#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j8d h GLN 3 N 0.00 -0.32 -0.03 -1.09 1.08 -2.01 -2.86 115.11 109.87 1j8d h GLN 3 Ca 0.00 0.02 -0.21 0.00 -1.45 0.00 0.00 58.65 57.01 1j8d h GLN 3 Cb 0.00 0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.50 1j8d h GLN 3 CO 0.00 -0.22 -0.86 0.87 -0.95 0.00 0.00 178.83 177.68 1j8d h LYS 4 N -0.33 0.42 -0.20 1.46 1.57 -1.99 -3.34 116.57 114.15 1j8d h LYS 4 Ca -0.01 -0.40 0.05 0.00 -1.87 0.00 0.00 60.65 58.42 1j8d h LYS 4 Cb 0.33 0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.69 1j8d h LYS 4 CO -0.11 1.06 -0.15 -0.07 -0.57 0.00 0.00 179.45 179.61 1j8d h LEU 5 N 0.26 -0.50 -2.72 2.94 3.38 -1.96 -1.56 115.31 115.15 1j8d h LEU 5 Ca -0.06 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1j8d h LEU 5 Cb 1.47 0.25 -0.00 0.00 0.09 0.00 0.00 40.66 42.47 1j8d h LEU 5 CO 0.15 -0.20 0.02 1.05 0.09 0.00 0.00 178.44 179.55 1j8d h GLU 6 N -0.16 0.00 -0.02 1.13 4.11 -1.63 -2.03 114.58 115.98 1j8d h GLU 6 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.55 1j8d h GLU 6 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1j8d h GLU 6 CO -0.29 0.00 -0.02 0.09 0.07 0.00 0.00 179.01 178.86 1j8d n ASN 7 N -3.42 1.88 -4.70 3.06 4.13 -0.60 -4.90 115.26 110.71 1j8d n ASN 7 Ca -0.03 -1.61 -0.42 0.00 1.68 0.00 0.00 54.58 54.20 1j8d n ASN 7 Cb 0.09 0.01 -0.03 0.00 -1.54 0.00 0.00 39.78 38.32 1j8d n ASN 7 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1j8d s ILE 8 N -2.03 4.39 0.00 2.41 1.01 -0.77 -4.42 121.20 121.80 1j8d s ILE 8 Ca 0.35 1.71 0.00 0.00 0.00 0.00 0.00 60.65 62.71 1j8d s ILE 8 Cb 0.21 -4.10 0.00 0.00 0.01 0.00 0.00 42.46 38.58 1j8d s ILE 8 CO 0.34 0.09 0.26 0.29 0.00 0.00 0.00 174.94 175.92 1j8d n LYS 9 N 4.29 0.46 -3.63 2.79 5.02 0.26 -4.94 118.16 122.41 1j8d n LYS 9 Ca 0.08 -0.26 -0.09 0.00 -2.02 0.00 0.00 58.31 56.02 1j8d n LYS 9 Cb 0.48 -0.73 -0.10 0.00 -0.02 0.00 0.00 35.03 34.66 1j8d n LYS 9 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1j8d s PHE 10 N -0.14 -0.76 -0.17 2.13 5.36 -0.28 -2.11 117.98 122.02 1j8d s PHE 10 Ca 0.00 1.40 -0.06 0.00 -0.96 0.00 0.00 56.93 57.31 1j8d s PHE 10 Cb 0.00 0.24 -0.03 0.00 -0.34 0.00 0.00 43.02 42.88 1j8d s PHE 10 CO 0.00 -0.49 0.02 0.08 -1.46 0.00 0.00 175.22 173.37 1j8d s VAL 11 N 2.59 4.40 -0.16 3.12 1.01 0.60 -0.20 120.40 131.75 1j8d s VAL 11 Ca 0.00 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.82 1j8d s VAL 11 Cb -0.12 -2.96 0.02 0.00 0.00 0.00 0.00 36.38 33.31 1j8d s VAL 11 CO -0.13 0.47 -0.19 -0.63 0.00 0.00 0.00 175.10 174.62 1j8d s ILE 12 N 0.41 1.93 -0.02 2.22 1.01 0.53 -0.06 121.20 127.23 1j8d s ILE 12 Ca 0.00 -0.87 0.08 0.00 0.00 0.00 0.00 60.65 59.86 1j8d s ILE 12 Cb -0.13 -1.74 -0.02 0.00 0.01 0.00 0.00 42.46 40.58 1j8d s ILE 12 CO 0.01 0.52 -0.26 0.28 0.00 0.00 0.00 174.94 175.50 1j8d s THR 13 N 1.18 2.02 1.19 2.92 -1.32 -0.38 -1.60 115.64 119.64 1j8d s THR 13 Ca 0.01 -1.11 -0.19 0.00 -1.21 0.00 0.00 61.69 59.19 1j8d s THR 13 Cb -0.14 -1.68 0.28 0.00 -1.51 0.00 0.00 72.50 69.45 1j8d s THR 13 CO -0.09 0.55 1.12 -0.62 -2.21 0.00 0.00 174.62 173.38 1j8d s ASP 14 N -0.64 1.07 0.01 8.08 2.15 -0.37 -1.59 116.67 125.38 1j8d s ASP 14 Ca 0.10 0.62 -0.02 0.00 0.43 0.00 0.00 52.55 53.68 1j8d s ASP 14 Cb -0.10 -0.86 -0.01 0.00 -0.30 0.00 0.00 42.92 41.65 1j8d s ASP 14 CO -0.01 -4.03 -0.05 0.52 -0.17 0.00 0.00 175.17 171.44 1j8d n VAL 15 N -4.69 0.56 -2.21 1.11 0.31 -1.26 -4.18 118.33 107.97 1j8d n VAL 15 Ca 0.13 0.23 -0.43 0.00 -0.01 0.00 0.00 64.34 64.26 1j8d n VAL 15 Cb 0.59 -1.44 -0.02 0.00 -0.91 0.00 0.00 33.84 32.06 1j8d n VAL 15 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1j8d s ASP 16 N -5.24 6.56 0.00 4.52 1.01 -1.26 -1.09 116.67 121.17 1j8d s ASP 16 Ca -0.04 1.61 0.00 0.00 0.71 0.00 0.00 52.55 54.83 1j8d s ASP 16 Cb 0.01 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.40 1j8d s ASP 16 CO 0.06 -1.11 0.00 0.61 0.21 0.00 0.00 175.17 174.94 1j8d n GLY 17 N 4.37 2.12 0.68 0.21 0.00 -0.92 -4.78 105.19 106.88 1j8d n GLY 17 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 1j8d n GLY 17 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1j8d n VAL 18 N -1.93 0.45 0.67 1.61 0.31 -0.70 -3.94 118.33 114.80 1j8d n VAL 18 Ca 0.00 0.22 0.12 0.00 -0.01 0.00 0.00 64.34 64.67 1j8d n VAL 18 Cb 0.00 -1.40 0.47 0.00 -0.91 0.00 0.00 33.84 32.00 1j8d n VAL 18 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1j8d n LEU 19 N -2.95 0.37 -4.35 7.52 4.77 -0.25 0.38 117.00 122.49 1j8d n LEU 19 Ca -0.02 0.56 -0.21 0.00 -0.03 0.00 0.00 56.01 56.31 1j8d n LEU 19 Cb 0.06 -0.46 -0.11 0.00 -2.33 0.00 0.00 43.42 40.58 1j8d n LEU 19 CO 0.02 -0.21 -0.47 -0.89 -1.33 0.00 0.00 177.39 174.51 1j8d s THR 20 N -3.09 1.84 -1.95 -5.08 2.01 -0.86 -3.72 115.64 104.80 1j8d s THR 20 Ca 0.10 -2.05 0.03 0.00 0.31 0.00 0.00 61.69 60.08 1j8d s THR 20 Cb 0.13 -1.94 0.10 0.00 0.01 0.00 0.00 72.50 70.80 1j8d s THR 20 CO 0.47 -0.41 1.06 -0.90 -0.69 0.00 0.00 174.62 174.15 1j8d n ASP 21 N -0.00 0.65 0.00 3.53 5.75 -1.23 -2.17 116.55 123.09 1j8d n ASP 21 Ca -0.11 -2.01 0.00 0.00 -0.01 0.00 0.00 54.79 52.67 1j8d n ASP 21 Cb 0.58 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 1j8d n ASP 21 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1j8d n GLY 22 N 0.65 1.09 3.73 6.12 0.00 -1.26 -4.72 105.19 110.81 1j8d n GLY 22 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1j8d n GLY 22 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1j8d s GLN 23 N -0.47 4.62 -0.31 1.61 -1.52 -1.26 -4.78 119.66 117.55 1j8d s GLN 23 Ca 0.00 1.59 -0.07 0.00 -1.95 0.00 0.00 55.36 54.92 1j8d s GLN 23 Cb 0.00 -3.34 0.02 0.00 -0.22 0.00 0.00 33.01 29.47 1j8d s GLN 23 CO 0.00 0.10 0.10 -0.51 -0.25 0.00 0.00 175.29 174.73 1j8d s LEU 24 N 0.02 4.02 -0.45 2.90 1.43 -1.26 -4.77 118.68 120.57 1j8d s LEU 24 Ca 0.49 -0.80 -0.22 0.00 -1.03 0.00 0.00 54.13 52.57 1j8d s LEU 24 Cb -0.26 -1.90 0.03 0.00 0.03 0.00 0.00 46.19 44.09 1j8d s LEU 24 CO 0.32 -0.23 0.70 -1.00 0.23 0.00 0.00 176.35 176.37 1j8d s HIS 25 N 1.49 3.03 0.07 0.29 3.76 -1.19 -5.03 115.29 117.72 1j8d s HIS 25 Ca 0.02 0.02 -0.00 0.00 -0.15 0.00 0.00 55.06 54.95 1j8d s HIS 25 Cb -0.18 -3.48 -0.04 0.00 1.11 0.00 0.00 32.58 29.99 1j8d s HIS 25 CO 0.03 -0.93 0.23 0.71 -0.85 0.00 0.00 174.74 173.94 1j8d s TYR 26 N 3.02 3.51 0.42 1.40 1.51 -1.26 0.32 117.35 126.27 1j8d s TYR 26 Ca 0.25 0.28 0.04 0.00 -1.01 0.00 0.00 57.07 56.64 1j8d s TYR 26 Cb -0.13 -1.79 -0.02 0.00 -0.11 0.00 0.00 41.96 39.91 1j8d s TYR 26 CO 0.20 0.57 0.14 0.16 -1.11 0.00 0.00 175.55 175.51 1j8d s ASP 27 N -2.53 2.86 0.65 2.29 3.84 -0.31 -4.81 116.67 118.66 1j8d s ASP 27 Ca 0.36 -1.72 0.20 0.00 -0.00 0.00 0.00 52.55 51.39 1j8d s ASP 27 Cb -0.13 0.57 1.09 0.00 -1.38 0.00 0.00 42.92 43.07 1j8d s ASP 27 CO 0.28 -0.97 1.60 0.00 -0.00 0.00 0.00 175.17 176.08 1j8d h ALA 28 N 1.74 1.53 -0.43 2.11 0.00 -2.01 -1.58 119.26 120.63 1j8d h ALA 28 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1j8d h ALA 28 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1j8d h ALA 28 CO 0.55 -0.53 0.00 0.09 0.00 0.00 0.00 179.25 179.35 1j8d n ASN 29 N -2.73 4.78 0.00 0.00 5.03 -1.26 -5.07 115.26 116.02 1j8d n ASN 29 Ca -0.01 -2.93 0.00 0.00 0.87 0.00 0.00 54.58 52.51 1j8d n ASN 29 Cb 0.57 -0.61 0.00 0.00 -1.02 0.00 0.00 39.78 38.72 1j8d n ASN 29 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1j8d n GLY 30 N 0.12 -0.10 3.61 7.41 0.00 -0.60 -4.90 105.19 110.73 1j8d n GLY 30 Ca 0.24 -1.80 -0.44 0.00 0.00 0.00 0.00 46.02 44.02 1j8d n GLY 30 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1j8d n GLU 31 N 0.00 2.11 -0.10 1.61 1.02 -1.26 -1.17 120.64 122.85 1j8d n GLU 31 Ca 0.00 0.66 -0.13 0.00 -0.02 0.00 0.00 57.16 57.67 1j8d n GLU 31 Cb 0.00 -3.04 -0.10 0.00 -0.02 0.00 0.00 31.44 28.29 1j8d n GLU 31 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1j8d n ALA 32 N 9.98 1.57 -2.95 0.62 0.00 0.15 -4.89 120.51 124.99 1j8d n ALA 32 Ca 0.28 -0.89 -0.10 0.00 0.00 0.00 0.00 53.44 52.73 1j8d n ALA 32 Cb 0.40 0.01 -0.11 0.00 0.00 0.00 0.00 19.45 19.75 1j8d n ALA 32 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1j8d s ILE 33 N -2.40 0.21 -0.04 0.00 1.01 -1.10 -5.05 121.20 113.83 1j8d s ILE 33 Ca -0.24 -0.90 0.01 0.00 0.00 0.00 0.00 60.65 59.52 1j8d s ILE 33 Cb 0.07 -0.33 0.02 0.00 0.01 0.00 0.00 42.46 42.23 1j8d s ILE 33 CO 0.50 -0.44 -0.03 -0.54 0.00 0.00 0.00 174.94 174.42 1j8d s LYS 34 N -1.41 0.70 -0.32 2.79 1.02 -1.26 -3.19 119.74 118.07 1j8d s LYS 34 Ca -0.14 -0.05 -0.14 0.00 0.02 0.00 0.00 55.97 55.66 1j8d s LYS 34 Cb -0.09 -0.78 -0.02 0.00 -0.52 0.00 0.00 37.83 36.41 1j8d s LYS 34 CO -0.01 -0.11 0.31 -1.12 -0.92 0.00 0.00 175.35 173.50 1j8d s SER 35 N 1.03 6.13 0.45 2.83 0.01 -1.26 -5.06 113.70 117.83 1j8d s SER 35 Ca -0.09 -0.19 0.08 0.00 1.31 0.00 0.00 55.95 57.05 1j8d s SER 35 Cb -0.14 -2.17 -0.00 0.00 0.21 0.00 0.00 66.02 63.92 1j8d s SER 35 CO -0.01 -0.25 0.43 -0.36 0.41 0.00 0.00 173.24 173.46 1j8d s PHE 36 N 1.91 2.48 -0.12 2.43 0.40 -1.26 -4.28 117.98 119.55 1j8d s PHE 36 Ca 0.10 -0.55 -0.00 0.00 -0.60 0.00 0.00 56.93 55.88 1j8d s PHE 36 Cb -0.17 -2.16 -0.02 0.00 0.51 0.00 0.00 43.02 41.18 1j8d s PHE 36 CO 0.11 -0.27 -0.11 -1.58 0.70 0.00 0.00 175.22 174.07 1j8d s HIS 37 N -2.52 2.84 0.45 0.36 2.46 -1.24 -5.01 115.29 112.63 1j8d s HIS 37 Ca 0.48 -0.44 0.13 0.00 0.47 0.00 0.00 55.06 55.70 1j8d s HIS 37 Cb -0.04 -1.82 1.06 0.00 -0.13 0.00 0.00 32.58 31.65 1j8d s HIS 37 CO 0.28 -0.06 2.03 -0.24 -2.47 0.00 0.00 174.74 174.28 1j8d h VAL 38 N 5.08 0.95 -0.07 0.89 3.04 -1.97 -2.17 116.25 122.00 1j8d h VAL 38 Ca -0.32 -0.12 -0.16 0.00 -1.01 0.00 0.00 66.70 65.09 1j8d h VAL 38 Cb 1.20 0.57 -0.01 0.00 -2.01 0.00 0.00 31.29 31.04 1j8d h VAL 38 CO 0.56 0.06 -0.65 0.03 -1.01 0.00 0.00 177.57 176.56 1j8d h ARG 39 N 0.35 0.26 -0.45 4.17 3.08 -1.96 -2.99 114.38 116.85 1j8d h ARG 39 Ca 0.20 -0.20 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1j8d h ARG 39 Cb 0.35 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1j8d h ARG 39 CO -0.05 0.82 0.28 -0.44 -1.07 0.00 0.00 179.97 179.51 1j8d h ASP 40 N 0.19 0.54 -0.73 7.04 3.45 -1.72 -2.02 116.42 123.18 1j8d h ASP 40 Ca -0.01 -0.05 0.02 0.00 0.43 0.00 0.00 57.03 57.42 1j8d h ASP 40 Cb 1.18 -0.14 -0.04 0.00 -0.56 0.00 0.00 39.33 39.77 1j8d h ASP 40 CO 0.10 0.43 0.47 1.23 -1.57 0.00 0.00 179.24 179.90 1j8d h GLY 41 N 0.60 1.04 1.31 2.75 0.00 -1.37 0.63 103.07 108.02 1j8d h GLY 41 Ca 0.16 -0.36 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 1j8d h GLY 41 CO -0.03 0.32 0.40 -2.00 0.00 0.00 0.00 176.54 175.23 1j8d h LEU 42 N 0.92 0.81 -0.68 3.11 6.46 -1.38 -1.25 115.31 123.31 1j8d h LEU 42 Ca 0.28 -0.05 -0.12 0.00 -0.12 0.00 0.00 57.88 57.87 1j8d h LEU 42 Cb -0.03 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 39.68 1j8d h LEU 42 CO -0.09 0.63 -0.28 1.23 -0.62 0.00 0.00 178.44 179.31 1j8d h GLY 43 N 0.97 0.78 0.97 3.75 0.00 -0.45 -2.93 103.07 106.17 1j8d h GLY 43 Ca 0.24 -0.70 -0.02 0.00 0.00 0.00 0.00 47.33 46.85 1j8d h GLY 43 CO -0.05 0.64 0.21 -2.22 0.00 0.00 0.00 176.54 175.12 1j8d h ILE 44 N 0.62 1.20 0.00 2.60 2.04 -0.00 -1.64 117.51 122.33 1j8d h ILE 44 Ca 0.08 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.32 1j8d h ILE 44 Cb 0.79 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1j8d h ILE 44 CO 0.07 0.23 0.00 0.29 0.00 0.00 0.00 178.15 178.74 1j8d n LYS 45 N -4.59 0.27 -0.19 2.37 4.76 -0.56 -4.62 118.16 115.60 1j8d n LYS 45 Ca 0.02 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 1j8d n LYS 45 Cb 0.14 -1.29 0.00 0.00 -1.84 0.00 0.00 35.03 32.04 1j8d n LYS 45 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1j8d n LEU 47 N 0.71 0.00 0.00 -0.35 4.77 -0.62 -4.45 117.00 117.06 1j8d n LEU 47 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1j8d n LEU 47 Cb 0.12 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1j8d n LEU 47 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.39 175.39 1j8d n ASP 49 N 0.47 0.00 -2.15 -1.43 -0.08 -1.26 -2.36 116.55 109.74 1j8d n ASP 49 Ca 0.00 0.00 -0.27 0.00 -1.51 0.00 0.00 54.79 53.01 1j8d n ASP 49 Cb 0.00 0.00 0.13 0.00 2.34 0.00 0.00 41.12 43.59 1j8d n ASP 49 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1j8d n ALA 50 N 0.00 5.75 -3.54 -1.67 0.00 -1.26 -4.93 120.51 114.86 1j8d n ALA 50 Ca 0.00 -3.23 -0.22 0.00 0.00 0.00 0.00 53.44 49.99 1j8d n ALA 50 Cb 0.00 -1.44 0.03 0.00 0.00 0.00 0.00 19.45 18.03 1j8d n ALA 50 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1j8d n ASP 51 N -1.02 -5.89 -3.27 0.00 9.92 -1.10 -4.99 116.55 110.19 1j8d n ASP 51 Ca 0.57 -0.77 -0.06 0.00 -0.53 0.00 0.00 54.79 54.00 1j8d n ASP 51 Cb 1.14 -3.56 -0.05 0.00 -0.64 0.00 0.00 41.12 38.01 1j8d n ASP 51 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1j8d s ILE 52 N -3.25 -0.71 0.68 0.53 1.01 -1.00 -4.87 121.20 113.59 1j8d s ILE 52 Ca 0.27 -0.24 -0.17 0.00 0.00 0.00 0.00 60.65 60.51 1j8d s ILE 52 Cb -0.09 -0.99 0.01 0.00 0.01 0.00 0.00 42.46 41.40 1j8d s ILE 52 CO 0.84 -0.23 1.22 -1.10 0.00 0.00 0.00 174.94 175.67 1j8d s GLN 53 N 2.59 2.47 -0.06 2.79 -0.21 -0.89 -4.78 119.66 121.56 1j8d s GLN 53 Ca 0.10 1.82 0.00 0.00 0.02 0.00 0.00 55.36 57.30 1j8d s GLN 53 Cb -0.12 -1.87 0.02 0.00 1.00 0.00 0.00 33.01 32.05 1j8d s GLN 53 CO -0.29 -1.60 -0.04 0.08 -2.12 0.00 0.00 175.29 171.32 1j8d s VAL 54 N -1.78 0.57 0.12 1.09 1.01 -1.26 -0.29 120.40 119.86 1j8d s VAL 54 Ca 0.76 -0.09 0.06 0.00 0.00 0.00 0.00 61.98 62.71 1j8d s VAL 54 Cb -0.31 -0.62 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 1j8d s VAL 54 CO 0.41 0.25 -0.15 0.00 0.00 0.00 0.00 175.10 175.61 1j8d s ALA 55 N 1.24 1.55 -0.07 5.51 0.00 0.92 -4.38 121.76 126.53 1j8d s ALA 55 Ca -0.06 -1.29 0.03 0.00 0.00 0.00 0.00 51.96 50.64 1j8d s ALA 55 Cb -0.14 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 1j8d s ALA 55 CO -0.02 0.13 -0.15 0.14 0.00 0.00 0.00 175.76 175.87 1j8d s VAL 56 N -2.02 2.97 -0.24 0.00 -7.23 -1.17 -1.25 120.40 111.46 1j8d s VAL 56 Ca 0.09 -0.74 0.01 0.00 -1.81 0.00 0.00 61.98 59.53 1j8d s VAL 56 Cb -0.06 -2.18 0.04 0.00 0.56 0.00 0.00 36.38 34.75 1j8d s VAL 56 CO 0.03 0.57 -0.11 -0.22 -0.31 0.00 0.00 175.10 175.06 1j8d s LEU 57 N -0.40 3.10 -0.07 1.32 0.20 -0.62 -1.59 118.68 120.62 1j8d s LEU 57 Ca 0.04 -1.10 0.03 0.00 0.69 0.00 0.00 54.13 53.79 1j8d s LEU 57 Cb -0.12 -1.57 0.01 0.00 -0.43 0.00 0.00 46.19 44.08 1j8d s LEU 57 CO 0.02 -0.13 -0.14 -0.55 -0.29 0.00 0.00 176.35 175.26 1j8d s SER 58 N 1.20 1.95 0.00 3.68 0.15 -0.49 -3.88 113.70 116.31 1j8d s SER 58 Ca -0.03 -0.33 0.00 0.00 0.70 0.00 0.00 55.95 56.28 1j8d s SER 58 Cb -0.18 -0.90 0.00 0.00 -1.71 0.00 0.00 66.02 63.24 1j8d s SER 58 CO -0.07 0.05 0.37 0.61 1.20 0.00 0.00 173.24 175.41 1j8d n GLY 59 N 3.76 0.46 3.43 9.45 0.00 -1.26 -1.80 105.19 119.24 1j8d n GLY 59 Ca -0.22 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.69 1j8d n GLY 59 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1j8d s ARG 60 N -1.28 1.48 -0.10 1.61 3.52 -1.26 -4.51 118.95 118.40 1j8d s ARG 60 Ca 0.00 -1.47 -0.16 0.00 -0.13 0.00 0.00 55.73 53.97 1j8d s ARG 60 Cb 0.00 0.39 0.04 0.00 -1.56 0.00 0.00 34.95 33.82 1j8d s ARG 60 CO 0.00 -0.57 0.40 0.34 -0.81 0.00 0.00 175.30 174.66 1j8d s ASP 61 N -3.11 -0.37 -0.13 -2.12 -1.08 -1.26 -0.98 116.67 107.61 1j8d s ASP 61 Ca 0.30 0.59 -0.30 0.00 -0.52 0.00 0.00 52.55 52.62 1j8d s ASP 61 Cb 0.02 0.65 0.11 0.00 -1.46 0.00 0.00 42.92 42.24 1j8d s ASP 61 CO 0.12 -0.28 0.88 -0.94 0.52 0.00 0.00 175.17 175.47 1j8d s SER 62 N -0.39 -0.48 0.54 -0.34 1.04 -1.26 -4.95 113.70 107.85 1j8d s SER 62 Ca -0.05 0.57 0.25 0.00 0.48 0.00 0.00 55.95 57.20 1j8d s SER 62 Cb -0.03 0.46 1.43 0.00 0.10 0.00 0.00 66.02 67.97 1j8d s SER 62 CO 0.03 -0.42 2.03 1.55 0.98 0.00 0.00 173.24 177.41 1j8d h PRO 63 N 2.89 0.00 0.20 4.02 0.13 -1.98 -0.60 132.00 136.66 1j8d h PRO 63 Ca -0.22 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.90 1j8d h PRO 63 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1j8d h PRO 63 CO 0.32 0.00 -0.10 0.82 -0.23 0.00 0.00 178.00 178.81 1j8d h ILE 64 N 0.00 0.88 -0.94 -3.56 2.04 -1.96 0.11 117.51 114.07 1j8d h ILE 64 Ca 0.19 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1j8d h ILE 64 Cb 0.79 1.13 -0.05 0.00 -0.74 0.00 0.00 36.82 37.96 1j8d h ILE 64 CO -0.00 0.10 0.59 0.25 0.00 0.00 0.00 178.15 179.09 1j8d h LEU 65 N -0.48 1.11 -0.64 1.44 5.85 -1.62 -1.63 115.31 119.34 1j8d h LEU 65 Ca -0.03 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1j8d h LEU 65 Cb 0.37 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1j8d h LEU 65 CO 0.05 0.83 0.36 0.03 -0.34 0.00 0.00 178.44 179.37 1j8d h ARG 66 N 1.29 0.88 -0.31 1.25 3.08 -0.92 0.12 114.38 119.77 1j8d h ARG 66 Ca 0.34 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1j8d h ARG 66 Cb -0.09 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 29.76 1j8d h ARG 66 CO -0.07 0.66 0.19 -0.09 -1.07 0.00 0.00 179.97 179.59 1j8d h ARG 67 N 0.87 0.41 -0.51 0.04 9.65 -0.31 -0.29 114.38 124.25 1j8d h ARG 67 Ca 0.23 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 59.08 1j8d h ARG 67 Cb 0.02 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.49 1j8d h ARG 67 CO -0.04 0.30 0.34 -0.09 2.80 0.00 0.00 179.97 183.28 1j8d h ARG 68 N 0.40 0.67 -0.93 0.20 9.65 -0.95 0.17 114.38 123.60 1j8d h ARG 68 Ca 0.11 -0.04 0.08 0.00 -1.10 0.00 0.00 59.98 59.03 1j8d h ARG 68 Cb -0.01 -0.15 -0.07 0.00 -1.39 0.00 0.00 29.97 28.35 1j8d h ARG 68 CO -0.02 0.44 0.58 0.82 2.80 0.00 0.00 179.97 184.59 1j8d h ILE 69 N 0.69 1.00 -0.14 1.20 2.04 -0.53 -1.48 117.51 120.29 1j8d h ILE 69 Ca 0.19 -0.34 -0.17 0.00 1.00 0.00 0.00 64.86 65.54 1j8d h ILE 69 Cb -0.08 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 35.91 1j8d h ILE 69 CO -0.04 0.18 -0.62 0.00 0.00 0.00 0.00 178.15 177.67 1j8d h ALA 70 N 1.46 0.66 -0.65 1.87 0.00 0.16 -0.45 119.26 122.31 1j8d h ALA 70 Ca 0.43 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1j8d h ALA 70 Cb 0.29 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1j8d h ALA 70 CO -0.21 0.71 0.27 -0.44 0.00 0.00 0.00 179.25 179.58 1j8d h ASP 71 N 0.37 0.85 0.93 0.00 5.19 0.14 -2.33 116.42 121.58 1j8d h ASP 71 Ca -0.01 -0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.29 1j8d h ASP 71 Cb 1.17 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 40.46 1j8d h ASP 71 CO 0.11 0.76 -0.21 0.18 -3.12 0.00 0.00 179.24 176.96 1j8d n LEU 72 N -4.32 0.35 -0.47 1.55 4.77 -0.64 -4.21 117.00 114.04 1j8d n LEU 72 Ca 0.06 0.35 -0.05 0.00 -0.03 0.00 0.00 56.01 56.33 1j8d n LEU 72 Cb 0.16 -0.37 -0.02 0.00 -2.33 0.00 0.00 43.42 40.87 1j8d n LEU 72 CO 0.39 -0.01 -0.06 0.61 -1.33 0.00 0.00 177.39 177.00 1j8d n GLY 73 N 1.45 0.59 3.71 -0.72 0.00 -0.62 -4.87 105.19 104.73 1j8d n GLY 73 Ca 0.06 -0.77 -0.42 0.00 0.00 0.00 0.00 46.02 44.88 1j8d n GLY 73 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j8d s ILE 74 N -2.22 3.80 -0.22 -0.61 1.01 -0.27 -4.92 121.20 117.77 1j8d s ILE 74 Ca 0.00 1.28 0.04 0.00 0.00 0.00 0.00 60.65 61.97 1j8d s ILE 74 Cb 0.00 -3.82 -0.20 0.00 0.01 0.00 0.00 42.46 38.45 1j8d s ILE 74 CO 0.00 0.09 -0.06 0.29 0.00 0.00 0.00 174.94 175.26 1j8d n LYS 75 N 4.09 0.67 -3.58 2.79 4.76 -1.26 -4.71 118.16 120.92 1j8d n LYS 75 Ca 0.10 0.14 -0.36 0.00 -2.87 0.00 0.00 58.31 55.32 1j8d n LYS 75 Cb 0.45 -1.56 -0.07 0.00 -1.84 0.00 0.00 35.03 32.01 1j8d n LYS 75 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1j8d s LEU 76 N -6.37 4.24 -0.16 -0.35 1.02 -1.26 -5.07 118.68 110.73 1j8d s LEU 76 Ca -0.27 0.45 -0.31 0.00 0.02 0.00 0.00 54.13 54.02 1j8d s LEU 76 Cb 0.08 -2.31 0.14 0.00 0.02 0.00 0.00 46.19 44.12 1j8d s LEU 76 CO 0.68 0.12 1.09 0.72 0.02 0.00 0.00 176.35 178.97 1j8d s PHE 77 N 0.41 -0.25 -0.10 0.29 -0.12 -1.26 -3.05 117.98 113.90 1j8d s PHE 77 Ca 0.15 0.33 -0.02 0.00 -0.05 0.00 0.00 56.93 57.34 1j8d s PHE 77 Cb -0.13 0.49 0.04 0.00 -0.63 0.00 0.00 43.02 42.79 1j8d s PHE 77 CO 0.03 -0.29 0.01 -0.06 -0.05 0.00 0.00 175.22 174.85 1j8d s PHE 78 N -1.75 0.78 0.31 3.49 0.08 -0.62 -4.97 117.98 115.30 1j8d s PHE 78 Ca 0.04 -0.35 0.10 0.00 0.12 0.00 0.00 56.93 56.84 1j8d s PHE 78 Cb -0.01 -0.87 -0.05 0.00 -0.57 0.00 0.00 43.02 41.52 1j8d s PHE 78 CO -0.03 -0.40 -0.07 -0.51 -0.10 0.00 0.00 175.22 174.11 1j8d s LEU 79 N 1.94 2.87 0.00 -0.37 1.43 -1.26 -1.39 118.68 121.89 1j8d s LEU 79 Ca 0.04 -0.98 0.00 0.00 -1.03 0.00 0.00 54.13 52.16 1j8d s LEU 79 Cb -0.13 -1.28 0.00 0.00 0.03 0.00 0.00 46.19 44.80 1j8d s LEU 79 CO -0.06 -0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.02 1j8d n GLY 80 N -0.82 1.62 3.47 -3.19 0.00 -0.15 -4.88 105.19 101.23 1j8d n GLY 80 Ca -0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 1j8d n GLY 80 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1j8d s LYS 81 N -0.08 3.27 0.00 1.61 2.20 -1.23 -4.69 119.74 120.82 1j8d s LYS 81 Ca 0.00 -0.79 0.30 0.00 -0.36 0.00 0.00 55.97 55.13 1j8d s LYS 81 Cb 0.00 -3.73 1.62 0.00 -1.51 0.00 0.00 37.83 34.21 1j8d s LYS 81 CO 0.00 -0.51 2.09 1.28 -0.36 0.00 0.00 175.35 177.85 1j8d n LEU 82 N 5.05 0.00 -4.52 5.43 4.77 -1.26 -4.07 117.00 122.40 1j8d n LEU 82 Ca -0.13 0.19 -0.38 0.00 -0.03 0.00 0.00 56.01 55.66 1j8d n LEU 82 Cb 0.49 -0.19 -0.11 0.00 -2.33 0.00 0.00 43.42 41.27 1j8d n LEU 82 CO 0.36 -0.00 -0.19 -0.70 -1.33 0.00 0.00 177.39 175.53 1j8d s GLU 83 N -2.39 3.67 -0.01 3.23 -6.30 -1.26 -4.97 118.70 110.67 1j8d s GLU 83 Ca 0.34 -0.50 0.19 0.00 -2.50 0.00 0.00 54.97 52.50 1j8d s GLU 83 Cb 0.21 -3.62 -0.24 0.00 0.00 0.00 0.00 34.13 30.48 1j8d s GLU 83 CO 0.43 -0.29 0.62 1.63 0.02 0.00 0.00 175.26 177.67 1j8d n LYS 84 N 5.03 0.79 0.36 4.30 5.02 -1.26 -4.34 118.16 128.06 1j8d n LYS 84 Ca -0.14 -0.07 -0.14 0.00 -2.02 0.00 0.00 58.31 55.94 1j8d n LYS 84 Cb 0.51 -1.40 -0.07 0.00 -0.02 0.00 0.00 35.03 34.05 1j8d n LYS 84 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1j8d h GLU 85 N 0.00 -0.87 0.00 1.97 4.81 -1.94 -1.96 114.58 116.58 1j8d h GLU 85 Ca 0.00 0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1j8d h GLU 85 Cb 0.61 0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 1j8d h GLU 85 CO 0.00 -0.58 -0.17 1.79 -0.73 0.00 0.00 179.01 179.32 1j8d h THR 86 N -0.93 0.64 -0.23 0.32 1.35 -1.94 -2.13 112.91 109.99 1j8d h THR 86 Ca -0.09 -0.75 -0.08 0.00 -0.55 0.00 0.00 66.41 64.93 1j8d h THR 86 Cb 0.69 1.48 -0.01 0.00 -1.73 0.00 0.00 68.15 68.58 1j8d h THR 86 CO 0.15 0.17 -0.22 0.00 -0.25 0.00 0.00 175.52 175.37 1j8d h ALA 87 N 1.83 1.20 0.18 6.62 0.00 -1.73 -1.17 119.26 126.19 1j8d h ALA 87 Ca -0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1j8d h ALA 87 Cb 0.46 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1j8d h ALA 87 CO 0.02 0.52 -0.09 0.00 0.00 0.00 0.00 179.25 179.70 1j8d h PHE 89 N -0.75 1.14 -0.19 0.00 0.04 -1.52 0.33 116.94 116.00 1j8d h PHE 89 Ca -0.03 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.76 1j8d h PHE 89 Cb 0.51 -0.36 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 1j8d h PHE 89 CO 0.06 0.45 0.03 -0.44 -0.60 0.00 0.00 178.31 177.81 1j8d h ASP 90 N 0.99 0.23 0.00 2.17 3.45 -1.11 0.42 116.42 122.57 1j8d h ASP 90 Ca 0.50 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.94 1j8d h ASP 90 Cb 0.50 -0.06 0.00 0.00 -0.56 0.00 0.00 39.33 39.21 1j8d h ASP 90 CO -0.27 0.26 0.00 0.18 -1.57 0.00 0.00 179.24 177.84 1j8d n LEU 91 N -4.41 2.21 0.00 1.55 4.77 0.11 -2.73 117.00 118.51 1j8d n LEU 91 Ca -0.00 -1.11 0.00 0.00 -0.03 0.00 0.00 56.01 54.87 1j8d n LEU 91 Cb 0.15 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 1j8d n LEU 91 CO 0.36 0.39 0.00 0.29 -1.33 0.00 0.00 177.39 177.10 1j8d n LYS 93 N 0.44 0.00 0.27 3.23 5.02 0.15 -1.01 118.16 126.26 1j8d n LYS 93 Ca 0.00 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.40 1j8d n LYS 93 Cb 0.39 0.00 0.74 0.00 -0.02 0.00 0.00 35.03 36.14 1j8d n LYS 93 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1j8d h GLN 94 N 0.00 0.00 -0.00 1.97 4.20 -1.74 -2.16 115.11 117.38 1j8d h GLN 94 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1j8d h GLN 94 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1j8d h GLN 94 CO 0.00 0.04 -0.62 0.00 -0.67 0.00 0.00 178.83 177.58 1j8d n ALA 95 N -2.42 3.88 -3.27 3.87 0.00 -0.18 -4.96 120.51 117.44 1j8d n ALA 95 Ca -0.03 -0.51 -0.17 0.00 0.00 0.00 0.00 53.44 52.74 1j8d n ALA 95 Cb 0.12 -0.94 0.06 0.00 0.00 0.00 0.00 19.45 18.70 1j8d n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j8d n GLY 96 N 1.45 -0.13 3.23 0.00 0.00 -0.81 -5.02 105.19 103.91 1j8d n GLY 96 Ca 0.07 -0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 1j8d n GLY 96 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j8d s VAL 97 N -3.23 1.17 0.67 1.61 -7.23 -1.26 -5.06 120.40 107.07 1j8d s VAL 97 Ca 0.38 -1.81 0.04 0.00 -1.81 0.00 0.00 61.98 58.79 1j8d s VAL 97 Cb -0.17 -1.58 0.12 0.00 0.56 0.00 0.00 36.38 35.31 1j8d s VAL 97 CO 0.53 -0.57 0.93 0.42 -0.31 0.00 0.00 175.10 176.10 1j8d s THR 98 N -2.62 2.05 0.09 5.32 -4.23 -1.26 -4.40 115.64 110.59 1j8d s THR 98 Ca 0.10 -0.79 -0.25 0.00 -1.18 0.00 0.00 61.69 59.58 1j8d s THR 98 Cb -0.02 -2.26 -0.16 0.00 1.34 0.00 0.00 72.50 71.41 1j8d s THR 98 CO 0.01 0.00 1.72 0.00 -0.54 0.00 0.00 174.62 175.81 1j8d h ALA 99 N -0.27 -0.16 0.00 3.99 0.00 -1.88 -1.44 119.26 119.51 1j8d h ALA 99 Ca -0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1j8d h ALA 99 Cb 1.27 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1j8d h ALA 99 CO 0.39 -0.59 0.00 0.39 0.00 0.00 0.00 179.25 179.44 1j8d n GLU 100 N -5.16 0.00 -0.01 0.00 1.02 -1.26 -0.72 120.64 114.52 1j8d n GLU 100 Ca -0.08 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.07 1j8d n GLU 100 Cb 0.09 -1.45 0.02 0.00 -0.02 0.00 0.00 31.44 30.07 1j8d n GLU 100 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1j8d n GLN 101 N -0.93 -0.05 -5.08 3.49 6.02 -0.55 -4.60 117.38 115.67 1j8d n GLN 101 Ca 0.00 -0.82 -0.32 0.00 -0.01 0.00 0.00 57.00 55.85 1j8d n GLN 101 Cb 0.00 -1.06 -0.16 0.00 1.02 0.00 0.00 30.24 30.04 1j8d n GLN 101 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1j8d s THR 102 N -0.35 2.38 0.13 5.09 -4.23 0.11 0.89 115.64 119.66 1j8d s THR 102 Ca 0.04 -0.91 0.03 0.00 -1.18 0.00 0.00 61.69 59.68 1j8d s THR 102 Cb 0.02 -1.94 -0.04 0.00 1.34 0.00 0.00 72.50 71.89 1j8d s THR 102 CO 0.04 0.55 0.17 0.00 -0.54 0.00 0.00 174.62 174.84 1j8d s ALA 103 N 0.32 3.72 -0.01 3.99 0.00 0.72 -3.82 121.76 126.67 1j8d s ALA 103 Ca -0.16 -1.09 0.01 0.00 0.00 0.00 0.00 51.96 50.72 1j8d s ALA 103 Cb -0.17 -1.53 0.01 0.00 0.00 0.00 0.00 23.12 21.43 1j8d s ALA 103 CO 0.08 0.59 -0.02 -0.47 0.00 0.00 0.00 175.76 175.94 1j8d s TYR 104 N -1.65 0.30 -0.14 0.00 5.04 0.15 -0.35 117.35 120.70 1j8d s TYR 104 Ca 0.32 -0.04 0.02 0.00 -2.44 0.00 0.00 57.07 54.94 1j8d s TYR 104 Cb -0.11 -0.28 0.01 0.00 0.35 0.00 0.00 41.96 41.93 1j8d s TYR 104 CO 0.25 -0.06 -0.21 -1.50 -1.34 0.00 0.00 175.55 172.69 1j8d s ILE 105 N 0.36 1.98 0.28 3.14 2.07 -0.63 0.15 121.20 128.56 1j8d s ILE 105 Ca -0.03 -0.93 0.05 0.00 -1.41 0.00 0.00 60.65 58.32 1j8d s ILE 105 Cb -0.06 -1.76 -0.02 0.00 0.13 0.00 0.00 42.46 40.75 1j8d s ILE 105 CO -0.01 0.53 0.17 0.61 -1.91 0.00 0.00 174.94 174.34 1j8d n GLY 106 N 4.12 3.28 0.00 1.50 0.00 -0.32 -1.24 105.19 112.54 1j8d n GLY 106 Ca -0.20 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 43.88 1j8d n GLY 106 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1j8d n ASP 107 N -1.84 0.00 -4.13 1.61 5.68 -1.26 -2.12 116.55 114.49 1j8d n ASP 107 Ca 0.01 0.00 -0.27 0.00 -0.50 0.00 0.00 54.79 54.03 1j8d n ASP 107 Cb 0.47 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.37 1j8d n ASP 107 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1j8d s ASP 108 N -0.40 3.04 0.27 -1.12 -1.08 -1.26 -3.82 116.67 112.31 1j8d s ASP 108 Ca 0.00 -1.72 -0.01 0.00 -0.52 0.00 0.00 52.55 50.30 1j8d s ASP 108 Cb 0.00 0.60 0.59 0.00 -1.46 0.00 0.00 42.92 42.64 1j8d s ASP 108 CO 0.00 -0.97 1.69 0.28 0.52 0.00 0.00 175.17 176.68 1j8d h SER 109 N 1.68 0.13 -0.97 -0.34 0.02 -1.99 0.12 113.55 112.19 1j8d h SER 109 Ca -0.35 0.16 0.28 0.00 -0.84 0.00 0.00 61.79 61.03 1j8d h SER 109 Cb 1.28 0.18 -0.04 0.00 0.14 0.00 0.00 62.40 63.97 1j8d h SER 109 CO 0.57 -0.03 0.81 0.58 -1.14 0.00 0.00 176.83 177.62 1j8d h VAL 110 N 0.32 0.32 0.00 2.27 2.07 -1.96 0.81 116.25 120.08 1j8d h VAL 110 Ca 0.48 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.00 1j8d h VAL 110 Cb 0.88 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1j8d h VAL 110 CO -0.54 0.00 -0.56 0.47 0.02 0.00 0.00 177.57 176.96 1j8d n ASP 111 N -3.89 0.54 -0.28 0.57 8.00 0.40 -4.29 116.55 117.60 1j8d n ASP 111 Ca 0.21 -0.22 0.09 0.00 0.71 0.00 0.00 54.79 55.58 1j8d n ASP 111 Cb 1.14 0.29 0.24 0.00 -0.02 0.00 0.00 41.12 42.77 1j8d n ASP 111 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1j8d h LEU 112 N 0.00 0.10 -1.42 0.64 3.38 0.65 -0.17 115.31 118.50 1j8d h LEU 112 Ca 0.00 0.16 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 1j8d h LEU 112 Cb 0.55 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1j8d h LEU 112 CO 0.00 -0.05 -0.24 -0.65 0.09 0.00 0.00 178.44 177.59 1j8d h PRO 113 N 0.30 0.00 0.00 1.13 0.11 -1.75 -2.83 132.00 128.96 1j8d h PRO 113 Ca 0.49 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.48 1j8d h PRO 113 Cb 0.89 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.99 1j8d h PRO 113 CO -0.55 0.24 -0.55 0.00 -0.21 0.00 0.00 178.00 176.93 1j8d h ALA 114 N 1.76 0.76 -0.02 -0.75 0.00 -1.29 -1.58 119.26 118.14 1j8d h ALA 114 Ca -0.00 -0.50 -0.13 0.00 0.00 0.00 0.00 54.91 54.28 1j8d h ALA 114 Cb 0.60 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1j8d h ALA 114 CO 0.03 0.69 -0.59 0.74 0.00 0.00 0.00 179.25 180.12 1j8d h PHE 115 N 0.00 0.08 -0.12 0.00 0.05 -1.21 -0.31 116.94 115.44 1j8d h PHE 115 Ca -0.01 -0.03 -0.21 0.00 3.82 0.00 0.00 57.97 61.55 1j8d h PHE 115 Cb 1.25 -0.02 0.00 0.00 2.00 0.00 0.00 35.95 39.19 1j8d h PHE 115 CO 0.00 0.64 -0.76 0.00 -0.18 0.00 0.00 178.31 178.01 1j8d h ALA 116 N 1.35 0.43 -0.10 2.45 0.00 -1.35 -3.28 119.26 118.76 1j8d h ALA 116 Ca -0.01 -0.60 -0.20 0.00 0.00 0.00 0.00 54.91 54.11 1j8d h ALA 116 Cb 1.05 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.82 1j8d h ALA 116 CO 0.08 0.72 -0.71 0.00 0.00 0.00 0.00 179.25 179.34 1j8d h ALA 117 N 0.72 0.23 0.00 0.00 0.00 -0.91 -3.37 119.26 115.92 1j8d h ALA 117 Ca -0.04 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1j8d h ALA 117 Cb 1.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1j8d h ALA 117 CO 0.15 0.55 -0.07 0.00 0.00 0.00 0.00 179.25 179.88 1j8d n GLY 119 N 1.38 1.92 2.64 0.00 0.00 -1.24 -4.42 105.19 105.47 1j8d n GLY 119 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 1j8d n GLY 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j8d s THR 120 N -0.31 0.26 0.16 2.61 2.01 -1.25 -5.01 115.64 114.12 1j8d s THR 120 Ca 0.00 -0.77 0.10 0.00 0.31 0.00 0.00 61.69 61.33 1j8d s THR 120 Cb 0.00 -1.08 -0.04 0.00 0.01 0.00 0.00 72.50 71.39 1j8d s THR 120 CO 0.00 -0.54 -0.20 -0.94 -0.69 0.00 0.00 174.62 172.24 1j8d s SER 121 N 1.95 3.67 0.09 3.53 1.04 -1.26 0.29 113.70 123.02 1j8d s SER 121 Ca 0.06 -0.72 0.07 0.00 0.48 0.00 0.00 55.95 55.84 1j8d s SER 121 Cb -0.16 -0.40 -0.03 0.00 0.10 0.00 0.00 66.02 65.52 1j8d s SER 121 CO -0.24 0.14 -0.19 -0.36 0.98 0.00 0.00 173.24 173.57 1j8d s PHE 122 N -1.45 1.66 -0.04 5.02 0.40 0.41 -2.24 117.98 121.74 1j8d s PHE 122 Ca 0.20 -0.43 0.04 0.00 -0.60 0.00 0.00 56.93 56.14 1j8d s PHE 122 Cb -0.09 -0.92 -0.00 0.00 0.51 0.00 0.00 43.02 42.52 1j8d s PHE 122 CO 0.10 0.17 -0.17 0.00 0.70 0.00 0.00 175.22 176.03 1j8d s ALA 123 N -1.18 1.48 0.64 5.36 0.00 -0.32 -1.17 121.76 126.57 1j8d s ALA 123 Ca 0.05 -0.66 -0.15 0.00 0.00 0.00 0.00 51.96 51.20 1j8d s ALA 123 Cb -0.10 -0.49 -0.01 0.00 0.00 0.00 0.00 23.12 22.51 1j8d s ALA 123 CO 0.04 0.27 1.08 0.14 0.00 0.00 0.00 175.76 177.28 1j8d s VAL 124 N 0.05 3.61 0.25 0.00 -7.23 -0.90 0.22 120.40 116.41 1j8d s VAL 124 Ca -0.04 0.72 -0.04 0.00 -1.81 0.00 0.00 61.98 60.81 1j8d s VAL 124 Cb -0.11 -3.26 0.26 0.00 0.56 0.00 0.00 36.38 33.82 1j8d s VAL 124 CO 0.02 -0.50 1.67 0.00 -0.31 0.00 0.00 175.10 175.98 1j8d h ALA 125 N 0.09 0.97 -0.05 1.32 0.00 -0.90 -0.16 119.26 120.54 1j8d h ALA 125 Ca -0.46 0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1j8d h ALA 125 Cb 1.23 0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1j8d h ALA 125 CO 0.56 -0.38 0.00 -0.40 0.00 0.00 0.00 179.25 179.03 1j8d n ASP 126 N -5.21 0.43 -4.68 0.00 5.75 -1.26 -4.90 116.55 106.68 1j8d n ASP 126 Ca 0.15 -1.54 -0.38 0.00 -0.01 0.00 0.00 54.79 53.02 1j8d n ASP 126 Cb 0.50 -0.03 0.05 0.00 -1.03 0.00 0.00 41.12 40.62 1j8d n ASP 126 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1j8d n ALA 127 N -0.48 0.84 -1.30 2.12 0.00 -0.07 -4.97 120.51 116.66 1j8d n ALA 127 Ca 0.14 0.05 -0.30 0.00 0.00 0.00 0.00 53.44 53.33 1j8d n ALA 127 Cb 0.13 -2.24 0.12 0.00 0.00 0.00 0.00 19.45 17.46 1j8d n ALA 127 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1j8d s PRO 128 N -2.92 1.62 0.42 0.00 0.04 -1.25 -4.79 135.00 128.13 1j8d s PRO 128 Ca 0.76 0.83 0.09 0.00 0.04 0.00 0.00 61.00 62.72 1j8d s PRO 128 Cb -0.42 -1.85 0.91 0.00 0.04 0.00 0.00 34.50 33.19 1j8d s PRO 128 CO 0.46 -1.99 2.06 -0.84 0.04 0.00 0.00 177.00 176.73 1j8d h ILE 129 N -1.37 1.10 0.00 0.56 3.07 -1.97 -1.29 117.51 117.62 1j8d h ILE 129 Ca -0.48 -0.21 0.00 0.00 1.55 0.00 0.00 64.86 65.72 1j8d h ILE 129 Cb 1.27 0.64 0.00 0.00 -0.27 0.00 0.00 36.82 38.46 1j8d h ILE 129 CO 0.55 0.10 0.00 0.10 -1.05 0.00 0.00 178.15 177.85 1j8d h TYR 130 N 0.44 0.00 0.13 0.16 -0.00 -1.98 0.57 116.97 116.29 1j8d h TYR 130 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 58.73 58.51 1j8d h TYR 130 Cb -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.71 1j8d h TYR 130 CO 0.00 0.00 -1.78 0.28 -0.00 0.00 0.00 178.16 176.66 1j8d h VAL 131 N 0.00 0.79 -0.65 -0.90 2.07 -1.61 -3.23 116.25 112.73 1j8d h VAL 131 Ca 0.00 -2.38 0.04 0.00 0.82 0.00 0.00 66.70 65.19 1j8d h VAL 131 Cb 0.37 2.58 -0.05 0.00 -1.52 0.00 0.00 31.29 32.67 1j8d h VAL 131 CO 0.00 0.81 0.38 0.11 0.02 0.00 0.00 177.57 178.89 1j8d h LYS 132 N -0.07 0.70 0.00 1.57 1.57 -1.00 -0.08 116.57 119.26 1j8d h LYS 132 Ca -0.38 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 1j8d h LYS 132 Cb 1.94 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 34.10 1j8d h LYS 132 CO 0.08 0.46 0.00 0.09 -0.57 0.00 0.00 179.45 179.51 1j8d n ASN 133 N -4.75 0.52 -1.06 0.86 3.02 0.16 -2.71 115.26 111.30 1j8d n ASN 133 Ca 0.07 0.64 0.10 0.00 -0.03 0.00 0.00 54.58 55.36 1j8d n ASN 133 Cb 0.13 -0.75 0.24 0.00 -0.61 0.00 0.00 39.78 38.79 1j8d n ASN 133 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1j8d n ALA 134 N -1.72 2.33 -2.72 5.41 0.00 -0.06 -4.99 120.51 118.75 1j8d n ALA 134 Ca 0.02 -1.17 -0.32 0.00 0.00 0.00 0.00 53.44 51.98 1j8d n ALA 134 Cb 0.19 -0.74 -0.09 0.00 0.00 0.00 0.00 19.45 18.81 1j8d n ALA 134 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1j8d s VAL 135 N -1.09 1.39 -0.04 0.00 -7.23 -1.08 -4.84 120.40 107.52 1j8d s VAL 135 Ca 0.38 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.47 1j8d s VAL 135 Cb 0.20 -2.39 -0.29 0.00 0.56 0.00 0.00 36.38 34.46 1j8d s VAL 135 CO 0.27 0.00 0.71 0.44 -0.31 0.00 0.00 175.10 176.21 1j8d h ASP 136 N 1.46 0.51 -3.50 4.85 3.45 -1.75 -3.47 116.42 117.97 1j8d h ASP 136 Ca -0.44 -0.78 -0.28 0.00 0.43 0.00 0.00 57.03 55.97 1j8d h ASP 136 Cb 1.30 -0.17 -0.33 0.00 -0.56 0.00 0.00 39.33 39.57 1j8d h ASP 136 CO 0.76 1.66 -0.68 -2.28 -1.57 0.00 0.00 179.24 177.13 1j8d s HIS 137 N -2.59 -0.04 -0.10 4.55 5.04 -0.99 -5.04 115.29 116.11 1j8d s HIS 137 Ca -0.14 0.25 -0.15 0.00 -1.54 0.00 0.00 55.06 53.49 1j8d s HIS 137 Cb 0.06 -0.17 -0.05 0.00 0.04 0.00 0.00 32.58 32.46 1j8d s HIS 137 CO 0.85 -0.11 0.36 0.08 -2.34 0.00 0.00 174.74 173.57 1j8d s VAL 138 N 1.05 5.21 0.34 0.89 1.01 -1.26 -1.18 120.40 126.46 1j8d s VAL 138 Ca -0.09 0.71 -0.16 0.00 0.00 0.00 0.00 61.98 62.44 1j8d s VAL 138 Cb -0.12 -3.68 -0.09 0.00 0.00 0.00 0.00 36.38 32.49 1j8d s VAL 138 CO -0.04 0.44 0.77 -0.76 0.00 0.00 0.00 175.10 175.51 1j8d s LEU 139 N -0.03 4.05 0.30 3.92 1.43 0.13 -4.91 118.68 123.58 1j8d s LEU 139 Ca 0.21 1.35 0.16 0.00 -1.03 0.00 0.00 54.13 54.81 1j8d s LEU 139 Cb -0.14 -4.14 0.25 0.00 0.03 0.00 0.00 46.19 42.19 1j8d s LEU 139 CO 0.08 -0.22 1.53 0.77 0.23 0.00 0.00 176.35 178.74 1j8d h SER 140 N 2.24 0.00 -3.70 2.29 4.64 -1.95 -2.97 113.55 114.10 1j8d h SER 140 Ca -0.48 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.34 1j8d h SER 140 Cb 1.18 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.24 1j8d h SER 140 CO 0.65 0.51 0.14 -0.89 -0.87 0.00 0.00 176.83 176.36 1j8d s THR 141 N -3.15 4.58 0.57 2.95 2.01 -1.26 -4.68 115.64 116.65 1j8d s THR 141 Ca 0.02 1.18 -0.15 0.00 0.31 0.00 0.00 61.69 63.05 1j8d s THR 141 Cb 0.09 -3.73 -0.05 0.00 0.01 0.00 0.00 72.50 68.81 1j8d s THR 141 CO 0.73 -0.02 1.03 -1.00 -0.69 0.00 0.00 174.62 174.67 1j8d s HIS 142 N -1.79 3.23 0.30 4.92 0.09 -1.26 -1.00 115.29 119.78 1j8d s HIS 142 Ca 0.50 1.47 -0.29 0.00 -0.00 0.00 0.00 55.06 56.74 1j8d s HIS 142 Cb -0.13 -2.89 -0.13 0.00 -0.00 0.00 0.00 32.58 29.43 1j8d s HIS 142 CO 0.19 -0.78 1.33 0.41 -0.00 0.00 0.00 174.74 175.89 1j8d n GLY 143 N -1.41 0.63 3.15 -2.22 0.00 -1.25 -0.88 105.19 103.21 1j8d n GLY 143 Ca 0.08 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1j8d n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j8d n GLY 144 N 1.34 1.52 0.78 -0.02 0.00 0.16 -3.49 105.19 105.48 1j8d n GLY 144 Ca 0.08 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.16 1j8d n GLY 144 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j8d n LYS 145 N -2.00 2.94 0.00 1.61 4.76 -0.06 -4.47 118.16 120.94 1j8d n LYS 145 Ca 0.00 -2.34 0.00 0.00 -2.87 0.00 0.00 58.31 53.10 1j8d n LYS 145 Cb 0.00 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.71 1j8d n LYS 145 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1j8d n GLY 146 N 0.27 1.47 0.29 0.72 0.00 -1.25 -4.82 105.19 101.86 1j8d n GLY 146 Ca 0.15 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.19 1j8d n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j8d h ALA 147 N 0.00 1.10 -0.34 4.61 0.00 -1.81 0.10 119.26 122.92 1j8d h ALA 147 Ca 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1j8d h ALA 147 Cb 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1j8d h ALA 147 CO 0.00 0.06 0.15 0.35 0.00 0.00 0.00 179.25 179.80 1j8d h PHE 148 N 0.73 0.50 -0.75 0.00 3.57 -1.90 -2.49 116.94 116.60 1j8d h PHE 148 Ca 0.37 -0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.86 1j8d h PHE 148 Cb 0.34 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.89 1j8d h PHE 148 CO -0.07 0.46 0.50 -0.09 -2.23 0.00 0.00 178.31 176.87 1j8d h ARG 149 N 0.40 0.95 -0.04 1.11 9.65 -1.56 0.18 114.38 125.07 1j8d h ARG 149 Ca 0.11 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.94 1j8d h ARG 149 Cb 0.16 -0.21 0.00 0.00 -1.39 0.00 0.00 29.97 28.52 1j8d h ARG 149 CO -0.01 0.63 0.00 -1.91 2.80 0.00 0.00 179.97 181.47 1j8d n GLU 150 N -4.44 0.04 0.00 0.20 2.13 -0.07 0.03 120.64 118.53 1j8d n GLU 150 Ca 0.09 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.91 1j8d n GLU 150 Cb 0.07 -1.02 0.00 0.00 0.27 0.00 0.00 31.44 30.76 1j8d n GLU 150 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1j8d n SER 152 N 0.40 0.00 -0.51 4.31 3.41 0.64 -4.72 113.62 117.15 1j8d n SER 152 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1j8d n SER 152 Cb 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 1j8d n SER 152 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1j8d n ASP 153 N 0.00 0.00 0.00 4.04 9.92 0.10 -0.93 116.55 129.69 1j8d n ASP 153 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1j8d n ASP 153 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 1j8d n ASP 153 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1j8d n ILE 155 N 0.27 0.00 0.39 0.53 5.41 -1.26 -1.45 119.36 123.25 1j8d n ILE 155 Ca 0.00 0.00 0.12 0.00 1.00 0.00 0.00 62.75 63.87 1j8d n ILE 155 Cb 0.00 0.00 0.51 0.00 -0.71 0.00 0.00 39.64 39.44 1j8d n ILE 155 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1j8d h LEU 156 N 0.00 0.00 0.30 1.39 3.38 -1.41 -2.74 115.31 116.23 1j8d h LEU 156 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1j8d h LEU 156 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1j8d h LEU 156 CO 0.00 0.00 -0.15 -0.61 0.09 0.00 0.00 178.44 177.77 1j8d h GLN 157 N 0.00 -0.39 -0.16 1.13 5.75 -1.46 0.32 115.11 120.31 1j8d h GLN 157 Ca 0.00 0.03 0.05 0.00 -0.15 0.00 0.00 58.65 58.57 1j8d h GLN 157 Cb 0.37 0.09 -0.01 0.00 1.07 0.00 0.00 27.48 29.01 1j8d h GLN 157 CO 0.00 -0.26 0.12 0.00 -2.65 0.00 0.00 178.83 176.04 1j8d h ALA 158 N -1.17 2.08 -0.34 3.38 0.00 -1.82 -1.85 119.26 119.54 1j8d h ALA 158 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1j8d h ALA 158 Cb 0.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1j8d h ALA 158 CO 0.07 -0.20 0.00 1.04 0.00 0.00 0.00 179.25 180.16 1j8d n GLN 159 N -4.39 2.33 -1.17 0.00 6.02 -1.04 -4.75 117.38 114.38 1j8d n GLN 159 Ca 0.01 -1.44 -0.06 0.00 -0.01 0.00 0.00 57.00 55.50 1j8d n GLN 159 Cb 0.25 -1.54 -0.02 0.00 1.02 0.00 0.00 30.24 29.94 1j8d n GLN 159 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1j8d n GLY 160 N 0.76 0.74 1.23 1.08 0.00 -0.70 -4.88 105.19 103.43 1j8d n GLY 160 Ca 0.13 -0.23 0.11 0.00 0.00 0.00 0.00 46.02 46.03 1j8d n GLY 160 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j8d n LYS 161 N -1.68 2.63 0.06 1.61 5.02 -0.25 -4.58 118.16 120.97 1j8d n LYS 161 Ca -0.06 -2.48 0.21 0.00 -2.02 0.00 0.00 58.31 53.97 1j8d n LYS 161 Cb 0.33 -1.53 0.74 0.00 -0.02 0.00 0.00 35.03 34.55 1j8d n LYS 161 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1j8d h SER 162 N 4.21 0.00 -1.04 4.39 4.64 -1.24 -2.38 113.55 122.14 1j8d h SER 162 Ca 0.00 0.00 0.30 0.00 -0.47 0.00 0.00 61.79 61.62 1j8d h SER 162 Cb 0.97 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.02 1j8d h SER 162 CO 0.00 0.00 0.80 0.77 -0.87 0.00 0.00 176.83 177.53 1j8d h SER 163 N 0.00 0.00 0.06 4.97 4.64 -1.88 0.33 113.55 121.66 1j8d h SER 163 Ca 0.22 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.53 1j8d h SER 163 Cb 1.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1j8d h SER 163 CO -0.00 0.00 -0.05 -0.37 -0.87 0.00 0.00 176.83 175.54 1j8d h VAL 164 N 0.00 0.95 0.00 0.95 -1.51 -1.63 -2.82 116.25 112.19 1j8d h VAL 164 Ca 0.49 -0.17 0.00 0.00 -1.23 0.00 0.00 66.70 65.79 1j8d h VAL 164 Cb 2.09 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 32.34 1j8d h VAL 164 CO -0.01 0.05 -0.70 2.22 -1.23 0.00 0.00 177.57 177.90 1j8d n PHE 165 N -4.36 0.00 -0.13 5.19 1.16 0.87 -3.51 117.46 116.67 1j8d n PHE 165 Ca -0.03 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.43 1j8d n PHE 165 Cb 0.13 -0.03 -0.01 0.00 -1.61 0.00 0.00 39.48 37.96 1j8d n PHE 165 CO 0.00 0.00 0.00 -0.44 -1.87 0.00 0.00 176.76 174.45 1j8d h ASP 166 N 0.00 1.01 -5.27 5.98 3.45 -0.65 -3.48 116.42 117.46 1j8d h ASP 166 Ca 0.00 -0.44 -0.13 0.00 0.43 0.00 0.00 57.03 56.90 1j8d h ASP 166 Cb 0.07 -0.28 -0.15 0.00 -0.56 0.00 0.00 39.33 38.41 1j8d h ASP 166 CO 0.00 1.24 -0.58 0.28 -1.57 0.00 0.00 179.24 178.61 1j8d s THR 167 N -4.48 0.17 0.26 0.35 -1.32 -1.07 -5.04 115.64 104.52 1j8d s THR 167 Ca -0.11 -1.67 -0.02 0.00 -1.21 0.00 0.00 61.69 58.68 1j8d s THR 167 Cb 0.12 -1.63 0.26 0.00 -1.51 0.00 0.00 72.50 69.74 1j8d s THR 167 CO 0.88 -0.75 1.85 0.00 -2.21 0.00 0.00 174.62 174.39 1j8d h ALA 168 N 2.96 1.38 -0.07 11.08 0.00 -1.92 -0.54 119.26 132.14 1j8d h ALA 168 Ca -0.34 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 1j8d h ALA 168 Cb 1.17 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1j8d h ALA 168 CO 0.61 0.29 -0.32 0.37 0.00 0.00 0.00 179.25 180.21 1j8d h GLN 169 N 1.03 0.35 -0.62 0.00 4.15 -1.96 -0.80 115.11 117.25 1j8d h GLN 169 Ca 0.44 -0.27 -0.03 0.00 0.77 0.00 0.00 58.65 59.56 1j8d h GLN 169 Cb 0.31 0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.03 1j8d h GLN 169 CO -0.22 0.91 0.25 0.78 -1.93 0.00 0.00 178.83 178.63 1j8d h GLY 170 N -0.14 0.97 0.58 2.39 0.00 -1.61 -1.80 103.07 103.46 1j8d h GLY 170 Ca -0.02 -0.49 -0.04 0.00 0.00 0.00 0.00 47.33 46.78 1j8d h GLY 170 CO 0.07 0.47 -0.11 -2.75 0.00 0.00 0.00 176.54 174.22 1j8d h PHE 171 N 0.90 0.22 -0.16 5.60 3.57 -1.08 -2.81 116.94 123.18 1j8d h PHE 171 Ca 0.21 -0.08 0.05 0.00 3.53 0.00 0.00 57.97 61.68 1j8d h PHE 171 Cb 0.16 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 1j8d h PHE 171 CO 0.01 0.70 0.16 -0.07 -2.23 0.00 0.00 178.31 176.88 1j8d h LEU 172 N -0.32 0.00 0.63 0.59 3.38 -0.97 -1.93 115.31 116.69 1j8d h LEU 172 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1j8d h LEU 172 Cb 0.69 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1j8d h LEU 172 CO 0.02 0.00 -0.43 0.11 0.09 0.00 0.00 178.44 178.24 1j8d h LYS 173 N 0.00 -0.97 -0.53 1.13 1.57 -1.06 -2.67 116.57 114.05 1j8d h LYS 173 Ca 0.08 0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1j8d h LYS 173 Cb 0.40 0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1j8d h LYS 173 CO -0.00 -0.64 0.00 0.43 -0.57 0.00 0.00 179.45 178.66 1j8d n SER 174 N -5.10 1.08 -0.23 0.86 7.64 -0.95 -4.40 113.62 112.51 1j8d n SER 174 Ca -0.12 -2.06 0.23 0.00 1.01 0.00 0.00 58.87 57.93 1j8d n SER 174 Cb 0.43 -0.30 0.59 0.00 -1.01 0.00 0.00 64.21 63.92 1j8d n SER 174 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 1j8d h VAL 175 N 0.55 0.60 -0.03 0.44 3.04 -1.00 -1.08 116.25 118.77 1j8d h VAL 175 Ca 0.00 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.61 1j8d h VAL 175 Cb 0.42 0.34 0.00 0.00 -2.01 0.00 0.00 31.29 30.03 1j8d h VAL 175 CO 0.03 0.04 0.00 0.29 -1.01 0.00 0.00 177.57 176.93 1j8d n LYS 176 N -4.43 1.19 -3.06 4.17 5.02 -1.26 -4.64 118.16 115.15 1j8d n LYS 176 Ca 0.20 -0.16 -0.19 0.00 -2.02 0.00 0.00 58.31 56.14 1j8d n LYS 176 Cb 0.83 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 34.32 1j8d n LYS 176 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1j8d n SER 177 N -0.01 -0.80 -1.33 4.39 7.64 -0.41 -5.20 113.62 117.89 1j8d n SER 177 Ca 0.01 -2.87 0.17 0.00 1.01 0.00 0.00 58.87 57.20 1j8d n SER 177 Cb 0.27 0.12 -0.06 0.00 -1.01 0.00 0.00 64.21 63.53 1j8d n SER 177 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j8d n GLY 179 N 1.54 -2.49 0.00 0.23 0.00 -1.26 -4.80 105.19 98.40 1j8d n GLY 179 Ca 0.18 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 45.06 1j8d n GLY 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93