#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tls h GLN 3 N 0.00 0.63 -0.20 1.64 7.50 -1.99 -2.28 115.11 120.41 1tls h GLN 3 Ca 0.00 -0.14 -0.00 0.00 0.50 0.00 0.00 58.65 59.01 1tls h GLN 3 Cb 0.00 -0.09 -0.01 0.00 0.05 0.00 0.00 27.48 27.43 1tls h GLN 3 CO 0.00 0.63 0.12 -0.92 -1.50 0.00 0.00 178.83 177.16 1tls h TYR 4 N 0.51 0.27 -0.36 2.96 3.20 -2.00 -2.25 116.97 119.30 1tls h TYR 4 Ca 0.13 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.95 1tls h TYR 4 Cb 0.26 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 1tls h TYR 4 CO 0.01 0.21 0.00 -0.07 -1.64 0.00 0.00 178.16 176.67 1tls h LEU 5 N 0.25 0.53 -0.81 2.82 3.38 -2.00 -1.55 115.31 117.94 1tls h LEU 5 Ca 0.07 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 1tls h LEU 5 Cb 0.02 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1tls h LEU 5 CO -0.01 0.60 -0.52 -0.33 0.09 0.00 0.00 178.44 178.27 1tls h GLU 6 N 0.54 0.00 -0.12 1.13 5.08 -1.14 -2.76 114.58 117.31 1tls h GLU 6 Ca 0.12 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.41 1tls h GLU 6 Cb 0.35 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 1tls h GLU 6 CO 0.01 0.52 -0.18 1.25 -1.00 0.00 0.00 179.01 179.61 1tls h LEU 7 N 0.00 0.37 -0.05 1.33 5.85 -0.74 -1.89 115.31 120.19 1tls h LEU 7 Ca -0.01 -0.53 0.04 0.00 0.84 0.00 0.00 57.88 58.23 1tls h LEU 7 Cb 1.03 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.90 1tls h LEU 7 CO 0.07 0.83 -0.25 0.24 -0.34 0.00 0.00 178.44 178.98 1tls h MET 8 N -0.07 -0.35 -0.31 1.25 2.86 -1.22 0.89 114.93 117.99 1tls h MET 8 Ca 0.01 0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.74 1tls h MET 8 Cb 0.75 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.47 1tls h MET 8 CO 0.04 -0.23 0.21 0.37 1.06 0.00 0.00 176.91 178.36 1tls h GLN 9 N -0.36 0.12 -0.23 1.72 5.75 -1.54 -1.53 115.11 119.04 1tls h GLN 9 Ca 0.08 -0.01 -0.17 0.00 -0.15 0.00 0.00 58.65 58.40 1tls h GLN 9 Cb 0.47 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 28.99 1tls h GLN 9 CO -0.25 0.08 -0.55 -0.22 -2.65 0.00 0.00 178.83 175.24 1tls h LYS 10 N 0.13 0.70 -0.01 1.69 3.64 -0.00 -0.59 116.57 122.13 1tls h LYS 10 Ca 0.14 -0.44 -0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1tls h LYS 10 Cb 0.40 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1tls h LYS 10 CO -0.02 1.06 0.00 0.28 -2.27 0.00 0.00 179.45 178.51 1tls h VAL 11 N 0.53 1.14 -0.90 2.00 2.07 -0.30 0.30 116.25 121.10 1tls h VAL 11 Ca 0.01 -0.40 0.03 0.00 0.82 0.00 0.00 66.70 67.16 1tls h VAL 11 Cb 1.12 1.39 -0.05 0.00 -1.52 0.00 0.00 31.29 32.24 1tls h VAL 11 CO 0.11 0.10 0.59 -0.07 0.02 0.00 0.00 177.57 178.32 1tls h LEU 12 N -0.16 0.99 0.13 2.57 3.38 -1.37 1.58 115.31 122.43 1tls h LEU 12 Ca 0.00 -0.01 -0.28 0.00 0.09 0.00 0.00 57.88 57.68 1tls h LEU 12 Cb 0.17 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1tls h LEU 12 CO -0.00 0.69 -1.26 0.44 0.09 0.00 0.00 178.44 178.39 1tls h ASP 13 N 1.15 0.43 0.00 -0.43 3.32 -0.78 -3.39 116.42 116.73 1tls h ASP 13 Ca 0.35 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 56.93 1tls h ASP 13 Cb -0.04 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.37 1tls h ASP 13 CO -0.10 1.37 -0.00 -0.62 -1.72 0.00 0.00 179.24 178.16 1tls n GLU 14 N -3.53 2.43 -2.71 3.56 1.02 0.10 -5.07 120.64 116.44 1tls n GLU 14 Ca -0.09 -1.37 -0.34 0.00 -0.02 0.00 0.00 57.16 55.34 1tls n GLU 14 Cb 1.03 -0.93 -0.06 0.00 -0.02 0.00 0.00 31.44 31.46 1tls n GLU 14 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1tls s GLY 15 N -0.91 2.45 0.06 0.62 0.00 0.54 -4.83 107.32 105.25 1tls s GLY 15 Ca 0.01 0.49 0.03 0.00 0.00 0.00 0.00 44.72 45.25 1tls s GLY 15 CO 0.00 0.79 0.03 -1.59 0.00 0.00 0.00 173.10 172.33 1tls s THR 16 N -2.08 4.26 0.15 0.90 2.01 -0.81 -4.78 115.64 115.29 1tls s THR 16 Ca 0.64 -0.80 -0.30 0.00 0.31 0.00 0.00 61.69 61.54 1tls s THR 16 Cb -0.12 -3.00 -0.07 0.00 0.01 0.00 0.00 72.50 69.31 1tls s THR 16 CO 0.16 0.19 1.08 -1.10 -0.69 0.00 0.00 174.62 174.27 1tls s GLN 17 N -2.14 4.59 0.02 4.92 -0.21 -1.26 -1.50 119.66 124.08 1tls s GLN 17 Ca 0.25 1.67 0.01 0.00 0.02 0.00 0.00 55.36 57.32 1tls s GLN 17 Cb -0.12 -3.31 -0.01 0.00 1.00 0.00 0.00 33.01 30.57 1tls s GLN 17 CO 0.18 0.06 -0.05 0.15 -2.12 0.00 0.00 175.29 173.51 1tls s LYS 18 N -0.13 0.39 0.45 2.91 1.02 -0.42 -4.96 119.74 119.01 1tls s LYS 18 Ca 0.50 -0.47 -0.09 0.00 0.02 0.00 0.00 55.97 55.94 1tls s LYS 18 Cb -0.28 -0.22 -0.05 0.00 -0.52 0.00 0.00 37.83 36.76 1tls s LYS 18 CO 0.33 0.04 0.80 -0.80 -0.92 0.00 0.00 175.35 174.81 1tls s ASN 19 N -0.92 6.41 0.19 2.83 0.01 -1.26 -0.52 114.94 121.67 1tls s ASN 19 Ca -0.06 1.09 -0.06 0.00 -0.71 0.00 0.00 52.86 53.13 1tls s ASN 19 Cb -0.06 -2.31 -0.02 0.00 0.41 0.00 0.00 41.25 39.26 1tls s ASN 19 CO -0.00 -0.50 0.23 1.51 -1.51 0.00 0.00 177.10 176.83 1tls s ASP 20 N -3.57 0.10 0.30 -1.22 -4.77 -1.26 -4.80 116.67 101.45 1tls s ASP 20 Ca 0.50 -1.13 0.05 0.00 -3.30 0.00 0.00 52.55 48.67 1tls s ASP 20 Cb -0.10 0.42 0.76 0.00 -1.09 0.00 0.00 42.92 42.91 1tls s ASP 20 CO 0.38 -0.90 1.68 -0.09 0.70 0.00 0.00 175.17 176.94 1tls h ARG 21 N 2.57 0.34 0.00 2.11 2.43 -1.98 -0.86 114.38 118.99 1tls h ARG 21 Ca -0.33 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 1tls h ARG 21 Cb 1.24 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1tls h ARG 21 CO 0.49 0.23 0.00 0.25 -1.51 0.00 0.00 179.97 179.43 1tls n THR 22 N -5.08 0.26 -1.72 0.20 -2.24 -1.26 -4.89 114.28 99.54 1tls n THR 22 Ca 0.23 0.06 -0.18 0.00 -2.27 0.00 0.00 64.05 61.90 1tls n THR 22 Cb 0.70 -0.73 -0.06 0.00 -2.10 0.00 0.00 70.33 68.14 1tls n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tls n GLY 23 N 0.40 1.22 0.13 3.38 0.00 -0.33 -4.84 105.19 105.14 1tls n GLY 23 Ca 0.12 -0.16 -0.20 0.00 0.00 0.00 0.00 46.02 45.78 1tls n GLY 23 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1tls n THR 24 N -2.87 1.72 0.00 2.61 -1.04 -1.26 -4.94 114.28 108.49 1tls n THR 24 Ca -0.19 -0.66 0.00 0.00 -2.04 0.00 0.00 64.05 61.17 1tls n THR 24 Cb 0.60 -1.61 0.00 0.00 -1.82 0.00 0.00 70.33 67.51 1tls n THR 24 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1tls n GLY 25 N 2.00 -0.10 3.45 3.41 0.00 -1.26 -4.57 105.19 108.12 1tls n GLY 25 Ca -0.33 -1.38 -0.22 0.00 0.00 0.00 0.00 46.02 44.09 1tls n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tls s THR 26 N -1.30 0.75 -0.25 2.61 -4.23 0.32 0.47 115.64 114.00 1tls s THR 26 Ca 0.00 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.53 1tls s THR 26 Cb 0.00 -2.54 0.06 0.00 1.34 0.00 0.00 72.50 71.36 1tls s THR 26 CO 0.00 0.00 -0.09 -0.22 -0.54 0.00 0.00 174.62 173.77 1tls s LEU 27 N -3.51 3.07 0.15 4.79 1.98 -0.34 -1.29 118.68 123.53 1tls s LEU 27 Ca 0.31 -1.30 0.08 0.00 -2.89 0.00 0.00 54.13 50.32 1tls s LEU 27 Cb 0.05 -1.39 -0.04 0.00 0.66 0.00 0.00 46.19 45.47 1tls s LEU 27 CO 0.15 -0.21 -0.17 -0.94 -1.89 0.00 0.00 176.35 173.29 1tls s SER 28 N 1.23 2.47 0.28 3.68 1.04 -0.56 -0.99 113.70 120.84 1tls s SER 28 Ca -0.08 -0.84 0.07 0.00 0.48 0.00 0.00 55.95 55.58 1tls s SER 28 Cb -0.19 -0.13 -0.06 0.00 0.10 0.00 0.00 66.02 65.74 1tls s SER 28 CO -0.06 -0.07 -0.08 0.27 0.98 0.00 0.00 173.24 174.29 1tls s ILE 29 N -2.06 1.75 -0.13 -1.02 -4.36 -0.18 -1.93 121.20 113.26 1tls s ILE 29 Ca 0.13 -2.15 -0.01 0.00 -0.26 0.00 0.00 60.65 58.36 1tls s ILE 29 Cb -0.06 -2.42 0.03 0.00 1.25 0.00 0.00 42.46 41.26 1tls s ILE 29 CO 0.05 -0.32 -0.06 0.12 0.24 0.00 0.00 174.94 174.98 1tls s PHE 30 N -2.95 1.48 0.00 1.37 5.36 -1.26 -1.70 117.98 120.28 1tls s PHE 30 Ca 0.29 -0.83 0.00 0.00 -0.96 0.00 0.00 56.93 55.43 1tls s PHE 30 Cb 0.03 -1.22 0.00 0.00 -0.34 0.00 0.00 43.02 41.49 1tls s PHE 30 CO 0.12 -0.54 0.00 0.41 -1.46 0.00 0.00 175.22 173.75 1tls n GLY 31 N 4.94 -1.90 3.38 13.12 0.00 -1.04 -5.02 105.19 118.66 1tls n GLY 31 Ca -0.12 -0.85 -0.10 0.00 0.00 0.00 0.00 46.02 44.96 1tls n GLY 31 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1tls s HIS 32 N 0.00 0.10 -0.28 1.61 2.46 -1.12 -4.95 115.29 113.11 1tls s HIS 32 Ca 0.00 -0.46 -0.20 0.00 0.47 0.00 0.00 55.06 54.87 1tls s HIS 32 Cb 0.00 0.14 0.09 0.00 -0.13 0.00 0.00 32.58 32.67 1tls s HIS 32 CO 0.00 -0.76 0.75 -1.14 -2.47 0.00 0.00 174.74 171.13 1tls s GLN 33 N -3.90 0.71 0.01 2.88 0.74 -1.26 -1.46 119.66 117.38 1tls s GLN 33 Ca 0.11 1.05 -0.02 0.00 0.05 0.00 0.00 55.36 56.55 1tls s GLN 33 Cb 0.02 0.24 -0.01 0.00 1.10 0.00 0.00 33.01 34.36 1tls s GLN 33 CO -0.04 -0.12 0.02 0.00 -0.55 0.00 0.00 175.29 174.60 1tls s MET 34 N 1.04 0.27 -0.05 1.67 0.23 -0.61 -5.01 119.30 116.84 1tls s MET 34 Ca -0.05 -0.39 0.05 0.00 -1.03 0.00 0.00 55.69 54.27 1tls s MET 34 Cb -0.05 0.10 -0.02 0.00 -1.53 0.00 0.00 34.83 33.33 1tls s MET 34 CO -0.11 -0.05 -0.21 0.50 -2.03 0.00 0.00 175.02 173.12 1tls s ARG 35 N -1.04 2.44 -0.16 3.16 3.52 -1.26 -0.20 118.95 125.41 1tls s ARG 35 Ca -0.11 -0.83 0.00 0.00 -0.13 0.00 0.00 55.73 54.66 1tls s ARG 35 Cb -0.07 -2.23 0.03 0.00 -1.56 0.00 0.00 34.95 31.12 1tls s ARG 35 CO -0.00 0.51 -0.11 -0.06 -0.81 0.00 0.00 175.30 174.83 1tls s PHE 36 N -0.48 2.11 -0.44 5.12 0.40 0.17 -4.97 117.98 119.89 1tls s PHE 36 Ca 0.06 -1.26 -0.26 0.00 -0.60 0.00 0.00 56.93 54.87 1tls s PHE 36 Cb -0.12 -1.54 0.02 0.00 0.51 0.00 0.00 43.02 41.90 1tls s PHE 36 CO 0.01 -0.67 0.97 1.21 0.70 0.00 0.00 175.22 177.45 1tls s ASN 37 N 1.50 6.58 0.00 1.36 3.04 -1.26 0.21 114.94 126.36 1tls s ASN 37 Ca 0.03 0.32 0.05 0.00 0.04 0.00 0.00 52.86 53.29 1tls s ASN 37 Cb -0.14 -2.48 0.22 0.00 -1.54 0.00 0.00 41.25 37.32 1tls s ASN 37 CO -0.09 -1.04 1.04 0.18 -3.04 0.00 0.00 177.10 174.14 1tls n LEU 38 N 7.21 0.00 0.09 3.21 4.77 -0.20 -1.41 117.00 130.66 1tls n LEU 38 Ca 0.08 0.36 0.12 0.00 -0.03 0.00 0.00 56.01 56.53 1tls n LEU 38 Cb 0.48 -0.36 0.07 0.00 -2.33 0.00 0.00 43.42 41.29 1tls n LEU 38 CO 0.64 -0.30 0.16 1.56 -1.33 0.00 0.00 177.39 178.12 1tls h GLN 39 N 0.00 0.00 -0.02 3.23 4.20 -1.83 -3.33 115.11 117.36 1tls h GLN 39 Ca 0.00 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.57 1tls h GLN 39 Cb 0.06 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 1tls h GLN 39 CO 0.00 0.00 -0.64 -0.44 -0.67 0.00 0.00 178.83 177.08 1tls h ASP 40 N 0.00 0.10 -0.31 1.46 3.32 -1.63 -3.49 116.42 115.88 1tls h ASP 40 Ca 0.00 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1tls h ASP 40 Cb 0.89 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1tls h ASP 40 CO 0.00 0.71 0.00 0.61 -1.72 0.00 0.00 179.24 178.84 1tls n GLY 41 N 0.31 0.02 3.68 2.75 0.00 -1.25 -4.87 105.19 105.82 1tls n GLY 41 Ca -0.02 -1.31 -0.41 0.00 0.00 0.00 0.00 46.02 44.28 1tls n GLY 41 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1tls s PHE 42 N -1.94 3.45 -0.74 1.61 5.36 -0.13 -4.58 117.98 121.01 1tls s PHE 42 Ca 0.00 1.16 -0.11 0.00 -0.96 0.00 0.00 56.93 57.03 1tls s PHE 42 Cb 0.00 -2.89 -0.09 0.00 -0.34 0.00 0.00 43.02 39.70 1tls s PHE 42 CO 0.00 -0.13 1.91 -0.35 -1.46 0.00 0.00 175.22 175.20 1tls n PRO 43 N 4.76 1.61 -3.98 10.12 -0.04 -1.26 -3.80 135.00 142.41 1tls n PRO 43 Ca 0.01 -1.45 -0.35 0.00 -0.04 0.00 0.00 63.50 61.67 1tls n PRO 43 Cb 0.50 -2.54 -0.11 0.00 -0.04 0.00 0.00 33.50 31.31 1tls n PRO 43 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1tls s LEU 44 N 0.40 3.58 0.13 1.53 2.96 -1.26 -4.03 118.68 121.99 1tls s LEU 44 Ca 0.41 -0.06 -0.34 0.00 -0.22 0.00 0.00 54.13 53.92 1tls s LEU 44 Cb 0.10 -1.92 -0.13 0.00 0.50 0.00 0.00 46.19 44.74 1tls s LEU 44 CO 0.03 0.09 1.65 0.52 -1.32 0.00 0.00 176.35 177.32 1tls n VAL 45 N 4.08 0.11 0.42 1.68 0.31 -1.26 -4.71 118.33 118.95 1tls n VAL 45 Ca -0.16 -0.02 0.08 0.00 -0.01 0.00 0.00 64.34 64.22 1tls n VAL 45 Cb 0.52 -1.67 -0.10 0.00 -0.91 0.00 0.00 33.84 31.68 1tls n VAL 45 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1tls n THR 46 N 3.79 0.00 1.24 2.52 -2.24 -1.26 -4.32 114.28 114.01 1tls n THR 46 Ca 0.18 -0.23 0.03 0.00 -2.27 0.00 0.00 64.05 61.76 1tls n THR 46 Cb 0.30 0.64 0.10 0.00 -2.10 0.00 0.00 70.33 69.27 1tls n THR 46 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1tls n THR 47 N -1.65 0.33 -3.63 4.28 -2.24 -1.26 -0.36 114.28 109.75 1tls n THR 47 Ca 0.00 -0.29 -0.12 0.00 -2.27 0.00 0.00 64.05 61.37 1tls n THR 47 Cb 0.31 0.09 -0.07 0.00 -2.10 0.00 0.00 70.33 68.56 1tls n THR 47 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1tls s LYS 48 N -1.70 0.68 0.07 -0.78 2.20 -1.26 -4.60 119.74 114.36 1tls s LYS 48 Ca 0.14 0.75 -0.31 0.00 -0.36 0.00 0.00 55.97 56.20 1tls s LYS 48 Cb 0.08 0.33 -0.06 0.00 -1.51 0.00 0.00 37.83 36.67 1tls s LYS 48 CO 0.09 -0.09 1.30 0.50 -0.36 0.00 0.00 175.35 176.79 1tls s ARG 49 N 0.19 4.36 0.11 4.03 3.52 -1.09 -4.65 118.95 125.43 1tls s ARG 49 Ca 0.01 1.91 0.04 0.00 -0.13 0.00 0.00 55.73 57.56 1tls s ARG 49 Cb -0.05 -3.35 -0.04 0.00 -1.56 0.00 0.00 34.95 29.95 1tls s ARG 49 CO -0.02 -0.38 0.10 0.00 -0.81 0.00 0.00 175.30 174.19 1tls s HIS 51 N -1.54 3.67 0.33 0.00 2.46 -1.26 -4.90 115.29 114.06 1tls s HIS 51 Ca 0.30 -1.95 0.06 0.00 0.47 0.00 0.00 55.06 53.94 1tls s HIS 51 Cb -0.11 -3.95 0.70 0.00 -0.13 0.00 0.00 32.58 29.09 1tls s HIS 51 CO 0.23 -1.12 1.89 -0.07 -2.47 0.00 0.00 174.74 173.19 1tls h LEU 52 N 8.35 0.75 -0.67 8.88 3.38 -1.99 -2.20 115.31 131.81 1tls h LEU 52 Ca 0.14 0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.23 1tls h LEU 52 Cb 1.01 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 41.56 1tls h LEU 52 CO 0.89 0.42 0.30 -0.09 0.09 0.00 0.00 178.44 180.06 1tls h ARG 53 N 0.82 0.51 -0.33 1.13 2.43 -2.00 -0.99 114.38 115.95 1tls h ARG 53 Ca 0.42 -0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 59.39 1tls h ARG 53 Cb 0.50 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.93 1tls h ARG 53 CO -0.19 0.34 -0.45 0.77 -1.51 0.00 0.00 179.97 178.93 1tls h SER 54 N 0.53 0.93 0.41 -3.80 0.02 -1.80 -2.47 113.55 107.38 1tls h SER 54 Ca 0.33 -0.45 -0.02 0.00 -0.84 0.00 0.00 61.79 60.81 1tls h SER 54 Cb 0.37 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.65 1tls h SER 54 CO -0.28 1.24 -0.20 0.40 -1.14 0.00 0.00 176.83 176.85 1tls h ILE 55 N 0.69 0.59 -0.34 3.27 2.04 -0.98 -2.50 117.51 120.27 1tls h ILE 55 Ca 0.04 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1tls h ILE 55 Cb 1.04 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1tls h ILE 55 CO 0.10 0.03 0.17 0.40 0.00 0.00 0.00 178.15 178.86 1tls h ILE 56 N -0.65 1.15 -0.95 -0.67 2.04 -1.27 -2.88 117.51 114.29 1tls h ILE 56 Ca -0.06 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.38 1tls h ILE 56 Cb 0.48 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 37.32 1tls h ILE 56 CO 0.09 0.16 0.59 0.45 0.00 0.00 0.00 178.15 179.44 1tls h HIS 57 N 0.42 1.23 -0.26 1.37 3.86 -1.49 -0.71 115.15 119.56 1tls h HIS 57 Ca 0.12 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.32 1tls h HIS 57 Cb 0.09 -0.41 -0.01 0.00 1.06 0.00 0.00 27.41 28.14 1tls h HIS 57 CO -0.02 0.80 0.12 1.49 0.86 0.00 0.00 177.93 181.18 1tls h GLU 58 N 1.30 0.39 -0.55 2.45 4.81 -1.33 -2.10 114.58 119.54 1tls h GLU 58 Ca 0.34 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.42 1tls h GLU 58 Cb -0.09 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.21 1tls h GLU 58 CO -0.07 0.40 0.01 1.25 -0.73 0.00 0.00 179.01 179.87 1tls h LEU 59 N 0.28 0.91 -1.35 1.64 5.85 -1.23 -1.21 115.31 120.20 1tls h LEU 59 Ca 0.09 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 1tls h LEU 59 Cb 0.15 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1tls h LEU 59 CO -0.01 0.96 0.23 -0.07 -0.34 0.00 0.00 178.44 179.22 1tls h LEU 60 N 0.87 0.60 -0.42 2.25 3.38 -1.02 -1.03 115.31 119.95 1tls h LEU 60 Ca 0.16 -0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.96 1tls h LEU 60 Cb 0.50 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1tls h LEU 60 CO 0.02 0.51 -0.22 -0.25 0.09 0.00 0.00 178.44 178.60 1tls h TRP 61 N 0.68 1.02 0.47 1.13 7.01 -0.80 -2.28 115.95 123.18 1tls h TRP 61 Ca 0.17 -0.26 -0.02 0.00 2.11 0.00 0.00 58.89 60.89 1tls h TRP 61 Cb 0.07 -0.23 0.00 0.00 -2.10 0.00 0.00 29.16 26.90 1tls h TRP 61 CO 0.01 1.05 -0.24 0.74 -2.79 0.00 0.00 178.44 177.20 1tls h PHE 62 N 0.70 -0.63 -0.03 2.65 0.04 -0.42 -3.00 116.94 116.25 1tls h PHE 62 Ca 0.09 -0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.86 1tls h PHE 62 Cb 0.79 0.21 -0.00 0.00 2.20 0.00 0.00 35.95 39.15 1tls h PHE 62 CO 0.06 -0.39 0.03 -0.07 -0.60 0.00 0.00 178.31 177.34 1tls h LEU 63 N -0.66 0.00 -0.52 1.54 3.38 -1.14 -1.79 115.31 116.12 1tls h LEU 63 Ca -0.06 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.83 1tls h LEU 63 Cb 0.52 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1tls h LEU 63 CO 0.09 0.00 -0.38 1.56 0.09 0.00 0.00 178.44 179.80 1tls h GLN 64 N 0.00 0.00 0.00 1.13 4.20 -1.27 -3.47 115.11 115.69 1tls h GLN 64 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1tls h GLN 64 Cb 0.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.86 1tls h GLN 64 CO -0.00 0.38 0.00 0.41 -0.67 0.00 0.00 178.83 178.95 1tls n GLY 65 N 0.70 0.77 3.83 3.46 0.00 -0.67 -5.07 105.19 108.21 1tls n GLY 65 Ca 0.01 -0.55 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 1tls n GLY 65 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tls s ASP 66 N -2.52 6.97 -0.03 1.61 -1.08 -1.17 -3.83 116.67 116.63 1tls s ASP 66 Ca 0.00 1.29 0.04 0.00 -0.52 0.00 0.00 52.55 53.36 1tls s ASP 66 Cb 0.00 -2.37 0.06 0.00 -1.46 0.00 0.00 42.92 39.15 1tls s ASP 66 CO 0.00 0.06 0.93 0.35 0.52 0.00 0.00 175.17 177.03 1tls n THR 67 N 0.75 0.45 -5.02 1.71 -2.24 -1.26 -4.30 114.28 104.38 1tls n THR 67 Ca -0.03 -0.53 -0.32 0.00 -2.27 0.00 0.00 64.05 60.90 1tls n THR 67 Cb 0.51 0.45 -0.14 0.00 -2.10 0.00 0.00 70.33 69.05 1tls n THR 67 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1tls s ASN 68 N -1.18 3.61 0.00 3.42 3.84 -1.26 -1.47 114.94 121.90 1tls s ASN 68 Ca 0.06 -0.34 0.24 0.00 0.21 0.00 0.00 52.86 53.03 1tls s ASN 68 Cb 0.06 -0.61 1.01 0.00 -0.55 0.00 0.00 41.25 41.15 1tls s ASN 68 CO 0.01 0.32 1.75 2.30 -2.79 0.00 0.00 177.10 178.69 1tls n ILE 69 N 2.24 0.38 -0.18 -5.21 -5.35 -0.17 -4.09 119.36 106.99 1tls n ILE 69 Ca -0.17 0.09 -0.03 0.00 -0.27 0.00 0.00 62.75 62.38 1tls n ILE 69 Cb 0.52 -0.69 0.04 0.00 -1.74 0.00 0.00 39.64 37.76 1tls n ILE 69 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1tls h ALA 70 N 2.82 0.25 -0.39 -1.28 0.00 -1.92 0.34 119.26 119.08 1tls h ALA 70 Ca 0.00 0.20 0.06 0.00 0.00 0.00 0.00 54.91 55.17 1tls h ALA 70 Cb 0.40 0.51 -0.05 0.00 0.00 0.00 0.00 17.79 18.65 1tls h ALA 70 CO 0.00 -0.50 0.09 -0.92 0.00 0.00 0.00 179.25 177.92 1tls h TYR 71 N -0.06 0.15 -0.61 0.00 3.20 -2.00 -0.44 116.97 117.22 1tls h TYR 71 Ca 0.26 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 1tls h TYR 71 Cb 0.45 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.69 1tls h TYR 71 CO -0.50 0.03 0.35 -0.07 -1.64 0.00 0.00 178.16 176.33 1tls h LEU 72 N 0.22 0.73 0.32 2.82 3.38 -0.97 -3.03 115.31 118.78 1tls h LEU 72 Ca 0.18 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1tls h LEU 72 Cb 0.21 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1tls h LEU 72 CO -0.23 0.57 -0.15 0.45 0.09 0.00 0.00 178.44 179.17 1tls h HIS 73 N 0.84 -0.39 -1.20 1.13 3.86 0.69 0.33 115.15 120.39 1tls h HIS 73 Ca 0.22 -0.01 0.35 0.00 -1.16 0.00 0.00 60.37 59.77 1tls h HIS 73 Cb -0.01 0.13 -0.05 0.00 1.06 0.00 0.00 27.41 28.54 1tls h HIS 73 CO 0.00 -0.10 0.97 0.93 0.86 0.00 0.00 177.93 180.60 1tls h GLU 74 N -0.68 0.00 -0.48 2.45 5.08 -1.01 0.33 114.58 120.27 1tls h GLU 74 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1tls h GLU 74 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1tls h GLU 74 CO 0.07 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.17 1tls n ASN 75 N -3.90 3.29 -2.92 1.42 4.13 -1.17 -4.98 115.26 111.13 1tls n ASN 75 Ca 0.26 -1.98 -0.20 0.00 1.68 0.00 0.00 54.58 54.34 1tls n ASN 75 Cb 1.36 -0.32 0.05 0.00 -1.54 0.00 0.00 39.78 39.33 1tls n ASN 75 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1tls n ASN 76 N 0.98 -5.63 -4.25 6.41 3.02 0.11 -5.00 115.26 110.90 1tls n ASN 76 Ca 0.16 -0.38 -0.34 0.00 -0.03 0.00 0.00 54.58 54.00 1tls n ASN 76 Cb 0.50 -4.32 -0.15 0.00 -0.61 0.00 0.00 39.78 35.20 1tls n ASN 76 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1tls s VAL 77 N -3.20 2.73 -0.12 2.41 1.01 0.11 -4.98 120.40 118.36 1tls s VAL 77 Ca 0.41 -0.73 0.14 0.00 0.00 0.00 0.00 61.98 61.80 1tls s VAL 77 Cb -0.18 -2.18 0.31 0.00 0.00 0.00 0.00 36.38 34.34 1tls s VAL 77 CO 0.50 0.50 1.15 0.35 0.00 0.00 0.00 175.10 177.61 1tls n THR 78 N 4.35 1.43 0.33 3.92 -2.24 -1.26 -3.77 114.28 117.02 1tls n THR 78 Ca -0.19 -2.07 0.15 0.00 -2.27 0.00 0.00 64.05 59.66 1tls n THR 78 Cb 0.51 0.06 0.64 0.00 -2.10 0.00 0.00 70.33 69.44 1tls n THR 78 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 1tls h ILE 79 N 2.48 0.00 -0.11 2.28 3.07 -1.95 -3.19 117.51 120.08 1tls h ILE 79 Ca -0.03 -0.32 0.00 0.00 1.55 0.00 0.00 64.86 66.06 1tls h ILE 79 Cb 1.20 1.17 0.00 0.00 -0.27 0.00 0.00 36.82 38.92 1tls h ILE 79 CO 0.02 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 177.91 1tls n TRP 80 N -2.67 0.13 -0.22 0.16 7.02 -1.26 -4.72 117.44 115.88 1tls n TRP 80 Ca 0.01 -0.16 0.03 0.00 -1.02 0.00 0.00 57.50 56.36 1tls n TRP 80 Cb 0.24 -0.01 0.14 0.00 -2.42 0.00 0.00 31.31 29.26 1tls n TRP 80 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1tls h ASP 81 N 1.88 0.03 0.15 -0.99 5.19 -1.91 -2.77 116.42 118.01 1tls h ASP 81 Ca 0.00 0.12 0.00 0.00 -0.62 0.00 0.00 57.03 56.53 1tls h ASP 81 Cb 0.50 0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.18 1tls h ASP 81 CO 0.00 0.00 0.00 -0.33 -3.12 0.00 0.00 179.24 175.79 1tls h GLU 82 N 0.28 0.00 0.00 3.56 3.07 -1.84 -2.83 114.58 116.82 1tls h GLU 82 Ca 0.36 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 1tls h GLU 82 Cb 0.57 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.48 1tls h GLU 82 CO -0.44 0.00 -0.79 0.91 -1.40 0.00 0.00 179.01 177.29 1tls n TRP 83 N -2.70 0.00 -2.47 4.33 8.01 -1.05 -4.99 117.44 118.57 1tls n TRP 83 Ca -0.02 0.00 -0.40 0.00 -1.31 0.00 0.00 57.50 55.77 1tls n TRP 83 Cb 0.09 -0.05 -0.04 0.00 -2.01 0.00 0.00 31.31 29.30 1tls n TRP 83 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1tls s ALA 84 N -2.37 3.37 1.03 6.99 0.00 -1.07 -4.81 121.76 124.90 1tls s ALA 84 Ca 0.03 0.88 -0.09 0.00 0.00 0.00 0.00 51.96 52.79 1tls s ALA 84 Cb 0.10 -3.32 0.12 0.00 0.00 0.00 0.00 23.12 20.01 1tls s ALA 84 CO 0.55 -0.18 0.62 -0.40 0.00 0.00 0.00 175.76 176.35 1tls n ASP 85 N 1.02 -0.36 0.28 0.00 5.68 -0.61 -4.86 116.55 117.71 1tls n ASP 85 Ca -0.00 -1.13 0.14 0.00 -0.50 0.00 0.00 54.79 53.29 1tls n ASP 85 Cb 0.45 -0.49 0.83 0.00 -1.14 0.00 0.00 41.12 40.77 1tls n ASP 85 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1tls h GLU 86 N 0.00 0.00 -0.01 0.11 3.07 -1.97 -2.36 114.58 113.42 1tls h GLU 86 Ca -0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.65 1tls h GLU 86 Cb 0.59 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.50 1tls h GLU 86 CO 0.14 0.04 -0.48 0.09 -1.40 0.00 0.00 179.01 177.40 1tls n ASN 87 N -3.88 1.40 0.00 1.42 5.03 -1.26 -4.96 115.26 113.01 1tls n ASN 87 Ca -0.03 -1.11 0.00 0.00 0.87 0.00 0.00 54.58 54.31 1tls n ASN 87 Cb 0.12 0.42 0.00 0.00 -1.02 0.00 0.00 39.78 39.30 1tls n ASN 87 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1tls n GLY 88 N 1.41 0.71 3.79 7.41 0.00 -0.89 -4.90 105.19 112.73 1tls n GLY 88 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 1tls n GLY 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tls s ASP 89 N -2.24 7.24 0.00 1.61 1.01 -1.26 -1.00 116.67 122.04 1tls s ASP 89 Ca 0.00 1.57 0.10 0.00 0.71 0.00 0.00 52.55 54.93 1tls s ASP 89 Cb 0.00 -2.47 -0.05 0.00 1.01 0.00 0.00 42.92 41.40 1tls s ASP 89 CO 0.00 0.11 0.53 0.18 0.21 0.00 0.00 175.17 176.19 1tls n LEU 90 N 1.13 0.85 0.00 1.23 4.77 -0.54 -1.58 117.00 122.85 1tls n LEU 90 Ca -0.04 -0.64 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 1tls n LEU 90 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1tls n LEU 90 CO 0.45 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 1tls n GLY 91 N 1.06 -3.07 2.49 -0.72 0.00 -1.26 -0.27 105.19 103.42 1tls n GLY 91 Ca 0.03 -1.78 -0.01 0.00 0.00 0.00 0.00 46.02 44.26 1tls n GLY 91 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1tls n PRO 92 N -0.52 0.20 0.00 1.61 -0.05 -1.26 -4.83 135.00 130.16 1tls n PRO 92 Ca 0.00 -0.14 0.00 0.00 -0.05 0.00 0.00 63.50 63.31 1tls n PRO 92 Cb 0.00 -1.59 0.00 0.00 -0.05 0.00 0.00 33.50 31.86 1tls n PRO 92 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 175.50 176.78 1tls n VAL 93 N 3.10 0.00 -0.18 0.52 0.24 -1.26 -4.39 118.33 116.36 1tls n VAL 93 Ca 0.04 0.00 -0.05 0.00 -2.04 0.00 0.00 64.34 62.30 1tls n VAL 93 Cb 0.08 -1.11 -0.04 0.00 -1.47 0.00 0.00 33.84 31.30 1tls n VAL 93 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1tls n TYR 94 N -0.44 -0.19 -0.26 6.34 4.01 -1.26 -2.05 117.16 123.30 1tls n TYR 94 Ca 0.00 0.53 0.06 0.00 -0.16 0.00 0.00 57.90 58.33 1tls n TYR 94 Cb 0.00 -0.47 0.30 0.00 -0.31 0.00 0.00 39.34 38.86 1tls n TYR 94 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1tls h GLY 95 N 0.00 1.20 1.19 2.72 0.00 -1.75 0.14 103.07 106.57 1tls h GLY 95 Ca 0.07 -0.36 -0.21 0.00 0.00 0.00 0.00 47.33 46.82 1tls h GLY 95 CO -0.40 0.23 -0.72 1.70 0.00 0.00 0.00 176.54 177.35 1tls h LYS 96 N 0.88 0.81 -0.21 4.80 3.11 -1.52 -2.64 116.57 121.81 1tls h LYS 96 Ca 0.38 -0.62 -0.06 0.00 -2.81 0.00 0.00 60.65 57.55 1tls h LYS 96 Cb 0.33 0.12 -0.01 0.00 -1.00 0.00 0.00 32.23 31.68 1tls h LYS 96 CO -0.15 1.23 -0.09 1.96 -2.81 0.00 0.00 179.45 179.59 1tls h GLN 97 N 0.57 0.44 -0.83 1.90 1.08 -0.99 1.06 115.11 118.34 1tls h GLN 97 Ca -0.04 -0.19 -0.04 0.00 -1.45 0.00 0.00 58.65 56.94 1tls h GLN 97 Cb 1.34 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.72 1tls h GLN 97 CO 0.15 0.72 0.38 -1.49 -0.95 0.00 0.00 178.83 177.64 1tls h TRP 98 N 0.14 1.22 0.00 2.96 4.06 -0.82 -3.05 115.95 120.45 1tls h TRP 98 Ca 0.05 -0.07 0.00 0.00 2.06 0.00 0.00 58.89 60.93 1tls h TRP 98 Cb 0.58 -0.37 0.00 0.00 -1.00 0.00 0.00 29.16 28.37 1tls h TRP 98 CO 0.06 0.89 -1.74 0.54 -3.56 0.00 0.00 178.44 174.63 1tls n ARG 99 N -4.30 0.61 -2.78 0.49 5.12 -0.99 -0.22 116.66 114.58 1tls n ARG 99 Ca 0.08 -0.15 -0.10 0.00 -1.93 0.00 0.00 57.85 55.75 1tls n ARG 99 Cb 0.15 -1.46 0.08 0.00 -1.16 0.00 0.00 32.46 30.07 1tls n ARG 99 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1tls n ALA 100 N -2.07 -0.48 -1.85 7.54 0.00 0.36 -3.84 120.51 120.17 1tls n ALA 100 Ca -0.02 -1.68 -0.42 0.00 0.00 0.00 0.00 53.44 51.32 1tls n ALA 100 Cb 0.48 -1.13 -0.03 0.00 0.00 0.00 0.00 19.45 18.77 1tls n ALA 100 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1tls s TRP 101 N -0.03 2.15 -0.10 0.00 -0.11 -0.98 -4.67 118.94 115.20 1tls s TRP 101 Ca 0.24 0.12 -0.30 0.00 1.22 0.00 0.00 56.10 57.38 1tls s TRP 101 Cb 0.30 -4.05 -0.02 0.00 -1.50 0.00 0.00 33.47 28.20 1tls s TRP 101 CO -0.05 -4.33 1.06 -1.25 -4.62 0.00 0.00 176.95 167.76 1tls s PRO 102 N 3.07 4.40 0.43 5.86 0.05 -1.26 -1.46 135.00 146.09 1tls s PRO 102 Ca 0.77 1.47 -0.02 0.00 0.05 0.00 0.00 61.00 63.27 1tls s PRO 102 Cb -0.41 -3.55 -0.03 0.00 0.05 0.00 0.00 34.50 30.56 1tls s PRO 102 CO 0.34 -0.37 0.69 0.95 0.05 0.00 0.00 177.00 178.66 1tls s THR 103 N 2.13 4.75 0.38 1.26 -4.23 -0.60 -5.00 115.64 114.33 1tls s THR 103 Ca 0.50 -0.17 0.33 0.00 -1.18 0.00 0.00 61.69 61.17 1tls s THR 103 Cb -0.20 -3.78 0.36 0.00 1.34 0.00 0.00 72.50 70.22 1tls s THR 103 CO 0.18 -0.64 2.11 1.55 -0.54 0.00 0.00 174.62 177.29 1tls h PRO 104 N 0.42 0.00 -1.09 3.99 0.14 -1.97 -3.21 132.00 130.28 1tls h PRO 104 Ca -0.48 0.00 -0.59 0.00 0.14 0.00 0.00 66.00 65.08 1tls h PRO 104 Cb 1.22 0.00 -0.26 0.00 0.14 0.00 0.00 31.00 32.10 1tls h PRO 104 CO 0.61 0.06 0.76 -0.40 0.14 0.00 0.00 178.00 179.17 1tls n ASP 105 N -3.34 6.90 0.00 1.44 5.68 -1.26 -4.89 116.55 121.08 1tls n ASP 105 Ca -0.01 -3.61 0.00 0.00 -0.50 0.00 0.00 54.79 50.66 1tls n ASP 105 Cb 0.22 -0.97 0.00 0.00 -1.14 0.00 0.00 41.12 39.24 1tls n ASP 105 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1tls n GLY 106 N -0.71 0.13 3.99 6.12 0.00 -1.21 -4.99 105.19 108.52 1tls n GLY 106 Ca 0.56 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.36 1tls n GLY 106 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tls s ARG 107 N -1.33 2.25 -0.10 1.61 0.52 -1.26 -4.94 118.95 115.70 1tls s ARG 107 Ca 0.00 -1.00 -0.04 0.00 -0.52 0.00 0.00 55.73 54.17 1tls s ARG 107 Cb 0.00 -2.47 0.05 0.00 0.52 0.00 0.00 34.95 33.06 1tls s ARG 107 CO 0.00 -0.94 0.21 -1.01 0.02 0.00 0.00 175.30 173.58 1tls s HIS 108 N -2.85 -0.29 -0.19 -0.53 3.76 -1.26 -1.56 115.29 112.36 1tls s HIS 108 Ca 0.61 0.76 -0.09 0.00 -0.15 0.00 0.00 55.06 56.18 1tls s HIS 108 Cb -0.08 -0.10 -0.05 0.00 1.11 0.00 0.00 32.58 33.46 1tls s HIS 108 CO 0.40 -0.28 0.11 0.42 -0.85 0.00 0.00 174.74 174.54 1tls s ILE 109 N 2.00 5.23 -0.57 0.60 -1.09 -0.54 -4.87 121.20 121.96 1tls s ILE 109 Ca -0.01 0.12 -0.21 0.00 -2.23 0.00 0.00 60.65 58.32 1tls s ILE 109 Cb -0.12 -3.37 0.07 0.00 -1.58 0.00 0.00 42.46 37.47 1tls s ILE 109 CO -0.07 0.46 0.77 -0.62 -1.23 0.00 0.00 174.94 174.25 1tls s ASP 110 N 0.26 6.22 0.36 3.58 -1.08 -1.25 -2.33 116.67 122.43 1tls s ASP 110 Ca 0.07 -1.00 0.15 0.00 -0.52 0.00 0.00 52.55 51.25 1tls s ASP 110 Cb -0.11 -2.34 0.69 0.00 -1.46 0.00 0.00 42.92 39.69 1tls s ASP 110 CO -0.01 -1.13 1.77 1.56 0.52 0.00 0.00 175.17 177.88 1tls h GLN 111 N 9.23 0.00 -0.21 4.34 4.20 -0.85 -2.35 115.11 129.47 1tls h GLN 111 Ca -0.28 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.22 1tls h GLN 111 Cb 1.08 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.87 1tls h GLN 111 CO 1.07 0.41 -0.68 0.82 -0.67 0.00 0.00 178.83 179.78 1tls h ILE 112 N 0.00 1.27 0.10 2.54 1.08 -1.89 -1.70 117.51 118.91 1tls h ILE 112 Ca -0.00 -1.87 -0.00 0.00 -0.39 0.00 0.00 64.86 62.59 1tls h ILE 112 Cb 0.79 1.83 0.00 0.00 -3.07 0.00 0.00 36.82 36.37 1tls h ILE 112 CO 0.05 0.60 -0.05 0.74 -0.69 0.00 0.00 178.15 178.81 1tls h THR 113 N 0.60 1.02 -0.08 -0.27 2.02 -1.86 -0.71 112.91 113.62 1tls h THR 113 Ca -0.02 -0.41 0.02 0.00 0.77 0.00 0.00 66.41 66.77 1tls h THR 113 Cb 1.31 1.28 -0.05 0.00 -1.74 0.00 0.00 68.15 68.94 1tls h THR 113 CO 0.15 0.10 -0.44 0.74 0.37 0.00 0.00 175.52 176.44 1tls h THR 114 N -0.31 0.00 -0.53 3.16 2.02 -1.43 0.99 112.91 116.81 1tls h THR 114 Ca -0.01 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.27 1tls h THR 114 Cb 0.26 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.57 1tls h THR 114 CO 0.02 0.00 -0.24 0.58 0.37 0.00 0.00 175.52 176.25 1tls h VAL 115 N -0.49 0.30 -0.52 3.16 2.07 -1.23 -0.91 116.25 118.63 1tls h VAL 115 Ca 0.02 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.63 1tls h VAL 115 Cb 0.56 0.30 -0.07 0.00 -1.52 0.00 0.00 31.29 30.55 1tls h VAL 115 CO -0.34 0.00 0.10 -0.07 0.02 0.00 0.00 177.57 177.29 1tls h LEU 116 N -0.12 -0.00 -0.97 2.57 3.38 -0.33 0.60 115.31 120.44 1tls h LEU 116 Ca 0.24 0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.26 1tls h LEU 116 Cb 0.50 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 1tls h LEU 116 CO -0.60 0.02 0.26 0.78 0.09 0.00 0.00 178.44 178.99 1tls h ASN 117 N 0.24 0.92 -0.19 -0.43 -0.26 0.26 -2.93 115.58 113.18 1tls h ASN 117 Ca 0.26 -0.14 -0.12 0.00 -0.56 0.00 0.00 56.30 55.75 1tls h ASN 117 Cb 0.36 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.37 1tls h ASN 117 CO -0.34 0.83 -0.30 1.56 -1.06 0.00 0.00 177.43 178.12 1tls h GLN 118 N 0.98 0.69 0.00 0.81 4.20 -0.20 -2.21 115.11 119.37 1tls h GLN 118 Ca 0.23 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1tls h GLN 118 Cb 0.21 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.97 1tls h GLN 118 CO -0.02 0.90 0.00 1.28 -0.67 0.00 0.00 178.83 180.32 1tls n LEU 119 N -4.08 0.53 -0.11 1.46 4.77 0.11 -1.49 117.00 118.19 1tls n LEU 119 Ca -0.01 0.62 -0.15 0.00 -0.03 0.00 0.00 56.01 56.45 1tls n LEU 119 Cb 0.47 -0.53 -0.11 0.00 -2.33 0.00 0.00 43.42 40.92 1tls n LEU 119 CO 0.45 -0.45 -1.21 0.29 -1.33 0.00 0.00 177.39 175.14 1tls n LYS 120 N -2.08 0.61 -0.01 3.23 5.02 -1.15 -4.51 118.16 119.27 1tls n LYS 120 Ca 0.03 0.12 0.07 0.00 -2.02 0.00 0.00 58.31 56.50 1tls n LYS 120 Cb 0.24 -1.45 -0.10 0.00 -0.02 0.00 0.00 35.03 33.71 1tls n LYS 120 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1tls n ASN 121 N -3.10 1.74 -2.81 4.39 3.02 -0.84 -4.79 115.26 112.86 1tls n ASN 121 Ca -0.38 -0.13 -0.10 0.00 -0.03 0.00 0.00 54.58 53.93 1tls n ASN 121 Cb 0.93 1.51 0.07 0.00 -0.61 0.00 0.00 39.78 41.68 1tls n ASN 121 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1tls n ASP 122 N -1.85 -1.44 0.00 6.41 2.03 -0.56 -4.98 116.55 116.16 1tls n ASP 122 Ca -0.02 -3.29 0.03 0.00 0.52 0.00 0.00 54.79 52.03 1tls n ASP 122 Cb 0.32 1.14 0.13 0.00 -0.72 0.00 0.00 41.12 41.99 1tls n ASP 122 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1tls n PRO 123 N 0.14 0.00 0.00 -0.67 -0.04 -0.67 -1.27 135.00 132.49 1tls n PRO 123 Ca 0.08 0.40 0.14 0.00 -0.04 0.00 0.00 63.50 64.07 1tls n PRO 123 Cb 0.73 -1.50 0.50 0.00 -0.04 0.00 0.00 33.50 33.19 1tls n PRO 123 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1tls n ASP 124 N -1.50 1.49 -4.77 3.54 8.00 -1.26 -3.93 116.55 118.12 1tls n ASP 124 Ca 0.01 -1.45 -0.40 0.00 0.71 0.00 0.00 54.79 53.67 1tls n ASP 124 Cb 0.07 0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 1tls n ASP 124 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1tls s SER 125 N -2.05 6.15 -0.18 -2.24 0.15 -0.40 -4.92 113.70 110.21 1tls s SER 125 Ca 0.36 2.80 0.16 0.00 0.70 0.00 0.00 55.95 59.96 1tls s SER 125 Cb 0.21 -2.65 0.64 0.00 -1.71 0.00 0.00 66.02 62.51 1tls s SER 125 CO 0.35 -0.98 1.55 0.54 1.20 0.00 0.00 173.24 175.91 1tls n ARG 126 N 0.04 3.72 -0.04 5.44 1.74 -1.26 -4.33 116.66 121.97 1tls n ARG 126 Ca 0.04 -2.92 0.03 0.00 -0.77 0.00 0.00 57.85 54.23 1tls n ARG 126 Cb 0.42 -1.97 0.05 0.00 -1.02 0.00 0.00 32.46 29.94 1tls n ARG 126 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1tls n ARG 127 N 0.13 2.16 -2.51 5.56 1.74 -1.26 -4.98 116.66 117.50 1tls n ARG 127 Ca 0.24 -1.78 -0.41 0.00 -0.77 0.00 0.00 57.85 55.13 1tls n ARG 127 Cb 0.97 -1.12 -0.01 0.00 -1.02 0.00 0.00 32.46 31.29 1tls n ARG 127 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1tls s ILE 128 N -1.52 4.04 0.03 0.55 1.01 -1.26 -4.93 121.20 119.12 1tls s ILE 128 Ca 0.10 -1.75 0.01 0.00 0.00 0.00 0.00 60.65 59.02 1tls s ILE 128 Cb 0.09 -5.11 -0.02 0.00 0.01 0.00 0.00 42.46 37.43 1tls s ILE 128 CO 0.01 -1.89 -0.06 -0.63 0.00 0.00 0.00 174.94 172.37 1tls s ILE 129 N 5.13 0.35 -0.07 2.92 1.01 -1.26 -0.97 121.20 128.32 1tls s ILE 129 Ca 0.56 -0.97 0.04 0.00 0.00 0.00 0.00 60.65 60.27 1tls s ILE 129 Cb 0.03 -0.45 0.00 0.00 0.01 0.00 0.00 42.46 42.06 1tls s ILE 129 CO 0.08 -0.41 -0.18 -0.69 0.00 0.00 0.00 174.94 173.74 1tls s VAL 130 N -1.36 1.54 -0.09 2.92 1.01 -0.68 -4.91 120.40 118.83 1tls s VAL 130 Ca -0.12 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.14 1tls s VAL 130 Cb -0.10 -1.35 0.01 0.00 0.00 0.00 0.00 36.38 34.95 1tls s VAL 130 CO -0.00 0.44 -0.17 -0.55 0.00 0.00 0.00 175.10 174.82 1tls s SER 131 N 0.30 2.36 0.00 3.32 0.15 -1.26 -0.12 113.70 118.45 1tls s SER 131 Ca -0.11 -0.41 0.23 0.00 0.70 0.00 0.00 55.95 56.35 1tls s SER 131 Cb -0.15 -1.08 0.06 0.00 -1.71 0.00 0.00 66.02 63.14 1tls s SER 131 CO 0.05 0.07 1.10 0.00 1.20 0.00 0.00 173.24 175.66 1tls n ALA 132 N 3.80 4.26 -1.58 5.45 0.00 -0.30 -4.65 120.51 127.50 1tls n ALA 132 Ca -0.21 -0.51 -0.42 0.00 0.00 0.00 0.00 53.44 52.30 1tls n ALA 132 Cb 0.52 -0.90 -0.01 0.00 0.00 0.00 0.00 19.45 19.06 1tls n ALA 132 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1tls n TRP 133 N -1.42 3.11 -3.17 0.00 -0.00 -1.11 -4.82 117.44 110.01 1tls n TRP 133 Ca 0.05 -2.71 -0.46 0.00 -0.00 0.00 0.00 57.50 54.38 1tls n TRP 133 Cb 0.34 -2.36 -0.03 0.00 -0.00 0.00 0.00 31.31 29.26 1tls n TRP 133 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.69 178.90 1tls s ASN 134 N 3.57 6.52 0.51 5.87 3.04 -1.26 -4.93 114.94 128.26 1tls s ASN 134 Ca 0.50 -2.11 0.31 0.00 0.04 0.00 0.00 52.86 51.60 1tls s ASN 134 Cb 0.14 -2.28 1.44 0.00 -1.54 0.00 0.00 41.25 39.01 1tls s ASN 134 CO -0.04 -0.87 1.84 0.58 -3.04 0.00 0.00 177.10 175.57 1tls h VAL 135 N 5.45 0.49 0.00 -5.21 2.07 -2.01 -1.21 116.25 115.83 1tls h VAL 135 Ca -0.03 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1tls h VAL 135 Cb 1.05 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1tls h VAL 135 CO 0.96 0.01 0.00 0.61 0.02 0.00 0.00 177.57 179.17 1tls n GLY 136 N -1.69 -1.42 0.00 2.17 0.00 -1.26 -3.82 105.19 99.17 1tls n GLY 136 Ca 0.22 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1tls n GLY 136 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1tls n GLU 137 N -2.08 -0.65 -0.32 1.61 1.02 -0.47 -4.76 120.64 114.99 1tls n GLU 137 Ca 0.04 -0.44 0.19 0.00 -0.02 0.00 0.00 57.16 56.93 1tls n GLU 137 Cb 0.31 -0.94 0.45 0.00 -0.02 0.00 0.00 31.44 31.24 1tls n GLU 137 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1tls h LEU 138 N 0.00 0.55 0.00 -4.62 3.38 -1.62 -0.61 115.31 112.38 1tls h LEU 138 Ca 0.00 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1tls h LEU 138 Cb 0.04 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1tls h LEU 138 CO 0.00 0.15 0.00 -0.90 0.09 0.00 0.00 178.44 177.78 1tls n ASP 139 N -4.66 0.00 -0.65 -0.43 5.75 -1.26 -2.15 116.55 113.15 1tls n ASP 139 Ca 0.24 0.19 0.08 0.00 -0.01 0.00 0.00 54.79 55.29 1tls n ASP 139 Cb 0.76 -0.36 0.07 0.00 -1.03 0.00 0.00 41.12 40.55 1tls n ASP 139 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1tls n LYS 140 N -1.36 1.26 -3.42 0.11 5.02 -0.24 -4.99 118.16 114.54 1tls n LYS 140 Ca 0.07 -1.47 -0.38 0.00 -2.02 0.00 0.00 58.31 54.51 1tls n LYS 140 Cb 0.17 -1.31 -0.06 0.00 -0.02 0.00 0.00 35.03 33.81 1tls n LYS 140 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1tls s MET 141 N -1.33 4.02 0.31 1.97 -1.94 -0.91 -4.12 119.30 117.30 1tls s MET 141 Ca 0.19 0.52 0.03 0.00 -1.71 0.00 0.00 55.69 54.72 1tls s MET 141 Cb 0.13 -3.23 0.62 0.00 2.01 0.00 0.00 34.83 34.36 1tls s MET 141 CO 0.20 0.66 1.87 0.00 -0.01 0.00 0.00 175.02 177.74 1tls h ALA 142 N 4.72 1.60 -2.53 3.03 0.00 -0.95 -3.43 119.26 121.71 1tls h ALA 142 Ca -0.51 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.30 1tls h ALA 142 Cb 1.22 -0.21 -0.21 0.00 0.00 0.00 0.00 17.79 18.59 1tls h ALA 142 CO 0.62 0.19 -0.19 -1.17 0.00 0.00 0.00 179.25 178.70 1tls s LEU 143 N -10.04 0.48 0.39 0.00 2.96 -1.26 -5.07 118.68 106.14 1tls s LEU 143 Ca -0.11 0.46 -0.23 0.00 -0.22 0.00 0.00 54.13 54.02 1tls s LEU 143 Cb 0.21 1.50 -0.10 0.00 0.50 0.00 0.00 46.19 48.31 1tls s LEU 143 CO 0.80 -0.35 0.98 0.00 -1.32 0.00 0.00 176.35 176.46 1tls s ALA 144 N -0.71 3.10 0.10 5.97 0.00 -1.26 -4.94 121.76 124.02 1tls s ALA 144 Ca -0.08 0.54 -0.36 0.00 0.00 0.00 0.00 51.96 52.06 1tls s ALA 144 Cb -0.04 -3.20 -0.16 0.00 0.00 0.00 0.00 23.12 19.72 1tls s ALA 144 CO 0.04 0.03 1.36 -2.30 0.00 0.00 0.00 175.76 174.89 1tls n PRO 145 N -0.09 1.31 -0.08 0.00 -0.02 -1.26 -4.92 135.00 129.94 1tls n PRO 145 Ca 0.05 0.47 -0.14 0.00 -2.02 0.00 0.00 63.50 61.86 1tls n PRO 145 Cb 0.51 -2.12 -0.10 0.00 -0.02 0.00 0.00 33.50 31.77 1tls n PRO 145 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tls s HIS 147 N -2.17 3.10 -0.91 0.00 0.00 -1.26 -0.46 115.29 113.59 1tls s HIS 147 Ca -0.19 -1.18 0.21 0.00 -3.00 0.00 0.00 55.06 50.91 1tls s HIS 147 Cb -0.00 -4.10 -0.20 0.00 -4.00 0.00 0.00 32.58 24.27 1tls s HIS 147 CO 0.55 -1.36 0.89 0.00 -1.00 0.00 0.00 174.74 173.82 1tls n ALA 148 N 6.24 4.52 -3.64 -1.38 0.00 -1.16 -4.78 120.51 120.31 1tls n ALA 148 Ca 0.04 -0.58 -0.08 0.00 0.00 0.00 0.00 53.44 52.82 1tls n ALA 148 Cb 0.45 -0.79 -0.07 0.00 0.00 0.00 0.00 19.45 19.05 1tls n ALA 148 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1tls s PHE 149 N -3.05 -0.51 0.04 0.00 2.19 -1.23 -1.15 117.98 114.27 1tls s PHE 149 Ca 0.07 1.18 -0.05 0.00 0.33 0.00 0.00 56.93 58.46 1tls s PHE 149 Cb 0.16 0.37 -0.02 0.00 -1.31 0.00 0.00 43.02 42.22 1tls s PHE 149 CO 0.86 -0.25 0.07 -0.59 1.83 0.00 0.00 175.22 177.15 1tls s PHE 150 N 0.44 0.24 -0.02 10.12 -0.71 0.84 -1.87 117.98 127.02 1tls s PHE 150 Ca 0.01 -0.58 0.01 0.00 -1.04 0.00 0.00 56.93 55.33 1tls s PHE 150 Cb -0.05 -0.17 0.01 0.00 -1.21 0.00 0.00 43.02 41.60 1tls s PHE 150 CO -0.08 -0.36 -0.03 -1.14 -1.34 0.00 0.00 175.22 172.27 1tls s GLN 151 N -2.75 0.40 0.39 1.99 0.74 -0.52 -1.69 119.66 118.22 1tls s GLN 151 Ca -0.04 -0.09 0.07 0.00 0.05 0.00 0.00 55.36 55.35 1tls s GLN 151 Cb -0.00 -0.43 0.00 0.00 1.10 0.00 0.00 33.01 33.67 1tls s GLN 151 CO -0.05 0.01 0.54 -0.06 -0.55 0.00 0.00 175.29 175.18 1tls s PHE 152 N 0.31 2.95 -0.27 1.67 0.08 -0.14 -0.83 117.98 121.75 1tls s PHE 152 Ca -0.03 -0.28 -0.24 0.00 0.12 0.00 0.00 56.93 56.50 1tls s PHE 152 Cb -0.06 -2.24 0.08 0.00 -0.57 0.00 0.00 43.02 40.23 1tls s PHE 152 CO -0.01 -0.27 0.75 -0.47 -0.10 0.00 0.00 175.22 175.12 1tls s TYR 153 N -2.30 -0.79 -0.02 0.36 5.04 -0.65 -4.71 117.35 114.27 1tls s TYR 153 Ca 0.51 1.87 0.07 0.00 -2.44 0.00 0.00 57.07 57.08 1tls s TYR 153 Cb -0.10 0.33 -0.02 0.00 0.35 0.00 0.00 41.96 42.52 1tls s TYR 153 CO 0.33 -0.38 -0.24 0.08 -1.34 0.00 0.00 175.55 173.99 1tls s VAL 154 N 0.55 1.92 -0.28 3.14 1.01 -1.25 -1.37 120.40 124.11 1tls s VAL 154 Ca -0.01 -1.04 -0.15 0.00 0.00 0.00 0.00 61.98 60.78 1tls s VAL 154 Cb -0.05 -1.60 0.10 0.00 0.00 0.00 0.00 36.38 34.83 1tls s VAL 154 CO -0.03 0.54 0.73 0.00 0.00 0.00 0.00 175.10 176.35 1tls s ALA 155 N -0.51 -1.97 -1.37 5.51 0.00 -1.08 -4.84 121.76 117.50 1tls s ALA 155 Ca 0.08 2.38 0.00 0.00 0.00 0.00 0.00 51.96 54.42 1tls s ALA 155 Cb -0.10 -1.52 0.00 0.00 0.00 0.00 0.00 23.12 21.51 1tls s ALA 155 CO -0.00 -0.44 0.00 -0.25 0.00 0.00 0.00 175.76 175.07 1tls n ASP 156 N 4.35 -4.62 -0.96 0.00 8.00 -1.26 -2.98 116.55 119.07 1tls n ASP 156 Ca -0.19 0.09 -0.11 0.00 0.71 0.00 0.00 54.79 55.29 1tls n ASP 156 Cb 0.58 -3.68 -0.03 0.00 -0.02 0.00 0.00 41.12 37.97 1tls n ASP 156 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tls n GLY 157 N -1.05 0.81 3.11 0.44 0.00 -1.26 -5.02 105.19 102.21 1tls n GLY 157 Ca -0.17 -0.50 -0.26 0.00 0.00 0.00 0.00 46.02 45.09 1tls n GLY 157 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tls s LYS 158 N -3.44 1.79 -0.03 1.61 1.02 -1.16 -1.86 119.74 117.67 1tls s LYS 158 Ca 0.00 -0.57 -0.17 0.00 0.02 0.00 0.00 55.97 55.26 1tls s LYS 158 Cb 0.00 -1.52 -0.05 0.00 -0.52 0.00 0.00 37.83 35.73 1tls s LYS 158 CO 0.00 0.19 0.46 -1.17 -0.92 0.00 0.00 175.35 173.91 1tls s LEU 159 N 0.19 4.41 0.19 3.17 2.96 0.36 -2.63 118.68 127.33 1tls s LEU 159 Ca -0.07 0.96 0.09 0.00 -0.22 0.00 0.00 54.13 54.88 1tls s LEU 159 Cb -0.13 -2.67 -0.04 0.00 0.50 0.00 0.00 46.19 43.85 1tls s LEU 159 CO 0.03 0.20 -0.17 -0.44 -1.32 0.00 0.00 176.35 174.64 1tls s SER 160 N -0.45 2.78 -0.03 3.68 0.01 -0.47 0.69 113.70 119.91 1tls s SER 160 Ca 0.25 -0.94 -0.09 0.00 1.31 0.00 0.00 55.95 56.49 1tls s SER 160 Cb -0.17 -0.17 0.01 0.00 0.21 0.00 0.00 66.02 65.91 1tls s SER 160 CO 0.13 -0.07 0.20 0.00 0.41 0.00 0.00 173.24 173.91 1tls s GLN 162 N -0.86 1.70 -0.08 0.00 0.74 -0.01 -0.88 119.66 120.28 1tls s GLN 162 Ca -0.09 -0.42 0.01 0.00 0.05 0.00 0.00 55.36 54.91 1tls s GLN 162 Cb -0.05 -1.41 -0.02 0.00 1.10 0.00 0.00 33.01 32.63 1tls s GLN 162 CO 0.02 0.04 -0.11 -1.17 -0.55 0.00 0.00 175.29 173.51 1tls s LEU 163 N 0.63 2.89 -0.39 3.68 2.96 0.35 -1.43 118.68 127.37 1tls s LEU 163 Ca -0.14 -0.18 -0.10 0.00 -0.22 0.00 0.00 54.13 53.49 1tls s LEU 163 Cb -0.16 -1.62 0.05 0.00 0.50 0.00 0.00 46.19 44.96 1tls s LEU 163 CO 0.04 0.29 0.22 -0.47 -1.32 0.00 0.00 176.35 175.11 1tls s TYR 164 N -0.39 3.28 -0.43 5.38 5.04 -0.78 0.17 117.35 129.62 1tls s TYR 164 Ca 0.05 -1.25 -0.14 0.00 -2.44 0.00 0.00 57.07 53.29 1tls s TYR 164 Cb -0.12 -2.66 0.04 0.00 0.35 0.00 0.00 41.96 39.57 1tls s TYR 164 CO 0.02 -0.75 0.32 -1.14 -1.34 0.00 0.00 175.55 172.66 1tls s GLN 165 N 1.49 2.93 0.43 4.97 0.74 0.99 -3.00 119.66 128.21 1tls s GLN 165 Ca 0.02 -1.17 0.18 0.00 0.05 0.00 0.00 55.36 54.44 1tls s GLN 165 Cb -0.21 -3.98 0.98 0.00 1.10 0.00 0.00 33.01 30.90 1tls s GLN 165 CO 0.04 -0.85 1.92 0.07 -0.55 0.00 0.00 175.29 175.92 1tls h ARG 166 N 8.63 0.00 -2.84 1.67 0.11 -1.05 -0.21 114.38 120.69 1tls h ARG 166 Ca -0.27 0.00 -0.16 0.00 0.10 0.00 0.00 59.98 59.65 1tls h ARG 166 Cb 1.11 0.00 -0.29 0.00 1.11 0.00 0.00 29.97 31.91 1tls h ARG 166 CO 0.77 0.26 -0.41 0.45 0.10 0.00 0.00 179.97 181.15 1tls s SER 167 N -6.67 -0.33 -0.15 0.08 0.15 -1.22 -2.13 113.70 103.43 1tls s SER 167 Ca -0.03 0.70 -0.03 0.00 0.70 0.00 0.00 55.95 57.29 1tls s SER 167 Cb 0.14 0.61 0.05 0.00 -1.71 0.00 0.00 66.02 65.11 1tls s SER 167 CO 0.68 -0.18 0.05 0.00 1.20 0.00 0.00 173.24 174.98 1tls s ASP 169 N 2.02 5.74 0.23 0.00 -1.08 -1.26 -1.41 116.67 120.91 1tls s ASP 169 Ca 0.02 -0.17 -0.07 0.00 -0.52 0.00 0.00 52.55 51.81 1tls s ASP 169 Cb -0.15 -2.55 0.29 0.00 -1.46 0.00 0.00 42.92 39.05 1tls s ASP 169 CO -0.07 -2.10 1.86 0.58 0.52 0.00 0.00 175.17 175.95 1tls h VAL 170 N 6.51 1.07 0.02 1.11 2.07 -1.71 -1.11 116.25 124.21 1tls h VAL 170 Ca -0.23 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 1tls h VAL 170 Cb 1.09 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1tls h VAL 170 CO 1.26 0.18 -0.01 0.15 0.02 0.00 0.00 177.57 179.17 1tls h PHE 171 N 0.98 -0.03 0.00 1.57 3.04 -1.90 -3.36 116.94 117.24 1tls h PHE 171 Ca 0.35 -0.00 -0.33 0.00 3.98 0.00 0.00 57.97 61.97 1tls h PHE 171 Cb 0.10 0.01 -0.05 0.00 2.56 0.00 0.00 35.95 38.57 1tls h PHE 171 CO -0.03 0.70 -1.77 1.28 -2.02 0.00 0.00 178.31 176.47 1tls n LEU 172 N -4.73 1.91 -0.03 0.59 4.77 -1.23 -4.71 117.00 113.57 1tls n LEU 172 Ca -0.09 0.39 -0.14 0.00 -0.03 0.00 0.00 56.01 56.13 1tls n LEU 172 Cb 0.36 -0.91 -0.10 0.00 -2.33 0.00 0.00 43.42 40.44 1tls n LEU 172 CO 0.31 0.40 0.48 1.23 -1.33 0.00 0.00 177.39 178.48 1tls h GLY 173 N -0.97 0.26 -0.20 -0.72 0.00 -1.50 -3.40 103.07 96.54 1tls h GLY 173 Ca -0.49 -0.35 0.18 0.00 0.00 0.00 0.00 47.33 46.67 1tls h GLY 173 CO -0.29 0.31 0.17 -2.00 0.00 0.00 0.00 176.54 174.73 1tls h LEU 174 N -0.31 -0.04 -1.55 3.11 5.85 -1.50 -1.48 115.31 119.40 1tls h LEU 174 Ca -0.01 0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 1tls h LEU 174 Cb 0.86 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 1tls h LEU 174 CO 0.04 -0.08 -0.19 -0.65 -0.34 0.00 0.00 178.44 177.22 1tls h PRO 175 N 0.23 0.06 0.01 5.25 0.11 -1.79 -2.16 132.00 133.71 1tls h PRO 175 Ca 0.45 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.54 1tls h PRO 175 Cb 0.80 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.90 1tls h PRO 175 CO -0.57 0.25 -0.00 0.74 -0.21 0.00 0.00 178.00 178.21 1tls h PHE 176 N 0.05 -0.01 -0.46 0.65 -1.00 -1.54 -2.76 116.94 111.88 1tls h PHE 176 Ca 0.01 -0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.71 1tls h PHE 176 Cb 0.36 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.91 1tls h PHE 176 CO 0.00 0.70 -0.02 -0.91 -1.61 0.00 0.00 178.31 176.47 1tls h ASN 177 N -0.73 0.75 0.41 2.17 -0.26 -1.19 -2.12 115.58 114.61 1tls h ASN 177 Ca -0.00 -0.19 -0.02 0.00 -0.56 0.00 0.00 56.30 55.53 1tls h ASN 177 Cb 0.71 -0.20 0.00 0.00 -1.06 0.00 0.00 38.32 37.77 1tls h ASN 177 CO 0.00 0.83 -0.20 0.40 -1.06 0.00 0.00 177.43 177.40 1tls h ILE 178 N 0.72 0.36 -0.53 2.81 2.04 -1.49 -2.44 117.51 118.98 1tls h ILE 178 Ca 0.14 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 65.38 1tls h ILE 178 Cb 0.47 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.08 1tls h ILE 178 CO 0.02 0.07 0.34 0.00 0.00 0.00 0.00 178.15 178.59 1tls h ALA 179 N -0.74 1.60 0.05 1.87 0.00 -1.50 -2.40 119.26 118.14 1tls h ALA 179 Ca -0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1tls h ALA 179 Cb 0.54 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1tls h ALA 179 CO 0.09 0.36 -0.02 1.03 0.00 0.00 0.00 179.25 180.71 1tls h SER 180 N 0.72 -0.06 -0.54 0.00 0.87 -1.44 -2.34 113.55 110.76 1tls h SER 180 Ca 0.19 -0.18 -0.06 0.00 -1.23 0.00 0.00 61.79 60.52 1tls h SER 180 Cb -0.06 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 61.88 1tls h SER 180 CO -0.04 0.14 0.14 1.88 -0.53 0.00 0.00 176.83 178.43 1tls h TYR 181 N -0.26 0.94 -0.71 2.24 -1.99 -1.36 -1.67 116.97 114.16 1tls h TYR 181 Ca -0.01 -0.09 -0.06 0.00 2.00 0.00 0.00 58.73 60.57 1tls h TYR 181 Cb 0.23 -0.27 -0.03 0.00 2.00 0.00 0.00 36.73 38.66 1tls h TYR 181 CO -0.01 0.78 0.21 0.00 -0.00 0.00 0.00 178.16 179.15 1tls h ALA 182 N 1.28 1.04 0.00 3.88 0.00 -1.40 -1.50 119.26 122.56 1tls h ALA 182 Ca 0.19 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1tls h ALA 182 Cb 0.32 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1tls h ALA 182 CO -0.00 0.64 -0.36 1.25 0.00 0.00 0.00 179.25 180.78 1tls h LEU 183 N 1.05 0.00 -0.12 0.00 5.85 -1.21 -2.94 115.31 117.95 1tls h LEU 183 Ca 0.23 0.00 -0.24 0.00 0.84 0.00 0.00 57.88 58.71 1tls h LEU 183 Cb 0.31 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.35 1tls h LEU 183 CO -0.01 0.36 -0.89 0.25 -0.34 0.00 0.00 178.44 177.81 1tls h LEU 184 N 0.00 0.87 -0.34 2.25 5.85 -0.34 -2.97 115.31 120.63 1tls h LEU 184 Ca -0.00 -0.63 -0.02 0.00 0.84 0.00 0.00 57.88 58.07 1tls h LEU 184 Cb 0.96 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 1tls h LEU 184 CO 0.05 1.42 0.13 0.58 -0.34 0.00 0.00 178.44 180.28 1tls h VAL 185 N 0.44 1.19 -0.70 1.05 2.07 -1.31 -0.10 116.25 118.89 1tls h VAL 185 Ca -0.08 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 66.84 1tls h VAL 185 Cb 1.53 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 32.20 1tls h VAL 185 CO 0.18 0.20 0.36 0.45 0.02 0.00 0.00 177.57 178.78 1tls h HIS 186 N 0.40 0.98 -0.04 1.57 3.86 -1.59 0.17 115.15 120.50 1tls h HIS 186 Ca 0.11 -0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.24 1tls h HIS 186 Cb 0.19 -0.31 0.00 0.00 1.06 0.00 0.00 27.41 28.35 1tls h HIS 186 CO -0.00 0.70 -0.17 0.52 0.86 0.00 0.00 177.93 179.84 1tls h MET 187 N 0.99 0.19 0.16 2.45 2.07 -1.34 -1.93 114.93 117.52 1tls h MET 187 Ca 0.25 -0.15 -0.01 0.00 -2.07 0.00 0.00 59.70 57.72 1tls h MET 187 Cb 0.07 0.03 0.00 0.00 -1.87 0.00 0.00 31.60 29.83 1tls h MET 187 CO -0.04 0.79 -0.08 0.52 1.07 0.00 0.00 176.91 179.18 1tls h MET 188 N -0.38 -0.21 -0.51 1.72 2.86 -0.87 -2.36 114.93 115.18 1tls h MET 188 Ca -0.01 0.01 0.10 0.00 -2.06 0.00 0.00 59.70 57.74 1tls h MET 188 Cb 0.82 0.05 -0.08 0.00 0.06 0.00 0.00 31.60 32.44 1tls h MET 188 CO 0.04 0.02 0.02 0.00 1.06 0.00 0.00 176.91 178.04 1tls h ALA 189 N 0.39 0.51 -0.82 6.32 0.00 -0.71 -1.79 119.26 123.16 1tls h ALA 189 Ca -0.02 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1tls h ALA 189 Cb 0.33 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1tls h ALA 189 CO 0.04 -0.37 0.52 0.37 0.00 0.00 0.00 179.25 179.80 1tls h GLN 190 N 0.14 1.09 0.00 0.00 4.15 -1.26 -1.02 115.11 118.20 1tls h GLN 190 Ca 0.26 -0.08 -0.04 0.00 0.77 0.00 0.00 58.65 59.56 1tls h GLN 190 Cb 0.39 -0.24 -0.01 0.00 0.21 0.00 0.00 27.48 27.84 1tls h GLN 190 CO -0.41 0.74 -0.21 1.96 -1.93 0.00 0.00 178.83 178.98 1tls h GLN 191 N 1.11 0.00 -0.01 1.69 1.08 -0.79 -3.25 115.11 114.94 1tls h GLN 191 Ca 0.30 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.50 1tls h GLN 191 Cb -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.34 1tls h GLN 191 CO -0.06 0.21 0.00 0.00 -0.95 0.00 0.00 178.83 178.03 1tls n ASP 193 N 0.54 -5.36 -4.82 0.00 8.00 -0.51 -4.97 116.55 109.44 1tls n ASP 193 Ca 0.06 -0.35 -0.22 0.00 0.71 0.00 0.00 54.79 54.99 1tls n ASP 193 Cb 0.24 -4.05 -0.04 0.00 -0.02 0.00 0.00 41.12 37.25 1tls n ASP 193 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1tls s LEU 194 N -5.73 3.66 0.31 0.64 1.43 -0.51 -5.05 118.68 113.43 1tls s LEU 194 Ca 0.38 -0.41 0.03 0.00 -1.03 0.00 0.00 54.13 53.10 1tls s LEU 194 Cb -0.17 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 43.80 1tls s LEU 194 CO 0.47 -0.20 0.47 -1.61 0.23 0.00 0.00 176.35 175.71 1tls s GLU 195 N -3.91 3.38 0.09 1.70 0.41 -0.78 -4.35 118.70 115.25 1tls s GLU 195 Ca 0.37 -0.61 -0.20 0.00 -0.41 0.00 0.00 54.97 54.12 1tls s GLU 195 Cb -0.07 -2.77 -0.07 0.00 -1.78 0.00 0.00 34.13 29.45 1tls s GLU 195 CO 0.25 0.21 0.61 0.14 -0.49 0.00 0.00 175.26 175.99 1tls s VAL 196 N -2.18 4.67 0.00 2.63 -7.23 -1.26 -0.49 120.40 116.54 1tls s VAL 196 Ca 0.39 1.30 0.00 0.00 -1.81 0.00 0.00 61.98 61.86 1tls s VAL 196 Cb -0.09 -3.94 0.00 0.00 0.56 0.00 0.00 36.38 32.91 1tls s VAL 196 CO 0.33 0.54 0.00 0.61 -0.31 0.00 0.00 175.10 176.27 1tls n GLY 197 N 1.66 1.38 3.75 2.32 0.00 0.22 -4.66 105.19 109.85 1tls n GLY 197 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 1tls n GLY 197 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tls s ASP 198 N 0.17 5.44 -0.28 1.61 1.01 -1.25 -1.03 116.67 122.35 1tls s ASP 198 Ca 0.00 0.04 -0.06 0.00 0.71 0.00 0.00 52.55 53.24 1tls s ASP 198 Cb 0.00 -1.48 0.00 0.00 1.01 0.00 0.00 42.92 42.45 1tls s ASP 198 CO 0.00 0.24 0.06 0.12 0.21 0.00 0.00 175.17 175.79 1tls s PHE 199 N -1.23 3.11 -0.23 4.23 5.36 0.13 -1.28 117.98 128.07 1tls s PHE 199 Ca 0.24 -0.93 -0.05 0.00 -0.96 0.00 0.00 56.93 55.24 1tls s PHE 199 Cb -0.12 -2.22 -0.01 0.00 -0.34 0.00 0.00 43.02 40.33 1tls s PHE 199 CO 0.16 -0.55 -0.01 0.08 -1.46 0.00 0.00 175.22 173.43 1tls s VAL 200 N 1.50 3.54 -0.21 3.12 1.01 -0.05 0.41 120.40 129.72 1tls s VAL 200 Ca 0.03 -0.50 -0.09 0.00 0.00 0.00 0.00 61.98 61.42 1tls s VAL 200 Cb -0.16 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.52 1tls s VAL 200 CO 0.02 0.36 0.11 0.86 0.00 0.00 0.00 175.10 176.44 1tls s TRP 201 N 1.49 3.30 -0.02 5.22 -0.00 0.71 -0.49 118.94 129.15 1tls s TRP 201 Ca 0.05 0.15 0.07 0.00 -0.00 0.00 0.00 56.10 56.37 1tls s TRP 201 Cb -0.15 -2.16 -0.02 0.00 -0.00 0.00 0.00 33.47 31.14 1tls s TRP 201 CO -0.02 0.13 -0.25 0.99 -0.00 0.00 0.00 176.95 177.80 1tls s THR 202 N 0.63 1.97 0.16 5.86 2.01 0.13 -1.58 115.64 124.82 1tls s THR 202 Ca 0.06 -1.06 0.11 0.00 0.31 0.00 0.00 61.69 61.10 1tls s THR 202 Cb -0.12 -1.64 -0.04 0.00 0.01 0.00 0.00 72.50 70.70 1tls s THR 202 CO 0.01 0.56 -0.23 -0.83 -0.69 0.00 0.00 174.62 173.44 1tls s GLY 203 N -0.54 1.67 0.00 4.40 0.00 -0.54 -0.00 107.32 112.31 1tls s GLY 203 Ca 0.08 -1.52 0.00 0.00 0.00 0.00 0.00 44.72 43.28 1tls s GLY 203 CO -0.00 -1.52 0.00 0.61 0.00 0.00 0.00 173.10 172.18 1tls n GLY 204 N 0.54 0.43 3.55 0.20 0.00 -0.09 -2.75 105.19 107.08 1tls n GLY 204 Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 1tls n GLY 204 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tls s ASP 205 N -1.00 6.25 -0.25 1.61 -1.08 -0.91 -2.49 116.67 118.81 1tls s ASP 205 Ca 0.00 -0.30 -0.12 0.00 -0.52 0.00 0.00 52.55 51.61 1tls s ASP 205 Cb 0.00 -2.55 -0.05 0.00 -1.46 0.00 0.00 42.92 38.86 1tls s ASP 205 CO 0.00 -1.71 0.21 -0.89 0.52 0.00 0.00 175.17 173.31 1tls s THR 206 N 5.40 5.31 0.22 1.71 2.01 -0.69 -0.64 115.64 128.96 1tls s THR 206 Ca 0.37 0.28 -0.09 0.00 0.31 0.00 0.00 61.69 62.55 1tls s THR 206 Cb -0.08 -3.55 -0.01 0.00 0.01 0.00 0.00 72.50 68.86 1tls s THR 206 CO 0.18 0.30 0.36 -1.38 -0.69 0.00 0.00 174.62 173.38 1tls s HIS 207 N 1.34 0.54 -0.10 4.92 -3.43 -0.50 -1.01 115.29 117.05 1tls s HIS 207 Ca 0.09 -0.87 0.03 0.00 -0.80 0.00 0.00 55.06 53.51 1tls s HIS 207 Cb -0.14 -0.03 -0.01 0.00 -1.43 0.00 0.00 32.58 30.97 1tls s HIS 207 CO 0.07 -0.85 -0.20 -0.51 -2.00 0.00 0.00 174.74 171.24 1tls s LEU 208 N -3.04 2.30 0.47 5.38 1.43 -0.16 -1.65 118.68 123.41 1tls s LEU 208 Ca 0.25 -0.47 -0.22 0.00 -1.03 0.00 0.00 54.13 52.66 1tls s LEU 208 Cb 0.02 -1.47 -0.07 0.00 0.03 0.00 0.00 46.19 44.70 1tls s LEU 208 CO 0.08 0.18 1.13 -0.31 0.23 0.00 0.00 176.35 177.66 1tls s TYR 209 N 0.23 2.88 0.60 0.29 2.02 -1.26 -1.20 117.35 120.91 1tls s TYR 209 Ca -0.13 1.55 0.30 0.00 -0.37 0.00 0.00 57.07 58.42 1tls s TYR 209 Cb -0.17 -3.31 1.78 0.00 -0.40 0.00 0.00 41.96 39.87 1tls s TYR 209 CO 0.07 -1.37 2.17 0.66 -1.57 0.00 0.00 175.55 175.51 1tls h SER 210 N 1.87 0.00 -0.42 2.29 4.64 -0.23 -1.63 113.55 120.08 1tls h SER 210 Ca -0.49 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.71 1tls h SER 210 Cb 1.24 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.27 1tls h SER 210 CO 0.60 0.00 0.15 -0.46 -0.87 0.00 0.00 176.83 176.24 1tls n ASN 211 N -3.73 3.57 -0.20 4.97 0.23 -1.26 -3.89 115.26 114.95 1tls n ASN 211 Ca -0.01 -2.67 0.03 0.00 -0.53 0.00 0.00 54.58 51.40 1tls n ASN 211 Cb 0.22 -0.64 0.04 0.00 -2.08 0.00 0.00 39.78 37.32 1tls n ASN 211 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1tls n HIS 212 N 0.04 0.00 -0.03 -2.53 8.25 -0.61 -4.70 115.22 115.64 1tls n HIS 212 Ca 0.23 -0.37 -0.16 0.00 -0.26 0.00 0.00 57.72 57.16 1tls n HIS 212 Cb 0.93 -0.07 -0.08 0.00 1.12 0.00 0.00 29.99 31.89 1tls n HIS 212 CO 0.00 0.00 0.00 1.98 0.64 0.00 0.00 176.34 178.96 1tls h MET 213 N 0.00 0.55 0.01 -0.41 4.05 -1.71 -1.91 114.93 115.51 1tls h MET 213 Ca 0.00 -0.44 -0.00 0.00 -0.28 0.00 0.00 59.70 58.98 1tls h MET 213 Cb 1.06 0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.95 1tls h MET 213 CO 0.00 1.07 -0.00 -0.44 0.23 0.00 0.00 176.91 177.76 1tls h ASP 214 N 0.17 -0.01 -0.82 1.39 3.32 -1.89 -1.38 116.42 117.20 1tls h ASP 214 Ca -0.03 -0.38 0.12 0.00 0.02 0.00 0.00 57.03 56.76 1tls h ASP 214 Cb 1.15 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.65 1tls h ASP 214 CO 0.11 0.38 0.54 1.56 -1.72 0.00 0.00 179.24 180.10 1tls h GLN 215 N -0.39 0.66 0.22 3.56 7.50 -1.93 -1.28 115.11 123.45 1tls h GLN 215 Ca -0.00 -0.04 -0.01 0.00 0.50 0.00 0.00 58.65 59.10 1tls h GLN 215 Cb 0.38 -0.15 0.00 0.00 0.05 0.00 0.00 27.48 27.77 1tls h GLN 215 CO 0.00 0.43 -0.11 1.15 -1.50 0.00 0.00 178.83 178.81 1tls h THR 216 N 0.67 0.85 -0.06 -0.54 2.02 -1.06 -1.84 112.91 112.96 1tls h THR 216 Ca 0.39 -0.47 -0.05 0.00 0.77 0.00 0.00 66.41 67.05 1tls h THR 216 Cb 0.59 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 1tls h THR 216 CO -0.16 0.10 -0.21 0.45 0.37 0.00 0.00 175.52 176.07 1tls h HIS 217 N -0.54 0.10 0.68 3.16 3.86 -0.51 -2.56 115.15 119.33 1tls h HIS 217 Ca -0.03 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.13 1tls h HIS 217 Cb 0.40 -0.03 0.01 0.00 1.06 0.00 0.00 27.41 28.85 1tls h HIS 217 CO 0.00 0.30 -0.33 1.25 0.86 0.00 0.00 177.93 180.02 1tls h LEU 218 N 0.09 -0.78 -0.38 2.43 5.85 -1.17 -2.99 115.31 118.36 1tls h LEU 218 Ca 0.02 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.80 1tls h LEU 218 Cb 0.43 0.20 -0.09 0.00 0.37 0.00 0.00 40.66 41.57 1tls h LEU 218 CO 0.03 -0.46 -0.37 -0.61 -0.34 0.00 0.00 178.44 176.69 1tls h GLN 219 N -1.08 -0.29 -0.82 1.25 4.15 -1.24 -0.64 115.11 116.45 1tls h GLN 219 Ca -0.09 0.02 0.19 0.00 0.77 0.00 0.00 58.65 59.53 1tls h GLN 219 Cb 0.73 0.06 -0.05 0.00 0.21 0.00 0.00 27.48 28.44 1tls h GLN 219 CO 0.15 -0.19 0.55 -0.07 -1.93 0.00 0.00 178.83 177.35 1tls h LEU 220 N -0.30 0.31 0.00 -2.39 3.38 -1.52 0.46 115.31 115.26 1tls h LEU 220 Ca 0.15 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1tls h LEU 220 Cb 0.56 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1tls h LEU 220 CO -0.54 0.14 0.00 -1.54 0.09 0.00 0.00 178.44 176.59 1tls n SER 221 N -4.46 0.00 -4.85 -0.43 3.41 -0.25 -4.76 113.62 102.28 1tls n SER 221 Ca 0.17 -0.59 -0.30 0.00 -0.26 0.00 0.00 58.87 57.88 1tls n SER 221 Cb 0.67 -0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.54 1tls n SER 221 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1tls s ARG 222 N -2.05 3.17 -0.18 4.33 0.52 0.16 -5.10 118.95 119.80 1tls s ARG 222 Ca 0.30 -0.57 -0.09 0.00 -0.52 0.00 0.00 55.73 54.86 1tls s ARG 222 Cb 0.14 -2.89 -0.05 0.00 0.52 0.00 0.00 34.95 32.68 1tls s ARG 222 CO 0.25 0.58 0.11 -2.00 0.02 0.00 0.00 175.30 174.26 1tls s GLU 223 N -2.50 4.00 0.72 3.54 2.12 -1.26 -5.04 118.70 120.29 1tls s GLU 223 Ca 0.32 -0.25 -0.16 0.00 0.36 0.00 0.00 54.97 55.25 1tls s GLU 223 Cb -0.12 -3.31 0.03 0.00 0.26 0.00 0.00 34.13 30.98 1tls s GLU 223 CO 0.25 0.36 1.25 -2.14 -0.54 0.00 0.00 175.26 174.45 1tls s PRO 224 N 0.15 2.14 0.52 4.30 0.02 -1.26 -4.85 135.00 136.02 1tls s PRO 224 Ca 0.08 1.91 0.06 0.00 0.02 0.00 0.00 61.00 63.06 1tls s PRO 224 Cb -0.12 -1.82 0.03 0.00 0.02 0.00 0.00 34.50 32.62 1tls s PRO 224 CO -0.01 -1.87 0.39 1.03 -0.33 0.00 0.00 177.00 176.22 1tls s ARG 225 N -3.74 2.29 0.31 5.54 1.81 -1.26 -5.07 118.95 118.83 1tls s ARG 225 Ca 0.78 -1.94 -0.30 0.00 -1.72 0.00 0.00 55.73 52.55 1tls s ARG 225 Cb -0.33 -2.14 -0.12 0.00 -0.45 0.00 0.00 34.95 31.91 1tls s ARG 225 CO 0.45 -0.54 1.52 -2.30 -0.68 0.00 0.00 175.30 173.75 1tls n PRO 226 N -1.71 2.56 -1.93 3.54 -0.02 -1.26 -4.95 135.00 131.22 1tls n PRO 226 Ca -0.01 0.91 -0.37 0.00 -2.02 0.00 0.00 63.50 62.01 1tls n PRO 226 Cb 0.64 -2.64 0.04 0.00 -0.02 0.00 0.00 33.50 31.51 1tls n PRO 226 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1tls s LEU 227 N -0.78 3.77 0.00 2.45 1.43 -1.26 -4.83 118.68 119.46 1tls s LEU 227 Ca 0.61 2.55 -0.12 0.00 -1.03 0.00 0.00 54.13 56.15 1tls s LEU 227 Cb -0.52 -4.43 0.17 0.00 0.03 0.00 0.00 46.19 41.44 1tls s LEU 227 CO 0.53 -1.55 0.60 -0.81 0.23 0.00 0.00 176.35 175.36 1tls n PRO 228 N -1.27 -2.29 -4.16 1.29 -0.04 -1.25 -4.66 135.00 122.62 1tls n PRO 228 Ca 0.12 -0.97 -0.23 0.00 -0.04 0.00 0.00 63.50 62.39 1tls n PRO 228 Cb 0.47 -0.92 -0.17 0.00 -0.04 0.00 0.00 33.50 32.85 1tls n PRO 228 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1tls s LYS 229 N -4.37 1.11 0.11 0.54 -0.14 -0.35 -0.95 119.74 115.68 1tls s LYS 229 Ca 0.39 -0.17 -0.21 0.00 -1.36 0.00 0.00 55.97 54.63 1tls s LYS 229 Cb -0.04 -1.11 -0.07 0.00 -1.68 0.00 0.00 37.83 34.93 1tls s LYS 229 CO 0.30 -0.12 0.63 -1.17 -0.76 0.00 0.00 175.35 174.24 1tls s LEU 230 N 1.13 4.54 -0.20 3.17 2.96 -1.26 -1.65 118.68 127.36 1tls s LEU 230 Ca -0.07 1.37 -0.00 0.00 -0.22 0.00 0.00 54.13 55.21 1tls s LEU 230 Cb -0.14 -3.04 0.05 0.00 0.50 0.00 0.00 46.19 43.56 1tls s LEU 230 CO -0.01 0.24 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.58 1tls s ILE 231 N -1.15 1.29 -0.19 6.68 -1.09 0.42 -4.99 121.20 122.18 1tls s ILE 231 Ca 0.32 -0.92 -0.18 0.00 -2.23 0.00 0.00 60.65 57.63 1tls s ILE 231 Cb -0.20 -1.53 -0.03 0.00 -1.58 0.00 0.00 42.46 39.12 1tls s ILE 231 CO 0.21 -0.00 0.52 -0.63 -1.23 0.00 0.00 174.94 173.81 1tls s ILE 232 N 1.53 5.11 -2.09 2.92 1.01 -1.26 -0.71 121.20 127.70 1tls s ILE 232 Ca -0.02 0.96 0.28 0.00 0.00 0.00 0.00 60.65 61.86 1tls s ILE 232 Cb -0.17 -3.84 0.46 0.00 0.01 0.00 0.00 42.46 38.92 1tls s ILE 232 CO -0.07 0.19 1.73 0.29 0.00 0.00 0.00 174.94 177.07 1tls n LYS 233 N 4.69 1.20 -3.89 2.79 4.01 0.24 -4.94 118.16 122.26 1tls n LYS 233 Ca -0.05 -0.65 -0.09 0.00 -0.51 0.00 0.00 58.31 57.01 1tls n LYS 233 Cb 0.50 -1.49 -0.05 0.00 -0.51 0.00 0.00 35.03 33.48 1tls n LYS 233 CO 0.00 0.00 0.00 0.50 -1.11 0.00 0.00 177.40 176.79 1tls s ARG 234 N -2.24 1.34 -0.57 1.97 3.52 -1.26 -5.06 118.95 116.65 1tls s ARG 234 Ca 0.33 -1.08 0.04 0.00 -0.13 0.00 0.00 55.73 54.89 1tls s ARG 234 Cb 0.20 0.45 0.16 0.00 -1.56 0.00 0.00 34.95 34.21 1tls s ARG 234 CO 0.42 -0.54 0.39 0.21 -0.81 0.00 0.00 175.30 174.97 1tls s LYS 235 N -3.94 1.84 1.02 5.12 2.20 -1.26 -5.08 119.74 119.63 1tls s LYS 235 Ca 0.15 -2.73 -0.14 0.00 -0.36 0.00 0.00 55.97 52.89 1tls s LYS 235 Cb 0.01 -2.76 0.10 0.00 -1.51 0.00 0.00 37.83 33.67 1tls s LYS 235 CO 0.01 -1.27 0.46 -0.35 -0.36 0.00 0.00 175.35 173.85 1tls n PRO 236 N 2.59 -0.92 0.21 4.03 -0.05 -1.26 -4.90 135.00 134.70 1tls n PRO 236 Ca 0.18 -0.23 0.09 0.00 -0.05 0.00 0.00 63.50 63.49 1tls n PRO 236 Cb 0.37 -1.92 0.35 0.00 -0.05 0.00 0.00 33.50 32.26 1tls n PRO 236 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 175.50 176.38 1tls h GLU 237 N -1.88 0.00 -3.71 0.54 4.39 -2.00 -3.45 114.58 108.48 1tls h GLU 237 Ca -0.48 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.14 1tls h GLU 237 Cb 1.31 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 29.82 1tls h GLU 237 CO 0.38 0.23 -0.31 -1.54 -1.16 0.00 0.00 179.01 176.61 1tls s SER 238 N -6.20 0.05 0.46 1.42 1.04 -1.26 -5.03 113.70 104.17 1tls s SER 238 Ca 0.02 -0.56 0.13 0.00 0.48 0.00 0.00 55.95 56.02 1tls s SER 238 Cb 0.09 0.36 1.04 0.00 0.10 0.00 0.00 66.02 67.61 1tls s SER 238 CO 0.65 -0.74 2.05 -0.29 0.98 0.00 0.00 173.24 175.89 1tls h ILE 239 N 2.73 1.09 0.00 -1.02 2.10 -1.94 -1.92 117.51 118.55 1tls h ILE 239 Ca -0.34 -0.35 0.00 0.00 1.08 0.00 0.00 64.86 65.25 1tls h ILE 239 Cb 1.21 1.05 0.00 0.00 -1.09 0.00 0.00 36.82 37.99 1tls h ILE 239 CO 0.54 0.11 0.00 0.49 -1.08 0.00 0.00 178.15 178.21 1tls n PHE 240 N -4.42 0.00 0.14 2.19 3.72 -1.26 -3.70 117.46 114.14 1tls n PHE 240 Ca -0.01 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.45 1tls n PHE 240 Cb 0.16 -0.01 0.11 0.00 -0.94 0.00 0.00 39.48 38.81 1tls n PHE 240 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1tls n ASP 241 N -1.01 2.54 -4.77 4.37 9.92 -0.72 -4.96 116.55 121.92 1tls n ASP 241 Ca 0.14 -1.77 -0.36 0.00 -0.53 0.00 0.00 54.79 52.28 1tls n ASP 241 Cb 0.07 -0.13 -0.00 0.00 -0.64 0.00 0.00 41.12 40.41 1tls n ASP 241 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1tls s TYR 242 N -1.01 2.73 0.17 1.24 1.51 -1.24 -4.87 117.35 115.88 1tls s TYR 242 Ca 0.20 1.54 0.11 0.00 -1.01 0.00 0.00 57.07 57.91 1tls s TYR 242 Cb 0.12 -3.31 -0.04 0.00 -0.11 0.00 0.00 41.96 38.62 1tls s TYR 242 CO 0.16 -1.53 -0.24 1.03 -1.11 0.00 0.00 175.55 173.86 1tls s ARG 243 N -3.14 1.43 0.31 -0.62 0.52 -1.26 -5.02 118.95 111.18 1tls s ARG 243 Ca 0.70 -1.45 0.07 0.00 -0.52 0.00 0.00 55.73 54.53 1tls s ARG 243 Cb -0.25 -1.75 0.85 0.00 0.52 0.00 0.00 34.95 34.33 1tls s ARG 243 CO 0.29 0.38 1.67 0.35 0.02 0.00 0.00 175.30 178.01 1tls h PHE 244 N 3.39 0.69 0.00 -0.53 3.57 -1.96 -2.28 116.94 119.83 1tls h PHE 244 Ca -0.47 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.02 1tls h PHE 244 Cb 1.20 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.78 1tls h PHE 244 CO 0.67 -0.12 -0.24 0.93 -2.23 0.00 0.00 178.31 177.31 1tls h GLU 245 N 0.34 0.00 0.00 1.11 3.07 -2.02 -3.19 114.58 113.89 1tls h GLU 245 Ca 0.62 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.48 1tls h GLU 245 Cb 1.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.20 1tls h GLU 245 CO -0.59 0.24 0.00 -0.25 -1.40 0.00 0.00 179.01 177.02 1tls n ASP 246 N -3.66 0.30 -4.57 1.42 8.00 -0.86 -4.72 116.55 112.46 1tls n ASP 246 Ca -0.01 0.61 -0.34 0.00 0.71 0.00 0.00 54.79 55.76 1tls n ASP 246 Cb 0.37 -0.66 -0.11 0.00 -0.02 0.00 0.00 41.12 40.69 1tls n ASP 246 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1tls s PHE 247 N -3.22 2.99 -0.06 1.24 0.08 -1.21 0.82 117.98 118.62 1tls s PHE 247 Ca 0.02 -0.06 -0.02 0.00 0.12 0.00 0.00 56.93 56.98 1tls s PHE 247 Cb 0.06 -1.79 0.04 0.00 -0.57 0.00 0.00 43.02 40.75 1tls s PHE 247 CO 0.20 0.24 0.12 -1.21 -0.10 0.00 0.00 175.22 174.46 1tls s GLU 248 N -0.47 0.02 -0.26 0.44 0.41 0.11 -4.99 118.70 113.96 1tls s GLU 248 Ca 0.07 0.40 -0.09 0.00 -0.41 0.00 0.00 54.97 54.94 1tls s GLU 248 Cb -0.12 -0.28 -0.04 0.00 -1.78 0.00 0.00 34.13 31.91 1tls s GLU 248 CO 0.02 -0.24 0.14 0.42 -0.49 0.00 0.00 175.26 175.11 1tls s ILE 249 N 1.69 4.92 0.14 -1.63 1.01 -1.26 0.16 121.20 126.23 1tls s ILE 249 Ca -0.03 0.04 0.08 0.00 0.00 0.00 0.00 60.65 60.73 1tls s ILE 249 Cb -0.12 -3.32 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 1tls s ILE 249 CO -0.05 0.30 -0.07 -1.61 0.00 0.00 0.00 174.94 173.50 1tls s GLU 250 N 1.60 2.17 -1.42 2.79 0.41 -0.66 -4.71 118.70 118.88 1tls s GLU 250 Ca 0.07 -1.11 0.00 0.00 -0.41 0.00 0.00 54.97 53.51 1tls s GLU 250 Cb -0.15 -2.28 0.00 0.00 -1.78 0.00 0.00 34.13 29.92 1tls s GLU 250 CO 0.07 0.47 0.00 0.41 -0.49 0.00 0.00 175.26 175.73 1tls n GLY 251 N 0.32 0.43 3.61 -1.39 0.00 -1.26 -1.21 105.19 105.68 1tls n GLY 251 Ca -0.12 -0.27 -0.41 0.00 0.00 0.00 0.00 46.02 45.22 1tls n GLY 251 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1tls s TYR 252 N -2.68 3.22 -0.43 1.61 5.04 -1.26 -4.45 117.35 118.40 1tls s TYR 252 Ca 0.00 0.66 0.05 0.00 -2.44 0.00 0.00 57.07 55.34 1tls s TYR 252 Cb 0.00 -2.99 0.19 0.00 0.35 0.00 0.00 41.96 39.50 1tls s TYR 252 CO 0.00 -0.46 0.47 -3.47 -1.34 0.00 0.00 175.55 170.75 1tls n ASP 253 N 5.89 -1.13 -4.94 4.32 2.03 -1.26 -5.12 116.55 116.34 1tls n ASP 253 Ca -0.00 -2.58 -0.24 0.00 0.52 0.00 0.00 54.79 52.49 1tls n ASP 253 Cb 0.49 0.03 0.03 0.00 -0.72 0.00 0.00 41.12 40.94 1tls n ASP 253 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1tls s PRO 254 N 0.08 2.85 1.13 -0.67 0.04 -1.26 -4.87 135.00 132.30 1tls s PRO 254 Ca 0.33 -0.36 -0.16 0.00 0.04 0.00 0.00 61.00 60.85 1tls s PRO 254 Cb 0.06 -2.42 0.25 0.00 0.04 0.00 0.00 34.50 32.43 1tls s PRO 254 CO -0.16 -0.57 1.09 -1.01 0.04 0.00 0.00 177.00 176.39 1tls s HIS 255 N -2.79 1.17 0.61 0.56 3.76 0.51 -4.82 115.29 114.29 1tls s HIS 255 Ca 0.53 0.74 -0.19 0.00 -0.15 0.00 0.00 55.06 55.99 1tls s HIS 255 Cb -0.10 -3.33 -0.03 0.00 1.11 0.00 0.00 32.58 30.23 1tls s HIS 255 CO 0.41 -3.54 1.24 -2.14 -0.85 0.00 0.00 174.74 169.86 1tls s PRO 256 N -5.14 2.84 0.96 8.40 0.02 -1.26 -2.66 135.00 138.16 1tls s PRO 256 Ca 0.68 1.92 -0.11 0.00 0.02 0.00 0.00 61.00 63.52 1tls s PRO 256 Cb -0.15 -1.91 0.17 0.00 0.02 0.00 0.00 34.50 32.63 1tls s PRO 256 CO 0.57 -1.34 1.10 0.20 -0.33 0.00 0.00 177.00 177.21 1tls s GLY 257 N -1.50 1.64 -0.09 0.52 0.00 -1.26 -4.00 107.32 102.64 1tls s GLY 257 Ca 0.79 0.30 -0.02 0.00 0.00 0.00 0.00 44.72 45.79 1tls s GLY 257 CO 0.36 0.79 0.00 -0.42 0.00 0.00 0.00 173.10 173.83 1tls s ILE 258 N -2.67 0.41 0.32 0.90 1.01 -1.26 -4.89 121.20 115.02 1tls s ILE 258 Ca 0.66 0.02 -0.24 0.00 0.00 0.00 0.00 60.65 61.09 1tls s ILE 258 Cb -0.22 -0.62 -0.10 0.00 0.01 0.00 0.00 42.46 41.54 1tls s ILE 258 CO 0.59 0.19 0.89 -0.54 0.00 0.00 0.00 174.94 176.08 1tls s LYS 259 N 1.95 4.45 -0.02 2.79 -0.14 -1.26 -5.06 119.74 122.45 1tls s LYS 259 Ca 0.04 1.19 -0.18 0.00 -1.36 0.00 0.00 55.97 55.66 1tls s LYS 259 Cb -0.13 -2.72 0.03 0.00 -1.68 0.00 0.00 37.83 33.33 1tls s LYS 259 CO -0.06 0.26 0.38 0.00 -0.76 0.00 0.00 175.35 175.17 1tls s ALA 260 N -1.69 -0.98 0.18 5.17 0.00 -1.26 -4.96 121.76 118.23 1tls s ALA 260 Ca 0.50 0.54 -0.22 0.00 0.00 0.00 0.00 51.96 52.78 1tls s ALA 260 Cb -0.17 0.04 -0.08 0.00 0.00 0.00 0.00 23.12 22.92 1tls s ALA 260 CO 0.22 -0.28 0.73 -1.25 0.00 0.00 0.00 175.76 175.18 1tls s PRO 261 N -1.26 4.40 0.13 0.00 0.04 -1.26 -5.05 135.00 131.99 1tls s PRO 261 Ca -0.13 0.99 -0.27 0.00 0.04 0.00 0.00 61.00 61.64 1tls s PRO 261 Cb -0.04 -3.11 -0.07 0.00 0.04 0.00 0.00 34.50 31.32 1tls s PRO 261 CO 0.05 0.51 0.84 0.54 0.04 0.00 0.00 177.00 178.98 1tls s VAL 262 N -1.29 4.46 -0.10 -0.36 0.11 -1.26 -4.98 120.40 116.97 1tls s VAL 262 Ca 0.38 1.83 -0.22 0.00 -2.93 0.00 0.00 61.98 61.04 1tls s VAL 262 Cb -0.20 -4.21 -0.03 0.00 -1.53 0.00 0.00 36.38 30.41 1tls s VAL 262 CO 0.23 0.43 0.65 0.00 -3.33 0.00 0.00 175.10 173.08 1tls s ALA 263 N -0.57 3.41 -2.60 1.54 0.00 -1.26 -5.22 121.76 117.06 1tls s ALA 263 Ca 0.40 -0.00 0.27 0.00 0.00 0.00 0.00 51.96 52.63 1tls s ALA 263 Cb -0.23 -2.91 0.88 0.00 0.00 0.00 0.00 23.12 20.87 1tls s ALA 263 CO 0.27 -0.18 1.65 -0.89 0.00 0.00 0.00 175.76 176.61