#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u9b n MET 1 N 0.00 0.08 -0.05 3.52 2.81 -1.26 -1.87 117.12 120.35 1u9b n MET 1 Ca 0.00 0.14 0.06 0.00 -1.81 0.00 0.00 57.70 56.09 1u9b n MET 1 Cb 0.00 -1.50 0.28 0.00 -0.71 0.00 0.00 33.22 31.29 1u9b n MET 1 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1u9b n SER 2 N -1.44 0.63 -0.32 7.83 7.64 -1.26 -4.15 113.62 122.55 1u9b n SER 2 Ca 0.06 -1.75 0.00 0.00 1.01 0.00 0.00 58.87 58.19 1u9b n SER 2 Cb 0.22 -0.06 0.13 0.00 -1.01 0.00 0.00 64.21 63.49 1u9b n SER 2 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1u9b h GLY 3 N 5.49 1.31 0.97 0.23 0.00 -1.71 0.12 103.07 109.49 1u9b h GLY 3 Ca 0.00 -0.41 -0.07 0.00 0.00 0.00 0.00 47.33 46.85 1u9b h GLY 3 CO 0.00 0.31 -0.01 -2.22 0.00 0.00 0.00 176.54 174.62 1u9b h ILE 4 N 1.04 1.26 -0.22 2.60 2.04 -1.86 -0.95 117.51 121.43 1u9b h ILE 4 Ca 0.37 -1.06 -0.03 0.00 1.00 0.00 0.00 64.86 65.15 1u9b h ILE 4 Cb 0.10 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1u9b h ILE 4 CO -0.15 0.36 0.03 0.00 0.00 0.00 0.00 178.15 178.39 1u9b h ALA 5 N 0.89 0.29 -0.73 1.87 0.00 -1.45 -2.42 119.26 117.72 1u9b h ALA 5 Ca 0.12 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1u9b h ALA 5 Cb 0.51 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1u9b h ALA 5 CO 0.02 -0.04 0.25 -0.07 0.00 0.00 0.00 179.25 179.41 1u9b h LEU 6 N 0.16 1.03 -0.47 0.00 3.38 -0.74 0.12 115.31 118.78 1u9b h LEU 6 Ca 0.07 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1u9b h LEU 6 Cb 0.32 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1u9b h LEU 6 CO 0.00 0.94 0.26 -1.28 0.09 0.00 0.00 178.44 178.46 1u9b h SER 7 N 1.07 0.60 -0.51 -0.43 0.87 -1.07 -0.88 113.55 113.19 1u9b h SER 7 Ca 0.24 -0.09 -0.10 0.00 -1.23 0.00 0.00 61.79 60.61 1u9b h SER 7 Cb 0.27 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.06 1u9b h SER 7 CO -0.01 0.52 -0.05 -0.09 -0.53 0.00 0.00 176.83 176.66 1u9b h ARG 8 N 0.63 0.94 -0.41 2.24 9.65 -0.90 -2.45 114.38 124.08 1u9b h ARG 8 Ca 0.17 -0.33 -0.01 0.00 -1.10 0.00 0.00 59.98 58.71 1u9b h ARG 8 Cb 0.06 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.55 1u9b h ARG 8 CO -0.03 0.99 0.22 -0.07 2.80 0.00 0.00 179.97 183.88 1u9b h LEU 9 N 0.81 0.49 -0.63 3.80 3.38 -0.51 0.80 115.31 123.44 1u9b h LEU 9 Ca 0.14 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 1u9b h LEU 9 Cb 0.60 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 1u9b h LEU 9 CO 0.04 0.40 -0.53 0.00 0.09 0.00 0.00 178.44 178.44 1u9b h ALA 10 N 1.69 0.81 -0.37 1.53 0.00 -0.91 -1.08 119.26 120.91 1u9b h ALA 10 Ca 0.15 -0.50 -0.11 0.00 0.00 0.00 0.00 54.91 54.44 1u9b h ALA 10 Cb 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1u9b h ALA 10 CO -0.02 0.68 -0.23 1.96 0.00 0.00 0.00 179.25 181.63 1u9b h GLN 11 N 0.34 0.75 -0.40 0.00 1.08 -0.76 -1.98 115.11 114.12 1u9b h GLN 11 Ca 0.01 -0.30 -0.04 0.00 -1.45 0.00 0.00 58.65 56.86 1u9b h GLN 11 Cb 1.04 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.42 1u9b h GLN 11 CO 0.09 0.91 0.08 0.93 -0.95 0.00 0.00 178.83 179.89 1u9b h GLU 12 N 0.65 0.66 -0.19 1.46 4.39 -0.58 -1.06 114.58 119.91 1u9b h GLU 12 Ca 0.09 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.62 1u9b h GLU 12 Cb 0.74 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1u9b h GLU 12 CO 0.06 0.70 0.13 -0.09 -1.16 0.00 0.00 179.01 178.64 1u9b h ARG 13 N 0.51 0.26 -0.16 2.33 2.43 -1.07 -1.39 114.38 117.29 1u9b h ARG 13 Ca 0.12 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.30 1u9b h ARG 13 Cb 0.35 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 1u9b h ARG 13 CO 0.01 0.18 0.03 -0.22 -1.51 0.00 0.00 179.97 178.45 1u9b h LYS 14 N 0.25 0.09 -0.54 0.20 3.64 -1.26 -1.78 116.57 117.18 1u9b h LYS 14 Ca 0.07 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 1u9b h LYS 14 Cb -0.02 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 1u9b h LYS 14 CO -0.01 0.06 0.24 0.00 -2.27 0.00 0.00 179.45 177.46 1u9b h ALA 15 N 1.12 1.41 0.30 5.00 0.00 -0.96 -2.00 119.26 124.14 1u9b h ALA 15 Ca 0.07 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1u9b h ALA 15 Cb 0.07 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1u9b h ALA 15 CO -0.10 0.46 -0.15 2.35 0.00 0.00 0.00 179.25 181.81 1u9b h TRP 16 N 0.76 -0.38 -0.87 0.00 2.91 -0.79 -0.57 115.95 117.01 1u9b h TRP 16 Ca 0.19 -0.01 0.16 0.00 1.13 0.00 0.00 58.89 60.36 1u9b h TRP 16 Cb 0.11 0.13 -0.10 0.00 -0.51 0.00 0.00 29.16 28.79 1u9b h TRP 16 CO 0.01 -0.12 0.45 0.00 -1.03 0.00 0.00 178.44 177.75 1u9b h ARG 17 N -0.59 0.61 -0.35 2.65 3.08 -1.17 0.31 114.38 118.92 1u9b h ARG 17 Ca -0.04 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 59.99 1u9b h ARG 17 Cb 0.43 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 1u9b h ARG 17 CO 0.07 0.40 0.19 -0.22 -1.07 0.00 0.00 179.97 179.34 1u9b h LYS 18 N 0.62 0.37 -1.92 0.04 3.64 -1.01 -3.44 116.57 114.88 1u9b h LYS 18 Ca 0.48 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.88 1u9b h LYS 18 Cb 0.71 -0.08 -0.22 0.00 -0.41 0.00 0.00 32.23 32.23 1u9b h LYS 18 CO -0.38 0.25 0.06 0.34 -2.27 0.00 0.00 179.45 177.44 1u9b s ASP 19 N -5.44 -0.91 0.22 4.20 2.15 0.10 -5.10 116.67 111.89 1u9b s ASP 19 Ca -0.13 1.42 -0.14 0.00 0.43 0.00 0.00 52.55 54.13 1u9b s ASP 19 Cb 0.11 1.47 0.01 0.00 -0.30 0.00 0.00 42.92 44.21 1u9b s ASP 19 CO 0.71 -0.22 0.47 -1.38 -0.17 0.00 0.00 175.17 174.58 1u9b s HIS 20 N 1.75 0.20 0.27 -5.34 -3.43 -1.22 -4.39 115.29 103.14 1u9b s HIS 20 Ca -0.09 -0.57 -0.29 0.00 -0.80 0.00 0.00 55.06 53.31 1u9b s HIS 20 Cb -0.06 0.23 -0.10 0.00 -1.43 0.00 0.00 32.58 31.23 1u9b s HIS 20 CO -0.19 -0.93 1.23 -2.14 -2.00 0.00 0.00 174.74 170.71 1u9b s PRO 21 N -3.96 4.47 0.21 -0.38 0.02 -1.26 -4.95 135.00 129.14 1u9b s PRO 21 Ca 0.17 2.02 -0.32 0.00 0.02 0.00 0.00 61.00 62.89 1u9b s PRO 21 Cb -0.00 -3.15 -0.13 0.00 0.02 0.00 0.00 34.50 31.24 1u9b s PRO 21 CO 0.04 -0.06 1.59 0.34 -0.33 0.00 0.00 177.00 178.58 1u9b n PHE 22 N 1.47 2.47 0.00 6.54 7.35 -1.26 -1.92 117.46 132.10 1u9b n PHE 22 Ca 0.01 0.23 0.00 0.00 -0.76 0.00 0.00 57.45 56.94 1u9b n PHE 22 Cb 0.43 -2.57 0.00 0.00 0.35 0.00 0.00 39.48 37.69 1u9b n PHE 22 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1u9b n GLY 23 N 3.16 3.16 3.80 7.13 0.00 -1.26 -4.96 105.19 116.23 1u9b n GLY 23 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 1u9b n GLY 23 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1u9b s PHE 24 N -2.04 3.31 -0.01 1.61 0.40 -0.81 -4.45 117.98 115.98 1u9b s PHE 24 Ca 0.00 1.64 0.04 0.00 -0.60 0.00 0.00 56.93 58.01 1u9b s PHE 24 Cb 0.00 -2.95 -0.01 0.00 0.51 0.00 0.00 43.02 40.57 1u9b s PHE 24 CO 0.00 -0.28 -0.14 0.08 0.70 0.00 0.00 175.22 175.57 1u9b s VAL 25 N -1.95 1.14 -0.28 -0.44 1.01 -0.63 -4.89 120.40 114.36 1u9b s VAL 25 Ca 0.60 -0.61 -0.01 0.00 0.00 0.00 0.00 61.98 61.96 1u9b s VAL 25 Cb -0.14 -0.95 0.17 0.00 0.00 0.00 0.00 36.38 35.45 1u9b s VAL 25 CO 0.19 0.32 0.50 0.00 0.00 0.00 0.00 175.10 176.11 1u9b s ALA 26 N -0.30 -1.74 -0.06 5.51 0.00 -1.26 -1.39 121.76 122.52 1u9b s ALA 26 Ca 0.05 1.36 -0.05 0.00 0.00 0.00 0.00 51.96 53.31 1u9b s ALA 26 Cb -0.06 -1.98 0.02 0.00 0.00 0.00 0.00 23.12 21.10 1u9b s ALA 26 CO -0.00 -1.34 0.16 0.54 0.00 0.00 0.00 175.76 175.11 1u9b s VAL 27 N 2.71 -0.01 0.66 0.00 0.11 -0.76 -4.99 120.40 118.13 1u9b s VAL 27 Ca 0.17 0.03 -0.16 0.00 -2.93 0.00 0.00 61.98 59.08 1u9b s VAL 27 Cb -0.15 -0.23 0.00 0.00 -1.53 0.00 0.00 36.38 34.47 1u9b s VAL 27 CO -0.19 0.01 1.16 -2.84 -3.33 0.00 0.00 175.10 169.90 1u9b s PRO 28 N 0.25 2.68 0.70 1.54 0.02 -1.26 -0.42 135.00 138.50 1u9b s PRO 28 Ca -0.01 1.59 -0.05 0.00 0.02 0.00 0.00 61.00 62.55 1u9b s PRO 28 Cb -0.03 -1.92 0.08 0.00 0.02 0.00 0.00 34.50 32.65 1u9b s PRO 28 CO -0.01 -1.38 0.99 0.95 -0.33 0.00 0.00 177.00 177.22 1u9b s THR 29 N -2.06 2.31 -0.11 0.99 -4.23 -0.05 -4.78 115.64 107.72 1u9b s THR 29 Ca 0.71 -0.38 -0.01 0.00 -1.18 0.00 0.00 61.69 60.83 1u9b s THR 29 Cb -0.25 -2.93 -0.03 0.00 1.34 0.00 0.00 72.50 70.63 1u9b s THR 29 CO 0.40 0.00 -0.05 -0.54 -0.54 0.00 0.00 174.62 173.89 1u9b s LYS 30 N -5.19 3.15 0.55 3.99 -0.14 -1.26 0.15 119.74 120.99 1u9b s LYS 30 Ca 0.62 -0.52 -0.18 0.00 -1.36 0.00 0.00 55.97 54.53 1u9b s LYS 30 Cb -0.09 -2.74 -0.06 0.00 -1.68 0.00 0.00 37.83 33.25 1u9b s LYS 30 CO 0.44 0.50 1.04 -0.80 -0.76 0.00 0.00 175.35 175.77 1u9b s ASN 31 N -0.35 6.06 0.47 2.83 0.01 0.77 -4.81 114.94 119.92 1u9b s ASN 31 Ca 0.06 1.84 0.38 0.00 -0.71 0.00 0.00 52.86 54.43 1u9b s ASN 31 Cb -0.12 -2.54 1.53 0.00 0.41 0.00 0.00 41.25 40.52 1u9b s ASN 31 CO 0.02 -0.97 1.50 -0.81 -1.51 0.00 0.00 177.10 175.33 1u9b n PRO 32 N -1.59 -0.02 -0.19 -0.60 -0.04 -1.26 0.46 135.00 131.76 1u9b n PRO 32 Ca 0.09 1.15 -0.03 0.00 -0.04 0.00 0.00 63.50 64.66 1u9b n PRO 32 Cb 0.53 -2.39 0.04 0.00 -0.04 0.00 0.00 33.50 31.63 1u9b n PRO 32 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1u9b n ASP 33 N -4.34 2.90 0.00 3.54 5.68 -1.26 -4.84 116.55 118.23 1u9b n ASP 33 Ca 0.40 -2.25 0.00 0.00 -0.50 0.00 0.00 54.79 52.45 1u9b n ASP 33 Cb 1.68 -0.55 0.00 0.00 -1.14 0.00 0.00 41.12 41.11 1u9b n ASP 33 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1u9b n GLY 34 N 0.21 0.36 3.90 6.12 0.00 0.17 -4.96 105.19 110.99 1u9b n GLY 34 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 1u9b n GLY 34 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1u9b s THR 35 N -1.72 4.16 -0.38 2.61 -4.23 -1.21 -4.76 115.64 110.13 1u9b s THR 35 Ca 0.00 0.33 -0.22 0.00 -1.18 0.00 0.00 61.69 60.62 1u9b s THR 35 Cb 0.00 -3.65 0.01 0.00 1.34 0.00 0.00 72.50 70.20 1u9b s THR 35 CO 0.00 -0.74 0.74 -0.32 -0.54 0.00 0.00 174.62 173.76 1u9b s MET 36 N -5.04 3.67 -0.88 3.99 -2.45 -1.26 0.27 119.30 117.60 1u9b s MET 36 Ca 0.53 0.16 -0.20 0.00 -1.25 0.00 0.00 55.69 54.94 1u9b s MET 36 Cb -0.11 -3.83 0.11 0.00 1.25 0.00 0.00 34.83 32.25 1u9b s MET 36 CO 0.48 -0.86 1.11 1.21 1.05 0.00 0.00 175.02 178.01 1u9b s ASN 37 N 1.87 6.52 0.00 1.11 2.47 0.39 -4.85 114.94 122.46 1u9b s ASN 37 Ca 0.29 -1.79 0.10 0.00 0.42 0.00 0.00 52.86 51.88 1u9b s ASN 37 Cb -0.13 -2.41 0.44 0.00 -1.45 0.00 0.00 41.25 37.70 1u9b s ASN 37 CO 0.17 -1.17 1.31 0.18 -3.72 0.00 0.00 177.10 173.88 1u9b n LEU 38 N 6.93 0.00 -0.60 3.21 4.77 -1.26 -2.75 117.00 127.31 1u9b n LEU 38 Ca 0.19 0.48 0.13 0.00 -0.03 0.00 0.00 56.01 56.77 1u9b n LEU 38 Cb 0.48 -0.48 0.36 0.00 -2.33 0.00 0.00 43.42 41.45 1u9b n LEU 38 CO 0.54 -0.31 0.75 0.23 -1.33 0.00 0.00 177.39 177.27 1u9b n MET 39 N -1.48 1.75 -3.57 3.23 2.81 -1.26 -4.76 117.12 113.85 1u9b n MET 39 Ca 0.03 -1.20 -0.25 0.00 -1.81 0.00 0.00 57.70 54.46 1u9b n MET 39 Cb 0.11 -1.48 -0.16 0.00 -0.71 0.00 0.00 33.22 30.99 1u9b n MET 39 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 1u9b s ASN 40 N -2.08 2.47 0.09 7.83 3.04 -1.11 -1.41 114.94 123.78 1u9b s ASN 40 Ca 0.33 -0.73 0.06 0.00 0.04 0.00 0.00 52.86 52.55 1u9b s ASN 40 Cb 0.20 -0.15 -0.04 0.00 -1.54 0.00 0.00 41.25 39.73 1u9b s ASN 40 CO 0.36 -0.37 -0.04 0.26 -3.04 0.00 0.00 177.10 174.27 1u9b s TRP 41 N 2.17 2.90 -0.23 0.43 0.52 0.40 -0.87 118.94 124.26 1u9b s TRP 41 Ca 0.05 -0.07 -0.06 0.00 0.02 0.00 0.00 56.10 56.04 1u9b s TRP 41 Cb -0.16 -1.50 -0.02 0.00 -1.15 0.00 0.00 33.47 30.64 1u9b s TRP 41 CO -0.17 0.46 0.03 -1.21 0.02 0.00 0.00 176.95 176.07 1u9b s GLU 42 N -2.26 3.57 0.29 4.98 2.02 0.43 -1.10 118.70 126.64 1u9b s GLU 42 Ca 0.24 -0.53 0.07 0.00 0.02 0.00 0.00 54.97 54.78 1u9b s GLU 42 Cb -0.11 -3.19 -0.06 0.00 0.10 0.00 0.00 34.13 30.86 1u9b s GLU 42 CO 0.17 -0.16 -0.07 0.00 0.02 0.00 0.00 175.26 175.21 1u9b s ALA 44 N -2.91 -0.49 -0.15 0.00 0.00 -0.48 -0.00 121.76 117.74 1u9b s ALA 44 Ca 0.30 0.86 -0.00 0.00 0.00 0.00 0.00 51.96 53.12 1u9b s ALA 44 Cb 0.03 -0.54 -0.01 0.00 0.00 0.00 0.00 23.12 22.60 1u9b s ALA 44 CO 0.13 -0.17 -0.14 0.42 0.00 0.00 0.00 175.76 176.00 1u9b s ILE 45 N 1.04 2.87 0.22 0.00 1.01 0.14 -1.60 121.20 124.88 1u9b s ILE 45 Ca -0.08 -0.71 -0.26 0.00 0.00 0.00 0.00 60.65 59.60 1u9b s ILE 45 Cb -0.09 -2.21 -0.09 0.00 0.01 0.00 0.00 42.46 40.08 1u9b s ILE 45 CO -0.06 0.51 0.86 -2.16 0.00 0.00 0.00 174.94 174.08 1u9b s PRO 46 N 0.65 4.64 0.51 2.79 0.04 -1.26 -0.36 135.00 142.01 1u9b s PRO 46 Ca -0.07 1.27 -0.23 0.00 0.04 0.00 0.00 61.00 62.01 1u9b s PRO 46 Cb -0.16 -3.16 -0.06 0.00 0.04 0.00 0.00 34.50 31.17 1u9b s PRO 46 CO 0.02 0.49 1.33 0.20 0.04 0.00 0.00 177.00 179.09 1u9b s GLY 47 N -1.29 2.88 0.40 0.56 0.00 0.19 -4.94 107.32 105.12 1u9b s GLY 47 Ca 0.41 1.28 -0.24 0.00 0.00 0.00 0.00 44.72 46.16 1u9b s GLY 47 CO 0.27 1.81 1.07 1.25 0.00 0.00 0.00 173.10 177.50 1u9b s LYS 48 N -2.76 4.15 0.10 2.90 2.20 -1.26 -4.30 119.74 120.77 1u9b s LYS 48 Ca 0.68 1.58 -0.31 0.00 -0.36 0.00 0.00 55.97 57.56 1u9b s LYS 48 Cb -0.39 -2.58 -0.08 0.00 -1.51 0.00 0.00 37.83 33.27 1u9b s LYS 48 CO 0.47 -0.17 1.51 0.15 -0.36 0.00 0.00 175.35 176.94 1u9b s LYS 49 N -2.43 4.25 0.00 4.03 1.02 -1.26 -2.32 119.74 123.03 1u9b s LYS 49 Ca 0.57 2.21 0.00 0.00 0.02 0.00 0.00 55.97 58.78 1u9b s LYS 49 Cb -0.24 -3.35 0.00 0.00 -0.52 0.00 0.00 37.83 33.72 1u9b s LYS 49 CO 0.30 -0.58 0.00 0.41 -0.92 0.00 0.00 175.35 174.56 1u9b n GLY 50 N 3.72 0.65 3.45 -3.33 0.00 -1.26 -5.00 105.19 103.42 1u9b n GLY 50 Ca 0.13 -0.55 -0.22 0.00 0.00 0.00 0.00 46.02 45.39 1u9b n GLY 50 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1u9b s THR 51 N -2.00 1.43 -0.61 2.61 -4.23 -1.13 -4.99 115.64 106.72 1u9b s THR 51 Ca 0.00 -2.05 0.16 0.00 -1.18 0.00 0.00 61.69 58.63 1u9b s THR 51 Cb 0.00 -2.65 0.16 0.00 1.34 0.00 0.00 72.50 71.35 1u9b s THR 51 CO 0.00 -0.14 1.50 -2.65 -0.54 0.00 0.00 174.62 172.80 1u9b n PRO 52 N -0.66 0.10 0.14 3.99 -0.02 -1.26 -1.62 135.00 135.67 1u9b n PRO 52 Ca -0.04 0.46 0.12 0.00 -2.02 0.00 0.00 63.50 62.02 1u9b n PRO 52 Cb 0.65 -1.75 0.06 0.00 -0.02 0.00 0.00 33.50 32.45 1u9b n PRO 52 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 1u9b h TRP 53 N 0.00 0.00 -1.10 6.00 4.06 -1.88 -3.35 115.95 119.68 1u9b h TRP 53 Ca 0.00 0.00 -0.76 0.00 2.06 0.00 0.00 58.89 60.19 1u9b h TRP 53 Cb 0.17 0.00 0.06 0.00 -1.00 0.00 0.00 29.16 28.38 1u9b h TRP 53 CO 0.00 0.00 0.06 -1.91 -3.56 0.00 0.00 178.44 173.03 1u9b n GLU 54 N -2.81 0.16 0.00 0.49 2.13 -0.64 -1.88 120.64 118.08 1u9b n GLU 54 Ca 0.01 0.06 0.00 0.00 0.66 0.00 0.00 57.16 57.89 1u9b n GLU 54 Cb 0.54 -1.53 0.00 0.00 0.27 0.00 0.00 31.44 30.72 1u9b n GLU 54 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1u9b n GLY 55 N 1.67 3.21 3.91 8.31 0.00 -1.26 -4.88 105.19 116.15 1u9b n GLY 55 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 1u9b n GLY 55 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1u9b s GLY 56 N -2.63 1.81 -0.32 -0.02 0.00 -0.79 -4.30 107.32 101.07 1u9b s GLY 56 Ca 0.00 -0.63 0.03 0.00 0.00 0.00 0.00 44.72 44.12 1u9b s GLY 56 CO 0.00 -0.53 0.04 -2.27 0.00 0.00 0.00 173.10 170.33 1u9b s LEU 57 N -3.57 3.99 -0.32 0.66 2.96 0.27 -0.63 118.68 122.04 1u9b s LEU 57 Ca 0.43 -1.91 -0.18 0.00 -0.22 0.00 0.00 54.13 52.25 1u9b s LEU 57 Cb -0.11 -1.44 -0.01 0.00 0.50 0.00 0.00 46.19 45.13 1u9b s LEU 57 CO 0.30 -0.36 0.51 -0.36 -1.32 0.00 0.00 176.35 175.12 1u9b s PHE 58 N 1.09 3.20 0.09 5.38 0.08 0.52 -4.83 117.98 123.52 1u9b s PHE 58 Ca 0.08 0.31 -0.29 0.00 0.12 0.00 0.00 56.93 57.15 1u9b s PHE 58 Cb -0.19 -2.86 -0.06 0.00 -0.57 0.00 0.00 43.02 39.35 1u9b s PHE 58 CO -0.11 -0.46 0.91 0.21 -0.10 0.00 0.00 175.22 175.67 1u9b s LYS 59 N 2.36 4.64 0.01 0.44 2.20 -1.26 -0.68 119.74 127.44 1u9b s LYS 59 Ca 0.19 1.34 0.01 0.00 -0.36 0.00 0.00 55.97 57.15 1u9b s LYS 59 Cb -0.15 -3.38 -0.01 0.00 -1.51 0.00 0.00 37.83 32.78 1u9b s LYS 59 CO 0.12 0.22 -0.04 -1.17 -0.36 0.00 0.00 175.35 174.12 1u9b s LEU 60 N 0.03 2.07 -0.14 5.43 0.20 0.99 -1.78 118.68 125.47 1u9b s LEU 60 Ca 0.45 -0.17 -0.05 0.00 0.69 0.00 0.00 54.13 55.04 1u9b s LEU 60 Cb -0.22 -0.15 -0.04 0.00 -0.43 0.00 0.00 46.19 45.35 1u9b s LEU 60 CO 0.28 -0.03 0.04 -0.60 -0.29 0.00 0.00 176.35 175.75 1u9b s ARG 61 N -0.43 3.57 -0.22 1.98 3.52 0.86 0.29 118.95 128.52 1u9b s ARG 61 Ca -0.02 -0.36 -0.04 0.00 -0.13 0.00 0.00 55.73 55.18 1u9b s ARG 61 Cb -0.03 -3.04 -0.00 0.00 -1.56 0.00 0.00 34.95 30.31 1u9b s ARG 61 CO -0.00 0.46 -0.05 -1.64 -0.81 0.00 0.00 175.30 173.26 1u9b s MET 62 N -0.17 3.32 -0.17 5.12 -1.94 -0.26 -0.86 119.30 124.34 1u9b s MET 62 Ca 0.06 -0.66 0.00 0.00 -1.71 0.00 0.00 55.69 53.38 1u9b s MET 62 Cb -0.12 -3.00 0.01 0.00 2.01 0.00 0.00 34.83 33.73 1u9b s MET 62 CO 0.02 -0.22 -0.17 -0.51 -0.01 0.00 0.00 175.02 174.12 1u9b s LEU 63 N 1.46 2.30 0.03 -0.03 1.43 -0.36 -0.45 118.68 123.06 1u9b s LEU 63 Ca 0.05 -0.57 -0.01 0.00 -1.03 0.00 0.00 54.13 52.57 1u9b s LEU 63 Cb -0.14 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 1u9b s LEU 63 CO -0.04 0.03 0.20 -0.36 0.23 0.00 0.00 176.35 176.41 1u9b s PHE 64 N 1.15 3.53 0.32 0.29 0.40 -0.50 -1.02 117.98 122.14 1u9b s PHE 64 Ca 0.01 0.29 0.04 0.00 -0.60 0.00 0.00 56.93 56.67 1u9b s PHE 64 Cb -0.14 -1.79 -0.02 0.00 0.51 0.00 0.00 43.02 41.58 1u9b s PHE 64 CO -0.07 0.61 0.48 0.15 0.70 0.00 0.00 175.22 177.09 1u9b s LYS 65 N -2.27 3.31 0.43 0.44 1.02 -1.26 -4.90 119.74 116.51 1u9b s LYS 65 Ca 0.32 -0.68 0.16 0.00 0.02 0.00 0.00 55.97 55.78 1u9b s LYS 65 Cb -0.13 -2.77 1.06 0.00 -0.52 0.00 0.00 37.83 35.48 1u9b s LYS 65 CO 0.24 0.17 1.92 -0.44 -0.92 0.00 0.00 175.35 176.31 1u9b h ASP 66 N 0.89 0.38 0.09 2.83 3.32 -1.97 0.08 116.42 122.03 1u9b h ASP 66 Ca -0.49 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1u9b h ASP 66 Cb 1.24 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1u9b h ASP 66 CO 0.58 0.19 -0.05 -0.90 -1.72 0.00 0.00 179.24 177.35 1u9b n ASP 67 N -4.48 0.92 -4.63 6.45 5.75 -1.26 -4.44 116.55 114.86 1u9b n ASP 67 Ca 0.15 -1.14 -0.45 0.00 -0.01 0.00 0.00 54.79 53.34 1u9b n ASP 67 Cb 0.54 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.62 1u9b n ASP 67 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1u9b n TYR 68 N -0.39 1.69 0.08 2.11 9.36 0.01 -0.40 117.16 129.62 1u9b n TYR 68 Ca 0.18 0.61 0.06 0.00 3.32 0.00 0.00 57.90 62.08 1u9b n TYR 68 Cb 0.29 -2.33 0.24 0.00 -0.63 0.00 0.00 39.34 36.91 1u9b n TYR 68 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1u9b n PRO 69 N 1.07 2.90 -0.23 2.98 -0.04 -1.26 -3.38 135.00 137.03 1u9b n PRO 69 Ca 0.09 -1.92 -0.06 0.00 -0.04 0.00 0.00 63.50 61.58 1u9b n PRO 69 Cb 0.32 -1.71 0.04 0.00 -0.04 0.00 0.00 33.50 32.11 1u9b n PRO 69 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1u9b h SER 70 N 2.72 0.77 -3.04 3.54 0.87 -1.10 -3.37 113.55 113.95 1u9b h SER 70 Ca 0.00 -0.05 -0.62 0.00 -1.23 0.00 0.00 61.79 59.89 1u9b h SER 70 Cb 1.09 -0.19 -0.09 0.00 -0.44 0.00 0.00 62.40 62.77 1u9b h SER 70 CO 0.17 0.60 -0.60 -0.94 -0.53 0.00 0.00 176.83 175.54 1u9b s SER 71 N -5.87 5.47 0.67 6.23 1.04 -1.25 -4.83 113.70 115.16 1u9b s SER 71 Ca -0.13 -0.07 -0.10 0.00 0.48 0.00 0.00 55.95 56.13 1u9b s SER 71 Cb 0.14 -1.44 0.00 0.00 0.10 0.00 0.00 66.02 64.82 1u9b s SER 71 CO 0.77 0.14 1.04 -2.16 0.98 0.00 0.00 173.24 174.01 1u9b s PRO 72 N -2.62 3.00 0.69 4.02 0.04 -1.26 -4.46 135.00 134.42 1u9b s PRO 72 Ca 0.29 0.42 -0.11 0.00 0.04 0.00 0.00 61.00 61.64 1u9b s PRO 72 Cb -0.11 -2.08 0.01 0.00 0.04 0.00 0.00 34.50 32.35 1u9b s PRO 72 CO 0.22 -0.88 1.07 -1.25 0.04 0.00 0.00 177.00 176.20 1u9b s PRO 73 N -5.25 2.96 -0.18 0.56 0.04 -1.26 -4.77 135.00 127.09 1u9b s PRO 73 Ca 0.57 0.66 -0.18 0.00 0.04 0.00 0.00 61.00 62.08 1u9b s PRO 73 Cb -0.11 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 1u9b s PRO 73 CO 0.51 -1.01 0.51 0.21 0.04 0.00 0.00 177.00 177.26 1u9b s LYS 74 N -5.22 4.22 -0.18 4.56 2.20 -0.18 -4.90 119.74 120.23 1u9b s LYS 74 Ca 0.58 0.42 -0.04 0.00 -0.36 0.00 0.00 55.97 56.57 1u9b s LYS 74 Cb -0.12 -3.54 -0.02 0.00 -1.51 0.00 0.00 37.83 32.64 1u9b s LYS 74 CO 0.53 -0.09 -0.04 0.00 -0.36 0.00 0.00 175.35 175.39 1u9b s LYS 76 N 0.76 0.18 0.17 0.00 2.20 -0.04 -1.39 119.74 121.62 1u9b s LYS 76 Ca -0.02 0.26 -0.30 0.00 -0.36 0.00 0.00 55.97 55.55 1u9b s LYS 76 Cb -0.15 -0.65 -0.08 0.00 -1.51 0.00 0.00 37.83 35.44 1u9b s LYS 76 CO 0.02 -0.30 1.32 -0.06 -0.36 0.00 0.00 175.35 175.97 1u9b s PHE 77 N 1.99 3.27 -0.22 4.03 0.08 0.50 -0.10 117.98 127.53 1u9b s PHE 77 Ca 0.03 1.16 -0.01 0.00 0.12 0.00 0.00 56.93 58.24 1u9b s PHE 77 Cb -0.12 -3.61 0.06 0.00 -0.57 0.00 0.00 43.02 38.78 1u9b s PHE 77 CO -0.04 -1.96 -0.00 -1.21 -0.10 0.00 0.00 175.22 171.91 1u9b s GLU 78 N 0.25 1.12 0.95 0.44 2.02 -0.73 -2.93 118.70 119.81 1u9b s GLU 78 Ca 0.59 -0.74 -0.15 0.00 0.02 0.00 0.00 54.97 54.68 1u9b s GLU 78 Cb -0.36 -2.34 0.18 0.00 0.10 0.00 0.00 34.13 31.70 1u9b s GLU 78 CO 0.36 -0.65 1.24 -1.25 0.02 0.00 0.00 175.26 174.98 1u9b s PRO 79 N 1.62 0.77 0.38 0.39 0.04 -1.26 -4.48 135.00 132.45 1u9b s PRO 79 Ca -0.03 -0.15 -0.27 0.00 0.04 0.00 0.00 61.00 60.59 1u9b s PRO 79 Cb -0.18 -1.84 -0.10 0.00 0.04 0.00 0.00 34.50 32.43 1u9b s PRO 79 CO -0.08 -2.37 1.35 -2.14 0.04 0.00 0.00 177.00 173.80 1u9b s PRO 80 N -5.68 4.10 0.18 0.56 0.02 -1.15 -4.95 135.00 128.08 1u9b s PRO 80 Ca 0.70 2.27 -0.00 0.00 0.02 0.00 0.00 61.00 63.98 1u9b s PRO 80 Cb -0.08 -2.89 -0.04 0.00 0.02 0.00 0.00 34.50 31.52 1u9b s PRO 80 CO 0.53 -0.43 0.36 -0.51 -0.33 0.00 0.00 177.00 176.62 1u9b s LEU 81 N -2.19 4.26 -0.35 -5.54 1.43 -1.26 -5.00 118.68 110.03 1u9b s LEU 81 Ca 0.54 0.35 -0.28 0.00 -1.03 0.00 0.00 54.13 53.71 1u9b s LEU 81 Cb -0.41 -3.11 0.02 0.00 0.03 0.00 0.00 46.19 42.72 1u9b s LEU 81 CO 0.53 -0.01 1.01 0.12 0.23 0.00 0.00 176.35 178.23 1u9b s PHE 82 N -1.82 3.10 -0.27 0.29 2.19 -1.26 -4.81 117.98 115.40 1u9b s PHE 82 Ca 0.38 0.99 -0.26 0.00 0.33 0.00 0.00 56.93 58.36 1u9b s PHE 82 Cb -0.11 -3.71 0.16 0.00 -1.31 0.00 0.00 43.02 38.05 1u9b s PHE 82 CO 0.29 -0.82 1.23 -1.58 1.83 0.00 0.00 175.22 176.17 1u9b s HIS 83 N 3.61 -0.24 0.58 10.12 2.46 -1.26 -4.96 115.29 125.60 1u9b s HIS 83 Ca 0.42 0.54 0.28 0.00 0.47 0.00 0.00 55.06 56.78 1u9b s HIS 83 Cb -0.12 0.44 1.76 0.00 -0.13 0.00 0.00 32.58 34.53 1u9b s HIS 83 CO 0.18 -0.14 2.23 -1.35 -2.47 0.00 0.00 174.74 173.18 1u9b h PRO 84 N 3.26 0.00 -0.34 2.88 0.11 -1.89 -2.88 132.00 133.13 1u9b h PRO 84 Ca -0.24 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.85 1u9b h PRO 84 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1u9b h PRO 84 CO 0.18 0.00 0.01 0.09 -0.21 0.00 0.00 178.00 178.07 1u9b n ASN 85 N -3.91 4.15 -4.12 -2.05 5.03 -1.26 -0.27 115.26 112.84 1u9b n ASN 85 Ca -0.02 -3.06 -0.33 0.00 0.87 0.00 0.00 54.58 52.03 1u9b n ASN 85 Cb 0.11 -0.58 -0.16 0.00 -1.02 0.00 0.00 39.78 38.13 1u9b n ASN 85 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1u9b s VAL 86 N -2.86 2.17 0.93 2.41 1.01 -1.09 -0.85 120.40 122.12 1u9b s VAL 86 Ca 0.45 -1.12 -0.10 0.00 0.00 0.00 0.00 61.98 61.20 1u9b s VAL 86 Cb 0.36 -2.03 0.15 0.00 0.00 0.00 0.00 36.38 34.87 1u9b s VAL 86 CO 0.10 0.36 1.12 -0.31 0.00 0.00 0.00 175.10 176.37 1u9b s TYR 87 N 1.25 1.71 0.61 5.22 2.02 0.13 -4.32 117.35 123.96 1u9b s TYR 87 Ca 0.01 1.67 0.32 0.00 -0.37 0.00 0.00 57.07 58.70 1u9b s TYR 87 Cb -0.15 -3.27 1.85 0.00 -0.40 0.00 0.00 41.96 39.98 1u9b s TYR 87 CO -0.10 -2.83 2.20 -1.35 -1.57 0.00 0.00 175.55 171.90 1u9b h PRO 88 N -1.88 0.00 0.00 -1.71 0.11 -1.89 0.27 132.00 126.90 1u9b h PRO 88 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1u9b h PRO 88 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1u9b h PRO 88 CO 0.44 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.89 1u9b h SER 89 N 0.00 0.00 0.00 -2.05 4.64 -1.97 -3.46 113.55 110.72 1u9b h SER 89 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1u9b h SER 89 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1u9b h SER 89 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1u9b n GLY 90 N 0.21 0.26 3.75 -0.77 0.00 0.95 -4.76 105.19 104.83 1u9b n GLY 90 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1u9b n GLY 90 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1u9b s THR 91 N -2.00 2.86 -0.04 2.61 2.01 -1.25 -0.37 115.64 119.47 1u9b s THR 91 Ca 0.00 0.75 -0.25 0.00 0.31 0.00 0.00 61.69 62.51 1u9b s THR 91 Cb 0.00 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.99 1u9b s THR 91 CO 0.00 0.13 0.75 -0.69 -0.69 0.00 0.00 174.62 174.13 1u9b s VAL 92 N -0.26 4.97 -0.48 3.82 1.01 -0.49 -0.70 120.40 128.28 1u9b s VAL 92 Ca 0.56 1.57 -0.16 0.00 0.00 0.00 0.00 61.98 63.94 1u9b s VAL 92 Cb -0.39 -4.09 0.07 0.00 0.00 0.00 0.00 36.38 31.96 1u9b s VAL 92 CO 0.44 0.25 0.43 0.00 0.00 0.00 0.00 175.10 176.23 1u9b s LEU 94 N 1.80 0.13 0.31 0.00 2.96 -1.26 -4.88 118.68 117.75 1u9b s LEU 94 Ca 0.06 0.73 0.07 0.00 -0.22 0.00 0.00 54.13 54.77 1u9b s LEU 94 Cb -0.23 1.08 0.78 0.00 0.50 0.00 0.00 46.19 48.31 1u9b s LEU 94 CO 0.08 -0.18 1.78 0.77 -1.32 0.00 0.00 176.35 177.48 1u9b h SER 95 N 7.15 0.75 0.51 3.68 4.64 -1.95 0.30 113.55 128.63 1u9b h SER 95 Ca -0.38 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1u9b h SER 95 Cb 1.17 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1u9b h SER 95 CO 0.33 0.27 0.00 0.16 -0.87 0.00 0.00 176.83 176.72 1u9b h ILE 96 N 0.73 0.00 -0.47 0.95 3.07 -1.96 -2.13 117.51 117.69 1u9b h ILE 96 Ca 0.57 -0.19 0.00 0.00 1.55 0.00 0.00 64.86 66.79 1u9b h ILE 96 Cb 0.93 0.90 0.00 0.00 -0.27 0.00 0.00 36.82 38.39 1u9b h ILE 96 CO -0.36 0.00 0.00 0.18 -1.05 0.00 0.00 178.15 176.92 1u9b n LEU 97 N -2.42 2.81 -4.14 0.16 4.77 0.11 -3.41 117.00 114.88 1u9b n LEU 97 Ca 0.01 -1.41 -0.32 0.00 -0.03 0.00 0.00 56.01 54.26 1u9b n LEU 97 Cb 0.17 -0.37 -0.17 0.00 -2.33 0.00 0.00 43.42 40.73 1u9b n LEU 97 CO 0.18 0.63 -0.53 -1.61 -1.33 0.00 0.00 177.39 174.72 1u9b s GLU 98 N -1.46 2.86 0.20 3.23 2.02 -0.89 -4.76 118.70 119.90 1u9b s GLU 98 Ca 0.33 -0.80 -0.10 0.00 0.02 0.00 0.00 54.97 54.42 1u9b s GLU 98 Cb 0.18 -2.34 0.25 0.00 0.10 0.00 0.00 34.13 32.33 1u9b s GLU 98 CO 0.20 -0.04 1.75 1.49 0.02 0.00 0.00 175.26 178.69 1u9b h GLU 99 N 7.39 0.40 0.00 1.61 4.81 -1.87 -0.31 114.58 126.61 1u9b h GLU 99 Ca -0.33 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 1u9b h GLU 99 Cb 1.18 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.47 1u9b h GLU 99 CO 0.55 0.27 0.00 -0.25 -0.73 0.00 0.00 179.01 178.84 1u9b n ASP 100 N -4.98 0.00 0.00 1.04 8.00 -1.26 -4.47 116.55 114.88 1u9b n ASP 100 Ca 0.08 -0.60 0.00 0.00 0.71 0.00 0.00 54.79 54.98 1u9b n ASP 100 Cb 0.25 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.27 1u9b n ASP 100 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1u9b n LYS 101 N -1.07 0.00 -0.10 -1.24 5.02 -0.18 -4.99 118.16 115.60 1u9b n LYS 101 Ca 0.17 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.57 1u9b n LYS 101 Cb 0.11 0.00 0.15 0.00 -0.02 0.00 0.00 35.03 35.27 1u9b n LYS 101 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1u9b n ASP 102 N 0.00 3.12 -4.76 4.39 8.00 -0.86 -4.97 116.55 121.47 1u9b n ASP 102 Ca 0.00 -1.94 -0.41 0.00 0.71 0.00 0.00 54.79 53.15 1u9b n ASP 102 Cb 0.00 -0.13 -0.02 0.00 -0.02 0.00 0.00 41.12 40.96 1u9b n ASP 102 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 1u9b s TRP 103 N -1.61 2.91 -0.02 1.24 -0.11 -0.91 -4.68 118.94 115.76 1u9b s TRP 103 Ca 0.31 1.15 0.02 0.00 1.22 0.00 0.00 56.10 58.80 1u9b s TRP 103 Cb 0.20 -3.85 0.01 0.00 -1.50 0.00 0.00 33.47 28.33 1u9b s TRP 103 CO 0.29 -2.58 -0.07 1.03 -4.62 0.00 0.00 176.95 171.00 1u9b s ARG 104 N -1.19 0.73 0.57 5.86 0.52 -1.26 -4.90 118.95 119.28 1u9b s ARG 104 Ca 0.55 -0.22 0.28 0.00 -0.52 0.00 0.00 55.73 55.82 1u9b s ARG 104 Cb -0.43 -0.71 1.49 0.00 0.52 0.00 0.00 34.95 35.83 1u9b s ARG 104 CO 0.51 0.07 1.98 -1.35 0.02 0.00 0.00 175.30 176.53 1u9b h PRO 105 N 6.43 0.00 0.00 3.54 0.11 -1.88 -0.99 132.00 139.22 1u9b h PRO 105 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1u9b h PRO 105 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1u9b h PRO 105 CO 0.49 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.28 1u9b h ALA 106 N 1.64 1.00 -2.68 -0.75 0.00 -1.96 -3.45 119.26 113.05 1u9b h ALA 106 Ca 0.20 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.59 1u9b h ALA 106 Cb 0.96 0.00 0.06 0.00 0.00 0.00 0.00 17.79 18.82 1u9b h ALA 106 CO -0.00 0.00 0.94 0.42 0.00 0.00 0.00 179.25 180.61 1u9b s ILE 107 N -3.22 2.20 0.49 0.00 1.01 -0.38 -4.98 121.20 116.32 1u9b s ILE 107 Ca 0.07 0.15 0.03 0.00 0.00 0.00 0.00 60.65 60.90 1u9b s ILE 107 Cb 0.11 -3.10 0.02 0.00 0.01 0.00 0.00 42.46 39.50 1u9b s ILE 107 CO 0.52 0.02 0.69 0.42 0.00 0.00 0.00 174.94 176.59 1u9b s THR 108 N 0.85 3.10 0.27 2.92 -4.23 -1.26 -4.96 115.64 112.32 1u9b s THR 108 Ca 0.70 -0.72 -0.05 0.00 -1.18 0.00 0.00 61.69 60.45 1u9b s THR 108 Cb -0.48 -3.13 0.25 0.00 1.34 0.00 0.00 72.50 70.49 1u9b s THR 108 CO 0.36 -0.08 1.93 0.40 -0.54 0.00 0.00 174.62 176.70 1u9b h ILE 109 N 0.30 1.24 -0.45 2.99 2.04 -1.94 -1.12 117.51 120.57 1u9b h ILE 109 Ca -0.43 -0.46 0.01 0.00 1.00 0.00 0.00 64.86 64.98 1u9b h ILE 109 Cb 1.28 -0.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 1u9b h ILE 109 CO 0.52 0.24 0.28 0.50 0.00 0.00 0.00 178.15 179.69 1u9b h LYS 110 N 1.26 0.56 -0.70 2.37 3.64 -1.96 -0.48 116.57 121.25 1u9b h LYS 110 Ca 0.34 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.67 1u9b h LYS 110 Cb -0.12 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.54 1u9b h LYS 110 CO -0.07 0.37 0.37 1.96 -2.27 0.00 0.00 179.45 179.81 1u9b h GLN 111 N 0.58 0.99 -0.02 1.90 4.20 -1.84 0.89 115.11 121.81 1u9b h GLN 111 Ca 0.17 -0.13 0.01 0.00 0.06 0.00 0.00 58.65 58.77 1u9b h GLN 111 Cb -0.03 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.54 1u9b h GLN 111 CO -0.06 0.75 -0.05 0.82 -0.67 0.00 0.00 178.83 179.63 1u9b h ILE 112 N 0.97 0.87 -0.71 2.54 2.04 -0.54 0.12 117.51 122.81 1u9b h ILE 112 Ca 0.25 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.10 1u9b h ILE 112 Cb 0.06 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 1u9b h ILE 112 CO -0.04 0.00 0.41 -0.07 0.00 0.00 0.00 178.15 178.46 1u9b h LEU 113 N -0.07 0.86 -0.92 1.44 3.38 -0.72 -0.31 115.31 118.97 1u9b h LEU 113 Ca 0.03 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1u9b h LEU 113 Cb 0.11 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1u9b h LEU 113 CO -0.07 0.68 -0.07 -0.07 0.09 0.00 0.00 178.44 179.01 1u9b h LEU 114 N 0.97 0.70 -0.39 1.67 3.38 -0.61 -1.12 115.31 119.90 1u9b h LEU 114 Ca 0.25 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1u9b h LEU 114 Cb -0.01 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1u9b h LEU 114 CO -0.05 0.81 0.16 1.23 0.09 0.00 0.00 178.44 180.69 1u9b h GLY 115 N 0.96 0.63 0.89 0.83 0.00 0.08 -0.36 103.07 106.11 1u9b h GLY 115 Ca 0.12 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1u9b h GLY 115 CO 0.03 0.32 -0.06 -2.22 0.00 0.00 0.00 176.54 174.61 1u9b h ILE 116 N 0.49 0.94 -0.46 2.60 2.04 -0.83 -0.74 117.51 121.55 1u9b h ILE 116 Ca 0.13 -0.24 0.09 0.00 1.00 0.00 0.00 64.86 65.84 1u9b h ILE 116 Cb 0.18 1.10 -0.09 0.00 -0.74 0.00 0.00 36.82 37.28 1u9b h ILE 116 CO -0.01 0.06 -0.10 -0.61 0.00 0.00 0.00 178.15 177.49 1u9b h GLN 117 N -0.28 0.01 -0.95 2.37 4.15 -1.07 0.19 115.11 119.54 1u9b h GLN 117 Ca -0.02 -0.00 0.09 0.00 0.77 0.00 0.00 58.65 59.49 1u9b h GLN 117 Cb 0.22 -0.00 -0.07 0.00 0.21 0.00 0.00 27.48 27.84 1u9b h GLN 117 CO 0.03 0.01 0.59 1.49 -1.93 0.00 0.00 178.83 179.02 1u9b h GLU 118 N 0.01 0.99 -0.25 1.69 4.81 -0.83 -0.53 114.58 120.47 1u9b h GLU 118 Ca 0.22 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.40 1u9b h GLU 118 Cb 0.34 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1u9b h GLU 118 CO -0.46 0.66 0.17 1.25 -0.73 0.00 0.00 179.01 179.89 1u9b h LEU 119 N 1.02 0.26 -0.43 1.64 5.85 0.89 -3.01 115.31 121.53 1u9b h LEU 119 Ca 0.44 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 59.24 1u9b h LEU 119 Cb 0.29 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 41.17 1u9b h LEU 119 CO -0.21 0.19 -0.16 -0.07 -0.34 0.00 0.00 178.44 177.85 1u9b h LEU 120 N 0.31 -0.55 -2.31 2.25 3.38 -0.23 -2.41 115.31 115.75 1u9b h LEU 120 Ca 0.10 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1u9b h LEU 120 Cb 0.01 0.32 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1u9b h LEU 120 CO -0.02 -0.19 0.00 -3.20 0.09 0.00 0.00 178.44 175.12 1u9b n ASN 121 N -5.36 3.43 -3.26 -0.43 4.05 -1.16 -4.53 115.26 107.99 1u9b n ASN 121 Ca 0.03 -1.98 -0.25 0.00 0.45 0.00 0.00 54.58 52.83 1u9b n ASN 121 Cb 0.27 -0.30 -0.07 0.00 1.23 0.00 0.00 39.78 40.90 1u9b n ASN 121 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1u9b n GLU 122 N 1.44 1.20 -1.27 1.20 1.02 -0.91 -5.11 120.64 118.20 1u9b n GLU 122 Ca 0.20 -3.62 -0.34 0.00 -0.02 0.00 0.00 57.16 53.38 1u9b n GLU 122 Cb 0.59 -1.51 0.11 0.00 -0.02 0.00 0.00 31.44 30.60 1u9b n GLU 122 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1u9b n PRO 123 N 1.30 0.43 -3.48 3.49 -0.02 -1.22 -4.69 135.00 130.82 1u9b n PRO 123 Ca 0.24 0.22 -0.43 0.00 -2.02 0.00 0.00 63.50 61.51 1u9b n PRO 123 Cb 0.49 -2.46 -0.06 0.00 -0.02 0.00 0.00 33.50 31.46 1u9b n PRO 123 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1u9b s ASN 124 N -1.92 6.09 0.61 2.55 2.47 -1.26 -4.92 114.94 118.56 1u9b s ASN 124 Ca 0.76 -2.52 0.40 0.00 0.42 0.00 0.00 52.86 51.93 1u9b s ASN 124 Cb -0.32 -2.07 2.20 0.00 -1.45 0.00 0.00 41.25 39.62 1u9b s ASN 124 CO 0.48 -0.56 2.24 -0.29 -3.72 0.00 0.00 177.10 175.25 1u9b h ILE 125 N 5.27 0.00 0.00 -5.21 2.10 -1.97 0.78 117.51 118.48 1u9b h ILE 125 Ca -0.02 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.92 1u9b h ILE 125 Cb 1.03 0.90 0.00 0.00 -1.09 0.00 0.00 36.82 37.66 1u9b h ILE 125 CO 0.79 0.00 -0.08 1.56 -1.08 0.00 0.00 178.15 179.34 1u9b h GLN 126 N 0.00 0.00 -2.07 2.19 1.08 -2.01 -3.38 115.11 110.92 1u9b h GLN 126 Ca 0.00 0.00 -0.57 0.00 -1.45 0.00 0.00 58.65 56.63 1u9b h GLN 126 Cb 0.03 0.00 -0.40 0.00 -0.05 0.00 0.00 27.48 27.05 1u9b h GLN 126 CO 0.00 0.00 -0.93 -0.25 -0.95 0.00 0.00 178.83 176.70 1u9b n ASP 127 N -2.29 1.57 -4.73 1.46 8.00 0.27 -5.09 116.55 115.74 1u9b n ASP 127 Ca 0.05 -3.01 -0.42 0.00 0.71 0.00 0.00 54.79 52.13 1u9b n ASP 127 Cb 0.44 -0.64 -0.03 0.00 -0.02 0.00 0.00 41.12 40.87 1u9b n ASP 127 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1u9b s PRO 128 N -1.82 4.30 -0.02 -0.24 0.04 -1.26 -4.69 135.00 131.31 1u9b s PRO 128 Ca 0.38 2.22 0.16 0.00 0.04 0.00 0.00 61.00 63.79 1u9b s PRO 128 Cb 0.19 -3.16 -0.24 0.00 0.04 0.00 0.00 34.50 31.33 1u9b s PRO 128 CO -0.08 -0.42 0.37 0.00 0.04 0.00 0.00 177.00 176.91 1u9b n ALA 129 N 2.96 2.69 -3.02 8.56 0.00 0.63 -4.99 120.51 127.35 1u9b n ALA 129 Ca 0.09 -0.38 -0.12 0.00 0.00 0.00 0.00 53.44 53.03 1u9b n ALA 129 Cb 0.41 -0.54 -0.13 0.00 0.00 0.00 0.00 19.45 19.19 1u9b n ALA 129 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1u9b s GLN 130 N -3.03 0.14 0.04 0.00 -2.07 -1.18 -4.40 119.66 109.16 1u9b s GLN 130 Ca -0.05 0.17 -0.27 0.00 -1.82 0.00 0.00 55.36 53.40 1u9b s GLN 130 Cb 0.10 0.06 -0.17 0.00 -1.09 0.00 0.00 33.01 31.91 1u9b s GLN 130 CO 0.65 -0.02 1.46 0.00 -1.32 0.00 0.00 175.29 176.06 1u9b h ALA 131 N 6.01 -0.45 0.06 2.60 0.00 -1.94 -3.01 119.26 122.54 1u9b h ALA 131 Ca -0.26 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1u9b h ALA 131 Cb 1.20 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1u9b h ALA 131 CO 0.43 -0.67 -0.21 1.49 0.00 0.00 0.00 179.25 180.30 1u9b h GLU 132 N -0.62 -0.29 -0.68 0.00 4.81 -1.97 -1.51 114.58 114.31 1u9b h GLU 132 Ca -0.05 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.22 1u9b h GLU 132 Cb 0.45 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.86 1u9b h GLU 132 CO 0.08 -0.20 0.45 0.00 -0.73 0.00 0.00 179.01 178.61 1u9b h ALA 133 N -1.19 1.56 -0.51 2.92 0.00 -1.86 -2.28 119.26 117.90 1u9b h ALA 133 Ca -0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1u9b h ALA 133 Cb 0.30 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1u9b h ALA 133 CO -0.10 0.39 0.04 -0.92 0.00 0.00 0.00 179.25 178.66 1u9b h TYR 134 N 0.87 0.94 0.41 0.00 3.20 -1.43 -1.52 116.97 119.45 1u9b h TYR 134 Ca 0.26 -0.15 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 1u9b h TYR 134 Cb -0.03 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 37.99 1u9b h TYR 134 CO -0.00 0.86 -0.20 1.15 -1.64 0.00 0.00 178.16 178.34 1u9b h THR 135 N 0.75 0.59 -0.94 1.81 2.02 -0.92 -1.80 112.91 114.42 1u9b h THR 135 Ca 0.15 -0.26 0.08 0.00 0.77 0.00 0.00 66.41 67.15 1u9b h THR 135 Cb 0.46 0.72 -0.07 0.00 -1.74 0.00 0.00 68.15 67.52 1u9b h THR 135 CO 0.02 0.05 0.59 0.40 0.37 0.00 0.00 175.52 176.95 1u9b h ILE 136 N -0.70 1.01 -0.60 3.11 2.04 -1.45 0.45 117.51 121.37 1u9b h ILE 136 Ca -0.06 -0.35 0.02 0.00 1.00 0.00 0.00 64.86 65.47 1u9b h ILE 136 Cb 0.50 -0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 36.44 1u9b h ILE 136 CO 0.09 0.19 0.38 0.22 0.00 0.00 0.00 178.15 179.03 1u9b h TYR 137 N 1.03 0.72 -0.00 1.37 3.20 -1.12 0.24 116.97 122.40 1u9b h TYR 137 Ca 0.43 0.02 -0.20 0.00 3.14 0.00 0.00 58.73 62.12 1u9b h TYR 137 Cb 0.28 -0.24 0.02 0.00 1.54 0.00 0.00 36.73 38.33 1u9b h TYR 137 CO -0.02 0.43 -0.79 0.00 -1.64 0.00 0.00 178.16 176.14 1u9b h GLN 139 N 0.11 0.30 -1.71 0.00 1.08 -0.05 -3.44 115.11 111.40 1u9b h GLN 139 Ca -0.10 -0.52 -0.40 0.00 -1.45 0.00 0.00 58.65 56.18 1u9b h GLN 139 Cb 1.48 0.19 -0.29 0.00 -0.05 0.00 0.00 27.48 28.81 1u9b h GLN 139 CO 0.16 1.19 -0.78 -1.71 -0.95 0.00 0.00 178.83 176.74 1u9b n ASN 140 N -3.51 -1.71 -0.22 1.46 2.85 0.83 -5.01 115.26 109.95 1u9b n ASN 140 Ca -0.17 -2.64 0.02 0.00 -0.11 0.00 0.00 54.58 51.68 1u9b n ASN 140 Cb 1.05 0.44 0.11 0.00 1.24 0.00 0.00 39.78 42.63 1u9b n ASN 140 CO 0.00 0.00 0.00 -0.09 -2.11 0.00 0.00 177.26 175.06 1u9b h ARG 141 N 5.22 0.09 -0.34 1.20 9.65 -1.68 -0.77 114.38 127.76 1u9b h ARG 141 Ca 0.16 -0.01 0.06 0.00 -1.10 0.00 0.00 59.98 59.10 1u9b h ARG 141 Cb 0.99 -0.02 -0.08 0.00 -1.39 0.00 0.00 29.97 29.47 1u9b h ARG 141 CO 0.23 0.06 -0.41 0.28 2.80 0.00 0.00 179.97 182.94 1u9b h VAL 142 N 0.10 0.14 -0.47 0.20 2.07 -1.93 0.24 116.25 116.59 1u9b h VAL 142 Ca 0.35 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.88 1u9b h VAL 142 Cb 0.58 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 1u9b h VAL 142 CO -0.59 0.00 0.31 -0.33 0.02 0.00 0.00 177.57 176.98 1u9b h GLU 143 N -0.35 0.61 0.60 1.57 4.39 -1.61 -2.00 114.58 117.78 1u9b h GLU 143 Ca 0.13 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.77 1u9b h GLU 143 Cb 0.58 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1u9b h GLU 143 CO -0.52 0.41 -0.45 -0.92 -1.16 0.00 0.00 179.01 176.36 1u9b h TYR 144 N 0.63 -1.22 -0.63 4.33 3.20 0.77 -0.37 116.97 123.69 1u9b h TYR 144 Ca 0.17 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.14 1u9b h TYR 144 Cb -0.06 0.45 -0.04 0.00 1.54 0.00 0.00 36.73 38.62 1u9b h TYR 144 CO -0.00 -0.65 0.42 0.93 -1.64 0.00 0.00 178.16 177.22 1u9b h GLU 145 N -1.01 0.43 -0.14 1.82 4.39 -0.76 -0.54 114.58 118.77 1u9b h GLU 145 Ca -0.07 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.60 1u9b h GLU 145 Cb 0.85 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.40 1u9b h GLU 145 CO 0.02 0.28 0.07 0.87 -1.16 0.00 0.00 179.01 179.09 1u9b h LYS 146 N 0.44 0.20 -0.39 2.33 1.57 -0.79 -0.23 116.57 119.71 1u9b h LYS 146 Ca 0.29 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1u9b h LYS 146 Cb 0.54 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 1u9b h LYS 146 CO -0.08 0.23 0.25 0.00 -0.57 0.00 0.00 179.45 179.28 1u9b h ARG 147 N 0.11 0.51 -0.25 3.15 2.47 0.39 -2.02 114.38 118.75 1u9b h ARG 147 Ca 0.05 -0.04 0.03 0.00 -1.26 0.00 0.00 59.98 58.77 1u9b h ARG 147 Cb 0.10 -0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 28.27 1u9b h ARG 147 CO -0.01 0.35 0.05 0.28 0.56 0.00 0.00 179.97 181.21 1u9b h VAL 148 N 0.52 0.89 -0.27 2.04 2.07 -1.00 -0.79 116.25 119.71 1u9b h VAL 148 Ca 0.14 -0.05 0.05 0.00 0.82 0.00 0.00 66.70 67.65 1u9b h VAL 148 Cb -0.04 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.41 1u9b h VAL 148 CO -0.03 0.03 0.00 0.03 0.02 0.00 0.00 177.57 177.62 1u9b h ARG 149 N 0.15 0.08 -0.19 1.57 3.08 -0.85 0.54 114.38 118.76 1u9b h ARG 149 Ca 0.11 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 1u9b h ARG 149 Cb 0.11 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1u9b h ARG 149 CO -0.15 0.06 0.10 0.00 -1.07 0.00 0.00 179.97 178.90 1u9b h ALA 150 N 1.23 1.81 -0.02 0.04 0.00 -1.07 -0.90 119.26 120.35 1u9b h ALA 150 Ca 0.13 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1u9b h ALA 150 Cb 0.17 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1u9b h ALA 150 CO -0.21 0.17 -0.03 0.37 0.00 0.00 0.00 179.25 179.55 1u9b h GLN 151 N 0.27 0.05 -0.35 0.00 4.15 0.71 -1.52 115.11 118.42 1u9b h GLN 151 Ca 0.07 -0.03 0.06 0.00 0.77 0.00 0.00 58.65 59.52 1u9b h GLN 151 Cb 0.03 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 1u9b h GLN 151 CO -0.01 0.55 0.24 0.00 -1.93 0.00 0.00 178.83 177.68 1u9b h ALA 152 N 0.50 2.07 -0.13 3.38 0.00 0.41 -0.93 119.26 124.56 1u9b h ALA 152 Ca 0.00 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 1u9b h ALA 152 Cb 0.54 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1u9b h ALA 152 CO 0.01 -0.15 -0.75 -0.22 0.00 0.00 0.00 179.25 178.14 1u9b h LYS 153 N 0.20 0.66 0.00 0.00 3.64 -1.07 -2.77 116.57 117.23 1u9b h LYS 153 Ca 0.16 -0.53 -0.07 0.00 -1.27 0.00 0.00 60.65 58.94 1u9b h LYS 153 Cb 0.37 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1u9b h LYS 153 CO -0.03 1.15 -0.32 -0.22 -2.27 0.00 0.00 179.45 177.76 1u9b h LYS 154 N 0.45 0.00 -0.65 1.90 3.64 -0.13 -3.04 116.57 118.73 1u9b h LYS 154 Ca -0.04 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 58.98 1u9b h LYS 154 Cb 1.36 0.00 -0.21 0.00 -0.41 0.00 0.00 32.23 32.97 1u9b h LYS 154 CO 0.15 0.32 0.23 1.19 -2.27 0.00 0.00 179.45 179.07 1u9b n PHE 155 N -3.89 2.04 -2.74 1.91 3.72 -0.63 -4.98 117.46 112.89 1u9b n PHE 155 Ca -0.02 -1.82 -0.42 0.00 -0.05 0.00 0.00 57.45 55.14 1u9b n PHE 155 Cb 0.39 -0.72 -0.03 0.00 -0.94 0.00 0.00 39.48 38.18 1u9b n PHE 155 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1u9b s ALA 156 N -3.32 3.45 -0.09 4.37 0.00 -1.06 0.96 121.76 126.06 1u9b s ALA 156 Ca 0.51 0.27 -0.29 0.00 0.00 0.00 0.00 51.96 52.45 1u9b s ALA 156 Cb 0.44 -3.39 -0.05 0.00 0.00 0.00 0.00 23.12 20.13 1u9b s ALA 156 CO 0.04 -0.64 1.68 -1.25 0.00 0.00 0.00 175.76 175.59 1u9b s PRO 157 N 2.11 4.06 0.00 0.00 0.04 -1.26 -4.93 135.00 135.02 1u9b s PRO 157 Ca 0.45 2.08 0.00 0.00 0.04 0.00 0.00 61.00 63.58 1u9b s PRO 157 Cb -0.18 -4.02 0.00 0.00 0.04 0.00 0.00 34.50 30.35 1u9b s PRO 157 CO 0.16 -0.99 0.00 0.43 0.04 0.00 0.00 177.00 176.63