#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 -0.61 -9.74 0.99 4.07 -1.99 -3.42 115.31 104.61 1j08 h LEU 3 Ca 0.00 0.01 -0.53 0.00 0.08 0.00 0.00 57.88 57.45 1j08 h LEU 3 Cb 0.00 0.16 -0.03 0.00 1.08 0.00 0.00 40.66 41.87 1j08 h LEU 3 CO 0.00 -0.42 0.17 -0.63 -1.08 0.00 0.00 178.44 176.48 1j08 s ILE 4 N -6.00 4.39 0.66 1.22 1.01 -1.26 -5.07 121.20 116.14 1j08 s ILE 4 Ca -0.17 1.66 -0.07 0.00 0.00 0.00 0.00 60.65 62.08 1j08 s ILE 4 Cb 0.04 -4.11 0.03 0.00 0.01 0.00 0.00 42.46 38.44 1j08 s ILE 4 CO 0.62 0.49 0.98 -0.94 0.00 0.00 0.00 174.94 176.08 1j08 s SER 5 N -1.21 5.22 0.20 3.58 1.04 -1.26 -4.91 113.70 116.37 1j08 s SER 5 Ca 0.37 0.65 -0.10 0.00 0.48 0.00 0.00 55.95 57.34 1j08 s SER 5 Cb -0.22 -1.46 0.24 0.00 0.10 0.00 0.00 66.02 64.67 1j08 s SER 5 CO 0.26 -1.34 1.79 -0.33 0.98 0.00 0.00 173.24 174.59 1j08 h GLU 6 N -0.42 0.56 -0.30 4.02 3.07 -1.97 -1.87 114.58 117.65 1j08 h GLU 6 Ca -0.45 -0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 58.38 1j08 h GLU 6 Cb 1.28 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 29.05 1j08 h GLU 6 CO 0.61 0.37 0.18 0.93 -1.40 0.00 0.00 179.01 179.70 1j08 h GLU 7 N 0.57 0.41 -0.37 2.33 5.08 -2.00 -2.48 114.58 118.13 1j08 h GLU 7 Ca 0.29 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.55 1j08 h GLU 7 Cb 0.24 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 1j08 h GLU 7 CO -0.21 0.31 -0.05 -0.44 -1.00 0.00 0.00 179.01 177.62 1j08 h ASP 8 N 0.39 0.58 -0.81 1.42 3.32 -1.88 -1.55 116.42 117.89 1j08 h ASP 8 Ca 0.11 -0.14 -0.04 0.00 0.02 0.00 0.00 57.03 56.98 1j08 h ASP 8 Cb 0.01 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.37 1j08 h ASP 8 CO -0.02 0.69 0.35 0.11 -1.72 0.00 0.00 179.24 178.65 1j08 h LYS 9 N 0.57 1.20 -0.66 3.56 1.57 -1.13 0.41 116.57 122.08 1j08 h LYS 9 Ca 0.11 -0.20 -0.06 0.00 -1.87 0.00 0.00 60.65 58.63 1j08 h LYS 9 Cb 0.44 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 1j08 h LYS 9 CO 0.02 0.94 0.17 0.00 -0.57 0.00 0.00 179.45 180.02 1j08 h ARG 10 N 1.17 1.06 -0.39 3.15 2.47 -0.97 -1.27 114.38 119.60 1j08 h ARG 10 Ca 0.28 -0.25 -0.09 0.00 -1.26 0.00 0.00 59.98 58.65 1j08 h ARG 10 Cb 0.17 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.34 1j08 h ARG 10 CO -0.03 0.94 -0.13 0.82 0.56 0.00 0.00 179.97 182.13 1j08 h ILE 11 N 0.99 1.28 -0.67 2.04 2.04 -0.61 -1.37 117.51 121.20 1j08 h ILE 11 Ca 0.21 -1.23 0.01 0.00 1.00 0.00 0.00 64.86 64.84 1j08 h ILE 11 Cb 0.35 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 1j08 h ILE 11 CO 0.00 0.41 0.44 0.40 0.00 0.00 0.00 178.15 179.40 1j08 h ILE 12 N 0.57 1.17 -0.26 -0.67 2.04 0.03 0.11 117.51 120.51 1j08 h ILE 12 Ca 0.09 -0.32 -0.05 0.00 1.00 0.00 0.00 64.86 65.59 1j08 h ILE 12 Cb 0.66 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 1j08 h ILE 12 CO 0.05 0.17 -0.03 0.11 0.00 0.00 0.00 178.15 178.44 1j08 h LYS 13 N 0.91 0.48 0.05 2.37 1.57 -1.12 0.25 116.57 121.08 1j08 h LYS 13 Ca 0.25 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1j08 h LYS 13 Cb -0.10 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.17 1j08 h LYS 13 CO -0.05 0.67 -0.02 1.49 -0.57 0.00 0.00 179.45 180.96 1j08 h GLU 14 N 0.24 -0.06 0.00 3.15 4.81 -1.05 -0.87 114.58 120.80 1j08 h GLU 14 Ca 0.07 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1j08 h GLU 14 Cb 0.47 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.87 1j08 h GLU 14 CO 0.02 0.38 -0.36 0.93 -0.73 0.00 0.00 179.01 179.25 1j08 h GLU 15 N -0.53 0.00 0.00 1.92 4.39 -0.89 -3.40 114.58 116.07 1j08 h GLU 15 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1j08 h GLU 15 Cb 0.47 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 1j08 h GLU 15 CO 0.01 0.00 0.00 1.19 -1.16 0.00 0.00 179.01 179.05 1j08 n PHE 16 N -2.78 0.00 0.30 4.33 3.01 0.02 -4.86 117.46 117.48 1j08 n PHE 16 Ca 0.03 0.00 0.19 0.00 1.01 0.00 0.00 57.45 58.68 1j08 n PHE 16 Cb 0.51 0.01 1.04 0.00 -0.01 0.00 0.00 39.48 41.03 1j08 n PHE 16 CO 0.00 0.00 0.00 0.74 1.01 0.00 0.00 176.76 178.51 1j08 h PHE 17 N 0.00 0.00 0.00 1.38 0.04 -1.47 0.30 116.94 117.19 1j08 h PHE 17 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1j08 h PHE 17 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1j08 h PHE 17 CO 0.00 0.00 0.00 0.66 -0.60 0.00 0.00 178.31 178.37 1j08 h SER 18 N 0.00 0.00 -0.18 2.17 4.64 -1.37 -1.67 113.55 117.14 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 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 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 -2.44 1.92 -2.41 4.77 5.02 0.10 -4.95 118.16 120.16 1j08 n LYS 19 Ca 0.01 -1.37 -0.37 0.00 -2.02 0.00 0.00 58.31 54.56 1j08 n LYS 19 Cb 0.23 -1.43 -0.03 0.00 -0.02 0.00 0.00 35.03 33.77 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 -1.78 4.06 0.00 1.97 -1.94 -0.63 -4.84 119.30 116.14 1j08 s MET 20 Ca 0.34 1.67 0.00 0.00 -1.71 0.00 0.00 55.69 55.99 1j08 s MET 20 Cb 0.19 -2.57 0.00 0.00 2.01 0.00 0.00 34.83 34.46 1j08 s MET 20 CO 0.29 -0.27 0.00 0.28 -0.01 0.00 0.00 175.02 175.31 1j08 n VAL 21 N -0.08 0.00 -2.99 -6.03 0.31 -1.26 -5.03 118.33 103.26 1j08 n VAL 21 Ca 0.05 0.06 -0.32 0.00 -0.01 0.00 0.00 64.34 64.11 1j08 n VAL 21 Cb 0.48 -0.90 -0.06 0.00 -0.91 0.00 0.00 33.84 32.46 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 -2.69 6.75 0.51 4.52 0.01 -0.92 -5.03 114.94 118.10 1j08 s ASN 22 Ca 0.00 1.35 -0.22 0.00 -0.71 0.00 0.00 52.86 53.29 1j08 s ASN 22 Cb 0.00 -2.40 -0.06 0.00 0.41 0.00 0.00 41.25 39.20 1j08 s ASN 22 CO 0.00 -0.29 1.21 -2.16 -1.51 0.00 0.00 177.10 174.35 1j08 s PRO 23 N -3.23 3.44 -0.04 -0.60 0.04 -1.26 -4.61 135.00 128.74 1j08 s PRO 23 Ca 0.55 1.87 0.07 0.00 0.04 0.00 0.00 61.00 63.53 1j08 s PRO 23 Cb -0.10 -2.25 -0.01 0.00 0.04 0.00 0.00 34.50 32.18 1j08 s PRO 23 CO 0.20 -0.84 -0.24 0.08 0.04 0.00 0.00 177.00 176.23 1j08 s VAL 24 N -1.53 1.98 -0.15 -0.36 1.01 0.15 -0.50 120.40 121.00 1j08 s VAL 24 Ca 0.69 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 61.64 1j08 s VAL 24 Cb -0.31 -1.66 0.01 0.00 0.00 0.00 0.00 36.38 34.42 1j08 s VAL 24 CO 0.36 0.55 -0.21 -0.75 0.00 0.00 0.00 175.10 175.06 1j08 s LYS 25 N -0.31 2.94 -0.49 2.72 2.20 -0.36 -1.49 119.74 124.94 1j08 s LYS 25 Ca 0.02 -0.82 -0.22 0.00 -0.36 0.00 0.00 55.97 54.59 1j08 s LYS 25 Cb -0.12 -2.43 0.04 0.00 -1.51 0.00 0.00 37.83 33.81 1j08 s LYS 25 CO 0.02 -0.09 0.75 -0.51 -0.36 0.00 0.00 175.35 175.16 1j08 s LEU 26 N 1.00 4.47 -0.45 5.43 1.43 -0.15 -1.89 118.68 128.52 1j08 s LEU 26 Ca -0.03 -0.45 -0.18 0.00 -1.03 0.00 0.00 54.13 52.44 1j08 s LEU 26 Cb -0.15 -2.73 0.04 0.00 0.03 0.00 0.00 46.19 43.38 1j08 s LEU 26 CO -0.06 -0.96 0.48 -0.63 0.23 0.00 0.00 176.35 175.41 1j08 s ILE 27 N 3.17 5.06 -0.25 -0.59 1.01 -0.94 -1.59 121.20 127.07 1j08 s ILE 27 Ca 0.24 -0.46 -0.08 0.00 0.00 0.00 0.00 60.65 60.36 1j08 s ILE 27 Cb -0.15 -4.11 -0.03 0.00 0.01 0.00 0.00 42.46 38.18 1j08 s ILE 27 CO 0.18 -0.53 0.08 -0.69 0.00 0.00 0.00 174.94 173.99 1j08 s VAL 28 N 2.19 4.43 -0.26 2.92 1.01 -0.66 -1.90 120.40 128.14 1j08 s VAL 28 Ca 0.12 -0.13 -0.13 0.00 0.00 0.00 0.00 61.98 61.84 1j08 s VAL 28 Cb -0.18 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 1j08 s VAL 28 CO 0.13 0.33 0.29 -0.36 0.00 0.00 0.00 175.10 175.49 1j08 s PHE 29 N 1.63 3.27 -0.06 5.22 0.40 0.59 -0.05 117.98 128.98 1j08 s PHE 29 Ca 0.06 0.33 0.02 0.00 -0.60 0.00 0.00 56.93 56.74 1j08 s PHE 29 Cb -0.15 -2.46 0.02 0.00 0.51 0.00 0.00 43.02 40.93 1j08 s PHE 29 CO 0.04 -0.13 -0.10 0.42 0.70 0.00 0.00 175.22 176.16 1j08 s ILE 30 N 1.70 0.96 0.50 0.64 1.01 -0.32 -2.07 121.20 123.61 1j08 s ILE 30 Ca 0.12 -0.37 0.04 0.00 0.00 0.00 0.00 60.65 60.44 1j08 s ILE 30 Cb -0.15 -0.90 -0.01 0.00 0.01 0.00 0.00 42.46 41.41 1j08 s ILE 30 CO 0.09 0.32 0.15 -0.83 0.00 0.00 0.00 174.94 174.66 1j08 s GLY 31 N 0.75 2.69 0.16 6.18 0.00 -1.26 -1.72 107.32 114.12 1j08 s GLY 31 Ca -0.13 -1.08 0.22 0.00 0.00 0.00 0.00 44.72 43.74 1j08 s GLY 31 CO 0.02 -2.07 0.97 0.28 0.00 0.00 0.00 173.10 172.30 1j08 n LYS 32 N -1.38 0.59 -3.00 2.90 5.02 -1.26 -4.79 118.16 116.24 1j08 n LYS 32 Ca -0.10 0.07 -0.40 0.00 -2.02 0.00 0.00 58.31 55.86 1j08 n LYS 32 Cb 0.66 -1.77 -0.05 0.00 -0.02 0.00 0.00 35.03 33.85 1j08 n LYS 32 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1j08 s GLU 33 N -3.37 4.47 -1.33 1.97 0.41 -1.26 -4.31 118.70 115.28 1j08 s GLU 33 Ca -0.01 1.01 0.00 0.00 -0.41 0.00 0.00 54.97 55.56 1j08 s GLU 33 Cb 0.11 -3.38 0.00 0.00 -1.78 0.00 0.00 34.13 29.07 1j08 s GLU 33 CO 0.81 0.23 0.00 0.72 -0.49 0.00 0.00 175.26 176.53 1j08 n HIS 34 N 3.04 -0.63 -3.79 1.61 8.25 -1.26 -4.91 115.22 117.53 1j08 n HIS 34 Ca -0.02 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.08 1j08 n HIS 34 Cb 0.51 -2.64 -0.11 0.00 1.12 0.00 0.00 29.99 28.86 1j08 n HIS 34 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1j08 n GLN 36 N 4.51 0.69 -1.31 0.00 -0.06 -1.26 -4.58 117.38 115.37 1j08 n GLN 36 Ca -0.16 0.23 -0.11 0.00 -2.00 0.00 0.00 57.00 54.96 1j08 n GLN 36 Cb 0.52 -1.69 0.12 0.00 -4.06 0.00 0.00 30.24 25.12 1j08 n GLN 36 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 1j08 n TYR 37 N -3.19 1.57 -0.04 3.69 4.01 -1.26 -4.80 117.16 117.14 1j08 n TYR 37 Ca -0.28 -1.93 -0.12 0.00 -0.16 0.00 0.00 57.90 55.42 1j08 n TYR 37 Cb 1.06 -0.39 -0.06 0.00 -0.31 0.00 0.00 39.34 39.63 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 -0.03 0.84 -0.26 0.00 5.19 -1.95 -0.48 116.42 119.74 1j08 h ASP 39 Ca 0.04 -0.13 -0.05 0.00 -0.62 0.00 0.00 57.03 56.27 1j08 h ASP 39 Cb 0.32 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.60 1j08 h ASP 39 CO 0.00 0.77 -0.04 1.56 -3.12 0.00 0.00 179.24 178.41 1j08 h GLN 40 N 0.90 0.49 -0.30 3.56 7.50 -1.89 -0.63 115.11 124.73 1j08 h GLN 40 Ca 0.21 -0.18 0.04 0.00 0.50 0.00 0.00 58.65 59.22 1j08 h GLN 40 Cb 0.22 -0.03 -0.04 0.00 0.05 0.00 0.00 27.48 27.67 1j08 h GLN 40 CO -0.01 0.69 0.06 1.25 -1.50 0.00 0.00 178.83 179.32 1j08 h LEU 41 N 0.24 0.02 -0.26 1.46 5.85 -0.82 0.12 115.31 121.92 1j08 h LEU 41 Ca 0.07 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.89 1j08 h LEU 41 Cb 0.50 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.53 1j08 h LEU 41 CO 0.02 0.05 -0.13 0.50 -0.34 0.00 0.00 178.44 178.53 1j08 h LYS 42 N 0.17 -0.10 -0.71 1.25 3.64 -0.91 -1.92 116.57 117.99 1j08 h LYS 42 Ca 0.14 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 1j08 h LYS 42 Cb 0.15 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 1j08 h LYS 42 CO -0.18 -0.07 0.29 0.37 -2.27 0.00 0.00 179.45 177.60 1j08 h GLN 43 N -0.10 1.04 0.08 1.90 4.15 -0.54 -2.83 115.11 118.80 1j08 h GLN 43 Ca 0.14 -0.17 -0.00 0.00 0.77 0.00 0.00 58.65 59.38 1j08 h GLN 43 Cb 0.31 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.82 1j08 h GLN 43 CO -0.32 0.84 -0.04 1.25 -1.93 0.00 0.00 178.83 178.63 1j08 h LEU 44 N 1.02 -0.09 -1.32 -2.39 5.85 -0.09 -1.57 115.31 116.73 1j08 h LEU 44 Ca 0.24 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 1j08 h LEU 44 Cb 0.18 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 1j08 h LEU 44 CO -0.02 0.08 -0.04 -0.37 -0.34 0.00 0.00 178.44 177.75 1j08 h VAL 45 N -0.25 1.18 -0.26 1.05 -1.51 -1.35 -1.65 116.25 113.47 1j08 h VAL 45 Ca -0.01 -0.75 -0.06 0.00 -1.23 0.00 0.00 66.70 64.65 1j08 h VAL 45 Cb 0.21 1.03 -0.01 0.00 -2.13 0.00 0.00 31.29 30.40 1j08 h VAL 45 CO 0.02 0.25 -0.08 -0.61 -1.23 0.00 0.00 177.57 175.92 1j08 h GLN 46 N 0.39 0.50 -0.95 5.19 4.15 -1.38 0.03 115.11 123.04 1j08 h GLN 46 Ca 0.08 -0.20 0.01 0.00 0.77 0.00 0.00 58.65 59.31 1j08 h GLN 46 Cb 0.33 -0.03 -0.05 0.00 0.21 0.00 0.00 27.48 27.94 1j08 h GLN 46 CO 0.01 0.73 0.62 0.93 -1.93 0.00 0.00 178.83 179.20 1j08 h GLU 47 N 0.24 1.25 -0.27 1.69 5.08 -0.90 -1.81 114.58 119.87 1j08 h GLU 47 Ca 0.06 -0.08 -0.15 0.00 -1.00 0.00 0.00 59.36 58.19 1j08 h GLU 47 Cb 0.55 -0.28 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1j08 h GLU 47 CO 0.03 0.83 -0.42 -0.07 -1.00 0.00 0.00 179.01 178.37 1j08 h LEU 48 N 1.29 0.84 -1.66 1.33 3.38 -1.22 -3.18 115.31 116.09 1j08 h LEU 48 Ca 0.35 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 1j08 h LEU 48 Cb -0.14 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.35 1j08 h LEU 48 CO -0.07 1.19 0.17 0.28 0.09 0.00 0.00 178.44 180.11 1j08 h SER 49 N 0.51 0.35 0.29 -0.43 0.02 -0.65 -1.53 113.55 112.11 1j08 h SER 49 Ca 0.02 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1j08 h SER 49 Cb 1.02 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.47 1j08 h SER 49 CO 0.10 0.28 0.00 -0.62 -1.14 0.00 0.00 176.83 175.45 1j08 n GLU 50 N -4.47 0.26 0.12 3.45 1.02 -0.71 -3.36 120.64 116.95 1j08 n GLU 50 Ca 0.01 0.12 0.12 0.00 -0.02 0.00 0.00 57.16 57.40 1j08 n GLU 50 Cb 0.09 -1.50 0.20 0.00 -0.02 0.00 0.00 31.44 30.21 1j08 n GLU 50 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1j08 h LEU 51 N 0.00 0.00 -7.00 -4.62 3.38 -1.38 -3.47 115.31 102.22 1j08 h LEU 51 Ca 0.00 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1j08 h LEU 51 Cb 0.15 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 40.69 1j08 h LEU 51 CO 0.00 0.03 0.23 0.28 0.09 0.00 0.00 178.44 179.08 1j08 s THR 52 N -3.20 0.00 -2.00 0.22 -1.32 -1.21 -4.97 115.64 103.15 1j08 s THR 52 Ca 0.06 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.56 1j08 s THR 52 Cb 0.10 -1.00 0.05 0.00 -1.51 0.00 0.00 72.50 70.15 1j08 s THR 52 CO 0.69 0.00 0.92 -0.90 -2.21 0.00 0.00 174.62 173.12 1j08 n ASP 53 N 1.29 0.00 -0.48 8.08 5.68 -1.26 -2.24 116.55 127.62 1j08 n ASP 53 Ca -0.17 -1.62 0.10 0.00 -0.50 0.00 0.00 54.79 52.60 1j08 n ASP 53 Cb 0.57 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.56 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 -0.54 1.51 -4.80 0.11 5.02 -1.26 -4.92 118.16 113.29 1j08 n LYS 54 Ca 0.01 -1.02 -0.27 0.00 -2.02 0.00 0.00 58.31 55.02 1j08 n LYS 54 Cb 0.01 -1.37 -0.17 0.00 -0.02 0.00 0.00 35.03 33.48 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 -2.17 1.79 0.23 -0.35 2.96 -0.95 0.33 118.68 120.52 1j08 s LEU 55 Ca 0.17 -0.38 0.00 0.00 -0.22 0.00 0.00 54.13 53.70 1j08 s LEU 55 Cb 0.16 -1.01 -0.04 0.00 0.50 0.00 0.00 46.19 45.79 1j08 s LEU 55 CO 0.45 0.08 0.14 -0.94 -1.32 0.00 0.00 176.35 174.76 1j08 s SER 56 N 0.54 0.54 0.09 3.68 1.04 -0.55 -4.67 113.70 114.37 1j08 s SER 56 Ca -0.16 -1.44 -0.08 0.00 0.48 0.00 0.00 55.95 54.76 1j08 s SER 56 Cb -0.16 0.36 -0.01 0.00 0.10 0.00 0.00 66.02 66.31 1j08 s SER 56 CO 0.05 -0.85 0.16 -0.72 0.98 0.00 0.00 173.24 172.87 1j08 s TYR 57 N -3.99 0.22 -0.05 5.02 1.13 -1.26 -0.97 117.35 117.44 1j08 s TYR 57 Ca 0.39 -0.66 -0.02 0.00 -1.41 0.00 0.00 57.07 55.37 1j08 s TYR 57 Cb 0.07 -0.11 0.03 0.00 -1.10 0.00 0.00 41.96 40.85 1j08 s TYR 57 CO 0.14 -0.53 0.09 -2.00 -2.51 0.00 0.00 175.55 170.74 1j08 s GLU 58 N -3.87 0.00 -0.27 -3.49 2.12 -0.62 -4.92 118.70 107.66 1j08 s GLU 58 Ca 0.06 0.32 -0.17 0.00 0.36 0.00 0.00 54.97 55.54 1j08 s GLU 58 Cb 0.05 -0.27 -0.03 0.00 0.26 0.00 0.00 34.13 34.14 1j08 s GLU 58 CO -0.10 -0.21 0.48 0.42 -0.54 0.00 0.00 175.26 175.31 1j08 s ILE 59 N 1.42 5.09 -0.16 -3.70 -1.09 -1.26 -1.65 121.20 119.85 1j08 s ILE 59 Ca -0.05 0.79 -0.06 0.00 -2.23 0.00 0.00 60.65 59.09 1j08 s ILE 59 Cb -0.12 -3.80 -0.04 0.00 -1.58 0.00 0.00 42.46 36.92 1j08 s ILE 59 CO -0.04 0.09 0.05 -0.69 -1.23 0.00 0.00 174.94 173.11 1j08 s VAL 60 N 2.26 4.66 -0.76 2.92 1.01 0.93 -4.99 120.40 126.43 1j08 s VAL 60 Ca 0.20 -0.09 -0.27 0.00 0.00 0.00 0.00 61.98 61.82 1j08 s VAL 60 Cb -0.16 -3.07 0.03 0.00 0.00 0.00 0.00 36.38 33.18 1j08 s VAL 60 CO 0.09 0.49 1.32 -0.62 0.00 0.00 0.00 175.10 176.39 1j08 s ASP 61 N 0.11 6.15 0.57 3.32 -1.08 -1.26 -1.17 116.67 123.30 1j08 s ASP 61 Ca 0.04 -0.51 0.38 0.00 -0.52 0.00 0.00 52.55 51.94 1j08 s ASP 61 Cb -0.12 -2.56 1.94 0.00 -1.46 0.00 0.00 42.92 40.71 1j08 s ASP 61 CO 0.01 -1.84 2.15 0.15 0.52 0.00 0.00 175.17 176.16 1j08 h PHE 62 N 10.23 0.00 -0.23 -5.34 3.57 -1.66 -2.86 116.94 120.66 1j08 h PHE 62 Ca -0.23 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.27 1j08 h PHE 62 Cb 1.05 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.79 1j08 h PHE 62 CO 1.14 0.00 0.00 -0.25 -2.23 0.00 0.00 178.31 176.97 1j08 n ASP 63 N -2.92 2.61 -4.31 0.41 8.00 -1.26 -4.32 116.55 114.76 1j08 n ASP 63 Ca -0.02 -2.30 -0.20 0.00 0.71 0.00 0.00 54.79 52.98 1j08 n ASP 63 Cb 0.13 -0.52 -0.11 0.00 -0.02 0.00 0.00 41.12 40.60 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 -1.66 1.68 0.47 -3.53 -4.23 -1.08 -5.04 115.64 102.24 1j08 s THR 64 Ca 0.20 -1.95 0.18 0.00 -1.18 0.00 0.00 61.69 58.94 1j08 s THR 64 Cb 0.15 -1.82 0.23 0.00 1.34 0.00 0.00 72.50 72.39 1j08 s THR 64 CO 0.07 -0.41 2.05 1.55 -0.54 0.00 0.00 174.62 177.34 1j08 h PRO 65 N 3.13 0.00 -0.12 3.99 0.13 -1.89 -0.92 132.00 136.33 1j08 h PRO 65 Ca -0.41 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.53 1j08 h PRO 65 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1j08 h PRO 65 CO 0.54 0.13 -0.73 0.93 -0.23 0.00 0.00 178.00 178.64 1j08 h GLU 66 N 0.00 0.57 -0.42 0.86 4.39 -1.96 -2.09 114.58 115.93 1j08 h GLU 66 Ca -0.00 -0.45 -0.08 0.00 0.34 0.00 0.00 59.36 59.17 1j08 h GLU 66 Cb 0.25 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 1j08 h GLU 66 CO 0.02 1.08 -0.04 0.78 -1.16 0.00 0.00 179.01 179.68 1j08 h GLY 67 N 0.99 0.83 1.03 -3.84 0.00 -1.52 -1.15 103.07 99.42 1j08 h GLY 67 Ca -0.04 -0.64 -0.05 0.00 0.00 0.00 0.00 47.33 46.60 1j08 h GLY 67 CO 0.14 0.59 0.22 0.50 0.00 0.00 0.00 176.54 177.99 1j08 h LYS 68 N 0.60 1.06 -0.59 4.80 1.57 -1.19 0.30 116.57 123.11 1j08 h LYS 68 Ca 0.11 -0.22 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 1j08 h LYS 68 Cb 0.55 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.68 1j08 h LYS 68 CO 0.03 0.91 0.24 1.49 -0.57 0.00 0.00 179.45 181.55 1j08 h GLU 69 N 1.00 0.88 -0.23 3.15 4.81 -1.21 0.21 114.58 123.19 1j08 h GLU 69 Ca 0.22 -0.16 -0.12 0.00 -0.13 0.00 0.00 59.36 59.17 1j08 h GLU 69 Cb 0.29 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1j08 h GLU 69 CO -0.01 0.76 -0.36 1.25 -0.73 0.00 0.00 179.01 179.91 1j08 h LEU 70 N 0.82 0.54 -0.70 1.64 7.12 -0.90 -1.90 115.31 121.93 1j08 h LEU 70 Ca 0.20 -0.22 -0.01 0.00 0.13 0.00 0.00 57.88 57.98 1j08 h LEU 70 Cb 0.20 -0.15 -0.03 0.00 -0.53 0.00 0.00 40.66 40.15 1j08 h LEU 70 CO -0.02 0.86 0.41 0.00 -0.13 0.00 0.00 178.44 179.56 1j08 h ALA 71 N 1.17 0.89 -0.56 1.25 0.00 0.41 -2.50 119.26 119.92 1j08 h ALA 71 Ca 0.05 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1j08 h ALA 71 Cb 0.84 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1j08 h ALA 71 CO 0.07 0.38 0.07 1.49 0.00 0.00 0.00 179.25 181.25 1j08 h GLU 72 N 0.95 0.95 -0.39 0.00 4.81 -0.28 0.20 114.58 120.82 1j08 h GLU 72 Ca 0.25 -0.27 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1j08 h GLU 72 Cb -0.01 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 1j08 h GLU 72 CO -0.04 0.92 0.24 0.87 -0.73 0.00 0.00 179.01 180.26 1j08 h LYS 73 N 0.84 0.51 -0.64 1.92 1.57 -1.02 -0.98 116.57 118.78 1j08 h LYS 73 Ca 0.17 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1j08 h LYS 73 Cb 0.45 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1j08 h LYS 73 CO 0.02 0.36 0.00 0.66 -0.57 0.00 0.00 179.45 179.91 1j08 n TYR 74 N -4.46 1.25 -3.80 -1.35 4.01 -0.97 -4.95 117.16 106.88 1j08 n TYR 74 Ca 0.03 -0.51 -0.25 0.00 -0.16 0.00 0.00 57.90 57.01 1j08 n TYR 74 Cb 0.07 -0.20 0.03 0.00 -0.31 0.00 0.00 39.34 38.93 1j08 n TYR 74 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1j08 n ARG 75 N 0.99 -5.08 -3.92 -0.72 1.74 -0.37 -4.99 116.66 104.31 1j08 n ARG 75 Ca 0.22 0.60 -0.35 0.00 -0.77 0.00 0.00 57.85 57.55 1j08 n ARG 75 Cb 0.76 -5.27 -0.13 0.00 -1.02 0.00 0.00 32.46 26.80 1j08 n ARG 75 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1j08 s ILE 76 N -3.54 3.85 -2.16 0.55 -1.09 0.60 -5.00 121.20 114.41 1j08 s ILE 76 Ca 0.27 -0.33 0.21 0.00 -2.23 0.00 0.00 60.65 58.56 1j08 s ILE 76 Cb -0.14 -2.77 0.06 0.00 -1.58 0.00 0.00 42.46 38.04 1j08 s ILE 76 CO 0.82 0.40 1.07 -0.90 -1.23 0.00 0.00 174.94 175.10 1j08 n ASP 77 N 4.66 2.24 -3.48 3.58 5.75 -1.26 -4.26 116.55 123.77 1j08 n ASP 77 Ca -0.17 -1.62 -0.11 0.00 -0.01 0.00 0.00 54.79 52.88 1j08 n ASP 77 Cb 0.51 0.29 -0.02 0.00 -1.03 0.00 0.00 41.12 40.87 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 -2.08 1.23 0.15 0.11 1.70 -1.26 -5.17 118.95 113.64 1j08 s ARG 78 Ca 0.20 -0.48 0.09 0.00 -0.47 0.00 0.00 55.73 55.06 1j08 s ARG 78 Cb 0.17 0.55 -0.04 0.00 -0.57 0.00 0.00 34.95 35.06 1j08 s ARG 78 CO 0.42 -0.54 -0.20 0.00 -1.08 0.00 0.00 175.30 173.89 1j08 s ALA 79 N -3.64 2.05 0.35 7.88 0.00 -1.26 -4.22 121.76 122.92 1j08 s ALA 79 Ca 0.03 -1.44 -0.27 0.00 0.00 0.00 0.00 51.96 50.28 1j08 s ALA 79 Cb -0.01 -0.24 -0.09 0.00 0.00 0.00 0.00 23.12 22.78 1j08 s ALA 79 CO -0.10 0.32 1.10 -1.25 0.00 0.00 0.00 175.76 175.83 1j08 s PRO 80 N -2.47 4.33 -0.19 0.00 0.04 -1.26 -4.82 135.00 130.63 1j08 s PRO 80 Ca 0.14 1.73 -0.17 0.00 0.04 0.00 0.00 61.00 62.73 1j08 s PRO 80 Cb -0.08 -2.85 0.05 0.00 0.04 0.00 0.00 34.50 31.67 1j08 s PRO 80 CO 0.06 -0.04 0.51 0.00 0.04 0.00 0.00 177.00 177.57 1j08 s ALA 81 N -1.39 -1.26 -0.10 8.56 0.00 -0.88 -2.88 121.76 123.81 1j08 s ALA 81 Ca 0.52 1.45 0.02 0.00 0.00 0.00 0.00 51.96 53.95 1j08 s ALA 81 Cb -0.29 -0.85 0.01 0.00 0.00 0.00 0.00 23.12 22.00 1j08 s ALA 81 CO 0.36 -0.24 -0.15 0.99 0.00 0.00 0.00 175.76 176.72 1j08 s THR 82 N 0.32 1.47 -0.15 0.00 2.01 0.55 -0.30 115.64 119.54 1j08 s THR 82 Ca -0.00 -0.64 -0.02 0.00 0.31 0.00 0.00 61.69 61.34 1j08 s THR 82 Cb -0.04 -1.33 -0.02 0.00 0.01 0.00 0.00 72.50 71.12 1j08 s THR 82 CO 0.00 0.43 -0.09 0.28 -0.69 0.00 0.00 174.62 174.55 1j08 s THR 83 N 0.85 3.32 -0.55 -0.82 -1.32 -0.80 -0.34 115.64 115.99 1j08 s THR 83 Ca -0.10 -0.56 -0.20 0.00 -1.21 0.00 0.00 61.69 59.63 1j08 s THR 83 Cb -0.15 -2.43 0.07 0.00 -1.51 0.00 0.00 72.50 68.48 1j08 s THR 83 CO 0.01 0.50 0.71 -0.63 -2.21 0.00 0.00 174.62 173.01 1j08 s ILE 84 N 0.49 4.75 0.15 5.08 1.01 0.19 -2.22 121.20 130.65 1j08 s ILE 84 Ca -0.07 -0.54 0.03 0.00 0.00 0.00 0.00 60.65 60.07 1j08 s ILE 84 Cb -0.15 -4.42 -0.04 0.00 0.01 0.00 0.00 42.46 37.87 1j08 s ILE 84 CO 0.04 -0.99 0.23 0.42 0.00 0.00 0.00 174.94 174.64 1j08 s THR 85 N 2.93 5.05 -0.59 2.92 -4.23 -0.79 -4.38 115.64 116.55 1j08 s THR 85 Ca 0.16 -0.80 -0.17 0.00 -1.18 0.00 0.00 61.69 59.70 1j08 s THR 85 Cb -0.20 -3.59 0.12 0.00 1.34 0.00 0.00 72.50 70.18 1j08 s THR 85 CO 0.11 -0.09 0.62 -1.58 -0.54 0.00 0.00 174.62 173.14 1j08 s GLN 86 N -3.16 3.06 -1.51 3.99 0.74 -0.53 -1.22 119.66 121.02 1j08 s GLN 86 Ca 0.33 -1.57 -0.13 0.00 0.05 0.00 0.00 55.36 54.04 1j08 s GLN 86 Cb -0.11 -4.30 0.08 0.00 1.10 0.00 0.00 33.01 29.78 1j08 s GLN 86 CO 0.27 -1.44 0.95 -3.47 -0.55 0.00 0.00 175.29 171.05 1j08 n ASP 87 N 5.71 -4.91 0.00 6.67 2.03 0.34 -0.80 116.55 125.60 1j08 n ASP 87 Ca -0.10 -0.72 0.00 0.00 0.52 0.00 0.00 54.79 54.49 1j08 n ASP 87 Cb 0.42 -3.92 0.00 0.00 -0.72 0.00 0.00 41.12 36.90 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 -1.67 3.39 3.72 0.27 0.00 -1.26 -4.99 105.19 104.65 1j08 n GLY 88 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.78 4.46 -0.18 1.61 2.20 0.02 -4.95 119.74 122.13 1j08 s LYS 89 Ca 0.00 1.77 -0.29 0.00 -0.36 0.00 0.00 55.97 57.09 1j08 s LYS 89 Cb 0.00 -3.32 -0.01 0.00 -1.51 0.00 0.00 37.83 32.98 1j08 s LYS 89 CO 0.00 -0.19 1.25 0.34 -0.36 0.00 0.00 175.35 176.39 1j08 s ASP 90 N 0.78 6.94 0.00 1.43 -1.08 -1.26 -1.45 116.67 122.03 1j08 s ASP 90 Ca 0.57 1.65 0.14 0.00 -0.52 0.00 0.00 52.55 54.38 1j08 s ASP 90 Cb -0.30 -2.54 0.21 0.00 -1.46 0.00 0.00 42.92 38.84 1j08 s ASP 90 CO 0.31 -0.77 1.08 0.49 0.52 0.00 0.00 175.17 176.80 1j08 n PHE 91 N 6.65 0.22 -1.31 -5.34 3.01 -1.26 -4.97 117.46 114.46 1j08 n PHE 91 Ca 0.14 -0.19 -0.06 0.00 1.01 0.00 0.00 57.45 58.35 1j08 n PHE 91 Cb 0.45 -0.01 -0.02 0.00 -0.01 0.00 0.00 39.48 39.89 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 0.77 0.77 3.34 1.37 0.00 -1.26 -3.79 105.19 106.39 1j08 n GLY 92 Ca 0.10 -0.75 -0.44 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.25 4.96 0.09 1.61 1.01 -1.26 -1.15 120.40 123.41 1j08 s VAL 93 Ca 0.00 -1.23 0.06 0.00 0.00 0.00 0.00 61.98 60.80 1j08 s VAL 93 Cb 0.00 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 1j08 s VAL 93 CO 0.00 -0.61 -0.15 -0.13 0.00 0.00 0.00 175.10 174.21 1j08 s ARG 94 N 1.57 0.90 -0.13 2.72 3.00 -0.78 -0.63 118.95 125.60 1j08 s ARG 94 Ca 0.04 -1.05 0.01 0.00 0.00 0.00 0.00 55.73 54.73 1j08 s ARG 94 Cb -0.25 -0.89 0.02 0.00 0.00 0.00 0.00 34.95 33.83 1j08 s ARG 94 CO 0.05 0.19 -0.14 0.71 0.00 0.00 0.00 175.30 176.11 1j08 s TYR 95 N -1.49 2.00 -0.48 -0.53 1.51 0.54 -1.45 117.35 117.45 1j08 s TYR 95 Ca 0.02 -1.04 -0.11 0.00 -1.01 0.00 0.00 57.07 54.92 1j08 s TYR 95 Cb -0.09 -1.48 0.11 0.00 -0.11 0.00 0.00 41.96 40.40 1j08 s TYR 95 CO 0.03 -0.57 0.37 -0.06 -1.11 0.00 0.00 175.55 174.21 1j08 s PHE 96 N 1.30 3.35 0.00 2.71 0.40 0.14 -0.33 117.98 125.55 1j08 s PHE 96 Ca 0.00 -1.58 0.00 0.00 -0.60 0.00 0.00 56.93 54.75 1j08 s PHE 96 Cb -0.14 -3.43 0.00 0.00 0.51 0.00 0.00 43.02 39.96 1j08 s PHE 96 CO -0.07 -0.95 0.00 0.41 0.70 0.00 0.00 175.22 175.31 1j08 n GLY 97 N 5.02 1.47 3.79 4.36 0.00 -1.14 -0.96 105.19 117.73 1j08 n GLY 97 Ca -0.10 -2.24 -0.37 0.00 0.00 0.00 0.00 46.02 43.31 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 -1.40 4.35 -1.35 -0.61 2.07 -1.26 -4.83 121.20 118.17 1j08 s ILE 98 Ca 0.00 1.62 -0.11 0.00 -1.41 0.00 0.00 60.65 60.74 1j08 s ILE 98 Cb 0.00 -3.95 0.12 0.00 0.13 0.00 0.00 42.46 38.76 1j08 s ILE 98 CO 0.00 0.17 2.02 -2.65 -1.91 0.00 0.00 174.94 172.57 1j08 n PRO 99 N 0.62 3.34 -2.29 3.50 -0.02 -1.26 -4.92 135.00 133.97 1j08 n PRO 99 Ca 0.00 -3.17 -0.26 0.00 -2.02 0.00 0.00 63.50 58.06 1j08 n PRO 99 Cb 0.50 -3.06 0.05 0.00 -0.02 0.00 0.00 33.50 30.98 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 1.43 3.26 0.00 3.55 0.00 -1.26 -2.44 121.76 126.30 1j08 s ALA 100 Ca 0.43 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.50 1j08 s ALA 100 Cb 0.11 -2.56 0.00 0.00 0.00 0.00 0.00 23.12 20.67 1j08 s ALA 100 CO -0.03 -1.10 0.00 0.41 0.00 0.00 0.00 175.76 175.03 1j08 n GLY 101 N -2.77 3.25 0.13 0.00 0.00 -1.26 -1.75 105.19 102.78 1j08 n GLY 101 Ca 0.07 -0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.07 1j08 n GLY 101 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1j08 n HIS 102 N 14.00 0.73 0.39 1.61 8.25 -0.68 -2.06 115.22 137.45 1j08 n HIS 102 Ca 0.00 0.31 0.13 0.00 -0.26 0.00 0.00 57.72 57.90 1j08 n HIS 102 Cb 0.00 -0.99 0.35 0.00 1.12 0.00 0.00 29.99 30.47 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 -0.31 -0.41 4.39 -1.58 -3.30 114.58 113.36 1j08 h GLU 103 Ca 0.00 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 1j08 h GLU 103 Cb 0.27 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 1j08 h GLU 103 CO 0.00 0.00 0.18 0.35 -1.16 0.00 0.00 179.01 178.38 1j08 h PHE 104 N 0.00 0.42 -0.50 4.33 3.57 -1.07 -0.78 116.94 122.92 1j08 h PHE 104 Ca 0.00 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 1j08 h PHE 104 Cb 0.79 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.37 1j08 h PHE 104 CO 0.00 0.33 0.08 0.00 -2.23 0.00 0.00 178.31 176.48 1j08 h ALA 105 N 1.06 1.20 -0.69 2.41 0.00 -1.77 -1.99 119.26 119.48 1j08 h ALA 105 Ca 0.11 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1j08 h ALA 105 Cb 0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1j08 h ALA 105 CO -0.02 0.54 0.19 0.00 0.00 0.00 0.00 179.25 179.96 1j08 h ALA 106 N 1.34 1.03 -0.46 0.00 0.00 -1.59 -1.09 119.26 118.49 1j08 h ALA 106 Ca 0.16 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1j08 h ALA 106 Cb 0.34 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1j08 h ALA 106 CO 0.01 0.64 0.23 0.35 0.00 0.00 0.00 179.25 180.48 1j08 h PHE 107 N 1.03 0.64 -0.63 0.00 3.57 -0.58 -1.33 116.94 119.64 1j08 h PHE 107 Ca 0.22 -0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.63 1j08 h PHE 107 Cb 0.33 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.84 1j08 h PHE 107 CO 0.03 0.51 0.14 -0.07 -2.23 0.00 0.00 178.31 176.68 1j08 h LEU 108 N 0.59 0.98 -0.90 0.59 3.38 -1.11 -2.50 115.31 116.34 1j08 h LEU 108 Ca 0.16 -0.24 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 1j08 h LEU 108 Cb 0.09 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1j08 h LEU 108 CO -0.02 0.97 -0.30 -0.33 0.09 0.00 0.00 178.44 178.84 1j08 h GLU 109 N 0.94 0.45 -0.42 1.13 5.08 -1.00 -2.71 114.58 118.05 1j08 h GLU 109 Ca 0.20 -0.19 -0.10 0.00 -1.00 0.00 0.00 59.36 58.27 1j08 h GLU 109 Cb 0.38 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 1j08 h GLU 109 CO 0.01 0.71 -0.13 -0.44 -1.00 0.00 0.00 179.01 178.16 1j08 h ASP 110 N 0.39 0.77 -0.84 1.42 3.32 -1.00 -0.68 116.42 119.80 1j08 h ASP 110 Ca 0.05 -0.24 -0.03 0.00 0.02 0.00 0.00 57.03 56.83 1j08 h ASP 110 Cb 0.73 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 40.03 1j08 h ASP 110 CO 0.06 0.91 0.40 0.40 -1.72 0.00 0.00 179.24 179.29 1j08 h ILE 111 N 0.70 1.26 -0.15 0.35 2.04 -1.21 0.44 117.51 120.94 1j08 h ILE 111 Ca 0.11 -0.73 -0.06 0.00 1.00 0.00 0.00 64.86 65.19 1j08 h ILE 111 Cb 0.61 0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1j08 h ILE 111 CO 0.04 0.31 -0.13 0.58 0.00 0.00 0.00 178.15 178.96 1j08 h VAL 112 N 1.21 1.34 -0.66 1.67 2.07 -1.17 -1.25 116.25 119.45 1j08 h VAL 112 Ca 0.29 -1.26 -0.07 0.00 0.82 0.00 0.00 66.70 66.49 1j08 h VAL 112 Cb 0.12 1.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 1j08 h VAL 112 CO -0.04 0.37 0.15 0.44 0.02 0.00 0.00 177.57 178.52 1j08 h ASP 113 N -0.01 0.99 -0.35 0.57 5.19 -0.94 -0.85 116.42 121.03 1j08 h ASP 113 Ca 0.03 -0.21 -0.11 0.00 -0.62 0.00 0.00 57.03 56.12 1j08 h ASP 113 Cb 0.64 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 39.88 1j08 h ASP 113 CO 0.03 0.96 -0.17 0.58 -3.12 0.00 0.00 179.24 177.52 1j08 h VAL 114 N 1.00 1.27 -0.37 -1.35 2.07 -0.91 0.55 116.25 118.51 1j08 h VAL 114 Ca 0.21 -1.27 -0.00 0.00 0.82 0.00 0.00 66.70 66.45 1j08 h VAL 114 Cb 0.36 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1j08 h VAL 114 CO 0.00 0.43 0.22 -1.28 0.02 0.00 0.00 177.57 176.96 1j08 h SER 115 N 0.72 0.44 1.80 0.57 0.87 -0.69 -2.44 113.55 114.81 1j08 h SER 115 Ca 0.11 -0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.58 1j08 h SER 115 Cb 0.68 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 62.52 1j08 h SER 115 CO 0.05 0.37 -0.14 0.11 -0.53 0.00 0.00 176.83 176.69 1j08 h LYS 116 N 0.47 0.00 -4.38 2.24 1.57 -1.03 -2.44 116.57 113.01 1j08 h LYS 116 Ca 0.13 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.62 1j08 h LYS 116 Cb 0.01 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.42 1j08 h LYS 116 CO -0.02 0.14 -0.49 0.41 -0.57 0.00 0.00 179.45 178.91 1j08 n GLY 117 N 1.06 -0.16 3.29 3.86 0.00 0.19 -4.98 105.19 108.46 1j08 n GLY 117 Ca 0.03 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 1j08 n GLY 117 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1j08 s ASP 118 N -3.17 -0.08 0.38 1.61 2.15 -0.86 -4.99 116.67 111.70 1j08 s ASP 118 Ca 0.40 -0.49 0.06 0.00 0.43 0.00 0.00 52.55 52.96 1j08 s ASP 118 Cb -0.18 0.43 -0.02 0.00 -0.30 0.00 0.00 42.92 42.85 1j08 s ASP 118 CO 0.50 -0.82 0.23 0.35 -0.17 0.00 0.00 175.17 175.26 1j08 n THR 119 N -0.17 0.00 -0.80 1.71 -2.24 -1.26 -4.64 114.28 106.88 1j08 n THR 119 Ca -0.15 -2.49 0.08 0.00 -2.27 0.00 0.00 64.05 59.22 1j08 n THR 119 Cb 0.63 1.09 0.26 0.00 -2.10 0.00 0.00 70.33 70.21 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 -1.59 3.89 -4.74 3.42 5.75 -1.26 -5.02 116.55 117.00 1j08 n ASP 120 Ca 0.02 -2.77 -0.35 0.00 -0.01 0.00 0.00 54.79 51.68 1j08 n ASP 120 Cb 0.63 -0.49 0.07 0.00 -1.03 0.00 0.00 41.12 40.29 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 -2.39 3.43 0.73 -2.12 1.43 -1.26 -4.96 118.68 113.53 1j08 s LEU 121 Ca 0.40 2.32 -0.15 0.00 -1.03 0.00 0.00 54.13 55.66 1j08 s LEU 121 Cb 0.30 -4.59 0.04 0.00 0.03 0.00 0.00 46.19 41.97 1j08 s LEU 121 CO 0.12 -1.98 1.23 -0.04 0.23 0.00 0.00 176.35 175.91 1j08 s MET 122 N -3.77 2.12 0.24 1.70 -1.94 -1.26 -4.78 119.30 111.61 1j08 s MET 122 Ca 0.74 1.83 -0.05 0.00 -1.71 0.00 0.00 55.69 56.50 1j08 s MET 122 Cb -0.28 -1.82 0.35 0.00 2.01 0.00 0.00 34.83 35.09 1j08 s MET 122 CO 0.41 -1.87 1.84 1.96 -0.01 0.00 0.00 175.02 177.35 1j08 h GLN 123 N -0.23 0.87 -0.23 2.03 4.20 -2.00 -0.98 115.11 118.78 1j08 h GLN 123 Ca -0.48 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.11 1j08 h GLN 123 Cb 1.31 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.87 1j08 h GLN 123 CO 0.50 0.58 -0.15 0.22 -0.67 0.00 0.00 178.83 179.31 1j08 h ASP 124 N 0.90 0.37 -0.15 1.46 1.82 -2.00 -1.90 116.42 116.92 1j08 h ASP 124 Ca 0.38 -0.09 -0.11 0.00 -0.39 0.00 0.00 57.03 56.82 1j08 h ASP 124 Cb 0.24 -0.10 0.00 0.00 0.68 0.00 0.00 39.33 40.15 1j08 h ASP 124 CO -0.20 0.55 -0.33 0.28 -1.61 0.00 0.00 179.24 177.93 1j08 h SER 125 N 0.36 0.56 -0.84 2.28 0.02 -1.61 -2.60 113.55 111.72 1j08 h SER 125 Ca 0.07 -0.56 -0.02 0.00 -0.84 0.00 0.00 61.79 60.44 1j08 h SER 125 Cb 0.47 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.81 1j08 h SER 125 CO 0.03 1.02 0.46 0.11 -1.14 0.00 0.00 176.83 177.30 1j08 h LYS 126 N 0.12 1.19 -0.49 3.45 1.57 -1.07 0.03 116.57 121.36 1j08 h LYS 126 Ca 0.00 -0.14 -0.13 0.00 -1.87 0.00 0.00 60.65 58.51 1j08 h LYS 126 Cb 0.93 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 1j08 h LYS 126 CO 0.07 0.87 -0.19 0.93 -0.57 0.00 0.00 179.45 180.57 1j08 h GLU 127 N 1.19 0.99 0.04 3.15 5.08 -1.36 0.28 114.58 123.95 1j08 h GLU 127 Ca 0.30 -0.41 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1j08 h GLU 127 Cb 0.04 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1j08 h GLU 127 CO -0.05 1.08 -0.02 0.93 -1.00 0.00 0.00 179.01 179.95 1j08 h GLU 128 N 0.86 -0.05 -0.88 2.33 4.39 -1.17 -3.19 114.58 116.86 1j08 h GLU 128 Ca 0.12 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.83 1j08 h GLU 128 Cb 0.76 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.38 1j08 h GLU 128 CO 0.06 0.27 0.58 0.28 -1.16 0.00 0.00 179.01 179.04 1j08 h VAL 129 N -0.39 1.23 0.00 3.13 2.07 -0.93 -2.25 116.25 119.11 1j08 h VAL 129 Ca -0.01 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1j08 h VAL 129 Cb 0.35 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.06 1j08 h VAL 129 CO 0.01 0.22 0.00 -1.54 0.02 0.00 0.00 177.57 176.28 1j08 n SER 130 N -4.39 0.38 -0.07 0.57 3.41 0.08 -1.70 113.62 111.90 1j08 n SER 130 Ca 0.10 0.63 0.11 0.00 -0.26 0.00 0.00 58.87 59.46 1j08 n SER 130 Cb 0.03 -0.70 0.09 0.00 -0.26 0.00 0.00 64.21 63.37 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 -1.96 0.18 -1.98 4.33 5.02 -0.85 -4.88 118.16 118.03 1j08 n LYS 131 Ca 0.01 -0.13 -0.43 0.00 -2.02 0.00 0.00 58.31 55.74 1j08 n LYS 131 Cb 0.11 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.59 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 -2.91 3.51 -0.16 -0.18 1.01 -0.69 -4.86 121.20 116.92 1j08 s ILE 132 Ca 0.12 0.57 0.17 0.00 0.00 0.00 0.00 60.65 61.50 1j08 s ILE 132 Cb 0.17 -3.53 0.37 0.00 0.01 0.00 0.00 42.46 39.48 1j08 s ILE 132 CO 0.74 -0.23 1.23 -0.67 0.00 0.00 0.00 174.94 176.02 1j08 n ASP 133 N 8.91 2.59 -4.52 3.58 2.03 -1.26 -4.77 116.55 123.11 1j08 n ASP 133 Ca 0.21 -3.23 -0.27 0.00 0.52 0.00 0.00 54.79 52.02 1j08 n ASP 133 Cb 0.45 -0.48 -0.10 0.00 -0.72 0.00 0.00 41.12 40.27 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 -2.94 1.86 -0.19 -0.67 1.02 -1.26 -5.07 119.74 112.50 1j08 s LYS 134 Ca 0.36 -1.34 -0.29 0.00 0.02 0.00 0.00 55.97 54.71 1j08 s LYS 134 Cb 0.31 -2.06 -0.03 0.00 -0.52 0.00 0.00 37.83 35.53 1j08 s LYS 134 CO 0.03 0.43 1.64 -0.51 -0.92 0.00 0.00 175.35 176.01 1j08 s ASP 135 N -2.72 6.40 -0.05 2.83 1.01 -1.26 -4.64 116.67 118.24 1j08 s ASP 135 Ca 0.23 1.74 0.06 0.00 0.71 0.00 0.00 52.55 55.29 1j08 s ASP 135 Cb -0.09 -2.53 -0.01 0.00 1.01 0.00 0.00 42.92 41.30 1j08 s ASP 135 CO 0.13 -1.22 -0.23 -0.69 0.21 0.00 0.00 175.17 173.37 1j08 s VAL 136 N 5.08 1.90 -0.13 -1.27 1.01 -0.42 0.37 120.40 126.95 1j08 s VAL 136 Ca 0.73 -0.99 -0.00 0.00 0.00 0.00 0.00 61.98 61.72 1j08 s VAL 136 Cb -0.27 -1.60 0.02 0.00 0.00 0.00 0.00 36.38 34.54 1j08 s VAL 136 CO 0.29 0.53 -0.10 -0.60 0.00 0.00 0.00 175.10 175.22 1j08 s ARG 137 N -0.21 1.85 -0.29 2.72 3.52 -0.14 -0.28 118.95 126.13 1j08 s ARG 137 Ca -0.01 -0.38 -0.07 0.00 -0.13 0.00 0.00 55.73 55.14 1j08 s ARG 137 Cb -0.12 -1.79 0.00 0.00 -1.56 0.00 0.00 34.95 31.47 1j08 s ARG 137 CO 0.02 -0.25 0.08 0.42 -0.81 0.00 0.00 175.30 174.77 1j08 s ILE 138 N 1.59 4.06 -0.13 4.11 1.01 0.16 -0.28 121.20 131.73 1j08 s ILE 138 Ca 0.04 -0.57 -0.11 0.00 0.00 0.00 0.00 60.65 60.02 1j08 s ILE 138 Cb -0.13 -3.05 -0.05 0.00 0.01 0.00 0.00 42.46 39.25 1j08 s ILE 138 CO -0.09 0.14 0.23 -0.76 0.00 0.00 0.00 174.94 174.46 1j08 s LEU 139 N 1.53 4.33 -0.34 2.97 1.43 0.82 0.10 118.68 129.53 1j08 s LEU 139 Ca 0.04 0.52 0.01 0.00 -1.03 0.00 0.00 54.13 53.67 1j08 s LEU 139 Cb -0.17 -2.25 0.10 0.00 0.03 0.00 0.00 46.19 43.91 1j08 s LEU 139 CO 0.03 0.26 0.10 -0.63 0.23 0.00 0.00 176.35 176.35 1j08 s ILE 140 N -0.35 1.37 -0.11 -0.59 -1.09 -0.05 -1.15 121.20 119.22 1j08 s ILE 140 Ca 0.16 -1.84 -0.30 0.00 -2.23 0.00 0.00 60.65 56.44 1j08 s ILE 140 Cb -0.13 -2.02 -0.01 0.00 -1.58 0.00 0.00 42.46 38.72 1j08 s ILE 140 CO 0.04 -0.68 1.04 -0.36 -1.23 0.00 0.00 174.94 173.75 1j08 s PHE 141 N 1.23 3.44 0.29 3.97 0.08 0.10 -0.45 117.98 126.63 1j08 s PHE 141 Ca 0.11 1.52 0.03 0.00 0.12 0.00 0.00 56.93 58.71 1j08 s PHE 141 Cb -0.19 -3.24 -0.04 0.00 -0.57 0.00 0.00 43.02 38.99 1j08 s PHE 141 CO -0.17 -0.43 0.17 0.14 -0.10 0.00 0.00 175.22 174.83 1j08 s VAL 142 N 2.21 0.21 0.17 -0.44 -7.23 0.00 -2.08 120.40 113.24 1j08 s VAL 142 Ca 0.49 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.69 1j08 s VAL 142 Cb -0.19 -2.51 -0.05 0.00 0.56 0.00 0.00 36.38 34.20 1j08 s VAL 142 CO 0.17 0.00 -0.04 0.42 -0.31 0.00 0.00 175.10 175.33 1j08 s THR 143 N -3.68 0.95 0.21 5.32 -4.23 -1.26 -0.66 115.64 112.29 1j08 s THR 143 Ca 0.37 -2.02 0.17 0.00 -1.18 0.00 0.00 61.69 59.03 1j08 s THR 143 Cb 0.05 -2.03 0.10 0.00 1.34 0.00 0.00 72.50 71.96 1j08 s THR 143 CO 0.18 -0.58 1.72 -0.65 -0.54 0.00 0.00 174.62 174.76 1j08 h PRO 144 N 2.70 0.00 0.00 3.99 0.11 -1.97 -3.25 132.00 133.58 1j08 h PRO 144 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1j08 h PRO 144 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1j08 h PRO 144 CO 0.64 0.42 -0.30 1.15 -0.21 0.00 0.00 178.00 179.70 1j08 h THR 145 N 0.00 0.00 -3.24 -1.15 2.02 -1.97 -1.82 112.91 106.76 1j08 h THR 145 Ca -0.00 -0.76 -0.56 0.00 0.77 0.00 0.00 66.41 65.86 1j08 h THR 145 Cb 0.91 1.59 -0.06 0.00 -1.74 0.00 0.00 68.15 68.85 1j08 h THR 145 CO 0.05 0.00 1.04 0.00 0.37 0.00 0.00 175.52 176.99 1j08 h PRO 147 N 10.40 0.00 0.00 0.00 0.13 -1.90 -3.11 132.00 137.52 1j08 h PRO 147 Ca -0.26 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.84 1j08 h PRO 147 Cb 1.09 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 1j08 h PRO 147 CO 1.13 0.00 -1.40 0.66 -0.23 0.00 0.00 178.00 178.17 1j08 n TYR 148 N -2.81 0.64 -0.26 1.56 4.01 -1.26 -4.31 117.16 114.73 1j08 n TYR 148 Ca 0.02 0.19 0.04 0.00 -0.16 0.00 0.00 57.90 57.98 1j08 n TYR 148 Cb 0.31 -0.83 0.17 0.00 -0.31 0.00 0.00 39.34 38.68 1j08 n TYR 148 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1j08 h PRO 150 N 0.58 0.49 -0.50 0.00 0.11 -1.75 -1.50 132.00 129.43 1j08 h PRO 150 Ca 0.39 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.40 1j08 h PRO 150 Cb 0.49 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.47 1j08 h PRO 150 CO -0.32 0.33 0.04 -0.07 -0.21 0.00 0.00 178.00 177.76 1j08 h LEU 151 N 0.51 0.78 -0.15 2.35 3.38 -1.57 -0.80 115.31 119.81 1j08 h LEU 151 Ca 0.28 -0.17 -0.23 0.00 0.09 0.00 0.00 57.88 57.84 1j08 h LEU 151 Cb 0.42 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 40.98 1j08 h LEU 151 CO -0.08 0.82 -0.83 0.00 0.09 0.00 0.00 178.44 178.43 1j08 h ALA 152 N 1.27 0.30 -0.30 1.53 0.00 -1.25 -2.37 119.26 118.43 1j08 h ALA 152 Ca 0.15 -0.62 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1j08 h ALA 152 Cb 0.41 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1j08 h ALA 152 CO 0.01 0.69 0.16 0.28 0.00 0.00 0.00 179.25 180.40 1j08 h VAL 153 N 0.49 1.14 -0.63 0.00 2.07 -1.19 -2.49 116.25 115.65 1j08 h VAL 153 Ca -0.07 -0.37 -0.04 0.00 0.82 0.00 0.00 66.70 67.04 1j08 h VAL 153 Cb 1.46 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 32.04 1j08 h VAL 153 CO 0.17 0.14 0.22 0.03 0.02 0.00 0.00 177.57 178.15 1j08 h ARG 154 N 0.37 0.96 -0.31 1.57 2.47 -1.17 -1.27 114.38 116.99 1j08 h ARG 154 Ca 0.11 -0.19 0.02 0.00 -1.26 0.00 0.00 59.98 58.66 1j08 h ARG 154 Cb 0.08 -0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.23 1j08 h ARG 154 CO -0.02 0.83 0.15 1.98 0.56 0.00 0.00 179.97 183.48 1j08 h MET 155 N 0.89 0.31 -0.60 0.04 4.05 -1.32 0.40 114.93 118.71 1j08 h MET 155 Ca 0.21 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.57 1j08 h MET 155 Cb 0.25 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 30.95 1j08 h MET 155 CO -0.01 0.21 0.23 0.00 0.23 0.00 0.00 176.91 177.57 1j08 h ALA 156 N 1.16 1.28 0.00 0.39 0.00 -1.22 -2.02 119.26 118.86 1j08 h ALA 156 Ca 0.13 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1j08 h ALA 156 Cb 0.05 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1j08 h ALA 156 CO -0.09 0.53 -0.57 0.45 0.00 0.00 0.00 179.25 179.56 1j08 h HIS 157 N 0.86 0.00 -0.22 0.00 -0.00 -0.50 -2.26 115.15 113.03 1j08 h HIS 157 Ca 0.20 0.00 -0.16 0.00 -0.00 0.00 0.00 60.37 60.41 1j08 h HIS 157 Cb 0.18 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.58 1j08 h HIS 157 CO 0.01 0.57 -0.51 0.87 -0.00 0.00 0.00 177.93 178.87 1j08 h LYS 158 N 0.00 0.63 -0.61 2.45 1.57 -0.47 -0.35 116.57 119.79 1j08 h LYS 158 Ca -0.01 -0.38 -0.04 0.00 -1.87 0.00 0.00 60.65 58.35 1j08 h LYS 158 Cb 1.04 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.36 1j08 h LYS 158 CO 0.07 0.99 0.22 0.74 -0.57 0.00 0.00 179.45 180.91 1j08 h PHE 159 N 0.49 0.94 -0.52 -1.35 0.04 -1.19 -0.86 116.94 114.49 1j08 h PHE 159 Ca 0.02 -0.08 -0.05 0.00 2.80 0.00 0.00 57.97 60.66 1j08 h PHE 159 Cb 1.06 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.91 1j08 h PHE 159 CO 0.05 0.76 0.13 0.00 -0.60 0.00 0.00 178.31 178.66 1j08 h ALA 160 N 1.08 0.68 -0.21 2.45 0.00 -1.21 -0.91 119.26 121.14 1j08 h ALA 160 Ca 0.20 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1j08 h ALA 160 Cb 0.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1j08 h ALA 160 CO -0.01 0.37 0.10 0.82 0.00 0.00 0.00 179.25 180.53 1j08 h ILE 161 N 0.72 1.13 -0.38 0.00 2.04 -0.73 -1.35 117.51 118.94 1j08 h ILE 161 Ca 0.16 -0.37 -0.11 0.00 1.00 0.00 0.00 64.86 65.55 1j08 h ILE 161 Cb 0.32 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 1j08 h ILE 161 CO 0.00 0.12 -0.22 -0.33 0.00 0.00 0.00 178.15 177.73 1j08 h GLU 162 N 0.21 0.74 0.00 2.37 4.39 -1.10 -0.68 114.58 120.51 1j08 h GLU 162 Ca 0.07 -0.29 -0.05 0.00 0.34 0.00 0.00 59.36 59.42 1j08 h GLU 162 Cb 0.11 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 1j08 h GLU 162 CO -0.01 0.90 -0.26 -0.97 -1.16 0.00 0.00 179.01 177.51 1j08 h ASN 163 N 0.65 0.00 -0.07 1.42 -0.73 -0.97 0.93 115.58 116.82 1j08 h ASN 163 Ca 0.09 0.00 -0.15 0.00 1.87 0.00 0.00 56.30 58.12 1j08 h ASN 163 Cb 0.71 0.00 0.01 0.00 0.27 0.00 0.00 38.32 39.31 1j08 h ASN 163 CO 0.05 0.26 -0.53 0.74 -0.37 0.00 0.00 177.43 177.59 1j08 h THR 164 N 0.00 1.39 -0.75 -3.57 2.02 -0.81 -1.42 112.91 109.77 1j08 h THR 164 Ca -0.00 -1.90 0.03 0.00 0.77 0.00 0.00 66.41 65.31 1j08 h THR 164 Cb 0.46 2.33 -0.04 0.00 -1.74 0.00 0.00 68.15 69.16 1j08 h THR 164 CO 0.03 0.56 0.49 0.50 0.37 0.00 0.00 175.52 177.48 1j08 h LYS 165 N 0.03 0.89 0.00 6.66 3.64 -0.55 0.12 116.57 127.35 1j08 h LYS 165 Ca -0.05 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1j08 h LYS 165 Cb 1.19 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 1j08 h LYS 165 CO 0.11 0.59 0.00 0.00 -2.27 0.00 0.00 179.45 177.87 1j08 n ALA 166 N -2.43 2.08 -1.01 5.00 0.00 0.27 -4.84 120.51 119.58 1j08 n ALA 166 Ca 0.10 -0.10 -0.00 0.00 0.00 0.00 0.00 53.44 53.43 1j08 n ALA 166 Cb 0.12 -1.28 -0.00 0.00 0.00 0.00 0.00 19.45 18.29 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 0.10 0.46 0.10 0.00 0.00 0.41 -4.92 105.19 101.33 1j08 n GLY 167 Ca 0.12 -0.42 -0.14 0.00 0.00 0.00 0.00 46.02 45.57 1j08 n GLY 167 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j08 n LYS 168 N -2.94 0.52 -2.63 1.61 4.76 -0.82 -5.00 118.16 113.66 1j08 n LYS 168 Ca -0.00 0.39 -0.18 0.00 -2.87 0.00 0.00 58.31 55.64 1j08 n LYS 168 Cb 0.01 -1.58 0.01 0.00 -1.84 0.00 0.00 35.03 31.63 1j08 n LYS 168 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1j08 n GLY 169 N 1.46 -0.34 0.40 0.72 0.00 -0.60 -4.91 105.19 101.92 1j08 n GLY 169 Ca -0.24 -0.08 0.10 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.13 1.37 -3.59 1.61 5.02 -1.26 -4.94 118.16 113.24 1j08 n LYS 170 Ca -0.15 -0.83 -0.36 0.00 -2.02 0.00 0.00 58.31 54.95 1j08 n LYS 170 Cb 0.63 -1.39 -0.08 0.00 -0.02 0.00 0.00 35.03 34.17 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 -2.28 5.33 -0.20 -0.18 1.01 -1.26 -1.30 121.20 122.33 1j08 s ILE 171 Ca 0.15 0.40 -0.03 0.00 0.00 0.00 0.00 60.65 61.17 1j08 s ILE 171 Cb 0.16 -3.58 -0.01 0.00 0.01 0.00 0.00 42.46 39.04 1j08 s ILE 171 CO 0.52 0.37 -0.06 -0.76 0.00 0.00 0.00 174.94 175.02 1j08 s LEU 172 N 0.70 2.88 -0.35 2.97 1.43 0.62 -4.56 118.68 122.37 1j08 s LEU 172 Ca 0.13 -0.36 -0.09 0.00 -1.03 0.00 0.00 54.13 52.78 1j08 s LEU 172 Cb -0.13 -1.72 0.03 0.00 0.03 0.00 0.00 46.19 44.40 1j08 s LEU 172 CO 0.03 0.03 0.15 -0.83 0.23 0.00 0.00 176.35 175.96 1j08 s GLY 173 N 1.18 1.88 -0.31 -3.19 0.00 -0.30 0.39 107.32 106.96 1j08 s GLY 173 Ca 0.02 -1.67 -0.00 0.00 0.00 0.00 0.00 44.72 43.07 1j08 s GLY 173 CO -0.01 0.78 0.00 0.99 0.00 0.00 0.00 173.10 174.86 1j08 s ASP 174 N 1.50 4.83 0.17 1.64 1.11 0.12 -1.86 116.67 124.18 1j08 s ASP 174 Ca 0.01 -1.47 -0.30 0.00 0.18 0.00 0.00 52.55 50.97 1j08 s ASP 174 Cb -0.19 -1.68 -0.07 0.00 1.07 0.00 0.00 42.92 42.04 1j08 s ASP 174 CO 0.05 -0.29 1.05 -0.32 1.18 0.00 0.00 175.17 176.84 1j08 s MET 175 N 1.17 4.65 -0.22 8.23 -2.45 -0.53 -0.87 119.30 129.29 1j08 s MET 175 Ca -0.03 1.63 0.00 0.00 -1.25 0.00 0.00 55.69 56.04 1j08 s MET 175 Cb -0.20 -3.30 0.06 0.00 1.25 0.00 0.00 34.83 32.64 1j08 s MET 175 CO -0.03 0.17 -0.05 0.08 1.05 0.00 0.00 175.02 176.24 1j08 s VAL 176 N -0.34 1.36 -0.54 10.11 1.01 0.40 0.28 120.40 132.68 1j08 s VAL 176 Ca 0.48 -1.05 -0.27 0.00 0.00 0.00 0.00 61.98 61.13 1j08 s VAL 176 Cb -0.28 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.46 1j08 s VAL 176 CO 0.34 -0.07 1.71 -0.70 0.00 0.00 0.00 175.10 176.38 1j08 s GLU 177 N 1.48 2.97 0.40 2.72 -6.30 -0.13 -0.82 118.70 119.02 1j08 s GLU 177 Ca -0.04 0.72 0.13 0.00 -2.50 0.00 0.00 54.97 53.28 1j08 s GLU 177 Cb -0.18 -4.27 0.97 0.00 0.00 0.00 0.00 34.13 30.64 1j08 s GLU 177 CO -0.07 -2.32 1.89 0.00 0.02 0.00 0.00 175.26 174.78 1j08 h ALA 178 N 13.37 2.02 -0.31 6.30 0.00 -1.19 -1.14 119.26 138.30 1j08 h ALA 178 Ca -0.28 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.53 1j08 h ALA 178 Cb 1.14 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1j08 h ALA 178 CO 1.17 -0.25 -0.26 0.82 0.00 0.00 0.00 179.25 180.73 1j08 h ILE 179 N 0.52 1.27 0.00 0.00 2.04 -1.90 -2.90 117.51 116.54 1j08 h ILE 179 Ca 0.42 -1.34 -0.10 0.00 1.00 0.00 0.00 64.86 64.84 1j08 h ILE 179 Cb 0.85 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 1j08 h ILE 179 CO -0.16 0.43 -0.55 -0.08 0.00 0.00 0.00 178.15 177.79 1j08 h GLU 180 N 0.53 0.00 -2.19 2.37 4.57 -1.73 -3.37 114.58 114.76 1j08 h GLU 180 Ca 0.07 0.00 -0.58 0.00 -1.18 0.00 0.00 59.36 57.67 1j08 h GLU 180 Cb 0.73 0.00 -0.42 0.00 -0.16 0.00 0.00 28.75 28.90 1j08 h GLU 180 CO 0.06 0.41 -0.71 0.66 -1.18 0.00 0.00 179.01 178.24 1j08 n TYR 181 N -3.16 3.12 -0.33 0.92 4.01 -0.51 -4.93 117.16 116.28 1j08 n TYR 181 Ca 0.01 -4.01 -0.04 0.00 -0.16 0.00 0.00 57.90 53.70 1j08 n TYR 181 Cb 0.72 -0.50 0.08 0.00 -0.31 0.00 0.00 39.34 39.33 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 3.60 1.21 0.03 -0.72 0.13 -1.69 -1.02 132.00 133.54 1j08 h PRO 182 Ca 0.15 -0.12 -0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1j08 h PRO 182 Cb 0.65 -0.25 0.00 0.00 0.13 0.00 0.00 31.00 31.53 1j08 h PRO 182 CO 0.77 0.86 -0.02 0.93 -0.23 0.00 0.00 178.00 180.31 1j08 h GLU 183 N 1.22 -0.04 -0.64 0.86 3.07 -1.91 0.40 114.58 117.52 1j08 h GLU 183 Ca 0.31 0.00 0.03 0.00 -0.50 0.00 0.00 59.36 59.21 1j08 h GLU 183 Cb -0.02 0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 27.86 1j08 h GLU 183 CO -0.06 0.12 0.39 2.35 -1.40 0.00 0.00 179.01 180.42 1j08 h TRP 184 N -0.21 0.73 -0.60 4.33 2.91 -1.93 -0.12 115.95 121.06 1j08 h TRP 184 Ca -0.00 0.02 -0.09 0.00 1.13 0.00 0.00 58.89 59.95 1j08 h TRP 184 Cb 0.19 -0.24 -0.02 0.00 -0.51 0.00 0.00 29.16 28.58 1j08 h TRP 184 CO -0.02 0.41 0.03 0.00 -1.03 0.00 0.00 178.44 177.83 1j08 h ALA 185 N 1.29 0.92 -0.21 2.65 0.00 -0.92 -2.49 119.26 120.50 1j08 h ALA 185 Ca 0.26 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1j08 h ALA 185 Cb 0.05 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1j08 h ALA 185 CO -0.12 0.65 -0.10 -0.44 0.00 0.00 0.00 179.25 179.24 1j08 h ASP 186 N 0.95 0.32 0.00 0.00 3.32 0.61 -1.51 116.42 120.11 1j08 h ASP 186 Ca 0.18 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 1j08 h ASP 186 Cb 0.50 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 1j08 h ASP 186 CO 0.02 0.46 -0.00 -0.61 -1.72 0.00 0.00 179.24 177.39 1j08 h GLN 187 N 0.32 0.00 -0.34 3.56 4.15 -0.57 -1.62 115.11 120.61 1j08 h GLN 187 Ca 0.07 0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.39 1j08 h GLN 187 Cb 0.39 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.02 1j08 h GLN 187 CO 0.02 0.00 0.01 0.66 -1.93 0.00 0.00 178.83 177.60 1j08 n TYR 188 N -4.45 1.13 -4.20 3.99 4.01 -0.77 -4.97 117.16 111.90 1j08 n TYR 188 Ca -0.03 -1.19 -0.29 0.00 -0.16 0.00 0.00 57.90 56.23 1j08 n TYR 188 Cb 0.09 -0.42 -0.07 0.00 -0.31 0.00 0.00 39.34 38.63 1j08 n TYR 188 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1j08 n ASN 189 N -0.76 0.53 -4.69 7.72 5.03 -0.61 -4.86 115.26 117.62 1j08 n ASN 189 Ca 0.28 -1.19 -0.42 0.00 0.87 0.00 0.00 54.58 54.12 1j08 n ASN 189 Cb 0.99 -2.07 -0.03 0.00 -1.02 0.00 0.00 39.78 37.66 1j08 n ASN 189 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1j08 s VAL 190 N -4.24 4.47 0.00 2.41 1.01 -0.64 -4.86 120.40 118.55 1j08 s VAL 190 Ca 0.00 1.77 0.00 0.00 0.00 0.00 0.00 61.98 63.75 1j08 s VAL 190 Cb -0.00 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.24 1j08 s VAL 190 CO 0.96 0.01 0.00 0.23 0.00 0.00 0.00 175.10 176.31 1j08 n MET 191 N 5.01 0.00 -2.56 2.72 2.81 -1.26 -4.86 117.12 118.97 1j08 n MET 191 Ca 0.10 0.00 -0.33 0.00 -1.81 0.00 0.00 57.70 55.66 1j08 n MET 191 Cb 0.47 0.00 -0.04 0.00 -0.71 0.00 0.00 33.22 32.94 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 -2.00 2.97 0.11 3.04 0.00 -1.26 -5.07 121.76 119.55 1j08 s ALA 192 Ca 0.00 0.41 0.05 0.00 0.00 0.00 0.00 51.96 52.42 1j08 s ALA 192 Cb 0.00 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.90 1j08 s ALA 192 CO 0.00 -0.18 -0.12 0.14 0.00 0.00 0.00 175.76 175.60 1j08 s VAL 193 N -2.25 1.16 0.56 0.00 -7.23 -1.26 -4.24 120.40 107.14 1j08 s VAL 193 Ca 0.63 -1.67 -0.15 0.00 -1.81 0.00 0.00 61.98 58.98 1j08 s VAL 193 Cb -0.12 -1.44 -0.06 0.00 0.56 0.00 0.00 36.38 35.32 1j08 s VAL 193 CO 0.22 -0.46 1.01 -2.16 -0.31 0.00 0.00 175.10 173.39 1j08 s PRO 194 N -2.67 3.71 -0.09 4.82 0.04 -1.26 -4.72 135.00 134.83 1j08 s PRO 194 Ca 0.07 0.96 0.03 0.00 0.04 0.00 0.00 61.00 62.10 1j08 s PRO 194 Cb -0.04 -2.10 0.01 0.00 0.04 0.00 0.00 34.50 32.40 1j08 s PRO 194 CO 0.02 -0.47 -0.19 0.21 0.04 0.00 0.00 177.00 176.60 1j08 s LYS 195 N -4.35 2.49 -0.10 4.56 2.20 -0.89 -0.96 119.74 122.69 1j08 s LYS 195 Ca 0.59 -0.68 -0.00 0.00 -0.36 0.00 0.00 55.97 55.51 1j08 s LYS 195 Cb -0.11 -1.93 -0.03 0.00 -1.51 0.00 0.00 37.83 34.25 1j08 s LYS 195 CO 0.38 0.11 -0.08 0.42 -0.36 0.00 0.00 175.35 175.82 1j08 s ILE 196 N 0.49 3.53 -0.13 5.43 1.09 0.42 -0.72 121.20 131.31 1j08 s ILE 196 Ca -0.17 -0.52 0.00 0.00 -1.10 0.00 0.00 60.65 58.86 1j08 s ILE 196 Cb -0.17 -2.47 0.02 0.00 -1.06 0.00 0.00 42.46 38.78 1j08 s ILE 196 CO 0.06 0.56 -0.11 -0.69 -0.10 0.00 0.00 174.94 174.66 1j08 s VAL 197 N -0.25 1.35 -0.28 2.92 1.01 -0.30 -1.73 120.40 123.11 1j08 s VAL 197 Ca 0.03 -0.50 -0.08 0.00 0.00 0.00 0.00 61.98 61.43 1j08 s VAL 197 Cb -0.13 -1.30 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 1j08 s VAL 197 CO 0.03 0.42 0.11 -0.63 0.00 0.00 0.00 175.10 175.03 1j08 s ILE 198 N 1.58 4.42 -0.05 2.22 1.01 0.45 -0.12 121.20 130.70 1j08 s ILE 198 Ca 0.05 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.34 1j08 s ILE 198 Cb -0.13 -3.18 -0.03 0.00 0.01 0.00 0.00 42.46 39.13 1j08 s ILE 198 CO -0.10 0.17 -0.01 -1.10 0.00 0.00 0.00 174.94 173.91 1j08 s GLN 199 N 1.60 2.86 -0.15 2.79 -0.21 0.62 -1.50 119.66 125.67 1j08 s GLN 199 Ca 0.05 -0.52 0.01 0.00 0.02 0.00 0.00 55.36 54.92 1j08 s GLN 199 Cb -0.16 -2.71 0.02 0.00 1.00 0.00 0.00 33.01 31.16 1j08 s GLN 199 CO 0.05 0.66 -0.16 0.08 -2.12 0.00 0.00 175.29 173.80 1j08 s VAL 200 N -0.96 1.71 -1.46 1.09 1.01 -0.54 -0.97 120.40 120.27 1j08 s VAL 200 Ca 0.16 -0.73 -0.07 0.00 0.00 0.00 0.00 61.98 61.34 1j08 s VAL 200 Cb -0.11 -1.57 0.03 0.00 0.00 0.00 0.00 36.38 34.72 1j08 s VAL 200 CO 0.06 0.48 0.65 0.59 0.00 0.00 0.00 175.10 176.88 1j08 n ASN 201 N 4.62 -5.36 0.00 3.32 3.02 0.16 -2.29 115.26 118.73 1j08 n ASN 201 Ca -0.18 -0.37 0.00 0.00 -0.03 0.00 0.00 54.58 53.99 1j08 n ASN 201 Cb 0.50 -4.34 0.00 0.00 -0.61 0.00 0.00 39.78 35.33 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 -1.48 2.00 3.63 7.41 0.00 -1.26 -5.04 105.19 110.45 1j08 n GLY 202 Ca -0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.45 2.86 0.09 1.61 -1.05 -0.97 -5.04 118.70 115.75 1j08 s GLU 203 Ca 0.00 -0.48 -0.31 0.00 -0.15 0.00 0.00 54.97 54.03 1j08 s GLU 203 Cb 0.00 -2.69 -0.08 0.00 -0.44 0.00 0.00 34.13 30.92 1j08 s GLU 203 CO 0.00 0.68 1.58 -0.51 0.95 0.00 0.00 175.26 177.96 1j08 s ASP 204 N -0.87 6.65 -0.05 0.83 1.01 -1.26 -1.47 116.67 121.50 1j08 s ASP 204 Ca 0.13 2.45 -0.01 0.00 0.71 0.00 0.00 52.55 55.83 1j08 s ASP 204 Cb -0.11 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.22 1j08 s ASP 204 CO 0.02 -0.83 -0.06 0.29 0.21 0.00 0.00 175.17 174.80 1j08 n LYS 205 N 5.06 0.12 -4.15 8.23 4.76 -0.56 -4.94 118.16 126.68 1j08 n LYS 205 Ca 0.15 0.04 -0.15 0.00 -2.87 0.00 0.00 58.31 55.48 1j08 n LYS 205 Cb 0.41 -0.89 -0.13 0.00 -1.84 0.00 0.00 35.03 32.57 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 -2.10 0.50 -0.01 -0.18 1.01 -1.10 -4.94 120.40 113.57 1j08 s VAL 206 Ca -0.07 -0.53 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 1j08 s VAL 206 Cb 0.02 -0.47 0.01 0.00 0.00 0.00 0.00 36.38 35.94 1j08 s VAL 206 CO 0.11 -0.04 0.04 -1.10 0.00 0.00 0.00 175.10 174.11 1j08 s GLN 207 N -0.63 0.04 0.23 2.72 -0.21 -1.26 -0.41 119.66 120.14 1j08 s GLN 207 Ca -0.02 0.06 -0.21 0.00 0.02 0.00 0.00 55.36 55.22 1j08 s GLN 207 Cb -0.05 -0.00 0.04 0.00 1.00 0.00 0.00 33.01 34.00 1j08 s GLN 207 CO 0.00 -0.02 0.64 -0.59 -2.12 0.00 0.00 175.29 173.20 1j08 s PHE 208 N 0.11 -0.26 0.10 0.91 -0.71 -0.71 -5.01 117.98 112.41 1j08 s PHE 208 Ca -0.01 -0.10 0.10 0.00 -1.04 0.00 0.00 56.93 55.88 1j08 s PHE 208 Cb -0.01 0.58 -0.04 0.00 -1.21 0.00 0.00 43.02 42.35 1j08 s PHE 208 CO -0.00 -1.05 -0.25 -1.21 -1.34 0.00 0.00 175.22 171.37 1j08 s GLU 209 N -3.87 1.62 0.00 1.99 2.02 -1.26 -0.44 118.70 118.76 1j08 s GLU 209 Ca 0.08 -1.23 0.00 0.00 0.02 0.00 0.00 54.97 53.84 1j08 s GLU 209 Cb -0.03 -1.98 0.00 0.00 0.10 0.00 0.00 34.13 32.22 1j08 s GLU 209 CO -0.01 0.48 0.00 0.41 0.02 0.00 0.00 175.26 176.16 1j08 n GLY 210 N 1.16 2.16 3.42 -1.39 0.00 -0.13 -4.83 105.19 105.57 1j08 n GLY 210 Ca -0.17 -1.78 -0.43 0.00 0.00 0.00 0.00 46.02 43.63 1j08 n GLY 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j08 n ALA 211 N 1.96 3.96 -1.69 4.61 0.00 -1.26 -4.83 120.51 123.27 1j08 n ALA 211 Ca 0.00 -4.07 -0.43 0.00 0.00 0.00 0.00 53.44 48.93 1j08 n ALA 211 Cb 0.00 -3.30 -0.02 0.00 0.00 0.00 0.00 19.45 16.14 1j08 n ALA 211 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1j08 n TYR 212 N 6.63 2.26 -1.05 0.00 4.02 -1.26 -4.88 117.16 122.88 1j08 n TYR 212 Ca 0.43 0.48 -0.31 0.00 -0.01 0.00 0.00 57.90 58.50 1j08 n TYR 212 Cb 0.43 -2.45 0.13 0.00 -0.02 0.00 0.00 39.34 37.44 1j08 n TYR 212 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 176.86 173.71 1j08 s PRO 213 N -1.17 1.57 0.13 -0.72 0.02 -1.26 -4.50 135.00 129.07 1j08 s PRO 213 Ca 0.61 1.21 -0.24 0.00 0.02 0.00 0.00 61.00 62.60 1j08 s PRO 213 Cb -0.60 -1.82 -0.05 0.00 0.02 0.00 0.00 34.50 32.05 1j08 s PRO 213 CO 0.56 -2.14 1.36 -1.91 -0.33 0.00 0.00 177.00 174.54 1j08 n GLU 214 N -3.86 -0.34 -0.11 5.54 2.13 -1.26 -1.02 120.64 121.71 1j08 n GLU 214 Ca 0.09 1.34 -0.05 0.00 0.66 0.00 0.00 57.16 59.20 1j08 n GLU 214 Cb 0.53 -1.98 0.02 0.00 0.27 0.00 0.00 31.44 30.28 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 0.05 -0.51 5.31 1.79 -1.99 0.59 116.57 121.81 1j08 h LYS 215 Ca 0.13 -0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.51 1j08 h LYS 215 Cb 0.32 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.94 1j08 h LYS 215 CO -0.74 0.03 0.01 0.52 -1.08 0.00 0.00 179.45 178.20 1j08 h MET 216 N 0.05 0.89 -0.42 3.15 2.86 -1.72 -0.86 114.93 118.88 1j08 h MET 216 Ca 0.19 -0.28 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1j08 h MET 216 Cb 0.28 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 1j08 h MET 216 CO -0.36 0.92 0.18 0.35 1.06 0.00 0.00 176.91 179.06 1j08 h PHE 217 N 0.76 0.63 -0.98 -0.22 3.04 -0.79 -2.01 116.94 117.36 1j08 h PHE 217 Ca 0.15 -0.04 0.03 0.00 3.98 0.00 0.00 57.97 62.09 1j08 h PHE 217 Cb 0.51 -0.19 -0.06 0.00 2.56 0.00 0.00 35.95 38.77 1j08 h PHE 217 CO 0.04 0.54 0.65 1.25 -2.02 0.00 0.00 178.31 178.76 1j08 h LEU 218 N 0.54 1.08 -0.81 0.59 5.85 -0.67 -1.68 115.31 120.22 1j08 h LEU 218 Ca 0.14 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 1j08 h LEU 218 Cb 0.16 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 1j08 h LEU 218 CO -0.01 0.74 0.27 -0.33 -0.34 0.00 0.00 178.44 178.77 1j08 h GLU 219 N 1.25 1.16 -0.51 1.25 5.08 -0.64 -0.29 114.58 121.89 1j08 h GLU 219 Ca 0.39 -0.23 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 1j08 h GLU 219 Cb -0.01 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 1j08 h GLU 219 CO -0.12 0.96 0.16 0.87 -1.00 0.00 0.00 179.01 179.89 1j08 h LYS 220 N 1.12 0.79 -0.16 2.33 1.79 -0.68 0.19 116.57 121.94 1j08 h LYS 220 Ca 0.25 -0.17 -0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1j08 h LYS 220 Cb 0.26 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 1j08 h LYS 220 CO -0.01 0.73 0.09 1.25 -1.08 0.00 0.00 179.45 180.42 1j08 h LEU 221 N 0.69 0.19 -0.86 2.94 5.85 -1.00 -0.78 115.31 122.35 1j08 h LEU 221 Ca 0.16 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 1j08 h LEU 221 Cb 0.26 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 1j08 h LEU 221 CO -0.01 0.22 0.37 -0.07 -0.34 0.00 0.00 178.44 178.61 1j08 h LEU 222 N 0.16 1.10 -1.01 2.25 3.38 -0.87 -2.25 115.31 118.06 1j08 h LEU 222 Ca 0.06 -0.15 0.02 0.00 0.09 0.00 0.00 57.88 57.90 1j08 h LEU 222 Cb 0.07 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.48 1j08 h LEU 222 CO -0.01 0.94 0.67 -1.28 0.09 0.00 0.00 178.44 178.85 1j08 h SER 223 N 1.18 1.13 0.65 -0.43 0.87 -0.26 -1.71 113.55 114.99 1j08 h SER 223 Ca 0.28 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 1j08 h SER 223 Cb 0.16 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 61.84 1j08 h SER 223 CO -0.03 0.80 0.00 0.00 -0.53 0.00 0.00 176.83 177.07 1j08 h ALA 224 N 1.39 1.00 0.00 6.23 0.00 -0.54 -1.94 119.26 125.40 1j08 h ALA 224 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1j08 h ALA 224 Cb -0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1j08 h ALA 224 CO -0.10 0.00 -0.78 1.28 0.00 0.00 0.00 179.25 179.65 1j08 n LEU 225 N -2.95 0.74 0.00 0.00 4.77 -0.67 -4.84 117.00 114.04 1j08 n LEU 225 Ca -0.00 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 1j08 n LEU 225 Cb 0.22 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1j08 n LEU 225 CO 0.23 0.18 0.12 -1.20 -1.33 0.00 0.00 177.39 175.39