#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ux2 s PHE 1 N 0.00 2.01 0.92 4.31 0.08 -1.26 -5.07 117.98 118.97 1ux2 s PHE 1 Ca 0.00 -1.25 -0.14 0.00 0.12 0.00 0.00 56.93 55.66 1ux2 s PHE 1 Cb 0.00 -1.47 0.16 0.00 -0.57 0.00 0.00 43.02 41.14 1ux2 s PHE 1 CO 0.00 -0.66 1.23 0.16 -0.10 0.00 0.00 175.22 175.85 1ux2 s ASP 2 N 1.53 3.47 0.41 1.36 1.47 -1.26 -4.21 116.67 119.44 1ux2 s ASP 2 Ca 0.01 0.58 0.08 0.00 1.18 0.00 0.00 52.55 54.40 1ux2 s ASP 2 Cb -0.15 -0.87 0.89 0.00 -0.34 0.00 0.00 42.92 42.45 1ux2 s ASP 2 CO -0.08 -2.54 2.04 0.03 0.68 0.00 0.00 175.17 175.30 1ux2 h ARG 3 N -1.50 0.52 -0.47 2.11 3.08 -1.98 -1.19 114.38 114.96 1ux2 h ARG 3 Ca -0.46 -0.03 0.02 0.00 0.07 0.00 0.00 59.98 59.58 1ux2 h ARG 3 Cb 1.29 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 31.19 1ux2 h ARG 3 CO 0.51 0.35 0.27 0.00 -1.07 0.00 0.00 179.97 180.03 1ux2 h ALA 4 N 1.73 0.60 -0.52 0.04 0.00 -1.99 -1.68 119.26 117.43 1ux2 h ALA 4 Ca 0.19 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 1ux2 h ALA 4 Cb 0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1ux2 h ALA 4 CO -0.05 -0.04 0.01 -0.44 0.00 0.00 0.00 179.25 178.73 1ux2 h ASP 5 N 0.55 0.90 -0.22 0.00 3.32 -1.60 -0.50 116.42 118.86 1ux2 h ASP 5 Ca 0.19 -0.30 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 1ux2 h ASP 5 Cb 0.03 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1ux2 h ASP 5 CO -0.09 0.98 0.13 0.40 -1.72 0.00 0.00 179.24 178.94 1ux2 h ILE 6 N 0.79 1.10 -0.35 0.35 2.04 -1.19 -0.02 117.51 120.22 1ux2 h ILE 6 Ca 0.15 -0.24 -0.14 0.00 1.00 0.00 0.00 64.86 65.63 1ux2 h ILE 6 Cb 0.52 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1ux2 h ILE 6 CO 0.03 0.09 -0.34 -0.07 0.00 0.00 0.00 178.15 177.86 1ux2 h LEU 7 N 0.26 0.83 0.19 1.44 3.38 -1.26 -1.03 115.31 119.12 1ux2 h LEU 7 Ca 0.08 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1ux2 h LEU 7 Cb 0.04 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.56 1ux2 h LEU 7 CO -0.01 1.09 -0.09 0.22 0.09 0.00 0.00 178.44 179.73 1ux2 h TYR 8 N 0.66 -0.24 -0.60 1.13 3.20 -0.93 -0.71 116.97 119.49 1ux2 h TYR 8 Ca 0.07 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.96 1ux2 h TYR 8 Cb 0.88 0.08 -0.04 0.00 1.54 0.00 0.00 36.73 39.19 1ux2 h TYR 8 CO 0.05 -0.14 0.37 -0.91 -1.64 0.00 0.00 178.16 175.88 1ux2 h ASN 9 N -0.26 0.60 0.29 -2.11 2.35 -0.83 -0.52 115.58 115.09 1ux2 h ASN 9 Ca -0.03 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 1ux2 h ASN 9 Cb 0.20 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.45 1ux2 h ASN 9 CO 0.04 0.42 -0.14 0.40 -1.65 0.00 0.00 177.43 176.50 1ux2 h ILE 10 N 0.72 0.71 -0.79 2.81 2.04 -1.14 -2.38 117.51 119.49 1ux2 h ILE 10 Ca 0.24 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.15 1ux2 h ILE 10 Cb 0.02 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 36.77 1ux2 h ILE 10 CO -0.10 0.00 0.52 -0.09 0.00 0.00 0.00 178.15 178.48 1ux2 h ARG 11 N -0.39 0.90 0.00 2.37 2.43 -0.87 0.28 114.38 119.10 1ux2 h ARG 11 Ca -0.04 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.00 1ux2 h ARG 11 Cb 0.30 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1ux2 h ARG 11 CO 0.06 0.59 -0.36 1.96 -1.51 0.00 0.00 179.97 180.72 1ux2 h GLN 12 N 0.93 0.00 0.00 0.20 1.08 -1.03 -3.39 115.11 112.90 1ux2 h GLN 12 Ca 0.32 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.52 1ux2 h GLN 12 Cb 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.54 1ux2 h GLN 12 CO -0.10 0.36 -0.18 0.25 -0.95 0.00 0.00 178.83 178.21 1ux2 n THR 13 N -3.37 0.00 -2.25 -0.54 -2.24 -0.90 -4.99 114.28 99.98 1ux2 n THR 13 Ca 0.01 -0.22 -0.42 0.00 -2.27 0.00 0.00 64.05 61.14 1ux2 n THR 13 Cb 0.55 0.81 -0.03 0.00 -2.10 0.00 0.00 70.33 69.56 1ux2 n THR 13 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ux2 s SER 14 N -0.80 6.90 -0.67 3.42 0.15 0.94 -4.97 113.70 118.68 1ux2 s SER 14 Ca 0.00 2.21 -0.07 0.00 0.70 0.00 0.00 55.95 58.79 1ux2 s SER 14 Cb 0.00 -2.58 0.17 0.00 -1.71 0.00 0.00 66.02 61.90 1ux2 s SER 14 CO 0.00 -0.61 0.52 -0.13 1.20 0.00 0.00 173.24 174.23 1ux2 s ARG 15 N 1.25 2.86 0.14 5.44 0.52 -1.26 -4.93 118.95 122.97 1ux2 s ARG 15 Ca 0.63 -2.43 0.16 0.00 -0.52 0.00 0.00 55.73 53.57 1ux2 s ARG 15 Cb -0.34 -3.96 0.71 0.00 0.52 0.00 0.00 34.95 31.88 1ux2 s ARG 15 CO 0.29 -1.21 1.48 -2.30 0.02 0.00 0.00 175.30 173.58 1ux2 n PRO 16 N 3.79 0.09 0.00 3.54 -0.02 -1.26 -1.15 135.00 139.98 1ux2 n PRO 16 Ca 0.08 0.44 0.12 0.00 -2.02 0.00 0.00 63.50 62.11 1ux2 n PRO 16 Cb 0.41 -1.71 0.16 0.00 -0.02 0.00 0.00 33.50 32.34 1ux2 n PRO 16 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1ux2 n ASP 17 N -1.88 2.21 -4.43 2.55 8.00 -1.26 -3.87 116.55 117.87 1ux2 n ASP 17 Ca 0.01 -1.62 -0.39 0.00 0.71 0.00 0.00 54.79 53.50 1ux2 n ASP 17 Cb 0.12 0.18 -0.12 0.00 -0.02 0.00 0.00 41.12 41.29 1ux2 n ASP 17 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ux2 s VAL 18 N -2.23 4.55 0.22 2.53 1.01 -0.30 -5.07 120.40 121.12 1ux2 s VAL 18 Ca 0.26 -0.46 -0.31 0.00 0.00 0.00 0.00 61.98 61.47 1ux2 s VAL 18 Cb 0.19 -3.33 -0.10 0.00 0.00 0.00 0.00 36.38 33.14 1ux2 s VAL 18 CO 0.43 0.05 1.52 -0.51 0.00 0.00 0.00 175.10 176.59 1ux2 s ILE 19 N 1.60 2.55 -1.48 2.22 2.07 -1.26 -4.84 121.20 122.06 1ux2 s ILE 19 Ca 0.04 0.43 -0.09 0.00 -1.41 0.00 0.00 60.65 59.63 1ux2 s ILE 19 Cb -0.17 -3.28 0.01 0.00 0.13 0.00 0.00 42.46 39.15 1ux2 s ILE 19 CO 0.06 0.05 2.62 -0.81 -1.91 0.00 0.00 174.94 174.96 1ux2 n PRO 20 N 3.04 3.94 -2.57 3.50 -0.04 -1.26 -4.96 135.00 136.65 1ux2 n PRO 20 Ca 0.10 -2.77 -0.36 0.00 -0.04 0.00 0.00 63.50 60.43 1ux2 n PRO 20 Cb 0.39 -2.79 -0.04 0.00 -0.04 0.00 0.00 33.50 31.01 1ux2 n PRO 20 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1ux2 s THR 21 N 0.97 3.79 0.01 0.52 -4.23 -1.26 -4.74 115.64 110.70 1ux2 s THR 21 Ca 0.60 1.37 0.05 0.00 -1.18 0.00 0.00 61.69 62.53 1ux2 s THR 21 Cb 0.17 -3.70 -0.02 0.00 1.34 0.00 0.00 72.50 70.29 1ux2 s THR 21 CO -0.07 0.00 -0.14 -1.10 -0.54 0.00 0.00 174.62 172.77 1ux2 s GLN 22 N -2.49 1.07 -0.40 3.99 -0.21 -1.23 -4.78 119.66 115.61 1ux2 s GLN 22 Ca 0.57 -0.63 0.00 0.00 0.02 0.00 0.00 55.36 55.32 1ux2 s GLN 22 Cb -0.21 -1.06 0.00 0.00 1.00 0.00 0.00 33.01 32.74 1ux2 s GLN 22 CO 0.27 0.28 0.00 0.54 -2.12 0.00 0.00 175.29 174.26 1ux2 n ARG 23 N 2.35 -1.80 -2.25 2.91 1.74 -1.26 0.14 116.66 118.49 1ux2 n ARG 23 Ca -0.16 0.23 -0.21 0.00 -0.77 0.00 0.00 57.85 56.94 1ux2 n ARG 23 Cb 0.55 -4.50 -0.02 0.00 -1.02 0.00 0.00 32.46 27.46 1ux2 n ARG 23 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1ux2 n ASP 24 N -0.39 -5.82 -4.91 0.55 2.03 -1.26 -5.01 116.55 101.74 1ux2 n ASP 24 Ca -0.04 0.08 -0.29 0.00 0.52 0.00 0.00 54.79 55.06 1ux2 n ASP 24 Cb 0.31 -4.90 -0.04 0.00 -0.72 0.00 0.00 41.12 35.77 1ux2 n ASP 24 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1ux2 s ARG 25 N -4.81 3.59 0.62 -0.67 0.52 0.37 -4.99 118.95 113.58 1ux2 s ARG 25 Ca 0.00 -0.15 -0.17 0.00 -0.52 0.00 0.00 55.73 54.89 1ux2 s ARG 25 Cb 0.00 -2.79 -0.02 0.00 0.52 0.00 0.00 34.95 32.66 1ux2 s ARG 25 CO 0.00 0.37 1.15 -1.25 0.02 0.00 0.00 175.30 175.59 1ux2 s PRO 26 N -3.15 2.92 -0.04 3.54 0.04 -1.19 -3.52 135.00 133.60 1ux2 s PRO 26 Ca 0.41 1.61 -0.30 0.00 0.04 0.00 0.00 61.00 62.76 1ux2 s PRO 26 Cb -0.11 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 1ux2 s PRO 26 CO 0.27 -1.20 1.31 0.08 0.04 0.00 0.00 177.00 177.51 1ux2 s VAL 27 N -1.94 4.00 -0.51 -0.36 1.01 0.52 -4.77 120.40 118.35 1ux2 s VAL 27 Ca 0.72 1.34 -0.28 0.00 0.00 0.00 0.00 61.98 63.76 1ux2 s VAL 27 Cb -0.25 -3.86 0.03 0.00 0.00 0.00 0.00 36.38 32.30 1ux2 s VAL 27 CO 0.36 -0.02 1.12 0.00 0.00 0.00 0.00 175.10 176.56 1ux2 s ALA 28 N 2.45 3.12 -0.25 5.51 0.00 -1.26 -1.64 121.76 129.69 1ux2 s ALA 28 Ca 0.60 -0.63 -0.08 0.00 0.00 0.00 0.00 51.96 51.85 1ux2 s ALA 28 Cb -0.28 -3.90 -0.03 0.00 0.00 0.00 0.00 23.12 18.91 1ux2 s ALA 28 CO 0.24 -2.35 0.08 0.08 0.00 0.00 0.00 175.76 173.81 1ux2 s VAL 29 N 4.50 4.43 -0.09 0.00 1.01 -0.09 -4.37 120.40 125.80 1ux2 s VAL 29 Ca 0.45 -0.13 -0.19 0.00 0.00 0.00 0.00 61.98 62.11 1ux2 s VAL 29 Cb -0.08 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 1ux2 s VAL 29 CO 0.29 0.33 0.52 -0.44 0.00 0.00 0.00 175.10 175.80 1ux2 s SER 30 N 1.62 6.77 -0.09 3.32 0.01 0.64 -1.44 113.70 124.53 1ux2 s SER 30 Ca 0.06 0.92 0.03 0.00 1.31 0.00 0.00 55.95 58.27 1ux2 s SER 30 Cb -0.15 -2.31 0.01 0.00 0.21 0.00 0.00 66.02 63.78 1ux2 s SER 30 CO 0.04 0.01 -0.16 -0.69 0.41 0.00 0.00 173.24 172.85 1ux2 s VAL 31 N 0.46 1.50 -0.06 3.43 1.01 -0.20 -1.41 120.40 125.13 1ux2 s VAL 31 Ca 0.28 -0.68 -0.02 0.00 0.00 0.00 0.00 61.98 61.55 1ux2 s VAL 31 Cb -0.16 -1.35 0.04 0.00 0.00 0.00 0.00 36.38 34.91 1ux2 s VAL 31 CO 0.12 0.44 0.13 -0.55 0.00 0.00 0.00 175.10 175.24 1ux2 s SER 32 N 0.66 0.18 -0.18 3.32 0.15 -0.23 -3.13 113.70 114.49 1ux2 s SER 32 Ca -0.14 0.26 -0.14 0.00 0.70 0.00 0.00 55.95 56.63 1ux2 s SER 32 Cb -0.16 0.15 -0.04 0.00 -1.71 0.00 0.00 66.02 64.25 1ux2 s SER 32 CO 0.04 -0.17 0.32 -0.76 1.20 0.00 0.00 173.24 173.86 1ux2 s LEU 33 N 1.47 4.21 -0.31 3.45 1.43 -1.26 -0.68 118.68 126.99 1ux2 s LEU 33 Ca -0.06 0.49 -0.06 0.00 -1.03 0.00 0.00 54.13 53.48 1ux2 s LEU 33 Cb -0.12 -2.40 0.03 0.00 0.03 0.00 0.00 46.19 43.73 1ux2 s LEU 33 CO -0.05 0.04 0.07 -0.54 0.23 0.00 0.00 176.35 176.10 1ux2 s LYS 34 N 0.75 2.76 0.09 1.70 -0.14 -0.68 -4.96 119.74 119.25 1ux2 s LYS 34 Ca 0.17 -1.08 -0.30 0.00 -1.36 0.00 0.00 55.97 53.40 1ux2 s LYS 34 Cb -0.14 -3.36 -0.06 0.00 -1.68 0.00 0.00 37.83 32.60 1ux2 s LYS 34 CO 0.05 -0.57 1.08 -0.06 -0.76 0.00 0.00 175.35 175.09 1ux2 s PHE 35 N 1.41 3.60 -0.13 3.18 0.08 -1.26 -0.23 117.98 124.63 1ux2 s PHE 35 Ca -0.01 1.57 0.02 0.00 0.12 0.00 0.00 56.93 58.63 1ux2 s PHE 35 Cb -0.19 -3.24 -0.09 0.00 -0.57 0.00 0.00 43.02 38.93 1ux2 s PHE 35 CO 0.02 -0.52 -0.10 -0.89 -0.10 0.00 0.00 175.22 173.63 1ux2 n ILE 36 N 3.31 0.74 -3.62 0.64 2.08 0.62 -3.29 119.36 119.83 1ux2 n ILE 36 Ca 0.05 -0.30 -0.15 0.00 0.56 0.00 0.00 62.75 62.91 1ux2 n ILE 36 Cb 0.48 -0.94 -0.07 0.00 -0.75 0.00 0.00 39.64 38.37 1ux2 n ILE 36 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 1ux2 s ASN 37 N -5.15 -0.42 -0.23 4.38 3.84 -0.85 0.00 114.94 116.51 1ux2 s ASN 37 Ca -0.16 0.30 0.02 0.00 0.21 0.00 0.00 52.86 53.23 1ux2 s ASN 37 Cb 0.04 0.45 0.05 0.00 -0.55 0.00 0.00 41.25 41.24 1ux2 s ASN 37 CO 0.31 -0.60 -0.14 -0.63 -2.79 0.00 0.00 177.10 173.25 1ux2 s ILE 38 N -1.75 2.05 -0.21 -5.21 1.01 -1.26 -0.47 121.20 115.36 1ux2 s ILE 38 Ca -0.09 -1.33 -0.00 0.00 0.00 0.00 0.00 60.65 59.23 1ux2 s ILE 38 Cb -0.02 -2.06 -0.20 0.00 0.01 0.00 0.00 42.46 40.19 1ux2 s ILE 38 CO 0.04 0.17 -0.02 0.18 0.00 0.00 0.00 174.94 175.30 1ux2 n LEU 39 N 4.53 2.76 -3.72 2.97 4.77 0.70 -4.59 117.00 124.40 1ux2 n LEU 39 Ca -0.16 -0.02 -0.12 0.00 -0.03 0.00 0.00 56.01 55.67 1ux2 n LEU 39 Cb 0.45 -0.92 -0.10 0.00 -2.33 0.00 0.00 43.42 40.52 1ux2 n LEU 39 CO 0.22 0.89 0.08 -0.70 -1.33 0.00 0.00 177.39 176.55 1ux2 s GLU 40 N -2.53 0.46 -0.00 3.23 2.12 -1.15 -4.99 118.70 115.83 1ux2 s GLU 40 Ca -0.30 0.62 0.01 0.00 0.36 0.00 0.00 54.97 55.67 1ux2 s GLU 40 Cb 0.08 0.17 -0.00 0.00 0.26 0.00 0.00 34.13 34.64 1ux2 s GLU 40 CO 0.66 -0.08 -0.05 0.08 -0.54 0.00 0.00 175.26 175.33 1ux2 s VAL 41 N 0.51 0.37 -0.22 3.70 1.01 -1.26 -0.71 120.40 123.80 1ux2 s VAL 41 Ca -0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 61.68 1ux2 s VAL 41 Cb -0.04 -0.32 0.07 0.00 0.00 0.00 0.00 36.38 36.09 1ux2 s VAL 41 CO -0.03 0.08 0.07 0.21 0.00 0.00 0.00 175.10 175.43 1ux2 s ASN 42 N -0.18 3.00 0.45 3.32 3.84 -0.66 -5.02 114.94 119.69 1ux2 s ASN 42 Ca 0.01 -0.94 0.25 0.00 0.21 0.00 0.00 52.86 52.40 1ux2 s ASN 42 Cb -0.02 -0.52 0.75 0.00 -0.55 0.00 0.00 41.25 40.91 1ux2 s ASN 42 CO -0.00 -0.35 1.75 -0.08 -2.79 0.00 0.00 177.10 175.63 1ux2 h GLU 43 N 8.29 0.00 -0.02 0.43 4.81 -1.88 -0.29 114.58 125.92 1ux2 h GLU 43 Ca -0.16 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.03 1ux2 h GLU 43 Cb 1.10 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.48 1ux2 h GLU 43 CO 0.36 0.14 -0.14 0.82 -0.73 0.00 0.00 179.01 179.45 1ux2 h ILE 44 N 0.00 1.51 0.00 2.32 1.08 -1.97 -3.33 117.51 117.12 1ux2 h ILE 44 Ca -0.00 -1.71 0.00 0.00 -0.39 0.00 0.00 64.86 62.76 1ux2 h ILE 44 Cb 0.85 2.57 0.00 0.00 -3.07 0.00 0.00 36.82 37.17 1ux2 h ILE 44 CO 0.02 0.46 -0.45 0.35 -0.69 0.00 0.00 178.15 177.84 1ux2 n THR 45 N -4.61 0.05 -3.46 -0.27 -2.24 -1.21 -4.98 114.28 97.56 1ux2 n THR 45 Ca -0.09 -0.04 -0.19 0.00 -2.27 0.00 0.00 64.05 61.46 1ux2 n THR 45 Cb 0.42 0.09 0.07 0.00 -2.10 0.00 0.00 70.33 68.81 1ux2 n THR 45 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1ux2 n ASN 46 N -1.59 -3.73 -4.03 3.42 3.02 -0.14 -4.95 115.26 107.26 1ux2 n ASN 46 Ca 0.05 -0.74 -0.21 0.00 -0.03 0.00 0.00 54.58 53.65 1ux2 n ASN 46 Cb 0.35 -4.72 -0.15 0.00 -0.61 0.00 0.00 39.78 34.64 1ux2 n ASN 46 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1ux2 s GLU 47 N -5.25 1.09 0.08 3.52 2.02 -1.05 -2.31 118.70 116.80 1ux2 s GLU 47 Ca 0.21 -0.37 0.08 0.00 0.02 0.00 0.00 54.97 54.90 1ux2 s GLU 47 Cb -0.04 -1.01 -0.03 0.00 0.10 0.00 0.00 34.13 33.15 1ux2 s GLU 47 CO 0.77 0.15 -0.21 0.14 0.02 0.00 0.00 175.26 176.13 1ux2 s VAL 48 N 0.11 1.67 -0.21 2.63 -7.23 -0.33 -1.65 120.40 115.38 1ux2 s VAL 48 Ca -0.02 -1.39 -0.00 0.00 -1.81 0.00 0.00 61.98 58.76 1ux2 s VAL 48 Cb -0.09 -1.49 0.02 0.00 0.56 0.00 0.00 36.38 35.38 1ux2 s VAL 48 CO 0.01 0.05 -0.13 -0.62 -0.31 0.00 0.00 175.10 174.09 1ux2 s ASP 49 N -1.59 3.74 0.01 4.85 -1.08 0.11 -0.42 116.67 122.29 1ux2 s ASP 49 Ca 0.07 -0.71 0.01 0.00 -0.52 0.00 0.00 52.55 51.40 1ux2 s ASP 49 Cb -0.09 -1.58 -0.01 0.00 -1.46 0.00 0.00 42.92 39.77 1ux2 s ASP 49 CO 0.03 -0.05 -0.05 0.54 0.52 0.00 0.00 175.17 176.16 1ux2 s VAL 50 N 1.32 0.36 -0.15 1.11 0.11 -0.58 -0.22 120.40 122.35 1ux2 s VAL 50 Ca 0.03 -0.55 -0.02 0.00 -2.93 0.00 0.00 61.98 58.51 1ux2 s VAL 50 Cb -0.15 -0.38 -0.02 0.00 -1.53 0.00 0.00 36.38 34.31 1ux2 s VAL 50 CO -0.08 -0.13 -0.08 -0.69 -3.33 0.00 0.00 175.10 170.79 1ux2 s VAL 51 N -0.66 3.42 0.01 2.04 1.01 0.38 -1.84 120.40 124.75 1ux2 s VAL 51 Ca -0.04 -0.52 -0.11 0.00 0.00 0.00 0.00 61.98 61.31 1ux2 s VAL 51 Cb -0.05 -2.48 0.01 0.00 0.00 0.00 0.00 36.38 33.86 1ux2 s VAL 51 CO -0.00 0.50 0.22 0.72 0.00 0.00 0.00 175.10 176.54 1ux2 s PHE 52 N 0.54 -0.04 -0.30 5.22 -0.12 -0.40 -0.28 117.98 122.60 1ux2 s PHE 52 Ca -0.06 -0.01 -0.24 0.00 -0.05 0.00 0.00 56.93 56.58 1ux2 s PHE 52 Cb -0.15 0.02 0.00 0.00 -0.63 0.00 0.00 43.02 42.26 1ux2 s PHE 52 CO 0.03 -0.36 0.82 -1.58 -0.05 0.00 0.00 175.22 174.08 1ux2 s TRP 53 N -1.64 3.20 -1.13 3.49 0.51 0.68 -0.06 118.94 123.99 1ux2 s TRP 53 Ca -0.12 0.87 -0.17 0.00 -2.12 0.00 0.00 56.10 54.56 1ux2 s TRP 53 Cb -0.05 -3.25 0.13 0.00 -0.81 0.00 0.00 33.47 29.48 1ux2 s TRP 53 CO 0.01 -0.57 1.42 -1.14 -0.51 0.00 0.00 176.95 176.16 1ux2 s GLN 54 N 3.02 3.89 -0.27 4.98 0.74 -0.35 -1.68 119.66 129.99 1ux2 s GLN 54 Ca 0.34 -2.10 -0.29 0.00 0.05 0.00 0.00 55.36 53.36 1ux2 s GLN 54 Cb -0.14 -5.15 -0.01 0.00 1.10 0.00 0.00 33.01 28.81 1ux2 s GLN 54 CO 0.12 -1.91 1.43 -1.14 -0.55 0.00 0.00 175.29 173.24 1ux2 s GLN 55 N 2.75 3.86 -0.09 1.67 0.74 0.14 -3.99 119.66 124.75 1ux2 s GLN 55 Ca 0.43 1.40 0.02 0.00 0.05 0.00 0.00 55.36 57.26 1ux2 s GLN 55 Cb -0.02 -3.94 0.01 0.00 1.10 0.00 0.00 33.01 30.16 1ux2 s GLN 55 CO -0.02 -1.20 -0.14 0.99 -0.55 0.00 0.00 175.29 174.38 1ux2 s THR 56 N 4.72 1.33 0.03 -0.34 2.01 0.71 -1.06 115.64 123.03 1ux2 s THR 56 Ca 0.62 -0.56 0.04 0.00 0.31 0.00 0.00 61.69 62.10 1ux2 s THR 56 Cb -0.20 -1.22 -0.02 0.00 0.01 0.00 0.00 72.50 71.07 1ux2 s THR 56 CO 0.26 0.40 -0.12 0.42 -0.69 0.00 0.00 174.62 174.89 1ux2 s THR 57 N 0.89 0.90 0.31 -0.82 -4.23 -0.50 -0.09 115.64 112.10 1ux2 s THR 57 Ca -0.09 -0.86 -0.19 0.00 -1.18 0.00 0.00 61.69 59.36 1ux2 s THR 57 Cb -0.15 -0.83 0.04 0.00 1.34 0.00 0.00 72.50 72.90 1ux2 s THR 57 CO 0.01 -0.02 0.77 -1.66 -0.54 0.00 0.00 174.62 173.17 1ux2 s TRP 58 N -0.78 -0.07 -0.10 3.99 -2.14 -0.87 -0.26 118.94 118.71 1ux2 s TRP 58 Ca -0.00 -0.47 -0.02 0.00 2.66 0.00 0.00 56.10 58.28 1ux2 s TRP 58 Cb -0.07 0.75 -0.03 0.00 -3.10 0.00 0.00 33.47 31.02 1ux2 s TRP 58 CO 0.01 -1.33 -0.03 0.45 -2.66 0.00 0.00 176.95 173.39 1ux2 s SER 59 N -2.99 4.97 -0.33 -2.66 0.15 -1.26 -0.48 113.70 111.10 1ux2 s SER 59 Ca 0.13 0.02 -0.01 0.00 0.70 0.00 0.00 55.95 56.80 1ux2 s SER 59 Cb -0.05 -1.50 0.11 0.00 -1.71 0.00 0.00 66.02 62.87 1ux2 s SER 59 CO 0.08 0.31 0.14 -0.62 1.20 0.00 0.00 173.24 174.35 1ux2 s ASP 60 N -0.47 3.80 0.00 5.45 -1.08 0.13 -4.87 116.67 119.64 1ux2 s ASP 60 Ca 0.08 -1.82 0.20 0.00 -0.52 0.00 0.00 52.55 50.49 1ux2 s ASP 60 Cb -0.12 -0.79 0.87 0.00 -1.46 0.00 0.00 42.92 41.42 1ux2 s ASP 60 CO 0.02 -0.38 1.64 0.54 0.52 0.00 0.00 175.17 177.51 1ux2 n ARG 61 N 4.59 0.03 0.00 4.34 1.74 -1.26 -1.89 116.66 124.21 1ux2 n ARG 61 Ca 0.01 0.15 0.08 0.00 -0.77 0.00 0.00 57.85 57.32 1ux2 n ARG 61 Cb 0.40 -1.50 0.39 0.00 -1.02 0.00 0.00 32.46 30.73 1ux2 n ARG 61 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1ux2 n THR 62 N -1.48 0.74 0.55 0.55 -2.24 -1.26 -2.06 114.28 109.08 1ux2 n THR 62 Ca 0.05 0.18 0.11 0.00 -2.27 0.00 0.00 64.05 62.13 1ux2 n THR 62 Cb 0.23 -0.89 0.06 0.00 -2.10 0.00 0.00 70.33 67.63 1ux2 n THR 62 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ux2 n LEU 63 N -1.45 0.64 -4.74 3.22 4.77 -0.79 -4.86 117.00 113.78 1ux2 n LEU 63 Ca 0.05 0.06 -0.36 0.00 -0.03 0.00 0.00 56.01 55.73 1ux2 n LEU 63 Cb 0.19 -0.12 0.05 0.00 -2.33 0.00 0.00 43.42 41.21 1ux2 n LEU 63 CO 0.15 0.01 0.87 0.00 -1.33 0.00 0.00 177.39 177.09 1ux2 s ALA 64 N -3.20 2.48 0.07 -1.18 0.00 -0.87 -4.74 121.76 114.32 1ux2 s ALA 64 Ca 0.04 1.11 -0.04 0.00 0.00 0.00 0.00 51.96 53.07 1ux2 s ALA 64 Cb 0.14 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 1ux2 s ALA 64 CO 0.78 -1.35 0.07 1.67 0.00 0.00 0.00 175.76 176.93 1ux2 s TRP 65 N -1.50 0.39 -0.39 0.00 -2.14 -0.79 -4.98 118.94 109.53 1ux2 s TRP 65 Ca 0.79 -0.88 -0.29 0.00 2.66 0.00 0.00 56.10 58.39 1ux2 s TRP 65 Cb -0.34 -0.26 0.00 0.00 -3.10 0.00 0.00 33.47 29.78 1ux2 s TRP 65 CO 0.36 -0.46 1.45 1.21 -2.66 0.00 0.00 176.95 176.85 1ux2 s ASN 66 N -2.91 6.32 -0.26 -2.66 3.84 -1.26 -4.67 114.94 113.34 1ux2 s ASN 66 Ca 0.07 0.93 0.12 0.00 0.21 0.00 0.00 52.86 54.20 1ux2 s ASN 66 Cb 0.07 -2.54 0.57 0.00 -0.55 0.00 0.00 41.25 38.80 1ux2 s ASN 66 CO -0.10 -1.43 1.54 -1.54 -2.79 0.00 0.00 177.10 172.79 1ux2 n SER 67 N 8.86 3.56 0.14 -4.21 3.41 -1.26 -4.60 113.62 119.53 1ux2 n SER 67 Ca 0.17 -3.36 0.05 0.00 -0.26 0.00 0.00 58.87 55.47 1ux2 n SER 67 Cb 0.48 -0.63 0.49 0.00 -0.26 0.00 0.00 64.21 64.28 1ux2 n SER 67 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1ux2 h SER 68 N 1.63 0.20 -0.08 4.04 4.64 -1.95 -3.04 113.55 118.99 1ux2 h SER 68 Ca 0.17 -0.02 -0.15 0.00 -0.47 0.00 0.00 61.79 61.33 1ux2 h SER 68 Cb 1.79 -0.05 -0.27 0.00 -0.31 0.00 0.00 62.40 63.56 1ux2 h SER 68 CO 0.44 0.23 -0.86 1.41 -0.87 0.00 0.00 176.83 177.17 1ux2 n HIS 69 N -4.42 0.25 -4.14 4.77 8.25 -1.26 -5.08 115.22 113.58 1ux2 n HIS 69 Ca -0.01 -1.05 -0.09 0.00 -0.26 0.00 0.00 57.72 56.31 1ux2 n HIS 69 Cb 0.15 -0.20 -0.10 0.00 1.12 0.00 0.00 29.99 30.96 1ux2 n HIS 69 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1ux2 s SER 70 N -2.64 0.73 0.34 0.41 0.01 -1.15 -2.89 113.70 108.51 1ux2 s SER 70 Ca 0.36 -1.06 -0.27 0.00 1.31 0.00 0.00 55.95 56.29 1ux2 s SER 70 Cb 0.38 0.18 -0.13 0.00 0.21 0.00 0.00 66.02 66.66 1ux2 s SER 70 CO -0.12 -0.58 1.06 -2.65 0.41 0.00 0.00 173.24 171.36 1ux2 n PRO 71 N -0.01 1.50 -0.19 12.44 -0.02 -1.26 -4.79 135.00 142.67 1ux2 n PRO 71 Ca -0.11 0.53 0.11 0.00 -2.02 0.00 0.00 63.50 62.01 1ux2 n PRO 71 Cb 0.62 -2.00 0.21 0.00 -0.02 0.00 0.00 33.50 32.31 1ux2 n PRO 71 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1ux2 n ASP 72 N 0.92 3.40 -3.76 2.55 3.85 -1.26 -4.83 116.55 117.42 1ux2 n ASP 72 Ca 0.08 -1.97 -0.13 0.00 -0.71 0.00 0.00 54.79 52.07 1ux2 n ASP 72 Cb 0.35 -0.26 -0.10 0.00 -1.35 0.00 0.00 41.12 39.76 1ux2 n ASP 72 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 1ux2 s GLN 73 N -1.38 0.46 0.06 0.11 -0.21 -1.26 0.18 119.66 117.63 1ux2 s GLN 73 Ca 0.37 0.30 -0.05 0.00 0.02 0.00 0.00 55.36 56.00 1ux2 s GLN 73 Cb 0.22 0.22 -0.02 0.00 1.00 0.00 0.00 33.01 34.42 1ux2 s GLN 73 CO 0.30 -0.08 0.07 0.14 -2.12 0.00 0.00 175.29 173.60 1ux2 s VAL 74 N -0.21 0.17 -0.17 1.09 -7.23 -0.48 -4.99 120.40 108.57 1ux2 s VAL 74 Ca -0.04 -1.43 -0.11 0.00 -1.81 0.00 0.00 61.98 58.59 1ux2 s VAL 74 Cb -0.03 -1.30 -0.05 0.00 0.56 0.00 0.00 36.38 35.56 1ux2 s VAL 74 CO 0.01 -0.79 0.20 -0.44 -0.31 0.00 0.00 175.10 173.78 1ux2 s SER 75 N -2.70 6.33 -0.03 4.85 0.01 -1.26 -1.06 113.70 119.82 1ux2 s SER 75 Ca 0.03 0.38 0.04 0.00 1.31 0.00 0.00 55.95 57.71 1ux2 s SER 75 Cb 0.05 -2.13 -0.00 0.00 0.21 0.00 0.00 66.02 64.14 1ux2 s SER 75 CO -0.09 0.16 -0.14 -0.69 0.41 0.00 0.00 173.24 172.89 1ux2 s VAL 76 N 0.28 1.18 0.31 3.43 1.01 0.12 -4.93 120.40 121.80 1ux2 s VAL 76 Ca 0.12 -0.58 -0.29 0.00 0.00 0.00 0.00 61.98 61.23 1ux2 s VAL 76 Cb -0.12 -1.02 -0.12 0.00 0.00 0.00 0.00 36.38 35.12 1ux2 s VAL 76 CO 0.01 0.35 1.42 -2.65 0.00 0.00 0.00 175.10 174.23 1ux2 n PRO 77 N 3.15 2.33 0.31 2.72 -0.02 -1.26 -0.59 135.00 141.63 1ux2 n PRO 77 Ca -0.18 0.82 0.19 0.00 -2.02 0.00 0.00 63.50 62.32 1ux2 n PRO 77 Cb 0.54 -2.49 1.01 0.00 -0.02 0.00 0.00 33.50 32.53 1ux2 n PRO 77 CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 1ux2 h ILE 78 N 2.92 0.15 0.00 4.25 3.07 -1.71 -1.32 117.51 124.88 1ux2 h ILE 78 Ca -0.47 -0.19 0.00 0.00 1.55 0.00 0.00 64.86 65.76 1ux2 h ILE 78 Cb 1.26 1.16 0.00 0.00 -0.27 0.00 0.00 36.82 38.97 1ux2 h ILE 78 CO 0.70 0.02 0.00 0.77 -1.05 0.00 0.00 178.15 178.59 1ux2 h SER 79 N 0.00 0.00 -0.02 2.16 4.64 -1.88 -0.51 113.55 117.94 1ux2 h SER 79 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ux2 h SER 79 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1ux2 h SER 79 CO 0.00 0.00 -0.01 -1.20 -0.87 0.00 0.00 176.83 174.75 1ux2 n SER 80 N -3.02 2.53 -4.38 4.97 7.64 -0.50 -4.90 113.62 115.96 1ux2 n SER 80 Ca -0.01 -1.83 -0.25 0.00 1.01 0.00 0.00 58.87 57.78 1ux2 n SER 80 Cb 0.16 0.01 -0.12 0.00 -1.01 0.00 0.00 64.21 63.25 1ux2 n SER 80 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1ux2 s LEU 81 N -2.02 2.43 0.04 -3.43 1.43 -0.20 -4.62 118.68 112.32 1ux2 s LEU 81 Ca 0.31 -0.86 -0.31 0.00 -1.03 0.00 0.00 54.13 52.24 1ux2 s LEU 81 Cb 0.20 -1.02 -0.06 0.00 0.03 0.00 0.00 46.19 45.35 1ux2 s LEU 81 CO 0.32 0.06 1.29 0.86 0.23 0.00 0.00 176.35 179.10 1ux2 s TRP 82 N -1.80 3.23 -0.00 0.29 -0.00 -1.25 -4.64 118.94 114.76 1ux2 s TRP 82 Ca 0.18 1.10 0.08 0.00 -0.00 0.00 0.00 56.10 57.46 1ux2 s TRP 82 Cb -0.07 -3.54 -0.02 0.00 -0.00 0.00 0.00 33.47 29.84 1ux2 s TRP 82 CO 0.08 -1.80 -0.25 0.14 -0.00 0.00 0.00 176.95 175.12 1ux2 s VAL 83 N 1.53 1.97 0.31 5.86 -7.23 -1.26 -5.05 120.40 116.52 1ux2 s VAL 83 Ca 0.61 -1.12 -0.29 0.00 -1.81 0.00 0.00 61.98 59.36 1ux2 s VAL 83 Cb -0.31 -1.64 -0.12 0.00 0.56 0.00 0.00 36.38 34.87 1ux2 s VAL 83 CO 0.28 0.50 1.48 -0.81 -0.31 0.00 0.00 175.10 176.23 1ux2 n PRO 84 N 2.31 2.46 -1.11 4.82 -0.04 -1.26 -4.89 135.00 137.29 1ux2 n PRO 84 Ca -0.16 0.87 -0.33 0.00 -0.04 0.00 0.00 63.50 63.84 1ux2 n PRO 84 Cb 0.52 -2.58 -0.03 0.00 -0.04 0.00 0.00 33.50 31.37 1ux2 n PRO 84 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1ux2 n ASP 85 N 1.50 7.45 -4.78 3.54 5.75 -1.26 -4.95 116.55 123.79 1ux2 n ASP 85 Ca 0.07 -2.48 -0.37 0.00 -0.01 0.00 0.00 54.79 52.00 1ux2 n ASP 85 Cb 0.36 -1.40 -0.06 0.00 -1.03 0.00 0.00 41.12 38.99 1ux2 n ASP 85 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1ux2 s LEU 86 N 0.14 4.29 -0.11 -2.12 1.43 -1.26 -0.81 118.68 120.24 1ux2 s LEU 86 Ca 0.60 1.85 -0.09 0.00 -1.03 0.00 0.00 54.13 55.46 1ux2 s LEU 86 Cb 0.16 -4.08 0.03 0.00 0.03 0.00 0.00 46.19 42.33 1ux2 s LEU 86 CO -0.05 -0.14 0.28 0.00 0.23 0.00 0.00 176.35 176.67 1ux2 s ALA 87 N -1.67 -0.68 -0.13 4.21 0.00 0.29 -4.86 121.76 118.92 1ux2 s ALA 87 Ca 0.52 0.85 -0.29 0.00 0.00 0.00 0.00 51.96 53.04 1ux2 s ALA 87 Cb -0.18 -0.50 -0.02 0.00 0.00 0.00 0.00 23.12 22.42 1ux2 s ALA 87 CO 0.23 -0.15 1.16 0.00 0.00 0.00 0.00 175.76 177.01 1ux2 s ALA 88 N 0.38 3.57 0.36 0.00 0.00 -1.26 -2.01 121.76 122.80 1ux2 s ALA 88 Ca -0.02 0.45 0.09 0.00 0.00 0.00 0.00 51.96 52.48 1ux2 s ALA 88 Cb -0.04 -3.54 0.67 0.00 0.00 0.00 0.00 23.12 20.21 1ux2 s ALA 88 CO -0.02 -0.92 1.84 1.88 0.00 0.00 0.00 175.76 178.54 1ux2 h TYR 89 N 7.64 0.24 -0.54 0.00 0.05 -0.23 -2.95 116.97 121.19 1ux2 h TYR 89 Ca -0.28 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.46 1ux2 h TYR 89 Cb 1.12 -0.06 0.00 0.00 1.01 0.00 0.00 36.73 38.80 1ux2 h TYR 89 CO 0.75 0.45 0.00 0.27 -1.05 0.00 0.00 178.16 178.58 1ux2 n ASN 90 N -4.18 4.09 -4.77 3.88 6.94 -1.26 -4.98 115.26 114.98 1ux2 n ASN 90 Ca -0.01 -2.35 -0.41 0.00 -0.02 0.00 0.00 54.58 51.79 1ux2 n ASN 90 Cb 0.35 -0.48 -0.02 0.00 -2.36 0.00 0.00 39.78 37.27 1ux2 n ASN 90 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ux2 s ALA 91 N -1.65 3.55 -0.27 -2.53 0.00 -1.12 -1.62 121.76 118.12 1ux2 s ALA 91 Ca 0.43 1.36 0.03 0.00 0.00 0.00 0.00 51.96 53.78 1ux2 s ALA 91 Cb 0.27 -3.53 0.08 0.00 0.00 0.00 0.00 23.12 19.94 1ux2 s ALA 91 CO 0.22 -0.78 1.01 0.44 0.00 0.00 0.00 175.76 176.65 1ux2 n ILE 92 N 1.01 0.88 -4.07 0.00 -5.35 -0.18 -4.88 119.36 106.77 1ux2 n ILE 92 Ca 0.02 -0.94 -0.07 0.00 -0.27 0.00 0.00 62.75 61.48 1ux2 n ILE 92 Cb 0.41 0.57 -0.10 0.00 -1.74 0.00 0.00 39.64 38.78 1ux2 n ILE 92 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1ux2 s SER 93 N -0.91 0.46 0.34 7.28 1.04 -1.23 -4.94 113.70 115.74 1ux2 s SER 93 Ca 0.06 -0.97 -0.29 0.00 0.48 0.00 0.00 55.95 55.23 1ux2 s SER 93 Cb 0.03 0.21 -0.11 0.00 0.10 0.00 0.00 66.02 66.26 1ux2 s SER 93 CO 0.04 -0.61 1.37 -0.54 0.98 0.00 0.00 173.24 174.49 1ux2 s LYS 94 N -3.91 4.27 0.06 4.02 1.02 -1.26 -4.66 119.74 119.28 1ux2 s LYS 94 Ca 0.07 2.34 -0.30 0.00 0.02 0.00 0.00 55.97 58.10 1ux2 s LYS 94 Cb 0.08 -3.04 -0.09 0.00 -0.52 0.00 0.00 37.83 34.26 1ux2 s LYS 94 CO -0.10 -0.32 1.82 -1.25 -0.92 0.00 0.00 175.35 174.58 1ux2 s PRO 95 N -1.83 4.16 -0.51 -1.68 0.04 -1.26 -4.79 135.00 129.12 1ux2 s PRO 95 Ca 0.51 2.50 -0.19 0.00 0.04 0.00 0.00 61.00 63.85 1ux2 s PRO 95 Cb -0.42 -3.82 0.06 0.00 0.04 0.00 0.00 34.50 30.36 1ux2 s PRO 95 CO 0.56 -0.86 0.63 -2.00 0.04 0.00 0.00 177.00 175.37 1ux2 s GLU 96 N 3.41 3.13 -0.19 4.56 2.12 -0.42 -4.95 118.70 126.36 1ux2 s GLU 96 Ca 0.81 -0.88 -0.29 0.00 0.36 0.00 0.00 54.97 54.97 1ux2 s GLU 96 Cb -0.42 -4.10 0.00 0.00 0.26 0.00 0.00 34.13 29.87 1ux2 s GLU 96 CO 0.36 -1.22 1.02 0.08 -0.54 0.00 0.00 175.26 174.97 1ux2 s VAL 97 N 2.64 4.72 -0.73 3.70 1.01 -1.26 -0.76 120.40 129.72 1ux2 s VAL 97 Ca 0.15 2.02 0.24 0.00 0.00 0.00 0.00 61.98 64.39 1ux2 s VAL 97 Cb -0.19 -4.31 -0.06 0.00 0.00 0.00 0.00 36.38 31.83 1ux2 s VAL 97 CO 0.12 -0.11 1.17 0.18 0.00 0.00 0.00 175.10 176.46 1ux2 n LEU 98 N 5.85 0.63 -4.50 3.92 4.77 0.13 -4.97 117.00 122.83 1ux2 n LEU 98 Ca 0.11 0.01 -0.24 0.00 -0.03 0.00 0.00 56.01 55.85 1ux2 n LEU 98 Cb 0.47 -0.15 -0.10 0.00 -2.33 0.00 0.00 43.42 41.32 1ux2 n LEU 98 CO 0.52 0.05 -0.45 0.42 -1.33 0.00 0.00 177.39 176.60 1ux2 s THR 99 N -3.13 2.54 0.22 -5.08 -4.23 -1.26 -4.99 115.64 99.71 1ux2 s THR 99 Ca 0.06 -2.33 -0.32 0.00 -1.18 0.00 0.00 61.69 57.93 1ux2 s THR 99 Cb 0.15 -2.41 -0.14 0.00 1.34 0.00 0.00 72.50 71.44 1ux2 s THR 99 CO 0.76 -0.37 1.37 -2.65 -0.54 0.00 0.00 174.62 173.20 1ux2 n PRO 100 N -0.68 1.86 -1.99 3.99 -0.02 -1.26 -4.84 135.00 132.07 1ux2 n PRO 100 Ca -0.05 0.66 -0.42 0.00 -2.02 0.00 0.00 63.50 61.68 1ux2 n PRO 100 Cb 0.60 -2.29 -0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1ux2 n PRO 100 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1ux2 n GLN 101 N 2.04 3.47 -4.74 -0.52 6.02 -1.26 -4.88 117.38 117.51 1ux2 n GLN 101 Ca 0.13 -3.07 -0.27 0.00 -0.01 0.00 0.00 57.00 53.78 1ux2 n GLN 101 Cb 0.30 -3.01 -0.14 0.00 1.02 0.00 0.00 30.24 28.41 1ux2 n GLN 101 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1ux2 s LEU 102 N 0.49 2.16 0.31 1.08 1.43 -1.26 -1.88 118.68 121.00 1ux2 s LEU 102 Ca 0.47 -0.54 0.10 0.00 -1.03 0.00 0.00 54.13 53.12 1ux2 s LEU 102 Cb 0.13 -1.07 -0.05 0.00 0.03 0.00 0.00 46.19 45.23 1ux2 s LEU 102 CO -0.05 0.19 -0.02 0.00 0.23 0.00 0.00 176.35 176.70 1ux2 s ALA 103 N -0.79 3.12 -0.19 4.21 0.00 0.24 -4.69 121.76 123.66 1ux2 s ALA 103 Ca 0.09 -1.85 -0.09 0.00 0.00 0.00 0.00 51.96 50.11 1ux2 s ALA 103 Cb -0.09 -0.49 -0.05 0.00 0.00 0.00 0.00 23.12 22.49 1ux2 s ALA 103 CO 0.02 0.16 0.10 0.50 0.00 0.00 0.00 175.76 176.54 1ux2 s ARG 104 N -3.67 4.05 -0.12 0.00 6.06 -0.10 -0.70 118.95 124.47 1ux2 s ARG 104 Ca 0.33 -0.28 0.02 0.00 -2.50 0.00 0.00 55.73 53.31 1ux2 s ARG 104 Cb -0.03 -3.31 0.01 0.00 0.06 0.00 0.00 34.95 31.68 1ux2 s ARG 104 CO 0.19 0.31 -0.18 0.08 -2.50 0.00 0.00 175.30 173.20 1ux2 s VAL 105 N 0.30 1.75 0.17 7.11 1.01 -0.23 -0.70 120.40 129.82 1ux2 s VAL 105 Ca 0.06 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.20 1ux2 s VAL 105 Cb -0.12 -1.57 -0.05 0.00 0.00 0.00 0.00 36.38 34.64 1ux2 s VAL 105 CO -0.01 0.49 0.41 -0.69 0.00 0.00 0.00 175.10 175.30 1ux2 s VAL 106 N 0.90 5.14 -0.33 2.92 1.01 -0.09 -1.39 120.40 128.55 1ux2 s VAL 106 Ca -0.07 0.02 0.17 0.00 0.00 0.00 0.00 61.98 62.10 1ux2 s VAL 106 Cb -0.15 -3.65 0.17 0.00 0.00 0.00 0.00 36.38 32.75 1ux2 s VAL 106 CO -0.01 -0.04 1.51 -1.54 0.00 0.00 0.00 175.10 175.02 1ux2 n SER 107 N -0.14 0.44 -0.56 3.32 3.41 0.13 -0.09 113.62 120.12 1ux2 n SER 107 Ca -0.02 0.70 0.12 0.00 -0.26 0.00 0.00 58.87 59.40 1ux2 n SER 107 Cb 0.52 -0.75 0.41 0.00 -0.26 0.00 0.00 64.21 64.14 1ux2 n SER 107 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1ux2 n ASP 108 N -2.10 1.70 0.00 4.04 5.68 -1.26 -1.89 116.55 122.72 1ux2 n ASP 108 Ca -0.01 -1.66 0.00 0.00 -0.50 0.00 0.00 54.79 52.62 1ux2 n ASP 108 Cb 0.05 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 39.96 1ux2 n ASP 108 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ux2 n GLY 109 N 1.16 0.61 3.72 6.12 0.00 0.87 -4.69 105.19 112.98 1ux2 n GLY 109 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1ux2 n GLY 109 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ux2 s GLU 110 N -0.85 4.36 -0.08 1.61 2.56 -1.24 0.22 118.70 125.27 1ux2 s GLU 110 Ca 0.00 2.01 0.03 0.00 0.00 0.00 0.00 54.97 57.01 1ux2 s GLU 110 Cb 0.00 -3.25 -0.02 0.00 2.00 0.00 0.00 34.13 32.86 1ux2 s GLU 110 CO 0.00 -0.35 -0.17 0.08 -0.56 0.00 0.00 175.26 174.26 1ux2 s VAL 111 N 0.85 2.79 -0.24 3.70 1.01 0.37 -0.92 120.40 127.96 1ux2 s VAL 111 Ca 0.61 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.82 1ux2 s VAL 111 Cb -0.35 -2.11 0.06 0.00 0.00 0.00 0.00 36.38 33.98 1ux2 s VAL 111 CO 0.32 0.56 -0.10 -0.76 0.00 0.00 0.00 175.10 175.12 1ux2 s LEU 112 N -0.15 3.03 -0.18 3.92 1.02 0.12 -2.05 118.68 124.39 1ux2 s LEU 112 Ca -0.02 -1.25 0.01 0.00 0.02 0.00 0.00 54.13 52.90 1ux2 s LEU 112 Cb -0.14 -1.42 0.02 0.00 0.02 0.00 0.00 46.19 44.67 1ux2 s LEU 112 CO 0.04 -0.19 -0.20 -0.47 0.02 0.00 0.00 176.35 175.55 1ux2 s TYR 113 N 1.22 2.77 -0.50 0.29 5.04 0.87 -0.92 117.35 126.12 1ux2 s TYR 113 Ca -0.07 -1.56 0.07 0.00 -2.44 0.00 0.00 57.07 53.07 1ux2 s TYR 113 Cb -0.19 -1.91 0.23 0.00 0.35 0.00 0.00 41.96 40.44 1ux2 s TYR 113 CO -0.06 -0.76 0.56 -0.12 -1.34 0.00 0.00 175.55 173.83 1ux2 n MET 114 N 4.54 1.31 -2.01 4.97 0.00 -1.26 -0.21 117.12 124.46 1ux2 n MET 114 Ca -0.21 -3.78 -0.40 0.00 -0.00 0.00 0.00 57.70 53.31 1ux2 n MET 114 Cb 0.50 -1.70 -0.00 0.00 0.00 0.00 0.00 33.22 32.02 1ux2 n MET 114 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 1ux2 s PRO 115 N -1.44 3.97 -0.14 2.12 0.04 -1.26 -4.74 135.00 133.55 1ux2 s PRO 115 Ca 0.35 2.22 -0.24 0.00 0.04 0.00 0.00 61.00 63.37 1ux2 s PRO 115 Cb 0.13 -2.78 -0.02 0.00 0.04 0.00 0.00 34.50 31.86 1ux2 s PRO 115 CO -0.10 -0.51 0.77 0.45 0.04 0.00 0.00 177.00 177.65 1ux2 s SER 116 N -0.65 6.93 -0.10 6.66 0.15 -1.26 -1.21 113.70 124.22 1ux2 s SER 116 Ca 0.57 1.14 0.04 0.00 0.70 0.00 0.00 55.95 58.39 1ux2 s SER 116 Cb -0.39 -2.43 -0.00 0.00 -1.71 0.00 0.00 66.02 61.48 1ux2 s SER 116 CO 0.51 -0.30 -0.23 -0.63 1.20 0.00 0.00 173.24 173.80 1ux2 s ILE 117 N 1.70 2.20 -0.24 6.45 1.01 0.91 0.20 121.20 133.44 1ux2 s ILE 117 Ca 0.37 -0.97 -0.09 0.00 0.00 0.00 0.00 60.65 59.96 1ux2 s ILE 117 Cb -0.17 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 1ux2 s ILE 117 CO 0.14 0.56 0.12 -0.60 0.00 0.00 0.00 174.94 175.16 1ux2 s ARG 118 N 0.27 3.90 0.01 2.79 3.52 0.07 -1.28 118.95 128.23 1ux2 s ARG 118 Ca -0.16 -0.36 -0.12 0.00 -0.13 0.00 0.00 55.73 54.96 1ux2 s ARG 118 Cb -0.17 -3.43 0.01 0.00 -1.56 0.00 0.00 34.95 29.80 1ux2 s ARG 118 CO 0.08 -0.02 0.24 -1.14 -0.81 0.00 0.00 175.30 173.66 1ux2 s GLN 119 N 1.22 0.64 -0.03 5.12 0.74 -0.77 -1.30 119.66 125.29 1ux2 s GLN 119 Ca 0.06 -0.36 -0.02 0.00 0.05 0.00 0.00 55.36 55.09 1ux2 s GLN 119 Cb -0.14 0.28 -0.04 0.00 1.10 0.00 0.00 33.01 34.21 1ux2 s GLN 119 CO 0.05 -0.18 0.10 1.03 -0.55 0.00 0.00 175.29 175.74 1ux2 s ARG 120 N -1.71 3.17 0.05 1.67 0.52 -1.26 -1.52 118.95 119.87 1ux2 s ARG 120 Ca -0.11 -0.41 0.04 0.00 -0.52 0.00 0.00 55.73 54.73 1ux2 s ARG 120 Cb -0.05 -2.94 -0.03 0.00 0.52 0.00 0.00 34.95 32.46 1ux2 s ARG 120 CO 0.01 0.67 -0.11 -0.06 0.02 0.00 0.00 175.30 175.84 1ux2 s PHE 121 N -1.18 0.94 -0.32 -0.53 0.08 0.44 -1.01 117.98 116.40 1ux2 s PHE 121 Ca 0.22 -0.46 -0.12 0.00 0.12 0.00 0.00 56.93 56.68 1ux2 s PHE 121 Cb -0.12 -0.54 -0.02 0.00 -0.57 0.00 0.00 43.02 41.76 1ux2 s PHE 121 CO 0.13 -0.01 0.22 0.45 -0.10 0.00 0.00 175.22 175.91 1ux2 s SER 122 N -1.60 6.00 0.33 1.36 0.15 -0.64 -1.19 113.70 118.11 1ux2 s SER 122 Ca -0.06 -0.35 -0.18 0.00 0.70 0.00 0.00 55.95 56.07 1ux2 s SER 122 Cb -0.10 -2.12 0.05 0.00 -1.71 0.00 0.00 66.02 62.14 1ux2 s SER 122 CO 0.01 -0.19 0.81 0.00 1.20 0.00 0.00 173.24 175.06 1ux2 s ASP 124 N -3.06 6.09 0.00 0.00 -1.08 -1.26 -4.31 116.67 113.04 1ux2 s ASP 124 Ca 0.15 1.07 0.20 0.00 -0.52 0.00 0.00 52.55 53.45 1ux2 s ASP 124 Cb -0.05 -2.53 -0.07 0.00 -1.46 0.00 0.00 42.92 38.81 1ux2 s ASP 124 CO 0.09 -1.59 0.94 0.52 0.52 0.00 0.00 175.17 175.66 1ux2 n VAL 125 N 7.26 0.00 -1.78 1.11 0.31 -1.26 -3.72 118.33 120.26 1ux2 n VAL 125 Ca 0.20 -0.21 -0.41 0.00 -0.01 0.00 0.00 64.34 63.90 1ux2 n VAL 125 Cb 0.47 1.16 -0.00 0.00 -0.91 0.00 0.00 33.84 34.56 1ux2 n VAL 125 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1ux2 s SER 126 N -2.43 6.32 0.00 4.52 1.04 -1.26 -2.20 113.70 119.70 1ux2 s SER 126 Ca 0.14 3.05 0.00 0.00 0.48 0.00 0.00 55.95 59.62 1ux2 s SER 126 Cb 0.16 -2.66 0.00 0.00 0.10 0.00 0.00 66.02 63.62 1ux2 s SER 126 CO 0.59 -0.90 0.00 0.61 0.98 0.00 0.00 173.24 174.52 1ux2 n GLY 127 N 0.86 0.77 0.37 7.32 0.00 -1.26 -4.15 105.19 109.09 1ux2 n GLY 127 Ca 0.03 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.19 1ux2 n GLY 127 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1ux2 h VAL 128 N 0.00 0.83 -0.91 1.61 3.04 -1.65 -1.43 116.25 117.74 1ux2 h VAL 128 Ca 0.00 -0.14 -0.43 0.00 -1.01 0.00 0.00 66.70 65.12 1ux2 h VAL 128 Cb 0.00 0.38 -0.25 0.00 -2.01 0.00 0.00 31.29 29.41 1ux2 h VAL 128 CO 0.00 0.07 0.53 -0.67 -1.01 0.00 0.00 177.57 176.49 1ux2 n ASP 129 N -4.47 4.01 -4.67 3.17 2.03 -1.26 -1.13 116.55 114.23 1ux2 n ASP 129 Ca 0.13 -3.51 -0.27 0.00 0.52 0.00 0.00 54.79 51.66 1ux2 n ASP 129 Cb 0.48 -0.81 -0.10 0.00 -0.72 0.00 0.00 41.12 39.98 1ux2 n ASP 129 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1ux2 s THR 130 N -3.22 2.14 0.33 5.18 -4.23 -0.54 -4.98 115.64 110.31 1ux2 s THR 130 Ca 0.56 -1.88 0.05 0.00 -1.18 0.00 0.00 61.69 59.23 1ux2 s THR 130 Cb 0.47 -2.99 0.13 0.00 1.34 0.00 0.00 72.50 71.45 1ux2 s THR 130 CO 0.11 -0.01 1.84 -0.33 -0.54 0.00 0.00 174.62 175.70 1ux2 h GLU 131 N 1.64 0.47 -0.02 3.99 5.08 -1.91 -2.69 114.58 121.13 1ux2 h GLU 131 Ca -0.43 -0.12 -0.14 0.00 -1.00 0.00 0.00 59.36 57.67 1ux2 h GLU 131 Cb 1.25 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 1ux2 h GLU 131 CO 0.76 0.56 -0.64 0.77 -1.00 0.00 0.00 179.01 179.47 1ux2 h SER 132 N 0.44 0.10 -4.03 1.42 0.02 -1.97 -3.49 113.55 106.05 1ux2 h SER 132 Ca 0.09 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1ux2 h SER 132 Cb 0.43 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1ux2 h SER 132 CO 0.02 0.71 0.00 0.61 -1.14 0.00 0.00 176.83 177.03 1ux2 n GLY 133 N 0.32 -1.24 3.92 -3.77 0.00 -1.02 -4.80 105.19 98.60 1ux2 n GLY 133 Ca -0.02 -1.55 -0.28 0.00 0.00 0.00 0.00 46.02 44.17 1ux2 n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ux2 s ALA 134 N -1.02 3.76 -0.32 4.61 0.00 0.62 -4.40 121.76 125.02 1ux2 s ALA 134 Ca 0.00 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.27 1ux2 s ALA 134 Cb 0.00 -2.10 0.09 0.00 0.00 0.00 0.00 23.12 21.11 1ux2 s ALA 134 CO 0.00 0.40 0.00 0.99 0.00 0.00 0.00 175.76 177.15 1ux2 s THR 135 N -1.92 2.29 -0.23 0.00 2.01 -1.25 -1.12 115.64 115.42 1ux2 s THR 135 Ca 0.40 -2.09 -0.17 0.00 0.31 0.00 0.00 61.69 60.15 1ux2 s THR 135 Cb -0.11 -2.57 -0.03 0.00 0.01 0.00 0.00 72.50 69.79 1ux2 s THR 135 CO 0.29 -0.41 0.45 0.00 -0.69 0.00 0.00 174.62 174.26 1ux2 s ARG 137 N 1.80 3.97 -0.16 0.00 0.52 -1.26 0.19 118.95 124.02 1ux2 s ARG 137 Ca 0.20 -0.34 0.01 0.00 -0.52 0.00 0.00 55.73 55.08 1ux2 s ARG 137 Cb -0.15 -3.30 0.01 0.00 0.52 0.00 0.00 34.95 32.03 1ux2 s ARG 137 CO 0.09 0.19 -0.19 0.42 0.02 0.00 0.00 175.30 175.83 1ux2 s ILE 138 N 0.63 2.32 -0.24 1.52 1.01 0.69 -4.86 121.20 122.27 1ux2 s ILE 138 Ca 0.04 -0.88 -0.08 0.00 0.00 0.00 0.00 60.65 59.73 1ux2 s ILE 138 Cb -0.13 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 1ux2 s ILE 138 CO 0.01 0.53 0.09 -0.54 0.00 0.00 0.00 174.94 175.03 1ux2 s LYS 139 N 0.94 3.78 -0.17 2.79 1.02 -1.26 -0.03 119.74 126.82 1ux2 s LYS 139 Ca -0.03 -0.42 0.01 0.00 0.02 0.00 0.00 55.97 55.55 1ux2 s LYS 139 Cb -0.15 -3.36 0.01 0.00 -0.52 0.00 0.00 37.83 33.81 1ux2 s LYS 139 CO -0.04 -0.08 -0.18 0.42 -0.92 0.00 0.00 175.35 174.56 1ux2 s ILE 140 N 1.34 2.28 0.26 2.17 1.01 0.07 0.59 121.20 128.93 1ux2 s ILE 140 Ca 0.05 -0.88 -0.05 0.00 0.00 0.00 0.00 60.65 59.78 1ux2 s ILE 140 Cb -0.15 -1.96 -0.02 0.00 0.01 0.00 0.00 42.46 40.35 1ux2 s ILE 140 CO 0.04 0.53 0.35 -0.83 0.00 0.00 0.00 174.94 175.03 1ux2 s GLY 141 N 1.12 1.20 0.25 6.18 0.00 -0.85 -1.15 107.32 114.07 1ux2 s GLY 141 Ca 0.01 -1.40 -0.30 0.00 0.00 0.00 0.00 44.72 43.03 1ux2 s GLY 141 CO -0.07 -1.04 1.51 -0.45 0.00 0.00 0.00 173.10 173.06 1ux2 s SER 142 N -3.15 6.55 0.19 1.64 0.15 -1.26 -0.55 113.70 117.28 1ux2 s SER 142 Ca 0.31 2.75 0.04 0.00 0.70 0.00 0.00 55.95 59.75 1ux2 s SER 142 Cb 0.02 -2.62 0.09 0.00 -1.71 0.00 0.00 66.02 61.80 1ux2 s SER 142 CO 0.14 -0.79 1.45 -0.25 1.20 0.00 0.00 173.24 174.99 1ux2 h TRP 143 N 5.34 0.27 0.00 3.44 2.91 -1.30 -3.39 115.95 123.21 1ux2 h TRP 143 Ca -0.46 -0.13 0.00 0.00 1.13 0.00 0.00 58.89 59.43 1ux2 h TRP 143 Cb 1.22 -0.04 0.00 0.00 -0.51 0.00 0.00 29.16 29.83 1ux2 h TRP 143 CO 0.61 0.89 0.00 0.25 -1.03 0.00 0.00 178.44 179.16 1ux2 n THR 144 N -3.73 0.00 -3.78 2.65 -2.24 -1.26 -5.01 114.28 100.91 1ux2 n THR 144 Ca -0.03 -0.30 -0.37 0.00 -2.27 0.00 0.00 64.05 61.09 1ux2 n THR 144 Cb 0.74 1.10 -0.13 0.00 -2.10 0.00 0.00 70.33 69.94 1ux2 n THR 144 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1ux2 s HIS 145 N -0.44 3.10 0.95 4.78 3.76 -1.26 -5.10 115.29 121.07 1ux2 s HIS 145 Ca 0.00 -0.78 -0.16 0.00 -0.15 0.00 0.00 55.06 53.97 1ux2 s HIS 145 Cb 0.00 -2.23 0.23 0.00 1.11 0.00 0.00 32.58 31.69 1ux2 s HIS 145 CO 0.00 -0.50 1.05 -2.39 -0.85 0.00 0.00 174.74 172.05 1ux2 n HIS 146 N 4.88 -3.89 0.30 1.40 1.44 -1.26 -4.52 115.22 113.56 1ux2 n HIS 146 Ca -0.16 -0.94 0.18 0.00 -2.01 0.00 0.00 57.72 54.79 1ux2 n HIS 146 Cb 0.50 -0.93 0.90 0.00 0.12 0.00 0.00 29.99 30.57 1ux2 n HIS 146 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 1ux2 h SER 147 N -1.98 0.00 1.09 4.39 4.64 -0.71 -0.34 113.55 120.65 1ux2 h SER 147 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1ux2 h SER 147 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1ux2 h SER 147 CO 0.25 0.04 -0.01 0.54 -0.87 0.00 0.00 176.83 176.77 1ux2 n ARG 148 N -3.30 0.06 -0.06 4.77 1.74 -1.26 -4.22 116.66 114.38 1ux2 n ARG 148 Ca -0.02 0.05 -0.10 0.00 -0.77 0.00 0.00 57.85 57.01 1ux2 n ARG 148 Cb 0.19 -1.57 -0.05 0.00 -1.02 0.00 0.00 32.46 30.01 1ux2 n ARG 148 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1ux2 n GLU 149 N -1.67 0.29 -3.85 5.56 1.02 -0.25 -3.17 120.64 118.57 1ux2 n GLU 149 Ca 0.07 0.08 -0.25 0.00 -0.02 0.00 0.00 57.16 57.04 1ux2 n GLU 149 Cb 0.36 -1.16 -0.17 0.00 -0.02 0.00 0.00 31.44 30.45 1ux2 n GLU 149 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1ux2 s ILE 150 N -2.24 0.76 -0.11 -3.67 1.01 -0.53 -0.35 121.20 116.07 1ux2 s ILE 150 Ca -0.17 -0.13 -0.10 0.00 0.00 0.00 0.00 60.65 60.26 1ux2 s ILE 150 Cb 0.05 -0.84 -0.05 0.00 0.01 0.00 0.00 42.46 41.63 1ux2 s ILE 150 CO 0.26 0.31 0.22 -0.94 0.00 0.00 0.00 174.94 174.80 1ux2 s SER 151 N 1.82 6.47 -0.15 3.58 1.04 -0.65 -4.14 113.70 121.67 1ux2 s SER 151 Ca 0.05 0.56 0.00 0.00 0.48 0.00 0.00 55.95 57.04 1ux2 s SER 151 Cb -0.12 -2.13 -0.00 0.00 0.10 0.00 0.00 66.02 63.86 1ux2 s SER 151 CO -0.07 0.33 -0.15 -0.69 0.98 0.00 0.00 173.24 173.64 1ux2 s VAL 152 N -0.69 2.73 0.03 5.02 1.01 -1.26 -0.91 120.40 126.33 1ux2 s VAL 152 Ca 0.16 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.41 1ux2 s VAL 152 Cb -0.13 -2.15 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 1ux2 s VAL 152 CO 0.05 0.52 -0.08 -1.81 0.00 0.00 0.00 175.10 173.78 1ux2 s ASP 153 N 0.71 0.91 0.24 3.32 1.01 -0.52 -4.68 116.67 117.67 1ux2 s ASP 153 Ca -0.07 -0.39 -0.30 0.00 0.71 0.00 0.00 52.55 52.51 1ux2 s ASP 153 Cb -0.16 -0.02 -0.09 0.00 1.01 0.00 0.00 42.92 43.66 1ux2 s ASP 153 CO 0.02 -0.08 1.28 -2.84 0.21 0.00 0.00 175.17 173.76 1ux2 s PRO 154 N -1.04 4.41 0.38 8.23 0.02 -1.26 -1.04 135.00 144.71 1ux2 s PRO 154 Ca -0.04 2.06 -0.24 0.00 0.02 0.00 0.00 61.00 62.80 1ux2 s PRO 154 Cb -0.07 -3.16 -0.09 0.00 0.02 0.00 0.00 34.50 31.19 1ux2 s PRO 154 CO 0.00 -0.17 1.01 -0.08 -0.33 0.00 0.00 177.00 177.42 1ux2 s THR 155 N -0.38 3.96 -0.27 0.99 -1.32 -1.18 -4.84 115.64 112.60 1ux2 s THR 155 Ca 0.53 1.49 -0.29 0.00 -1.21 0.00 0.00 61.69 62.21 1ux2 s THR 155 Cb -0.37 -3.76 -0.02 0.00 -1.51 0.00 0.00 72.50 66.84 1ux2 s THR 155 CO 0.42 -0.00 1.67 0.42 -2.21 0.00 0.00 174.62 174.92 1ux2 s THR 156 N -1.72 3.62 -0.26 5.08 -4.23 -1.26 -4.98 115.64 111.89 1ux2 s THR 156 Ca 0.56 0.68 0.00 0.00 -1.18 0.00 0.00 61.69 61.75 1ux2 s THR 156 Cb -0.19 -3.71 0.07 0.00 1.34 0.00 0.00 72.50 70.02 1ux2 s THR 156 CO 0.24 -0.36 0.00 -0.70 -0.54 0.00 0.00 174.62 173.27 1ux2 s GLU 157 N 5.03 1.29 0.38 3.99 2.56 -1.26 -4.98 118.70 125.71 1ux2 s GLU 157 Ca 0.74 -1.07 0.11 0.00 0.00 0.00 0.00 54.97 54.75 1ux2 s GLU 157 Cb -0.24 -2.49 0.77 0.00 2.00 0.00 0.00 34.13 34.18 1ux2 s GLU 157 CO 0.31 -0.74 1.88 -0.97 -0.56 0.00 0.00 175.26 175.19 1ux2 h ASN 158 N 7.97 0.12 -3.95 -1.70 -1.24 -2.07 -3.46 115.58 111.26 1ux2 h ASN 158 Ca -0.15 -0.03 -0.52 0.00 0.71 0.00 0.00 56.30 56.31 1ux2 h ASN 158 Cb 1.06 -0.03 0.08 0.00 0.73 0.00 0.00 38.32 40.15 1ux2 h ASN 158 CO 0.43 0.37 0.60 -0.94 -1.29 0.00 0.00 177.43 176.59 1ux2 s SER 159 N -6.92 6.34 0.66 1.15 1.04 -1.26 -4.98 113.70 109.74 1ux2 s SER 159 Ca -0.04 2.61 -0.17 0.00 0.48 0.00 0.00 55.95 58.82 1ux2 s SER 159 Cb 0.15 -2.63 -0.07 0.00 0.10 0.00 0.00 66.02 63.57 1ux2 s SER 159 CO 0.73 -0.82 0.45 -0.67 0.98 0.00 0.00 173.24 173.90 1ux2 n ASP 160 N 0.12 -1.42 -0.22 7.02 -0.08 -1.26 -4.94 116.55 115.77 1ux2 n ASP 160 Ca 0.04 0.63 -0.07 0.00 -1.51 0.00 0.00 54.79 53.88 1ux2 n ASP 160 Cb 0.44 -1.17 0.03 0.00 2.34 0.00 0.00 41.12 42.77 1ux2 n ASP 160 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 1ux2 h ASP 161 N -0.15 0.87 -0.17 1.67 3.32 -1.96 -3.06 116.42 116.95 1ux2 h ASP 161 Ca -0.45 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.42 1ux2 h ASP 161 Cb 1.37 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.70 1ux2 h ASP 161 CO 0.43 0.81 0.00 -1.20 -1.72 0.00 0.00 179.24 177.57 1ux2 n SER 162 N -4.43 2.08 -0.32 6.45 7.64 -1.26 -4.60 113.62 119.17 1ux2 n SER 162 Ca 0.04 -1.75 0.12 0.00 1.01 0.00 0.00 58.87 58.29 1ux2 n SER 162 Cb 0.18 -0.11 0.25 0.00 -1.01 0.00 0.00 64.21 63.52 1ux2 n SER 162 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1ux2 n GLU 163 N 0.60 -0.08 -0.04 1.43 4.07 -1.16 -1.62 120.64 123.85 1ux2 n GLU 163 Ca 0.17 1.40 0.03 0.00 -0.06 0.00 0.00 57.16 58.69 1ux2 n GLU 163 Cb 0.41 -2.20 0.05 0.00 -0.06 0.00 0.00 31.44 29.64 1ux2 n GLU 163 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1ux2 n TYR 164 N -5.39 0.10 -2.34 4.31 4.01 -1.26 -5.03 117.16 111.57 1ux2 n TYR 164 Ca 0.21 -0.25 -0.41 0.00 -0.16 0.00 0.00 57.90 57.30 1ux2 n TYR 164 Cb 0.67 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.65 1ux2 n TYR 164 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 1ux2 s PHE 165 N -0.71 3.38 0.15 -0.72 5.36 -0.64 -4.55 117.98 120.24 1ux2 s PHE 165 Ca 0.08 1.55 -0.31 0.00 -0.96 0.00 0.00 56.93 57.28 1ux2 s PHE 165 Cb 0.05 -3.44 -0.10 0.00 -0.34 0.00 0.00 43.02 39.19 1ux2 s PHE 165 CO 0.07 -1.12 1.61 0.45 -1.46 0.00 0.00 175.22 174.77 1ux2 s SER 166 N -0.54 6.57 0.06 6.13 0.15 0.10 -4.87 113.70 121.30 1ux2 s SER 166 Ca 0.48 2.61 0.19 0.00 0.70 0.00 0.00 55.95 59.93 1ux2 s SER 166 Cb -0.35 -2.59 0.78 0.00 -1.71 0.00 0.00 66.02 62.16 1ux2 s SER 166 CO 0.44 -0.86 1.59 0.00 1.20 0.00 0.00 173.24 175.61 1ux2 n GLN 167 N 4.41 0.05 0.00 5.44 10.64 -1.26 -3.19 117.38 133.46 1ux2 n GLN 167 Ca 0.15 0.25 0.11 0.00 -1.83 0.00 0.00 57.00 55.68 1ux2 n GLN 167 Cb 0.39 -1.59 0.05 0.00 -0.86 0.00 0.00 30.24 28.23 1ux2 n GLN 167 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1ux2 n TYR 168 N -1.68 0.00 -1.79 2.61 4.01 -1.26 -4.94 117.16 114.11 1ux2 n TYR 168 Ca 0.04 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.40 1ux2 n TYR 168 Cb 0.21 -0.01 0.04 0.00 -0.31 0.00 0.00 39.34 39.28 1ux2 n TYR 168 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1ux2 s SER 169 N -2.42 5.16 0.39 7.72 0.15 -1.19 -4.89 113.70 118.62 1ux2 s SER 169 Ca 0.20 2.72 0.28 0.00 0.70 0.00 0.00 55.95 59.86 1ux2 s SER 169 Cb 0.18 -2.63 1.31 0.00 -1.71 0.00 0.00 66.02 63.18 1ux2 s SER 169 CO 0.53 -1.64 1.85 0.03 1.20 0.00 0.00 173.24 175.21 1ux2 h ARG 170 N 1.29 0.00 -6.10 5.44 3.08 -1.92 -3.45 114.38 112.72 1ux2 h ARG 170 Ca -0.51 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 58.97 1ux2 h ARG 170 Cb 1.31 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.26 1ux2 h ARG 170 CO 0.56 0.00 -0.62 -0.06 -1.07 0.00 0.00 179.97 178.79 1ux2 s PHE 171 N -3.57 2.60 0.06 3.04 0.08 -1.26 -1.28 117.98 117.65 1ux2 s PHE 171 Ca 0.01 -0.36 0.04 0.00 0.12 0.00 0.00 56.93 56.73 1ux2 s PHE 171 Cb 0.09 -1.40 -0.03 0.00 -0.57 0.00 0.00 43.02 41.11 1ux2 s PHE 171 CO 0.38 0.51 -0.11 -1.83 -0.10 0.00 0.00 175.22 174.06 1ux2 s GLU 172 N -3.72 0.69 -0.11 0.44 -1.05 0.11 -4.81 118.70 110.26 1ux2 s GLU 172 Ca 0.34 -0.87 -0.19 0.00 -0.15 0.00 0.00 54.97 54.10 1ux2 s GLU 172 Cb -0.03 -0.59 -0.04 0.00 -0.44 0.00 0.00 34.13 33.03 1ux2 s GLU 172 CO 0.20 0.12 0.50 0.42 0.95 0.00 0.00 175.26 177.46 1ux2 s ILE 173 N -1.34 5.17 -0.19 1.83 1.01 -1.26 -1.76 121.20 124.66 1ux2 s ILE 173 Ca -0.05 1.01 -0.02 0.00 0.00 0.00 0.00 60.65 61.59 1ux2 s ILE 173 Cb -0.10 -3.84 -0.21 0.00 0.01 0.00 0.00 42.46 38.32 1ux2 s ILE 173 CO 0.01 0.32 0.05 0.18 0.00 0.00 0.00 174.94 175.50 1ux2 n LEU 174 N 3.67 2.77 -3.59 2.97 4.77 0.52 -4.92 117.00 123.18 1ux2 n LEU 174 Ca -0.06 0.02 -0.12 0.00 -0.03 0.00 0.00 56.01 55.82 1ux2 n LEU 174 Cb 0.52 -0.97 -0.06 0.00 -2.33 0.00 0.00 43.42 40.57 1ux2 n LEU 174 CO 0.44 0.89 0.65 -0.62 -1.33 0.00 0.00 177.39 177.42 1ux2 s ASP 175 N -6.73 -0.51 -0.19 -1.43 2.15 -1.02 -5.03 116.67 103.92 1ux2 s ASP 175 Ca -0.29 0.76 -0.02 0.00 0.43 0.00 0.00 52.55 53.44 1ux2 s ASP 175 Cb 0.08 0.70 0.06 0.00 -0.30 0.00 0.00 42.92 43.45 1ux2 s ASP 175 CO 0.68 -0.32 -0.00 -0.69 -0.17 0.00 0.00 175.17 174.67 1ux2 s VAL 176 N -0.49 0.85 0.15 1.11 1.01 -1.26 -0.42 120.40 121.36 1ux2 s VAL 176 Ca -0.02 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 61.32 1ux2 s VAL 176 Cb -0.02 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1ux2 s VAL 176 CO 0.01 -0.11 0.04 0.42 0.00 0.00 0.00 175.10 175.46 1ux2 s THR 177 N 1.72 4.05 0.04 3.92 -4.23 -0.74 -4.94 115.64 115.45 1ux2 s THR 177 Ca -0.02 -1.19 0.08 0.00 -1.18 0.00 0.00 61.69 59.38 1ux2 s THR 177 Cb -0.17 -3.02 -0.03 0.00 1.34 0.00 0.00 72.50 70.63 1ux2 s THR 177 CO -0.07 -0.04 -0.23 -1.10 -0.54 0.00 0.00 174.62 172.63 1ux2 s GLN 178 N -2.81 1.56 -0.12 3.99 -0.21 -1.26 -0.31 119.66 120.50 1ux2 s GLN 178 Ca 0.28 -1.01 -0.11 0.00 0.02 0.00 0.00 55.36 54.54 1ux2 s GLN 178 Cb -0.10 -1.70 0.03 0.00 1.00 0.00 0.00 33.01 32.24 1ux2 s GLN 178 CO 0.20 0.44 0.33 0.21 -2.12 0.00 0.00 175.29 174.35 1ux2 s LYS 179 N -1.19 0.39 -0.25 2.91 2.47 0.21 -4.96 119.74 119.32 1ux2 s LYS 179 Ca 0.09 0.44 -0.10 0.00 -1.56 0.00 0.00 55.97 54.85 1ux2 s LYS 179 Cb -0.09 0.19 -0.04 0.00 -1.46 0.00 0.00 37.83 36.42 1ux2 s LYS 179 CO 0.02 -0.05 0.14 0.21 0.16 0.00 0.00 175.35 175.83 1ux2 s LYS 180 N 0.14 3.91 0.28 4.03 2.20 -1.26 0.12 119.74 129.17 1ux2 s LYS 180 Ca -0.00 -0.35 0.10 0.00 -0.36 0.00 0.00 55.97 55.36 1ux2 s LYS 180 Cb -0.02 -3.51 -0.05 0.00 -1.51 0.00 0.00 37.83 32.74 1ux2 s LYS 180 CO 0.01 -0.08 -0.02 -0.80 -0.36 0.00 0.00 175.35 174.10 1ux2 s ASN 181 N 1.41 4.35 -0.06 1.43 0.01 0.49 -4.99 114.94 117.58 1ux2 s ASN 181 Ca 0.07 -0.77 -0.03 0.00 -0.71 0.00 0.00 52.86 51.42 1ux2 s ASN 181 Cb -0.15 -0.70 0.04 0.00 0.41 0.00 0.00 41.25 40.85 1ux2 s ASN 181 CO 0.07 -0.05 0.12 -0.55 -1.51 0.00 0.00 177.10 175.17 1ux2 s SER 182 N -3.67 0.72 0.09 -1.22 0.15 -1.26 -1.84 113.70 106.66 1ux2 s SER 182 Ca 0.32 0.23 0.09 0.00 0.70 0.00 0.00 55.95 57.29 1ux2 s SER 182 Cb -0.05 0.11 -0.03 0.00 -1.71 0.00 0.00 66.02 64.34 1ux2 s SER 182 CO 0.19 -0.23 -0.24 -0.69 1.20 0.00 0.00 173.24 173.48 1ux2 s VAL 183 N 2.03 1.95 -0.16 4.45 1.01 -0.45 -4.91 120.40 124.33 1ux2 s VAL 183 Ca 0.01 -1.50 -0.01 0.00 0.00 0.00 0.00 61.98 60.48 1ux2 s VAL 183 Cb -0.12 -1.72 -0.01 0.00 0.00 0.00 0.00 36.38 34.53 1ux2 s VAL 183 CO -0.05 0.13 -0.11 -0.89 0.00 0.00 0.00 175.10 174.19 1ux2 s THR 184 N -0.97 3.12 0.39 3.92 2.01 -1.26 -0.35 115.64 122.50 1ux2 s THR 184 Ca 0.10 -0.62 0.08 0.00 0.31 0.00 0.00 61.69 61.56 1ux2 s THR 184 Cb -0.10 -2.34 -0.00 0.00 0.01 0.00 0.00 72.50 70.07 1ux2 s THR 184 CO 0.04 0.50 0.49 -0.31 -0.69 0.00 0.00 174.62 174.65 1ux2 s TYR 185 N 0.70 2.87 0.22 4.92 1.51 -1.26 -5.03 117.35 121.28 1ux2 s TYR 185 Ca -0.05 -0.37 0.02 0.00 -1.01 0.00 0.00 57.07 55.66 1ux2 s TYR 185 Cb -0.15 -2.21 0.18 0.00 -0.11 0.00 0.00 41.96 39.67 1ux2 s TYR 185 CO 0.02 -0.23 1.52 0.77 -1.11 0.00 0.00 175.55 176.53 1ux2 h SER 186 N 0.82 0.36 -0.15 2.29 0.02 -2.00 -3.20 113.55 111.69 1ux2 h SER 186 Ca -0.42 -0.21 0.04 0.00 -0.84 0.00 0.00 61.79 60.36 1ux2 h SER 186 Cb 1.27 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 1ux2 h SER 186 CO 0.50 0.90 0.17 0.00 -1.14 0.00 0.00 176.83 177.26 1ux2 h PRO 189 N 6.86 1.19 -7.40 0.00 0.11 -1.86 -3.37 132.00 127.54 1ux2 h PRO 189 Ca -0.38 -0.12 -0.46 0.00 0.11 0.00 0.00 66.00 65.16 1ux2 h PRO 189 Cb 1.16 -0.24 0.11 0.00 0.11 0.00 0.00 31.00 32.13 1ux2 h PRO 189 CO 0.43 0.85 0.24 -1.21 -0.21 0.00 0.00 178.00 178.10 1ux2 s GLU 190 N -5.84 1.52 -0.13 1.05 0.41 -1.26 -4.96 118.70 109.48 1ux2 s GLU 190 Ca -0.12 -0.62 -0.08 0.00 -0.41 0.00 0.00 54.97 53.74 1ux2 s GLU 190 Cb 0.17 -2.13 -0.04 0.00 -1.78 0.00 0.00 34.13 30.35 1ux2 s GLU 190 CO 0.82 -1.68 0.14 0.00 -0.49 0.00 0.00 175.26 174.05 1ux2 s ALA 191 N -3.41 3.84 -0.14 5.21 0.00 -1.26 -4.45 121.76 121.56 1ux2 s ALA 191 Ca 0.67 -0.65 -0.01 0.00 0.00 0.00 0.00 51.96 51.97 1ux2 s ALA 191 Cb -0.07 -2.01 -0.02 0.00 0.00 0.00 0.00 23.12 21.02 1ux2 s ALA 191 CO 0.47 0.53 -0.12 0.71 0.00 0.00 0.00 175.76 177.35 1ux2 s TYR 192 N -0.75 2.85 0.19 0.00 2.02 0.53 -0.15 117.35 122.03 1ux2 s TYR 192 Ca 0.14 -0.60 -0.19 0.00 -0.37 0.00 0.00 57.07 56.04 1ux2 s TYR 192 Cb -0.12 -1.87 -0.08 0.00 -0.40 0.00 0.00 41.96 39.50 1ux2 s TYR 192 CO 0.03 -0.19 0.69 -1.21 -1.57 0.00 0.00 175.55 173.29 1ux2 s GLU 193 N 0.38 4.22 0.05 -0.62 2.02 -1.26 -1.34 118.70 122.15 1ux2 s GLU 193 Ca -0.10 0.81 -0.02 0.00 0.02 0.00 0.00 54.97 55.68 1ux2 s GLU 193 Cb -0.16 -2.94 -0.03 0.00 0.10 0.00 0.00 34.13 31.10 1ux2 s GLU 193 CO 0.05 0.44 0.01 0.16 0.02 0.00 0.00 175.26 175.94 1ux2 s ASP 194 N -1.58 0.39 -0.20 -0.19 -4.77 -0.77 -4.12 116.67 105.42 1ux2 s ASP 194 Ca 0.40 -0.86 -0.12 0.00 -3.30 0.00 0.00 52.55 48.67 1ux2 s ASP 194 Cb -0.17 0.21 -0.05 0.00 -1.09 0.00 0.00 42.92 41.83 1ux2 s ASP 194 CO 0.21 -0.58 0.23 -0.69 0.70 0.00 0.00 175.17 175.04 1ux2 s VAL 195 N -3.58 5.33 -0.32 2.11 1.01 -0.30 -0.38 120.40 124.27 1ux2 s VAL 195 Ca 0.04 0.38 -0.12 0.00 0.00 0.00 0.00 61.98 62.27 1ux2 s VAL 195 Cb 0.05 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.84 1ux2 s VAL 195 CO -0.09 0.36 0.22 -0.70 0.00 0.00 0.00 175.10 174.89 1ux2 s GLU 196 N 0.79 3.61 -0.27 2.72 2.12 0.33 -0.75 118.70 127.26 1ux2 s GLU 196 Ca 0.12 -0.56 -0.11 0.00 0.36 0.00 0.00 54.97 54.78 1ux2 s GLU 196 Cb -0.13 -3.74 -0.05 0.00 0.26 0.00 0.00 34.13 30.48 1ux2 s GLU 196 CO 0.03 -0.36 0.20 0.08 -0.54 0.00 0.00 175.26 174.67 1ux2 s VAL 197 N 1.72 5.31 -0.43 3.70 1.01 0.96 -0.62 120.40 132.05 1ux2 s VAL 197 Ca 0.06 0.21 -0.13 0.00 0.00 0.00 0.00 61.98 62.12 1ux2 s VAL 197 Cb -0.17 -3.54 0.05 0.00 0.00 0.00 0.00 36.38 32.72 1ux2 s VAL 197 CO 0.10 0.27 0.30 -0.44 0.00 0.00 0.00 175.10 175.33 1ux2 s SER 198 N 1.56 5.94 -0.53 3.32 0.01 0.58 -0.23 113.70 124.36 1ux2 s SER 198 Ca 0.08 -1.19 -0.20 0.00 1.31 0.00 0.00 55.95 55.95 1ux2 s SER 198 Cb -0.15 -2.10 0.06 0.00 0.21 0.00 0.00 66.02 64.03 1ux2 s SER 198 CO 0.09 -0.52 0.71 -0.22 0.41 0.00 0.00 173.24 173.71 1ux2 s LEU 199 N 1.59 4.80 -0.30 2.44 2.96 0.13 -1.80 118.68 128.50 1ux2 s LEU 199 Ca 0.04 -0.84 -0.19 0.00 -0.22 0.00 0.00 54.13 52.92 1ux2 s LEU 199 Cb -0.22 -2.51 -0.02 0.00 0.50 0.00 0.00 46.19 43.94 1ux2 s LEU 199 CO 0.06 -0.99 0.54 0.21 -1.32 0.00 0.00 176.35 174.85 1ux2 s ASN 200 N 2.82 6.42 0.09 3.68 2.47 0.44 -0.56 114.94 130.30 1ux2 s ASN 200 Ca 0.18 0.35 -0.13 0.00 0.42 0.00 0.00 52.86 53.68 1ux2 s ASN 200 Cb -0.18 -2.29 0.02 0.00 -1.45 0.00 0.00 41.25 37.35 1ux2 s ASN 200 CO 0.13 -0.39 0.31 0.72 -3.72 0.00 0.00 177.10 174.15 1ux2 s PHE 201 N 2.41 -0.07 0.06 0.43 -0.12 -0.28 -0.35 117.98 120.06 1ux2 s PHE 201 Ca 0.22 -0.24 -0.10 0.00 -0.05 0.00 0.00 56.93 56.75 1ux2 s PHE 201 Cb -0.15 0.12 0.01 0.00 -0.63 0.00 0.00 43.02 42.36 1ux2 s PHE 201 CO 0.11 -0.61 0.22 -0.98 -0.05 0.00 0.00 175.22 173.91 1ux2 s ARG 202 N -3.53 0.79 0.32 1.99 1.70 -0.72 -0.28 118.95 119.22 1ux2 s ARG 202 Ca 0.02 -0.74 -0.29 0.00 -0.47 0.00 0.00 55.73 54.25 1ux2 s ARG 202 Cb 0.02 0.33 -0.10 0.00 -0.57 0.00 0.00 34.95 34.63 1ux2 s ARG 202 CO -0.10 -0.25 1.33 0.21 -1.08 0.00 0.00 175.30 175.42 1ux2 s LYS 203 N -3.11 4.33 0.45 3.89 2.20 -0.28 -0.71 119.74 126.51 1ux2 s LYS 203 Ca -0.01 2.25 -0.24 0.00 -0.36 0.00 0.00 55.97 57.61 1ux2 s LYS 203 Cb 0.01 -3.07 -0.07 0.00 -1.51 0.00 0.00 37.83 33.19 1ux2 s LYS 203 CO -0.07 -0.24 1.23 0.15 -0.36 0.00 0.00 175.35 176.06 1ux2 s LYS 204 N -1.64 3.75 0.00 4.03 1.02 -0.41 -4.83 119.74 121.67 1ux2 s LYS 204 Ca 0.50 1.94 0.27 0.00 0.02 0.00 0.00 55.97 58.71 1ux2 s LYS 204 Cb -0.40 -2.50 0.84 0.00 -0.52 0.00 0.00 37.83 35.24 1ux2 s LYS 204 CO 0.52 -0.61 1.63 0.41 -0.92 0.00 0.00 175.35 176.38