#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l8j s GLN 9 N 0.00 3.13 0.18 1.47 -0.21 -1.26 -4.14 119.66 118.83 1l8j s GLN 9 Ca 0.00 -0.87 -0.23 0.00 0.02 0.00 0.00 55.36 54.28 1l8j s GLN 9 Cb 0.00 -4.18 0.06 0.00 1.00 0.00 0.00 33.01 29.89 1l8j s GLN 9 CO 0.00 -1.56 0.69 -0.98 -2.12 0.00 0.00 175.29 171.32 1l8j s ARG 10 N 3.38 1.39 -0.12 2.91 1.70 -1.26 -0.57 118.95 126.38 1l8j s ARG 10 Ca 0.19 -0.63 -0.01 0.00 -0.47 0.00 0.00 55.73 54.81 1l8j s ARG 10 Cb -0.18 0.56 0.04 0.00 -0.57 0.00 0.00 34.95 34.80 1l8j s ARG 10 CO 0.11 -0.62 -0.01 -1.17 -1.08 0.00 0.00 175.30 172.53 1l8j s LEU 11 N -2.79 0.95 -0.04 -1.89 2.96 -0.27 -0.96 118.68 116.64 1l8j s LEU 11 Ca 0.05 -0.38 0.03 0.00 -0.22 0.00 0.00 54.13 53.62 1l8j s LEU 11 Cb -0.03 -0.60 -0.03 0.00 0.50 0.00 0.00 46.19 46.04 1l8j s LEU 11 CO -0.05 -0.21 -0.12 -1.00 -1.32 0.00 0.00 176.35 173.65 1l8j s HIS 12 N 1.86 2.77 -0.03 5.38 3.76 -0.42 -1.46 115.29 127.15 1l8j s HIS 12 Ca 0.03 -0.11 0.03 0.00 -0.15 0.00 0.00 55.06 54.86 1l8j s HIS 12 Cb -0.14 -1.63 -0.00 0.00 1.11 0.00 0.00 32.58 31.92 1l8j s HIS 12 CO -0.07 0.26 -0.12 -1.64 -0.85 0.00 0.00 174.74 172.31 1l8j s MET 13 N -0.94 1.26 -0.06 1.40 -1.94 0.89 -0.80 119.30 119.11 1l8j s MET 13 Ca 0.13 -0.43 0.03 0.00 -1.71 0.00 0.00 55.69 53.71 1l8j s MET 13 Cb -0.11 -1.14 0.01 0.00 2.01 0.00 0.00 34.83 35.60 1l8j s MET 13 CO 0.02 0.18 -0.16 -1.17 -0.01 0.00 0.00 175.02 173.89 1l8j s LEU 14 N 0.07 1.81 -0.09 -0.03 2.96 -0.03 -1.40 118.68 121.97 1l8j s LEU 14 Ca -0.02 -0.36 -0.01 0.00 -0.22 0.00 0.00 54.13 53.52 1l8j s LEU 14 Cb -0.09 -0.97 0.03 0.00 0.50 0.00 0.00 46.19 45.65 1l8j s LEU 14 CO 0.01 0.09 -0.04 -1.58 -1.32 0.00 0.00 176.35 173.51 1l8j s GLN 15 N 0.40 1.04 -0.17 1.98 0.74 0.66 -1.55 119.66 122.76 1l8j s GLN 15 Ca -0.12 -0.08 -0.01 0.00 0.05 0.00 0.00 55.36 55.20 1l8j s GLN 15 Cb -0.15 -1.22 -0.01 0.00 1.10 0.00 0.00 33.01 32.74 1l8j s GLN 15 CO 0.04 -0.25 -0.11 0.42 -0.55 0.00 0.00 175.29 174.84 1l8j s ILE 16 N 1.71 3.04 -0.20 -2.34 1.01 0.08 0.01 121.20 124.51 1l8j s ILE 16 Ca 0.03 -0.63 0.01 0.00 0.00 0.00 0.00 60.65 60.06 1l8j s ILE 16 Cb -0.13 -2.32 0.03 0.00 0.01 0.00 0.00 42.46 40.05 1l8j s ILE 16 CO -0.06 0.49 -0.18 -0.44 0.00 0.00 0.00 174.94 174.75 1l8j s SER 17 N 0.93 3.41 -0.34 3.58 0.01 0.17 -1.80 113.70 119.65 1l8j s SER 17 Ca -0.02 -0.81 -0.12 0.00 1.31 0.00 0.00 55.95 56.31 1l8j s SER 17 Cb -0.15 -1.48 -0.00 0.00 0.21 0.00 0.00 66.02 64.59 1l8j s SER 17 CO -0.00 -0.04 0.22 -0.47 0.41 0.00 0.00 173.24 173.35 1l8j s TYR 18 N 1.26 3.22 -0.28 2.43 5.04 -0.64 -0.04 117.35 128.34 1l8j s TYR 18 Ca 0.02 -0.47 -0.06 0.00 -2.44 0.00 0.00 57.07 54.13 1l8j s TYR 18 Cb -0.15 -2.45 0.01 0.00 0.35 0.00 0.00 41.96 39.72 1l8j s TYR 18 CO -0.11 -0.46 0.04 -0.06 -1.34 0.00 0.00 175.55 173.63 1l8j s PHE 19 N 1.66 3.11 0.03 4.97 0.40 0.33 -0.46 117.98 128.02 1l8j s PHE 19 Ca 0.05 -1.02 0.10 0.00 -0.60 0.00 0.00 56.93 55.46 1l8j s PHE 19 Cb -0.18 -2.20 -0.20 0.00 0.51 0.00 0.00 43.02 40.94 1l8j s PHE 19 CO 0.09 -0.58 1.01 0.07 0.70 0.00 0.00 175.22 176.50 1l8j h ARG 20 N 8.18 0.00 -2.88 0.44 0.11 -1.78 0.72 114.38 119.17 1l8j h ARG 20 Ca -0.33 0.00 0.04 0.00 0.10 0.00 0.00 59.98 59.78 1l8j h ARG 20 Cb 1.13 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.20 1l8j h ARG 20 CO 0.60 0.74 0.33 0.16 0.10 0.00 0.00 179.97 181.90 1l8j s ASP 21 N -6.40 -0.04 0.58 0.08 1.47 -1.25 -3.99 116.67 107.12 1l8j s ASP 21 Ca -0.01 -0.95 0.28 0.00 1.18 0.00 0.00 52.55 53.05 1l8j s ASP 21 Cb 0.09 0.76 1.63 0.00 -0.34 0.00 0.00 42.92 45.06 1l8j s ASP 21 CO 0.82 -1.48 2.09 -0.65 0.68 0.00 0.00 175.17 176.63 1l8j h PRO 22 N 2.00 0.00 -0.45 2.11 0.11 -1.97 -2.90 132.00 130.90 1l8j h PRO 22 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1l8j h PRO 22 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1l8j h PRO 22 CO 0.37 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.82 1l8j n TYR 23 N -3.84 0.59 -3.68 0.65 4.01 -1.26 -4.78 117.16 108.86 1l8j n TYR 23 Ca 0.02 -0.40 -0.22 0.00 -0.16 0.00 0.00 57.90 57.14 1l8j n TYR 23 Cb 0.34 -0.01 -0.18 0.00 -0.31 0.00 0.00 39.34 39.18 1l8j n TYR 23 CO 0.00 0.00 0.00 -1.01 -0.46 0.00 0.00 176.86 175.39 1l8j s HIS 24 N -1.10 0.23 0.00 -0.72 3.76 -1.10 -5.07 115.29 111.31 1l8j s HIS 24 Ca 0.34 0.03 0.03 0.00 -0.15 0.00 0.00 55.06 55.30 1l8j s HIS 24 Cb 0.18 -0.60 -0.01 0.00 1.11 0.00 0.00 32.58 33.26 1l8j s HIS 24 CO 0.25 -0.29 -0.09 0.54 -0.85 0.00 0.00 174.74 174.29 1l8j s VAL 25 N 2.12 0.70 -0.19 -0.90 0.11 -1.26 -2.83 120.40 118.14 1l8j s VAL 25 Ca 0.04 -0.49 0.00 0.00 -2.93 0.00 0.00 61.98 58.60 1l8j s VAL 25 Cb -0.13 -0.61 0.02 0.00 -1.53 0.00 0.00 36.38 34.13 1l8j s VAL 25 CO -0.05 0.12 -0.17 0.86 -3.33 0.00 0.00 175.10 172.53 1l8j s TRP 26 N -0.37 2.82 -0.09 1.54 -0.00 0.39 -0.57 118.94 122.67 1l8j s TRP 26 Ca 0.02 -1.54 -0.04 0.00 -0.00 0.00 0.00 56.10 54.54 1l8j s TRP 26 Cb -0.04 -1.95 -0.04 0.00 -0.00 0.00 0.00 33.47 31.44 1l8j s TRP 26 CO -0.00 -0.77 0.10 0.71 -0.00 0.00 0.00 176.95 176.99 1l8j s TYR 27 N 1.32 3.44 -0.17 5.86 1.51 0.68 -1.62 117.35 128.36 1l8j s TYR 27 Ca 0.05 0.39 -0.04 0.00 -1.01 0.00 0.00 57.07 56.45 1l8j s TYR 27 Cb -0.13 -1.87 0.06 0.00 -0.11 0.00 0.00 41.96 39.91 1l8j s TYR 27 CO -0.11 0.64 0.07 -1.14 -1.11 0.00 0.00 175.55 173.89 1l8j s GLN 28 N -1.13 0.28 0.24 -0.62 0.74 -0.74 -1.40 119.66 117.03 1l8j s GLN 28 Ca 0.16 -0.19 -0.06 0.00 0.05 0.00 0.00 55.36 55.33 1l8j s GLN 28 Cb -0.12 -1.88 -0.02 0.00 1.10 0.00 0.00 33.01 32.09 1l8j s GLN 28 CO 0.06 -0.64 0.32 0.20 -0.55 0.00 0.00 175.29 174.68 1l8j s GLY 29 N 2.04 1.12 -0.10 2.59 0.00 0.86 -0.74 107.32 113.07 1l8j s GLY 29 Ca 0.01 -1.36 -0.30 0.00 0.00 0.00 0.00 44.72 43.07 1l8j s GLY 29 CO -0.08 -1.04 1.00 0.54 0.00 0.00 0.00 173.10 173.52 1l8j s ASN 30 N -3.12 -0.31 0.09 1.64 4.22 -0.60 -0.42 114.94 116.44 1l8j s ASN 30 Ca 0.31 0.14 0.07 0.00 -2.14 0.00 0.00 52.86 51.24 1l8j s ASN 30 Cb 0.03 0.30 -0.03 0.00 1.28 0.00 0.00 41.25 42.82 1l8j s ASN 30 CO 0.13 -0.43 -0.18 0.00 -2.04 0.00 0.00 177.10 174.58 1l8j s ALA 31 N -2.20 1.52 -0.05 3.54 0.00 -0.90 -0.85 121.76 122.82 1l8j s ALA 31 Ca 0.04 -1.15 0.02 0.00 0.00 0.00 0.00 51.96 50.87 1l8j s ALA 31 Cb -0.01 -0.17 0.01 0.00 0.00 0.00 0.00 23.12 22.95 1l8j s ALA 31 CO -0.04 0.26 -0.11 -1.12 0.00 0.00 0.00 175.76 174.75 1l8j s SER 32 N -1.88 1.55 -0.15 0.00 0.01 0.02 -0.81 113.70 112.45 1l8j s SER 32 Ca 0.03 -0.25 -0.02 0.00 1.31 0.00 0.00 55.95 57.02 1l8j s SER 32 Cb -0.10 -0.60 -0.02 0.00 0.21 0.00 0.00 66.02 65.52 1l8j s SER 32 CO 0.03 0.05 -0.09 -0.22 0.41 0.00 0.00 173.24 173.42 1l8j s LEU 33 N 0.47 2.89 -1.70 2.44 2.96 0.03 -1.30 118.68 124.47 1l8j s LEU 33 Ca -0.09 -0.29 0.00 0.00 -0.22 0.00 0.00 54.13 53.53 1l8j s LEU 33 Cb -0.13 -1.68 0.00 0.00 0.50 0.00 0.00 46.19 44.88 1l8j s LEU 33 CO 0.02 0.13 0.00 0.61 -1.32 0.00 0.00 176.35 175.79 1l8j n GLY 34 N 3.77 0.30 1.73 7.98 0.00 -0.14 -1.31 105.19 117.53 1l8j n GLY 34 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1l8j n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l8j n GLY 35 N -0.73 0.79 3.45 -0.02 0.00 -1.26 -4.94 105.19 102.48 1l8j n GLY 35 Ca -0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 1l8j n GLY 35 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1l8j s HIS 36 N -3.11 2.87 0.18 1.61 3.76 -0.42 -5.05 115.29 115.13 1l8j s HIS 36 Ca 0.00 -0.39 -0.33 0.00 -0.15 0.00 0.00 55.06 54.19 1l8j s HIS 36 Cb 0.00 -1.83 -0.13 0.00 1.11 0.00 0.00 32.58 31.74 1l8j s HIS 36 CO 0.00 -0.03 1.66 1.28 -0.85 0.00 0.00 174.74 176.79 1l8j n LEU 37 N 3.17 3.56 0.00 0.89 4.77 -1.26 -0.79 117.00 127.34 1l8j n LEU 37 Ca -0.18 1.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.87 1l8j n LEU 37 Cb 0.53 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.11 1l8j n LEU 37 CO 0.30 -0.04 -0.13 0.35 -1.33 0.00 0.00 177.39 176.54 1l8j n THR 38 N 3.72 0.00 -3.92 -5.08 -2.24 0.01 -4.87 114.28 101.91 1l8j n THR 38 Ca 0.17 -0.05 -0.09 0.00 -2.27 0.00 0.00 64.05 61.81 1l8j n THR 38 Cb 0.32 0.40 -0.08 0.00 -2.10 0.00 0.00 70.33 68.87 1l8j n THR 38 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1l8j s HIS 39 N -0.61 0.23 0.00 4.78 3.76 -0.93 -0.04 115.29 122.49 1l8j s HIS 39 Ca 0.00 -0.66 -0.00 0.00 -0.15 0.00 0.00 55.06 54.25 1l8j s HIS 39 Cb 0.00 -0.14 -0.00 0.00 1.11 0.00 0.00 32.58 33.55 1l8j s HIS 39 CO 0.00 -0.47 -0.00 0.08 -0.85 0.00 0.00 174.74 173.49 1l8j s VAL 40 N -3.60 0.01 -0.08 -0.90 1.01 -0.88 -2.11 120.40 113.85 1l8j s VAL 40 Ca 0.03 -0.11 0.04 0.00 0.00 0.00 0.00 61.98 61.94 1l8j s VAL 40 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 36.38 36.39 1l8j s VAL 40 CO -0.09 -0.06 -0.20 -0.22 0.00 0.00 0.00 175.10 174.53 1l8j s LEU 41 N -0.17 1.94 -0.22 3.92 2.96 0.44 -1.97 118.68 125.58 1l8j s LEU 41 Ca -0.02 -0.47 -0.26 0.00 -0.22 0.00 0.00 54.13 53.16 1l8j s LEU 41 Cb -0.01 -1.21 0.08 0.00 0.50 0.00 0.00 46.19 45.55 1l8j s LEU 41 CO -0.00 0.12 0.77 -0.70 -1.32 0.00 0.00 176.35 175.22 1l8j s GLU 42 N 0.40 0.82 0.00 1.98 2.56 -0.46 -0.10 118.70 123.90 1l8j s GLU 42 Ca -0.16 0.76 0.00 0.00 0.00 0.00 0.00 54.97 55.56 1l8j s GLU 42 Cb -0.17 0.40 0.00 0.00 2.00 0.00 0.00 34.13 36.36 1l8j s GLU 42 CO 0.07 -0.14 0.00 0.41 -0.56 0.00 0.00 175.26 175.04 1l8j n GLY 43 N 2.18 2.85 3.80 -1.50 0.00 -0.49 0.57 105.19 112.60 1l8j n GLY 43 Ca -0.15 -2.08 -0.31 0.00 0.00 0.00 0.00 46.02 43.49 1l8j n GLY 43 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1l8j s PRO 44 N -2.40 2.51 0.51 1.61 0.04 -1.25 -0.23 135.00 135.80 1l8j s PRO 44 Ca 0.00 0.88 0.28 0.00 0.04 0.00 0.00 61.00 62.19 1l8j s PRO 44 Cb 0.00 -1.95 1.39 0.00 0.04 0.00 0.00 34.50 33.99 1l8j s PRO 44 CO 0.00 -1.38 1.91 0.38 0.04 0.00 0.00 177.00 177.95 1l8j h ASP 45 N -0.92 0.07 1.08 6.66 3.04 -1.23 -0.52 116.42 124.60 1l8j h ASP 45 Ca -0.45 0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.35 1l8j h ASP 45 Cb 1.23 -0.01 0.00 0.00 -1.04 0.00 0.00 39.33 39.52 1l8j h ASP 45 CO 0.57 0.03 0.00 0.35 -2.04 0.00 0.00 179.24 178.15 1l8j n THR 46 N -4.34 0.57 -2.86 1.15 -2.24 -1.26 -4.40 114.28 100.90 1l8j n THR 46 Ca 0.17 -0.04 -0.03 0.00 -2.27 0.00 0.00 64.05 61.89 1l8j n THR 46 Cb 0.84 -0.76 0.01 0.00 -2.10 0.00 0.00 70.33 68.32 1l8j n THR 46 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1l8j s ASN 47 N -3.95 -1.35 0.04 3.42 2.47 -0.21 -5.14 114.94 110.21 1l8j s ASN 47 Ca 0.09 -1.35 -0.20 0.00 0.42 0.00 0.00 52.86 51.83 1l8j s ASN 47 Cb 0.13 1.75 -0.06 0.00 -1.45 0.00 0.00 41.25 41.62 1l8j s ASN 47 CO 0.49 -0.08 0.58 0.42 -3.72 0.00 0.00 177.10 174.80 1l8j s THR 48 N 1.15 4.82 -0.18 -5.21 -4.23 -1.18 -3.95 115.64 106.86 1l8j s THR 48 Ca 0.26 1.23 -0.08 0.00 -1.18 0.00 0.00 61.69 61.91 1l8j s THR 48 Cb 0.00 -3.91 -0.04 0.00 1.34 0.00 0.00 72.50 69.88 1l8j s THR 48 CO -0.06 0.49 0.10 -0.89 -0.54 0.00 0.00 174.62 173.72 1l8j s THR 49 N -0.68 5.13 -0.12 3.99 2.01 0.19 -4.95 115.64 121.22 1l8j s THR 49 Ca 0.30 0.09 -0.02 0.00 0.31 0.00 0.00 61.69 62.36 1l8j s THR 49 Cb -0.19 -3.31 0.04 0.00 0.01 0.00 0.00 72.50 69.05 1l8j s THR 49 CO 0.18 0.47 0.03 -0.63 -0.69 0.00 0.00 174.62 173.99 1l8j s ILE 50 N 0.18 0.28 0.03 1.82 1.01 -1.26 -1.36 121.20 121.90 1l8j s ILE 50 Ca 0.07 -0.09 -0.03 0.00 0.00 0.00 0.00 60.65 60.60 1l8j s ILE 50 Cb -0.12 -0.64 -0.01 0.00 0.01 0.00 0.00 42.46 41.70 1l8j s ILE 50 CO -0.00 0.02 0.05 0.27 0.00 0.00 0.00 174.94 175.27 1l8j s ILE 51 N 1.99 0.13 -0.18 2.92 -0.00 -0.83 -5.02 121.20 120.21 1l8j s ILE 51 Ca 0.03 -1.04 -0.15 0.00 -0.00 0.00 0.00 60.65 59.49 1l8j s ILE 51 Cb -0.14 -0.67 -0.04 0.00 -0.00 0.00 0.00 42.46 41.61 1l8j s ILE 51 CO -0.06 -0.57 0.34 0.00 -0.00 0.00 0.00 174.94 174.65 1l8j s GLN 52 N -2.14 4.22 0.33 0.37 -2.07 -1.26 -2.07 119.66 117.05 1l8j s GLN 52 Ca -0.09 0.15 0.26 0.00 -1.82 0.00 0.00 55.36 53.86 1l8j s GLN 52 Cb -0.04 -3.48 1.01 0.00 -1.09 0.00 0.00 33.01 29.41 1l8j s GLN 52 CO -0.03 0.11 1.78 -0.07 -1.32 0.00 0.00 175.29 175.76 1l8j h LEU 53 N 7.12 0.00 -8.06 2.60 3.38 -0.81 -3.42 115.31 116.12 1l8j h LEU 53 Ca -0.39 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.23 1l8j h LEU 53 Cb 1.16 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 41.65 1l8j h LEU 53 CO 0.73 0.00 -0.76 -1.10 0.09 0.00 0.00 178.44 177.40 1l8j s GLN 54 N -3.36 0.60 -1.58 1.13 -0.21 -1.25 -5.05 119.66 109.94 1l8j s GLN 54 Ca 0.05 -0.44 -0.09 0.00 0.02 0.00 0.00 55.36 54.89 1l8j s GLN 54 Cb 0.09 -0.54 -0.05 0.00 1.00 0.00 0.00 33.01 33.51 1l8j s GLN 54 CO 0.48 0.14 2.85 -0.35 -2.12 0.00 0.00 175.29 176.29 1l8j n PRO 55 N 2.43 3.81 -0.28 2.91 -0.04 -1.26 -4.60 135.00 137.96 1l8j n PRO 55 Ca -0.16 -2.40 -0.03 0.00 -0.04 0.00 0.00 63.50 60.87 1l8j n PRO 55 Cb 0.57 -2.79 0.08 0.00 -0.04 0.00 0.00 33.50 31.31 1l8j n PRO 55 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1l8j h LEU 56 N 6.91 0.85 -9.55 1.53 3.38 -1.96 -3.41 115.31 113.05 1l8j h LEU 56 Ca 0.84 -0.01 -0.65 0.00 0.09 0.00 0.00 57.88 58.14 1l8j h LEU 56 Cb 0.30 -0.20 -0.10 0.00 0.09 0.00 0.00 40.66 40.75 1l8j h LEU 56 CO 1.75 0.60 -0.58 -1.10 0.09 0.00 0.00 178.44 179.20 1l8j s GLN 57 N -6.12 3.05 0.86 1.13 -0.21 -1.26 -5.09 119.66 112.02 1l8j s GLN 57 Ca -0.13 -0.49 -0.11 0.00 0.02 0.00 0.00 55.36 54.65 1l8j s GLN 57 Cb 0.16 -2.85 0.11 0.00 1.00 0.00 0.00 33.01 31.43 1l8j s GLN 57 CO 0.78 0.65 1.11 -1.21 -2.12 0.00 0.00 175.29 174.49 1l8j s GLU 58 N -1.73 1.53 0.22 2.91 0.41 -1.26 -4.59 118.70 116.20 1l8j s GLU 58 Ca 0.23 1.22 -0.11 0.00 -0.41 0.00 0.00 54.97 55.90 1l8j s GLU 58 Cb -0.12 -1.81 0.31 0.00 -1.78 0.00 0.00 34.13 30.73 1l8j s GLU 58 CO 0.14 -2.17 1.63 -1.35 -0.49 0.00 0.00 175.26 173.02 1l8j h PRO 59 N -1.52 0.04 -0.28 0.39 0.11 -1.98 0.13 132.00 128.90 1l8j h PRO 59 Ca -0.45 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.55 1l8j h PRO 59 Cb 1.26 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1l8j h PRO 59 CO 0.49 0.03 -0.25 0.93 -0.21 0.00 0.00 178.00 178.99 1l8j h GLU 60 N 0.04 0.66 0.13 1.05 3.07 -1.99 -0.23 114.58 117.31 1l8j h GLU 60 Ca 0.35 -0.34 0.01 0.00 -0.50 0.00 0.00 59.36 58.87 1l8j h GLU 60 Cb 0.56 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.46 1l8j h GLU 60 CO -0.66 0.94 -0.14 1.03 -1.40 0.00 0.00 179.01 178.78 1l8j h SER 61 N 0.40 -0.37 -0.98 1.42 0.87 -1.78 -1.79 113.55 111.32 1l8j h SER 61 Ca 0.05 0.04 0.09 0.00 -1.23 0.00 0.00 61.79 60.74 1l8j h SER 61 Cb 0.80 0.13 -0.07 0.00 -0.44 0.00 0.00 62.40 62.83 1l8j h SER 61 CO 0.06 -0.21 0.63 -0.25 -0.53 0.00 0.00 176.83 176.53 1l8j h TRP 62 N -0.30 1.13 -0.57 2.24 2.91 -0.69 -1.24 115.95 119.44 1l8j h TRP 62 Ca 0.01 0.03 -0.03 0.00 1.13 0.00 0.00 58.89 60.03 1l8j h TRP 62 Cb 0.29 -0.37 -0.03 0.00 -0.51 0.00 0.00 29.16 28.55 1l8j h TRP 62 CO -0.14 0.53 0.23 0.00 -1.03 0.00 0.00 178.44 178.03 1l8j h ALA 63 N 1.51 1.34 -0.11 2.65 0.00 -0.40 0.50 119.26 124.74 1l8j h ALA 63 Ca 0.45 -0.15 -0.21 0.00 0.00 0.00 0.00 54.91 55.00 1l8j h ALA 63 Cb 0.33 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1l8j h ALA 63 CO -0.20 0.49 -0.79 0.00 0.00 0.00 0.00 179.25 178.75 1l8j h ARG 64 N 0.81 0.63 -0.52 0.00 3.08 -0.43 -2.15 114.38 115.80 1l8j h ARG 64 Ca 0.19 -0.53 -0.11 0.00 0.07 0.00 0.00 59.98 59.61 1l8j h ARG 64 Cb 0.15 0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 1l8j h ARG 64 CO -0.02 1.15 -0.09 1.15 -1.07 0.00 0.00 179.97 181.09 1l8j h THR 65 N 0.42 1.27 -0.45 2.04 2.02 -0.94 -2.00 112.91 115.26 1l8j h THR 65 Ca -0.05 -1.23 0.00 0.00 0.77 0.00 0.00 66.41 65.90 1l8j h THR 65 Cb 1.40 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 68.79 1l8j h THR 65 CO 0.15 0.43 0.29 -0.61 0.37 0.00 0.00 175.52 176.16 1l8j h GLN 66 N 0.84 0.60 -1.00 6.66 4.15 -0.91 -1.70 115.11 123.75 1l8j h GLN 66 Ca 0.14 -0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.54 1l8j h GLN 66 Cb 0.65 -0.13 -0.05 0.00 0.21 0.00 0.00 27.48 28.15 1l8j h GLN 66 CO 0.04 0.40 0.66 1.03 -1.93 0.00 0.00 178.83 179.03 1l8j h SER 67 N 0.61 1.12 -0.48 -0.69 0.87 -1.14 -0.97 113.55 112.88 1l8j h SER 67 Ca 0.16 -0.02 -0.08 0.00 -1.23 0.00 0.00 61.79 60.62 1l8j h SER 67 Cb -0.06 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 61.61 1l8j h SER 67 CO -0.03 0.80 0.02 1.23 -0.53 0.00 0.00 176.83 178.31 1l8j h GLY 68 N 1.32 0.96 0.90 5.77 0.00 -0.83 -1.56 103.07 109.62 1l8j h GLY 68 Ca 0.38 -0.65 -0.06 0.00 0.00 0.00 0.00 47.33 47.00 1l8j h GLY 68 CO -0.10 0.60 -0.02 1.41 0.00 0.00 0.00 176.54 178.43 1l8j h LEU 69 N 0.83 0.58 -0.59 3.11 3.38 -0.81 -1.21 115.31 120.59 1l8j h LEU 69 Ca 0.16 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 57.84 1l8j h LEU 69 Cb 0.47 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1l8j h LEU 69 CO 0.02 0.77 0.34 1.56 0.09 0.00 0.00 178.44 181.22 1l8j h GLN 70 N 0.37 0.64 -0.12 1.13 4.20 -0.97 -0.76 115.11 119.60 1l8j h GLN 70 Ca 0.09 -0.04 -0.09 0.00 0.06 0.00 0.00 58.65 58.67 1l8j h GLN 70 Cb 0.49 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 1l8j h GLN 70 CO 0.02 0.42 -0.32 0.77 -0.67 0.00 0.00 178.83 179.06 1l8j h SER 71 N 0.66 0.24 -0.30 1.46 0.02 -1.13 -1.44 113.55 113.05 1l8j h SER 71 Ca 0.25 -0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 61.09 1l8j h SER 71 Cb 0.09 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 1l8j h SER 71 CO -0.13 0.55 0.07 0.22 -1.14 0.00 0.00 176.83 176.40 1l8j h TYR 72 N 0.21 0.51 -0.41 3.45 3.20 -0.38 -2.14 116.97 121.41 1l8j h TYR 72 Ca 0.03 -0.06 -0.04 0.00 3.14 0.00 0.00 58.73 61.79 1l8j h TYR 72 Cb 0.67 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.78 1l8j h TYR 72 CO 0.01 0.55 0.09 -0.07 -1.64 0.00 0.00 178.16 177.10 1l8j h LEU 73 N 0.33 0.63 -0.49 2.82 3.38 -0.84 0.17 115.31 121.30 1l8j h LEU 73 Ca 0.09 -0.24 0.07 0.00 0.09 0.00 0.00 57.88 57.89 1l8j h LEU 73 Cb 0.30 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.82 1l8j h LEU 73 CO 0.00 0.71 0.17 0.25 0.09 0.00 0.00 178.44 179.65 1l8j h LEU 74 N 0.52 0.16 -0.54 1.67 5.85 -1.17 0.26 115.31 122.06 1l8j h LEU 74 Ca 0.13 0.06 -0.16 0.00 0.84 0.00 0.00 57.88 58.75 1l8j h LEU 74 Cb 0.33 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 1l8j h LEU 74 CO 0.00 0.12 -0.64 1.56 -0.34 0.00 0.00 178.44 179.14 1l8j h GLN 75 N 0.34 0.35 0.03 1.25 4.20 -1.08 -0.65 115.11 119.55 1l8j h GLN 75 Ca 0.24 -0.25 0.01 0.00 0.06 0.00 0.00 58.65 58.71 1l8j h GLN 75 Cb 0.26 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 1l8j h GLN 75 CO -0.25 0.87 -0.10 0.35 -0.67 0.00 0.00 178.83 179.03 1l8j h PHE 76 N 0.26 -0.25 -0.61 2.96 3.57 -0.17 0.15 116.94 122.85 1l8j h PHE 76 Ca -0.01 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 1l8j h PHE 76 Cb 1.17 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.99 1l8j h PHE 76 CO 0.03 -0.15 0.30 1.25 -2.23 0.00 0.00 178.31 177.51 1l8j h HIS 77 N -0.18 0.87 -0.46 0.41 2.76 -0.92 -2.06 115.15 115.57 1l8j h HIS 77 Ca 0.03 -0.04 0.05 0.00 -2.20 0.00 0.00 60.37 58.21 1l8j h HIS 77 Cb 0.21 -0.27 -0.05 0.00 1.55 0.00 0.00 27.41 28.86 1l8j h HIS 77 CO -0.15 0.66 0.19 0.78 -1.30 0.00 0.00 177.93 178.11 1l8j h GLY 78 N 0.83 0.62 1.02 5.26 0.00 -0.67 -1.02 103.07 109.12 1l8j h GLY 78 Ca 0.21 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.40 1l8j h GLY 78 CO -0.03 0.05 0.46 -2.00 0.00 0.00 0.00 176.54 175.03 1l8j h LEU 79 N 0.38 1.06 -0.87 3.11 5.85 -0.34 -1.27 115.31 123.23 1l8j h LEU 79 Ca 0.21 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 1l8j h LEU 79 Cb 0.18 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 1l8j h LEU 79 CO -0.19 0.85 0.45 0.58 -0.34 0.00 0.00 178.44 179.80 1l8j h VAL 80 N 1.18 1.26 -0.28 1.05 2.07 -0.69 -0.87 116.25 119.97 1l8j h VAL 80 Ca 0.30 -0.67 -0.11 0.00 0.82 0.00 0.00 66.70 67.04 1l8j h VAL 80 Cb 0.03 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 29.90 1l8j h VAL 80 CO -0.05 0.30 -0.29 0.03 0.02 0.00 0.00 177.57 177.58 1l8j h ARG 81 N 1.22 0.57 -0.39 1.57 3.08 -0.73 -2.24 114.38 117.46 1l8j h ARG 81 Ca 0.30 -0.24 -0.08 0.00 0.07 0.00 0.00 59.98 60.04 1l8j h ARG 81 Cb 0.06 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1l8j h ARG 81 CO -0.04 0.79 -0.05 1.25 -1.07 0.00 0.00 179.97 180.85 1l8j h LEU 82 N 0.49 0.72 -1.26 3.04 5.85 -0.82 0.23 115.31 123.56 1l8j h LEU 82 Ca 0.06 -0.34 -0.03 0.00 0.84 0.00 0.00 57.88 58.41 1l8j h LEU 82 Cb 0.75 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 1l8j h LEU 82 CO 0.06 0.89 0.14 0.58 -0.34 0.00 0.00 178.44 179.77 1l8j h VAL 83 N 0.54 1.19 -0.11 1.05 2.07 -1.03 0.16 116.25 120.11 1l8j h VAL 83 Ca 0.10 -0.62 -0.04 0.00 0.82 0.00 0.00 66.70 66.96 1l8j h VAL 83 Cb 0.55 0.69 -0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1l8j h VAL 83 CO 0.03 0.23 -0.08 -0.74 0.02 0.00 0.00 177.57 177.04 1l8j h HIS 84 N 0.65 0.28 -0.94 1.57 -0.00 -1.18 0.27 115.15 115.81 1l8j h HIS 84 Ca 0.15 -0.08 0.07 0.00 -0.00 0.00 0.00 60.37 60.51 1l8j h HIS 84 Cb 0.19 -0.06 -0.07 0.00 -0.00 0.00 0.00 27.41 27.47 1l8j h HIS 84 CO 0.01 0.63 0.59 0.37 -0.00 0.00 0.00 177.93 179.53 1l8j h GLN 85 N -0.14 1.02 0.00 5.26 4.15 -0.48 0.38 115.11 125.30 1l8j h GLN 85 Ca 0.02 -0.06 -0.29 0.00 0.77 0.00 0.00 58.65 59.09 1l8j h GLN 85 Cb 0.57 -0.23 -0.05 0.00 0.21 0.00 0.00 27.48 27.98 1l8j h GLN 85 CO 0.02 0.68 -1.69 0.93 -1.93 0.00 0.00 178.83 176.84 1l8j h GLU 86 N 1.06 0.00 0.00 1.69 4.39 -0.60 -3.42 114.58 117.69 1l8j h GLU 86 Ca 0.41 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.11 1l8j h GLU 86 Cb 0.21 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.86 1l8j h GLU 86 CO -0.19 0.50 0.00 0.54 -1.16 0.00 0.00 179.01 178.70 1l8j n ARG 87 N -3.05 0.73 -1.79 2.33 5.12 0.95 -5.08 116.66 115.87 1l8j n ARG 87 Ca -0.16 -0.14 0.00 0.00 -1.93 0.00 0.00 57.85 55.61 1l8j n ARG 87 Cb 1.05 -0.55 0.00 0.00 -1.16 0.00 0.00 32.46 31.80 1l8j n ARG 87 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1l8j n THR 88 N -0.14 -9.59 -4.20 0.55 -1.04 0.12 -4.89 114.28 95.10 1l8j n THR 88 Ca 0.00 2.14 -0.30 0.00 -2.04 0.00 0.00 64.05 63.85 1l8j n THR 88 Cb 0.09 -4.86 -0.09 0.00 -1.82 0.00 0.00 70.33 63.66 1l8j n THR 88 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1l8j s LEU 89 N -0.38 3.35 -0.47 -4.42 1.43 -1.26 -4.94 118.68 111.99 1l8j s LEU 89 Ca 0.00 -0.20 -0.22 0.00 -1.03 0.00 0.00 54.13 52.68 1l8j s LEU 89 Cb 0.00 -2.07 0.03 0.00 0.03 0.00 0.00 46.19 44.19 1l8j s LEU 89 CO 0.00 0.20 0.75 0.00 0.23 0.00 0.00 176.35 177.53 1l8j s ALA 90 N -1.24 3.30 0.20 4.21 0.00 -1.26 -5.05 121.76 121.92 1l8j s ALA 90 Ca 0.23 -1.18 0.04 0.00 0.00 0.00 0.00 51.96 51.05 1l8j s ALA 90 Cb -0.11 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.52 1l8j s ALA 90 CO 0.15 -1.97 0.30 -0.06 0.00 0.00 0.00 175.76 174.19 1l8j s PHE 91 N 3.19 3.42 0.74 0.00 0.40 -1.26 -4.40 117.98 120.06 1l8j s PHE 91 Ca 0.26 0.03 -0.11 0.00 -0.60 0.00 0.00 56.93 56.52 1l8j s PHE 91 Cb -0.13 -1.60 0.03 0.00 0.51 0.00 0.00 43.02 41.83 1l8j s PHE 91 CO 0.20 0.48 1.07 -1.25 0.70 0.00 0.00 175.22 176.43 1l8j s PRO 92 N -3.59 2.59 0.04 0.24 0.04 -1.26 -5.02 135.00 128.05 1l8j s PRO 92 Ca 0.34 1.00 -0.14 0.00 0.04 0.00 0.00 61.00 62.24 1l8j s PRO 92 Cb -0.10 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.51 1l8j s PRO 92 CO 0.28 -1.36 0.31 -0.48 0.04 0.00 0.00 177.00 175.79 1l8j s LEU 93 N -5.71 0.87 -0.09 -3.56 0.05 0.25 -4.98 118.68 105.51 1l8j s LEU 93 Ca 0.59 -0.18 0.04 0.00 0.05 0.00 0.00 54.13 54.64 1l8j s LEU 93 Cb -0.15 1.36 -0.00 0.00 -2.05 0.00 0.00 46.19 45.34 1l8j s LEU 93 CO 0.55 -0.61 -0.23 -0.89 -0.55 0.00 0.00 176.35 174.62 1l8j s THR 94 N -2.50 2.00 -0.05 5.48 2.01 -1.26 -0.51 115.64 120.80 1l8j s THR 94 Ca -0.05 -0.99 0.05 0.00 0.31 0.00 0.00 61.69 61.00 1l8j s THR 94 Cb -0.01 -1.72 -0.02 0.00 0.01 0.00 0.00 72.50 70.76 1l8j s THR 94 CO -0.03 0.55 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.63 1l8j s ILE 95 N 0.28 2.67 -0.15 1.82 1.01 0.95 0.27 121.20 128.05 1l8j s ILE 95 Ca -0.16 -0.86 0.02 0.00 0.00 0.00 0.00 60.65 59.64 1l8j s ILE 95 Cb -0.17 -2.02 0.01 0.00 0.01 0.00 0.00 42.46 40.30 1l8j s ILE 95 CO 0.08 0.58 -0.20 -0.60 0.00 0.00 0.00 174.94 174.80 1l8j s ARG 96 N -0.55 2.85 -0.21 2.79 3.52 -0.18 0.43 118.95 127.60 1l8j s ARG 96 Ca 0.08 -0.79 -0.02 0.00 -0.13 0.00 0.00 55.73 54.87 1l8j s ARG 96 Cb -0.11 -2.37 0.00 0.00 -1.56 0.00 0.00 34.95 30.91 1l8j s ARG 96 CO 0.01 -0.09 -0.09 0.00 -0.81 0.00 0.00 175.30 174.32 1l8j s PHE 98 N 1.41 2.91 0.23 0.00 5.36 -0.64 -0.24 117.98 127.00 1l8j s PHE 98 Ca 0.05 -1.76 -0.07 0.00 -0.96 0.00 0.00 56.93 54.19 1l8j s PHE 98 Cb -0.14 -1.94 -0.02 0.00 -0.34 0.00 0.00 43.02 40.58 1l8j s PHE 98 CO -0.07 -0.81 0.32 -0.48 -1.46 0.00 0.00 175.22 172.73 1l8j s LEU 99 N 1.26 0.72 0.00 6.12 2.34 -0.50 -0.29 118.68 128.33 1l8j s LEU 99 Ca 0.02 -1.16 0.00 0.00 0.06 0.00 0.00 54.13 53.05 1l8j s LEU 99 Cb -0.15 1.14 0.00 0.00 -0.56 0.00 0.00 46.19 46.62 1l8j s LEU 99 CO -0.10 -1.01 0.00 0.61 -1.06 0.00 0.00 176.35 174.78 1l8j n GLY 100 N -0.34 -1.00 3.08 -3.48 0.00 -0.78 -0.08 105.19 102.59 1l8j n GLY 100 Ca 0.00 -1.33 -0.10 0.00 0.00 0.00 0.00 46.02 44.59 1l8j n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l8j s GLU 102 N -1.61 0.15 -0.61 0.00 2.02 0.17 -1.12 118.70 117.70 1l8j s GLU 102 Ca -0.13 -0.28 -0.13 0.00 0.02 0.00 0.00 54.97 54.45 1l8j s GLU 102 Cb -0.07 0.05 0.15 0.00 0.10 0.00 0.00 34.13 34.37 1l8j s GLU 102 CO 0.00 -0.03 0.54 -0.51 0.02 0.00 0.00 175.26 175.28 1l8j s LEU 103 N -0.69 6.17 0.30 1.80 1.43 0.27 -0.54 118.68 127.42 1l8j s LEU 103 Ca -0.08 -2.15 -0.29 0.00 -1.03 0.00 0.00 54.13 50.58 1l8j s LEU 103 Cb -0.05 -2.14 -0.13 0.00 0.03 0.00 0.00 46.19 43.91 1l8j s LEU 103 CO -0.00 -0.71 1.30 -2.65 0.23 0.00 0.00 176.35 174.52 1l8j n PRO 104 N 4.69 2.01 -0.34 1.29 -0.02 -1.26 -4.43 135.00 136.93 1l8j n PRO 104 Ca -0.03 0.71 0.24 0.00 -2.02 0.00 0.00 63.50 62.40 1l8j n PRO 104 Cb 0.42 -2.29 0.50 0.00 -0.02 0.00 0.00 33.50 32.11 1l8j n PRO 104 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1l8j h PRO 105 N 3.09 0.37 -0.01 0.52 0.11 -1.96 -0.93 132.00 133.18 1l8j h PRO 105 Ca -0.45 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.61 1l8j h PRO 105 Cb 1.29 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 1l8j h PRO 105 CO 0.67 0.24 -0.56 0.39 -0.21 0.00 0.00 178.00 178.54 1l8j n GLU 106 N -4.72 1.47 -3.78 1.05 1.02 -1.26 -5.06 120.64 109.35 1l8j n GLU 106 Ca 0.28 -3.20 -0.20 0.00 -0.02 0.00 0.00 57.16 54.01 1l8j n GLU 106 Cb 0.94 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.86 1l8j n GLU 106 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1l8j s GLY 107 N -3.13 1.46 0.00 0.62 0.00 -0.36 -5.00 107.32 100.91 1l8j s GLY 107 Ca 0.38 -1.40 0.08 0.00 0.00 0.00 0.00 44.72 43.78 1l8j s GLY 107 CO -0.08 -1.37 1.10 1.44 0.00 0.00 0.00 173.10 174.19 1l8j n SER 108 N -1.46 2.48 -3.51 1.64 7.64 -1.26 -4.87 113.62 114.29 1l8j n SER 108 Ca -0.05 -1.87 -0.17 0.00 1.01 0.00 0.00 58.87 57.80 1l8j n SER 108 Cb 0.58 -0.14 -0.05 0.00 -1.01 0.00 0.00 64.21 63.59 1l8j n SER 108 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1l8j s ARG 109 N -0.94 1.08 0.48 1.43 3.52 -1.26 -5.16 118.95 118.10 1l8j s ARG 109 Ca 0.16 0.14 -0.22 0.00 -0.13 0.00 0.00 55.73 55.68 1l8j s ARG 109 Cb 0.08 0.51 -0.07 0.00 -1.56 0.00 0.00 34.95 33.91 1l8j s ARG 109 CO 0.11 -0.36 1.11 0.00 -0.81 0.00 0.00 175.30 175.35 1l8j s ALA 110 N -1.61 2.90 -0.19 6.12 0.00 -1.26 -4.45 121.76 123.27 1l8j s ALA 110 Ca -0.09 0.80 -0.08 0.00 0.00 0.00 0.00 51.96 52.59 1l8j s ALA 110 Cb -0.00 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.74 1l8j s ALA 110 CO 0.06 -0.54 0.09 -1.58 0.00 0.00 0.00 175.76 173.79 1l8j s HIS 111 N -1.71 3.29 0.14 0.00 2.46 0.30 -4.94 115.29 114.82 1l8j s HIS 111 Ca 0.66 0.13 0.06 0.00 0.47 0.00 0.00 55.06 56.38 1l8j s HIS 111 Cb -0.24 -2.12 -0.04 0.00 -0.13 0.00 0.00 32.58 30.05 1l8j s HIS 111 CO 0.28 0.16 -0.13 0.14 -2.47 0.00 0.00 174.74 172.72 1l8j s VAL 112 N 0.47 1.37 0.22 0.89 -7.23 -1.26 -0.66 120.40 114.20 1l8j s VAL 112 Ca 0.05 -1.87 -0.21 0.00 -1.81 0.00 0.00 61.98 58.13 1l8j s VAL 112 Cb -0.12 -1.68 0.04 0.00 0.56 0.00 0.00 36.38 35.18 1l8j s VAL 112 CO 0.00 -0.51 0.65 0.72 -0.31 0.00 0.00 175.10 175.65 1l8j s PHE 113 N -2.52 -0.32 -0.30 2.82 -0.12 -0.72 -4.80 117.98 112.02 1l8j s PHE 113 Ca 0.13 -0.03 -0.02 0.00 -0.05 0.00 0.00 56.93 56.96 1l8j s PHE 113 Cb -0.03 0.61 0.19 0.00 -0.63 0.00 0.00 43.02 43.16 1l8j s PHE 113 CO 0.03 -1.04 0.70 0.12 -0.05 0.00 0.00 175.22 174.98 1l8j s PHE 114 N -3.85 -1.41 -0.03 3.49 2.19 -1.26 -1.86 117.98 115.26 1l8j s PHE 114 Ca 0.07 1.32 0.06 0.00 0.33 0.00 0.00 56.93 58.71 1l8j s PHE 114 Cb -0.03 0.43 -0.02 0.00 -1.31 0.00 0.00 43.02 42.08 1l8j s PHE 114 CO -0.02 -0.78 -0.20 -1.21 1.83 0.00 0.00 175.22 174.84 1l8j s GLU 115 N 2.88 2.29 -0.08 10.12 2.02 0.60 -0.88 118.70 135.65 1l8j s GLU 115 Ca 0.15 -0.82 0.03 0.00 0.02 0.00 0.00 54.97 54.35 1l8j s GLU 115 Cb -0.13 -2.22 0.01 0.00 0.10 0.00 0.00 34.13 31.89 1l8j s GLU 115 CO -0.20 0.59 -0.17 0.08 0.02 0.00 0.00 175.26 175.58 1l8j s VAL 116 N -0.70 1.52 0.05 2.63 1.01 0.98 -1.62 120.40 124.27 1l8j s VAL 116 Ca 0.11 -0.70 0.09 0.00 0.00 0.00 0.00 61.98 61.48 1l8j s VAL 116 Cb -0.10 -1.35 -0.03 0.00 0.00 0.00 0.00 36.38 34.90 1l8j s VAL 116 CO 0.00 0.44 -0.26 0.00 0.00 0.00 0.00 175.10 175.29 1l8j s ALA 117 N 0.54 2.21 -0.12 5.51 0.00 -0.44 -1.27 121.76 128.18 1l8j s ALA 117 Ca -0.16 -1.26 0.02 0.00 0.00 0.00 0.00 51.96 50.55 1l8j s ALA 117 Cb -0.17 -0.46 0.01 0.00 0.00 0.00 0.00 23.12 22.51 1l8j s ALA 117 CO 0.06 0.52 -0.16 0.08 0.00 0.00 0.00 175.76 176.26 1l8j s VAL 118 N -0.82 1.59 -1.53 0.00 1.01 0.56 -1.01 120.40 120.21 1l8j s VAL 118 Ca 0.11 -0.69 -0.13 0.00 0.00 0.00 0.00 61.98 61.27 1l8j s VAL 118 Cb -0.10 -1.45 0.08 0.00 0.00 0.00 0.00 36.38 34.91 1l8j s VAL 118 CO 0.02 0.46 0.93 0.59 0.00 0.00 0.00 175.10 177.10 1l8j n ASN 119 N 4.26 -4.24 0.00 3.32 4.13 0.14 -1.62 115.26 121.25 1l8j n ASN 119 Ca -0.19 -0.81 0.00 0.00 1.68 0.00 0.00 54.58 55.26 1l8j n ASN 119 Cb 0.51 -3.77 0.00 0.00 -1.54 0.00 0.00 39.78 34.98 1l8j n ASN 119 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1l8j n GLY 120 N -1.66 0.65 3.35 7.41 0.00 -1.26 -5.02 105.19 108.64 1l8j n GLY 120 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1l8j n GLY 120 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1l8j s SER 121 N -2.41 3.16 0.25 1.61 0.01 -0.64 -5.07 113.70 110.61 1l8j s SER 121 Ca 0.00 -0.60 -0.30 0.00 1.31 0.00 0.00 55.95 56.36 1l8j s SER 121 Cb 0.00 -0.28 -0.14 0.00 0.21 0.00 0.00 66.02 65.81 1l8j s SER 121 CO 0.00 0.25 1.20 -1.20 0.41 0.00 0.00 173.24 173.91 1l8j n SER 122 N 1.72 1.92 0.00 2.44 7.64 -1.26 -0.32 113.62 125.76 1l8j n SER 122 Ca -0.17 1.16 0.00 0.00 1.01 0.00 0.00 58.87 60.87 1l8j n SER 122 Cb 0.52 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.39 1l8j n SER 122 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1l8j n PHE 123 N 1.09 0.00 -4.10 1.43 7.35 -0.40 -4.45 117.46 118.38 1l8j n PHE 123 Ca 0.11 0.00 -0.07 0.00 -0.76 0.00 0.00 57.45 56.73 1l8j n PHE 123 Cb 0.30 0.13 -0.10 0.00 0.35 0.00 0.00 39.48 40.16 1l8j n PHE 123 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1l8j s VAL 124 N -0.71 0.26 0.01 -2.13 -7.23 -0.89 -0.07 120.40 109.64 1l8j s VAL 124 Ca 0.00 -1.82 -0.07 0.00 -1.81 0.00 0.00 61.98 58.28 1l8j s VAL 124 Cb 0.00 -1.54 -0.00 0.00 0.56 0.00 0.00 36.38 35.40 1l8j s VAL 124 CO 0.00 -0.99 0.12 -0.94 -0.31 0.00 0.00 175.10 172.99 1l8j s SER 125 N -2.93 0.05 0.12 4.85 1.04 -0.58 -0.01 113.70 116.24 1l8j s SER 125 Ca 0.08 -0.25 -0.17 0.00 0.48 0.00 0.00 55.95 56.08 1l8j s SER 125 Cb 0.08 0.20 -0.07 0.00 0.10 0.00 0.00 66.02 66.32 1l8j s SER 125 CO -0.09 -0.37 0.57 0.12 0.98 0.00 0.00 173.24 174.44 1l8j s PHE 126 N -1.47 3.69 -0.70 5.02 5.36 -0.06 -0.77 117.98 129.06 1l8j s PHE 126 Ca -0.14 1.18 -0.02 0.00 -0.96 0.00 0.00 56.93 56.99 1l8j s PHE 126 Cb -0.08 -2.45 0.18 0.00 -0.34 0.00 0.00 43.02 40.34 1l8j s PHE 126 CO 0.01 0.49 0.53 1.03 -1.46 0.00 0.00 175.22 175.82 1l8j s ARG 127 N -1.60 2.74 0.26 10.12 0.52 0.38 -4.50 118.95 126.87 1l8j s ARG 127 Ca 0.35 -2.78 -0.01 0.00 -0.52 0.00 0.00 55.73 52.77 1l8j s ARG 127 Cb -0.17 -3.77 0.54 0.00 0.52 0.00 0.00 34.95 32.07 1l8j s ARG 127 CO 0.19 -1.20 1.76 -1.35 0.02 0.00 0.00 175.30 174.72 1l8j h PRO 128 N 6.65 0.61 -0.72 3.54 0.11 -1.87 -1.75 132.00 138.57 1l8j h PRO 128 Ca 0.04 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 66.12 1l8j h PRO 128 Cb 0.90 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 31.84 1l8j h PRO 128 CO 0.75 0.41 0.48 1.05 -0.21 0.00 0.00 178.00 180.47 1l8j h GLU 129 N 0.63 0.95 -0.02 1.05 9.09 -1.94 -0.44 114.58 123.90 1l8j h GLU 129 Ca 0.47 -0.06 0.00 0.00 0.05 0.00 0.00 59.36 59.82 1l8j h GLU 129 Cb 0.65 -0.21 0.00 0.00 -1.65 0.00 0.00 28.75 27.54 1l8j h GLU 129 CO -0.36 0.63 -0.07 0.54 0.05 0.00 0.00 179.01 179.80 1l8j n ARG 130 N -4.43 1.96 -3.75 1.06 5.12 -1.14 -4.97 116.66 110.52 1l8j n ARG 130 Ca 0.08 -1.51 -0.25 0.00 -1.93 0.00 0.00 57.85 54.24 1l8j n ARG 130 Cb 0.04 -1.47 0.04 0.00 -1.16 0.00 0.00 32.46 29.91 1l8j n ARG 130 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1l8j n ALA 131 N 0.80 -1.67 -2.52 7.54 0.00 -0.17 -4.99 120.51 119.50 1l8j n ALA 131 Ca 0.15 0.04 -0.25 0.00 0.00 0.00 0.00 53.44 53.38 1l8j n ALA 131 Cb 0.51 -3.31 -0.13 0.00 0.00 0.00 0.00 19.45 16.52 1l8j n ALA 131 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1l8j s LEU 132 N -6.95 2.27 0.01 0.00 1.43 -0.92 -4.75 118.68 109.77 1l8j s LEU 132 Ca 0.31 -0.65 -0.00 0.00 -1.03 0.00 0.00 54.13 52.76 1l8j s LEU 132 Cb -0.15 -0.92 -0.04 0.00 0.03 0.00 0.00 46.19 45.11 1l8j s LEU 132 CO 0.80 0.09 0.10 0.26 0.23 0.00 0.00 176.35 177.83 1l8j s TRP 133 N -1.06 3.32 0.17 0.29 0.52 -1.26 -0.47 118.94 120.44 1l8j s TRP 133 Ca 0.07 0.21 0.07 0.00 0.02 0.00 0.00 56.10 56.46 1l8j s TRP 133 Cb -0.10 -1.73 -0.04 0.00 -1.15 0.00 0.00 33.47 30.45 1l8j s TRP 133 CO 0.04 0.56 -0.14 1.14 0.02 0.00 0.00 176.95 178.57 1l8j s GLN 134 N -1.92 1.19 0.30 4.98 -2.07 0.05 -4.97 119.66 117.22 1l8j s GLN 134 Ca 0.25 -1.46 -0.23 0.00 -1.82 0.00 0.00 55.36 52.10 1l8j s GLN 134 Cb -0.12 -0.98 -0.09 0.00 -1.09 0.00 0.00 33.01 30.73 1l8j s GLN 134 CO 0.17 0.17 0.86 0.00 -1.32 0.00 0.00 175.29 175.16 1l8j s ALA 135 N -2.78 3.27 -0.37 2.60 0.00 -1.26 -1.53 121.76 121.68 1l8j s ALA 135 Ca 0.17 0.37 0.06 0.00 0.00 0.00 0.00 51.96 52.57 1l8j s ALA 135 Cb -0.01 -3.04 0.17 0.00 0.00 0.00 0.00 23.12 20.24 1l8j s ALA 135 CO 0.04 0.23 1.13 -0.25 0.00 0.00 0.00 175.76 176.92 1l8j n ASP 136 N 0.49 2.49 -4.90 0.00 8.00 0.90 -4.82 116.55 118.71 1l8j n ASP 136 Ca 0.01 -2.14 -0.27 0.00 0.71 0.00 0.00 54.79 53.10 1l8j n ASP 136 Cb 0.51 -0.15 -0.04 0.00 -0.02 0.00 0.00 41.12 41.42 1l8j n ASP 136 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1l8j s THR 137 N -1.24 5.07 0.24 -3.53 -1.32 -1.23 -4.66 115.64 108.97 1l8j s THR 137 Ca 0.14 -0.78 0.10 0.00 -1.21 0.00 0.00 61.69 59.94 1l8j s THR 137 Cb 0.09 -3.59 -0.05 0.00 -1.51 0.00 0.00 72.50 67.44 1l8j s THR 137 CO 0.07 -0.07 1.57 -0.61 -2.21 0.00 0.00 174.62 173.36 1l8j h GLN 138 N 2.31 0.00 -6.41 7.08 4.15 -1.95 -3.45 115.11 116.85 1l8j h GLN 138 Ca -0.48 0.00 -0.62 0.00 0.77 0.00 0.00 58.65 58.32 1l8j h GLN 138 Cb 1.19 0.00 -0.14 0.00 0.21 0.00 0.00 27.48 28.75 1l8j h GLN 138 CO 0.68 0.66 -0.72 0.08 -1.93 0.00 0.00 178.83 177.60 1l8j s VAL 139 N -3.47 3.18 0.41 2.39 1.01 -1.26 -5.12 120.40 117.54 1l8j s VAL 139 Ca -0.01 -1.72 -0.20 0.00 0.00 0.00 0.00 61.98 60.05 1l8j s VAL 139 Cb 0.12 -2.59 -0.11 0.00 0.00 0.00 0.00 36.38 33.80 1l8j s VAL 139 CO 0.77 -0.15 0.91 -0.89 0.00 0.00 0.00 175.10 175.73 1l8j s THR 140 N -1.81 4.45 0.04 3.92 2.01 -1.26 -5.03 115.64 117.95 1l8j s THR 140 Ca 0.26 1.38 -0.14 0.00 0.31 0.00 0.00 61.69 63.51 1l8j s THR 140 Cb -0.08 -3.60 0.02 0.00 0.01 0.00 0.00 72.50 68.84 1l8j s THR 140 CO 0.16 -0.29 0.30 -0.94 -0.69 0.00 0.00 174.62 173.15 1l8j s SER 141 N -2.20 -0.12 0.23 3.53 1.04 -1.26 -5.02 113.70 109.90 1l8j s SER 141 Ca 0.60 -0.18 -0.07 0.00 0.48 0.00 0.00 55.95 56.79 1l8j s SER 141 Cb -0.09 0.35 0.22 0.00 0.10 0.00 0.00 66.02 66.60 1l8j s SER 141 CO 0.14 -0.60 1.85 1.23 0.98 0.00 0.00 173.24 176.84 1l8j h GLY 142 N 3.27 1.34 0.82 7.32 0.00 -1.97 0.35 103.07 114.19 1l8j h GLY 142 Ca -0.32 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 46.39 1l8j h GLY 142 CO 0.46 0.59 -0.10 -2.08 0.00 0.00 0.00 176.54 175.41 1l8j h VAL 143 N 1.25 0.86 -0.30 4.60 2.07 -1.94 -0.16 116.25 122.64 1l8j h VAL 143 Ca 0.31 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1l8j h VAL 143 Cb 0.04 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1l8j h VAL 143 CO -0.05 0.08 0.20 0.58 0.02 0.00 0.00 177.57 178.40 1l8j h VAL 144 N -0.46 1.07 -0.07 2.57 2.07 -1.92 -0.60 116.25 118.92 1l8j h VAL 144 Ca -0.03 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 1l8j h VAL 144 Cb 0.35 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 1l8j h VAL 144 CO 0.05 0.07 0.04 0.74 0.02 0.00 0.00 177.57 178.49 1l8j h THR 145 N 0.40 1.05 -0.60 2.57 2.02 -0.88 -0.70 112.91 116.77 1l8j h THR 145 Ca 0.11 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 1l8j h THR 145 Cb -0.04 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 1l8j h THR 145 CO -0.03 0.05 0.29 0.15 0.37 0.00 0.00 175.52 176.35 1l8j h PHE 146 N 0.05 0.86 -0.35 3.16 3.57 -0.92 -0.19 116.94 123.13 1l8j h PHE 146 Ca 0.02 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.51 1l8j h PHE 146 Cb 0.04 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.48 1l8j h PHE 146 CO -0.06 0.66 0.18 1.15 -2.23 0.00 0.00 178.31 178.01 1l8j h THR 147 N 0.82 1.00 -0.66 4.41 2.02 -0.81 -0.44 112.91 119.24 1l8j h THR 147 Ca 0.21 -0.13 -0.04 0.00 0.77 0.00 0.00 66.41 67.22 1l8j h THR 147 Cb 0.12 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 1l8j h THR 147 CO -0.03 0.07 0.24 -0.07 0.37 0.00 0.00 175.52 176.10 1l8j h LEU 148 N 0.37 0.93 -0.77 2.58 3.38 -0.96 0.17 115.31 121.01 1l8j h LEU 148 Ca 0.14 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 57.99 1l8j h LEU 148 Cb 0.04 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.49 1l8j h LEU 148 CO -0.09 0.87 0.46 1.56 0.09 0.00 0.00 178.44 181.33 1l8j h GLN 149 N 0.94 0.82 -0.04 1.13 4.20 -0.39 0.39 115.11 122.16 1l8j h GLN 149 Ca 0.22 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.86 1l8j h GLN 149 Cb 0.24 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 1l8j h GLN 149 CO -0.01 0.54 -0.06 1.96 -0.67 0.00 0.00 178.83 180.59 1l8j h GLN 150 N 0.84 0.11 -0.99 1.46 1.08 -0.57 -2.27 115.11 114.78 1l8j h GLN 150 Ca 0.34 -0.07 0.07 0.00 -1.45 0.00 0.00 58.65 57.55 1l8j h GLN 150 Cb 0.18 0.01 -0.07 0.00 -0.05 0.00 0.00 27.48 27.55 1l8j h GLN 150 CO -0.18 0.62 0.63 -0.07 -0.95 0.00 0.00 178.83 178.89 1l8j h LEU 151 N -0.39 1.01 -0.81 1.46 3.38 -0.33 -1.79 115.31 117.83 1l8j h LEU 151 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1l8j h LEU 151 Cb 0.61 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1l8j h LEU 151 CO 0.01 0.63 0.00 0.59 0.09 0.00 0.00 178.44 179.77 1l8j n ASN 152 N -4.53 1.25 -0.03 -0.43 3.02 0.13 -4.20 115.26 110.49 1l8j n ASN 152 Ca 0.15 -1.42 -0.01 0.00 -0.03 0.00 0.00 54.58 53.27 1l8j n ASN 152 Cb 0.20 -0.00 -0.00 0.00 -0.61 0.00 0.00 39.78 39.36 1l8j n ASN 152 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1l8j h ALA 153 N 4.29 0.00 -2.52 5.41 0.00 -0.70 -3.49 119.26 122.25 1l8j h ALA 153 Ca 0.00 -0.26 -0.49 0.00 0.00 0.00 0.00 54.91 54.16 1l8j h ALA 153 Cb 0.42 0.15 0.06 0.00 0.00 0.00 0.00 17.79 18.41 1l8j h ALA 153 CO 0.00 0.15 0.42 0.71 0.00 0.00 0.00 179.25 180.53 1l8j s TYR 154 N -1.42 2.76 0.30 0.00 1.51 -1.19 -4.96 117.35 114.36 1l8j s TYR 154 Ca -0.04 1.55 0.34 0.00 -1.01 0.00 0.00 57.07 57.91 1l8j s TYR 154 Cb 0.01 -3.23 1.61 0.00 -0.11 0.00 0.00 41.96 40.23 1l8j s TYR 154 CO 0.06 -1.37 2.08 -0.91 -1.11 0.00 0.00 175.55 174.31 1l8j h ASN 155 N 1.31 0.00 0.09 2.29 -0.26 -1.94 -3.01 115.58 114.06 1l8j h ASN 155 Ca -0.50 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.24 1l8j h ASN 155 Cb 1.25 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.51 1l8j h ASN 155 CO 0.58 0.04 -0.05 0.03 -1.06 0.00 0.00 177.43 176.97 1l8j h ARG 156 N 0.00 -0.12 0.00 0.81 3.08 -1.94 -2.04 114.38 114.16 1l8j h ARG 156 Ca -0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1l8j h ARG 156 Cb 0.37 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1l8j h ARG 156 CO 0.01 -0.08 0.00 0.25 -1.07 0.00 0.00 179.97 179.07 1l8j n THR 157 N -2.76 0.00 0.00 2.04 -2.24 -1.23 -2.93 114.28 107.15 1l8j n THR 157 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1l8j n THR 157 Cb 0.05 -1.00 0.00 0.00 -2.10 0.00 0.00 70.33 67.28 1l8j n THR 157 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1l8j n ARG 158 N -0.94 0.00 -0.03 -0.78 1.74 -1.14 -4.78 116.66 110.74 1l8j n ARG 158 Ca 0.00 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.94 1l8j n ARG 158 Cb 0.00 -0.01 -0.02 0.00 -1.02 0.00 0.00 32.46 31.41 1l8j n ARG 158 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 1l8j h TYR 159 N 0.00 0.93 -0.50 -1.55 -1.99 -1.47 -1.56 116.97 110.84 1l8j h TYR 159 Ca 0.00 -0.36 -0.09 0.00 2.00 0.00 0.00 58.73 60.28 1l8j h TYR 159 Cb 0.00 -0.16 -0.02 0.00 2.00 0.00 0.00 36.73 38.55 1l8j h TYR 159 CO 0.00 1.16 -0.05 0.93 -0.00 0.00 0.00 178.16 180.20 1l8j h GLU 160 N 0.53 0.86 -0.40 4.88 5.08 -1.39 -0.89 114.58 123.26 1l8j h GLU 160 Ca -0.01 -0.27 -0.15 0.00 -1.00 0.00 0.00 59.36 57.93 1l8j h GLU 160 Cb 1.23 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1l8j h GLU 160 CO 0.13 0.89 -0.35 1.25 -1.00 0.00 0.00 179.01 179.94 1l8j h LEU 161 N 0.79 0.98 -0.70 1.33 5.85 -1.46 0.60 115.31 122.71 1l8j h LEU 161 Ca 0.14 -0.43 0.00 0.00 0.84 0.00 0.00 57.88 58.44 1l8j h LEU 161 Cb 0.54 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 1l8j h LEU 161 CO 0.03 1.22 0.44 -0.09 -0.34 0.00 0.00 178.44 179.70 1l8j h ARG 162 N 0.76 0.93 -0.49 1.25 2.43 -1.09 -1.16 114.38 117.01 1l8j h ARG 162 Ca 0.07 -0.07 -0.07 0.00 -0.81 0.00 0.00 59.98 59.11 1l8j h ARG 162 Cb 0.93 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.26 1l8j h ARG 162 CO 0.09 0.64 0.04 1.49 -1.51 0.00 0.00 179.97 180.72 1l8j h GLU 163 N 0.94 0.84 -0.44 0.20 4.81 -0.84 0.48 114.58 120.57 1l8j h GLU 163 Ca 0.25 -0.25 0.04 0.00 -0.13 0.00 0.00 59.36 59.28 1l8j h GLU 163 Cb -0.07 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.18 1l8j h GLU 163 CO -0.05 0.86 0.20 0.35 -0.73 0.00 0.00 179.01 179.64 1l8j h PHE 164 N 0.71 0.36 -0.02 0.92 3.57 -0.33 -0.81 116.94 121.34 1l8j h PHE 164 Ca 0.15 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.64 1l8j h PHE 164 Cb 0.45 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.10 1l8j h PHE 164 CO 0.03 0.16 -0.10 -0.07 -2.23 0.00 0.00 178.31 176.11 1l8j h LEU 165 N 0.40 0.11 -0.18 0.59 3.38 -1.07 0.20 115.31 118.74 1l8j h LEU 165 Ca 0.20 -0.69 -0.19 0.00 0.09 0.00 0.00 57.88 57.29 1l8j h LEU 165 Cb 0.14 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1l8j h LEU 165 CO -0.17 0.78 -0.92 -0.33 0.09 0.00 0.00 178.44 177.90 1l8j h GLU 166 N -0.55 0.02 0.00 1.13 4.39 -0.93 -3.30 114.58 115.34 1l8j h GLU 166 Ca -0.01 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1l8j h GLU 166 Cb 0.78 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.44 1l8j h GLU 166 CO 0.02 0.92 -0.31 -0.25 -1.16 0.00 0.00 179.01 178.23 1l8j n ASP 167 N -3.48 0.86 0.08 1.42 8.00 -0.39 -4.41 116.55 118.62 1l8j n ASP 167 Ca -0.01 0.13 -0.12 0.00 0.71 0.00 0.00 54.79 55.51 1l8j n ASP 167 Cb 0.86 -0.44 -0.05 0.00 -0.02 0.00 0.00 41.12 41.47 1l8j n ASP 167 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1l8j h THR 168 N -0.31 0.52 -0.34 -3.53 2.02 -1.20 0.11 112.91 110.18 1l8j h THR 168 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1l8j h THR 168 Cb 0.31 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 1l8j h THR 168 CO 0.00 0.00 0.21 0.00 0.37 0.00 0.00 175.52 176.10 1l8j h VAL 170 N 0.45 1.24 -0.79 0.00 2.07 -1.59 -1.16 116.25 116.47 1l8j h VAL 170 Ca 0.12 -0.87 0.01 0.00 0.82 0.00 0.00 66.70 66.78 1l8j h VAL 170 Cb -0.01 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 1l8j h VAL 170 CO -0.02 0.28 0.51 1.56 0.02 0.00 0.00 177.57 179.92 1l8j h GLN 171 N 0.35 1.04 -0.21 1.57 4.20 -0.62 -1.51 115.11 119.93 1l8j h GLN 171 Ca 0.09 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 1l8j h GLN 171 Cb 0.38 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 1l8j h GLN 171 CO 0.01 0.70 0.13 -0.92 -0.67 0.00 0.00 178.83 178.07 1l8j h TYR 172 N 1.07 0.27 -0.25 2.96 3.20 -0.58 -0.92 116.97 122.72 1l8j h TYR 172 Ca 0.29 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.16 1l8j h TYR 172 Cb -0.11 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.06 1l8j h TYR 172 CO 0.00 0.21 0.14 0.28 -1.64 0.00 0.00 178.16 177.15 1l8j h VAL 173 N 0.26 1.10 -0.84 1.81 2.07 -0.90 -0.43 116.25 119.31 1l8j h VAL 173 Ca 0.07 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.37 1l8j h VAL 173 Cb 0.01 0.82 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 1l8j h VAL 173 CO -0.01 0.10 0.56 1.56 0.02 0.00 0.00 177.57 179.79 1l8j h GLN 174 N 0.30 1.04 0.10 1.57 1.08 -1.08 -0.39 115.11 117.74 1l8j h GLN 174 Ca 0.09 -0.06 -0.18 0.00 -1.45 0.00 0.00 58.65 57.05 1l8j h GLN 174 Cb 0.03 -0.24 0.02 0.00 -0.05 0.00 0.00 27.48 27.25 1l8j h GLN 174 CO -0.02 0.69 -0.77 -0.22 -0.95 0.00 0.00 178.83 177.57 1l8j h LYS 175 N 1.07 0.34 0.00 1.46 3.64 -0.96 -3.39 116.57 118.74 1l8j h LYS 175 Ca 0.33 -0.50 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1l8j h LYS 175 Cb -0.01 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1l8j h LYS 175 CO -0.09 1.20 -0.74 0.72 -2.27 0.00 0.00 179.45 178.28 1l8j n HIS 176 N -4.14 0.07 1.27 1.91 8.25 -0.19 -5.11 115.22 117.28 1l8j n HIS 176 Ca -0.13 0.02 0.13 0.00 -0.26 0.00 0.00 57.72 57.48 1l8j n HIS 176 Cb 0.78 -0.23 0.33 0.00 1.12 0.00 0.00 29.99 31.99 1l8j n HIS 176 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09