#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aob h LYS 2 N 0.00 0.24 -0.25 0.03 3.64 -1.98 0.48 116.57 118.73 1aob h LYS 2 Ca 0.00 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.23 1aob h LYS 2 Cb 0.00 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1aob h LYS 2 CO 0.00 0.16 -0.39 1.96 -2.27 0.00 0.00 179.45 178.91 1aob h GLN 3 N 0.24 0.58 -0.09 1.90 7.50 -1.98 -1.69 115.11 121.57 1aob h GLN 3 Ca 0.35 -0.29 -0.16 0.00 0.50 0.00 0.00 58.65 59.05 1aob h GLN 3 Cb 0.55 0.00 0.01 0.00 0.05 0.00 0.00 27.48 28.09 1aob h GLN 3 CO -0.45 0.87 -0.56 -0.92 -1.50 0.00 0.00 178.83 176.27 1aob h TYR 4 N 0.48 0.74 -0.31 2.96 3.20 -1.91 -2.06 116.97 120.07 1aob h TYR 4 Ca 0.04 -0.34 -0.07 0.00 3.14 0.00 0.00 58.73 61.51 1aob h TYR 4 Cb 0.89 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 39.03 1aob h TYR 4 CO 0.04 1.13 -0.10 -0.07 -1.64 0.00 0.00 178.16 177.51 1aob h LEU 5 N 0.14 0.50 -1.13 2.82 3.38 -0.93 0.07 115.31 120.17 1aob h LEU 5 Ca -0.04 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 1aob h LEU 5 Cb 1.21 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 1aob h LEU 5 CO 0.11 0.64 0.15 -0.33 0.09 0.00 0.00 178.44 179.10 1aob h GLU 6 N 0.48 0.76 -0.12 1.13 5.08 -1.34 -1.15 114.58 119.43 1aob h GLU 6 Ca 0.09 -0.14 -0.11 0.00 -1.00 0.00 0.00 59.36 58.21 1aob h GLU 6 Cb 0.47 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1aob h GLU 6 CO 0.03 0.67 -0.34 1.25 -1.00 0.00 0.00 179.01 179.62 1aob h LEU 7 N 0.75 0.51 -0.55 1.33 5.85 -0.89 -2.15 115.31 120.16 1aob h LEU 7 Ca 0.17 -0.59 0.09 0.00 0.84 0.00 0.00 57.88 58.39 1aob h LEU 7 Cb 0.24 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.05 1aob h LEU 7 CO -0.01 1.01 0.14 0.24 -0.34 0.00 0.00 178.44 179.49 1aob h MET 8 N 0.04 0.28 -0.69 1.25 2.86 -0.79 -0.92 114.93 116.96 1aob h MET 8 Ca -0.01 -0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.65 1aob h MET 8 Cb 0.95 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 32.50 1aob h MET 8 CO 0.07 0.19 0.42 1.96 1.06 0.00 0.00 176.91 180.61 1aob h GLN 9 N 0.29 0.80 -0.26 1.72 1.08 -1.28 -2.24 115.11 115.22 1aob h GLN 9 Ca 0.28 -0.05 -0.05 0.00 -1.45 0.00 0.00 58.65 57.38 1aob h GLN 9 Cb 0.37 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 1aob h GLN 9 CO -0.33 0.53 -0.06 -0.22 -0.95 0.00 0.00 178.83 177.80 1aob h LYS 10 N 0.82 0.41 -0.14 1.46 3.64 -0.50 -1.52 116.57 120.74 1aob h LYS 10 Ca 0.28 -0.09 -0.21 0.00 -1.27 0.00 0.00 60.65 59.36 1aob h LYS 10 Cb 0.05 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 31.82 1aob h LYS 10 CO -0.12 0.49 -0.75 0.28 -2.27 0.00 0.00 179.45 177.08 1aob h VAL 11 N 0.39 1.30 0.06 2.00 2.07 -0.92 -0.70 116.25 120.45 1aob h VAL 11 Ca 0.08 -2.00 -0.00 0.00 0.82 0.00 0.00 66.70 65.60 1aob h VAL 11 Cb 0.36 1.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.12 1aob h VAL 11 CO 0.02 0.63 -0.03 -0.07 0.02 0.00 0.00 177.57 178.13 1aob h LEU 12 N 0.48 -0.07 -0.78 2.57 3.38 -1.14 -0.48 115.31 119.27 1aob h LEU 12 Ca -0.04 -0.19 -0.13 0.00 0.09 0.00 0.00 57.88 57.61 1aob h LEU 12 Cb 1.36 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.12 1aob h LEU 12 CO 0.15 0.15 -0.52 0.44 0.09 0.00 0.00 178.44 178.75 1aob h ASP 13 N -0.29 0.27 0.00 -0.43 3.32 -1.33 -3.38 116.42 114.58 1aob h ASP 13 Ca -0.01 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.91 1aob h ASP 13 Cb 0.25 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1aob h ASP 13 CO 0.01 0.74 -1.00 -0.62 -1.72 0.00 0.00 179.24 176.65 1aob n GLU 14 N -3.94 1.65 -1.95 3.56 1.02 -0.27 -5.06 120.64 115.65 1aob n GLU 14 Ca -0.02 -0.04 -0.40 0.00 -0.02 0.00 0.00 57.16 56.67 1aob n GLU 14 Cb 0.55 -1.05 -0.01 0.00 -0.02 0.00 0.00 31.44 30.91 1aob n GLU 14 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1aob s GLY 15 N -2.43 2.96 0.24 0.62 0.00 -0.19 -4.89 107.32 103.63 1aob s GLY 15 Ca -0.01 1.39 -0.10 0.00 0.00 0.00 0.00 44.72 46.01 1aob s GLY 15 CO 0.28 2.04 0.57 -1.59 0.00 0.00 0.00 173.10 174.40 1aob s THR 16 N -1.16 4.91 -0.39 0.90 2.01 -0.63 -4.56 115.64 116.71 1aob s THR 16 Ca 0.53 0.50 -0.28 0.00 0.31 0.00 0.00 61.69 62.75 1aob s THR 16 Cb -0.42 -3.62 -0.01 0.00 0.01 0.00 0.00 72.50 68.46 1aob s THR 16 CO 0.56 -0.09 1.63 -1.10 -0.69 0.00 0.00 174.62 174.93 1aob s GLN 17 N -2.87 3.38 -0.02 4.92 -0.21 -1.26 -0.70 119.66 122.91 1aob s GLN 17 Ca 0.48 1.13 0.04 0.00 0.02 0.00 0.00 55.36 57.03 1aob s GLN 17 Cb -0.11 -4.14 -0.01 0.00 1.00 0.00 0.00 33.01 29.75 1aob s GLN 17 CO 0.21 -1.80 -0.15 0.21 -2.12 0.00 0.00 175.29 171.65 1aob s LYS 18 N 5.45 1.31 0.23 2.91 2.20 -0.33 -4.98 119.74 126.53 1aob s LYS 18 Ca 0.70 -0.52 -0.01 0.00 -0.36 0.00 0.00 55.97 55.79 1aob s LYS 18 Cb -0.18 -1.23 -0.04 0.00 -1.51 0.00 0.00 37.83 34.88 1aob s LYS 18 CO 0.32 0.27 0.42 -0.80 -0.36 0.00 0.00 175.35 175.20 1aob s ASN 19 N -0.18 6.38 0.60 1.43 -0.87 -1.26 -0.39 114.94 120.65 1aob s ASN 19 Ca 0.02 0.41 -0.01 0.00 -1.57 0.00 0.00 52.86 51.71 1aob s ASN 19 Cb -0.08 -2.01 0.04 0.00 -0.02 0.00 0.00 41.25 39.18 1aob s ASN 19 CO 0.00 -0.08 0.85 -0.62 -2.57 0.00 0.00 177.10 174.68 1aob s ASP 20 N -3.31 5.12 -0.61 -1.22 2.15 -0.32 -4.90 116.67 113.58 1aob s ASP 20 Ca 0.39 0.13 -0.29 0.00 0.43 0.00 0.00 52.55 53.21 1aob s ASP 20 Cb -0.11 -0.93 -0.12 0.00 -0.30 0.00 0.00 42.92 41.46 1aob s ASP 20 CO 0.30 -1.29 2.46 0.54 -0.17 0.00 0.00 175.17 177.01 1aob n ARG 21 N -2.53 0.77 -2.61 4.34 1.74 -1.26 -1.83 116.66 115.28 1aob n ARG 21 Ca 0.08 0.05 -0.11 0.00 -0.77 0.00 0.00 57.85 57.11 1aob n ARG 21 Cb 0.60 -2.73 -0.01 0.00 -1.02 0.00 0.00 32.46 29.30 1aob n ARG 21 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1aob n THR 22 N 7.74 -0.46 0.00 0.55 -1.04 -1.26 -4.71 114.28 115.09 1aob n THR 22 Ca 0.46 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.47 1aob n THR 22 Cb 0.35 -1.25 0.00 0.00 -1.82 0.00 0.00 70.33 67.61 1aob n THR 22 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1aob n GLY 23 N -0.77 5.04 3.76 3.41 0.00 -0.76 -5.14 105.19 110.73 1aob n GLY 23 Ca -0.08 -0.72 -0.38 0.00 0.00 0.00 0.00 46.02 44.83 1aob n GLY 23 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1aob s THR 24 N 3.96 2.51 0.52 2.61 2.01 -1.26 -4.52 115.64 121.47 1aob s THR 24 Ca 0.00 0.41 -0.18 0.00 0.31 0.00 0.00 61.69 62.23 1aob s THR 24 Cb 0.00 -3.22 -0.07 0.00 0.01 0.00 0.00 72.50 69.22 1aob s THR 24 CO 0.00 0.02 1.03 -0.83 -0.69 0.00 0.00 174.62 174.15 1aob s GLY 25 N -0.97 2.34 0.09 4.40 0.00 -1.26 -1.17 107.32 110.74 1aob s GLY 25 Ca 0.64 0.48 0.03 0.00 0.00 0.00 0.00 44.72 45.88 1aob s GLY 25 CO 0.45 0.80 -0.09 -0.51 0.00 0.00 0.00 173.10 173.75 1aob s THR 26 N -2.21 0.80 -0.25 0.90 -4.23 0.48 -1.48 115.64 109.65 1aob s THR 26 Ca 0.65 -1.66 -0.10 0.00 -1.18 0.00 0.00 61.69 59.39 1aob s THR 26 Cb -0.15 -1.36 -0.05 0.00 1.34 0.00 0.00 72.50 72.28 1aob s THR 26 CO 0.26 -0.64 0.16 -0.76 -0.54 0.00 0.00 174.62 173.10 1aob s LEU 27 N -2.53 4.06 -0.01 4.79 1.43 -0.48 -1.18 118.68 124.75 1aob s LEU 27 Ca 0.05 0.07 0.02 0.00 -1.03 0.00 0.00 54.13 53.25 1aob s LEU 27 Cb -0.01 -2.10 -0.00 0.00 0.03 0.00 0.00 46.19 44.11 1aob s LEU 27 CO -0.01 0.04 -0.08 -0.55 0.23 0.00 0.00 176.35 175.97 1aob s SER 28 N 1.23 0.94 0.22 2.29 0.15 0.13 -1.63 113.70 117.04 1aob s SER 28 Ca 0.07 -0.14 0.12 0.00 0.70 0.00 0.00 55.95 56.69 1aob s SER 28 Cb -0.14 -0.13 -0.05 0.00 -1.71 0.00 0.00 66.02 64.00 1aob s SER 28 CO 0.06 0.09 -0.22 0.27 1.20 0.00 0.00 173.24 174.64 1aob s ILE 29 N -0.13 2.41 -0.17 6.45 -4.36 -0.66 -1.61 121.20 123.14 1aob s ILE 29 Ca 0.02 -2.16 0.01 0.00 -0.26 0.00 0.00 60.65 58.26 1aob s ILE 29 Cb -0.04 -2.20 0.01 0.00 1.25 0.00 0.00 42.46 41.49 1aob s ILE 29 CO -0.00 -0.22 -0.18 0.12 0.24 0.00 0.00 174.94 174.90 1aob s PHE 30 N -1.97 2.76 0.00 1.37 5.36 -1.26 -0.90 117.98 123.35 1aob s PHE 30 Ca 0.24 -1.39 0.00 0.00 -0.96 0.00 0.00 56.93 54.82 1aob s PHE 30 Cb -0.07 -1.90 0.00 0.00 -0.34 0.00 0.00 43.02 40.71 1aob s PHE 30 CO 0.12 -0.67 0.00 0.41 -1.46 0.00 0.00 175.22 173.62 1aob n GLY 31 N 4.37 -1.96 3.18 13.12 0.00 -0.48 -5.00 105.19 118.42 1aob n GLY 31 Ca -0.20 -0.63 -0.13 0.00 0.00 0.00 0.00 46.02 45.06 1aob n GLY 31 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1aob s HIS 32 N 0.00 -0.17 -0.01 1.61 2.46 -1.03 -4.98 115.29 113.16 1aob s HIS 32 Ca 0.00 0.33 -0.01 0.00 0.47 0.00 0.00 55.06 55.85 1aob s HIS 32 Cb 0.00 0.07 0.01 0.00 -0.13 0.00 0.00 32.58 32.53 1aob s HIS 32 CO 0.00 -0.29 0.03 -1.14 -2.47 0.00 0.00 174.74 170.87 1aob s GLN 33 N -0.87 0.01 0.12 2.88 0.74 -1.26 -1.35 119.66 119.94 1aob s GLN 33 Ca -0.09 0.08 0.06 0.00 0.05 0.00 0.00 55.36 55.45 1aob s GLN 33 Cb -0.05 -0.06 -0.04 0.00 1.10 0.00 0.00 33.01 33.97 1aob s GLN 33 CO 0.02 -0.05 -0.14 -1.64 -0.55 0.00 0.00 175.29 172.94 1aob s MET 34 N 0.31 1.00 -0.04 1.67 -1.94 -0.39 -4.98 119.30 114.93 1aob s MET 34 Ca -0.03 -1.23 0.03 0.00 -1.71 0.00 0.00 55.69 52.76 1aob s MET 34 Cb -0.04 -0.87 0.00 0.00 2.01 0.00 0.00 34.83 35.94 1aob s MET 34 CO -0.01 0.16 -0.12 0.50 -0.01 0.00 0.00 175.02 175.55 1aob s ARG 35 N -2.66 1.34 -0.20 2.03 3.52 -1.26 -1.05 118.95 120.67 1aob s ARG 35 Ca 0.08 -0.40 0.01 0.00 -0.13 0.00 0.00 55.73 55.30 1aob s ARG 35 Cb -0.05 -1.18 0.04 0.00 -1.56 0.00 0.00 34.95 32.20 1aob s ARG 35 CO 0.03 0.12 -0.13 -0.06 -0.81 0.00 0.00 175.30 174.44 1aob s PHE 36 N 0.30 2.58 -0.38 5.12 0.08 -0.31 -4.98 117.98 120.39 1aob s PHE 36 Ca -0.06 -1.65 -0.29 0.00 0.12 0.00 0.00 56.93 55.05 1aob s PHE 36 Cb -0.11 -1.74 0.02 0.00 -0.57 0.00 0.00 43.02 40.62 1aob s PHE 36 CO 0.02 -0.77 1.11 1.21 -0.10 0.00 0.00 175.22 176.69 1aob s ASN 37 N 1.34 6.80 0.00 1.36 3.84 -1.26 -0.81 114.94 126.22 1aob s ASN 37 Ca 0.00 0.81 0.14 0.00 0.21 0.00 0.00 52.86 54.02 1aob s ASN 37 Cb -0.15 -2.55 0.62 0.00 -0.55 0.00 0.00 41.25 38.62 1aob s ASN 37 CO -0.09 -1.04 1.44 0.18 -2.79 0.00 0.00 177.10 174.80 1aob n LEU 38 N 7.29 0.00 0.17 3.21 4.77 0.35 -1.63 117.00 131.16 1aob n LEU 38 Ca 0.12 0.47 0.05 0.00 -0.03 0.00 0.00 56.01 56.62 1aob n LEU 38 Cb 0.48 -0.47 0.20 0.00 -2.33 0.00 0.00 43.42 41.30 1aob n LEU 38 CO 0.64 -0.24 0.60 -0.61 -1.33 0.00 0.00 177.39 176.45 1aob h GLN 39 N 0.00 0.00 0.00 3.23 5.75 -1.79 -3.21 115.11 119.10 1aob h GLN 39 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1aob h GLN 39 Cb 0.23 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.78 1aob h GLN 39 CO 0.00 0.41 0.00 -0.25 -2.65 0.00 0.00 178.83 176.34 1aob n ASP 40 N -3.34 0.00 0.00 -0.69 8.00 -0.64 -5.01 116.55 114.87 1aob n ASP 40 Ca 0.01 -0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.17 1aob n ASP 40 Cb 0.61 -0.18 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 1aob n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1aob n GLY 41 N 0.80 3.29 3.69 0.44 0.00 -1.21 -4.80 105.19 107.40 1aob n GLY 41 Ca 0.15 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.85 1aob n GLY 41 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1aob s PHE 42 N -2.40 3.45 -1.16 1.61 5.36 -0.07 -4.62 117.98 120.15 1aob s PHE 42 Ca 0.00 1.51 -0.12 0.00 -0.96 0.00 0.00 56.93 57.36 1aob s PHE 42 Cb 0.00 -3.24 -0.07 0.00 -0.34 0.00 0.00 43.02 39.37 1aob s PHE 42 CO 0.00 -0.46 2.29 -0.35 -1.46 0.00 0.00 175.22 175.23 1aob n PRO 43 N 5.02 2.47 -4.03 10.12 -0.04 -1.26 -3.95 135.00 143.34 1aob n PRO 43 Ca 0.09 -1.96 -0.35 0.00 -0.04 0.00 0.00 63.50 61.24 1aob n PRO 43 Cb 0.48 -2.82 -0.12 0.00 -0.04 0.00 0.00 33.50 31.01 1aob n PRO 43 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1aob s LEU 44 N 0.81 3.46 0.08 1.53 2.96 -1.26 -4.29 118.68 121.97 1aob s LEU 44 Ca 0.52 -0.11 -0.32 0.00 -0.22 0.00 0.00 54.13 54.00 1aob s LEU 44 Cb 0.14 -1.88 -0.11 0.00 0.50 0.00 0.00 46.19 44.84 1aob s LEU 44 CO -0.01 0.09 1.85 0.55 -1.32 0.00 0.00 176.35 177.51 1aob n VAL 45 N 4.11 0.45 0.67 1.68 3.14 -1.26 -4.83 118.33 122.30 1aob n VAL 45 Ca -0.17 -0.08 0.11 0.00 -2.96 0.00 0.00 64.34 61.24 1aob n VAL 45 Cb 0.52 -2.08 -0.07 0.00 -1.06 0.00 0.00 33.84 31.14 1aob n VAL 45 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 1aob n THR 46 N 4.84 0.04 1.74 1.55 -2.24 -1.26 -4.32 114.28 114.63 1aob n THR 46 Ca 0.19 -0.17 0.12 0.00 -2.27 0.00 0.00 64.05 61.93 1aob n THR 46 Cb 0.36 0.54 0.74 0.00 -2.10 0.00 0.00 70.33 69.87 1aob n THR 46 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1aob n THR 47 N -1.78 0.00 -3.68 4.28 -2.24 -1.26 -0.79 114.28 108.80 1aob n THR 47 Ca 0.02 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.67 1aob n THR 47 Cb 0.41 -0.51 -0.09 0.00 -2.10 0.00 0.00 70.33 68.04 1aob n THR 47 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1aob s LYS 48 N -2.00 0.64 0.04 -0.78 -2.85 -1.26 -4.62 119.74 108.90 1aob s LYS 48 Ca 0.37 0.80 -0.30 0.00 -1.00 0.00 0.00 55.97 55.84 1aob s LYS 48 Cb 0.17 0.29 -0.07 0.00 -2.06 0.00 0.00 37.83 36.16 1aob s LYS 48 CO 0.29 -0.09 1.48 0.50 0.10 0.00 0.00 175.35 177.63 1aob s ARG 49 N 0.43 4.26 -0.09 1.78 3.52 -0.75 -4.74 118.95 123.36 1aob s ARG 49 Ca -0.01 2.09 0.01 0.00 -0.13 0.00 0.00 55.73 57.70 1aob s ARG 49 Cb -0.04 -3.53 -0.02 0.00 -1.56 0.00 0.00 34.95 29.80 1aob s ARG 49 CO -0.01 -0.60 -0.13 0.00 -0.81 0.00 0.00 175.30 173.75 1aob s HIS 51 N -0.21 3.20 0.01 0.00 3.76 -1.26 -4.97 115.29 115.82 1aob s HIS 51 Ca 0.01 -0.93 0.32 0.00 -0.15 0.00 0.00 55.06 54.31 1aob s HIS 51 Cb -0.13 -3.39 1.37 0.00 1.11 0.00 0.00 32.58 31.54 1aob s HIS 51 CO 0.03 -0.90 1.95 1.25 -0.85 0.00 0.00 174.74 176.22 1aob h LEU 52 N 9.00 0.00 -1.45 0.89 5.85 -2.01 -3.36 115.31 124.24 1aob h LEU 52 Ca -0.29 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.39 1aob h LEU 52 Cb 1.10 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 1aob h LEU 52 CO 0.93 0.00 -0.06 0.08 -0.34 0.00 0.00 178.44 179.05 1aob h ARG 53 N 0.00 0.28 -0.07 1.25 0.11 -2.00 -1.78 114.38 112.17 1aob h ARG 53 Ca 0.00 -0.05 -0.13 0.00 0.10 0.00 0.00 59.98 59.89 1aob h ARG 53 Cb 0.43 -0.04 -0.01 0.00 1.11 0.00 0.00 29.97 31.45 1aob h ARG 53 CO 0.00 0.37 -0.55 0.77 0.10 0.00 0.00 179.97 180.65 1aob h SER 54 N 0.28 0.24 0.34 0.08 0.02 -1.99 -2.86 113.55 109.65 1aob h SER 54 Ca 0.06 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1aob h SER 54 Cb 0.29 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.77 1aob h SER 54 CO 0.01 0.74 -0.16 0.40 -1.14 0.00 0.00 176.83 176.69 1aob h ILE 55 N 0.16 0.68 0.17 3.27 2.04 -1.62 -1.04 117.51 121.17 1aob h ILE 55 Ca -0.00 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.66 1aob h ILE 55 Cb 1.03 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.89 1aob h ILE 55 CO 0.08 0.04 -0.14 0.40 0.00 0.00 0.00 178.15 178.53 1aob h ILE 56 N -0.57 0.68 -0.44 -0.67 2.04 -1.40 -1.54 117.51 115.62 1aob h ILE 56 Ca -0.05 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.84 1aob h ILE 56 Cb 0.42 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 1aob h ILE 56 CO 0.08 0.00 0.29 0.45 0.00 0.00 0.00 178.15 178.97 1aob h HIS 57 N -0.33 0.47 -0.24 1.37 3.86 -1.54 -1.51 115.15 117.23 1aob h HIS 57 Ca -0.00 0.01 -0.18 0.00 -1.16 0.00 0.00 60.37 59.04 1aob h HIS 57 Cb 0.30 -0.16 -0.00 0.00 1.06 0.00 0.00 27.41 28.62 1aob h HIS 57 CO -0.12 0.28 -0.57 1.49 0.86 0.00 0.00 177.93 179.86 1aob h GLU 58 N 0.49 0.75 -0.12 2.45 4.81 -0.89 -2.86 114.58 119.21 1aob h GLU 58 Ca 0.18 -0.49 -0.02 0.00 -0.13 0.00 0.00 59.36 58.90 1aob h GLU 58 Cb 0.10 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.54 1aob h GLU 58 CO -0.04 1.11 0.01 1.25 -0.73 0.00 0.00 179.01 180.61 1aob h LEU 59 N 0.57 0.20 -1.74 1.64 5.85 -0.62 -1.40 115.31 119.80 1aob h LEU 59 Ca 0.01 -0.28 -0.03 0.00 0.84 0.00 0.00 57.88 58.41 1aob h LEU 59 Cb 1.16 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 42.13 1aob h LEU 59 CO 0.12 0.43 -0.16 -0.07 -0.34 0.00 0.00 178.44 178.42 1aob h LEU 60 N -0.04 0.00 -0.12 2.25 3.38 -1.40 -1.96 115.31 117.42 1aob h LEU 60 Ca 0.04 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1aob h LEU 60 Cb 0.32 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1aob h LEU 60 CO 0.00 0.16 -0.07 -0.25 0.09 0.00 0.00 178.44 178.38 1aob h TRP 61 N 0.00 0.30 -0.54 1.13 7.01 -1.32 -3.00 115.95 119.53 1aob h TRP 61 Ca -0.00 -0.08 0.07 0.00 2.11 0.00 0.00 58.89 60.99 1aob h TRP 61 Cb 0.31 -0.07 -0.06 0.00 -2.10 0.00 0.00 29.16 27.25 1aob h TRP 61 CO 0.00 0.62 0.22 0.74 -2.79 0.00 0.00 178.44 177.23 1aob h PHE 62 N -0.11 0.40 0.00 2.65 0.04 -0.85 -2.60 116.94 116.46 1aob h PHE 62 Ca 0.02 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.82 1aob h PHE 62 Cb 0.55 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.60 1aob h PHE 62 CO 0.07 0.14 0.00 -0.07 -0.60 0.00 0.00 178.31 177.86 1aob h LEU 63 N 0.42 0.00 -0.24 1.54 3.38 -1.38 -1.83 115.31 117.20 1aob h LEU 63 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1aob h LEU 63 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1aob h LEU 63 CO -0.24 0.00 -0.11 0.00 0.09 0.00 0.00 178.44 178.18 1aob n GLN 64 N -2.98 0.69 -1.65 1.13 1.13 -0.99 -4.90 117.38 109.80 1aob n GLN 64 Ca -0.01 -0.24 -0.05 0.00 -1.94 0.00 0.00 57.00 54.76 1aob n GLN 64 Cb 0.19 -1.50 -0.01 0.00 0.11 0.00 0.00 30.24 29.03 1aob n GLN 64 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1aob n GLY 65 N 1.28 0.45 3.73 1.08 0.00 -0.69 -5.01 105.19 106.03 1aob n GLY 65 Ca 0.14 -0.75 -0.38 0.00 0.00 0.00 0.00 46.02 45.03 1aob n GLY 65 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1aob s ASP 66 N -2.85 6.72 0.00 1.61 2.15 -1.14 -4.02 116.67 119.13 1aob s ASP 66 Ca 0.00 0.85 0.07 0.00 0.43 0.00 0.00 52.55 53.90 1aob s ASP 66 Cb 0.00 -2.30 -0.00 0.00 -0.30 0.00 0.00 42.92 40.32 1aob s ASP 66 CO 0.00 0.00 0.51 0.41 -0.17 0.00 0.00 175.17 175.92 1aob n THR 67 N 3.61 0.00 -4.04 1.71 -1.04 -1.26 -4.47 114.28 108.79 1aob n THR 67 Ca -0.07 -0.43 -0.34 0.00 -2.04 0.00 0.00 64.05 61.18 1aob n THR 67 Cb 0.52 1.08 -0.07 0.00 -1.82 0.00 0.00 70.33 70.04 1aob n THR 67 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1aob s ASN 68 N -1.09 5.93 0.23 8.00 3.84 -1.26 -1.75 114.94 128.84 1aob s ASN 68 Ca 0.06 0.25 0.23 0.00 0.21 0.00 0.00 52.86 53.61 1aob s ASN 68 Cb 0.05 -1.78 0.94 0.00 -0.55 0.00 0.00 41.25 39.91 1aob s ASN 68 CO 0.17 0.30 1.71 0.00 -2.79 0.00 0.00 177.10 176.50 1aob n ILE 69 N 1.36 0.80 -0.22 -5.21 0.13 0.18 -4.29 119.36 112.10 1aob n ILE 69 Ca -0.14 0.16 -0.02 0.00 -1.10 0.00 0.00 62.75 61.64 1aob n ILE 69 Cb 0.53 -1.07 0.04 0.00 -0.84 0.00 0.00 39.64 38.30 1aob n ILE 69 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1aob h ALA 70 N 2.32 0.20 -0.71 1.51 0.00 -1.91 -0.77 119.26 119.90 1aob h ALA 70 Ca 0.00 0.22 0.10 0.00 0.00 0.00 0.00 54.91 55.22 1aob h ALA 70 Cb 0.41 0.66 -0.07 0.00 0.00 0.00 0.00 17.79 18.79 1aob h ALA 70 CO 0.00 -0.55 0.35 -0.92 0.00 0.00 0.00 179.25 178.13 1aob h TYR 71 N -0.08 0.63 -0.43 0.00 3.20 -2.00 -0.36 116.97 117.93 1aob h TYR 71 Ca 0.28 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 62.05 1aob h TYR 71 Cb 0.53 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 1aob h TYR 71 CO -0.60 0.22 -0.26 -0.07 -1.64 0.00 0.00 178.16 175.81 1aob h LEU 72 N 0.59 0.93 -1.11 2.82 3.38 -1.63 -2.83 115.31 117.46 1aob h LEU 72 Ca 0.35 -0.36 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1aob h LEU 72 Cb 0.38 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1aob h LEU 72 CO -0.28 1.13 -0.10 0.45 0.09 0.00 0.00 178.44 179.73 1aob h HIS 73 N 0.77 0.55 0.00 1.13 3.86 -0.33 0.11 115.15 121.24 1aob h HIS 73 Ca 0.09 -0.08 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1aob h HIS 73 Cb 0.82 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 29.14 1aob h HIS 73 CO 0.05 0.60 -0.02 0.93 0.86 0.00 0.00 177.93 180.36 1aob h GLU 74 N 0.48 0.00 -0.36 2.45 5.08 -0.85 -1.24 114.58 120.13 1aob h GLU 74 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1aob h GLU 74 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1aob h GLU 74 CO 0.03 0.02 0.00 0.09 -1.00 0.00 0.00 179.01 178.14 1aob n ASN 75 N -3.54 3.13 -4.08 1.42 3.02 -0.84 -4.99 115.26 109.39 1aob n ASN 75 Ca -0.03 -2.13 -0.29 0.00 -0.03 0.00 0.00 54.58 52.10 1aob n ASN 75 Cb 0.11 -0.29 -0.03 0.00 -0.61 0.00 0.00 39.78 38.96 1aob n ASN 75 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1aob n ASN 76 N 0.47 -1.11 -4.49 6.41 5.15 -0.47 -4.97 115.26 116.25 1aob n ASN 76 Ca 0.14 -1.04 -0.37 0.00 -0.60 0.00 0.00 54.58 52.70 1aob n ASN 76 Cb 0.50 -2.80 -0.12 0.00 -0.53 0.00 0.00 39.78 36.83 1aob n ASN 76 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1aob s VAL 77 N -3.80 4.69 -0.07 3.44 1.01 0.32 -4.97 120.40 121.02 1aob s VAL 77 Ca 0.23 -0.12 0.11 0.00 0.00 0.00 0.00 61.98 62.20 1aob s VAL 77 Cb -0.13 -3.25 0.16 0.00 0.00 0.00 0.00 36.38 33.16 1aob s VAL 77 CO 0.91 0.25 1.08 1.07 0.00 0.00 0.00 175.10 178.42 1aob n THR 78 N 4.98 1.49 0.30 3.92 5.66 -1.26 -3.78 114.28 125.60 1aob n THR 78 Ca -0.15 -1.71 0.19 0.00 -3.05 0.00 0.00 64.05 59.33 1aob n THR 78 Cb 0.51 0.08 0.87 0.00 -1.55 0.00 0.00 70.33 70.25 1aob n THR 78 CO 0.00 0.00 0.00 0.16 -3.05 0.00 0.00 175.07 172.18 1aob h ILE 79 N 0.05 0.00 -0.04 1.09 3.07 -1.97 -2.96 117.51 116.75 1aob h ILE 79 Ca 0.00 -0.25 0.00 0.00 1.55 0.00 0.00 64.86 66.16 1aob h ILE 79 Cb 0.79 1.19 0.00 0.00 -0.27 0.00 0.00 36.82 38.53 1aob h ILE 79 CO 0.00 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 177.89 1aob n TRP 80 N -2.95 0.03 -0.29 0.16 7.02 -1.26 -4.63 117.44 115.52 1aob n TRP 80 Ca -0.01 -0.02 0.08 0.00 -1.02 0.00 0.00 57.50 56.54 1aob n TRP 80 Cb 0.19 -0.00 0.24 0.00 -2.42 0.00 0.00 31.31 29.32 1aob n TRP 80 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1aob h ASP 81 N 3.24 0.40 -0.53 -0.99 5.19 -1.87 -1.63 116.42 120.23 1aob h ASP 81 Ca 0.00 0.11 0.15 0.00 -0.62 0.00 0.00 57.03 56.68 1aob h ASP 81 Cb 0.69 0.07 -0.02 0.00 0.18 0.00 0.00 39.33 40.25 1aob h ASP 81 CO 0.00 0.13 0.41 -0.08 -3.12 0.00 0.00 179.24 176.57 1aob h GLU 82 N 0.51 0.00 0.00 3.56 4.81 -1.82 -2.83 114.58 118.81 1aob h GLU 82 Ca 0.48 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 59.43 1aob h GLU 82 Cb 0.76 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.09 1aob h GLU 82 CO -0.42 0.00 -2.22 0.91 -0.73 0.00 0.00 179.01 176.55 1aob n TRP 83 N -4.23 0.00 -1.95 0.92 7.02 -0.65 -5.00 117.44 113.55 1aob n TRP 83 Ca 0.10 0.00 -0.38 0.00 -1.02 0.00 0.00 57.50 56.20 1aob n TRP 83 Cb 0.63 -0.84 0.02 0.00 -2.42 0.00 0.00 31.31 28.70 1aob n TRP 83 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1aob s ALA 84 N -2.65 2.94 1.01 6.99 0.00 -0.98 -4.86 121.76 124.21 1aob s ALA 84 Ca -0.09 1.22 -0.06 0.00 0.00 0.00 0.00 51.96 53.03 1aob s ALA 84 Cb 0.07 -3.51 0.08 0.00 0.00 0.00 0.00 23.12 19.76 1aob s ALA 84 CO 0.79 -1.10 0.45 -0.40 0.00 0.00 0.00 175.76 175.50 1aob n ASP 85 N -0.69 -0.15 0.28 0.00 5.75 -0.60 -4.87 116.55 116.28 1aob n ASP 85 Ca 0.08 -1.11 0.12 0.00 -0.01 0.00 0.00 54.79 53.88 1aob n ASP 85 Cb 0.45 -0.35 0.81 0.00 -1.03 0.00 0.00 41.12 41.01 1aob n ASP 85 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1aob h GLU 86 N 0.00 0.00 -0.02 0.11 3.07 -1.96 -0.54 114.58 115.24 1aob h GLU 86 Ca -0.15 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.71 1aob h GLU 86 Cb 0.41 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 1aob h GLU 86 CO 0.10 0.00 -0.16 0.09 -1.40 0.00 0.00 179.01 177.64 1aob n ASN 87 N -4.11 2.03 0.00 1.42 4.13 -1.26 -4.95 115.26 112.52 1aob n ASN 87 Ca -0.03 -1.56 0.00 0.00 1.68 0.00 0.00 54.58 54.67 1aob n ASN 87 Cb 0.09 0.14 0.00 0.00 -1.54 0.00 0.00 39.78 38.47 1aob n ASN 87 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1aob n GLY 88 N 1.32 0.76 3.76 7.41 0.00 -0.21 -4.85 105.19 113.38 1aob n GLY 88 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1aob n GLY 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1aob s ASP 89 N -2.34 7.26 0.00 1.61 1.01 -1.26 -0.65 116.67 122.30 1aob s ASP 89 Ca 0.00 1.50 0.17 0.00 0.71 0.00 0.00 52.55 54.93 1aob s ASP 89 Cb 0.00 -2.47 0.11 0.00 1.01 0.00 0.00 42.92 41.57 1aob s ASP 89 CO 0.00 0.10 1.02 0.18 0.21 0.00 0.00 175.17 176.68 1aob n LEU 90 N 2.34 2.29 0.00 1.23 4.77 -0.72 -1.56 117.00 125.35 1aob n LEU 90 Ca -0.04 -0.95 0.00 0.00 -0.03 0.00 0.00 56.01 54.99 1aob n LEU 90 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1aob n LEU 90 CO 0.46 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 1aob n GLY 91 N 1.04 -2.34 2.49 -0.72 0.00 -1.26 -0.83 105.19 103.56 1aob n GLY 91 Ca 0.10 -1.60 -0.23 0.00 0.00 0.00 0.00 46.02 44.29 1aob n GLY 91 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1aob n PRO 92 N -0.39 2.25 -0.81 1.61 -0.04 -1.26 -4.85 135.00 131.50 1aob n PRO 92 Ca 0.00 -1.46 -0.10 0.00 -0.04 0.00 0.00 63.50 61.90 1aob n PRO 92 Cb 0.00 -2.41 0.07 0.00 -0.04 0.00 0.00 33.50 31.12 1aob n PRO 92 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1aob n VAL 93 N 3.84 0.00 0.00 0.52 0.24 -1.26 -4.49 118.33 117.18 1aob n VAL 93 Ca 0.48 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 62.38 1aob n VAL 93 Cb 0.22 -1.71 0.00 0.00 -1.47 0.00 0.00 33.84 30.88 1aob n VAL 93 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1aob n TYR 94 N -2.55 0.00 -0.35 6.34 4.01 -1.26 -1.43 117.16 121.92 1aob n TYR 94 Ca 0.06 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.79 1aob n TYR 94 Cb 0.21 -0.21 0.12 0.00 -0.31 0.00 0.00 39.34 39.15 1aob n TYR 94 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1aob h GLY 95 N 0.00 1.37 1.02 2.72 0.00 -1.78 0.96 103.07 107.36 1aob h GLY 95 Ca 0.00 -0.48 -0.08 0.00 0.00 0.00 0.00 47.33 46.77 1aob h GLY 95 CO 0.00 0.43 -0.00 1.70 0.00 0.00 0.00 176.54 178.67 1aob h LYS 96 N 1.23 0.89 -0.10 4.80 1.63 -1.38 -2.23 116.57 121.40 1aob h LYS 96 Ca 0.37 -0.29 -0.14 0.00 -0.85 0.00 0.00 60.65 59.74 1aob h LYS 96 Cb -0.05 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 31.49 1aob h LYS 96 CO -0.11 0.92 -0.55 1.96 -3.45 0.00 0.00 179.45 178.23 1aob h GLN 97 N 0.76 0.31 -0.39 1.90 1.08 -1.03 0.19 115.11 117.92 1aob h GLN 97 Ca 0.14 -0.20 -0.10 0.00 -1.45 0.00 0.00 58.65 57.05 1aob h GLN 97 Cb 0.52 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.97 1aob h GLN 97 CO 0.03 0.78 -0.14 -1.49 -0.95 0.00 0.00 178.83 177.06 1aob h TRP 98 N 0.24 0.89 0.00 2.96 4.06 -0.86 -3.26 115.95 119.98 1aob h TRP 98 Ca 0.00 -0.21 0.00 0.00 2.06 0.00 0.00 58.89 60.75 1aob h TRP 98 Cb 1.05 -0.21 0.00 0.00 -1.00 0.00 0.00 29.16 28.99 1aob h TRP 98 CO 0.03 0.94 -1.33 0.54 -3.56 0.00 0.00 178.44 175.06 1aob n ARG 99 N -4.30 0.85 -2.81 0.49 5.12 -0.84 -1.35 116.66 113.81 1aob n ARG 99 Ca -0.01 -0.08 -0.10 0.00 -1.93 0.00 0.00 57.85 55.72 1aob n ARG 99 Cb 0.39 -1.39 0.07 0.00 -1.16 0.00 0.00 32.46 30.37 1aob n ARG 99 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1aob n ALA 100 N -1.77 -0.24 -1.70 7.54 0.00 0.65 -3.93 120.51 121.06 1aob n ALA 100 Ca 0.00 -1.79 -0.42 0.00 0.00 0.00 0.00 53.44 51.22 1aob n ALA 100 Cb 0.38 -1.12 -0.03 0.00 0.00 0.00 0.00 19.45 18.68 1aob n ALA 100 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1aob s TRP 101 N -0.21 1.33 0.02 0.00 -0.11 -0.46 -4.58 118.94 114.93 1aob s TRP 101 Ca 0.25 -0.02 -0.30 0.00 1.22 0.00 0.00 56.10 57.25 1aob s TRP 101 Cb 0.30 -4.11 -0.04 0.00 -1.50 0.00 0.00 33.47 28.12 1aob s TRP 101 CO -0.06 -4.79 1.14 -1.25 -4.62 0.00 0.00 176.95 167.38 1aob s PRO 102 N 5.11 4.44 0.47 5.86 0.04 -1.26 -0.58 135.00 149.08 1aob s PRO 102 Ca 0.91 1.66 -0.02 0.00 0.04 0.00 0.00 61.00 63.58 1aob s PRO 102 Cb -0.38 -3.42 -0.01 0.00 0.04 0.00 0.00 34.50 30.73 1aob s PRO 102 CO 0.38 -0.25 0.73 0.95 0.04 0.00 0.00 177.00 178.85 1aob s THR 103 N 1.30 4.31 0.53 1.26 -4.23 -0.24 -4.98 115.64 113.59 1aob s THR 103 Ca 0.56 -0.22 0.20 0.00 -1.18 0.00 0.00 61.69 61.06 1aob s THR 103 Cb -0.26 -3.62 0.31 0.00 1.34 0.00 0.00 72.50 70.26 1aob s THR 103 CO 0.27 -0.52 2.13 -0.65 -0.54 0.00 0.00 174.62 175.31 1aob h PRO 104 N 0.28 0.00 -0.60 3.99 0.11 -1.97 -3.07 132.00 130.74 1aob h PRO 104 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 1aob h PRO 104 Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1aob h PRO 104 CO 0.60 0.00 0.02 -0.40 -0.21 0.00 0.00 178.00 178.01 1aob n ASP 105 N -4.40 5.61 0.00 -2.05 5.75 -1.26 -4.93 116.55 115.26 1aob n ASP 105 Ca -0.00 -2.94 0.00 0.00 -0.01 0.00 0.00 54.79 51.84 1aob n ASP 105 Cb 0.21 -0.69 0.00 0.00 -1.03 0.00 0.00 41.12 39.61 1aob n ASP 105 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1aob n GLY 106 N 0.55 0.71 3.90 6.12 0.00 -1.16 -5.08 105.19 110.24 1aob n GLY 106 Ca 0.28 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.02 1aob n GLY 106 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1aob s ARG 107 N -0.63 3.23 -0.17 1.61 0.52 -1.26 -4.89 118.95 117.37 1aob s ARG 107 Ca 0.00 0.29 0.00 0.00 -0.52 0.00 0.00 55.73 55.51 1aob s ARG 107 Cb 0.00 -2.22 0.03 0.00 0.52 0.00 0.00 34.95 33.28 1aob s ARG 107 CO 0.00 -0.59 -0.12 -1.01 0.02 0.00 0.00 175.30 173.60 1aob s HIS 108 N -3.02 2.22 -0.18 -0.53 3.76 -1.26 -1.08 115.29 115.20 1aob s HIS 108 Ca 0.53 -1.34 -0.15 0.00 -0.15 0.00 0.00 55.06 53.95 1aob s HIS 108 Cb -0.11 -1.59 -0.04 0.00 1.11 0.00 0.00 32.58 31.95 1aob s HIS 108 CO 0.48 -0.69 0.35 0.42 -0.85 0.00 0.00 174.74 174.45 1aob s ILE 109 N 1.47 5.25 -0.74 0.60 -1.09 0.25 -4.76 121.20 122.19 1aob s ILE 109 Ca 0.03 0.63 -0.19 0.00 -2.23 0.00 0.00 60.65 58.89 1aob s ILE 109 Cb -0.14 -3.68 0.12 0.00 -1.58 0.00 0.00 42.46 37.17 1aob s ILE 109 CO -0.10 0.32 0.90 -0.62 -1.23 0.00 0.00 174.94 174.21 1aob s ASP 110 N 0.77 6.38 0.46 3.58 -1.08 -1.25 -1.35 116.67 124.17 1aob s ASP 110 Ca 0.18 -1.66 0.25 0.00 -0.52 0.00 0.00 52.55 50.80 1aob s ASP 110 Cb -0.14 -2.35 1.00 0.00 -1.46 0.00 0.00 42.92 39.97 1aob s ASP 110 CO 0.06 -1.11 1.86 1.56 0.52 0.00 0.00 175.17 178.06 1aob h GLN 111 N 9.01 0.00 -0.04 4.34 4.20 -1.49 -2.52 115.11 128.62 1aob h GLN 111 Ca -0.11 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.36 1aob h GLN 111 Cb 1.06 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.86 1aob h GLN 111 CO 1.08 0.19 -0.89 0.82 -0.67 0.00 0.00 178.83 179.37 1aob h ILE 112 N 0.00 1.30 -0.18 2.54 1.08 -1.87 -2.03 117.51 118.35 1aob h ILE 112 Ca -0.00 -2.14 -0.13 0.00 -0.39 0.00 0.00 64.86 62.20 1aob h ILE 112 Cb 0.70 2.32 -0.01 0.00 -3.07 0.00 0.00 36.82 36.75 1aob h ILE 112 CO 0.03 0.66 -0.46 0.74 -0.69 0.00 0.00 178.15 178.43 1aob h THR 113 N 0.34 1.32 0.41 -0.27 2.02 -1.87 -2.61 112.91 112.24 1aob h THR 113 Ca -0.10 -1.65 -0.01 0.00 0.77 0.00 0.00 66.41 65.42 1aob h THR 113 Cb 1.55 1.67 -0.02 0.00 -1.74 0.00 0.00 68.15 69.62 1aob h THR 113 CO 0.18 0.51 -0.33 0.74 0.37 0.00 0.00 175.52 176.98 1aob h THR 114 N 0.37 0.31 -0.75 3.16 2.02 -1.47 -0.42 112.91 116.13 1aob h THR 114 Ca 0.02 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.34 1aob h THR 114 Cb 0.95 0.31 -0.09 0.00 -1.74 0.00 0.00 68.15 67.58 1aob h THR 114 CO 0.08 0.00 0.32 0.58 0.37 0.00 0.00 175.52 176.88 1aob h VAL 115 N -0.75 0.70 -0.63 3.16 2.07 -1.34 -0.97 116.25 118.49 1aob h VAL 115 Ca -0.04 -0.17 -0.07 0.00 0.82 0.00 0.00 66.70 67.25 1aob h VAL 115 Cb 0.65 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1aob h VAL 115 CO -0.02 0.09 0.14 -0.07 0.02 0.00 0.00 177.57 177.73 1aob h LEU 116 N 0.49 0.97 -0.59 2.57 3.38 -1.20 -1.67 115.31 119.26 1aob h LEU 116 Ca 0.41 -0.24 0.09 0.00 0.09 0.00 0.00 57.88 58.23 1aob h LEU 116 Cb 0.58 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 41.00 1aob h LEU 116 CO -0.37 0.97 0.21 0.78 0.09 0.00 0.00 178.44 180.12 1aob h ASN 117 N 0.94 0.19 0.17 -0.43 2.35 -0.17 -2.33 115.58 116.31 1aob h ASN 117 Ca 0.20 0.08 -0.14 0.00 -0.55 0.00 0.00 56.30 55.89 1aob h ASN 117 Cb 0.38 0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 1aob h ASN 117 CO 0.01 0.12 -0.51 1.56 -1.65 0.00 0.00 177.43 176.96 1aob h GLN 118 N 0.38 0.38 0.00 0.81 4.20 -0.99 0.15 115.11 120.04 1aob h GLN 118 Ca 0.30 -0.22 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 1aob h GLN 118 Cb 0.38 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 1aob h GLN 118 CO -0.31 0.80 -0.24 -0.07 -0.67 0.00 0.00 178.83 178.34 1aob h LEU 119 N 0.30 0.00 0.07 1.46 3.38 -1.07 -0.85 115.31 118.60 1aob h LEU 119 Ca 0.01 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.62 1aob h LEU 119 Cb 1.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.71 1aob h LEU 119 CO 0.09 0.24 -2.02 0.29 0.09 0.00 0.00 178.44 177.12 1aob n LYS 120 N -3.34 0.70 -0.02 1.13 5.02 -0.90 -4.19 118.16 116.55 1aob n LYS 120 Ca 0.01 0.29 0.09 0.00 -2.02 0.00 0.00 58.31 56.67 1aob n LYS 120 Cb 0.46 -1.66 -0.16 0.00 -0.02 0.00 0.00 35.03 33.65 1aob n LYS 120 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1aob n ASN 121 N -3.63 0.21 -3.08 4.39 3.02 0.02 -4.69 115.26 111.51 1aob n ASN 121 Ca -0.36 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.01 1aob n ASN 121 Cb 0.97 1.86 -0.02 0.00 -0.61 0.00 0.00 39.78 41.98 1aob n ASN 121 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1aob n ASP 122 N -2.28 -0.22 0.26 6.41 2.03 -0.37 -5.00 116.55 117.39 1aob n ASP 122 Ca -0.07 -3.04 0.14 0.00 0.52 0.00 0.00 54.79 52.35 1aob n ASP 122 Cb 0.60 -0.00 0.70 0.00 -0.72 0.00 0.00 41.12 41.70 1aob n ASP 122 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1aob h PRO 123 N 3.42 0.00 -0.01 -0.67 0.13 -1.60 -2.60 132.00 130.67 1aob h PRO 123 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1aob h PRO 123 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 1aob h PRO 123 CO 0.42 0.10 0.00 -0.25 -0.23 0.00 0.00 178.00 178.04 1aob n ASP 124 N -3.36 0.11 -4.72 1.44 8.00 -1.26 -4.01 116.55 112.76 1aob n ASP 124 Ca -0.01 -1.32 -0.43 0.00 0.71 0.00 0.00 54.79 53.75 1aob n ASP 124 Cb 0.29 -0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.37 1aob n ASP 124 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1aob n SER 125 N -0.78 3.35 -1.44 -2.24 2.88 -0.98 -4.91 113.62 109.50 1aob n SER 125 Ca 0.17 1.16 0.08 0.00 -1.33 0.00 0.00 58.87 58.94 1aob n SER 125 Cb 0.09 -1.53 0.31 0.00 -0.75 0.00 0.00 64.21 62.34 1aob n SER 125 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1aob n ARG 126 N 1.84 3.44 -0.34 -1.46 1.74 -1.26 -4.25 116.66 116.37 1aob n ARG 126 Ca 0.09 -2.49 0.08 0.00 -0.77 0.00 0.00 57.85 54.76 1aob n ARG 126 Cb 0.35 -1.84 0.17 0.00 -1.02 0.00 0.00 32.46 30.12 1aob n ARG 126 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1aob n ARG 127 N 0.92 1.40 -2.92 5.56 1.74 -1.26 -4.93 116.66 117.18 1aob n ARG 127 Ca 0.22 -2.91 -0.44 0.00 -0.77 0.00 0.00 57.85 53.95 1aob n ARG 127 Cb 0.81 -1.53 -0.00 0.00 -1.02 0.00 0.00 32.46 30.71 1aob n ARG 127 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1aob s ILE 128 N -3.00 4.92 -0.03 0.55 1.01 -1.26 -4.96 121.20 118.44 1aob s ILE 128 Ca 0.35 -2.43 0.07 0.00 0.00 0.00 0.00 60.65 58.63 1aob s ILE 128 Cb 0.32 -4.91 -0.01 0.00 0.01 0.00 0.00 42.46 37.86 1aob s ILE 128 CO -0.02 -1.63 -0.22 -0.63 0.00 0.00 0.00 174.94 172.43 1aob s ILE 129 N 1.93 1.78 -0.07 2.92 1.01 -1.26 -0.19 121.20 127.31 1aob s ILE 129 Ca 0.42 -0.95 0.05 0.00 0.00 0.00 0.00 60.65 60.17 1aob s ILE 129 Cb -0.03 -1.48 -0.01 0.00 0.01 0.00 0.00 42.46 40.96 1aob s ILE 129 CO -0.01 0.50 -0.23 0.54 0.00 0.00 0.00 174.94 175.74 1aob s VAL 130 N -0.42 1.96 -0.09 2.92 0.11 0.12 -4.90 120.40 120.10 1aob s VAL 130 Ca 0.06 -0.99 0.02 0.00 -2.93 0.00 0.00 61.98 58.13 1aob s VAL 130 Cb -0.10 -1.67 -0.02 0.00 -1.53 0.00 0.00 36.38 33.06 1aob s VAL 130 CO 0.00 0.54 -0.14 -0.55 -3.33 0.00 0.00 175.10 171.62 1aob s SER 131 N 0.04 3.98 0.00 3.54 0.15 -1.26 -1.24 113.70 118.91 1aob s SER 131 Ca -0.09 -0.28 0.15 0.00 0.70 0.00 0.00 55.95 56.43 1aob s SER 131 Cb -0.15 -1.24 0.15 0.00 -1.71 0.00 0.00 66.02 63.08 1aob s SER 131 CO 0.05 0.25 1.01 0.00 1.20 0.00 0.00 173.24 175.75 1aob n ALA 132 N 2.95 2.45 -2.86 5.45 0.00 -0.32 -4.69 120.51 123.49 1aob n ALA 132 Ca -0.18 -0.69 -0.44 0.00 0.00 0.00 0.00 53.44 52.14 1aob n ALA 132 Cb 0.52 -0.51 -0.00 0.00 0.00 0.00 0.00 19.45 19.46 1aob n ALA 132 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1aob s TRP 133 N -1.20 3.30 -0.58 0.00 -0.11 -1.20 -4.77 118.94 114.37 1aob s TRP 133 Ca 0.19 -1.94 -0.19 0.00 1.22 0.00 0.00 56.10 55.38 1aob s TRP 133 Cb 0.13 -4.41 0.10 0.00 -1.50 0.00 0.00 33.47 27.79 1aob s TRP 133 CO 0.19 -1.50 0.70 1.21 -4.62 0.00 0.00 176.95 172.93 1aob s ASN 134 N 3.23 6.19 0.27 5.86 3.84 -1.26 -4.95 114.94 128.12 1aob s ASN 134 Ca 0.44 -1.37 -0.00 0.00 0.21 0.00 0.00 52.86 52.14 1aob s ASN 134 Cb -0.02 -2.30 0.50 0.00 -0.55 0.00 0.00 41.25 38.88 1aob s ASN 134 CO 0.01 -1.10 1.84 0.58 -2.79 0.00 0.00 177.10 175.64 1aob h VAL 135 N 5.92 0.95 0.00 -5.21 2.07 -2.01 -2.10 116.25 115.87 1aob h VAL 135 Ca -0.29 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 66.88 1aob h VAL 135 Cb 1.09 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1aob h VAL 135 CO 1.09 0.18 0.00 0.61 0.02 0.00 0.00 177.57 179.47 1aob n GLY 136 N -1.35 -1.18 0.30 2.17 0.00 -1.26 -2.94 105.19 100.94 1aob n GLY 136 Ca 0.17 -0.09 0.03 0.00 0.00 0.00 0.00 46.02 46.13 1aob n GLY 136 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1aob n GLU 137 N -1.40 1.05 -0.16 1.61 1.02 -0.81 -4.77 120.64 117.17 1aob n GLU 137 Ca 0.08 -1.24 -0.07 0.00 -0.02 0.00 0.00 57.16 55.91 1aob n GLU 137 Cb 0.23 -1.14 0.08 0.00 -0.02 0.00 0.00 31.44 30.60 1aob n GLU 137 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1aob h LEU 138 N 1.24 0.91 -2.84 -4.62 3.38 -1.38 -2.48 115.31 109.53 1aob h LEU 138 Ca 0.00 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1aob h LEU 138 Cb 0.41 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1aob h LEU 138 CO 0.00 0.99 -0.00 0.44 0.09 0.00 0.00 178.44 179.96 1aob h ASP 139 N 0.85 0.00 -0.01 -0.43 3.32 -1.86 -2.78 116.42 115.52 1aob h ASP 139 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1aob h ASP 139 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1aob h ASP 139 CO 0.03 0.00 -0.34 0.29 -1.72 0.00 0.00 179.24 177.50 1aob n LYS 140 N -3.30 1.49 -3.13 3.56 4.76 -0.94 -4.94 118.16 115.66 1aob n LYS 140 Ca -0.03 -1.21 -0.33 0.00 -2.87 0.00 0.00 58.31 53.86 1aob n LYS 140 Cb 0.08 -1.47 -0.06 0.00 -1.84 0.00 0.00 35.03 31.73 1aob n LYS 140 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 1aob s MET 141 N -2.35 4.06 0.38 1.97 -1.94 -1.05 -4.27 119.30 116.10 1aob s MET 141 Ca 0.22 0.72 0.07 0.00 -1.71 0.00 0.00 55.69 54.98 1aob s MET 141 Cb 0.19 -2.55 0.75 0.00 2.01 0.00 0.00 34.83 35.23 1aob s MET 141 CO 0.50 0.22 1.94 0.00 -0.01 0.00 0.00 175.02 177.67 1aob h ALA 142 N 2.56 1.52 -2.58 3.03 0.00 -1.31 -3.43 119.26 119.06 1aob h ALA 142 Ca -0.48 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.17 1aob h ALA 142 Cb 1.18 -0.13 -0.22 0.00 0.00 0.00 0.00 17.79 18.62 1aob h ALA 142 CO 0.65 0.35 -0.21 -0.48 0.00 0.00 0.00 179.25 179.56 1aob s LEU 143 N -9.08 0.50 0.36 0.00 0.05 -1.26 -5.07 118.68 104.18 1aob s LEU 143 Ca -0.07 0.52 -0.27 0.00 0.05 0.00 0.00 54.13 54.35 1aob s LEU 143 Cb 0.16 1.46 -0.09 0.00 -2.05 0.00 0.00 46.19 45.67 1aob s LEU 143 CO 0.74 -0.31 1.26 0.00 -0.55 0.00 0.00 176.35 177.49 1aob s ALA 144 N -0.54 3.35 0.03 1.48 0.00 -1.26 -4.94 121.76 119.88 1aob s ALA 144 Ca -0.07 1.17 -0.37 0.00 0.00 0.00 0.00 51.96 52.69 1aob s ALA 144 Cb -0.04 -3.45 -0.16 0.00 0.00 0.00 0.00 23.12 19.47 1aob s ALA 144 CO 0.03 -0.63 1.45 -2.30 0.00 0.00 0.00 175.76 174.30 1aob n PRO 145 N 0.49 1.28 -0.07 0.00 -0.02 -1.26 -4.93 135.00 130.49 1aob n PRO 145 Ca 0.02 0.46 -0.19 0.00 -2.02 0.00 0.00 63.50 61.77 1aob n PRO 145 Cb 0.43 -2.13 -0.12 0.00 -0.02 0.00 0.00 33.50 31.66 1aob n PRO 145 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1aob s HIS 147 N -2.35 3.21 -0.23 0.00 0.00 -1.26 -1.29 115.29 113.37 1aob s HIS 147 Ca -0.24 -1.41 0.19 0.00 -3.00 0.00 0.00 55.06 50.61 1aob s HIS 147 Cb 0.03 -4.16 0.04 0.00 -4.00 0.00 0.00 32.58 24.50 1aob s HIS 147 CO 0.66 -1.38 1.18 0.00 -1.00 0.00 0.00 174.74 174.20 1aob h ALA 148 N 8.71 0.68 -1.96 -1.38 0.00 -1.70 -3.45 119.26 120.16 1aob h ALA 148 Ca 0.06 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1aob h ALA 148 Cb 1.04 0.06 -0.22 0.00 0.00 0.00 0.00 17.79 18.67 1aob h ALA 148 CO 1.04 0.38 0.11 0.12 0.00 0.00 0.00 179.25 180.90 1aob s PHE 149 N -3.13 -0.89 -0.05 0.00 2.19 -1.23 -1.17 117.98 113.70 1aob s PHE 149 Ca 0.01 1.95 -0.12 0.00 0.33 0.00 0.00 56.93 59.10 1aob s PHE 149 Cb 0.08 0.45 0.02 0.00 -1.31 0.00 0.00 43.02 42.26 1aob s PHE 149 CO 0.76 -0.44 0.29 -0.59 1.83 0.00 0.00 175.22 177.07 1aob s PHE 150 N 1.00 -0.21 -0.07 10.12 -0.71 -0.37 -1.14 117.98 126.60 1aob s PHE 150 Ca -0.05 0.41 0.05 0.00 -1.04 0.00 0.00 56.93 56.30 1aob s PHE 150 Cb -0.05 0.09 -0.00 0.00 -1.21 0.00 0.00 43.02 41.84 1aob s PHE 150 CO -0.10 -0.30 -0.22 -1.14 -1.34 0.00 0.00 175.22 172.12 1aob s GLN 151 N -0.81 2.58 0.38 1.99 0.74 -0.01 -0.70 119.66 123.83 1aob s GLN 151 Ca -0.09 -0.81 -0.00 0.00 0.05 0.00 0.00 55.36 54.51 1aob s GLN 151 Cb -0.04 -2.07 -0.03 0.00 1.10 0.00 0.00 33.01 31.97 1aob s GLN 151 CO 0.03 0.24 0.60 -0.06 -0.55 0.00 0.00 175.29 175.54 1aob s PHE 152 N 0.16 3.45 -0.14 1.67 0.08 0.73 -0.80 117.98 123.14 1aob s PHE 152 Ca -0.11 0.37 -0.10 0.00 0.12 0.00 0.00 56.93 57.21 1aob s PHE 152 Cb -0.16 -2.02 0.04 0.00 -0.57 0.00 0.00 43.02 40.32 1aob s PHE 152 CO 0.06 -0.02 0.35 -0.47 -0.10 0.00 0.00 175.22 175.04 1aob s TYR 153 N -2.41 -0.45 -0.12 0.36 5.04 -0.71 -4.52 117.35 114.54 1aob s TYR 153 Ca 0.42 1.03 0.03 0.00 -2.44 0.00 0.00 57.07 56.11 1aob s TYR 153 Cb -0.10 0.16 0.01 0.00 0.35 0.00 0.00 41.96 42.38 1aob s TYR 153 CO 0.37 -0.24 -0.21 0.08 -1.34 0.00 0.00 175.55 174.21 1aob s VAL 154 N 0.75 1.97 -0.10 3.14 1.01 -1.26 -1.14 120.40 124.77 1aob s VAL 154 Ca -0.05 -0.94 -0.09 0.00 0.00 0.00 0.00 61.98 60.91 1aob s VAL 154 Cb -0.06 -1.74 0.03 0.00 0.00 0.00 0.00 36.38 34.61 1aob s VAL 154 CO -0.05 0.53 0.26 0.00 0.00 0.00 0.00 175.10 175.85 1aob s ALA 155 N 0.72 -0.65 -1.45 5.51 0.00 -0.95 -4.75 121.76 120.19 1aob s ALA 155 Ca -0.10 0.77 -0.01 0.00 0.00 0.00 0.00 51.96 52.62 1aob s ALA 155 Cb -0.16 -0.45 0.00 0.00 0.00 0.00 0.00 23.12 22.51 1aob s ALA 155 CO 0.01 -0.13 0.28 -0.25 0.00 0.00 0.00 175.76 175.67 1aob n ASP 156 N 3.03 0.01 0.00 0.00 8.00 -1.26 -1.92 116.55 124.41 1aob n ASP 156 Ca -0.14 -1.11 0.00 0.00 0.71 0.00 0.00 54.79 54.26 1aob n ASP 156 Cb 0.58 -2.54 0.00 0.00 -0.02 0.00 0.00 41.12 39.14 1aob n ASP 156 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1aob n GLY 157 N -2.19 0.30 3.24 0.44 0.00 -1.26 -4.99 105.19 100.72 1aob n GLY 157 Ca -0.31 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 1aob n GLY 157 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aob s LYS 158 N -0.90 3.09 -0.25 1.61 1.02 -0.81 -0.68 119.74 122.81 1aob s LYS 158 Ca 0.00 -0.85 -0.17 0.00 0.02 0.00 0.00 55.97 54.96 1aob s LYS 158 Cb 0.00 -2.35 -0.03 0.00 -0.52 0.00 0.00 37.83 34.93 1aob s LYS 158 CO 0.00 0.17 0.49 -1.17 -0.92 0.00 0.00 175.35 173.92 1aob s LEU 159 N 0.38 4.06 0.39 3.17 2.96 -0.56 -2.25 118.68 126.83 1aob s LEU 159 Ca -0.17 0.50 0.08 0.00 -0.22 0.00 0.00 54.13 54.31 1aob s LEU 159 Cb -0.18 -2.62 -0.04 0.00 0.50 0.00 0.00 46.19 43.85 1aob s LEU 159 CO 0.08 -0.25 0.22 -0.44 -1.32 0.00 0.00 176.35 174.64 1aob s SER 160 N 1.51 4.67 -0.25 3.68 0.01 -0.29 -0.30 113.70 122.72 1aob s SER 160 Ca 0.20 -0.90 -0.18 0.00 1.31 0.00 0.00 55.95 56.38 1aob s SER 160 Cb -0.16 -0.58 0.07 0.00 0.21 0.00 0.00 66.02 65.57 1aob s SER 160 CO 0.09 -0.50 0.63 0.00 0.41 0.00 0.00 173.24 173.87 1aob s GLN 162 N 1.07 3.26 -0.15 0.00 0.74 0.02 -1.10 119.66 123.50 1aob s GLN 162 Ca -0.06 -0.75 -0.04 0.00 0.05 0.00 0.00 55.36 54.56 1aob s GLN 162 Cb -0.05 -2.55 -0.03 0.00 1.10 0.00 0.00 33.01 31.47 1aob s GLN 162 CO -0.10 0.15 -0.01 -1.17 -0.55 0.00 0.00 175.29 173.60 1aob s LEU 163 N 0.49 3.43 -0.26 3.68 2.96 -0.84 -0.83 118.68 127.31 1aob s LEU 163 Ca -0.11 -0.03 -0.10 0.00 -0.22 0.00 0.00 54.13 53.67 1aob s LEU 163 Cb -0.16 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 1aob s LEU 163 CO 0.05 0.21 0.15 -0.47 -1.32 0.00 0.00 176.35 174.97 1aob s TYR 164 N 0.11 3.20 -0.28 5.38 5.04 -0.29 -0.57 117.35 129.95 1aob s TYR 164 Ca 0.01 0.01 -0.00 0.00 -2.44 0.00 0.00 57.07 54.64 1aob s TYR 164 Cb -0.13 -2.31 0.05 0.00 0.35 0.00 0.00 41.96 39.91 1aob s TYR 164 CO 0.02 -0.16 -0.04 -1.14 -1.34 0.00 0.00 175.55 172.89 1aob s GLN 165 N 1.54 2.44 0.51 4.97 0.74 0.08 -2.53 119.66 127.42 1aob s GLN 165 Ca 0.07 -1.24 0.18 0.00 0.05 0.00 0.00 55.36 54.42 1aob s GLN 165 Cb -0.15 -3.06 1.29 0.00 1.10 0.00 0.00 33.01 32.19 1aob s GLN 165 CO 0.08 -0.57 2.12 0.07 -0.55 0.00 0.00 175.29 176.44 1aob h ARG 166 N 7.93 0.00 -3.20 1.67 0.11 -1.50 0.12 114.38 119.52 1aob h ARG 166 Ca -0.23 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.66 1aob h ARG 166 Cb 1.06 0.00 -0.28 0.00 1.11 0.00 0.00 29.97 31.87 1aob h ARG 166 CO 0.52 0.05 -0.50 0.45 0.10 0.00 0.00 179.97 180.59 1aob s SER 167 N -6.89 -0.21 -0.08 0.08 0.15 -1.26 -1.76 113.70 103.74 1aob s SER 167 Ca -0.05 0.41 -0.03 0.00 0.70 0.00 0.00 55.95 56.99 1aob s SER 167 Cb 0.16 0.37 0.04 0.00 -1.71 0.00 0.00 66.02 64.89 1aob s SER 167 CO 0.66 -0.10 0.15 0.00 1.20 0.00 0.00 173.24 175.14 1aob s ASP 169 N 2.16 6.45 0.29 0.00 -1.08 -1.26 -0.74 116.67 122.49 1aob s ASP 169 Ca 0.02 0.02 0.02 0.00 -0.52 0.00 0.00 52.55 52.10 1aob s ASP 169 Cb -0.12 -2.39 0.44 0.00 -1.46 0.00 0.00 42.92 39.39 1aob s ASP 169 CO -0.06 -0.87 1.76 0.58 0.52 0.00 0.00 175.17 177.11 1aob h VAL 170 N 5.92 1.25 0.07 1.11 2.07 -1.41 -0.14 116.25 125.11 1aob h VAL 170 Ca -0.25 -1.13 -0.00 0.00 0.82 0.00 0.00 66.70 66.14 1aob h VAL 170 Cb 1.09 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 1aob h VAL 170 CO 0.95 0.37 -0.03 0.15 0.02 0.00 0.00 177.57 179.02 1aob h PHE 171 N 0.48 -0.08 0.09 1.57 3.57 -1.92 -3.36 116.94 117.29 1aob h PHE 171 Ca 0.08 -0.00 -0.26 0.00 3.53 0.00 0.00 57.97 61.32 1aob h PHE 171 Cb 0.57 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 1aob h PHE 171 CO 0.02 0.26 -1.36 1.25 -2.23 0.00 0.00 178.31 176.25 1aob h LEU 172 N -0.99 0.31 0.05 0.59 5.85 -1.96 -3.43 115.31 115.73 1aob h LEU 172 Ca -0.01 -0.82 -0.23 0.00 0.84 0.00 0.00 57.88 57.67 1aob h LEU 172 Cb 0.38 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1aob h LEU 172 CO 0.01 1.59 -1.20 1.23 -0.34 0.00 0.00 178.44 179.74 1aob h GLY 173 N -0.06 0.12 0.72 3.75 0.00 -1.57 -3.41 103.07 102.62 1aob h GLY 173 Ca -0.30 -0.30 0.06 0.00 0.00 0.00 0.00 47.33 46.79 1aob h GLY 173 CO 0.02 0.27 0.58 -2.00 0.00 0.00 0.00 176.54 175.41 1aob h LEU 174 N -0.68 0.92 -2.03 3.11 5.85 -1.21 -2.08 115.31 119.19 1aob h LEU 174 Ca -0.29 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.49 1aob h LEU 174 Cb 1.48 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 1aob h LEU 174 CO -0.07 0.58 0.11 1.55 -0.34 0.00 0.00 178.44 180.28 1aob h PRO 175 N 1.05 0.00 -0.01 5.25 0.13 -1.79 -1.01 132.00 135.62 1aob h PRO 175 Ca 0.40 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.36 1aob h PRO 175 Cb 0.18 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.32 1aob h PRO 175 CO -0.18 0.00 -0.65 0.35 -0.23 0.00 0.00 178.00 177.29 1aob h PHE 176 N 0.00 0.68 -0.39 1.56 3.04 -1.69 -2.98 116.94 117.15 1aob h PHE 176 Ca 0.07 -0.36 -0.10 0.00 3.98 0.00 0.00 57.97 61.56 1aob h PHE 176 Cb 0.30 -0.08 -0.02 0.00 2.56 0.00 0.00 35.95 38.71 1aob h PHE 176 CO 0.00 1.18 -0.16 -0.91 -2.02 0.00 0.00 178.31 176.40 1aob h ASN 177 N -0.01 0.73 -0.18 0.41 -0.26 -0.56 -2.60 115.58 113.10 1aob h ASN 177 Ca -0.08 -0.23 -0.02 0.00 -0.56 0.00 0.00 56.30 55.41 1aob h ASN 177 Cb 1.35 -0.20 -0.01 0.00 -1.06 0.00 0.00 38.32 38.40 1aob h ASN 177 CO 0.13 0.89 0.03 0.40 -1.06 0.00 0.00 177.43 177.82 1aob h ILE 178 N 0.65 1.22 -0.67 2.81 2.04 -1.31 -2.95 117.51 119.31 1aob h ILE 178 Ca 0.10 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.21 1aob h ILE 178 Cb 0.63 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 38.04 1aob h ILE 178 CO 0.04 0.22 0.34 0.00 0.00 0.00 0.00 178.15 178.76 1aob h ALA 179 N 0.82 0.86 -0.15 1.87 0.00 -1.53 -1.33 119.26 119.81 1aob h ALA 179 Ca 0.06 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1aob h ALA 179 Cb 0.31 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1aob h ALA 179 CO 0.00 0.41 -0.04 1.03 0.00 0.00 0.00 179.25 180.65 1aob h SER 180 N 0.92 -0.14 -0.03 0.00 0.87 -1.49 -1.00 113.55 112.69 1aob h SER 180 Ca 0.23 0.04 -0.17 0.00 -1.23 0.00 0.00 61.79 60.67 1aob h SER 180 Cb 0.09 0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.14 1aob h SER 180 CO -0.03 -0.05 -0.55 1.88 -0.53 0.00 0.00 176.83 177.55 1aob h TYR 181 N 0.00 0.78 -0.41 2.24 0.05 -1.39 -2.26 116.97 115.98 1aob h TYR 181 Ca 0.07 -0.28 -0.05 0.00 0.05 0.00 0.00 58.73 58.53 1aob h TYR 181 Cb 0.11 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 37.68 1aob h TYR 181 CO -0.18 1.03 0.05 0.00 -1.05 0.00 0.00 178.16 178.01 1aob h ALA 182 N 0.91 1.32 -0.50 3.88 0.00 -1.16 -1.80 119.26 121.91 1aob h ALA 182 Ca 0.01 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 1aob h ALA 182 Cb 1.11 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1aob h ALA 182 CO 0.11 0.47 0.10 1.25 0.00 0.00 0.00 179.25 181.18 1aob h LEU 183 N 0.61 0.77 -1.04 0.00 5.85 -0.97 -2.57 115.31 117.97 1aob h LEU 183 Ca 0.13 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 1aob h LEU 183 Cb 0.31 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 1aob h LEU 183 CO 0.01 0.82 0.43 0.25 -0.34 0.00 0.00 178.44 179.60 1aob h LEU 184 N 0.69 0.99 -0.54 2.25 5.85 -0.79 -2.23 115.31 121.53 1aob h LEU 184 Ca 0.15 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1aob h LEU 184 Cb 0.37 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1aob h LEU 184 CO 0.01 0.80 0.31 0.58 -0.34 0.00 0.00 178.44 179.80 1aob h VAL 185 N 1.11 1.17 -0.85 1.05 2.07 -1.19 -0.67 116.25 118.93 1aob h VAL 185 Ca 0.28 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 1aob h VAL 185 Cb 0.04 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 1aob h VAL 185 CO -0.04 0.18 0.41 0.45 0.02 0.00 0.00 177.57 178.59 1aob h HIS 186 N 0.72 1.22 -0.12 1.57 3.86 -1.29 -1.12 115.15 120.00 1aob h HIS 186 Ca 0.19 -0.06 -0.03 0.00 -1.16 0.00 0.00 60.37 59.31 1aob h HIS 186 Cb 0.01 -0.38 -0.00 0.00 1.06 0.00 0.00 27.41 28.10 1aob h HIS 186 CO -0.02 0.88 -0.06 0.52 0.86 0.00 0.00 177.93 180.11 1aob h MET 187 N 1.21 0.25 -0.46 2.45 2.07 -1.11 -2.26 114.93 117.07 1aob h MET 187 Ca 0.29 -0.11 0.09 0.00 -2.07 0.00 0.00 59.70 57.90 1aob h MET 187 Cb 0.11 -0.01 -0.07 0.00 -1.87 0.00 0.00 31.60 29.76 1aob h MET 187 CO -0.04 0.59 0.02 0.52 1.07 0.00 0.00 176.91 179.07 1aob h MET 188 N -0.11 0.13 -0.09 1.72 2.86 -1.12 -2.27 114.93 116.05 1aob h MET 188 Ca 0.03 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1aob h MET 188 Cb 0.52 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 1aob h MET 188 CO 0.02 0.09 0.05 0.00 1.06 0.00 0.00 176.91 178.12 1aob h ALA 189 N 1.40 0.12 -0.77 6.32 0.00 -1.22 -1.84 119.26 123.27 1aob h ALA 189 Ca 0.23 -0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.19 1aob h ALA 189 Cb 0.34 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.02 1aob h ALA 189 CO -0.37 -0.34 0.40 0.37 0.00 0.00 0.00 179.25 179.31 1aob h GLN 190 N 0.04 0.64 0.00 0.00 4.15 -1.22 -1.51 115.11 117.22 1aob h GLN 190 Ca 0.03 -0.04 -0.06 0.00 0.77 0.00 0.00 58.65 59.35 1aob h GLN 190 Cb 0.09 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 1aob h GLN 190 CO -0.00 0.43 -0.29 1.96 -1.93 0.00 0.00 178.83 178.99 1aob h GLN 191 N 0.66 0.00 -0.44 1.69 1.08 -1.06 -3.09 115.11 113.95 1aob h GLN 191 Ca 0.38 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.58 1aob h GLN 191 Cb 0.42 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.85 1aob h GLN 191 CO -0.28 0.29 0.00 0.00 -0.95 0.00 0.00 178.83 177.90 1aob n ASP 193 N 1.53 -4.30 -4.54 0.00 8.00 -0.66 -4.96 116.55 111.61 1aob n ASP 193 Ca 0.20 -0.74 -0.26 0.00 0.71 0.00 0.00 54.79 54.70 1aob n ASP 193 Cb 0.61 -4.18 -0.10 0.00 -0.02 0.00 0.00 41.12 37.44 1aob n ASP 193 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1aob s LEU 194 N -7.14 2.87 0.75 0.64 1.43 -0.79 -5.05 118.68 111.40 1aob s LEU 194 Ca 0.50 -0.66 -0.11 0.00 -1.03 0.00 0.00 54.13 52.83 1aob s LEU 194 Cb -0.24 -1.55 0.04 0.00 0.03 0.00 0.00 46.19 44.47 1aob s LEU 194 CO 0.80 0.10 1.09 -1.61 0.23 0.00 0.00 176.35 176.96 1aob s GLU 195 N -2.90 2.49 0.17 1.70 0.41 0.14 -4.30 118.70 116.42 1aob s GLU 195 Ca 0.25 0.65 -0.17 0.00 -0.41 0.00 0.00 54.97 55.29 1aob s GLU 195 Cb -0.08 -1.96 -0.07 0.00 -1.78 0.00 0.00 34.13 30.23 1aob s GLU 195 CO 0.15 -1.34 0.62 0.14 -0.49 0.00 0.00 175.26 174.34 1aob s VAL 196 N -3.19 4.73 0.00 2.63 -7.23 -1.26 -1.49 120.40 114.58 1aob s VAL 196 Ca 0.59 1.05 0.00 0.00 -1.81 0.00 0.00 61.98 61.82 1aob s VAL 196 Cb -0.13 -3.80 0.00 0.00 0.56 0.00 0.00 36.38 33.01 1aob s VAL 196 CO 0.54 0.26 0.00 0.61 -0.31 0.00 0.00 175.10 176.19 1aob n GLY 197 N 0.85 1.28 3.81 2.32 0.00 0.59 -4.48 105.19 109.57 1aob n GLY 197 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1aob n GLY 197 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1aob s ASP 198 N 0.16 5.76 -0.23 1.61 1.01 -1.25 -0.50 116.67 123.22 1aob s ASP 198 Ca 0.00 0.08 -0.04 0.00 0.71 0.00 0.00 52.55 53.30 1aob s ASP 198 Cb 0.00 -1.62 -0.01 0.00 1.01 0.00 0.00 42.92 42.30 1aob s ASP 198 CO 0.00 0.18 -0.02 0.12 0.21 0.00 0.00 175.17 175.67 1aob s PHE 199 N -1.40 3.00 -0.23 4.23 5.36 0.01 -1.89 117.98 127.06 1aob s PHE 199 Ca 0.30 -0.91 -0.07 0.00 -0.96 0.00 0.00 56.93 55.29 1aob s PHE 199 Cb -0.12 -2.14 -0.03 0.00 -0.34 0.00 0.00 43.02 40.39 1aob s PHE 199 CO 0.23 -0.54 0.07 0.08 -1.46 0.00 0.00 175.22 173.60 1aob s VAL 200 N 1.49 4.48 -0.24 3.12 1.01 -0.26 -1.16 120.40 128.84 1aob s VAL 200 Ca 0.05 -0.12 -0.09 0.00 0.00 0.00 0.00 61.98 61.82 1aob s VAL 200 Cb -0.15 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 1aob s VAL 200 CO -0.02 0.37 0.12 0.86 0.00 0.00 0.00 175.10 176.43 1aob s TRP 201 N 1.26 3.21 -0.11 5.22 -0.00 -0.22 -1.99 118.94 126.32 1aob s TRP 201 Ca 0.05 -0.03 0.02 0.00 -0.00 0.00 0.00 56.10 56.14 1aob s TRP 201 Cb -0.15 -2.25 -0.01 0.00 -0.00 0.00 0.00 33.47 31.07 1aob s TRP 201 CO 0.04 -0.10 -0.17 0.99 -0.00 0.00 0.00 176.95 177.70 1aob s THR 202 N 1.25 2.68 0.22 5.86 2.01 0.27 -1.26 115.64 126.67 1aob s THR 202 Ca 0.06 -0.81 0.10 0.00 0.31 0.00 0.00 61.69 61.36 1aob s THR 202 Cb -0.14 -2.08 -0.05 0.00 0.01 0.00 0.00 72.50 70.24 1aob s THR 202 CO 0.05 0.55 -0.20 -0.83 -0.69 0.00 0.00 174.62 173.50 1aob s GLY 203 N 0.19 1.67 0.00 4.40 0.00 -0.45 -0.74 107.32 112.38 1aob s GLY 203 Ca -0.10 -1.71 0.00 0.00 0.00 0.00 0.00 44.72 42.91 1aob s GLY 203 CO 0.06 -1.78 0.00 0.61 0.00 0.00 0.00 173.10 171.99 1aob n GLY 204 N -0.20 0.39 3.55 0.20 0.00 0.43 -2.47 105.19 107.09 1aob n GLY 204 Ca -0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 1aob n GLY 204 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1aob s ASP 205 N -1.00 5.84 -0.32 1.61 -1.08 -0.72 -1.39 116.67 119.61 1aob s ASP 205 Ca 0.00 -0.25 -0.11 0.00 -0.52 0.00 0.00 52.55 51.67 1aob s ASP 205 Cb 0.00 -2.55 -0.02 0.00 -1.46 0.00 0.00 42.92 38.89 1aob s ASP 205 CO 0.00 -2.04 0.19 -0.89 0.52 0.00 0.00 175.17 172.95 1aob s THR 206 N 7.01 4.94 0.21 1.71 2.01 -0.08 -1.77 115.64 129.68 1aob s THR 206 Ca 0.48 -0.26 0.01 0.00 0.31 0.00 0.00 61.69 62.23 1aob s THR 206 Cb -0.09 -3.50 -0.05 0.00 0.01 0.00 0.00 72.50 68.87 1aob s THR 206 CO 0.15 0.07 0.05 -1.38 -0.69 0.00 0.00 174.62 172.82 1aob s HIS 207 N 1.67 1.36 -0.09 4.92 -3.43 0.08 -1.65 115.29 118.16 1aob s HIS 207 Ca 0.06 -1.12 0.02 0.00 -0.80 0.00 0.00 55.06 53.22 1aob s HIS 207 Cb -0.17 -0.78 0.01 0.00 -1.43 0.00 0.00 32.58 30.21 1aob s HIS 207 CO 0.08 -0.29 -0.14 -0.51 -2.00 0.00 0.00 174.74 171.88 1aob s LEU 208 N -3.24 1.67 0.41 5.38 1.43 -0.65 -0.93 118.68 122.76 1aob s LEU 208 Ca 0.31 -0.37 -0.25 0.00 -1.03 0.00 0.00 54.13 52.80 1aob s LEU 208 Cb 0.07 -0.97 -0.08 0.00 0.03 0.00 0.00 46.19 45.24 1aob s LEU 208 CO 0.09 0.03 1.18 -0.31 0.23 0.00 0.00 176.35 177.56 1aob s TYR 209 N 0.84 3.00 0.45 0.29 1.51 -1.26 -1.38 117.35 120.80 1aob s TYR 209 Ca -0.11 1.54 0.12 0.00 -1.01 0.00 0.00 57.07 57.62 1aob s TYR 209 Cb -0.15 -3.41 1.04 0.00 -0.11 0.00 0.00 41.96 39.33 1aob s TYR 209 CO 0.01 -1.42 2.06 0.66 -1.11 0.00 0.00 175.55 175.76 1aob h SER 210 N 2.50 0.29 -0.31 2.29 4.64 -1.61 -2.32 113.55 119.02 1aob h SER 210 Ca -0.49 -0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.73 1aob h SER 210 Cb 1.24 -0.07 -0.06 0.00 -0.31 0.00 0.00 62.40 63.20 1aob h SER 210 CO 0.62 0.20 0.12 -0.46 -0.87 0.00 0.00 176.83 176.44 1aob n ASN 211 N -4.49 3.12 -0.07 4.97 6.94 -1.26 -3.12 115.26 121.35 1aob n ASN 211 Ca 0.03 -2.51 0.05 0.00 -0.02 0.00 0.00 54.58 52.13 1aob n ASN 211 Cb 0.17 -0.61 0.07 0.00 -2.36 0.00 0.00 39.78 37.05 1aob n ASN 211 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 1aob n HIS 212 N 0.06 0.00 -0.14 -2.53 8.25 -0.87 -4.72 115.22 115.27 1aob n HIS 212 Ca 0.17 -0.67 -0.08 0.00 -0.26 0.00 0.00 57.72 56.88 1aob n HIS 212 Cb 0.80 -0.09 0.07 0.00 1.12 0.00 0.00 29.99 31.88 1aob n HIS 212 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 1aob h MET 213 N 0.00 0.91 -0.73 -0.41 2.86 -1.69 -1.93 114.93 113.95 1aob h MET 213 Ca 0.00 -0.33 -0.04 0.00 -2.06 0.00 0.00 59.70 57.27 1aob h MET 213 Cb 0.83 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.39 1aob h MET 213 CO 0.00 0.97 0.29 -0.44 1.06 0.00 0.00 176.91 178.80 1aob h ASP 214 N 0.81 1.00 -0.02 1.22 3.32 -1.88 -1.58 116.42 119.28 1aob h ASP 214 Ca 0.13 -0.17 -0.11 0.00 0.02 0.00 0.00 57.03 56.90 1aob h ASP 214 Cb 0.65 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 1aob h ASP 214 CO 0.05 0.89 -0.32 1.56 -1.72 0.00 0.00 179.24 179.70 1aob h GLN 215 N 1.04 0.49 -0.02 3.56 7.50 -1.91 -1.09 115.11 124.68 1aob h GLN 215 Ca 0.24 -0.21 -0.25 0.00 0.50 0.00 0.00 58.65 58.93 1aob h GLN 215 Cb 0.20 -0.02 0.02 0.00 0.05 0.00 0.00 27.48 27.74 1aob h GLN 215 CO -0.02 0.75 -0.99 1.79 -1.50 0.00 0.00 178.83 178.86 1aob h THR 216 N 0.42 1.30 -0.84 -0.54 1.35 -1.21 -1.82 112.91 111.57 1aob h THR 216 Ca 0.05 -2.23 -0.03 0.00 -0.55 0.00 0.00 66.41 63.65 1aob h THR 216 Cb 0.76 2.32 -0.04 0.00 -1.73 0.00 0.00 68.15 69.46 1aob h THR 216 CO 0.06 0.69 0.40 0.45 -0.25 0.00 0.00 175.52 176.87 1aob h HIS 217 N 0.39 1.21 -0.44 4.73 3.86 -1.23 -1.78 115.15 121.90 1aob h HIS 217 Ca -0.11 -0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.02 1aob h HIS 217 Cb 1.63 -0.38 -0.02 0.00 1.06 0.00 0.00 27.41 29.71 1aob h HIS 217 CO 0.09 0.88 0.21 1.25 0.86 0.00 0.00 177.93 181.22 1aob h LEU 218 N 1.20 0.58 -0.62 2.43 5.85 -1.20 -2.97 115.31 120.58 1aob h LEU 218 Ca 0.29 -0.13 -0.11 0.00 0.84 0.00 0.00 57.88 58.76 1aob h LEU 218 Cb 0.12 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1aob h LEU 218 CO -0.04 0.55 -0.12 -0.61 -0.34 0.00 0.00 178.44 177.88 1aob h GLN 219 N 0.57 0.97 0.00 1.25 4.15 -1.24 -2.64 115.11 118.16 1aob h GLN 219 Ca 0.15 -0.36 0.00 0.00 0.77 0.00 0.00 58.65 59.21 1aob h GLN 219 Cb 0.13 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.76 1aob h GLN 219 CO -0.02 1.02 0.00 -0.07 -1.93 0.00 0.00 178.83 177.84 1aob h LEU 220 N 0.86 0.00 -1.17 -2.39 3.38 -1.29 -1.77 115.31 112.92 1aob h LEU 220 Ca 0.13 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 1aob h LEU 220 Cb 0.67 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1aob h LEU 220 CO 0.05 0.00 -0.40 0.28 0.09 0.00 0.00 178.44 178.46 1aob h SER 221 N 0.00 0.02 -3.59 -0.43 0.02 -1.31 -3.46 113.55 104.80 1aob h SER 221 Ca 0.00 -0.01 -0.52 0.00 -0.84 0.00 0.00 61.79 60.43 1aob h SER 221 Cb 0.19 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.70 1aob h SER 221 CO 0.00 0.42 0.28 -0.13 -1.14 0.00 0.00 176.83 176.26 1aob s ARG 222 N -4.12 4.68 0.05 3.45 3.00 -0.67 -5.05 118.95 120.29 1aob s ARG 222 Ca -0.03 1.32 -0.30 0.00 0.00 0.00 0.00 55.73 56.73 1aob s ARG 222 Cb 0.14 -3.31 -0.04 0.00 0.00 0.00 0.00 34.95 31.74 1aob s ARG 222 CO 0.73 0.43 0.99 -1.21 0.00 0.00 0.00 175.30 176.24 1aob s GLU 223 N -0.72 4.60 0.60 3.54 0.41 -1.26 -5.01 118.70 120.87 1aob s GLU 223 Ca 0.41 1.46 -0.19 0.00 -0.41 0.00 0.00 54.97 56.23 1aob s GLU 223 Cb -0.24 -3.42 -0.03 0.00 -1.78 0.00 0.00 34.13 28.66 1aob s GLU 223 CO 0.28 0.04 1.27 -0.35 -0.49 0.00 0.00 175.26 176.01 1aob n PRO 224 N 3.46 1.29 -4.11 0.39 -0.04 -1.26 -4.84 135.00 129.89 1aob n PRO 224 Ca 0.05 0.49 -0.31 0.00 -0.04 0.00 0.00 63.50 63.69 1aob n PRO 224 Cb 0.50 -2.49 -0.07 0.00 -0.04 0.00 0.00 33.50 31.39 1aob n PRO 224 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1aob s ARG 225 N -3.10 2.74 0.12 0.54 6.06 -1.26 -5.07 118.95 118.97 1aob s ARG 225 Ca 0.78 -0.74 -0.35 0.00 -2.50 0.00 0.00 55.73 52.92 1aob s ARG 225 Cb -0.40 -2.65 -0.17 0.00 0.06 0.00 0.00 34.95 31.80 1aob s ARG 225 CO 0.44 0.56 1.16 -0.35 -2.50 0.00 0.00 175.30 174.62 1aob n PRO 226 N 0.62 0.91 -2.23 5.12 -0.04 -1.26 -4.84 135.00 133.28 1aob n PRO 226 Ca -0.10 0.33 -0.41 0.00 -0.04 0.00 0.00 63.50 63.28 1aob n PRO 226 Cb 0.52 -1.84 -0.03 0.00 -0.04 0.00 0.00 33.50 32.12 1aob n PRO 226 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1aob s LEU 227 N 0.65 4.47 1.17 1.53 1.43 -1.26 -4.73 118.68 121.94 1aob s LEU 227 Ca 0.79 2.56 -0.18 0.00 -1.03 0.00 0.00 54.13 56.27 1aob s LEU 227 Cb -0.95 -3.64 0.27 0.00 0.03 0.00 0.00 46.19 41.90 1aob s LEU 227 CO 0.52 -0.41 1.10 -2.16 0.23 0.00 0.00 176.35 175.62 1aob s PRO 228 N -1.69 -0.98 -0.15 1.29 0.04 -1.25 -4.68 135.00 127.58 1aob s PRO 228 Ca 0.47 0.08 0.01 0.00 0.04 0.00 0.00 61.00 61.61 1aob s PRO 228 Cb -0.37 -1.61 0.02 0.00 0.04 0.00 0.00 34.50 32.57 1aob s PRO 228 CO 0.49 -3.58 -0.18 0.21 0.04 0.00 0.00 177.00 173.98 1aob s LYS 229 N -5.27 2.66 -0.18 4.56 2.20 0.33 -0.90 119.74 123.14 1aob s LYS 229 Ca 0.70 -0.71 -0.23 0.00 -0.36 0.00 0.00 55.97 55.36 1aob s LYS 229 Cb -0.12 -2.27 -0.02 0.00 -1.51 0.00 0.00 37.83 33.91 1aob s LYS 229 CO 0.57 -0.13 0.75 -1.17 -0.36 0.00 0.00 175.35 175.00 1aob s LEU 230 N 1.15 4.16 -0.15 5.43 1.98 -1.26 -0.12 118.68 129.88 1aob s LEU 230 Ca -0.01 1.04 -0.00 0.00 -2.89 0.00 0.00 54.13 52.27 1aob s LEU 230 Cb -0.14 -3.09 -0.01 0.00 0.66 0.00 0.00 46.19 43.61 1aob s LEU 230 CO -0.07 -0.34 -0.14 -0.51 -1.89 0.00 0.00 176.35 173.40 1aob s ILE 231 N 2.03 2.81 -0.34 6.68 1.10 0.03 -4.99 121.20 128.51 1aob s ILE 231 Ca 0.34 -0.73 -0.13 0.00 -0.51 0.00 0.00 60.65 59.63 1aob s ILE 231 Cb -0.16 -2.19 -0.02 0.00 0.15 0.00 0.00 42.46 40.24 1aob s ILE 231 CO 0.12 0.51 0.26 -0.63 -2.11 0.00 0.00 174.94 173.09 1aob s ILE 232 N 0.70 5.27 -1.25 2.00 1.01 -1.26 -1.03 121.20 126.64 1aob s ILE 232 Ca -0.07 -0.16 0.19 0.00 0.00 0.00 0.00 60.65 60.62 1aob s ILE 232 Cb -0.15 -3.73 0.27 0.00 0.01 0.00 0.00 42.46 38.85 1aob s ILE 232 CO 0.02 -0.02 1.61 0.29 0.00 0.00 0.00 174.94 176.84 1aob n LYS 233 N 5.15 0.16 -3.68 2.79 5.02 0.70 -4.82 118.16 123.48 1aob n LYS 233 Ca -0.12 0.13 -0.15 0.00 -2.02 0.00 0.00 58.31 56.16 1aob n LYS 233 Cb 0.50 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.93 1aob n LYS 233 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1aob s ARG 234 N -2.75 0.73 -0.49 1.97 3.52 -1.26 -5.10 118.95 115.57 1aob s ARG 234 Ca 0.15 0.26 -0.12 0.00 -0.13 0.00 0.00 55.73 55.89 1aob s ARG 234 Cb 0.13 0.34 0.12 0.00 -1.56 0.00 0.00 34.95 33.98 1aob s ARG 234 CO 0.32 -0.18 0.40 0.21 -0.81 0.00 0.00 175.30 175.24 1aob s LYS 235 N -0.68 2.67 0.89 5.12 2.20 -1.26 -5.08 119.74 123.60 1aob s LYS 235 Ca -0.08 -1.73 -0.12 0.00 -0.36 0.00 0.00 55.97 53.69 1aob s LYS 235 Cb -0.03 -4.06 0.09 0.00 -1.51 0.00 0.00 37.83 32.32 1aob s LYS 235 CO 0.04 -1.23 0.90 -2.30 -0.36 0.00 0.00 175.35 172.41 1aob n PRO 236 N 5.03 -0.20 0.18 4.03 -0.02 -1.26 -4.92 135.00 137.84 1aob n PRO 236 Ca -0.10 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.52 1aob n PRO 236 Cb 0.41 -2.20 0.55 0.00 -0.02 0.00 0.00 33.50 32.23 1aob n PRO 236 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1aob h GLU 237 N -1.45 0.00 -3.00 -0.52 4.81 -1.99 -3.45 114.58 108.98 1aob h GLU 237 Ca -0.44 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 58.83 1aob h GLU 237 Cb 1.29 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.63 1aob h GLU 237 CO 0.40 0.00 0.24 -1.54 -0.73 0.00 0.00 179.01 177.39 1aob s SER 238 N -4.75 -0.18 0.62 1.04 1.04 -1.26 -5.03 113.70 105.18 1aob s SER 238 Ca 0.04 -0.77 0.39 0.00 0.48 0.00 0.00 55.95 56.09 1aob s SER 238 Cb 0.09 0.77 2.07 0.00 0.10 0.00 0.00 66.02 69.05 1aob s SER 238 CO 0.46 -1.45 2.26 -0.29 0.98 0.00 0.00 173.24 175.19 1aob h ILE 239 N 2.00 0.11 -0.02 -1.02 6.09 -1.94 -2.21 117.51 120.53 1aob h ILE 239 Ca -0.23 -0.16 0.00 0.00 -1.37 0.00 0.00 64.86 63.11 1aob h ILE 239 Cb 1.25 1.13 0.00 0.00 0.47 0.00 0.00 36.82 39.67 1aob h ILE 239 CO 0.28 0.01 -0.03 0.49 -3.07 0.00 0.00 178.15 175.84 1aob n PHE 240 N -3.22 0.00 -1.31 2.19 3.72 -1.26 -4.31 117.46 113.27 1aob n PHE 240 Ca -0.02 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.32 1aob n PHE 240 Cb 0.13 -0.01 0.21 0.00 -0.94 0.00 0.00 39.48 38.88 1aob n PHE 240 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1aob n ASP 241 N 0.53 3.10 -4.89 4.37 8.00 -0.83 -5.00 116.55 121.83 1aob n ASP 241 Ca 0.17 -3.58 -0.29 0.00 0.71 0.00 0.00 54.79 51.80 1aob n ASP 241 Cb 0.44 -0.66 -0.02 0.00 -0.02 0.00 0.00 41.12 40.86 1aob n ASP 241 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1aob s TYR 242 N -3.17 3.49 0.10 1.24 1.51 -1.26 -4.76 117.35 114.51 1aob s TYR 242 Ca 0.47 0.84 0.05 0.00 -1.01 0.00 0.00 57.07 57.42 1aob s TYR 242 Cb 0.41 -2.28 -0.04 0.00 -0.11 0.00 0.00 41.96 39.94 1aob s TYR 242 CO 0.04 -0.04 -0.12 1.03 -1.11 0.00 0.00 175.55 175.34 1aob s ARG 243 N -3.96 0.92 0.27 -0.62 0.52 -1.26 -5.05 118.95 109.76 1aob s ARG 243 Ca 0.48 -1.16 0.01 0.00 -0.52 0.00 0.00 55.73 54.53 1aob s ARG 243 Cb -0.10 -0.74 0.62 0.00 0.52 0.00 0.00 34.95 35.25 1aob s ARG 243 CO 0.34 0.14 1.71 0.35 0.02 0.00 0.00 175.30 177.86 1aob h PHE 244 N 3.66 0.60 0.00 -0.53 3.57 -1.99 -1.61 116.94 120.65 1aob h PHE 244 Ca -0.39 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.15 1aob h PHE 244 Cb 1.19 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.80 1aob h PHE 244 CO 0.64 0.01 0.00 -0.85 -2.23 0.00 0.00 178.31 175.88 1aob n GLU 245 N -5.02 0.16 0.05 1.11 0.00 -1.26 -3.43 120.64 112.25 1aob n GLU 245 Ca 0.19 0.44 0.09 0.00 0.00 0.00 0.00 57.16 57.89 1aob n GLU 245 Cb 0.55 -1.84 0.39 0.00 0.00 0.00 0.00 31.44 30.55 1aob n GLU 245 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1aob n ASP 246 N -2.15 0.27 -4.52 -1.84 8.00 -0.61 -4.76 116.55 110.95 1aob n ASP 246 Ca 0.02 0.56 -0.33 0.00 0.71 0.00 0.00 54.79 55.75 1aob n ASP 246 Cb 0.19 -0.62 -0.12 0.00 -0.02 0.00 0.00 41.12 40.54 1aob n ASP 246 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1aob s PHE 247 N -3.12 2.79 0.00 1.24 0.08 -1.22 -0.22 117.98 117.53 1aob s PHE 247 Ca 0.06 -0.09 0.01 0.00 0.12 0.00 0.00 56.93 57.03 1aob s PHE 247 Cb 0.10 -1.65 -0.00 0.00 -0.57 0.00 0.00 43.02 40.90 1aob s PHE 247 CO 0.34 0.25 -0.02 -1.21 -0.10 0.00 0.00 175.22 174.47 1aob s GLU 248 N -0.83 0.19 -0.18 0.44 2.02 -0.20 -4.97 118.70 115.18 1aob s GLU 248 Ca 0.12 -0.17 -0.04 0.00 0.02 0.00 0.00 54.97 54.91 1aob s GLU 248 Cb -0.11 -0.13 -0.02 0.00 0.10 0.00 0.00 34.13 33.97 1aob s GLU 248 CO 0.01 0.03 -0.03 0.42 0.02 0.00 0.00 175.26 175.71 1aob s ILE 249 N -0.28 3.77 -0.12 -1.63 -1.09 -1.26 -0.79 121.20 119.80 1aob s ILE 249 Ca -0.02 -0.39 -0.00 0.00 -2.23 0.00 0.00 60.65 58.01 1aob s ILE 249 Cb -0.02 -2.67 -0.02 0.00 -1.58 0.00 0.00 42.46 38.17 1aob s ILE 249 CO -0.00 0.47 -0.12 -0.70 -1.23 0.00 0.00 174.94 173.36 1aob s GLU 250 N 0.70 3.28 -0.25 2.79 2.12 0.83 -4.66 118.70 123.51 1aob s GLU 250 Ca -0.02 -0.66 -0.01 0.00 0.36 0.00 0.00 54.97 54.65 1aob s GLU 250 Cb -0.14 -2.63 0.00 0.00 0.26 0.00 0.00 34.13 31.61 1aob s GLU 250 CO 0.02 0.29 0.07 0.41 -0.54 0.00 0.00 175.26 175.52 1aob n GLY 251 N 3.30 0.43 3.48 -1.50 0.00 -1.26 -0.51 105.19 109.12 1aob n GLY 251 Ca -0.18 -0.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 1aob n GLY 251 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1aob s TYR 252 N -2.51 3.22 -0.61 1.61 5.04 -1.26 -4.22 117.35 118.62 1aob s TYR 252 Ca 0.04 -0.46 0.05 0.00 -2.44 0.00 0.00 57.07 54.25 1aob s TYR 252 Cb -0.02 -2.64 0.17 0.00 0.35 0.00 0.00 41.96 39.83 1aob s TYR 252 CO 0.04 -0.57 0.44 0.34 -1.34 0.00 0.00 175.55 174.47 1aob s ASP 253 N 1.71 3.74 0.87 4.32 2.15 -1.26 -5.10 116.67 123.11 1aob s ASP 253 Ca 0.07 -3.60 -0.12 0.00 0.43 0.00 0.00 52.55 49.33 1aob s ASP 253 Cb -0.18 -1.25 0.12 0.00 -0.30 0.00 0.00 42.92 41.30 1aob s ASP 253 CO 0.11 -0.11 1.13 -2.16 -0.17 0.00 0.00 175.17 173.96 1aob s PRO 254 N -0.97 1.45 0.80 4.34 0.04 -1.26 -4.89 135.00 134.51 1aob s PRO 254 Ca 0.27 0.39 -0.11 0.00 0.04 0.00 0.00 61.00 61.59 1aob s PRO 254 Cb -0.02 -1.87 0.08 0.00 0.04 0.00 0.00 34.50 32.73 1aob s PRO 254 CO -0.18 -2.00 1.16 -1.01 0.04 0.00 0.00 177.00 175.01 1aob s HIS 255 N -3.25 2.94 0.76 0.56 3.76 0.03 -4.87 115.29 115.22 1aob s HIS 255 Ca 0.63 0.71 -0.14 0.00 -0.15 0.00 0.00 55.06 56.10 1aob s HIS 255 Cb -0.15 -3.46 0.06 0.00 1.11 0.00 0.00 32.58 30.14 1aob s HIS 255 CO 0.53 -1.74 1.23 -2.14 -0.85 0.00 0.00 174.74 171.77 1aob s PRO 256 N -5.54 1.89 0.49 8.40 0.02 -1.26 -1.81 135.00 137.18 1aob s PRO 256 Ca 0.62 1.83 -0.22 0.00 0.02 0.00 0.00 61.00 63.24 1aob s PRO 256 Cb -0.11 -1.80 -0.07 0.00 0.02 0.00 0.00 34.50 32.55 1aob s PRO 256 CO 0.48 -2.04 1.18 0.20 -0.33 0.00 0.00 177.00 176.49 1aob s GLY 257 N -1.98 2.76 -0.09 0.52 0.00 -1.26 -3.45 107.32 103.82 1aob s GLY 257 Ca 0.75 0.95 0.03 0.00 0.00 0.00 0.00 44.72 46.46 1aob s GLY 257 CO 0.48 1.39 -0.19 -0.42 0.00 0.00 0.00 173.10 174.36 1aob s ILE 258 N -1.57 2.59 0.12 0.90 1.01 -1.26 -4.89 121.20 118.11 1aob s ILE 258 Ca 0.67 -0.85 -0.18 0.00 0.00 0.00 0.00 60.65 60.28 1aob s ILE 258 Cb -0.29 -2.02 -0.07 0.00 0.01 0.00 0.00 42.46 40.09 1aob s ILE 258 CO 0.34 0.56 0.59 -0.54 0.00 0.00 0.00 174.94 175.89 1aob s LYS 259 N 0.01 4.15 -0.22 2.79 -0.14 -1.26 -5.06 119.74 120.01 1aob s LYS 259 Ca -0.06 0.69 0.01 0.00 -1.36 0.00 0.00 55.97 55.25 1aob s LYS 259 Cb -0.15 -3.08 0.06 0.00 -1.68 0.00 0.00 37.83 32.97 1aob s LYS 259 CO 0.05 0.55 -0.06 0.00 -0.76 0.00 0.00 175.35 175.13 1aob s ALA 260 N -1.29 1.90 0.61 5.17 0.00 -1.26 -4.96 121.76 121.94 1aob s ALA 260 Ca 0.34 -1.26 -0.13 0.00 0.00 0.00 0.00 51.96 50.92 1aob s ALA 260 Cb -0.18 -1.37 -0.04 0.00 0.00 0.00 0.00 23.12 21.54 1aob s ALA 260 CO 0.20 -1.08 1.03 -1.25 0.00 0.00 0.00 175.76 174.65 1aob s PRO 261 N 1.43 3.48 0.03 0.00 0.04 -1.26 -5.08 135.00 133.63 1aob s PRO 261 Ca -0.04 0.89 0.06 0.00 0.04 0.00 0.00 61.00 61.95 1aob s PRO 261 Cb -0.18 -2.06 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 1aob s PRO 261 CO -0.07 -0.66 -0.19 0.14 0.04 0.00 0.00 177.00 176.26 1aob s VAL 262 N -2.95 1.50 0.81 -0.36 -7.23 -1.26 -4.92 120.40 105.99 1aob s VAL 262 Ca 0.57 -1.04 -0.11 0.00 -1.81 0.00 0.00 61.98 59.59 1aob s VAL 262 Cb -0.12 -1.30 0.08 0.00 0.56 0.00 0.00 36.38 35.60 1aob s VAL 262 CO 0.48 0.23 1.09 0.00 -0.31 0.00 0.00 175.10 176.58 1aob s ALA 263 N -0.70 2.06 0.00 1.32 0.00 -1.26 -5.23 121.76 117.95 1aob s ALA 263 Ca 0.06 0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.06 1aob s ALA 263 Cb -0.08 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.84 1aob s ALA 263 CO 0.01 -1.90 0.42 1.51 0.00 0.00 0.00 175.76 175.81