR 57 Cb 0.08 -0.12 0.05 0.00 -1.10 0.00 0.00 41.96 40.87 1j08 s TYR 57 CO 0.15 -0.51 0.13 -2.00 -2.51 0.00 0.00 175.55 170.81 1j08 s GLU 58 N -3.84 0.01 -0.16 -3.49 2.12 -0.00 -4.90 118.70 108.44 1j08 s GLU 58 Ca 0.05 0.46 -0.23 0.00 0.36 0.00 0.00 54.97 55.62 1j08 s GLU 58 Cb 0.05 -0.47 -0.02 0.00 0.26 0.00 0.00 34.13 33.95 1j08 s GLU 58 CO -0.11 -0.35 0.71 0.42 -0.54 0.00 0.00 175.26 175.39 1j08 s ILE 59 N 2.26 4.98 -0.14 -3.70 -1.09 -1.26 -1.58 121.20 120.67 1j08 s ILE 59 Ca 0.04 1.37 0.01 0.00 -2.23 0.00 0.00 60.65 59.84 1j08 s ILE 59 Cb -0.12 -4.02 -0.00 0.00 -1.58 0.00 0.00 42.46 36.73 1j08 s ILE 59 CO -0.06 0.11 -0.17 -0.69 -1.23 0.00 0.00 174.94 172.90 1j08 s VAL 60 N 1.77 2.54 -0.50 2.92 1.01 0.12 -4.98 120.40 123.28 1j08 s VAL 60 Ca 0.33 -0.83 -0.29 0.00 0.00 0.00 0.00 61.98 61.20 1j08 s VAL 60 Cb -0.16 -2.05 0.02 0.00 0.00 0.00 0.00 36.38 34.20 1j08 s VAL 60 CO 0.12 0.53 1.22 -0.62 0.00 0.00 0.00 175.10 176.36 1j08 s ASP 61 N 0.65 6.49 0.21 3.32 -1.08 -1.26 -0.90 116.67 124.10 1j08 s ASP 61 Ca -0.09 0.43 -0.09 0.00 -0.52 0.00 0.00 52.55 52.28 1j08 s ASP 61 Cb -0.16 -2.55 0.19 0.00 -1.46 0.00 0.00 42.92 38.94 1j08 s ASP 61 CO 0.02 -1.38 1.87 0.15 0.52 0.00 0.00 175.17 176.36 1j08 h PHE 62 N 9.73 0.94 -0.08 -5.34 3.57 -0.40 -3.28 116.94 122.07 1j08 h PHE 62 Ca -0.25 0.02 -0.59 0.00 3.53 0.00 0.00 57.97 60.69 1j08 h PHE 62 Cb 1.07 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 39.50 1j08 h PHE 62 CO 1.00 0.56 3.01 -0.25 -2.23 0.00 0.00 178.31 180.40 1j08 n ASP 63 N -4.58 8.11 -3.69 0.41 8.00 -1.26 -3.07 116.55 120.46 1j08 n ASP 63 Ca 0.08 -2.60 -0.14 0.00 0.71 0.00 0.00 54.79 52.85 1j08 n ASP 63 Cb 0.05 -1.52 -0.09 0.00 -0.02 0.00 0.00 41.12 39.54 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 1.73 0.01 0.52 -3.53 -4.23 -1.24 -4.98 115.64 103.92 1j08 s THR 64 Ca 0.68 -0.09 0.26 0.00 -1.18 0.00 0.00 61.69 61.37 1j08 s THR 64 Cb 0.21 -0.72 0.42 0.00 1.34 0.00 0.00 72.50 73.75 1j08 s THR 64 CO -0.05 -0.05 1.95 1.55 -0.54 0.00 0.00 174.62 177.48 1j08 h PRO 65 N 4.78 0.04 0.04 3.99 0.13 -1.91 0.42 132.00 139.50 1j08 h PRO 65 Ca -0.28 -0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.61 1j08 h PRO 65 Cb 1.17 -0.01 0.01 0.00 0.13 0.00 0.00 31.00 32.30 1j08 h PRO 65 CO 0.25 0.03 -1.04 1.49 -0.23 0.00 0.00 178.00 178.50 1j08 h GLU 66 N 0.05 0.40 -0.02 0.86 4.81 -1.93 -2.56 114.58 116.19 1j08 h GLU 66 Ca 0.32 -0.49 -0.02 0.00 -0.13 0.00 0.00 59.36 59.05 1j08 h GLU 66 Cb 1.23 0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.76 1j08 h GLU 66 CO -0.02 1.16 -0.05 0.78 -0.73 0.00 0.00 179.01 180.15 1j08 h GLY 67 N 1.22 0.07 2.00 1.92 0.00 -0.46 -0.19 103.07 107.64 1j08 h GLY 67 Ca -0.10 -0.09 -0.03 0.00 0.00 0.00 0.00 47.33 47.11 1j08 h GLY 67 CO 0.18 0.08 -0.13 0.50 0.00 0.00 0.00 176.54 177.17 1j08 h LYS 68 N -0.50 0.00 0.04 4.80 1.57 -0.37 0.13 116.57 122.23 1j08 h LYS 68 Ca -0.00 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.51 1j08 h LYS 68 Cb 0.65 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.98 1j08 h LYS 68 CO 0.01 0.13 -1.08 1.49 -0.57 0.00 0.00 179.45 179.43 1j08 h GLU 69 N 0.00 0.61 -0.82 3.15 4.81 -1.42 -0.81 114.58 120.10 1j08 h GLU 69 Ca -0.00 -0.70 0.00 0.00 -0.13 0.00 0.00 59.36 58.53 1j08 h GLU 69 Cb 0.26 0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1j08 h GLU 69 CO 0.02 1.29 0.00 -0.11 -0.73 0.00 0.00 179.01 179.48 1j08 n LEU 70 N -3.80 2.00 0.00 1.64 7.94 -0.09 -3.02 117.00 121.67 1j08 n LEU 70 Ca -0.11 -1.01 0.00 0.00 -1.11 0.00 0.00 56.01 53.78 1j08 n LEU 70 Cb 0.91 -0.50 0.00 0.00 0.53 0.00 0.00 43.42 44.36 1j08 n LEU 70 CO 0.55 0.33 -0.41 0.00 -1.11 0.00 0.00 177.39 176.75 1j08 n ALA 71 N 0.14 1.78 -0.04 1.96 0.00 0.30 -4.68 120.51 119.96 1j08 n ALA 71 Ca 0.07 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.35 1j08 n ALA 71 Cb 0.44 0.16 -0.07 0.00 0.00 0.00 0.00 19.45 19.98 1j08 n ALA 71 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1j08 h GLU 72 N 0.00 0.68 0.00 0.00 4.81 -1.06 0.19 114.58 119.20 1j08 h GLU 72 Ca 0.00 -0.51 -0.01 0.00 -0.13 0.00 0.00 59.36 58.71 1j08 h GLU 72 Cb 0.65 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.12 1j08 h GLU 72 CO 0.00 1.13 -0.03 1.57 -0.73 0.00 0.00 179.01 180.94 1j08 h LYS 73 N 0.37 0.00 -0.65 1.92 -0.00 -1.85 -2.18 116.57 114.18 1j08 h LYS 73 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.63 1j08 h LYS 73 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.43 1j08 h LYS 73 CO 0.12 0.03 0.00 0.66 -0.00 0.00 0.00 179.45 180.26 1j08 n TYR 74 N -3.14 1.42 -3.81 0.07 4.01 -1.20 -4.95 117.16 109.56 1j08 n TYR 74 Ca 0.01 -0.56 -0.26 0.00 -0.16 0.00 0.00 57.90 56.93 1j08 n TYR 74 Cb 0.35 -0.24 0.03 0.00 -0.31 0.00 0.00 39.34 39.16 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 1.03 -5.20 -3.76 -0.72 1.74 -0.82 -4.98 116.66 103.96 1j08 n ARG 75 Ca 0.24 0.60 -0.37 0.00 -0.77 0.00 0.00 57.85 57.56 1j08 n ARG 75 Cb 0.85 -5.31 -0.13 0.00 -1.02 0.00 0.00 32.46 26.85 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 -3.50 4.15 -2.77 0.55 -1.09 0.65 -4.97 121.20 114.23 1j08 s ILE 76 Ca 0.33 -0.38 0.24 0.00 -2.23 0.00 0.00 60.65 58.60 1j08 s ILE 76 Cb -0.16 -3.02 0.30 0.00 -1.58 0.00 0.00 42.46 38.00 1j08 s ILE 76 CO 0.82 0.24 1.33 -0.90 -1.23 0.00 0.00 174.94 175.20 1j08 n ASP 77 N 4.90 3.22 -3.69 3.58 5.75 -1.26 -4.46 116.55 124.59 1j08 n ASP 77 Ca -0.16 -2.00 -0.02 0.00 -0.01 0.00 0.00 54.79 52.61 1j08 n ASP 77 Cb 0.50 -0.11 -0.01 0.00 -1.03 0.00 0.00 41.12 40.47 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 -1.77 0.84 0.09 0.11 1.70 -1.26 -5.18 118.95 113.49 1j08 s ARG 78 Ca 0.33 -0.46 0.04 0.00 -0.47 0.00 0.00 55.73 55.17 1j08 s ARG 78 Cb 0.21 0.29 -0.04 0.00 -0.57 0.00 0.00 34.95 34.85 1j08 s ARG 78 CO 0.31 -0.38 -0.10 0.00 -1.08 0.00 0.00 175.30 174.04 1j08 s ALA 79 N -2.91 1.11 0.48 7.88 0.00 -1.26 -4.31 121.76 122.75 1j08 s ALA 79 Ca 0.13 -1.17 -0.20 0.00 0.00 0.00 0.00 51.96 50.72 1j08 s ALA 79 Cb 0.01 0.02 -0.09 0.00 0.00 0.00 0.00 23.12 23.07 1j08 s ALA 79 CO -0.01 -0.02 1.03 -1.25 0.00 0.00 0.00 175.76 175.51 1j08 s PRO 80 N -2.71 3.83 -0.27 0.00 0.04 -1.26 -4.85 135.00 129.78 1j08 s PRO 80 Ca 0.05 1.34 -0.25 0.00 0.04 0.00 0.00 61.00 62.17 1j08 s PRO 80 Cb -0.03 -2.10 0.09 0.00 0.04 0.00 0.00 34.50 32.49 1j08 s PRO 80 CO 0.00 -0.40 0.81 0.00 0.04 0.00 0.00 177.00 177.45 1j08 s ALA 81 N -2.01 -1.84 -0.07 8.56 0.00 -0.80 -2.97 121.76 122.63 1j08 s ALA 81 Ca 0.67 1.99 0.04 0.00 0.00 0.00 0.00 51.96 54.66 1j08 s ALA 81 Cb -0.16 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.70 1j08 s ALA 81 CO 0.20 -0.31 -0.19 0.99 0.00 0.00 0.00 175.76 176.45 1j08 s THR 82 N 0.36 1.63 -0.14 0.00 2.01 0.74 0.20 115.64 120.44 1j08 s THR 82 Ca 0.01 -0.79 0.00 0.00 0.31 0.00 0.00 61.69 61.22 1j08 s THR 82 Cb -0.05 -1.42 -0.01 0.00 0.01 0.00 0.00 72.50 71.04 1j08 s THR 82 CO -0.02 0.46 -0.15 0.28 -0.69 0.00 0.00 174.62 174.51 1j08 s THR 83 N 0.31 2.77 -0.69 -0.82 -1.32 -0.61 -0.56 115.64 114.72 1j08 s THR 83 Ca -0.12 -0.75 -0.21 0.00 -1.21 0.00 0.00 61.69 59.40 1j08 s THR 83 Cb -0.15 -2.16 0.08 0.00 -1.51 0.00 0.00 72.50 68.76 1j08 s THR 83 CO 0.05 0.52 0.96 -0.63 -2.21 0.00 0.00 174.62 173.31 1j08 s ILE 84 N 0.60 4.45 0.22 5.08 1.01 0.01 -2.20 121.20 130.38 1j08 s ILE 84 Ca -0.09 -0.64 -0.01 0.00 0.00 0.00 0.00 60.65 59.92 1j08 s ILE 84 Cb -0.16 -4.68 -0.04 0.00 0.01 0.00 0.00 42.46 37.59 1j08 s ILE 84 CO 0.03 -1.42 0.42 0.42 0.00 0.00 0.00 174.94 174.39 1j08 s THR 85 N 3.67 5.18 -0.72 2.92 -4.23 -1.04 -4.35 115.64 117.07 1j08 s THR 85 Ca 0.22 -0.35 -0.16 0.00 -1.18 0.00 0.00 61.69 60.22 1j08 s THR 85 Cb -0.16 -3.75 0.16 0.00 1.34 0.00 0.00 72.50 70.10 1j08 s THR 85 CO 0.07 -0.22 0.73 -1.58 -0.54 0.00 0.00 174.62 173.07 1j08 s GLN 86 N -3.44 3.34 -1.39 3.99 0.74 -0.01 -1.70 119.66 121.18 1j08 s GLN 86 Ca 0.39 -1.96 -0.03 0.00 0.05 0.00 0.00 55.36 53.81 1j08 s GLN 86 Cb -0.11 -4.42 0.02 0.00 1.10 0.00 0.00 33.01 29.60 1j08 s GLN 86 CO 0.30 -1.41 0.65 -3.47 -0.55 0.00 0.00 175.29 170.80 1j08 n ASP 87 N 5.08 -1.48 0.00 6.67 2.03 -0.10 -1.45 116.55 127.30 1j08 n ASP 87 Ca 0.03 -0.89 0.00 0.00 0.52 0.00 0.00 54.79 54.45 1j08 n ASP 87 Cb 0.45 -3.62 0.00 0.00 -0.72 0.00 0.00 41.12 37.23 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 -1.72 3.16 3.71 0.27 0.00 -1.26 -5.01 105.19 104.34 1j08 n GLY 88 Ca -0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.42 4.48 -0.03 1.61 2.20 -0.53 -4.96 119.74 122.09 1j08 s LYS 89 Ca 0.00 1.64 -0.30 0.00 -0.36 0.00 0.00 55.97 56.95 1j08 s LYS 89 Cb 0.00 -3.39 -0.03 0.00 -1.51 0.00 0.00 37.83 32.90 1j08 s LYS 89 CO 0.00 -0.17 1.16 0.34 -0.36 0.00 0.00 175.35 176.32 1j08 s ASP 90 N 1.01 7.10 0.00 1.43 -1.08 -1.26 -0.83 116.67 123.03 1j08 s ASP 90 Ca 0.56 1.81 0.08 0.00 -0.52 0.00 0.00 52.55 54.48 1j08 s ASP 90 Cb -0.26 -2.56 0.18 0.00 -1.46 0.00 0.00 42.92 38.81 1j08 s ASP 90 CO 0.29 -0.52 1.05 0.49 0.52 0.00 0.00 175.17 177.00 1j08 n PHE 91 N 4.84 0.23 -1.27 -5.34 3.01 -1.26 -4.97 117.46 112.70 1j08 n PHE 91 Ca 0.10 -0.33 -0.09 0.00 1.01 0.00 0.00 57.45 58.14 1j08 n PHE 91 Cb 0.47 -0.02 -0.04 0.00 -0.01 0.00 0.00 39.48 39.88 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 0.35 1.08 3.30 1.37 0.00 -1.26 -3.89 105.19 106.14 1j08 n GLY 92 Ca 0.08 -0.62 -0.43 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.34 4.78 0.11 1.61 1.01 -1.26 -0.35 120.40 123.96 1j08 s VAL 93 Ca 0.00 -1.43 0.05 0.00 0.00 0.00 0.00 61.98 60.60 1j08 s VAL 93 Cb 0.00 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 1j08 s VAL 93 CO 0.00 -0.69 -0.12 -0.13 0.00 0.00 0.00 175.10 174.16 1j08 s ARG 94 N 1.52 0.95 -0.12 2.72 3.00 -0.84 -0.81 118.95 125.38 1j08 s ARG 94 Ca 0.04 -1.23 -0.00 0.00 0.00 0.00 0.00 55.73 54.54 1j08 s ARG 94 Cb -0.26 -0.71 0.02 0.00 0.00 0.00 0.00 34.95 34.00 1j08 s ARG 94 CO 0.03 0.12 -0.09 0.71 0.00 0.00 0.00 175.30 176.07 1j08 s TYR 95 N -2.41 1.57 -0.51 -0.53 1.51 0.28 -2.03 117.35 115.23 1j08 s TYR 95 Ca 0.08 -0.79 -0.13 0.00 -1.01 0.00 0.00 57.07 55.22 1j08 s TYR 95 Cb -0.03 -1.27 0.12 0.00 -0.11 0.00 0.00 41.96 40.67 1j08 s TYR 95 CO 0.01 -0.52 0.43 -0.06 -1.11 0.00 0.00 175.55 174.30 1j08 s PHE 96 N 1.63 3.33 -0.15 2.71 0.40 0.15 -0.18 117.98 125.87 1j08 s PHE 96 Ca 0.04 -1.53 0.00 0.00 -0.60 0.00 0.00 56.93 54.84 1j08 s PHE 96 Cb -0.13 -3.65 0.00 0.00 0.51 0.00 0.00 43.02 39.76 1j08 s PHE 96 CO -0.08 -1.00 0.00 0.41 0.70 0.00 0.00 175.22 175.25 1j08 n GLY 97 N 5.10 0.88 3.78 4.36 0.00 -1.16 -1.33 105.19 116.83 1j08 n GLY 97 Ca -0.11 -2.32 -0.39 0.00 0.00 0.00 0.00 46.02 43.20 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 -1.00 4.82 0.00 -0.61 2.07 -1.26 -4.78 121.20 120.44 1j08 s ILE 98 Ca 0.00 1.24 -0.04 0.00 -1.41 0.00 0.00 60.65 60.44 1j08 s ILE 98 Cb 0.00 -3.92 -0.20 0.00 0.13 0.00 0.00 42.46 38.47 1j08 s ILE 98 CO 0.00 0.48 2.82 -2.65 -1.91 0.00 0.00 174.94 173.68 1j08 n PRO 99 N 2.24 1.48 -1.88 3.50 -0.02 -1.26 -4.92 135.00 134.14 1j08 n PRO 99 Ca -0.08 -0.74 -0.29 0.00 -2.02 0.00 0.00 63.50 60.37 1j08 n PRO 99 Cb 0.51 -1.86 0.10 0.00 -0.02 0.00 0.00 33.50 32.23 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 1.49 2.54 0.00 3.55 0.00 -1.26 -1.61 121.76 126.46 1j08 s ALA 100 Ca 0.49 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.74 1j08 s ALA 100 Cb 0.24 -2.94 0.00 0.00 0.00 0.00 0.00 23.12 20.41 1j08 s ALA 100 CO 0.00 -1.82 0.00 0.41 0.00 0.00 0.00 175.76 174.35 1j08 n GLY 101 N -3.29 2.89 0.00 0.00 0.00 -1.26 -2.34 105.19 101.18 1j08 n GLY 101 Ca 0.09 -0.35 0.08 0.00 0.00 0.00 0.00 46.02 45.83 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 13.80 0.03 0.46 1.61 8.25 -0.37 -2.47 115.22 136.53 1j08 n HIS 102 Ca 0.00 0.01 0.13 0.00 -0.26 0.00 0.00 57.72 57.60 1j08 n HIS 102 Cb 0.00 -0.52 0.35 0.00 1.12 0.00 0.00 29.99 30.95 1j08 n HIS 102 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 1j08 h GLU 103 N 0.00 0.00 -0.43 -0.41 4.39 -1.69 -3.31 114.58 113.14 1j08 h GLU 103 Ca 0.00 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.71 1j08 h GLU 103 Cb 0.27 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.89 1j08 h GLU 103 CO 0.00 0.00 0.26 0.35 -1.16 0.00 0.00 179.01 178.46 1j08 h PHE 104 N 0.00 0.50 -0.46 4.33 3.57 -0.97 -1.21 116.94 122.70 1j08 h PHE 104 Ca 0.00 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 1j08 h PHE 104 Cb 0.78 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.33 1j08 h PHE 104 CO 0.00 0.30 0.13 0.00 -2.23 0.00 0.00 178.31 176.50 1j08 h ALA 105 N 1.18 1.36 -0.42 2.41 0.00 -1.79 -1.93 119.26 120.07 1j08 h ALA 105 Ca 0.16 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1j08 h ALA 105 Cb -0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1j08 h ALA 105 CO -0.06 0.46 -0.19 0.00 0.00 0.00 0.00 179.25 179.46 1j08 h ALA 106 N 1.48 0.87 -0.59 0.00 0.00 -1.57 -2.01 119.26 117.43 1j08 h ALA 106 Ca 0.15 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1j08 h ALA 106 Cb 0.23 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1j08 h ALA 106 CO -0.01 0.63 0.31 0.35 0.00 0.00 0.00 179.25 180.54 1j08 h PHE 107 N 0.72 0.81 -0.54 0.00 3.57 -0.62 -0.97 116.94 119.92 1j08 h PHE 107 Ca 0.10 -0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.48 1j08 h PHE 107 Cb 0.71 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 1j08 h PHE 107 CO 0.04 0.60 -0.04 -0.07 -2.23 0.00 0.00 178.31 176.61 1j08 h LEU 108 N 0.79 0.96 -0.79 0.59 3.38 -1.22 -2.36 115.31 116.67 1j08 h LEU 108 Ca 0.21 -0.32 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 1j08 h LEU 108 Cb 0.06 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 1j08 h LEU 108 CO -0.03 1.06 0.17 -0.33 0.09 0.00 0.00 178.44 179.39 1j08 h GLU 109 N 0.85 1.08 -0.53 1.13 5.08 -1.09 -2.65 114.58 118.44 1j08 h GLU 109 Ca 0.15 -0.25 -0.08 0.00 -1.00 0.00 0.00 59.36 58.18 1j08 h GLU 109 Cb 0.59 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1j08 h GLU 109 CO 0.04 0.95 0.00 -0.44 -1.00 0.00 0.00 179.01 178.56 1j08 h ASP 110 N 1.02 0.86 -0.97 1.42 3.32 -1.05 -0.82 116.42 120.21 1j08 h ASP 110 Ca 0.22 -0.22 0.05 0.00 0.02 0.00 0.00 57.03 57.09 1j08 h ASP 110 Cb 0.36 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 39.62 1j08 h ASP 110 CO 0.00 0.92 0.63 0.40 -1.72 0.00 0.00 179.24 179.48 1j08 h ILE 111 N 0.83 1.13 -0.17 0.35 2.04 -1.09 0.12 117.51 120.72 1j08 h ILE 111 Ca 0.16 -0.41 -0.16 0.00 1.00 0.00 0.00 64.86 65.45 1j08 h ILE 111 Cb 0.49 -0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.42 1j08 h ILE 111 CO 0.02 0.22 -0.51 0.58 0.00 0.00 0.00 178.15 178.46 1j08 h VAL 112 N 1.18 1.32 -0.57 1.67 2.07 -1.15 -1.43 116.25 119.35 1j08 h VAL 112 Ca 0.40 -1.76 -0.10 0.00 0.82 0.00 0.00 66.70 66.06 1j08 h VAL 112 Cb 0.08 1.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 1j08 h VAL 112 CO -0.14 0.55 -0.04 0.44 0.02 0.00 0.00 177.57 178.40 1j08 h ASP 113 N 0.32 1.00 -0.20 0.57 3.32 -0.73 -0.50 116.42 120.20 1j08 h ASP 113 Ca -0.02 -0.29 -0.13 0.00 0.02 0.00 0.00 57.03 56.61 1j08 h ASP 113 Cb 1.14 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.41 1j08 h ASP 113 CO 0.11 1.07 -0.33 0.58 -1.72 0.00 0.00 179.24 178.95 1j08 h VAL 114 N 0.92 1.28 -0.56 -1.35 2.07 -0.80 0.16 116.25 117.98 1j08 h VAL 114 Ca 0.16 -1.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.19 1j08 h VAL 114 Cb 0.58 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 1j08 h VAL 114 CO 0.03 0.48 0.33 -1.28 0.02 0.00 0.00 177.57 177.16 1j08 h SER 115 N 0.60 0.68 1.35 0.57 0.87 -0.91 -2.97 113.55 113.74 1j08 h SER 115 Ca 0.06 -0.07 -0.12 0.00 -1.23 0.00 0.00 61.79 60.44 1j08 h SER 115 Cb 0.86 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.63 1j08 h SER 115 CO 0.07 0.55 -0.57 0.11 -0.53 0.00 0.00 176.83 176.46 1j08 h LYS 116 N 0.76 0.00 -0.44 2.24 1.57 -0.88 -2.22 116.57 117.59 1j08 h LYS 116 Ca 0.20 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.91 1j08 h LYS 116 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1j08 h LYS 116 CO -0.04 0.57 -0.08 0.41 -0.57 0.00 0.00 179.45 179.74 1j08 n GLY 117 N 1.14 0.28 3.74 3.86 0.00 0.55 -4.96 105.19 109.80 1j08 n GLY 117 Ca 0.01 -0.77 -0.03 0.00 0.00 0.00 0.00 46.02 45.24 1j08 n GLY 117 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1j08 s ASP 118 N -2.86 -0.16 0.43 1.61 3.84 -1.16 -4.87 116.67 113.49 1j08 s ASP 118 Ca 0.00 -0.38 0.03 0.00 -0.00 0.00 0.00 52.55 52.21 1j08 s ASP 118 Cb 0.00 0.45 -0.01 0.00 -1.38 0.00 0.00 42.92 41.98 1j08 s ASP 118 CO 0.00 -0.83 0.13 0.35 -0.00 0.00 0.00 175.17 174.82 1j08 n THR 119 N -0.48 0.00 -1.02 2.11 -2.24 -1.26 -4.74 114.28 106.65 1j08 n THR 119 Ca -0.06 -2.40 0.04 0.00 -2.27 0.00 0.00 64.05 59.35 1j08 n THR 119 Cb 0.61 0.81 0.31 0.00 -2.10 0.00 0.00 70.33 69.96 1j08 n THR 119 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1j08 n ASP 120 N -1.49 4.58 -4.73 3.42 5.75 -1.26 -5.00 116.55 117.82 1j08 n ASP 120 Ca -0.08 -3.10 -0.33 0.00 -0.01 0.00 0.00 54.79 51.26 1j08 n ASP 120 Cb 0.62 -0.64 0.09 0.00 -1.03 0.00 0.00 41.12 40.16 1j08 n ASP 120 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1j08 s LEU 121 N -2.89 3.24 0.63 -2.12 1.43 -1.26 -4.97 118.68 112.74 1j08 s LEU 121 Ca 0.49 2.20 -0.17 0.00 -1.03 0.00 0.00 54.13 55.62 1j08 s LEU 121 Cb 0.39 -4.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.03 1j08 s LEU 121 CO 0.11 -2.22 1.18 -0.04 0.23 0.00 0.00 176.35 175.62 1j08 s MET 122 N -4.15 2.80 0.22 1.70 -1.94 -1.26 -4.75 119.30 111.91 1j08 s MET 122 Ca 0.70 1.72 -0.08 0.00 -1.71 0.00 0.00 55.69 56.32 1j08 s MET 122 Cb -0.25 -1.92 0.32 0.00 2.01 0.00 0.00 34.83 34.99 1j08 s MET 122 CO 0.47 -1.32 1.74 0.37 -0.01 0.00 0.00 175.02 176.27 1j08 h GLN 123 N 0.51 0.39 -0.48 2.03 5.75 -1.99 0.31 115.11 121.62 1j08 h GLN 123 Ca -0.49 -0.02 0.10 0.00 -0.15 0.00 0.00 58.65 58.08 1j08 h GLN 123 Cb 1.29 -0.09 -0.09 0.00 1.07 0.00 0.00 27.48 29.66 1j08 h GLN 123 CO 0.54 0.26 -0.12 0.22 -2.65 0.00 0.00 178.83 177.07 1j08 h ASP 124 N 0.40 -0.45 0.01 -0.69 1.82 -2.00 -0.42 116.42 115.08 1j08 h ASP 124 Ca 0.33 0.15 -0.00 0.00 -0.39 0.00 0.00 57.03 57.11 1j08 h ASP 124 Cb 0.44 0.30 0.00 0.00 0.68 0.00 0.00 39.33 40.75 1j08 h ASP 124 CO -0.34 -0.16 -0.00 0.28 -1.61 0.00 0.00 179.24 177.41 1j08 h SER 125 N -0.00 -0.01 -0.65 2.28 0.02 -1.49 -2.21 113.55 111.49 1j08 h SER 125 Ca 0.23 -0.21 0.13 0.00 -0.84 0.00 0.00 61.79 61.10 1j08 h SER 125 Cb 0.35 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 62.80 1j08 h SER 125 CO -0.50 0.20 0.13 0.11 -1.14 0.00 0.00 176.83 175.63 1j08 h LYS 126 N -0.22 0.24 -0.61 3.45 1.57 -0.47 0.17 116.57 120.69 1j08 h LYS 126 Ca -0.00 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1j08 h LYS 126 Cb 0.22 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 1j08 h LYS 126 CO 0.00 0.16 0.40 0.93 -0.57 0.00 0.00 179.45 180.37 1j08 h GLU 127 N 0.24 0.80 -0.08 3.15 5.08 -0.91 -1.27 114.58 121.59 1j08 h GLU 127 Ca 0.35 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.65 1j08 h GLU 127 Cb 0.56 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 1j08 h GLU 127 CO -0.46 0.53 -0.02 0.93 -1.00 0.00 0.00 179.01 178.99 1j08 h GLU 128 N 0.83 0.16 -0.54 2.33 4.39 -0.60 -3.17 114.58 117.97 1j08 h GLU 128 Ca 0.23 -0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.87 1j08 h GLU 128 Cb -0.09 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.52 1j08 h GLU 128 CO -0.05 0.48 0.36 0.28 -1.16 0.00 0.00 179.01 178.92 1j08 h VAL 129 N -0.17 1.14 0.00 3.13 2.07 -0.93 -1.36 116.25 120.13 1j08 h VAL 129 Ca 0.02 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1j08 h VAL 129 Cb 0.42 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1j08 h VAL 129 CO 0.01 0.14 0.00 -1.54 0.02 0.00 0.00 177.57 176.19 1j08 n SER 130 N -4.45 0.15 -0.30 0.57 3.41 -0.49 -2.28 113.62 110.23 1j08 n SER 130 Ca 0.05 0.54 0.11 0.00 -0.26 0.00 0.00 58.87 59.30 1j08 n SER 130 Cb 0.05 -0.57 -0.05 0.00 -0.26 0.00 0.00 64.21 63.38 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 -1.66 0.73 -2.28 4.33 5.02 -0.52 -4.90 118.16 118.87 1j08 n LYS 131 Ca 0.03 -0.60 -0.42 0.00 -2.02 0.00 0.00 58.31 55.30 1j08 n LYS 131 Cb 0.19 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.68 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 -2.69 3.90 -0.06 -0.18 1.01 -0.97 -4.90 121.20 117.32 1j08 s ILE 132 Ca 0.14 1.23 0.09 0.00 0.00 0.00 0.00 60.65 62.12 1j08 s ILE 132 Cb 0.17 -3.79 0.14 0.00 0.01 0.00 0.00 42.46 39.00 1j08 s ILE 132 CO 0.69 -0.03 1.03 -0.67 0.00 0.00 0.00 174.94 175.96 1j08 n ASP 133 N 5.72 1.46 -4.65 3.58 2.03 -1.26 -4.84 116.55 118.58 1j08 n ASP 133 Ca 0.13 -2.46 -0.25 0.00 0.52 0.00 0.00 54.79 52.73 1j08 n ASP 133 Cb 0.44 -0.27 -0.08 0.00 -0.72 0.00 0.00 41.12 40.50 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 -1.58 2.35 -0.04 -0.67 1.02 -1.26 -5.06 119.74 114.50 1j08 s LYS 134 Ca 0.16 -1.24 -0.30 0.00 0.02 0.00 0.00 55.97 54.61 1j08 s LYS 134 Cb 0.14 -2.27 -0.05 0.00 -0.52 0.00 0.00 37.83 35.13 1j08 s LYS 134 CO 0.01 0.41 1.56 -0.51 -0.92 0.00 0.00 175.35 175.91 1j08 s ASP 135 N -3.27 6.73 -0.06 2.83 1.01 -1.26 -4.69 116.67 117.96 1j08 s ASP 135 Ca 0.29 2.19 0.03 0.00 0.71 0.00 0.00 52.55 55.76 1j08 s ASP 135 Cb -0.08 -2.54 0.01 0.00 1.01 0.00 0.00 42.92 41.31 1j08 s ASP 135 CO 0.19 -0.86 -0.14 -0.69 0.21 0.00 0.00 175.17 173.88 1j08 s VAL 136 N 3.43 1.23 -0.22 -1.27 1.01 -0.52 0.74 120.40 124.80 1j08 s VAL 136 Ca 0.69 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 62.12 1j08 s VAL 136 Cb -0.33 -1.10 0.05 0.00 0.00 0.00 0.00 36.38 35.00 1j08 s VAL 136 CO 0.28 0.37 -0.07 -0.60 0.00 0.00 0.00 175.10 175.08 1j08 s ARG 137 N 0.47 1.74 -0.36 2.72 3.52 0.12 -0.30 118.95 126.86 1j08 s ARG 137 Ca -0.12 -0.89 -0.13 0.00 -0.13 0.00 0.00 55.73 54.46 1j08 s ARG 137 Cb -0.14 -2.47 -0.01 0.00 -1.56 0.00 0.00 34.95 30.77 1j08 s ARG 137 CO 0.04 -0.52 0.26 0.42 -0.81 0.00 0.00 175.30 174.68 1j08 s ILE 138 N 1.42 5.27 -0.13 4.11 1.01 0.87 -1.00 121.20 132.75 1j08 s ILE 138 Ca -0.04 -0.36 -0.14 0.00 0.00 0.00 0.00 60.65 60.11 1j08 s ILE 138 Cb -0.18 -3.78 -0.05 0.00 0.01 0.00 0.00 42.46 38.47 1j08 s ILE 138 CO -0.07 -0.10 0.32 -0.76 0.00 0.00 0.00 174.94 174.33 1j08 s LEU 139 N 1.71 4.29 -0.34 2.97 1.43 0.10 -0.50 118.68 128.32 1j08 s LEU 139 Ca 0.06 0.61 0.02 0.00 -1.03 0.00 0.00 54.13 53.78 1j08 s LEU 139 Cb -0.18 -2.43 0.10 0.00 0.03 0.00 0.00 46.19 43.72 1j08 s LEU 139 CO 0.10 0.13 0.10 -0.63 0.23 0.00 0.00 176.35 176.29 1j08 s ILE 140 N 0.20 1.56 0.04 -0.59 1.09 0.22 -1.33 121.20 122.40 1j08 s ILE 140 Ca 0.19 -1.98 -0.30 0.00 -1.10 0.00 0.00 60.65 57.45 1j08 s ILE 140 Cb -0.14 -2.16 -0.05 0.00 -1.06 0.00 0.00 42.46 39.06 1j08 s ILE 140 CO 0.06 -0.67 1.09 -0.36 -0.10 0.00 0.00 174.94 174.96 1j08 s PHE 141 N 1.12 3.56 0.31 3.97 0.08 -0.54 -0.12 117.98 126.35 1j08 s PHE 141 Ca 0.11 1.51 0.00 0.00 0.12 0.00 0.00 56.93 58.67 1j08 s PHE 141 Cb -0.19 -3.27 -0.02 0.00 -0.57 0.00 0.00 43.02 38.97 1j08 s PHE 141 CO -0.15 -0.64 0.35 0.14 -0.10 0.00 0.00 175.22 174.83 1j08 s VAL 142 N 0.92 0.00 0.06 -0.44 -7.23 0.10 -2.44 120.40 111.37 1j08 s VAL 142 Ca 0.55 -1.79 0.02 0.00 -1.81 0.00 0.00 61.98 58.95 1j08 s VAL 142 Cb -0.26 -2.53 -0.03 0.00 0.56 0.00 0.00 36.38 34.12 1j08 s VAL 142 CO 0.29 0.00 -0.07 0.42 -0.31 0.00 0.00 175.10 175.43 1j08 s THR 143 N -3.46 0.53 0.52 5.32 -4.23 -1.26 0.61 115.64 113.67 1j08 s THR 143 Ca 0.35 -1.41 0.18 0.00 -1.18 0.00 0.00 61.69 59.63 1j08 s THR 143 Cb 0.02 -1.01 0.27 0.00 1.34 0.00 0.00 72.50 73.12 1j08 s THR 143 CO 0.20 -0.61 2.14 -0.65 -0.54 0.00 0.00 174.62 175.17 1j08 h PRO 144 N 3.89 0.00 0.00 3.99 0.11 -1.95 -2.68 132.00 135.36 1j08 h PRO 144 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1j08 h PRO 144 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1j08 h PRO 144 CO 0.51 0.04 -0.29 0.25 -0.21 0.00 0.00 178.00 178.29 1j08 n THR 145 N -4.35 0.27 -2.23 -1.15 -2.24 -1.26 -1.24 114.28 102.07 1j08 n THR 145 Ca -0.03 -0.16 -0.43 0.00 -2.27 0.00 0.00 64.05 61.16 1j08 n THR 145 Cb 0.12 -0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 68.07 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 10.82 0.00 -0.00 0.00 0.13 -1.89 -3.29 132.00 137.78 1j08 h PRO 147 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1j08 h PRO 147 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1j08 h PRO 147 CO 1.04 0.10 -0.43 0.66 -0.23 0.00 0.00 178.00 179.14 1j08 n TYR 148 N -3.27 0.00 -0.30 1.56 4.01 -1.26 -4.54 117.16 113.36 1j08 n TYR 148 Ca -0.00 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.81 1j08 n TYR 148 Cb 0.34 0.00 0.28 0.00 -0.31 0.00 0.00 39.34 39.65 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 0.92 0.00 -0.53 0.00 0.11 -1.80 -1.51 132.00 129.19 1j08 h PRO 150 Ca 0.42 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.41 1j08 h PRO 150 Cb 0.39 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.49 1j08 h PRO 150 CO -0.18 0.00 -0.12 -0.07 -0.21 0.00 0.00 178.00 177.42 1j08 h LEU 151 N 0.00 1.02 -0.25 2.35 3.38 -1.56 -1.29 115.31 118.97 1j08 h LEU 151 Ca 0.09 -0.34 -0.21 0.00 0.09 0.00 0.00 57.88 57.51 1j08 h LEU 151 Cb 0.38 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 40.85 1j08 h LEU 151 CO -0.00 1.14 -0.71 0.00 0.09 0.00 0.00 178.44 178.96 1j08 h ALA 152 N 0.95 0.41 -0.34 1.53 0.00 -1.34 -1.93 119.26 118.53 1j08 h ALA 152 Ca 0.14 -0.58 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 1j08 h ALA 152 Cb 0.69 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1j08 h ALA 152 CO 0.05 0.69 0.20 0.28 0.00 0.00 0.00 179.25 180.47 1j08 h VAL 153 N 0.53 1.13 -0.44 0.00 2.07 -1.27 -2.07 116.25 116.21 1j08 h VAL 153 Ca -0.03 -0.32 -0.06 0.00 0.82 0.00 0.00 66.70 67.11 1j08 h VAL 153 Cb 1.32 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 1j08 h VAL 153 CO 0.14 0.13 0.03 0.03 0.02 0.00 0.00 177.57 177.93 1j08 h ARG 154 N 0.43 0.69 -0.32 1.57 2.47 -1.21 -0.38 114.38 117.63 1j08 h ARG 154 Ca 0.12 -0.16 -0.02 0.00 -1.26 0.00 0.00 59.98 58.66 1j08 h ARG 154 Cb 0.04 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.25 1j08 h ARG 154 CO -0.02 0.68 0.13 1.98 0.56 0.00 0.00 179.97 183.30 1j08 h MET 155 N 0.66 0.48 -0.30 0.04 4.05 -1.01 0.05 114.93 118.91 1j08 h MET 155 Ca 0.14 -0.09 -0.02 0.00 -0.28 0.00 0.00 59.70 59.45 1j08 h MET 155 Cb 0.36 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.07 1j08 h MET 155 CO 0.01 0.49 0.09 0.00 0.23 0.00 0.00 176.91 177.74 1j08 h ALA 156 N 0.97 0.39 -0.68 0.39 0.00 -1.08 -2.62 119.26 116.63 1j08 h ALA 156 Ca 0.11 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1j08 h ALA 156 Cb 0.19 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1j08 h ALA 156 CO -0.01 0.02 0.40 0.45 0.00 0.00 0.00 179.25 180.11 1j08 h HIS 157 N 0.32 0.90 -0.51 0.00 -0.00 -0.90 -1.45 115.15 113.51 1j08 h HIS 157 Ca 0.10 -0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 60.40 1j08 h HIS 157 Cb 0.24 -0.30 -0.02 0.00 -0.00 0.00 0.00 27.41 27.33 1j08 h HIS 157 CO 0.00 0.60 0.06 0.87 -0.00 0.00 0.00 177.93 179.47 1j08 h LYS 158 N 0.94 0.82 -0.66 2.45 1.57 -0.80 0.12 116.57 121.01 1j08 h LYS 158 Ca 0.25 -0.19 -0.07 0.00 -1.87 0.00 0.00 60.65 58.76 1j08 h LYS 158 Cb -0.03 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 1j08 h LYS 158 CO -0.05 0.78 0.13 0.74 -0.57 0.00 0.00 179.45 180.49 1j08 h PHE 159 N 0.78 1.12 -0.33 -1.35 0.04 -0.97 -0.43 116.94 115.79 1j08 h PHE 159 Ca 0.16 -0.14 -0.07 0.00 2.80 0.00 0.00 57.97 60.72 1j08 h PHE 159 Cb 0.38 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 38.20 1j08 h PHE 159 CO 0.02 0.92 -0.08 0.00 -0.60 0.00 0.00 178.31 178.57 1j08 h ALA 160 N 1.13 0.46 -0.31 2.45 0.00 -0.65 -1.36 119.26 120.98 1j08 h ALA 160 Ca 0.21 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1j08 h ALA 160 Cb 0.39 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1j08 h ALA 160 CO 0.01 0.30 0.14 0.82 0.00 0.00 0.00 179.25 180.52 1j08 h ILE 161 N 0.43 1.17 -0.29 0.00 2.04 -0.57 -1.51 117.51 118.77 1j08 h ILE 161 Ca 0.08 -0.50 -0.02 0.00 1.00 0.00 0.00 64.86 65.43 1j08 h ILE 161 Cb 0.58 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 1j08 h ILE 161 CO 0.03 0.18 0.12 -0.33 0.00 0.00 0.00 178.15 178.15 1j08 h GLU 162 N 0.37 0.43 0.00 2.37 4.39 -1.04 -0.71 114.58 120.38 1j08 h GLU 162 Ca 0.11 -0.08 -0.05 0.00 0.34 0.00 0.00 59.36 59.68 1j08 h GLU 162 Cb 0.15 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 1j08 h GLU 162 CO -0.01 0.45 -0.22 -0.97 -1.16 0.00 0.00 179.01 177.09 1j08 h ASN 163 N 0.32 0.00 -0.06 1.42 -0.73 -1.19 -1.03 115.58 114.31 1j08 h ASN 163 Ca 0.10 0.00 -0.11 0.00 1.87 0.00 0.00 56.30 58.15 1j08 h ASN 163 Cb 0.18 0.00 0.01 0.00 0.27 0.00 0.00 38.32 38.77 1j08 h ASN 163 CO -0.01 0.22 -0.40 0.74 -0.37 0.00 0.00 177.43 177.62 1j08 h THR 164 N 0.00 1.42 -0.37 -3.57 2.02 -0.98 -0.46 112.91 110.98 1j08 h THR 164 Ca -0.00 -1.82 0.07 0.00 0.77 0.00 0.00 66.41 65.43 1j08 h THR 164 Cb 0.42 2.37 -0.02 0.00 -1.74 0.00 0.00 68.15 69.18 1j08 h THR 164 CO 0.03 0.53 0.25 0.50 0.37 0.00 0.00 175.52 177.20 1j08 h LYS 165 N -0.11 0.17 0.00 6.66 3.64 -0.64 -1.03 116.57 125.26 1j08 h LYS 165 Ca -0.03 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1j08 h LYS 165 Cb 1.07 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1j08 h LYS 165 CO 0.08 0.11 0.00 0.00 -2.27 0.00 0.00 179.45 177.37 1j08 n ALA 166 N -2.56 2.50 -0.07 5.00 0.00 -0.44 -4.89 120.51 120.06 1j08 n ALA 166 Ca 0.05 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1j08 n ALA 166 Cb 0.32 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.30 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 0.98 0.58 0.06 0.00 0.00 -0.39 -4.96 105.19 101.46 1j08 n GLY 167 Ca 0.18 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.15 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 4.00 0.00 -5.87 1.61 6.56 -1.60 -3.49 116.57 117.77 1j08 h LYS 168 Ca 0.00 0.00 -0.39 0.00 -1.06 0.00 0.00 60.65 59.20 1j08 h LYS 168 Cb 0.00 0.00 0.12 0.00 -0.57 0.00 0.00 32.23 31.78 1j08 h LYS 168 CO 0.00 0.15 -0.72 0.41 -2.06 0.00 0.00 179.45 177.23 1j08 n GLY 169 N 1.67 -0.49 0.51 3.86 0.00 -0.22 -4.91 105.19 105.61 1j08 n GLY 169 Ca -0.06 0.21 0.07 0.00 0.00 0.00 0.00 46.02 46.24 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 -4.74 1.08 -4.06 1.61 5.02 -1.26 -4.94 118.16 110.87 1j08 n LYS 170 Ca -0.07 -1.22 -0.34 0.00 -2.02 0.00 0.00 58.31 54.65 1j08 n LYS 170 Cb 0.59 -1.25 -0.10 0.00 -0.02 0.00 0.00 35.03 34.24 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 -1.23 4.63 -0.19 -0.18 1.01 -1.26 -1.43 121.20 122.54 1j08 s ILE 171 Ca 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 60.65 60.68 1j08 s ILE 171 Cb 0.11 -3.08 -0.01 0.00 0.01 0.00 0.00 42.46 39.49 1j08 s ILE 171 CO 0.20 0.46 -0.06 -0.76 0.00 0.00 0.00 174.94 174.79 1j08 s LEU 172 N 0.40 2.95 -0.39 2.97 1.43 0.58 -4.49 118.68 122.14 1j08 s LEU 172 Ca 0.02 -0.32 -0.07 0.00 -1.03 0.00 0.00 54.13 52.73 1j08 s LEU 172 Cb -0.13 -1.73 0.07 0.00 0.03 0.00 0.00 46.19 44.43 1j08 s LEU 172 CO 0.01 0.06 0.19 -0.83 0.23 0.00 0.00 176.35 176.00 1j08 s GLY 173 N 1.02 1.92 -0.29 -3.19 0.00 0.52 -0.09 107.32 107.20 1j08 s GLY 173 Ca 0.00 -2.06 -0.04 0.00 0.00 0.00 0.00 44.72 42.63 1j08 s GLY 173 CO 0.00 0.90 0.02 0.99 0.00 0.00 0.00 173.10 175.01 1j08 s ASP 174 N 1.80 4.89 0.07 1.64 1.11 0.34 -1.98 116.67 124.53 1j08 s ASP 174 Ca 0.02 -1.04 -0.30 0.00 0.18 0.00 0.00 52.55 51.41 1j08 s ASP 174 Cb -0.22 -1.76 -0.05 0.00 1.07 0.00 0.00 42.92 41.96 1j08 s ASP 174 CO 0.01 -0.23 1.00 -0.32 1.18 0.00 0.00 175.17 176.81 1j08 s MET 175 N 1.35 4.61 -0.24 8.23 -2.45 -0.86 -0.61 119.30 129.33 1j08 s MET 175 Ca -0.02 1.49 0.02 0.00 -1.25 0.00 0.00 55.69 55.92 1j08 s MET 175 Cb -0.18 -3.40 0.06 0.00 1.25 0.00 0.00 34.83 32.55 1j08 s MET 175 CO -0.00 0.06 -0.08 0.08 1.05 0.00 0.00 175.02 176.12 1j08 s VAL 176 N 0.47 1.78 -0.53 10.11 1.01 0.82 0.32 120.40 134.38 1j08 s VAL 176 Ca 0.50 -1.32 -0.28 0.00 0.00 0.00 0.00 61.98 60.89 1j08 s VAL 176 Cb -0.23 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 34.20 1j08 s VAL 176 CO 0.29 -0.01 1.53 -0.70 0.00 0.00 0.00 175.10 176.21 1j08 s GLU 177 N 1.29 3.23 0.35 2.72 -6.30 -0.44 0.02 118.70 119.57 1j08 s GLU 177 Ca -0.06 0.63 0.10 0.00 -2.50 0.00 0.00 54.97 53.15 1j08 s GLU 177 Cb -0.19 -4.16 0.87 0.00 0.00 0.00 0.00 34.13 30.65 1j08 s GLU 177 CO -0.06 -2.02 1.81 0.00 0.02 0.00 0.00 175.26 175.01 1j08 h ALA 178 N 11.83 1.89 -0.57 6.30 0.00 -0.13 -1.79 119.26 136.79 1j08 h ALA 178 Ca -0.28 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1j08 h ALA 178 Cb 1.11 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1j08 h ALA 178 CO 1.16 -0.21 0.24 0.82 0.00 0.00 0.00 179.25 181.26 1j08 h ILE 179 N 0.64 1.22 0.00 0.00 2.04 -1.90 -2.16 117.51 117.35 1j08 h ILE 179 Ca 0.53 -0.66 -0.06 0.00 1.00 0.00 0.00 64.86 65.67 1j08 h ILE 179 Cb 0.98 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 1j08 h ILE 179 CO -0.28 0.26 -0.28 -0.08 0.00 0.00 0.00 178.15 177.77 1j08 h GLU 180 N 0.77 0.00 -2.18 2.37 4.57 -1.77 -3.34 114.58 115.00 1j08 h GLU 180 Ca 0.19 0.00 -0.56 0.00 -1.18 0.00 0.00 59.36 57.81 1j08 h GLU 180 Cb 0.17 0.00 -0.41 0.00 -0.16 0.00 0.00 28.75 28.35 1j08 h GLU 180 CO -0.02 0.28 -0.80 0.66 -1.18 0.00 0.00 179.01 177.95 1j08 n TYR 181 N -3.28 2.98 -0.12 0.92 4.01 -0.74 -4.93 117.16 116.01 1j08 n TYR 181 Ca 0.01 -3.92 0.04 0.00 -0.16 0.00 0.00 57.90 53.88 1j08 n TYR 181 Cb 0.54 -0.46 0.36 0.00 -0.31 0.00 0.00 39.34 39.48 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 2.98 0.71 -0.42 -0.72 0.13 -1.53 -0.85 132.00 132.29 1j08 h PRO 182 Ca 0.12 -0.04 -0.12 0.00 -0.87 0.00 0.00 66.00 65.10 1j08 h PRO 182 Cb 0.64 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 31.60 1j08 h PRO 182 CO 0.73 0.47 -0.19 0.93 -0.23 0.00 0.00 178.00 179.71 1j08 h GLU 183 N 0.73 0.86 -0.46 0.86 3.07 -1.91 0.28 114.58 118.02 1j08 h GLU 183 Ca 0.24 -0.37 -0.05 0.00 -0.50 0.00 0.00 59.36 58.68 1j08 h GLU 183 Cb 0.06 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.93 1j08 h GLU 183 CO -0.06 1.02 0.10 2.35 -1.40 0.00 0.00 179.01 181.01 1j08 h TRP 184 N 0.68 0.77 -0.46 4.33 2.91 -1.85 -0.87 115.95 121.47 1j08 h TRP 184 Ca 0.09 -0.10 -0.09 0.00 1.13 0.00 0.00 58.89 59.93 1j08 h TRP 184 Cb 0.75 -0.22 -0.02 0.00 -0.51 0.00 0.00 29.16 29.17 1j08 h TRP 184 CO 0.06 0.71 -0.07 0.00 -1.03 0.00 0.00 178.44 178.11 1j08 h ALA 185 N 0.97 1.01 -0.23 2.65 0.00 -1.01 -2.77 119.26 119.89 1j08 h ALA 185 Ca 0.14 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 1j08 h ALA 185 Cb 0.34 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1j08 h ALA 185 CO 0.00 0.60 -0.28 0.22 0.00 0.00 0.00 179.25 179.79 1j08 h ASP 186 N 0.74 0.46 -0.91 0.00 3.58 -0.14 -0.39 116.42 119.76 1j08 h ASP 186 Ca 0.13 -0.16 0.21 0.00 0.42 0.00 0.00 57.03 57.63 1j08 h ASP 186 Cb 0.55 -0.13 -0.07 0.00 1.72 0.00 0.00 39.33 41.40 1j08 h ASP 186 CO 0.03 0.73 0.60 -0.61 -2.88 0.00 0.00 179.24 177.12 1j08 h GLN 187 N 0.40 0.39 -0.44 0.28 4.15 -0.86 0.22 115.11 119.25 1j08 h GLN 187 Ca 0.05 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.45 1j08 h GLN 187 Cb 0.70 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.30 1j08 h GLN 187 CO 0.05 0.26 0.00 0.66 -1.93 0.00 0.00 178.83 177.87 1j08 n TYR 188 N -4.51 0.95 -4.10 3.99 4.01 -0.95 -4.97 117.16 111.59 1j08 n TYR 188 Ca 0.20 -0.64 -0.33 0.00 -0.16 0.00 0.00 57.90 56.97 1j08 n TYR 188 Cb 0.72 -0.18 -0.01 0.00 -0.31 0.00 0.00 39.34 39.56 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 0.48 -3.03 -4.68 7.72 4.05 0.77 -4.83 115.26 115.75 1j08 n ASN 189 Ca 0.19 -0.96 -0.42 0.00 0.45 0.00 0.00 54.58 53.85 1j08 n ASN 189 Cb 0.71 -3.08 -0.03 0.00 1.23 0.00 0.00 39.78 38.61 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 -3.43 2.82 0.00 3.44 1.01 -0.21 -4.85 120.40 119.18 1j08 s VAL 190 Ca 0.57 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.68 1j08 s VAL 190 Cb -0.30 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1j08 s VAL 190 CO 0.90 -0.00 0.00 0.23 0.00 0.00 0.00 175.10 176.22 1j08 n MET 191 N 6.41 0.00 -2.57 2.72 2.81 -1.26 -4.88 117.12 120.34 1j08 n MET 191 Ca 0.18 0.00 -0.35 0.00 -1.81 0.00 0.00 57.70 55.72 1j08 n MET 191 Cb 0.40 0.00 -0.04 0.00 -0.71 0.00 0.00 33.22 32.87 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 -2.06 3.02 0.17 3.04 0.00 -1.26 -5.06 121.76 119.62 1j08 s ALA 192 Ca 0.00 0.64 0.08 0.00 0.00 0.00 0.00 51.96 52.68 1j08 s ALA 192 Cb 0.00 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 1j08 s ALA 192 CO 0.00 -0.21 -0.16 0.14 0.00 0.00 0.00 175.76 175.54 1j08 s VAL 193 N -1.80 1.68 0.50 0.00 -7.23 -1.26 -4.25 120.40 108.04 1j08 s VAL 193 Ca 0.61 -2.01 -0.19 0.00 -1.81 0.00 0.00 61.98 58.58 1j08 s VAL 193 Cb -0.19 -1.87 -0.08 0.00 0.56 0.00 0.00 36.38 34.79 1j08 s VAL 193 CO 0.24 -0.47 1.00 -2.16 -0.31 0.00 0.00 175.10 173.40 1j08 s PRO 194 N -3.17 3.87 -0.14 4.82 0.04 -1.26 -4.74 135.00 134.41 1j08 s PRO 194 Ca 0.17 1.16 0.02 0.00 0.04 0.00 0.00 61.00 62.39 1j08 s PRO 194 Cb -0.03 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.40 1j08 s PRO 194 CO 0.06 -0.35 -0.20 0.21 0.04 0.00 0.00 177.00 176.76 1j08 s LYS 195 N -3.60 3.10 -0.14 4.56 2.20 -1.02 -1.50 119.74 123.33 1j08 s LYS 195 Ca 0.63 -0.82 -0.04 0.00 -0.36 0.00 0.00 55.97 55.38 1j08 s LYS 195 Cb -0.13 -2.49 -0.03 0.00 -1.51 0.00 0.00 37.83 33.67 1j08 s LYS 195 CO 0.24 0.02 0.01 0.42 -0.36 0.00 0.00 175.35 175.68 1j08 s ILE 196 N 0.76 4.32 -0.12 5.43 1.09 0.70 -1.46 121.20 131.93 1j08 s ILE 196 Ca -0.08 -0.22 0.00 0.00 -1.10 0.00 0.00 60.65 59.26 1j08 s ILE 196 Cb -0.16 -2.89 0.02 0.00 -1.06 0.00 0.00 42.46 38.38 1j08 s ILE 196 CO -0.00 0.52 -0.11 -0.69 -0.10 0.00 0.00 174.94 174.55 1j08 s VAL 197 N 0.00 1.27 -0.27 2.92 1.01 -0.44 -1.81 120.40 123.09 1j08 s VAL 197 Ca 0.03 -0.47 -0.07 0.00 0.00 0.00 0.00 61.98 61.47 1j08 s VAL 197 Cb -0.13 -1.22 -0.02 0.00 0.00 0.00 0.00 36.38 35.02 1j08 s VAL 197 CO 0.02 0.40 0.08 -0.63 0.00 0.00 0.00 175.10 174.97 1j08 s ILE 198 N 1.39 4.21 -0.19 2.22 1.01 -0.33 -0.72 121.20 128.79 1j08 s ILE 198 Ca 0.00 -0.34 -0.06 0.00 0.00 0.00 0.00 60.65 60.25 1j08 s ILE 198 Cb -0.13 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.27 1j08 s ILE 198 CO -0.06 0.25 0.03 -1.10 0.00 0.00 0.00 174.94 174.05 1j08 s GLN 199 N 1.58 3.79 -0.18 2.79 -0.21 -0.17 -1.01 119.66 126.25 1j08 s GLN 199 Ca 0.05 -0.44 -0.02 0.00 0.02 0.00 0.00 55.36 54.97 1j08 s GLN 199 Cb -0.16 -3.13 -0.01 0.00 1.00 0.00 0.00 33.01 30.71 1j08 s GLN 199 CO 0.03 0.16 -0.07 0.08 -2.12 0.00 0.00 175.29 173.37 1j08 s VAL 200 N 0.64 3.33 -1.48 1.09 1.01 -0.58 -0.70 120.40 123.71 1j08 s VAL 200 Ca 0.01 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.35 1j08 s VAL 200 Cb -0.14 -2.46 0.07 0.00 0.00 0.00 0.00 36.38 33.84 1j08 s VAL 200 CO 0.02 0.47 0.93 0.59 0.00 0.00 0.00 175.10 177.11 1j08 n ASN 201 N 4.15 -4.06 0.00 3.32 3.02 0.23 -2.44 115.26 119.48 1j08 n ASN 201 Ca -0.18 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.59 1j08 n ASN 201 Cb 0.52 -3.94 0.00 0.00 -0.61 0.00 0.00 39.78 35.75 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 -1.69 1.96 3.36 7.41 0.00 -1.26 -5.04 105.19 109.93 1j08 n GLY 202 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.28 1.77 0.15 1.61 -1.05 -1.02 -5.05 118.70 114.82 1j08 s GLU 203 Ca 0.00 -1.14 -0.31 0.00 -0.15 0.00 0.00 54.97 53.37 1j08 s GLU 203 Cb 0.00 -1.98 -0.10 0.00 -0.44 0.00 0.00 34.13 31.61 1j08 s GLU 203 CO 0.00 0.51 1.69 -0.51 0.95 0.00 0.00 175.26 177.90 1j08 s ASP 204 N -1.35 6.49 -0.03 0.83 1.01 -1.26 -1.53 116.67 120.83 1j08 s ASP 204 Ca 0.12 2.70 0.00 0.00 0.71 0.00 0.00 52.55 56.09 1j08 s ASP 204 Cb -0.10 -2.58 -0.02 0.00 1.01 0.00 0.00 42.92 41.23 1j08 s ASP 204 CO 0.03 -0.92 -0.02 0.29 0.21 0.00 0.00 175.17 174.75 1j08 n LYS 205 N 4.69 0.44 -3.96 8.23 4.76 -0.18 -4.92 118.16 127.23 1j08 n LYS 205 Ca 0.16 0.01 -0.09 0.00 -2.87 0.00 0.00 58.31 55.52 1j08 n LYS 205 Cb 0.38 -1.05 -0.10 0.00 -1.84 0.00 0.00 35.03 32.42 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 -2.05 0.14 0.01 -0.18 1.01 -1.13 -4.98 120.40 113.21 1j08 s VAL 206 Ca -0.03 -1.15 -0.05 0.00 0.00 0.00 0.00 61.98 60.75 1j08 s VAL 206 Cb 0.01 -0.86 -0.00 0.00 0.00 0.00 0.00 36.38 35.52 1j08 s VAL 206 CO 0.07 -0.63 0.09 -1.10 0.00 0.00 0.00 175.10 173.52 1j08 s GLN 207 N -2.56 0.42 -0.02 2.72 -0.21 -1.26 -1.19 119.66 117.56 1j08 s GLN 207 Ca -0.05 -0.45 -0.30 0.00 0.02 0.00 0.00 55.36 54.58 1j08 s GLN 207 Cb -0.02 0.17 0.11 0.00 1.00 0.00 0.00 33.01 34.27 1j08 s GLN 207 CO -0.05 -0.09 1.07 -0.59 -2.12 0.00 0.00 175.29 173.52 1j08 s PHE 208 N -1.37 -0.17 0.07 0.91 -0.71 -0.75 -5.02 117.98 110.95 1j08 s PHE 208 Ca -0.15 0.03 0.07 0.00 -1.04 0.00 0.00 56.93 55.84 1j08 s PHE 208 Cb -0.08 0.56 -0.03 0.00 -1.21 0.00 0.00 43.02 42.26 1j08 s PHE 208 CO 0.01 -0.47 -0.19 -1.21 -1.34 0.00 0.00 175.22 172.03 1j08 s GLU 209 N -2.83 1.09 0.00 1.99 2.02 -1.26 -0.21 118.70 119.50 1j08 s GLU 209 Ca 0.10 -1.02 0.00 0.00 0.02 0.00 0.00 54.97 54.07 1j08 s GLU 209 Cb 0.00 -1.24 0.00 0.00 0.10 0.00 0.00 34.13 32.99 1j08 s GLU 209 CO -0.04 0.30 0.00 0.41 0.02 0.00 0.00 175.26 175.94 1j08 n GLY 210 N 1.40 2.41 3.57 -1.39 0.00 -0.56 -4.85 105.19 105.76 1j08 n GLY 210 Ca -0.19 -1.80 -0.39 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 -2.32 2.75 0.40 4.61 0.00 -1.26 -4.87 121.76 121.07 1j08 s ALA 211 Ca 0.00 -2.43 -0.27 0.00 0.00 0.00 0.00 51.96 49.27 1j08 s ALA 211 Cb 0.00 -4.59 -0.09 0.00 0.00 0.00 0.00 23.12 18.44 1j08 s ALA 211 CO 0.00 -3.76 1.36 0.71 0.00 0.00 0.00 175.76 174.06 1j08 s TYR 212 N 5.75 2.75 0.65 0.00 1.51 -1.26 -4.96 117.35 121.80 1j08 s TYR 212 Ca 0.53 1.34 -0.17 0.00 -1.01 0.00 0.00 57.07 57.77 1j08 s TYR 212 Cb 0.01 -3.78 -0.00 0.00 -0.11 0.00 0.00 41.96 38.08 1j08 s TYR 212 CO -0.00 -2.36 1.18 -2.14 -1.11 0.00 0.00 175.55 171.12 1j08 s PRO 213 N -2.18 2.68 0.10 -1.71 0.02 -1.26 -4.53 135.00 128.12 1j08 s PRO 213 Ca 0.56 1.70 -0.19 0.00 0.02 0.00 0.00 61.00 63.08 1j08 s PRO 213 Cb -0.41 -1.91 -0.04 0.00 0.02 0.00 0.00 34.50 32.16 1j08 s PRO 213 CO 0.53 -1.41 1.22 -1.91 -0.33 0.00 0.00 177.00 175.11 1j08 n GLU 214 N -2.13 -0.28 -0.14 5.54 2.13 -1.26 -0.02 120.64 124.48 1j08 n GLU 214 Ca 0.13 1.20 -0.04 0.00 0.66 0.00 0.00 57.16 59.11 1j08 n GLU 214 Cb 0.50 -1.78 0.02 0.00 0.27 0.00 0.00 31.44 30.46 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 -0.09 -0.31 5.31 1.79 -1.98 0.31 116.57 121.59 1j08 h LYS 215 Ca 0.10 0.01 -0.11 0.00 -2.18 0.00 0.00 60.65 58.47 1j08 h LYS 215 Cb 0.26 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 30.91 1j08 h LYS 215 CO -0.59 -0.06 -0.27 0.52 -1.08 0.00 0.00 179.45 177.97 1j08 h MET 216 N -0.10 0.62 -0.37 3.15 2.86 -1.57 0.88 114.93 120.41 1j08 h MET 216 Ca 0.22 -0.26 -0.09 0.00 -2.06 0.00 0.00 59.70 57.51 1j08 h MET 216 Cb 0.44 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 1j08 h MET 216 CO -0.52 0.83 -0.13 0.35 1.06 0.00 0.00 176.91 178.49 1j08 h PHE 217 N 0.54 0.84 -0.34 -0.22 3.04 0.26 -2.36 116.94 118.69 1j08 h PHE 217 Ca 0.07 -0.20 0.00 0.00 3.98 0.00 0.00 57.97 61.83 1j08 h PHE 217 Cb 0.74 -0.20 -0.02 0.00 2.56 0.00 0.00 35.95 39.03 1j08 h PHE 217 CO 0.03 0.91 0.22 1.25 -2.02 0.00 0.00 178.31 178.70 1j08 h LEU 218 N 0.53 0.40 -0.82 0.59 5.85 -0.14 -2.36 115.31 119.36 1j08 h LEU 218 Ca 0.09 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.88 1j08 h LEU 218 Cb 0.66 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.52 1j08 h LEU 218 CO 0.05 0.30 0.47 -0.33 -0.34 0.00 0.00 178.44 178.58 1j08 h GLU 219 N 0.46 0.76 -0.89 1.25 5.08 -0.68 -0.39 114.58 120.18 1j08 h GLU 219 Ca 0.13 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1j08 h GLU 219 Cb -0.04 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 28.99 1j08 h GLU 219 CO -0.03 0.51 0.53 0.87 -1.00 0.00 0.00 179.01 179.89 1j08 h LYS 220 N 0.79 1.22 -0.22 2.33 1.79 -0.99 -1.02 116.57 120.46 1j08 h LYS 220 Ca 0.39 -0.12 -0.05 0.00 -2.18 0.00 0.00 60.65 58.70 1j08 h LYS 220 Cb 0.36 -0.25 -0.01 0.00 -1.58 0.00 0.00 32.23 30.75 1j08 h LYS 220 CO -0.24 0.86 -0.05 1.25 -1.08 0.00 0.00 179.45 180.18 1j08 h LEU 221 N 1.23 0.44 -1.03 2.94 5.85 -0.74 -2.30 115.31 121.70 1j08 h LEU 221 Ca 0.32 -0.37 -0.08 0.00 0.84 0.00 0.00 57.88 58.59 1j08 h LEU 221 Cb -0.03 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 1j08 h LEU 221 CO -0.06 0.70 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.50 1j08 h LEU 222 N 0.16 0.49 -0.85 2.25 3.38 -0.90 -2.13 115.31 117.72 1j08 h LEU 222 Ca 0.06 -0.14 -0.12 0.00 0.09 0.00 0.00 57.88 57.77 1j08 h LEU 222 Cb 0.51 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1j08 h LEU 222 CO 0.02 0.68 -0.48 0.77 0.09 0.00 0.00 178.44 179.52 1j08 h SER 223 N 0.45 0.24 0.67 -0.43 4.64 -1.17 -1.82 113.55 116.13 1j08 h SER 223 Ca 0.08 -0.11 -0.02 0.00 -0.47 0.00 0.00 61.79 61.26 1j08 h SER 223 Cb 0.56 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1j08 h SER 223 CO 0.04 0.69 -0.10 0.00 -0.87 0.00 0.00 176.83 176.58 1j08 h ALA 224 N 1.32 1.09 -0.47 5.18 0.00 -0.80 -0.65 119.26 124.93 1j08 h ALA 224 Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1j08 h ALA 224 Cb 0.92 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1j08 h ALA 224 CO 0.07 0.13 0.00 1.28 0.00 0.00 0.00 179.25 180.73 1j08 n LEU 225 N -3.34 3.47 0.00 0.00 4.77 -0.70 -4.82 117.00 116.37 1j08 n LEU 225 Ca -0.01 -1.75 0.00 0.00 -0.03 0.00 0.00 56.01 54.23 1j08 n LEU 225 Cb 0.29 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1j08 n LEU 225 CO 0.29 0.61 0.00 -1.20 -1.33 0.00 0.00 177.39 175.76