#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 0.81 -0.08 1.64 7.50 -2.00 -2.55 115.11 120.42 1tls h GLN 3 Ca 0.00 -0.05 -0.01 0.00 0.50 0.00 0.00 58.65 59.09 1tls h GLN 3 Cb 0.00 -0.18 -0.00 0.00 0.05 0.00 0.00 27.48 27.34 1tls h GLN 3 CO 0.00 0.53 0.02 -0.92 -1.50 0.00 0.00 178.83 176.97 1tls h TYR 4 N 0.83 0.14 -0.11 2.96 3.20 -2.01 -2.64 116.97 119.34 1tls h TYR 4 Ca 0.36 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 62.12 1tls h TYR 4 Cb 0.24 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 1tls h TYR 4 CO -0.05 0.30 -0.37 -0.07 -1.64 0.00 0.00 178.16 176.32 1tls h LEU 5 N -0.06 0.23 -0.76 2.82 3.38 -1.98 -1.18 115.31 117.76 1tls h LEU 5 Ca 0.03 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 1tls h LEU 5 Cb 0.23 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1tls h LEU 5 CO -0.00 0.59 -0.20 -0.33 0.09 0.00 0.00 178.44 178.59 1tls h GLU 6 N 0.19 0.72 -0.33 1.13 5.08 -1.40 0.64 114.58 120.62 1tls h GLU 6 Ca 0.02 -0.28 -0.11 0.00 -1.00 0.00 0.00 59.36 58.00 1tls h GLU 6 Cb 0.75 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 1tls h GLU 6 CO 0.06 0.87 -0.22 1.25 -1.00 0.00 0.00 179.01 179.97 1tls h LEU 7 N 0.64 0.76 -0.56 1.33 5.85 -1.17 -0.62 115.31 121.54 1tls h LEU 7 Ca 0.09 -0.43 0.02 0.00 0.84 0.00 0.00 57.88 58.40 1tls h LEU 7 Cb 0.69 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1tls h LEU 7 CO 0.05 1.03 0.35 -0.03 -0.34 0.00 0.00 178.44 179.50 1tls h MET 8 N 0.50 0.67 -0.71 1.25 4.05 -0.99 -1.18 114.93 118.52 1tls h MET 8 Ca 0.07 -0.04 -0.06 0.00 -0.28 0.00 0.00 59.70 59.38 1tls h MET 8 Cb 0.77 -0.15 -0.03 0.00 -0.80 0.00 0.00 31.60 31.39 1tls h MET 8 CO 0.06 0.44 0.19 0.37 0.23 0.00 0.00 176.91 178.20 1tls h GLN 9 N 0.69 1.12 -0.48 0.39 5.75 -0.76 -2.99 115.11 118.84 1tls h GLN 9 Ca 0.22 -0.26 -0.03 0.00 -0.15 0.00 0.00 58.65 58.43 1tls h GLN 9 Cb 0.00 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.38 1tls h GLN 9 CO -0.09 0.98 0.18 -0.22 -2.65 0.00 0.00 178.83 177.03 1tls h LYS 10 N 1.06 0.72 -0.48 1.69 3.64 -0.56 -0.93 116.57 121.70 1tls h LYS 10 Ca 0.22 -0.14 0.05 0.00 -1.27 0.00 0.00 60.65 59.51 1tls h LYS 10 Cb 0.35 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.01 1tls h LYS 10 CO -0.00 0.66 0.23 0.28 -2.27 0.00 0.00 179.45 178.35 1tls h VAL 11 N 0.63 0.94 0.35 2.00 2.07 -1.13 0.43 116.25 121.54 1tls h VAL 11 Ca 0.16 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1tls h VAL 11 Cb 0.22 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1tls h VAL 11 CO -0.01 0.08 -0.17 -0.07 0.02 0.00 0.00 177.57 177.42 1tls h LEU 12 N 0.46 -0.40 -1.40 2.57 3.38 -1.35 0.62 115.31 119.19 1tls h LEU 12 Ca 0.22 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 1tls h LEU 12 Cb 0.14 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1tls h LEU 12 CO -0.16 -0.21 -0.27 0.44 0.09 0.00 0.00 178.44 178.32 1tls h ASP 13 N -0.57 0.00 0.00 -0.43 3.32 -0.88 -3.36 116.42 114.50 1tls h ASP 13 Ca -0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1tls h ASP 13 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 1tls h ASP 13 CO 0.08 0.27 -0.05 -0.62 -1.72 0.00 0.00 179.24 177.21 1tls n GLU 14 N -3.77 3.75 -1.64 3.56 1.02 0.12 -5.08 120.64 118.59 1tls n GLU 14 Ca -0.01 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.75 1tls n GLU 14 Cb 0.37 -0.32 0.06 0.00 -0.02 0.00 0.00 31.44 31.53 1tls n GLU 14 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1tls n GLY 15 N 0.62 -0.08 3.72 0.62 0.00 0.22 -4.89 105.19 105.38 1tls n GLY 15 Ca 0.00 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 1tls n GLY 15 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tls s THR 16 N -1.47 4.26 0.04 2.61 -4.23 0.33 -4.68 115.64 112.49 1tls s THR 16 Ca 0.77 -0.75 -0.30 0.00 -1.18 0.00 0.00 61.69 60.22 1tls s THR 16 Cb -0.41 -2.98 -0.06 0.00 1.34 0.00 0.00 72.50 70.39 1tls s THR 16 CO 0.46 0.23 1.31 -1.10 -0.54 0.00 0.00 174.62 174.98 1tls s GLN 17 N -2.02 4.35 0.06 3.99 -0.21 -1.26 -1.65 119.66 122.91 1tls s GLN 17 Ca 0.24 1.89 0.06 0.00 0.02 0.00 0.00 55.36 57.57 1tls s GLN 17 Cb -0.12 -3.42 -0.03 0.00 1.00 0.00 0.00 33.01 30.44 1tls s GLN 17 CO 0.16 -0.43 -0.16 0.15 -2.12 0.00 0.00 175.29 172.90 1tls s LYS 18 N 1.65 0.97 -0.26 2.91 1.02 -0.81 -5.00 119.74 120.22 1tls s LYS 18 Ca 0.61 -0.91 -0.15 0.00 0.02 0.00 0.00 55.97 55.55 1tls s LYS 18 Cb -0.31 -1.03 -0.04 0.00 -0.52 0.00 0.00 37.83 35.93 1tls s LYS 18 CO 0.28 0.25 0.36 1.21 -0.92 0.00 0.00 175.35 176.52 1tls s ASN 19 N -1.47 6.26 0.59 2.83 3.84 -1.26 -1.99 114.94 123.75 1tls s ASN 19 Ca 0.02 0.29 0.10 0.00 0.21 0.00 0.00 52.86 53.48 1tls s ASN 19 Cb -0.09 -2.21 0.10 0.00 -0.55 0.00 0.00 41.25 38.50 1tls s ASN 19 CO 0.02 -0.16 0.81 1.51 -2.79 0.00 0.00 177.10 176.49 1tls s ASP 20 N 1.57 5.02 0.22 -4.21 -4.77 -1.26 -4.96 116.67 108.28 1tls s ASP 20 Ca 0.15 -0.92 -0.08 0.00 -3.30 0.00 0.00 52.55 48.41 1tls s ASP 20 Cb -0.16 0.43 0.17 0.00 -1.09 0.00 0.00 42.92 42.28 1tls s ASP 20 CO 0.10 -1.42 1.81 -0.09 0.70 0.00 0.00 175.17 176.27 1tls h ARG 21 N 0.13 1.20 0.00 2.11 2.43 -2.00 -2.38 114.38 115.86 1tls h ARG 21 Ca -0.28 -0.18 -0.03 0.00 -0.81 0.00 0.00 59.98 58.67 1tls h ARG 21 Cb 1.29 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1tls h ARG 21 CO 0.40 0.92 -0.16 1.79 -1.51 0.00 0.00 179.97 181.42 1tls h THR 22 N 1.18 0.45 0.00 0.20 1.35 -1.95 -3.47 112.91 110.67 1tls h THR 22 Ca 0.28 -0.88 0.00 0.00 -0.55 0.00 0.00 66.41 65.27 1tls h THR 22 Cb 0.12 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 1tls h THR 22 CO -0.04 0.16 0.00 0.61 -0.25 0.00 0.00 175.52 176.00 1tls n GLY 23 N -0.06 0.71 0.12 5.82 0.00 -0.90 -4.89 105.19 106.00 1tls n GLY 23 Ca -0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 1tls n GLY 23 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1tls h THR 24 N 0.00 1.49 0.00 2.61 2.02 -1.91 -3.47 112.91 113.65 1tls h THR 24 Ca 0.00 -2.73 0.00 0.00 0.77 0.00 0.00 66.41 64.45 1tls h THR 24 Cb 0.00 2.59 0.00 0.00 -1.74 0.00 0.00 68.15 69.00 1tls h THR 24 CO 0.00 0.80 0.00 0.61 0.37 0.00 0.00 175.52 177.30 1tls n GLY 25 N 1.07 0.44 3.29 2.16 0.00 -1.26 -4.52 105.19 106.37 1tls n GLY 25 Ca -0.05 -1.55 -0.09 0.00 0.00 0.00 0.00 46.02 44.32 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 -2.41 0.10 -0.20 2.61 -4.23 -0.84 -2.15 115.64 108.52 1tls s THR 26 Ca 0.00 -1.10 -0.07 0.00 -1.18 0.00 0.00 61.69 59.35 1tls s THR 26 Cb 0.00 -1.47 -0.03 0.00 1.34 0.00 0.00 72.50 72.33 1tls s THR 26 CO 0.00 -0.44 0.05 -0.76 -0.54 0.00 0.00 174.62 172.92 1tls s LEU 27 N -2.88 3.59 0.02 4.79 1.43 -0.00 -1.93 118.68 123.70 1tls s LEU 27 Ca 0.08 -0.05 0.03 0.00 -1.03 0.00 0.00 54.13 53.16 1tls s LEU 27 Cb 0.03 -1.92 -0.02 0.00 0.03 0.00 0.00 46.19 44.32 1tls s LEU 27 CO -0.07 0.11 -0.09 -0.55 0.23 0.00 0.00 176.35 175.97 1tls s SER 28 N 0.77 1.06 0.10 2.29 0.15 -0.66 -1.10 113.70 116.31 1tls s SER 28 Ca 0.02 -0.37 0.08 0.00 0.70 0.00 0.00 55.95 56.38 1tls s SER 28 Cb -0.14 -0.05 -0.03 0.00 -1.71 0.00 0.00 66.02 64.09 1tls s SER 28 CO 0.02 -0.03 -0.19 0.27 1.20 0.00 0.00 173.24 174.50 1tls s ILE 29 N -0.79 1.58 -0.21 6.45 -4.36 -0.52 -0.51 121.20 122.85 1tls s ILE 29 Ca -0.02 -1.49 -0.04 0.00 -0.26 0.00 0.00 60.65 58.84 1tls s ILE 29 Cb -0.07 -1.45 -0.01 0.00 1.25 0.00 0.00 42.46 42.18 1tls s ILE 29 CO 0.00 -0.10 -0.04 0.12 0.24 0.00 0.00 174.94 175.16 1tls s PHE 30 N -1.19 2.96 0.13 1.37 5.36 -1.26 -1.16 117.98 124.19 1tls s PHE 30 Ca 0.05 -0.85 0.00 0.00 -0.96 0.00 0.00 56.93 55.17 1tls s PHE 30 Cb -0.10 -2.08 0.00 0.00 -0.34 0.00 0.00 43.02 40.50 1tls s PHE 30 CO 0.04 -0.48 0.00 0.41 -1.46 0.00 0.00 175.22 173.73 1tls n GLY 31 N 4.62 -4.30 3.50 13.12 0.00 -0.76 -5.04 105.19 116.33 1tls n GLY 31 Ca -0.18 -0.61 -0.18 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.76 -0.63 -0.06 1.61 2.46 -1.22 -4.99 115.29 111.70 1tls s HIS 32 Ca 0.00 1.08 -0.02 0.00 0.47 0.00 0.00 55.06 56.58 1tls s HIS 32 Cb 0.00 0.39 0.04 0.00 -0.13 0.00 0.00 32.58 32.88 1tls s HIS 32 CO 0.00 -0.60 0.12 -1.14 -2.47 0.00 0.00 174.74 170.65 1tls s GLN 33 N -1.20 0.01 0.08 2.88 0.74 -1.26 -0.79 119.66 120.12 1tls s GLN 33 Ca -0.11 0.43 0.06 0.00 0.05 0.00 0.00 55.36 55.79 1tls s GLN 33 Cb -0.00 -0.31 -0.03 0.00 1.10 0.00 0.00 33.01 33.76 1tls s GLN 33 CO 0.10 -0.27 -0.16 0.00 -0.55 0.00 0.00 175.29 174.41 1tls s MET 34 N 1.89 0.88 -0.07 1.67 0.23 0.36 -4.96 119.30 119.30 1tls s MET 34 Ca -0.00 -0.99 0.04 0.00 -1.03 0.00 0.00 55.69 53.70 1tls s MET 34 Cb -0.12 -0.94 -0.02 0.00 -1.53 0.00 0.00 34.83 32.22 1tls s MET 34 CO -0.05 0.21 -0.19 0.50 -2.03 0.00 0.00 175.02 173.47 1tls s ARG 35 N -1.76 2.73 -0.16 3.16 3.52 -1.26 0.16 118.95 125.33 1tls s ARG 35 Ca -0.00 -0.79 0.01 0.00 -0.13 0.00 0.00 55.73 54.81 1tls s ARG 35 Cb -0.10 -2.34 0.03 0.00 -1.56 0.00 0.00 34.95 30.98 1tls s ARG 35 CO 0.03 0.42 -0.14 -0.06 -0.81 0.00 0.00 175.30 174.73 1tls s PHE 36 N -0.22 2.32 -0.44 5.12 0.08 0.68 -4.96 117.98 120.56 1tls s PHE 36 Ca -0.01 -1.37 -0.29 0.00 0.12 0.00 0.00 56.93 55.39 1tls s PHE 36 Cb -0.13 -1.66 0.03 0.00 -0.57 0.00 0.00 43.02 40.69 1tls s PHE 36 CO 0.03 -0.71 1.13 1.21 -0.10 0.00 0.00 175.22 176.78 1tls s ASN 37 N 1.44 6.70 0.05 1.36 3.84 -1.26 0.66 114.94 127.73 1tls s ASN 37 Ca 0.04 0.62 0.17 0.00 0.21 0.00 0.00 52.86 53.89 1tls s ASN 37 Cb -0.14 -2.55 0.72 0.00 -0.55 0.00 0.00 41.25 38.73 1tls s ASN 37 CO -0.11 -1.17 1.53 0.18 -2.79 0.00 0.00 177.10 174.75 1tls n LEU 38 N 7.63 0.13 0.02 3.21 4.77 0.02 -2.44 117.00 130.34 1tls n LEU 38 Ca 0.12 0.53 -0.09 0.00 -0.03 0.00 0.00 56.01 56.54 1tls n LEU 38 Cb 0.48 -0.51 0.06 0.00 -2.33 0.00 0.00 43.42 41.13 1tls n LEU 38 CO 0.69 -0.29 0.46 1.56 -1.33 0.00 0.00 177.39 178.48 1tls h GLN 39 N 0.00 0.49 0.00 3.23 1.08 -1.82 -3.25 115.11 114.85 1tls h GLN 39 Ca 0.00 -0.32 0.00 0.00 -1.45 0.00 0.00 58.65 56.88 1tls h GLN 39 Cb 0.29 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.76 1tls h GLN 39 CO 0.00 0.93 0.00 -0.25 -0.95 0.00 0.00 178.83 178.56 1tls n ASP 40 N -3.93 0.00 0.00 1.46 8.00 -1.02 -4.99 116.55 116.06 1tls n ASP 40 Ca -0.03 -1.52 0.00 0.00 0.71 0.00 0.00 54.79 53.95 1tls n ASP 40 Cb 0.62 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.72 1tls n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tls n GLY 41 N 0.38 3.08 3.71 0.44 0.00 -1.23 -4.77 105.19 106.81 1tls n GLY 41 Ca 0.03 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.66 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 -2.96 3.26 -1.19 1.61 5.36 -1.10 -4.69 117.98 118.27 1tls s PHE 42 Ca 0.00 0.99 -0.18 0.00 -0.96 0.00 0.00 56.93 56.77 1tls s PHE 42 Cb 0.00 -3.65 -0.03 0.00 -0.34 0.00 0.00 43.02 38.99 1tls s PHE 42 CO 0.00 -2.27 2.00 -0.35 -1.46 0.00 0.00 175.22 173.14 1tls n PRO 43 N 3.97 2.35 -4.00 10.12 -0.04 -1.26 -4.14 135.00 142.00 1tls n PRO 43 Ca 0.11 -2.50 -0.35 0.00 -0.04 0.00 0.00 63.50 60.73 1tls n PRO 43 Cb 0.43 -3.29 -0.14 0.00 -0.04 0.00 0.00 33.50 30.46 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 3.57 2.77 0.18 1.53 2.96 -1.26 -3.87 118.68 124.56 1tls s LEU 44 Ca 0.55 -0.42 -0.33 0.00 -0.22 0.00 0.00 54.13 53.70 1tls s LEU 44 Cb 0.10 -1.69 -0.15 0.00 0.50 0.00 0.00 46.19 44.95 1tls s LEU 44 CO 0.04 -0.00 1.25 0.52 -1.32 0.00 0.00 176.35 176.83 1tls n VAL 45 N 4.67 0.78 0.43 1.68 0.31 -1.26 -4.83 118.33 120.11 1tls n VAL 45 Ca -0.19 -0.19 0.05 0.00 -0.01 0.00 0.00 64.34 64.00 1tls n VAL 45 Cb 0.51 -1.00 -0.06 0.00 -0.91 0.00 0.00 33.84 32.37 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 1.77 0.00 1.78 2.52 -2.24 -1.26 -4.39 114.28 112.46 1tls n THR 46 Ca 0.15 -0.25 0.15 0.00 -2.27 0.00 0.00 64.05 61.83 1tls n THR 46 Cb 0.26 0.88 0.85 0.00 -2.10 0.00 0.00 70.33 70.21 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 -1.35 0.00 -3.64 4.28 -2.24 -1.26 -0.80 114.28 109.26 1tls n THR 47 Ca 0.01 -0.02 -0.09 0.00 -2.27 0.00 0.00 64.05 61.68 1tls n THR 47 Cb 0.19 -0.39 -0.07 0.00 -2.10 0.00 0.00 70.33 67.95 1tls n THR 47 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1tls s LYS 48 N -2.17 0.73 0.21 -0.78 -2.85 -1.26 -4.64 119.74 108.97 1tls s LYS 48 Ca 0.41 1.13 -0.32 0.00 -1.00 0.00 0.00 55.97 56.20 1tls s LYS 48 Cb 0.21 0.21 -0.11 0.00 -2.06 0.00 0.00 37.83 36.08 1tls s LYS 48 CO 0.40 -0.13 1.65 0.50 0.10 0.00 0.00 175.35 177.86 1tls s ARG 49 N 1.24 4.16 -0.08 1.78 3.52 -0.59 -4.75 118.95 124.22 1tls s ARG 49 Ca -0.07 2.51 -0.04 0.00 -0.13 0.00 0.00 55.73 58.00 1tls s ARG 49 Cb -0.05 -3.09 -0.04 0.00 -1.56 0.00 0.00 34.95 30.21 1tls s ARG 49 CO -0.13 -0.68 0.08 0.00 -0.81 0.00 0.00 175.30 173.76 1tls s HIS 51 N -1.02 2.40 0.52 0.00 2.46 -1.26 -4.86 115.29 113.53 1tls s HIS 51 Ca 0.16 -0.55 0.23 0.00 0.47 0.00 0.00 55.06 55.37 1tls s HIS 51 Cb -0.12 -4.61 1.47 0.00 -0.13 0.00 0.00 32.58 29.20 1tls s HIS 51 CO 0.06 -1.94 2.15 1.25 -2.47 0.00 0.00 174.74 173.79 1tls h LEU 52 N 13.47 0.00 -0.57 8.88 5.85 -2.00 -3.05 115.31 137.90 1tls h LEU 52 Ca 0.13 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.69 1tls h LEU 52 Cb 1.02 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 1tls h LEU 52 CO 1.38 0.06 -0.70 -0.09 -0.34 0.00 0.00 178.44 178.75 1tls h ARG 53 N 0.00 0.10 -0.17 1.25 2.43 -2.00 -2.42 114.38 113.58 1tls h ARG 53 Ca -0.00 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 59.01 1tls h ARG 53 Cb 0.12 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1tls h ARG 53 CO 0.01 0.76 -0.19 0.77 -1.51 0.00 0.00 179.97 179.81 1tls h SER 54 N 0.07 0.46 0.11 -3.80 0.02 -1.92 -2.17 113.55 106.33 1tls h SER 54 Ca -0.01 -0.49 0.02 0.00 -0.84 0.00 0.00 61.79 60.46 1tls h SER 54 Cb 1.24 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 63.62 1tls h SER 54 CO 0.10 0.86 -0.23 0.40 -1.14 0.00 0.00 176.83 176.82 1tls h ILE 55 N 0.08 0.49 0.49 3.27 2.04 -1.58 -2.01 117.51 120.29 1tls h ILE 55 Ca 0.03 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 1tls h ILE 55 Cb 0.73 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1tls h ILE 55 CO 0.05 0.00 -0.23 0.40 0.00 0.00 0.00 178.15 178.36 1tls h ILE 56 N -0.42 0.50 -0.90 -0.67 2.04 -1.43 -2.90 117.51 113.73 1tls h ILE 56 Ca 0.03 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.71 1tls h ILE 56 Cb 0.44 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 37.06 1tls h ILE 56 CO -0.13 0.03 0.58 0.45 0.00 0.00 0.00 178.15 179.08 1tls h HIS 57 N -0.76 1.15 -0.09 1.37 3.86 -1.41 -0.83 115.15 118.45 1tls h HIS 57 Ca -0.07 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.20 1tls h HIS 57 Cb 0.55 -0.39 -0.05 0.00 1.06 0.00 0.00 27.41 28.59 1tls h HIS 57 CO -0.02 0.74 -0.22 1.49 0.86 0.00 0.00 177.93 180.79 1tls h GLU 58 N 1.23 -0.29 0.20 2.45 4.81 -1.32 0.41 114.58 122.07 1tls h GLU 58 Ca 0.33 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.59 1tls h GLU 58 Cb -0.11 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 1tls h GLU 58 CO -0.07 -0.19 -0.28 1.25 -0.73 0.00 0.00 179.01 178.99 1tls h LEU 59 N -0.30 -0.77 -2.14 1.64 5.85 -1.25 -0.18 115.31 118.16 1tls h LEU 59 Ca 0.09 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 1tls h LEU 59 Cb 0.42 0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.73 1tls h LEU 59 CO -0.26 -0.38 -0.07 -0.07 -0.34 0.00 0.00 178.44 177.32 1tls h LEU 60 N -0.54 0.00 -0.28 2.25 3.38 -0.78 -1.49 115.31 117.85 1tls h LEU 60 Ca 0.01 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.80 1tls h LEU 60 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1tls h LEU 60 CO -0.11 0.07 -0.55 -0.25 0.09 0.00 0.00 178.44 177.70 1tls h TRP 61 N 0.00 1.08 0.67 1.13 7.01 0.15 -3.21 115.95 122.79 1tls h TRP 61 Ca -0.00 -0.39 -0.03 0.00 2.11 0.00 0.00 58.89 60.58 1tls h TRP 61 Cb 0.20 -0.20 -0.00 0.00 -2.10 0.00 0.00 29.16 27.05 1tls h TRP 61 CO 0.00 1.22 -0.43 0.74 -2.79 0.00 0.00 178.44 177.18 1tls h PHE 62 N 0.64 -1.15 0.00 2.65 0.04 -0.13 -2.90 116.94 116.09 1tls h PHE 62 Ca 0.01 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1tls h PHE 62 Cb 1.16 0.41 0.00 0.00 2.20 0.00 0.00 35.95 39.72 1tls h PHE 62 CO 0.08 -0.64 0.39 -0.07 -0.60 0.00 0.00 178.31 177.47 1tls h LEU 63 N -1.04 0.00 0.00 1.54 3.38 -1.43 0.57 115.31 118.33 1tls h LEU 63 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1tls h LEU 63 Cb 0.84 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1tls h LEU 63 CO 0.08 0.00 -0.59 0.00 0.09 0.00 0.00 178.44 178.02 1tls n GLN 64 N -2.58 0.24 -2.10 1.13 1.13 -1.11 -4.94 117.38 109.15 1tls n GLN 64 Ca -0.01 0.07 -0.07 0.00 -1.94 0.00 0.00 57.00 55.05 1tls n GLN 64 Cb 0.43 -1.65 -0.00 0.00 0.11 0.00 0.00 30.24 29.12 1tls n GLN 64 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1tls n GLY 65 N 1.37 0.11 3.76 1.08 0.00 0.20 -5.02 105.19 106.69 1tls n GLY 65 Ca 0.04 -0.59 -0.39 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.69 6.90 0.00 1.61 2.15 -1.14 -4.07 116.67 119.43 1tls s ASP 66 Ca 0.00 1.08 0.08 0.00 0.43 0.00 0.00 52.55 54.14 1tls s ASP 66 Cb 0.00 -2.34 0.13 0.00 -0.30 0.00 0.00 42.92 40.42 1tls s ASP 66 CO 0.00 0.11 0.94 0.35 -0.17 0.00 0.00 175.17 176.40 1tls n THR 67 N 2.78 0.41 -4.05 1.71 -2.24 -1.26 -4.34 114.28 107.28 1tls n THR 67 Ca -0.08 -0.70 -0.35 0.00 -2.27 0.00 0.00 64.05 60.65 1tls n THR 67 Cb 0.51 0.90 -0.11 0.00 -2.10 0.00 0.00 70.33 69.53 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 -0.83 5.29 0.00 3.42 3.84 -1.26 -2.44 114.94 122.96 1tls s ASN 68 Ca 0.13 -0.04 0.13 0.00 0.21 0.00 0.00 52.86 53.28 1tls s ASN 68 Cb 0.08 -1.91 0.55 0.00 -0.55 0.00 0.00 41.25 39.42 1tls s ASN 68 CO 0.11 0.12 1.39 2.30 -2.79 0.00 0.00 177.10 178.24 1tls n ILE 69 N 3.87 1.08 0.00 -5.21 -5.35 -0.58 -3.75 119.36 109.41 1tls n ILE 69 Ca -0.17 0.27 0.00 0.00 -0.27 0.00 0.00 62.75 62.58 1tls n ILE 69 Cb 0.52 -1.05 0.00 0.00 -1.74 0.00 0.00 39.64 37.37 1tls n ILE 69 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1tls n ALA 70 N -1.47 -0.01 -0.38 -1.28 0.00 -1.26 0.80 120.51 116.90 1tls n ALA 70 Ca 0.03 0.00 0.31 0.00 0.00 0.00 0.00 53.44 53.79 1tls n ALA 70 Cb 0.14 0.41 0.58 0.00 0.00 0.00 0.00 19.45 20.58 1tls n ALA 70 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1tls h TYR 71 N 0.00 0.70 -0.02 0.00 5.03 -2.00 1.13 116.97 121.82 1tls h TYR 71 Ca 0.00 0.03 -0.08 0.00 2.58 0.00 0.00 58.73 61.26 1tls h TYR 71 Cb 0.00 -0.18 -0.01 0.00 1.55 0.00 0.00 36.73 38.09 1tls h TYR 71 CO -0.63 -0.22 -0.36 -0.07 -1.32 0.00 0.00 178.16 175.56 1tls h LEU 72 N 0.16 0.03 0.30 2.82 3.38 0.20 -3.24 115.31 118.96 1tls h LEU 72 Ca 0.78 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.73 1tls h LEU 72 Cb 2.18 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.93 1tls h LEU 72 CO -0.52 0.39 -0.14 0.45 0.09 0.00 0.00 178.44 178.71 1tls h HIS 73 N 0.03 -0.37 -0.55 1.13 3.86 0.29 0.55 115.15 120.09 1tls h HIS 73 Ca 0.00 -0.01 0.16 0.00 -1.16 0.00 0.00 60.37 59.36 1tls h HIS 73 Cb 0.65 0.12 -0.02 0.00 1.06 0.00 0.00 27.41 29.22 1tls h HIS 73 CO 0.00 -0.05 0.60 0.93 0.86 0.00 0.00 177.93 180.27 1tls h GLU 74 N -0.72 0.00 -0.53 2.45 5.08 -1.53 1.37 114.58 120.70 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 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 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 -3.63 4.52 -3.74 1.42 4.13 -1.19 -4.95 115.26 111.81 1tls n ASN 75 Ca 0.11 -2.57 -0.24 0.00 1.68 0.00 0.00 54.58 53.56 1tls n ASN 75 Cb 0.81 -0.54 0.03 0.00 -1.54 0.00 0.00 39.78 38.54 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 0.67 -2.35 -4.13 6.41 4.13 0.47 -4.97 115.26 115.50 1tls n ASN 76 Ca 0.24 -0.79 -0.34 0.00 1.68 0.00 0.00 54.58 55.37 1tls n ASN 76 Cb 0.88 -4.09 -0.14 0.00 -1.54 0.00 0.00 39.78 34.88 1tls n ASN 76 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1tls s VAL 77 N -3.55 2.61 -1.87 2.41 1.01 0.19 -5.00 120.40 116.21 1tls s VAL 77 Ca 0.20 -1.46 0.20 0.00 0.00 0.00 0.00 61.98 60.91 1tls s VAL 77 Cb -0.10 -2.49 0.47 0.00 0.00 0.00 0.00 36.38 34.26 1tls s VAL 77 CO 0.81 -0.04 1.39 0.35 0.00 0.00 0.00 175.10 177.61 1tls n THR 78 N 4.54 0.78 0.30 3.92 -2.24 -1.26 -3.75 114.28 116.58 1tls n THR 78 Ca -0.14 -0.89 0.18 0.00 -2.27 0.00 0.00 64.05 60.92 1tls n THR 78 Cb 0.43 0.70 1.00 0.00 -2.10 0.00 0.00 70.33 70.36 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 3.74 0.36 -0.29 2.28 3.07 -1.95 -2.87 117.51 121.86 1tls h ILE 79 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 1tls h ILE 79 Cb 0.90 0.98 0.00 0.00 -0.27 0.00 0.00 36.82 38.43 1tls h ILE 79 CO 0.00 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 177.89 1tls n TRP 80 N -3.61 0.80 0.10 0.16 7.02 -1.26 -4.77 117.44 115.87 1tls n TRP 80 Ca -0.03 -0.76 -0.13 0.00 -1.02 0.00 0.00 57.50 55.56 1tls n TRP 80 Cb 0.10 -0.23 -0.08 0.00 -2.42 0.00 0.00 31.31 28.68 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 1.87 -0.18 0.45 -0.99 5.19 -1.85 -3.25 116.42 117.66 1tls h ASP 81 Ca 0.00 -0.14 0.00 0.00 -0.62 0.00 0.00 57.03 56.27 1tls h ASP 81 Cb 1.22 0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.78 1tls h ASP 81 CO 0.15 0.04 0.00 -1.84 -3.12 0.00 0.00 179.24 174.47 1tls n GLU 82 N -5.10 0.02 0.00 3.56 0.00 -1.26 -3.00 120.64 114.86 1tls n GLU 82 Ca -0.09 0.30 0.05 0.00 0.00 0.00 0.00 57.16 57.43 1tls n GLU 82 Cb 0.18 -1.54 -0.06 0.00 0.00 0.00 0.00 31.44 30.02 1tls n GLU 82 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.13 178.04 1tls n TRP 83 N -1.58 0.00 -1.77 -1.84 8.01 -1.25 -5.03 117.44 113.99 1tls n TRP 83 Ca 0.03 0.00 -0.31 0.00 -1.31 0.00 0.00 57.50 55.91 1tls n TRP 83 Cb 0.15 0.00 0.04 0.00 -2.01 0.00 0.00 31.31 29.49 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 -2.00 2.86 0.74 6.99 0.00 -1.16 -4.78 121.76 124.40 1tls s ALA 84 Ca 0.05 -0.12 -0.03 0.00 0.00 0.00 0.00 51.96 51.86 1tls s ALA 84 Cb 0.09 -3.09 0.13 0.00 0.00 0.00 0.00 23.12 20.24 1tls s ALA 84 CO 0.45 -1.04 0.83 -0.40 0.00 0.00 0.00 175.76 175.60 1tls n ASP 85 N -2.98 0.80 0.10 0.00 5.68 -0.17 -4.86 116.55 115.13 1tls n ASP 85 Ca 0.07 -1.75 0.07 0.00 -0.50 0.00 0.00 54.79 52.68 1tls n ASP 85 Cb 0.55 -0.57 0.37 0.00 -1.14 0.00 0.00 41.12 40.34 1tls n ASP 85 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1tls n GLU 86 N -2.60 0.09 -0.04 0.11 0.00 -1.26 -1.08 120.64 115.87 1tls n GLU 86 Ca 0.13 0.57 0.04 0.00 0.00 0.00 0.00 57.16 57.90 1tls n GLU 86 Cb 0.45 -1.79 -0.16 0.00 0.00 0.00 0.00 31.44 29.94 1tls n GLU 86 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1tls n ASN 87 N -1.98 0.20 0.00 -1.84 5.03 -1.26 -5.00 115.26 110.42 1tls n ASN 87 Ca -0.01 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.44 1tls n ASN 87 Cb 0.03 1.66 0.00 0.00 -1.02 0.00 0.00 39.78 40.45 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 1.46 1.26 3.87 7.41 0.00 -0.24 -4.90 105.19 114.06 1tls n GLY 88 Ca -0.12 -0.18 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.17 6.64 -0.00 1.61 1.01 -1.26 -1.52 116.67 120.97 1tls s ASP 89 Ca 0.00 0.80 0.08 0.00 0.71 0.00 0.00 52.55 54.13 1tls s ASP 89 Cb 0.00 -2.18 -0.10 0.00 1.01 0.00 0.00 42.92 41.65 1tls s ASP 89 CO 0.00 0.15 0.26 0.18 0.21 0.00 0.00 175.17 175.97 1tls n LEU 90 N 0.81 0.21 0.00 1.23 4.77 -1.02 -1.00 117.00 122.00 1tls n LEU 90 Ca -0.07 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.61 1tls n LEU 90 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 1tls n LEU 90 CO 0.43 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 1tls n GLY 91 N 1.53 -3.38 2.80 -0.72 0.00 -1.26 0.13 105.19 104.28 1tls n GLY 91 Ca 0.00 -2.11 -0.08 0.00 0.00 0.00 0.00 46.02 43.83 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 -0.04 0.76 0.00 1.61 -0.04 -1.26 -4.82 135.00 131.21 1tls n PRO 92 Ca 0.00 -0.79 0.00 0.00 -0.04 0.00 0.00 63.50 62.67 1tls n PRO 92 Cb 0.00 -2.11 0.00 0.00 -0.04 0.00 0.00 33.50 31.35 1tls n PRO 92 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1tls n VAL 93 N 4.48 0.00 -0.14 0.52 0.24 -1.26 -4.46 118.33 117.71 1tls n VAL 93 Ca 0.16 0.00 -0.04 0.00 -2.04 0.00 0.00 64.34 62.42 1tls n VAL 93 Cb 0.07 -1.64 -0.03 0.00 -1.47 0.00 0.00 33.84 30.76 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 -1.05 -0.15 -0.16 6.34 4.01 -1.26 -0.81 117.16 124.08 1tls n TYR 94 Ca 0.00 0.43 -0.03 0.00 -0.16 0.00 0.00 57.90 58.14 1tls n TYR 94 Cb 0.00 -0.46 0.04 0.00 -0.31 0.00 0.00 39.34 38.60 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 0.36 1.20 2.72 0.00 -1.77 -0.14 103.07 105.43 1tls h GLY 95 Ca 0.05 0.17 -0.06 0.00 0.00 0.00 0.00 47.33 47.49 1tls h GLY 95 CO -0.32 -0.19 0.14 1.70 0.00 0.00 0.00 176.54 177.87 1tls h LYS 96 N -0.00 1.00 0.00 4.80 3.11 -1.11 -2.34 116.57 122.01 1tls h LYS 96 Ca 0.24 -0.23 -0.13 0.00 -2.81 0.00 0.00 60.65 57.73 1tls h LYS 96 Cb 0.38 -0.14 -0.02 0.00 -1.00 0.00 0.00 32.23 31.45 1tls h LYS 96 CO -0.52 0.89 -0.65 1.96 -2.81 0.00 0.00 179.45 178.32 1tls h GLN 97 N 0.95 0.00 -0.05 1.90 1.08 -1.13 -0.51 115.11 117.35 1tls h GLN 97 Ca 0.20 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.30 1tls h GLN 97 Cb 0.35 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.79 1tls h GLN 97 CO 0.00 0.56 -0.36 -1.49 -0.95 0.00 0.00 178.83 176.59 1tls h TRP 98 N 0.00 0.46 0.00 2.96 4.06 -0.90 -3.34 115.95 119.19 1tls h TRP 98 Ca -0.02 -0.21 0.00 0.00 2.06 0.00 0.00 58.89 60.72 1tls h TRP 98 Cb 1.46 -0.07 0.00 0.00 -1.00 0.00 0.00 29.16 29.55 1tls h TRP 98 CO 0.00 0.97 -1.21 0.54 -3.56 0.00 0.00 178.44 175.18 1tls n ARG 99 N -4.40 0.32 -2.74 0.49 5.12 -0.90 -0.94 116.66 113.62 1tls n ARG 99 Ca -0.09 -0.04 -0.07 0.00 -1.93 0.00 0.00 57.85 55.72 1tls n ARG 99 Cb 0.53 -1.57 0.05 0.00 -1.16 0.00 0.00 32.46 30.31 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 -1.86 -1.83 -2.17 7.54 0.00 -0.20 -4.06 120.51 117.93 1tls n ALA 100 Ca 0.01 -1.18 -0.43 0.00 0.00 0.00 0.00 53.44 51.85 1tls n ALA 100 Cb 0.45 -1.67 -0.02 0.00 0.00 0.00 0.00 19.45 18.20 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 0.63 2.24 -0.19 0.00 -0.11 0.37 -4.60 118.94 117.28 1tls s TRP 101 Ca 0.31 0.59 -0.29 0.00 1.22 0.00 0.00 56.10 57.93 1tls s TRP 101 Cb 0.20 -3.91 -0.03 0.00 -1.50 0.00 0.00 33.47 28.23 1tls s TRP 101 CO -0.21 -2.76 1.61 -1.25 -4.62 0.00 0.00 176.95 169.72 1tls s PRO 102 N 4.40 3.87 0.71 5.86 0.04 -1.26 -1.64 135.00 146.99 1tls s PRO 102 Ca 0.68 1.75 -0.11 0.00 0.04 0.00 0.00 61.00 63.36 1tls s PRO 102 Cb -0.25 -4.02 0.03 0.00 0.04 0.00 0.00 34.50 30.31 1tls s PRO 102 CO 0.27 -1.20 1.09 0.95 0.04 0.00 0.00 177.00 178.14 1tls s THR 103 N 4.96 3.09 0.47 1.26 -4.23 -0.96 -4.98 115.64 115.24 1tls s THR 103 Ca 0.71 0.26 0.12 0.00 -1.18 0.00 0.00 61.69 61.60 1tls s THR 103 Cb -0.26 -3.34 0.27 0.00 1.34 0.00 0.00 72.50 70.51 1tls s THR 103 CO 0.29 -0.43 2.10 1.55 -0.54 0.00 0.00 174.62 177.59 1tls h PRO 104 N -0.68 0.26 -0.01 3.99 0.13 -1.95 -3.19 132.00 130.56 1tls h PRO 104 Ca -0.45 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1tls h PRO 104 Cb 1.28 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1tls h PRO 104 CO 0.64 0.17 -0.23 -0.40 -0.23 0.00 0.00 178.00 177.95 1tls n ASP 105 N -4.51 0.82 0.00 1.44 5.75 -1.26 -4.96 116.55 113.84 1tls n ASP 105 Ca 0.00 -0.73 0.00 0.00 -0.01 0.00 0.00 54.79 54.05 1tls n ASP 105 Cb 0.09 0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 1tls n ASP 105 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1tls n GLY 106 N 1.34 0.76 2.42 6.12 0.00 -1.20 -5.11 105.19 109.51 1tls n GLY 106 Ca 0.12 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.97 1tls n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tls n ARG 107 N -0.98 -0.57 -3.69 1.61 1.74 -1.26 -4.90 116.66 108.61 1tls n ARG 107 Ca 0.00 -1.40 -0.10 0.00 -0.77 0.00 0.00 57.85 55.58 1tls n ARG 107 Cb 0.00 -0.75 -0.10 0.00 -1.02 0.00 0.00 32.46 30.59 1tls n ARG 107 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1tls s HIS 108 N -2.58 -0.63 -0.19 -1.55 3.76 -1.26 -2.27 115.29 110.57 1tls s HIS 108 Ca 0.46 1.34 -0.05 0.00 -0.15 0.00 0.00 55.06 56.67 1tls s HIS 108 Cb -0.02 0.29 -0.02 0.00 1.11 0.00 0.00 32.58 33.94 1tls s HIS 108 CO 0.32 -0.35 -0.01 0.42 -0.85 0.00 0.00 174.74 174.27 1tls s ILE 109 N 1.31 3.87 -0.75 0.60 1.01 -0.65 -4.85 121.20 121.74 1tls s ILE 109 Ca -0.09 -0.34 -0.20 0.00 0.00 0.00 0.00 60.65 60.02 1tls s ILE 109 Cb -0.08 -2.74 0.10 0.00 0.01 0.00 0.00 42.46 39.76 1tls s ILE 109 CO -0.12 0.44 0.97 -0.62 0.00 0.00 0.00 174.94 175.61 1tls s ASP 110 N 0.91 6.36 0.45 3.58 -1.08 -1.26 -0.48 116.67 125.14 1tls s ASP 110 Ca 0.01 -1.51 0.15 0.00 -0.52 0.00 0.00 52.55 50.67 1tls s ASP 110 Cb -0.14 -2.38 1.00 0.00 -1.46 0.00 0.00 42.92 39.93 1tls s ASP 110 CO 0.02 -1.22 1.99 1.56 0.52 0.00 0.00 175.17 178.04 1tls h GLN 111 N 9.18 0.00 -0.07 4.34 4.20 -1.29 -2.41 115.11 129.06 1tls h GLN 111 Ca -0.11 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.57 1tls h GLN 111 Cb 1.06 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.83 1tls h GLN 111 CO 1.13 0.19 -0.07 0.82 -0.67 0.00 0.00 178.83 180.23 1tls h ILE 112 N 0.00 1.37 -0.64 2.54 1.08 -1.81 -1.93 117.51 118.12 1tls h ILE 112 Ca -0.00 -1.22 0.04 0.00 -0.39 0.00 0.00 64.86 63.29 1tls h ILE 112 Cb 0.34 2.04 -0.04 0.00 -3.07 0.00 0.00 36.82 36.08 1tls h ILE 112 CO 0.02 0.34 0.38 0.74 -0.69 0.00 0.00 178.15 178.94 1tls h THR 113 N -0.27 1.04 -0.18 -0.27 2.02 -1.87 -1.50 112.91 111.87 1tls h THR 113 Ca 0.01 -0.25 0.01 0.00 0.77 0.00 0.00 66.41 66.94 1tls h THR 113 Cb 0.57 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 1tls h THR 113 CO 0.02 0.14 0.11 0.74 0.37 0.00 0.00 175.52 176.89 1tls h THR 114 N 0.74 1.03 -0.52 3.16 2.02 -1.40 -0.71 112.91 117.22 1tls h THR 114 Ca 0.27 -0.08 -0.04 0.00 0.77 0.00 0.00 66.41 67.33 1tls h THR 114 Cb 0.07 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 1tls h THR 114 CO -0.13 0.04 0.17 0.58 0.37 0.00 0.00 175.52 176.55 1tls h VAL 115 N 0.23 1.21 -0.13 3.16 2.07 -0.88 -0.90 116.25 121.00 1tls h VAL 115 Ca 0.07 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 1tls h VAL 115 Cb -0.01 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1tls h VAL 115 CO -0.03 0.27 0.05 -0.07 0.02 0.00 0.00 177.57 177.80 1tls h LEU 116 N 0.76 0.18 -1.50 2.57 3.38 -0.83 -0.32 115.31 119.56 1tls h LEU 116 Ca 0.18 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1tls h LEU 116 Cb 0.22 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1tls h LEU 116 CO -0.01 0.32 0.19 0.78 0.09 0.00 0.00 178.44 179.82 1tls h ASN 117 N 0.04 0.47 -0.15 -0.43 -0.26 -0.78 -0.22 115.58 114.25 1tls h ASN 117 Ca 0.04 -0.03 -0.18 0.00 -0.56 0.00 0.00 56.30 55.57 1tls h ASN 117 Cb 0.20 -0.12 0.01 0.00 -1.06 0.00 0.00 38.32 37.35 1tls h ASN 117 CO -0.00 0.40 -0.62 1.56 -1.06 0.00 0.00 177.43 177.70 1tls h GLN 118 N 0.54 0.69 0.00 0.81 4.20 -0.76 0.12 115.11 120.71 1tls h GLN 118 Ca 0.14 -0.54 -0.07 0.00 0.06 0.00 0.00 58.65 58.23 1tls h GLN 118 Cb 0.05 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 1tls h GLN 118 CO -0.02 1.16 -0.35 -0.07 -0.67 0.00 0.00 178.83 178.88 1tls h LEU 119 N 0.38 0.00 0.13 1.46 3.38 -0.47 0.17 115.31 120.36 1tls h LEU 119 Ca -0.03 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.62 1tls h LEU 119 Cb 1.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 1tls h LEU 119 CO 0.13 0.35 -1.61 0.11 0.09 0.00 0.00 178.44 177.51 1tls h LYS 120 N 0.00 0.28 0.00 1.13 1.57 -0.83 -3.37 116.57 115.35 1tls h LYS 120 Ca -0.00 -0.48 -0.17 0.00 -1.87 0.00 0.00 60.65 58.13 1tls h LYS 120 Cb 0.62 0.18 -0.03 0.00 0.08 0.00 0.00 32.23 33.08 1tls h LYS 120 CO 0.05 1.23 -1.83 0.09 -0.57 0.00 0.00 179.45 178.42 1tls n ASN 121 N -3.77 0.38 -3.06 0.86 4.13 0.39 -4.78 115.26 109.40 1tls n ASN 121 Ca -0.27 0.16 -0.17 0.00 1.68 0.00 0.00 54.58 55.98 1tls n ASN 121 Cb 0.97 0.94 -0.02 0.00 -1.54 0.00 0.00 39.78 40.13 1tls n ASN 121 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1tls n ASP 122 N -2.66 -0.40 0.26 6.41 2.03 0.56 -5.00 116.55 117.76 1tls n ASP 122 Ca -0.14 -3.04 0.12 0.00 0.52 0.00 0.00 54.79 52.25 1tls n ASP 122 Cb 0.83 0.09 0.71 0.00 -0.72 0.00 0.00 41.12 42.04 1tls n ASP 122 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1tls h PRO 123 N 3.50 0.00 0.00 -0.67 0.13 -1.65 -2.37 132.00 130.94 1tls h PRO 123 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1tls h PRO 123 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1tls h PRO 123 CO 0.41 0.12 0.00 -0.25 -0.23 0.00 0.00 178.00 178.05 1tls n ASP 124 N -3.74 0.50 -4.44 1.44 8.00 -1.26 -4.08 116.55 112.97 1tls n ASP 124 Ca -0.02 0.57 -0.42 0.00 0.71 0.00 0.00 54.79 55.63 1tls n ASP 124 Cb 0.23 -0.70 0.00 0.00 -0.02 0.00 0.00 41.12 40.63 1tls n ASP 124 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1tls n SER 125 N -2.00 -0.97 -0.68 -2.24 2.88 -0.89 -4.92 113.62 104.79 1tls n SER 125 Ca 0.05 0.92 0.07 0.00 -1.33 0.00 0.00 58.87 58.57 1tls n SER 125 Cb 0.32 -1.09 0.14 0.00 -0.75 0.00 0.00 64.21 62.83 1tls n SER 125 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1tls n ARG 126 N 0.67 2.24 -0.61 -1.46 1.74 -1.26 -4.44 116.66 113.55 1tls n ARG 126 Ca 0.12 -1.89 0.02 0.00 -0.77 0.00 0.00 57.85 55.33 1tls n ARG 126 Cb 0.39 -1.30 0.21 0.00 -1.02 0.00 0.00 32.46 30.74 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 0.71 2.14 -2.62 5.56 1.74 -1.26 -4.95 116.66 117.98 1tls n ARG 127 Ca 0.12 -3.02 -0.41 0.00 -0.77 0.00 0.00 57.85 53.77 1tls n ARG 127 Cb 0.42 -1.79 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 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 -3.07 4.02 0.04 0.55 1.01 -1.26 -4.95 121.20 117.53 1tls s ILE 128 Ca 0.42 -0.68 -0.03 0.00 0.00 0.00 0.00 60.65 60.37 1tls s ILE 128 Cb 0.37 -4.99 -0.02 0.00 0.01 0.00 0.00 42.46 37.83 1tls s ILE 128 CO 0.03 -1.85 0.03 -0.63 0.00 0.00 0.00 174.94 172.52 1tls s ILE 129 N 4.74 0.16 -0.05 2.92 1.01 -1.26 -1.13 121.20 127.59 1tls s ILE 129 Ca 0.42 -1.29 0.01 0.00 0.00 0.00 0.00 60.65 59.79 1tls s ILE 129 Cb -0.03 -0.98 0.02 0.00 0.01 0.00 0.00 42.46 41.48 1tls s ILE 129 CO -0.05 -0.71 -0.07 -0.69 0.00 0.00 0.00 174.94 173.41 1tls s VAL 130 N -2.84 0.77 -0.06 2.92 1.01 -0.16 -4.89 120.40 117.15 1tls s VAL 130 Ca -0.03 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 61.74 1tls s VAL 130 Cb 0.00 -0.75 -0.01 0.00 0.00 0.00 0.00 36.38 35.63 1tls s VAL 130 CO -0.06 0.28 -0.21 -0.55 0.00 0.00 0.00 175.10 174.55 1tls s SER 131 N 0.84 2.68 0.00 3.32 0.15 -1.26 -1.01 113.70 118.42 1tls s SER 131 Ca -0.12 -0.45 0.19 0.00 0.70 0.00 0.00 55.95 56.27 1tls s SER 131 Cb -0.15 -0.83 -0.17 0.00 -1.71 0.00 0.00 66.02 63.16 1tls s SER 131 CO 0.01 0.19 0.85 0.00 1.20 0.00 0.00 173.24 175.49 1tls n ALA 132 N 3.14 4.29 -1.60 5.45 0.00 0.44 -4.64 120.51 127.59 1tls n ALA 132 Ca -0.18 -0.55 -0.41 0.00 0.00 0.00 0.00 53.44 52.29 1tls n ALA 132 Cb 0.52 -0.70 -0.01 0.00 0.00 0.00 0.00 19.45 19.27 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 -1.18 3.16 -2.79 0.00 -0.00 -1.19 -4.82 117.44 110.62 1tls n TRP 133 Ca 0.05 -3.02 -0.43 0.00 -0.00 0.00 0.00 57.50 54.10 1tls n TRP 133 Cb 0.32 -2.53 -0.03 0.00 -0.00 0.00 0.00 31.31 29.08 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 2.82 6.58 0.43 5.87 3.04 -1.26 -4.89 114.94 127.53 1tls s ASN 134 Ca 0.54 -1.83 0.27 0.00 0.04 0.00 0.00 52.86 51.88 1tls s ASN 134 Cb 0.15 -2.46 1.32 0.00 -1.54 0.00 0.00 41.25 38.72 1tls s ASN 134 CO -0.08 -1.23 1.69 0.58 -3.04 0.00 0.00 177.10 175.02 1tls h VAL 135 N 6.19 0.28 0.00 -5.21 2.07 -2.01 0.41 116.25 117.99 1tls h VAL 135 Ca 0.18 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.62 1tls h VAL 135 Cb 1.02 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1tls h VAL 135 CO 1.23 0.03 -0.03 1.23 0.02 0.00 0.00 177.57 180.05 1tls h GLY 136 N 0.19 0.00 -0.08 2.17 0.00 -2.00 -3.23 103.07 100.12 1tls h GLY 136 Ca 0.72 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.05 1tls h GLY 136 CO -0.34 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.38 1tls n GLU 137 N -3.15 2.06 -0.34 4.80 1.02 0.11 -4.72 120.64 120.42 1tls n GLU 137 Ca 0.00 -1.30 0.01 0.00 -0.02 0.00 0.00 57.16 55.85 1tls n GLU 137 Cb 0.31 -1.02 0.17 0.00 -0.02 0.00 0.00 31.44 30.89 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 0.14 1.04 0.00 -4.62 3.38 -1.51 -1.97 115.31 111.77 1tls h LEU 138 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1tls h LEU 138 Cb 0.40 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1tls h LEU 138 CO 0.00 0.71 0.00 -0.90 0.09 0.00 0.00 178.44 178.34 1tls n ASP 139 N -4.44 0.00 0.03 -0.43 5.75 -1.26 -2.73 116.55 113.46 1tls n ASP 139 Ca 0.13 0.35 0.11 0.00 -0.01 0.00 0.00 54.79 55.37 1tls n ASP 139 Cb 0.11 -0.42 -0.07 0.00 -1.03 0.00 0.00 41.12 39.71 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 -1.42 0.48 -2.77 0.11 4.01 -0.74 -4.96 118.16 112.87 1tls n LYS 140 Ca 0.04 -0.05 -0.34 0.00 -0.51 0.00 0.00 58.31 57.45 1tls n LYS 140 Cb 0.14 -1.61 -0.06 0.00 -0.51 0.00 0.00 35.03 32.99 1tls n LYS 140 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 1tls s MET 141 N -3.34 4.26 0.40 1.97 -1.94 -1.10 -4.39 119.30 115.16 1tls s MET 141 Ca -0.01 1.21 0.10 0.00 -1.71 0.00 0.00 55.69 55.27 1tls s MET 141 Cb 0.13 -2.32 0.84 0.00 2.01 0.00 0.00 34.83 35.49 1tls s MET 141 CO 0.85 -0.01 1.96 0.00 -0.01 0.00 0.00 175.02 177.81 1tls h ALA 142 N 2.18 1.58 -2.23 3.03 0.00 0.70 -3.44 119.26 121.08 1tls h ALA 142 Ca -0.49 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.19 1tls h ALA 142 Cb 1.19 -0.09 -0.18 0.00 0.00 0.00 0.00 17.79 18.71 1tls h ALA 142 CO 0.62 0.31 0.07 -1.17 0.00 0.00 0.00 179.25 179.07 1tls s LEU 143 N -8.89 -0.24 0.36 0.00 2.96 -1.26 -5.08 118.68 106.53 1tls s LEU 143 Ca -0.06 0.46 -0.21 0.00 -0.22 0.00 0.00 54.13 54.11 1tls s LEU 143 Cb 0.16 2.21 -0.10 0.00 0.50 0.00 0.00 46.19 48.96 1tls s LEU 143 CO 0.73 -0.61 0.88 0.00 -1.32 0.00 0.00 176.35 176.03 1tls s ALA 144 N -1.55 3.18 0.14 5.97 0.00 -1.26 -4.96 121.76 123.27 1tls s ALA 144 Ca -0.10 0.33 -0.34 0.00 0.00 0.00 0.00 51.96 51.85 1tls s ALA 144 Cb -0.01 -3.05 -0.16 0.00 0.00 0.00 0.00 23.12 19.90 1tls s ALA 144 CO 0.06 0.20 1.22 -2.30 0.00 0.00 0.00 175.76 174.94 1tls n PRO 145 N -0.15 1.13 0.05 0.00 -0.02 -1.26 -4.86 135.00 129.89 1tls n PRO 145 Ca 0.04 0.40 -0.22 0.00 -2.02 0.00 0.00 63.50 61.71 1tls n PRO 145 Cb 0.53 -1.95 -0.15 0.00 -0.02 0.00 0.00 33.50 31.91 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 -2.58 3.35 -0.16 0.00 0.00 -1.26 -1.34 115.29 113.30 1tls s HIS 147 Ca -0.16 -1.43 -0.20 0.00 -3.00 0.00 0.00 55.06 50.26 1tls s HIS 147 Cb 0.06 -3.79 -0.18 0.00 -4.00 0.00 0.00 32.58 24.67 1tls s HIS 147 CO 0.83 -1.01 0.36 0.00 -1.00 0.00 0.00 174.74 173.93 1tls h ALA 148 N 8.68 0.09 -3.29 -1.38 0.00 -1.69 -3.44 119.26 118.23 1tls h ALA 148 Ca -0.23 -0.69 -0.22 0.00 0.00 0.00 0.00 54.91 53.78 1tls h ALA 148 Cb 1.09 0.32 -0.29 0.00 0.00 0.00 0.00 17.79 18.90 1tls h ALA 148 CO 0.98 0.31 -0.57 0.12 0.00 0.00 0.00 179.25 180.09 1tls s PHE 149 N -2.18 -0.17 0.02 0.00 5.36 -1.19 0.17 117.98 119.98 1tls s PHE 149 Ca -0.20 0.46 -0.07 0.00 -0.96 0.00 0.00 56.93 56.17 1tls s PHE 149 Cb 0.01 -0.02 -0.00 0.00 -0.34 0.00 0.00 43.02 42.67 1tls s PHE 149 CO 0.51 -0.13 0.13 -0.59 -1.46 0.00 0.00 175.22 173.68 1tls s PHE 150 N 0.73 0.10 -0.01 10.12 -0.71 -0.18 -0.60 117.98 127.43 1tls s PHE 150 Ca -0.05 -0.28 0.00 0.00 -1.04 0.00 0.00 56.93 55.56 1tls s PHE 150 Cb -0.07 -0.08 0.01 0.00 -1.21 0.00 0.00 43.02 41.67 1tls s PHE 150 CO -0.04 -0.33 0.00 -1.14 -1.34 0.00 0.00 175.22 172.38 1tls s GLN 151 N -1.93 0.08 0.13 1.99 0.74 0.73 -0.99 119.66 120.41 1tls s GLN 151 Ca -0.10 0.05 -0.01 0.00 0.05 0.00 0.00 55.36 55.35 1tls s GLN 151 Cb -0.05 -0.19 -0.04 0.00 1.10 0.00 0.00 33.01 33.83 1tls s GLN 151 CO -0.01 -0.06 0.30 -0.06 -0.55 0.00 0.00 175.29 174.91 1tls s PHE 152 N 0.46 3.50 -0.00 1.67 0.08 -0.28 -0.99 117.98 122.41 1tls s PHE 152 Ca -0.04 0.31 -0.04 0.00 0.12 0.00 0.00 56.93 57.27 1tls s PHE 152 Cb -0.06 -1.81 -0.00 0.00 -0.57 0.00 0.00 43.02 40.58 1tls s PHE 152 CO -0.01 0.50 0.09 -0.47 -0.10 0.00 0.00 175.22 175.22 1tls s TYR 153 N -1.67 0.06 -0.06 0.36 6.14 -0.75 -4.47 117.35 116.96 1tls s TYR 153 Ca 0.37 -0.13 0.02 0.00 0.64 0.00 0.00 57.07 57.97 1tls s TYR 153 Cb -0.12 -0.06 0.02 0.00 0.42 0.00 0.00 41.96 42.21 1tls s TYR 153 CO 0.28 -0.20 -0.11 0.08 0.64 0.00 0.00 175.55 176.24 1tls s VAL 154 N -1.03 1.01 -0.16 3.14 1.01 -1.26 -0.92 120.40 122.20 1tls s VAL 154 Ca -0.11 -0.40 -0.06 0.00 0.00 0.00 0.00 61.98 61.40 1tls s VAL 154 Cb -0.06 -0.94 0.07 0.00 0.00 0.00 0.00 36.38 35.44 1tls s VAL 154 CO 0.01 0.33 0.35 0.00 0.00 0.00 0.00 175.10 175.78 1tls s ALA 155 N 0.74 -0.87 -1.25 5.51 0.00 -0.61 -4.79 121.76 120.49 1tls s ALA 155 Ca -0.13 1.26 -0.00 0.00 0.00 0.00 0.00 51.96 53.09 1tls s ALA 155 Cb -0.15 -1.08 0.00 0.00 0.00 0.00 0.00 23.12 21.88 1tls s ALA 155 CO 0.03 -0.58 0.86 -0.25 0.00 0.00 0.00 175.76 175.82 1tls n ASP 156 N 5.07 -1.68 -0.21 0.00 8.00 -1.26 -2.35 116.55 124.12 1tls n ASP 156 Ca -0.12 -0.71 -0.03 0.00 0.71 0.00 0.00 54.79 54.64 1tls n ASP 156 Cb 0.51 -4.62 -0.01 0.00 -0.02 0.00 0.00 41.12 36.98 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 -1.35 0.35 3.63 0.44 0.00 -1.26 -4.98 105.19 102.01 1tls n GLY 157 Ca -0.29 -0.03 -0.34 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.96 2.83 -0.25 1.61 1.02 -0.99 -1.47 119.74 120.54 1tls s LYS 158 Ca 0.00 -0.50 -0.07 0.00 0.02 0.00 0.00 55.97 55.41 1tls s LYS 158 Cb 0.00 -2.67 -0.03 0.00 -0.52 0.00 0.00 37.83 34.61 1tls s LYS 158 CO 0.00 0.68 0.07 -1.17 -0.92 0.00 0.00 175.35 174.00 1tls s LEU 159 N -0.91 3.43 0.29 3.17 2.96 -0.49 -1.57 118.68 125.56 1tls s LEU 159 Ca 0.13 -0.21 0.08 0.00 -0.22 0.00 0.00 54.13 53.92 1tls s LEU 159 Cb -0.11 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.62 1tls s LEU 159 CO 0.03 -0.03 0.12 -0.44 -1.32 0.00 0.00 176.35 174.71 1tls s SER 160 N 1.59 4.94 -0.06 3.68 0.01 -0.10 -1.02 113.70 122.74 1tls s SER 160 Ca 0.06 -0.55 -0.08 0.00 1.31 0.00 0.00 55.95 56.69 1tls s SER 160 Cb -0.15 -0.99 0.02 0.00 0.21 0.00 0.00 66.02 65.11 1tls s SER 160 CO 0.03 -0.12 0.22 0.00 0.41 0.00 0.00 173.24 173.78 1tls s GLN 162 N -0.25 1.05 -0.09 0.00 0.74 -0.16 -0.42 119.66 120.53 1tls s GLN 162 Ca -0.04 -0.17 0.04 0.00 0.05 0.00 0.00 55.36 55.25 1tls s GLN 162 Cb -0.03 -1.01 -0.01 0.00 1.10 0.00 0.00 33.01 33.06 1tls s GLN 162 CO 0.01 -0.08 -0.22 -1.17 -0.55 0.00 0.00 175.29 173.28 1tls s LEU 163 N 0.97 2.25 -0.43 3.68 2.96 -0.80 -0.19 118.68 127.11 1tls s LEU 163 Ca -0.10 -0.47 -0.16 0.00 -0.22 0.00 0.00 54.13 53.18 1tls s LEU 163 Cb -0.14 -1.44 0.04 0.00 0.50 0.00 0.00 46.19 45.14 1tls s LEU 163 CO 0.00 0.20 0.37 -0.47 -1.32 0.00 0.00 176.35 175.13 1tls s TYR 164 N 0.09 3.22 -0.35 5.38 5.04 0.23 0.04 117.35 130.99 1tls s TYR 164 Ca -0.10 -0.63 -0.07 0.00 -2.44 0.00 0.00 57.07 53.82 1tls s TYR 164 Cb -0.16 -2.85 0.04 0.00 0.35 0.00 0.00 41.96 39.35 1tls s TYR 164 CO 0.06 -0.69 0.14 -1.14 -1.34 0.00 0.00 175.55 172.58 1tls s GLN 165 N 1.81 2.65 0.12 4.97 0.74 0.97 -2.36 119.66 128.56 1tls s GLN 165 Ca 0.07 -1.18 -0.13 0.00 0.05 0.00 0.00 55.36 54.16 1tls s GLN 165 Cb -0.20 -3.54 -0.06 0.00 1.10 0.00 0.00 33.01 30.31 1tls s GLN 165 CO 0.10 -0.70 1.46 0.07 -0.55 0.00 0.00 175.29 175.67 1tls h ARG 166 N 8.27 0.80 -5.27 1.67 -0.00 -1.50 1.49 114.38 119.84 1tls h ARG 166 Ca -0.23 -0.40 -0.54 0.00 -0.00 0.00 0.00 59.98 58.81 1tls h ARG 166 Cb 1.09 0.00 -0.31 0.00 -0.00 0.00 0.00 29.97 30.75 1tls h ARG 166 CO 0.63 1.03 -0.83 0.45 -0.00 0.00 0.00 179.97 181.25 1tls s SER 167 N -6.62 1.98 -0.10 0.08 0.15 -1.24 -0.08 113.70 107.87 1tls s SER 167 Ca -0.12 -0.32 -0.04 0.00 0.70 0.00 0.00 55.95 56.17 1tls s SER 167 Cb 0.10 -0.47 0.05 0.00 -1.71 0.00 0.00 66.02 63.99 1tls s SER 167 CO 0.85 0.15 0.21 0.00 1.20 0.00 0.00 173.24 175.65 1tls s ASP 169 N 1.91 6.19 0.22 0.00 -1.08 -1.26 -0.62 116.67 122.03 1tls s ASP 169 Ca -0.02 -0.97 -0.08 0.00 -0.52 0.00 0.00 52.55 50.95 1tls s ASP 169 Cb -0.12 -2.43 0.32 0.00 -1.46 0.00 0.00 42.92 39.23 1tls s ASP 169 CO -0.07 -1.47 1.74 0.58 0.52 0.00 0.00 175.17 176.46 1tls h VAL 170 N 5.98 0.73 0.54 1.11 2.07 -1.02 -0.97 116.25 124.70 1tls h VAL 170 Ca -0.27 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.09 1tls h VAL 170 Cb 1.07 0.29 0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1tls h VAL 170 CO 1.19 0.07 -0.26 0.15 0.02 0.00 0.00 177.57 178.75 1tls h PHE 171 N 0.40 -0.68 0.00 1.57 3.04 -1.91 -3.33 116.94 116.03 1tls h PHE 171 Ca 0.33 -0.02 -0.04 0.00 3.98 0.00 0.00 57.97 62.23 1tls h PHE 171 Cb 0.44 0.22 -0.01 0.00 2.56 0.00 0.00 35.95 39.17 1tls h PHE 171 CO -0.18 -0.42 -0.36 -0.07 -2.02 0.00 0.00 178.31 175.26 1tls h LEU 172 N -1.15 0.00 -0.17 0.59 3.38 -1.97 -3.44 115.31 112.56 1tls h LEU 172 Ca -0.07 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.60 1tls h LEU 172 Cb 0.56 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 1tls h LEU 172 CO 0.12 0.82 -0.15 1.23 0.09 0.00 0.00 178.44 180.54 1tls h GLY 173 N -1.00 0.44 0.03 0.83 0.00 -1.70 -3.37 103.07 98.31 1tls h GLY 173 Ca -0.05 -0.45 0.06 0.00 0.00 0.00 0.00 47.33 46.89 1tls h GLY 173 CO -0.03 0.40 -0.32 -2.00 0.00 0.00 0.00 176.54 174.59 1tls h LEU 174 N 0.06 -1.02 -1.66 3.11 5.85 -1.30 -0.30 115.31 120.06 1tls h LEU 174 Ca 0.03 0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 1tls h LEU 174 Cb 0.68 0.45 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 1tls h LEU 174 CO 0.04 -0.34 0.07 -0.65 -0.34 0.00 0.00 178.44 177.22 1tls h PRO 175 N -0.33 0.29 -0.19 5.25 0.11 -1.76 -0.90 132.00 134.46 1tls h PRO 175 Ca 0.13 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.07 1tls h PRO 175 Cb 0.54 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.59 1tls h PRO 175 CO -0.42 0.26 -0.39 0.74 -0.21 0.00 0.00 178.00 177.97 1tls h PHE 176 N 0.29 0.76 0.27 0.65 -1.00 -1.46 -3.19 116.94 113.26 1tls h PHE 176 Ca 0.07 -0.28 -0.01 0.00 2.81 0.00 0.00 57.97 60.56 1tls h PHE 176 Cb 0.08 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 39.51 1tls h PHE 176 CO 0.00 1.03 -0.13 -0.91 -1.61 0.00 0.00 178.31 176.70 1tls h ASN 177 N 0.28 -0.30 -0.40 2.17 -0.26 -0.24 -2.75 115.58 114.08 1tls h ASN 177 Ca 0.01 -0.11 0.08 0.00 -0.56 0.00 0.00 56.30 55.71 1tls h ASN 177 Cb 0.99 0.08 -0.07 0.00 -1.06 0.00 0.00 38.32 38.26 1tls h ASN 177 CO 0.09 -0.07 -0.04 0.40 -1.06 0.00 0.00 177.43 176.75 1tls h ILE 178 N -0.54 0.66 0.00 2.81 2.04 -1.32 -2.65 117.51 118.51 1tls h ILE 178 Ca -0.04 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.80 1tls h ILE 178 Cb 0.40 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1tls h ILE 178 CO 0.06 0.01 0.00 0.00 0.00 0.00 0.00 178.15 178.22 1tls h ALA 179 N 1.37 1.00 -0.03 1.87 0.00 -1.61 -3.00 119.26 118.87 1tls h ALA 179 Ca 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.98 1tls h ALA 179 Cb 0.29 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.09 1tls h ALA 179 CO -0.36 0.00 -0.46 1.03 0.00 0.00 0.00 179.25 179.45 1tls h SER 180 N 0.00 0.45 0.12 0.00 0.87 -1.18 -2.38 113.55 111.43 1tls h SER 180 Ca 0.00 -0.73 -0.18 0.00 -1.23 0.00 0.00 61.79 59.65 1tls h SER 180 Cb 0.71 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 62.53 1tls h SER 180 CO 0.00 1.12 -0.66 1.88 -0.53 0.00 0.00 176.83 178.63 1tls h TYR 181 N -0.17 0.66 -0.62 2.24 0.05 -1.55 -2.77 116.97 114.81 1tls h TYR 181 Ca -0.05 -0.27 -0.03 0.00 0.05 0.00 0.00 58.73 58.44 1tls h TYR 181 Cb 1.16 -0.11 -0.03 0.00 1.01 0.00 0.00 36.73 38.77 1tls h TYR 181 CO 0.15 1.02 0.29 0.00 -1.05 0.00 0.00 178.16 178.57 1tls h ALA 182 N 0.91 0.81 -0.50 3.88 0.00 -1.60 0.27 119.26 123.03 1tls h ALA 182 Ca -0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1tls h ALA 182 Cb 1.23 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1tls h ALA 182 CO 0.12 0.38 0.27 1.25 0.00 0.00 0.00 179.25 181.28 1tls h LEU 183 N 0.86 0.61 -0.08 0.00 5.85 -1.30 -2.12 115.31 119.13 1tls h LEU 183 Ca 0.21 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.81 1tls h LEU 183 Cb 0.14 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.02 1tls h LEU 183 CO -0.02 0.50 -0.27 0.25 -0.34 0.00 0.00 178.44 178.55 1tls h LEU 184 N 0.70 0.38 -0.54 2.25 5.85 -1.00 -1.62 115.31 121.33 1tls h LEU 184 Ca 0.18 -0.61 0.11 0.00 0.84 0.00 0.00 57.88 58.40 1tls h LEU 184 Cb 0.02 -0.11 -0.10 0.00 0.37 0.00 0.00 40.66 40.84 1tls h LEU 184 CO -0.03 0.93 -0.11 0.58 -0.34 0.00 0.00 178.44 179.47 1tls h VAL 185 N -0.15 0.48 0.09 1.05 2.07 -0.75 0.30 116.25 119.35 1tls h VAL 185 Ca -0.01 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1tls h VAL 185 Cb 0.89 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1tls h VAL 185 CO 0.06 0.00 -0.07 0.45 0.02 0.00 0.00 177.57 178.03 1tls h HIS 186 N 0.02 -0.19 -0.23 1.57 3.86 -1.25 0.50 115.15 119.43 1tls h HIS 186 Ca 0.26 -0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.38 1tls h HIS 186 Cb 0.40 0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.93 1tls h HIS 186 CO -0.43 -0.12 -0.27 0.52 0.86 0.00 0.00 177.93 178.50 1tls h MET 187 N -0.18 0.45 0.64 2.45 2.86 -0.79 -2.75 114.93 117.61 1tls h MET 187 Ca -0.00 -0.17 -0.03 0.00 -2.06 0.00 0.00 59.70 57.44 1tls h MET 187 Cb 0.16 -0.03 0.01 0.00 0.06 0.00 0.00 31.60 31.80 1tls h MET 187 CO -0.01 0.68 -0.31 0.52 1.06 0.00 0.00 176.91 178.86 1tls h MET 188 N 0.40 -0.83 -1.16 1.72 2.86 -0.05 -2.56 114.93 115.31 1tls h MET 188 Ca 0.06 0.06 0.34 0.00 -2.06 0.00 0.00 59.70 58.09 1tls h MET 188 Cb 0.68 0.19 -0.11 0.00 0.06 0.00 0.00 31.60 32.42 1tls h MET 188 CO 0.05 -0.51 0.75 0.00 1.06 0.00 0.00 176.91 178.26 1tls h ALA 189 N -0.96 2.48 0.08 6.32 0.00 -0.00 -2.73 119.26 124.45 1tls h ALA 189 Ca -0.09 0.08 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 1tls h ALA 189 Cb 0.70 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1tls h ALA 189 CO 0.14 -0.97 -0.97 0.37 0.00 0.00 0.00 179.25 177.82 1tls h GLN 190 N 0.25 0.17 0.00 0.00 4.15 -1.47 0.34 115.11 118.55 1tls h GLN 190 Ca 0.68 -0.28 0.00 0.00 0.77 0.00 0.00 58.65 59.82 1tls h GLN 190 Cb 1.97 0.11 0.00 0.00 0.21 0.00 0.00 27.48 29.77 1tls h GLN 190 CO -0.33 1.14 0.00 1.96 -1.93 0.00 0.00 178.83 179.67 1tls h GLN 191 N -0.57 0.00 -0.13 1.69 1.08 -1.16 -2.94 115.11 113.07 1tls h GLN 191 Ca -0.21 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.99 1tls h GLN 191 Cb 1.51 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.94 1tls h GLN 191 CO 0.02 0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.90 1tls n ASP 193 N -0.66 -2.24 -4.38 0.00 8.00 -0.93 -4.96 116.55 111.39 1tls n ASP 193 Ca 0.13 -1.28 -0.20 0.00 0.71 0.00 0.00 54.79 54.16 1tls n ASP 193 Cb 0.59 -1.75 -0.10 0.00 -0.02 0.00 0.00 41.12 39.85 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 -7.40 2.55 0.46 0.64 1.43 0.12 -5.02 118.68 111.46 1tls s LEU 194 Ca 0.30 -1.05 -0.09 0.00 -1.03 0.00 0.00 54.13 52.27 1tls s LEU 194 Cb -0.16 -0.74 -0.05 0.00 0.03 0.00 0.00 46.19 45.26 1tls s LEU 194 CO 0.98 -0.16 0.81 -0.70 0.23 0.00 0.00 176.35 177.50 1tls s GLU 195 N -3.64 3.67 0.18 1.70 2.56 -0.54 -4.34 118.70 118.29 1tls s GLU 195 Ca 0.25 0.40 -0.14 0.00 0.00 0.00 0.00 54.97 55.48 1tls s GLU 195 Cb -0.01 -2.35 -0.07 0.00 2.00 0.00 0.00 34.13 33.70 1tls s GLU 195 CO 0.09 -0.17 0.57 0.14 -0.56 0.00 0.00 175.26 175.34 1tls s VAL 196 N -2.61 4.84 0.00 3.70 -7.23 -1.26 -1.39 120.40 116.44 1tls s VAL 196 Ca 0.50 0.80 0.00 0.00 -1.81 0.00 0.00 61.98 61.47 1tls s VAL 196 Cb -0.10 -3.71 0.00 0.00 0.56 0.00 0.00 36.38 33.12 1tls s VAL 196 CO 0.39 0.15 0.00 0.61 -0.31 0.00 0.00 175.10 175.94 1tls n GLY 197 N 0.54 1.42 3.80 2.32 0.00 -0.19 -4.60 105.19 108.48 1tls n GLY 197 Ca -0.03 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 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 0.46 5.62 -0.35 1.61 1.01 -1.26 -0.80 116.67 122.96 1tls s ASP 198 Ca 0.00 -0.04 -0.03 0.00 0.71 0.00 0.00 52.55 53.20 1tls s ASP 198 Cb 0.00 -1.52 0.07 0.00 1.01 0.00 0.00 42.92 42.49 1tls s ASP 198 CO 0.00 0.12 0.09 0.12 0.21 0.00 0.00 175.17 175.71 1tls s PHE 199 N -1.58 3.41 -0.23 4.23 5.36 0.21 -1.67 117.98 127.71 1tls s PHE 199 Ca 0.31 -2.08 -0.11 0.00 -0.96 0.00 0.00 56.93 54.08 1tls s PHE 199 Cb -0.11 -2.60 -0.05 0.00 -0.34 0.00 0.00 43.02 39.92 1tls s PHE 199 CO 0.23 -0.87 0.19 0.08 -1.46 0.00 0.00 175.22 173.39 1tls s VAL 200 N 1.21 5.35 -0.16 3.12 1.01 0.43 -0.23 120.40 131.13 1tls s VAL 200 Ca 0.01 0.25 -0.03 0.00 0.00 0.00 0.00 61.98 62.22 1tls s VAL 200 Cb -0.21 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 1tls s VAL 200 CO -0.02 0.35 -0.07 0.86 0.00 0.00 0.00 175.10 176.22 1tls s TRP 201 N 0.96 2.94 -0.06 5.22 -0.00 0.42 -1.91 118.94 126.51 1tls s TRP 201 Ca 0.09 -0.55 0.03 0.00 -0.00 0.00 0.00 56.10 55.66 1tls s TRP 201 Cb -0.13 -1.96 0.01 0.00 -0.00 0.00 0.00 33.47 31.39 1tls s TRP 201 CO 0.04 -0.21 -0.13 0.99 -0.00 0.00 0.00 176.95 177.63 1tls s THR 202 N 0.63 1.20 0.30 5.86 2.01 0.11 -0.49 115.64 125.25 1tls s THR 202 Ca -0.04 -0.53 0.11 0.00 0.31 0.00 0.00 61.69 61.54 1tls s THR 202 Cb -0.15 -1.08 -0.05 0.00 0.01 0.00 0.00 72.50 71.23 1tls s THR 202 CO 0.03 0.36 -0.17 -0.83 -0.69 0.00 0.00 174.62 173.32 1tls s GLY 203 N 0.50 1.97 0.00 4.40 0.00 0.03 -0.02 107.32 114.19 1tls s GLY 203 Ca -0.12 -1.93 0.00 0.00 0.00 0.00 0.00 44.72 42.67 1tls s GLY 203 CO 0.03 -1.98 0.00 0.61 0.00 0.00 0.00 173.10 171.76 1tls n GLY 204 N -0.67 0.78 3.58 0.20 0.00 0.51 -3.41 105.19 106.19 1tls n GLY 204 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 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 6.40 -0.23 1.61 -1.08 0.88 -1.83 116.67 121.42 1tls s ASP 205 Ca 0.00 0.26 -0.05 0.00 -0.52 0.00 0.00 52.55 52.25 1tls s ASP 205 Cb 0.00 -2.55 -0.01 0.00 -1.46 0.00 0.00 42.92 38.90 1tls s ASP 205 CO 0.00 -1.49 -0.01 -0.89 0.52 0.00 0.00 175.17 173.29 1tls s THR 206 N 5.17 3.57 0.15 1.71 2.01 -0.30 -0.47 115.64 127.47 1tls s THR 206 Ca 0.47 -0.47 -0.05 0.00 0.31 0.00 0.00 61.69 61.95 1tls s THR 206 Cb -0.09 -2.66 -0.02 0.00 0.01 0.00 0.00 72.50 69.74 1tls s THR 206 CO 0.27 0.37 0.17 -1.38 -0.69 0.00 0.00 174.62 173.36 1tls s HIS 207 N 1.50 0.64 -0.19 4.92 -3.43 0.21 -1.44 115.29 117.50 1tls s HIS 207 Ca 0.05 -1.01 0.01 0.00 -0.80 0.00 0.00 55.06 53.32 1tls s HIS 207 Cb -0.15 -0.27 0.03 0.00 -1.43 0.00 0.00 32.58 30.75 1tls s HIS 207 CO -0.02 -0.62 -0.18 -0.51 -2.00 0.00 0.00 174.74 171.41 1tls s LEU 208 N -3.01 2.33 0.45 5.38 1.43 -0.26 -0.26 118.68 124.75 1tls s LEU 208 Ca 0.21 -0.75 -0.25 0.00 -1.03 0.00 0.00 54.13 52.31 1tls s LEU 208 Cb 0.05 -1.49 -0.08 0.00 0.03 0.00 0.00 46.19 44.70 1tls s LEU 208 CO 0.01 -0.03 1.35 -0.31 0.23 0.00 0.00 176.35 177.60 1tls s TYR 209 N 1.27 2.60 -0.26 0.29 2.02 -1.26 -0.82 117.35 121.18 1tls s TYR 209 Ca 0.03 1.36 0.22 0.00 -0.37 0.00 0.00 57.07 58.31 1tls s TYR 209 Cb -0.14 -3.76 1.13 0.00 -0.40 0.00 0.00 41.96 38.79 1tls s TYR 209 CO -0.12 -2.49 1.66 -1.13 -1.57 0.00 0.00 175.55 171.90 1tls n SER 210 N -0.25 0.57 -2.03 2.29 3.41 -0.91 -2.26 113.62 114.44 1tls n SER 210 Ca 0.06 0.74 -0.17 0.00 -0.26 0.00 0.00 58.87 59.25 1tls n SER 210 Cb 0.44 -0.83 0.20 0.00 -0.26 0.00 0.00 64.21 63.75 1tls n SER 210 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1tls n ASN 211 N -2.24 3.94 0.00 4.04 6.94 -1.26 -3.85 115.26 122.83 1tls n ASN 211 Ca -0.01 -3.33 0.00 0.00 -0.02 0.00 0.00 54.58 51.22 1tls n ASN 211 Cb 0.07 -0.78 0.00 0.00 -2.36 0.00 0.00 39.78 36.71 1tls n ASN 211 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 1tls n HIS 212 N -0.70 0.00 -0.11 -2.53 8.25 -0.96 -4.75 115.22 114.43 1tls n HIS 212 Ca 0.48 -0.10 -0.05 0.00 -0.26 0.00 0.00 57.72 57.79 1tls n HIS 212 Cb 1.47 -0.01 0.02 0.00 1.12 0.00 0.00 29.99 32.59 1tls n HIS 212 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 1tls h MET 213 N 0.00 0.14 0.71 -0.41 2.86 -1.71 0.12 114.93 116.64 1tls h MET 213 Ca 0.00 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 1tls h MET 213 Cb 0.52 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.15 1tls h MET 213 CO 0.00 0.09 -0.38 -0.44 1.06 0.00 0.00 176.91 177.24 1tls h ASP 214 N 0.15 -0.94 -1.00 1.22 3.32 -1.89 -0.78 116.42 116.50 1tls h ASP 214 Ca 0.18 0.04 0.08 0.00 0.02 0.00 0.00 57.03 57.35 1tls h ASP 214 Cb 0.23 0.26 -0.07 0.00 0.22 0.00 0.00 39.33 39.96 1tls h ASP 214 CO -0.26 -0.63 0.64 1.56 -1.72 0.00 0.00 179.24 178.83 1tls h GLN 215 N -1.01 1.08 0.30 3.56 7.50 -1.88 0.49 115.11 125.15 1tls h GLN 215 Ca -0.09 -0.07 -0.01 0.00 0.50 0.00 0.00 58.65 58.98 1tls h GLN 215 Cb 0.80 -0.24 0.00 0.00 0.05 0.00 0.00 27.48 28.09 1tls h GLN 215 CO 0.13 0.72 -0.14 1.15 -1.50 0.00 0.00 178.83 179.18 1tls h THR 216 N 1.12 0.72 -0.76 -0.54 2.02 -0.62 0.12 112.91 114.96 1tls h THR 216 Ca 0.46 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.50 1tls h THR 216 Cb 0.28 0.80 -0.04 0.00 -1.74 0.00 0.00 68.15 67.45 1tls h THR 216 CO -0.21 0.03 0.48 0.45 0.37 0.00 0.00 175.52 176.65 1tls h HIS 217 N -0.47 0.98 -0.54 3.16 3.86 0.07 0.09 115.15 122.30 1tls h HIS 217 Ca -0.04 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.16 1tls h HIS 217 Cb 0.36 -0.33 -0.03 0.00 1.06 0.00 0.00 27.41 28.48 1tls h HIS 217 CO -0.04 0.64 0.28 1.25 0.86 0.00 0.00 177.93 180.91 1tls h LEU 218 N 1.04 0.69 -0.48 2.43 5.85 0.25 -3.06 115.31 122.03 1tls h LEU 218 Ca 0.28 -0.11 -0.17 0.00 0.84 0.00 0.00 57.88 58.71 1tls h LEU 218 Cb -0.08 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 1tls h LEU 218 CO -0.06 0.61 -0.70 -0.61 -0.34 0.00 0.00 178.44 177.34 1tls h GLN 219 N 0.73 0.32 0.00 1.25 4.15 -0.14 -3.27 115.11 118.15 1tls h GLN 219 Ca 0.19 -0.26 0.00 0.00 0.77 0.00 0.00 58.65 59.35 1tls h GLN 219 Cb 0.09 0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.83 1tls h GLN 219 CO -0.03 0.90 0.00 1.28 -1.93 0.00 0.00 178.83 179.05 1tls n LEU 220 N -3.83 0.00 -0.52 -2.39 4.77 -0.04 -2.76 117.00 112.23 1tls n LEU 220 Ca -0.03 0.33 0.05 0.00 -0.03 0.00 0.00 56.01 56.33 1tls n LEU 220 Cb 0.69 -0.33 0.10 0.00 -2.33 0.00 0.00 43.42 41.54 1tls n LEU 220 CO 0.47 -0.23 0.53 -1.54 -1.33 0.00 0.00 177.39 175.28 1tls n SER 221 N -1.33 2.41 -4.88 -1.43 3.41 -1.23 -5.01 113.62 105.56 1tls n SER 221 Ca 0.04 -1.74 -0.32 0.00 -0.26 0.00 0.00 58.87 56.59 1tls n SER 221 Cb 0.08 -0.12 -0.05 0.00 -0.26 0.00 0.00 64.21 63.87 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 -0.94 3.32 -0.19 4.33 0.52 -1.11 -5.07 118.95 119.80 1tls s ARG 222 Ca 0.17 -0.45 -0.24 0.00 -0.52 0.00 0.00 55.73 54.70 1tls s ARG 222 Cb 0.10 -2.99 -0.02 0.00 0.52 0.00 0.00 34.95 32.56 1tls s ARG 222 CO 0.14 0.63 0.79 -1.21 0.02 0.00 0.00 175.30 175.66 1tls s GLU 223 N -2.24 4.26 0.58 3.54 0.41 -1.26 -4.98 118.70 119.00 1tls s GLU 223 Ca 0.31 0.91 -0.19 0.00 -0.41 0.00 0.00 54.97 55.58 1tls s GLU 223 Cb -0.13 -3.59 -0.06 0.00 -1.78 0.00 0.00 34.13 28.58 1tls s GLU 223 CO 0.23 -0.34 1.00 -0.35 -0.49 0.00 0.00 175.26 175.30 1tls n PRO 224 N 5.33 1.01 -3.67 0.39 -0.04 -1.26 -4.83 135.00 131.93 1tls n PRO 224 Ca 0.03 0.39 -0.24 0.00 -0.04 0.00 0.00 63.50 63.64 1tls n PRO 224 Cb 0.49 -2.18 0.00 0.00 -0.04 0.00 0.00 33.50 31.77 1tls n PRO 224 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1tls s ARG 225 N -2.67 2.31 0.54 0.54 1.81 -1.26 -5.04 118.95 115.17 1tls s ARG 225 Ca 0.74 -1.87 -0.20 0.00 -1.72 0.00 0.00 55.73 52.67 1tls s ARG 225 Cb -0.43 -2.25 -0.05 0.00 -0.45 0.00 0.00 34.95 31.77 1tls s ARG 225 CO 0.48 -0.60 1.19 -2.14 -0.68 0.00 0.00 175.30 173.55 1tls s PRO 226 N -4.33 3.30 0.36 3.54 0.02 -1.26 -4.90 135.00 131.72 1tls s PRO 226 Ca 0.42 1.79 -0.25 0.00 0.02 0.00 0.00 61.00 62.98 1tls s PRO 226 Cb -0.03 -2.10 -0.10 0.00 0.02 0.00 0.00 34.50 32.29 1tls s PRO 226 CO 0.26 -0.93 1.00 -0.51 -0.33 0.00 0.00 177.00 176.48 1tls s LEU 227 N -3.68 4.24 0.00 -5.54 1.43 -1.26 -4.76 118.68 109.10 1tls s LEU 227 Ca 0.72 1.93 0.00 0.00 -1.03 0.00 0.00 54.13 55.75 1tls s LEU 227 Cb -0.29 -4.11 0.00 0.00 0.03 0.00 0.00 46.19 41.82 1tls s LEU 227 CO 0.33 -0.27 0.00 -0.81 0.23 0.00 0.00 176.35 175.83 1tls n PRO 228 N 0.23 0.28 -3.79 1.29 -0.04 -1.26 -4.71 135.00 127.00 1tls n PRO 228 Ca 0.03 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.37 1tls n PRO 228 Cb 0.50 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.85 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 -0.85 0.41 -0.12 0.54 -0.14 -0.50 -2.72 119.74 116.36 1tls s LYS 229 Ca 0.00 0.11 -0.05 0.00 -1.36 0.00 0.00 55.97 54.67 1tls s LYS 229 Cb 0.00 0.19 -0.04 0.00 -1.68 0.00 0.00 37.83 36.30 1tls s LYS 229 CO 0.00 -0.08 0.05 -1.17 -0.76 0.00 0.00 175.35 173.39 1tls s LEU 230 N -0.44 3.84 -0.11 3.17 2.96 -1.26 -1.69 118.68 125.14 1tls s LEU 230 Ca -0.05 0.20 0.02 0.00 -0.22 0.00 0.00 54.13 54.08 1tls s LEU 230 Cb -0.04 -1.92 0.02 0.00 0.50 0.00 0.00 46.19 44.75 1tls s LEU 230 CO 0.01 0.33 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.59 1tls s ILE 231 N -0.56 1.53 -0.43 6.68 -1.09 0.13 -5.00 121.20 122.46 1tls s ILE 231 Ca 0.10 -0.66 -0.12 0.00 -2.23 0.00 0.00 60.65 57.75 1tls s ILE 231 Cb -0.12 -1.40 0.06 0.00 -1.58 0.00 0.00 42.46 39.42 1tls s ILE 231 CO 0.02 0.45 0.30 -0.63 -1.23 0.00 0.00 174.94 173.85 1tls s ILE 232 N 1.03 4.70 0.46 2.92 1.01 -1.26 -0.85 121.20 129.20 1tls s ILE 232 Ca -0.06 -1.14 0.20 0.00 0.00 0.00 0.00 60.65 59.65 1tls s ILE 232 Cb -0.15 -3.79 0.24 0.00 0.01 0.00 0.00 42.46 38.77 1tls s ILE 232 CO -0.02 -0.47 2.05 0.11 0.00 0.00 0.00 174.94 176.60 1tls h LYS 233 N 8.55 0.00 -3.75 2.79 1.57 -0.93 -3.45 116.57 121.35 1tls h LYS 233 Ca -0.25 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.43 1tls h LYS 233 Cb 1.10 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.26 1tls h LYS 233 CO 0.78 0.14 -0.38 0.50 -0.57 0.00 0.00 179.45 179.92 1tls s ARG 234 N -4.53 0.81 -0.63 3.15 3.52 -1.26 -5.10 118.95 114.91 1tls s ARG 234 Ca -0.04 -0.88 -0.11 0.00 -0.13 0.00 0.00 55.73 54.57 1tls s ARG 234 Cb 0.15 0.33 0.16 0.00 -1.56 0.00 0.00 34.95 34.03 1tls s ARG 234 CO 0.65 -0.25 0.53 0.21 -0.81 0.00 0.00 175.30 175.63 1tls s LYS 235 N -3.55 2.95 1.06 5.12 2.20 -1.26 -5.04 119.74 121.22 1tls s LYS 235 Ca 0.03 -2.12 -0.12 0.00 -0.36 0.00 0.00 55.97 53.39 1tls s LYS 235 Cb 0.03 -4.12 0.20 0.00 -1.51 0.00 0.00 37.83 32.43 1tls s LYS 235 CO -0.09 -1.25 0.91 -2.30 -0.36 0.00 0.00 175.35 172.26 1tls n PRO 236 N 4.40 -1.46 0.08 4.03 -0.02 -1.26 -4.91 135.00 135.86 1tls n PRO 236 Ca 0.01 -0.38 0.13 0.00 -2.02 0.00 0.00 63.50 61.23 1tls n PRO 236 Cb 0.42 -2.17 0.37 0.00 -0.02 0.00 0.00 33.50 32.10 1tls n PRO 236 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1tls n GLU 237 N -4.14 0.23 -3.64 -0.52 -0.58 -1.26 -4.84 120.64 105.89 1tls n GLU 237 Ca 0.06 0.15 -0.13 0.00 -0.42 0.00 0.00 57.16 56.83 1tls n GLU 237 Cb 0.54 -1.73 -0.06 0.00 -0.57 0.00 0.00 31.44 29.62 1tls n GLU 237 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1tls s SER 238 N -4.21 -0.32 0.00 1.62 1.04 -1.26 -5.04 113.70 105.53 1tls s SER 238 Ca 0.10 0.01 0.05 0.00 0.48 0.00 0.00 55.95 56.60 1tls s SER 238 Cb 0.14 0.44 0.25 0.00 0.10 0.00 0.00 66.02 66.95 1tls s SER 238 CO 0.62 -0.69 1.08 0.00 0.98 0.00 0.00 173.24 175.23 1tls n ILE 239 N 0.43 1.26 -0.78 -1.02 3.06 -1.26 -0.78 119.36 120.26 1tls n ILE 239 Ca -0.18 0.31 0.08 0.00 -2.50 0.00 0.00 62.75 60.46 1tls n ILE 239 Cb 0.60 -1.23 0.39 0.00 0.54 0.00 0.00 39.64 39.94 1tls n ILE 239 CO 0.00 0.00 0.00 0.49 -2.50 0.00 0.00 176.55 174.54 1tls n PHE 240 N -1.38 1.89 0.17 9.51 3.72 -1.26 -4.13 117.46 125.98 1tls n PHE 240 Ca 0.02 -0.68 0.02 0.00 -0.05 0.00 0.00 57.45 56.76 1tls n PHE 240 Cb 0.05 -0.43 0.01 0.00 -0.94 0.00 0.00 39.48 38.17 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 0.78 1.15 -4.52 4.37 8.00 0.04 -5.03 116.55 121.33 1tls n ASP 241 Ca 0.27 -1.08 -0.28 0.00 0.71 0.00 0.00 54.79 54.41 1tls n ASP 241 Cb 1.10 0.16 0.24 0.00 -0.02 0.00 0.00 41.12 42.60 1tls n ASP 241 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1tls s TYR 242 N -0.50 1.48 0.12 1.24 1.51 -1.26 -4.82 117.35 115.12 1tls s TYR 242 Ca 0.04 1.13 -0.18 0.00 -1.01 0.00 0.00 57.07 57.05 1tls s TYR 242 Cb 0.03 -3.13 0.04 0.00 -0.11 0.00 0.00 41.96 38.80 1tls s TYR 242 CO 0.07 -3.73 0.45 1.03 -1.11 0.00 0.00 175.55 172.26 1tls s ARG 243 N -4.55 1.11 0.09 -0.62 1.81 -1.26 -5.04 118.95 110.48 1tls s ARG 243 Ca 0.68 -0.61 -0.28 0.00 -1.72 0.00 0.00 55.73 53.80 1tls s ARG 243 Cb -0.24 0.49 -0.14 0.00 -0.45 0.00 0.00 34.95 34.61 1tls s ARG 243 CO 0.63 -0.44 1.66 0.35 -0.68 0.00 0.00 175.30 176.82 1tls h PHE 244 N 2.34 -0.56 -0.86 -0.53 3.57 -1.96 -1.81 116.94 117.13 1tls h PHE 244 Ca -0.34 -0.00 0.25 0.00 3.53 0.00 0.00 57.97 61.41 1tls h PHE 244 Cb 1.26 0.20 -0.03 0.00 2.79 0.00 0.00 35.95 40.17 1tls h PHE 244 CO 0.31 -0.33 0.72 0.93 -2.23 0.00 0.00 178.31 177.71 1tls h GLU 245 N -0.51 0.00 0.00 1.11 3.07 -2.02 0.73 114.58 116.96 1tls h GLU 245 Ca -0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 1tls h GLU 245 Cb 0.44 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.35 1tls h GLU 245 CO 0.01 0.00 0.00 -0.44 -1.40 0.00 0.00 179.01 177.18 1tls h ASP 246 N 0.00 0.00 -3.79 1.42 3.32 -1.72 -3.44 116.42 112.21 1tls h ASP 246 Ca 0.41 0.00 -0.68 0.00 0.02 0.00 0.00 57.03 56.78 1tls h ASP 246 Cb 1.85 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 41.20 1tls h ASP 246 CO -0.00 0.00 -0.74 -0.36 -1.72 0.00 0.00 179.24 176.41 1tls s PHE 247 N -3.36 2.77 -0.04 4.55 0.08 0.25 -0.22 117.98 122.00 1tls s PHE 247 Ca 0.04 -0.12 -0.04 0.00 0.12 0.00 0.00 56.93 56.93 1tls s PHE 247 Cb 0.09 -1.58 0.01 0.00 -0.57 0.00 0.00 43.02 40.98 1tls s PHE 247 CO 0.40 0.30 0.11 -2.00 -0.10 0.00 0.00 175.22 173.94 1tls s GLU 248 N -1.27 0.12 0.18 0.44 2.56 -0.03 -4.96 118.70 115.73 1tls s GLU 248 Ca 0.15 0.18 0.08 0.00 0.00 0.00 0.00 54.97 55.38 1tls s GLU 248 Cb -0.11 0.03 -0.04 0.00 2.00 0.00 0.00 34.13 36.01 1tls s GLU 248 CO 0.05 -0.04 -0.02 -1.50 -0.56 0.00 0.00 175.26 173.20 1tls s ILE 249 N 0.22 3.63 -0.14 -3.70 1.10 -1.26 0.19 121.20 121.25 1tls s ILE 249 Ca -0.01 -1.47 -0.06 0.00 -0.51 0.00 0.00 60.65 58.59 1tls s ILE 249 Cb -0.02 -2.82 0.06 0.00 0.15 0.00 0.00 42.46 39.82 1tls s ILE 249 CO -0.01 -0.11 0.31 -1.61 -2.11 0.00 0.00 174.94 171.41 1tls s GLU 250 N -2.93 0.26 0.00 3.50 2.02 -0.69 -4.88 118.70 115.98 1tls s GLU 250 Ca 0.27 0.69 0.00 0.00 0.02 0.00 0.00 54.97 55.95 1tls s GLU 250 Cb -0.09 -0.04 0.00 0.00 0.10 0.00 0.00 34.13 34.10 1tls s GLU 250 CO 0.18 -0.19 0.00 0.41 0.02 0.00 0.00 175.26 175.68 1tls n GLY 251 N 4.54 0.66 3.47 -1.39 0.00 -1.26 -1.42 105.19 109.79 1tls n GLY 251 Ca -0.20 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.00 3.00 -0.90 1.61 5.04 -1.26 -4.06 117.35 118.78 1tls s TYR 252 Ca 0.00 -1.27 -0.03 0.00 -2.44 0.00 0.00 57.07 53.33 1tls s TYR 252 Cb 0.00 -4.36 0.22 0.00 0.35 0.00 0.00 41.96 38.18 1tls s TYR 252 CO 0.00 -1.57 0.80 0.34 -1.34 0.00 0.00 175.55 173.78 1tls s ASP 253 N 3.88 6.14 0.63 4.32 2.15 -1.26 -5.07 116.67 127.45 1tls s ASP 253 Ca 0.35 -3.62 -0.11 0.00 0.43 0.00 0.00 52.55 49.59 1tls s ASP 253 Cb -0.04 -1.95 -0.03 0.00 -0.30 0.00 0.00 42.92 40.60 1tls s ASP 253 CO -0.09 -0.22 1.03 -2.16 -0.17 0.00 0.00 175.17 173.56 1tls s PRO 254 N -1.22 3.47 0.81 4.34 0.04 -1.26 -4.89 135.00 136.30 1tls s PRO 254 Ca 0.27 0.82 -0.12 0.00 0.04 0.00 0.00 61.00 62.02 1tls s PRO 254 Cb -0.09 -2.06 0.08 0.00 0.04 0.00 0.00 34.50 32.47 1tls s PRO 254 CO -0.11 -0.67 1.10 -1.01 0.04 0.00 0.00 177.00 176.34 1tls s HIS 255 N -3.09 2.76 0.53 0.56 3.76 0.02 -4.83 115.29 114.99 1tls s HIS 255 Ca 0.56 1.14 -0.21 0.00 -0.15 0.00 0.00 55.06 56.41 1tls s HIS 255 Cb -0.12 -3.14 -0.06 0.00 1.11 0.00 0.00 32.58 30.37 1tls s HIS 255 CO 0.52 -1.87 1.18 -2.14 -0.85 0.00 0.00 174.74 171.59 1tls s PRO 256 N -5.14 3.38 1.02 8.40 0.02 -1.26 -1.55 135.00 139.87 1tls s PRO 256 Ca 0.61 1.78 -0.15 0.00 0.02 0.00 0.00 61.00 63.26 1tls s PRO 256 Cb -0.15 -2.15 0.06 0.00 0.02 0.00 0.00 34.50 32.28 1tls s PRO 256 CO 0.54 -0.86 0.21 0.41 -0.33 0.00 0.00 177.00 176.97 1tls n GLY 257 N 0.39 -2.27 2.76 0.52 0.00 -1.26 -3.98 105.19 101.35 1tls n GLY 257 Ca 0.10 -0.76 -0.18 0.00 0.00 0.00 0.00 46.02 45.18 1tls n GLY 257 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tls s ILE 258 N -2.32 0.09 -0.01 -0.61 1.01 -1.26 -4.86 121.20 113.22 1tls s ILE 258 Ca 0.56 0.21 -0.22 0.00 0.00 0.00 0.00 60.65 61.20 1tls s ILE 258 Cb -0.17 -0.25 -0.05 0.00 0.01 0.00 0.00 42.46 42.00 1tls s ILE 258 CO 0.67 0.16 0.65 -0.54 0.00 0.00 0.00 174.94 175.88 1tls s LYS 259 N 1.51 4.38 -0.15 2.79 -0.14 -1.26 -5.08 119.74 121.79 1tls s LYS 259 Ca -0.03 0.82 -0.16 0.00 -1.36 0.00 0.00 55.97 55.24 1tls s LYS 259 Cb -0.13 -3.37 0.04 0.00 -1.68 0.00 0.00 37.83 32.69 1tls s LYS 259 CO -0.03 0.27 0.44 0.00 -0.76 0.00 0.00 175.35 175.27 1tls s ALA 260 N 0.10 -1.09 0.46 5.17 0.00 -1.26 -4.94 121.76 120.21 1tls s ALA 260 Ca 0.34 1.19 -0.23 0.00 0.00 0.00 0.00 51.96 53.26 1tls s ALA 260 Cb -0.18 -0.66 -0.07 0.00 0.00 0.00 0.00 23.12 22.20 1tls s ALA 260 CO 0.18 -0.21 1.19 -1.25 0.00 0.00 0.00 175.76 175.67 1tls s PRO 261 N 0.11 3.71 -0.12 0.00 0.04 -1.26 -5.03 135.00 132.46 1tls s PRO 261 Ca -0.01 1.83 -0.10 0.00 0.04 0.00 0.00 61.00 62.76 1tls s PRO 261 Cb -0.03 -2.41 -0.05 0.00 0.04 0.00 0.00 34.50 32.05 1tls s PRO 261 CO 0.01 -0.61 0.22 0.54 0.04 0.00 0.00 177.00 177.20 1tls s VAL 262 N -1.51 5.36 -0.31 -0.36 0.11 -1.26 -5.01 120.40 117.43 1tls s VAL 262 Ca 0.64 0.39 -0.28 0.00 -2.93 0.00 0.00 61.98 59.80 1tls s VAL 262 Cb -0.30 -3.51 0.01 0.00 -1.53 0.00 0.00 36.38 31.05 1tls s VAL 262 CO 0.37 0.54 1.01 0.00 -3.33 0.00 0.00 175.10 173.68 1tls s ALA 263 N -0.53 3.52 -2.74 1.54 0.00 -1.26 -5.22 121.76 117.07 1tls s ALA 263 Ca 0.16 -0.13 0.22 0.00 0.00 0.00 0.00 51.96 52.21 1tls s ALA 263 Cb -0.13 -3.58 0.17 0.00 0.00 0.00 0.00 23.12 19.58 1tls s ALA 263 CO 0.05 -1.39 1.19 -0.89 0.00 0.00 0.00 175.76 174.72