#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ux2 h GLU 0 N 0.00 -0.14 -4.90 5.55 4.81 -1.61 -3.43 114.58 114.85 1ux2 h GLU 0 Ca 0.00 0.01 -0.66 0.00 -0.13 0.00 0.00 59.36 58.58 1ux2 h GLU 0 Cb 0.00 0.03 -0.25 0.00 0.63 0.00 0.00 28.75 29.17 1ux2 h GLU 0 CO 0.00 -0.09 -0.64 -0.06 -0.73 0.00 0.00 179.01 177.49 1ux2 s PHE 1 N -1.95 3.09 0.86 0.92 0.08 -1.26 -5.07 117.98 114.65 1ux2 s PHE 1 Ca -0.02 -0.69 -0.13 0.00 0.12 0.00 0.00 56.93 56.21 1ux2 s PHE 1 Cb 0.00 -2.23 0.13 0.00 -0.57 0.00 0.00 43.02 40.35 1ux2 s PHE 1 CO 0.06 -0.46 1.22 0.16 -0.10 0.00 0.00 175.22 176.10 1ux2 s ASP 2 N 1.56 3.94 0.35 1.36 1.47 -1.26 -4.22 116.67 119.87 1ux2 s ASP 2 Ca 0.05 0.51 0.05 0.00 1.18 0.00 0.00 52.55 54.34 1ux2 s ASP 2 Cb -0.16 -0.82 0.71 0.00 -0.34 0.00 0.00 42.92 42.32 1ux2 s ASP 2 CO 0.02 -2.23 1.95 0.03 0.68 0.00 0.00 175.17 175.63 1ux2 h ARG 3 N -1.25 0.77 -0.73 2.11 3.08 -1.98 -0.41 114.38 115.97 1ux2 h ARG 3 Ca -0.45 -0.05 0.06 0.00 0.07 0.00 0.00 59.98 59.62 1ux2 h ARG 3 Cb 1.29 -0.17 -0.06 0.00 0.08 0.00 0.00 29.97 31.10 1ux2 h ARG 3 CO 0.53 0.51 0.42 0.00 -1.07 0.00 0.00 179.97 180.36 1ux2 h ALA 4 N 1.59 0.99 -0.35 0.04 0.00 -1.99 -0.89 119.26 118.65 1ux2 h ALA 4 Ca 0.32 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 55.09 1ux2 h ALA 4 Cb 0.25 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ux2 h ALA 4 CO -0.11 0.10 -0.39 -0.44 0.00 0.00 0.00 179.25 178.41 1ux2 h ASP 5 N 0.75 0.95 -0.34 0.00 3.32 -1.46 -0.53 116.42 119.12 1ux2 h ASP 5 Ca 0.33 -0.48 -0.02 0.00 0.02 0.00 0.00 57.03 56.88 1ux2 h ASP 5 Cb 0.21 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1ux2 h ASP 5 CO -0.19 1.24 0.13 0.40 -1.72 0.00 0.00 179.24 179.10 1ux2 h ILE 6 N 0.69 1.19 -0.46 0.35 2.04 -1.16 -0.51 117.51 119.64 1ux2 h ILE 6 Ca 0.05 -0.57 -0.07 0.00 1.00 0.00 0.00 64.86 65.27 1ux2 h ILE 6 Cb 0.98 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 1ux2 h ILE 6 CO 0.09 0.20 0.02 -0.07 0.00 0.00 0.00 178.15 178.40 1ux2 h LEU 7 N 0.40 0.78 0.01 1.44 3.38 -1.14 -0.98 115.31 119.20 1ux2 h LEU 7 Ca 0.11 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 57.81 1ux2 h LEU 7 Cb 0.19 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1ux2 h LEU 7 CO -0.01 0.88 -0.12 0.22 0.09 0.00 0.00 178.44 179.50 1ux2 h TYR 8 N 0.65 -0.32 -0.65 1.13 3.20 -1.03 -0.69 116.97 119.27 1ux2 h TYR 8 Ca 0.13 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.05 1ux2 h TYR 8 Cb 0.46 0.14 -0.05 0.00 1.54 0.00 0.00 36.73 38.83 1ux2 h TYR 8 CO 0.03 -0.19 0.38 -0.91 -1.64 0.00 0.00 178.16 175.84 1ux2 h ASN 9 N -0.22 0.60 -0.38 -2.11 2.35 -0.98 -0.70 115.58 114.14 1ux2 h ASN 9 Ca 0.04 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1ux2 h ASN 9 Cb 0.26 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 1ux2 h ASN 9 CO -0.11 0.41 0.22 0.40 -1.65 0.00 0.00 177.43 176.69 1ux2 h ILE 10 N 0.73 1.14 -0.31 2.81 2.04 -0.94 -2.37 117.51 120.62 1ux2 h ILE 10 Ca 0.27 -0.36 -0.11 0.00 1.00 0.00 0.00 64.86 65.67 1ux2 h ILE 10 Cb 0.09 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 1ux2 h ILE 10 CO -0.14 0.14 -0.27 -0.09 0.00 0.00 0.00 178.15 177.80 1ux2 h ARG 11 N 0.49 0.61 0.00 2.37 2.43 -0.70 0.23 114.38 119.82 1ux2 h ARG 11 Ca 0.14 -0.25 -0.05 0.00 -0.81 0.00 0.00 59.98 59.01 1ux2 h ARG 11 Cb 0.04 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1ux2 h ARG 11 CO -0.02 0.82 -0.23 1.96 -1.51 0.00 0.00 179.97 180.99 1ux2 h GLN 12 N 0.53 0.00 0.00 0.20 1.08 -1.04 -3.39 115.11 112.50 1ux2 h GLN 12 Ca 0.07 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1ux2 h GLN 12 Cb 0.74 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.17 1ux2 h GLN 12 CO 0.06 0.23 -0.11 0.25 -0.95 0.00 0.00 178.83 178.30 1ux2 n THR 13 N -3.27 0.00 -2.24 -0.54 -2.24 -0.90 -5.01 114.28 100.08 1ux2 n THR 13 Ca 0.01 -0.21 -0.41 0.00 -2.27 0.00 0.00 64.05 61.16 1ux2 n THR 13 Cb 0.51 0.85 -0.03 0.00 -2.10 0.00 0.00 70.33 69.55 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 -0.66 6.91 -0.59 3.42 0.15 0.78 -4.97 113.70 118.74 1ux2 s SER 14 Ca 0.00 2.36 -0.04 0.00 0.70 0.00 0.00 55.95 58.97 1ux2 s SER 14 Cb 0.00 -2.60 0.15 0.00 -1.71 0.00 0.00 66.02 61.86 1ux2 s SER 14 CO 0.00 -0.53 0.41 -0.13 1.20 0.00 0.00 173.24 174.19 1ux2 s ARG 15 N 0.11 2.52 0.24 5.44 0.52 -1.26 -4.94 118.95 121.57 1ux2 s ARG 15 Ca 0.58 -2.36 0.21 0.00 -0.52 0.00 0.00 55.73 53.64 1ux2 s ARG 15 Cb -0.36 -3.76 0.95 0.00 0.52 0.00 0.00 34.95 32.31 1ux2 s ARG 15 CO 0.36 -1.16 1.65 -2.30 0.02 0.00 0.00 175.30 173.87 1ux2 n PRO 16 N 3.79 0.16 -0.20 3.54 -0.02 -1.26 -1.24 135.00 139.76 1ux2 n PRO 16 Ca 0.05 0.47 0.11 0.00 -2.02 0.00 0.00 63.50 62.11 1ux2 n PRO 16 Cb 0.39 -1.84 0.26 0.00 -0.02 0.00 0.00 33.50 32.29 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 -2.15 3.03 -4.25 2.55 8.00 -1.26 -3.92 116.55 118.55 1ux2 n ASP 17 Ca 0.01 -1.94 -0.36 0.00 0.71 0.00 0.00 54.79 53.22 1ux2 n ASP 17 Cb 0.17 -0.27 -0.13 0.00 -0.02 0.00 0.00 41.12 40.86 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 -1.47 3.34 0.12 2.53 1.01 -0.38 -5.09 120.40 120.47 1ux2 s VAL 18 Ca 0.38 -1.01 -0.31 0.00 0.00 0.00 0.00 61.98 61.04 1ux2 s VAL 18 Cb 0.21 -2.77 -0.10 0.00 0.00 0.00 0.00 36.38 33.72 1ux2 s VAL 18 CO 0.29 0.06 1.76 -0.51 0.00 0.00 0.00 175.10 176.71 1ux2 s ILE 19 N 1.37 2.58 -0.83 2.22 2.07 -1.26 -4.84 121.20 122.52 1ux2 s ILE 19 Ca -0.00 0.16 -0.08 0.00 -1.41 0.00 0.00 60.65 59.32 1ux2 s ILE 19 Cb -0.18 -3.10 -0.14 0.00 0.13 0.00 0.00 42.46 39.16 1ux2 s ILE 19 CO -0.01 0.00 3.20 -0.81 -1.91 0.00 0.00 174.94 175.42 1ux2 n PRO 20 N 5.35 2.95 -1.65 3.50 -0.04 -1.26 -4.93 135.00 138.92 1ux2 n PRO 20 Ca 0.17 -1.78 -0.35 0.00 -0.04 0.00 0.00 63.50 61.50 1ux2 n PRO 20 Cb 0.38 -2.40 0.07 0.00 -0.04 0.00 0.00 33.50 31.51 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 1.16 2.39 -0.03 0.52 -4.23 -1.26 -4.82 115.64 109.37 1ux2 s THR 21 Ca 0.67 0.21 -0.01 0.00 -1.18 0.00 0.00 61.69 61.38 1ux2 s THR 21 Cb 0.25 -2.90 0.03 0.00 1.34 0.00 0.00 72.50 71.22 1ux2 s THR 21 CO -0.05 -0.08 0.07 -1.58 -0.54 0.00 0.00 174.62 172.44 1ux2 s GLN 22 N -3.68 0.02 -0.85 3.99 0.74 -1.26 -4.84 119.66 113.78 1ux2 s GLN 22 Ca 0.76 0.22 -0.04 0.00 0.05 0.00 0.00 55.36 56.36 1ux2 s GLN 22 Cb -0.30 -0.18 0.03 0.00 1.10 0.00 0.00 33.01 33.66 1ux2 s GLN 22 CO 0.41 -0.14 0.16 0.54 -0.55 0.00 0.00 175.29 175.71 1ux2 n ARG 23 N 4.00 -2.68 -1.76 1.67 1.74 -1.26 -0.72 116.66 117.63 1ux2 n ARG 23 Ca -0.25 0.37 -0.12 0.00 -0.77 0.00 0.00 57.85 57.08 1ux2 n ARG 23 Cb 0.52 -4.97 -0.03 0.00 -1.02 0.00 0.00 32.46 26.96 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 -1.88 -3.36 -4.90 0.55 2.03 -1.26 -4.97 116.55 102.76 1ux2 n ASP 24 Ca -0.06 0.26 -0.29 0.00 0.52 0.00 0.00 54.79 55.22 1ux2 n ASP 24 Cb 0.55 -3.06 -0.03 0.00 -0.72 0.00 0.00 41.12 37.86 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 -3.78 3.67 0.57 -0.67 0.52 0.10 -4.98 118.95 114.38 1ux2 s ARG 25 Ca 0.00 0.12 -0.19 0.00 -0.52 0.00 0.00 55.73 55.14 1ux2 s ARG 25 Cb 0.00 -2.59 -0.05 0.00 0.52 0.00 0.00 34.95 32.83 1ux2 s ARG 25 CO 0.00 0.17 1.14 -1.25 0.02 0.00 0.00 175.30 175.37 1ux2 s PRO 26 N -3.57 3.22 -0.07 3.54 0.04 -1.22 -4.03 135.00 132.91 1ux2 s PRO 26 Ca 0.46 1.61 -0.30 0.00 0.04 0.00 0.00 61.00 62.81 1ux2 s PRO 26 Cb -0.11 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 1ux2 s PRO 26 CO 0.30 -0.95 1.35 0.08 0.04 0.00 0.00 177.00 177.81 1ux2 s VAL 27 N -1.83 3.98 -0.55 -0.36 1.01 0.71 -4.78 120.40 118.58 1ux2 s VAL 27 Ca 0.73 1.28 -0.26 0.00 0.00 0.00 0.00 61.98 63.72 1ux2 s VAL 27 Cb -0.24 -3.83 0.03 0.00 0.00 0.00 0.00 36.38 32.35 1ux2 s VAL 27 CO 0.30 -0.05 1.07 0.00 0.00 0.00 0.00 175.10 176.42 1ux2 s ALA 28 N 2.89 3.09 -0.24 5.51 0.00 -1.26 -1.61 121.76 130.14 1ux2 s ALA 28 Ca 0.61 -0.96 -0.10 0.00 0.00 0.00 0.00 51.96 51.50 1ux2 s ALA 28 Cb -0.27 -3.87 -0.05 0.00 0.00 0.00 0.00 23.12 18.92 1ux2 s ALA 28 CO 0.22 -2.47 0.15 0.08 0.00 0.00 0.00 175.76 173.75 1ux2 s VAL 29 N 4.42 5.28 -0.09 0.00 1.01 -0.28 -4.39 120.40 126.35 1ux2 s VAL 29 Ca 0.38 0.15 -0.13 0.00 0.00 0.00 0.00 61.98 62.38 1ux2 s VAL 29 Cb -0.10 -3.47 -0.05 0.00 0.00 0.00 0.00 36.38 32.77 1ux2 s VAL 29 CO 0.24 0.34 0.32 -0.44 0.00 0.00 0.00 175.10 175.55 1ux2 s SER 30 N 1.12 6.57 -0.05 3.32 0.01 0.30 -1.28 113.70 123.70 1ux2 s SER 30 Ca 0.07 0.68 0.01 0.00 1.31 0.00 0.00 55.95 58.03 1ux2 s SER 30 Cb -0.14 -2.19 0.02 0.00 0.21 0.00 0.00 66.02 63.92 1ux2 s SER 30 CO 0.05 0.23 -0.07 -0.69 0.41 0.00 0.00 173.24 173.16 1ux2 s VAL 31 N -0.32 0.77 -0.07 3.43 1.01 0.78 -1.39 120.40 124.61 1ux2 s VAL 31 Ca 0.19 -0.26 -0.03 0.00 0.00 0.00 0.00 61.98 61.89 1ux2 s VAL 31 Cb -0.14 -0.76 0.04 0.00 0.00 0.00 0.00 36.38 35.52 1ux2 s VAL 31 CO 0.08 0.28 0.13 -0.55 0.00 0.00 0.00 175.10 175.04 1ux2 s SER 32 N 0.86 0.54 -0.13 3.32 0.15 0.02 -3.25 113.70 115.21 1ux2 s SER 32 Ca -0.12 0.27 -0.21 0.00 0.70 0.00 0.00 55.95 56.59 1ux2 s SER 32 Cb -0.15 0.18 -0.03 0.00 -1.71 0.00 0.00 66.02 64.30 1ux2 s SER 32 CO 0.01 -0.21 0.62 -0.76 1.20 0.00 0.00 173.24 174.09 1ux2 s LEU 33 N 1.92 4.24 -0.30 3.45 1.43 -1.26 -0.95 118.68 127.21 1ux2 s LEU 33 Ca -0.01 0.96 -0.05 0.00 -1.03 0.00 0.00 54.13 54.01 1ux2 s LEU 33 Cb -0.12 -2.91 0.03 0.00 0.03 0.00 0.00 46.19 43.22 1ux2 s LEU 33 CO -0.05 -0.14 0.05 -0.54 0.23 0.00 0.00 176.35 175.89 1ux2 s LYS 34 N 1.15 2.76 0.10 1.70 -0.14 -0.41 -4.96 119.74 119.95 1ux2 s LYS 34 Ca 0.31 -1.06 -0.30 0.00 -1.36 0.00 0.00 55.97 53.56 1ux2 s LYS 34 Cb -0.16 -3.29 -0.06 0.00 -1.68 0.00 0.00 37.83 32.64 1ux2 s LYS 34 CO 0.13 -0.54 0.99 -0.06 -0.76 0.00 0.00 175.35 175.11 1ux2 s PHE 35 N 1.39 3.75 -0.11 3.18 0.08 -1.26 0.02 117.98 125.03 1ux2 s PHE 35 Ca -0.01 1.75 0.02 0.00 0.12 0.00 0.00 56.93 58.80 1ux2 s PHE 35 Cb -0.18 -3.10 -0.08 0.00 -0.57 0.00 0.00 43.02 39.09 1ux2 s PHE 35 CO 0.01 0.03 -0.08 -0.89 -0.10 0.00 0.00 175.22 174.19 1ux2 n ILE 36 N 2.95 0.62 -3.58 0.64 2.08 0.25 -3.34 119.36 118.98 1ux2 n ILE 36 Ca 0.03 -0.25 -0.17 0.00 0.56 0.00 0.00 62.75 62.92 1ux2 n ILE 36 Cb 0.49 -0.87 -0.07 0.00 -0.75 0.00 0.00 39.64 38.44 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 -4.93 -0.54 -0.23 4.38 3.84 -0.83 0.10 114.94 116.72 1ux2 s ASN 37 Ca -0.13 0.56 -0.00 0.00 0.21 0.00 0.00 52.86 53.50 1ux2 s ASN 37 Cb 0.04 0.49 0.03 0.00 -0.55 0.00 0.00 41.25 41.25 1ux2 s ASN 37 CO 0.26 -0.57 -0.10 -0.63 -2.79 0.00 0.00 177.10 173.28 1ux2 s ILE 38 N -1.21 2.57 -0.23 -5.21 1.01 -1.26 -0.83 121.20 116.04 1ux2 s ILE 38 Ca -0.12 -1.11 0.06 0.00 0.00 0.00 0.00 60.65 59.48 1ux2 s ILE 38 Cb -0.01 -2.29 -0.20 0.00 0.01 0.00 0.00 42.46 39.96 1ux2 s ILE 38 CO 0.08 0.23 -0.08 0.18 0.00 0.00 0.00 174.94 175.36 1ux2 n LEU 39 N 4.61 2.04 -3.69 2.97 4.77 0.64 -4.60 117.00 123.74 1ux2 n LEU 39 Ca -0.17 -0.06 -0.12 0.00 -0.03 0.00 0.00 56.01 55.62 1ux2 n LEU 39 Cb 0.47 -0.49 -0.09 0.00 -2.33 0.00 0.00 43.42 40.98 1ux2 n LEU 39 CO 0.26 0.79 0.20 -0.70 -1.33 0.00 0.00 177.39 176.61 1ux2 s GLU 40 N -2.52 0.59 -0.00 3.23 2.12 -1.15 -4.99 118.70 115.98 1ux2 s GLU 40 Ca -0.26 0.79 0.01 0.00 0.36 0.00 0.00 54.97 55.87 1ux2 s GLU 40 Cb 0.08 0.23 -0.00 0.00 0.26 0.00 0.00 34.13 34.70 1ux2 s GLU 40 CO 0.68 -0.09 -0.04 0.08 -0.54 0.00 0.00 175.26 175.35 1ux2 s VAL 41 N 0.58 0.29 -0.21 3.70 1.01 -1.26 -0.56 120.40 123.95 1ux2 s VAL 41 Ca -0.02 -0.22 -0.04 0.00 0.00 0.00 0.00 61.98 61.70 1ux2 s VAL 41 Cb -0.05 -0.26 0.07 0.00 0.00 0.00 0.00 36.38 36.15 1ux2 s VAL 41 CO -0.03 0.04 0.09 0.21 0.00 0.00 0.00 175.10 175.41 1ux2 s ASN 42 N -0.19 2.87 0.37 3.32 3.84 -0.65 -5.02 114.94 119.48 1ux2 s ASN 42 Ca 0.00 -0.89 0.19 0.00 0.21 0.00 0.00 52.86 52.38 1ux2 s ASN 42 Cb -0.02 -0.40 0.61 0.00 -0.55 0.00 0.00 41.25 40.90 1ux2 s ASN 42 CO -0.00 -0.36 1.70 -0.08 -2.79 0.00 0.00 177.10 175.56 1ux2 h GLU 43 N 8.35 0.00 -0.03 0.43 4.81 -1.88 0.21 114.58 126.47 1ux2 h GLU 43 Ca -0.16 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.05 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 0.35 0.37 -0.05 0.82 -0.73 0.00 0.00 179.01 179.77 1ux2 h ILE 44 N 0.00 1.41 0.00 2.32 1.08 -1.97 -3.31 117.51 117.04 1ux2 h ILE 44 Ca -0.00 -1.30 0.00 0.00 -0.39 0.00 0.00 64.86 63.17 1ux2 h ILE 44 Cb 0.96 2.21 0.00 0.00 -3.07 0.00 0.00 36.82 36.92 1ux2 h ILE 44 CO 0.05 0.35 -0.48 0.35 -0.69 0.00 0.00 178.15 177.72 1ux2 n THR 45 N -4.75 0.07 -3.44 -0.27 -2.24 -1.20 -4.98 114.28 97.47 1ux2 n THR 45 Ca -0.08 -0.06 -0.18 0.00 -2.27 0.00 0.00 64.05 61.46 1ux2 n THR 45 Cb 0.30 0.10 0.07 0.00 -2.10 0.00 0.00 70.33 68.71 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 -1.63 -3.22 -4.08 3.42 3.02 0.04 -4.94 115.26 107.87 1ux2 n ASN 46 Ca 0.05 -0.70 -0.21 0.00 -0.03 0.00 0.00 54.58 53.70 1ux2 n ASN 46 Cb 0.36 -4.89 -0.15 0.00 -0.61 0.00 0.00 39.78 34.49 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 -5.24 1.01 0.05 3.52 2.02 -1.06 -2.08 118.70 116.91 1ux2 s GLU 47 Ca 0.14 -0.44 0.05 0.00 0.02 0.00 0.00 54.97 54.74 1ux2 s GLU 47 Cb -0.02 -0.97 -0.02 0.00 0.10 0.00 0.00 34.13 33.21 1ux2 s GLU 47 CO 0.75 0.27 -0.15 0.14 0.02 0.00 0.00 175.26 176.29 1ux2 s VAL 48 N -0.29 1.21 -0.23 2.63 -7.23 -0.41 -1.64 120.40 114.45 1ux2 s VAL 48 Ca 0.05 -1.10 -0.01 0.00 -1.81 0.00 0.00 61.98 59.11 1ux2 s VAL 48 Cb -0.05 -1.10 0.03 0.00 0.56 0.00 0.00 36.38 35.82 1ux2 s VAL 48 CO -0.00 -0.01 -0.10 -0.62 -0.31 0.00 0.00 175.10 174.05 1ux2 s ASP 49 N -1.28 4.02 0.10 4.85 -1.08 0.28 -0.29 116.67 123.28 1ux2 s ASP 49 Ca 0.02 -0.83 0.04 0.00 -0.52 0.00 0.00 52.55 51.26 1ux2 s ASP 49 Cb -0.08 -1.61 -0.04 0.00 -1.46 0.00 0.00 42.92 39.73 1ux2 s ASP 49 CO 0.02 -0.09 -0.11 0.68 0.52 0.00 0.00 175.17 176.19 1ux2 s VAL 50 N 1.30 1.01 -0.14 1.11 -7.23 -0.56 -0.26 120.40 115.63 1ux2 s VAL 50 Ca 0.01 -1.69 0.01 0.00 -1.81 0.00 0.00 61.98 58.50 1ux2 s VAL 50 Cb -0.16 -1.43 -0.00 0.00 0.56 0.00 0.00 36.38 35.35 1ux2 s VAL 50 CO -0.07 -0.56 -0.18 -0.69 -0.31 0.00 0.00 175.10 173.29 1ux2 s VAL 51 N -2.49 2.47 0.03 1.32 1.01 -0.01 -1.15 120.40 121.58 1ux2 s VAL 51 Ca 0.07 -0.85 -0.06 0.00 0.00 0.00 0.00 61.98 61.14 1ux2 s VAL 51 Cb -0.03 -2.01 -0.01 0.00 0.00 0.00 0.00 36.38 34.34 1ux2 s VAL 51 CO 0.00 0.53 0.11 0.72 0.00 0.00 0.00 175.10 176.47 1ux2 s PHE 52 N 0.65 0.15 -0.21 5.22 -0.12 -0.64 -0.58 117.98 122.46 1ux2 s PHE 52 Ca -0.09 -0.40 -0.20 0.00 -0.05 0.00 0.00 56.93 56.19 1ux2 s PHE 52 Cb -0.16 -0.11 -0.03 0.00 -0.63 0.00 0.00 43.02 42.09 1ux2 s PHE 52 CO 0.02 -0.36 0.58 -1.58 -0.05 0.00 0.00 175.22 173.84 1ux2 s TRP 53 N -2.34 3.36 -1.06 3.49 0.51 0.10 -0.79 118.94 122.20 1ux2 s TRP 53 Ca -0.07 0.84 -0.13 0.00 -2.12 0.00 0.00 56.10 54.61 1ux2 s TRP 53 Cb -0.03 -2.75 0.20 0.00 -0.81 0.00 0.00 33.47 30.09 1ux2 s TRP 53 CO -0.03 -0.17 1.17 -1.14 -0.51 0.00 0.00 176.95 176.27 1ux2 s GLN 54 N 1.89 3.96 -0.28 4.98 0.74 -0.29 -1.28 119.66 129.36 1ux2 s GLN 54 Ca 0.26 -2.61 -0.29 0.00 0.05 0.00 0.00 55.36 52.77 1ux2 s GLN 54 Cb -0.16 -4.77 -0.02 0.00 1.10 0.00 0.00 33.01 29.16 1ux2 s GLN 54 CO 0.10 -1.53 1.63 -1.14 -0.55 0.00 0.00 175.29 173.80 1ux2 s GLN 55 N 0.67 3.63 -0.11 1.67 0.74 -0.12 -3.91 119.66 122.22 1ux2 s GLN 55 Ca 0.33 1.47 0.02 0.00 0.05 0.00 0.00 55.36 57.23 1ux2 s GLN 55 Cb -0.07 -4.08 0.01 0.00 1.10 0.00 0.00 33.01 29.98 1ux2 s GLN 55 CO -0.06 -1.50 -0.16 0.99 -0.55 0.00 0.00 175.29 174.01 1ux2 s THR 56 N 5.72 1.57 0.09 -0.34 2.01 0.35 -0.80 115.64 124.24 1ux2 s THR 56 Ca 0.72 -0.68 0.06 0.00 0.31 0.00 0.00 61.69 62.10 1ux2 s THR 56 Cb -0.22 -1.43 -0.03 0.00 0.01 0.00 0.00 72.50 70.83 1ux2 s THR 56 CO 0.31 0.45 -0.16 0.42 -0.69 0.00 0.00 174.62 174.95 1ux2 s THR 57 N 1.00 1.34 0.21 -0.82 -4.23 -0.49 -0.56 115.64 112.10 1ux2 s THR 57 Ca -0.06 -1.45 -0.22 0.00 -1.18 0.00 0.00 61.69 58.78 1ux2 s THR 57 Cb -0.15 -1.30 0.06 0.00 1.34 0.00 0.00 72.50 72.45 1ux2 s THR 57 CO -0.02 -0.20 0.92 -1.66 -0.54 0.00 0.00 174.62 173.11 1ux2 s TRP 58 N -1.38 -0.06 -0.08 3.99 -2.14 -1.08 -0.53 118.94 117.66 1ux2 s TRP 58 Ca 0.02 -0.35 0.01 0.00 2.66 0.00 0.00 56.10 58.44 1ux2 s TRP 58 Cb -0.09 0.69 -0.03 0.00 -3.10 0.00 0.00 33.47 30.94 1ux2 s TRP 58 CO 0.03 -1.02 -0.08 0.45 -2.66 0.00 0.00 176.95 173.66 1ux2 s SER 59 N -3.06 4.51 -0.37 -2.66 0.15 -1.26 -0.05 113.70 110.96 1ux2 s SER 59 Ca 0.15 -0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.71 1ux2 s SER 59 Cb -0.03 -1.23 0.13 0.00 -1.71 0.00 0.00 66.02 63.18 1ux2 s SER 59 CO 0.05 0.32 0.19 -0.62 1.20 0.00 0.00 173.24 174.38 1ux2 s ASP 60 N -0.56 3.55 0.36 5.45 -1.08 0.92 -4.88 116.67 120.44 1ux2 s ASP 60 Ca 0.08 -2.17 0.25 0.00 -0.52 0.00 0.00 52.55 50.20 1ux2 s ASP 60 Cb -0.12 -0.77 1.31 0.00 -1.46 0.00 0.00 42.92 41.88 1ux2 s ASP 60 CO 0.02 -0.33 1.77 0.03 0.52 0.00 0.00 175.17 177.18 1ux2 h ARG 61 N 7.26 0.00 0.00 4.34 3.08 -1.84 -1.66 114.38 125.56 1ux2 h ARG 61 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1ux2 h ARG 61 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.02 1ux2 h ARG 61 CO 0.42 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.57 1ux2 n THR 62 N -2.39 0.97 0.34 2.04 -2.24 -1.26 -2.33 114.28 109.41 1ux2 n THR 62 Ca -0.01 0.24 0.11 0.00 -2.27 0.00 0.00 64.05 62.13 1ux2 n THR 62 Cb 0.08 -1.00 0.03 0.00 -2.10 0.00 0.00 70.33 67.33 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 -1.56 0.66 -4.73 3.22 4.77 -0.62 -4.88 117.00 113.85 1ux2 n LEU 63 Ca 0.03 0.16 -0.38 0.00 -0.03 0.00 0.00 56.01 55.80 1ux2 n LEU 63 Cb 0.18 -0.09 0.06 0.00 -2.33 0.00 0.00 43.42 41.23 1ux2 n LEU 63 CO 0.14 -0.07 0.94 0.00 -1.33 0.00 0.00 177.39 177.08 1ux2 n ALA 64 N -2.00 1.36 -2.27 -1.18 0.00 -0.99 -4.75 120.51 110.69 1ux2 n ALA 64 Ca 0.01 0.06 -0.08 0.00 0.00 0.00 0.00 53.44 53.43 1ux2 n ALA 64 Cb 0.49 -2.34 -0.09 0.00 0.00 0.00 0.00 19.45 17.51 1ux2 n ALA 64 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 1ux2 s TRP 65 N -1.34 0.45 -0.45 0.00 -2.14 -0.73 -4.97 118.94 109.77 1ux2 s TRP 65 Ca 0.77 -0.93 -0.29 0.00 2.66 0.00 0.00 56.10 58.31 1ux2 s TRP 65 Cb -0.40 -0.29 0.02 0.00 -3.10 0.00 0.00 33.47 29.71 1ux2 s TRP 65 CO 0.45 -0.47 1.18 1.21 -2.66 0.00 0.00 176.95 176.66 1ux2 s ASN 66 N -2.92 6.63 -0.29 -2.66 3.84 -1.26 -4.67 114.94 113.60 1ux2 s ASN 66 Ca 0.09 0.61 0.10 0.00 0.21 0.00 0.00 52.86 53.87 1ux2 s ASN 66 Cb 0.07 -2.55 0.55 0.00 -0.55 0.00 0.00 41.25 38.77 1ux2 s ASN 66 CO -0.08 -1.23 1.53 -1.54 -2.79 0.00 0.00 177.10 172.99 1ux2 n SER 67 N 7.86 3.05 0.12 -4.21 3.41 -1.26 -4.62 113.62 117.96 1ux2 n SER 67 Ca 0.13 -3.57 0.04 0.00 -0.26 0.00 0.00 58.87 55.20 1ux2 n SER 67 Cb 0.49 -0.65 0.44 0.00 -0.26 0.00 0.00 64.21 64.23 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 1.25 0.24 -0.18 4.04 4.64 -1.95 -3.15 113.55 118.44 1ux2 h SER 68 Ca 0.23 -0.03 -0.19 0.00 -0.47 0.00 0.00 61.79 61.33 1ux2 h SER 68 Cb 1.81 -0.06 -0.30 0.00 -0.31 0.00 0.00 62.40 63.54 1ux2 h SER 68 CO 0.47 0.31 -0.89 1.41 -0.87 0.00 0.00 176.83 177.25 1ux2 n HIS 69 N -4.37 0.60 -3.98 4.77 8.25 -1.26 -5.08 115.22 114.15 1ux2 n HIS 69 Ca -0.00 -1.30 -0.08 0.00 -0.26 0.00 0.00 57.72 56.08 1ux2 n HIS 69 Cb 0.19 -0.22 -0.09 0.00 1.12 0.00 0.00 29.99 31.00 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 -2.88 0.31 0.33 0.41 0.01 -1.19 -1.30 113.70 109.39 1ux2 s SER 70 Ca 0.36 -0.82 -0.27 0.00 1.31 0.00 0.00 55.95 56.52 1ux2 s SER 70 Cb 0.37 0.26 -0.13 0.00 0.21 0.00 0.00 66.02 66.74 1ux2 s SER 70 CO -0.09 -0.65 1.08 -2.65 0.41 0.00 0.00 173.24 171.33 1ux2 n PRO 71 N 0.07 1.54 -0.25 12.44 -0.02 -1.26 -4.75 135.00 142.77 1ux2 n PRO 71 Ca -0.15 0.54 0.12 0.00 -2.02 0.00 0.00 63.50 62.00 1ux2 n PRO 71 Cb 0.61 -2.00 0.25 0.00 -0.02 0.00 0.00 33.50 32.34 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 0.97 3.62 -3.74 2.55 3.85 -1.26 -4.83 116.55 117.71 1ux2 n ASP 72 Ca 0.08 -2.00 -0.13 0.00 -0.71 0.00 0.00 54.79 52.03 1ux2 n ASP 72 Cb 0.34 -0.32 -0.10 0.00 -1.35 0.00 0.00 41.12 39.69 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 -1.35 0.49 0.05 0.11 -0.21 -1.26 0.00 119.66 117.49 1ux2 s GLN 73 Ca 0.42 0.49 0.00 0.00 0.02 0.00 0.00 55.36 56.29 1ux2 s GLN 73 Cb 0.24 0.24 -0.03 0.00 1.00 0.00 0.00 33.01 34.45 1ux2 s GLN 73 CO 0.32 -0.07 -0.04 0.14 -2.12 0.00 0.00 175.29 173.52 1ux2 s VAL 74 N 0.07 0.34 -0.13 1.09 -7.23 -0.47 -5.00 120.40 109.07 1ux2 s VAL 74 Ca -0.01 -1.55 -0.15 0.00 -1.81 0.00 0.00 61.98 58.46 1ux2 s VAL 74 Cb -0.03 -1.17 -0.05 0.00 0.56 0.00 0.00 36.38 35.70 1ux2 s VAL 74 CO 0.01 -0.79 0.36 -0.44 -0.31 0.00 0.00 175.10 173.93 1ux2 s SER 75 N -2.46 6.55 -0.04 4.85 0.01 -1.26 -0.85 113.70 120.50 1ux2 s SER 75 Ca 0.01 0.65 0.04 0.00 1.31 0.00 0.00 55.95 57.95 1ux2 s SER 75 Cb 0.01 -2.22 -0.00 0.00 0.21 0.00 0.00 66.02 64.02 1ux2 s SER 75 CO -0.06 0.10 -0.14 -0.69 0.41 0.00 0.00 173.24 172.86 1ux2 s VAL 76 N 0.33 1.19 0.29 3.43 1.01 0.76 -4.94 120.40 122.46 1ux2 s VAL 76 Ca 0.20 -0.58 -0.30 0.00 0.00 0.00 0.00 61.98 61.30 1ux2 s VAL 76 Cb -0.14 -1.04 -0.12 0.00 0.00 0.00 0.00 36.38 35.08 1ux2 s VAL 76 CO 0.07 0.35 1.51 -2.65 0.00 0.00 0.00 175.10 174.38 1ux2 n PRO 77 N 3.22 2.47 0.25 2.72 -0.02 -1.26 -0.62 135.00 141.76 1ux2 n PRO 77 Ca -0.18 0.88 0.17 0.00 -2.02 0.00 0.00 63.50 62.34 1ux2 n PRO 77 Cb 0.53 -2.61 0.80 0.00 -0.02 0.00 0.00 33.50 32.21 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 3.18 0.00 0.00 4.25 3.07 -1.79 -1.11 117.51 125.11 1ux2 h ILE 78 Ca -0.47 -0.21 -0.00 0.00 1.55 0.00 0.00 64.86 65.73 1ux2 h ILE 78 Cb 1.24 1.06 -0.00 0.00 -0.27 0.00 0.00 36.82 38.86 1ux2 h ILE 78 CO 0.76 0.00 -0.02 0.77 -1.05 0.00 0.00 178.15 178.61 1ux2 h SER 79 N 0.00 0.00 -0.20 2.16 4.64 -1.89 -1.24 113.55 117.02 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 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1ux2 h SER 79 CO 0.00 0.02 0.00 -1.20 -0.87 0.00 0.00 176.83 174.78 1ux2 n SER 80 N -3.19 2.64 -4.25 4.97 7.64 -0.42 -4.87 113.62 116.14 1ux2 n SER 80 Ca -0.02 -1.86 -0.21 0.00 1.01 0.00 0.00 58.87 57.80 1ux2 n SER 80 Cb 0.17 -0.13 -0.12 0.00 -1.01 0.00 0.00 64.21 63.13 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 -1.69 2.34 0.14 -3.43 1.43 -0.47 -4.60 118.68 112.40 1ux2 s LEU 81 Ca 0.35 -0.72 -0.30 0.00 -1.03 0.00 0.00 54.13 52.42 1ux2 s LEU 81 Cb 0.21 -0.69 -0.08 0.00 0.03 0.00 0.00 46.19 45.66 1ux2 s LEU 81 CO 0.30 -0.04 1.28 0.86 0.23 0.00 0.00 176.35 178.98 1ux2 s TRP 82 N -1.56 3.33 0.04 0.29 -0.00 -1.25 -4.69 118.94 115.10 1ux2 s TRP 82 Ca 0.06 1.20 0.08 0.00 -0.00 0.00 0.00 56.10 57.44 1ux2 s TRP 82 Cb -0.08 -3.55 -0.03 0.00 -0.00 0.00 0.00 33.47 29.81 1ux2 s TRP 82 CO 0.04 -1.75 -0.23 0.14 -0.00 0.00 0.00 176.95 175.15 1ux2 s VAL 83 N 0.59 1.83 0.33 5.86 -7.23 -1.26 -5.06 120.40 115.45 1ux2 s VAL 83 Ca 0.59 -1.26 -0.29 0.00 -1.81 0.00 0.00 61.98 59.20 1ux2 s VAL 83 Cb -0.34 -1.58 -0.11 0.00 0.56 0.00 0.00 36.38 34.91 1ux2 s VAL 83 CO 0.33 0.26 1.55 -0.81 -0.31 0.00 0.00 175.10 176.12 1ux2 n PRO 84 N 1.82 2.68 -1.16 4.82 -0.04 -1.26 -4.87 135.00 136.99 1ux2 n PRO 84 Ca -0.17 0.95 -0.20 0.00 -0.04 0.00 0.00 63.50 64.03 1ux2 n PRO 84 Cb 0.53 -2.70 -0.12 0.00 -0.04 0.00 0.00 33.50 31.16 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 1.45 6.22 -4.77 3.54 5.75 -1.26 -4.94 116.55 122.54 1ux2 n ASP 85 Ca 0.06 -2.61 -0.40 0.00 -0.01 0.00 0.00 54.79 51.83 1ux2 n ASP 85 Cb 0.37 -1.42 -0.02 0.00 -1.03 0.00 0.00 41.12 39.02 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 -0.32 4.31 -0.04 -2.12 1.43 -1.26 -1.07 118.68 119.61 1ux2 s LEU 86 Ca 0.66 2.54 -0.05 0.00 -1.03 0.00 0.00 54.13 56.24 1ux2 s LEU 86 Cb 0.29 -3.82 0.01 0.00 0.03 0.00 0.00 46.19 42.70 1ux2 s LEU 86 CO -0.04 -0.62 0.14 0.00 0.23 0.00 0.00 176.35 176.05 1ux2 s ALA 87 N -1.25 -0.33 -0.16 4.21 0.00 0.26 -4.86 121.76 119.63 1ux2 s ALA 87 Ca 0.53 0.24 -0.29 0.00 0.00 0.00 0.00 51.96 52.44 1ux2 s ALA 87 Cb -0.36 -0.14 -0.00 0.00 0.00 0.00 0.00 23.12 22.62 1ux2 s ALA 87 CO 0.46 -0.10 1.01 0.00 0.00 0.00 0.00 175.76 177.13 1ux2 s ALA 88 N -0.32 3.52 0.36 0.00 0.00 -1.26 -1.95 121.76 122.12 1ux2 s ALA 88 Ca -0.04 0.28 0.10 0.00 0.00 0.00 0.00 51.96 52.30 1ux2 s ALA 88 Cb -0.03 -3.46 0.70 0.00 0.00 0.00 0.00 23.12 20.33 1ux2 s ALA 88 CO 0.00 -0.77 1.84 1.88 0.00 0.00 0.00 175.76 178.71 1ux2 h TYR 89 N 7.25 0.16 -0.42 0.00 0.05 -0.24 -2.89 116.97 120.88 1ux2 h TYR 89 Ca -0.26 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.49 1ux2 h TYR 89 Cb 1.11 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 38.81 1ux2 h TYR 89 CO 0.73 0.41 0.00 0.27 -1.05 0.00 0.00 178.16 178.52 1ux2 n ASN 90 N -4.16 4.44 -4.77 3.88 6.94 -1.26 -4.98 115.26 115.35 1ux2 n ASN 90 Ca -0.01 -2.79 -0.40 0.00 -0.02 0.00 0.00 54.58 51.35 1ux2 n ASN 90 Cb 0.36 -0.55 -0.03 0.00 -2.36 0.00 0.00 39.78 37.20 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 -2.45 3.42 -0.26 -2.53 0.00 -1.09 -1.26 121.76 117.58 1ux2 s ALA 91 Ca 0.45 1.09 0.03 0.00 0.00 0.00 0.00 51.96 53.53 1ux2 s ALA 91 Cb 0.34 -3.41 0.08 0.00 0.00 0.00 0.00 23.12 20.12 1ux2 s ALA 91 CO 0.14 -0.45 1.03 0.44 0.00 0.00 0.00 175.76 176.92 1ux2 n ILE 92 N 0.84 0.92 -4.07 0.00 -5.35 -0.19 -4.86 119.36 106.64 1ux2 n ILE 92 Ca 0.00 -0.96 -0.09 0.00 -0.27 0.00 0.00 62.75 61.44 1ux2 n ILE 92 Cb 0.43 0.55 -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 -0.94 0.59 0.36 7.28 1.04 -1.24 -4.95 113.70 115.85 1ux2 s SER 93 Ca 0.06 -0.83 -0.28 0.00 0.48 0.00 0.00 55.95 55.39 1ux2 s SER 93 Cb 0.03 0.14 -0.10 0.00 0.10 0.00 0.00 66.02 66.19 1ux2 s SER 93 CO 0.04 -0.46 1.33 -0.54 0.98 0.00 0.00 173.24 174.59 1ux2 s LYS 94 N -3.04 4.21 0.06 4.02 1.02 -1.26 -4.68 119.74 120.07 1ux2 s LYS 94 Ca 0.00 2.25 -0.30 0.00 0.02 0.00 0.00 55.97 57.94 1ux2 s LYS 94 Cb 0.01 -2.96 -0.09 0.00 -0.52 0.00 0.00 37.83 34.27 1ux2 s LYS 94 CO -0.06 -0.32 1.87 -1.25 -0.92 0.00 0.00 175.35 174.68 1ux2 s PRO 95 N -1.97 4.15 -0.45 -1.68 0.04 -1.26 -4.84 135.00 128.99 1ux2 s PRO 95 Ca 0.52 2.55 -0.21 0.00 0.04 0.00 0.00 61.00 63.89 1ux2 s PRO 95 Cb -0.40 -3.93 0.03 0.00 0.04 0.00 0.00 34.50 30.23 1ux2 s PRO 95 CO 0.53 -0.90 0.68 -2.00 0.04 0.00 0.00 177.00 175.35 1ux2 s GLU 96 N 3.77 3.29 -0.18 4.56 2.12 -0.30 -4.94 118.70 127.02 1ux2 s GLU 96 Ca 0.84 -0.35 -0.26 0.00 0.36 0.00 0.00 54.97 55.56 1ux2 s GLU 96 Cb -0.43 -3.96 -0.01 0.00 0.26 0.00 0.00 34.13 29.99 1ux2 s GLU 96 CO 0.38 -1.06 0.86 0.08 -0.54 0.00 0.00 175.26 174.98 1ux2 s VAL 97 N 2.93 4.85 -0.28 3.70 1.01 -1.26 -0.13 120.40 131.23 1ux2 s VAL 97 Ca 0.24 1.68 0.23 0.00 0.00 0.00 0.00 61.98 64.13 1ux2 s VAL 97 Cb -0.14 -4.16 -0.11 0.00 0.00 0.00 0.00 36.38 31.97 1ux2 s VAL 97 CO 0.19 -0.00 0.91 0.18 0.00 0.00 0.00 175.10 176.38 1ux2 n LEU 98 N 5.39 0.58 -4.68 3.92 4.77 0.18 -4.98 117.00 122.18 1ux2 n LEU 98 Ca 0.05 0.17 -0.23 0.00 -0.03 0.00 0.00 56.01 55.98 1ux2 n LEU 98 Cb 0.48 -0.06 -0.07 0.00 -2.33 0.00 0.00 43.42 41.45 1ux2 n LEU 98 CO 0.49 -0.09 -0.29 0.42 -1.33 0.00 0.00 177.39 176.59 1ux2 s THR 99 N -3.36 3.61 0.18 -5.08 -4.23 -1.25 -5.00 115.64 100.51 1ux2 s THR 99 Ca -0.01 -1.80 -0.33 0.00 -1.18 0.00 0.00 61.69 58.37 1ux2 s THR 99 Cb 0.12 -2.96 -0.15 0.00 1.34 0.00 0.00 72.50 70.85 1ux2 s THR 99 CO 0.82 -0.36 1.33 -2.65 -0.54 0.00 0.00 174.62 173.23 1ux2 n PRO 100 N -0.97 1.61 -2.09 3.99 -0.02 -1.26 -4.84 135.00 131.42 1ux2 n PRO 100 Ca -0.06 0.58 -0.42 0.00 -2.02 0.00 0.00 63.50 61.57 1ux2 n PRO 100 Cb 0.59 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 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 2.19 3.21 -4.61 -0.52 1.13 -1.26 -4.89 117.38 112.63 1ux2 n GLN 101 Ca 0.14 -3.08 -0.22 0.00 -1.94 0.00 0.00 57.00 51.90 1ux2 n GLN 101 Cb 0.27 -3.15 -0.15 0.00 0.11 0.00 0.00 30.24 27.32 1ux2 n GLN 101 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1ux2 s LEU 102 N 1.40 2.07 0.25 1.08 1.43 -1.26 -2.24 118.68 121.41 1ux2 s LEU 102 Ca 0.44 -0.33 0.10 0.00 -1.03 0.00 0.00 54.13 53.31 1ux2 s LEU 102 Cb 0.11 -0.74 -0.04 0.00 0.03 0.00 0.00 46.19 45.55 1ux2 s LEU 102 CO -0.04 0.15 -0.03 0.00 0.23 0.00 0.00 176.35 176.67 1ux2 s ALA 103 N -0.49 3.12 -0.24 4.21 0.00 0.21 -4.69 121.76 123.87 1ux2 s ALA 103 Ca 0.05 -1.63 -0.12 0.00 0.00 0.00 0.00 51.96 50.26 1ux2 s ALA 103 Cb -0.06 -0.75 -0.05 0.00 0.00 0.00 0.00 23.12 22.26 1ux2 s ALA 103 CO 0.00 0.30 0.22 0.50 0.00 0.00 0.00 175.76 176.78 1ux2 s ARG 104 N -3.54 4.07 -0.13 0.00 6.06 0.61 -0.17 118.95 125.84 1ux2 s ARG 104 Ca 0.30 -0.17 -0.01 0.00 -2.50 0.00 0.00 55.73 53.35 1ux2 s ARG 104 Cb -0.07 -3.57 -0.02 0.00 0.06 0.00 0.00 34.95 31.35 1ux2 s ARG 104 CO 0.19 -0.02 -0.08 0.08 -2.50 0.00 0.00 175.30 172.97 1ux2 s VAL 105 N 1.29 3.51 0.07 7.11 1.01 -0.03 -0.68 120.40 132.69 1ux2 s VAL 105 Ca 0.10 -0.51 -0.00 0.00 0.00 0.00 0.00 61.98 61.57 1ux2 s VAL 105 Cb -0.14 -2.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1ux2 s VAL 105 CO 0.07 0.52 0.23 -0.69 0.00 0.00 0.00 175.10 175.23 1ux2 s VAL 106 N 0.16 5.37 -0.43 2.92 1.01 0.16 -1.37 120.40 128.22 1ux2 s VAL 106 Ca -0.04 -0.35 0.15 0.00 0.00 0.00 0.00 61.98 61.74 1ux2 s VAL 106 Cb -0.14 -3.63 0.15 0.00 0.00 0.00 0.00 36.38 32.76 1ux2 s VAL 106 CO 0.04 0.12 1.46 -1.54 0.00 0.00 0.00 175.10 175.18 1ux2 n SER 107 N 0.25 0.39 -0.79 3.32 3.41 0.10 -0.76 113.62 119.55 1ux2 n SER 107 Ca -0.05 0.68 0.09 0.00 -0.26 0.00 0.00 58.87 59.33 1ux2 n SER 107 Cb 0.51 -0.73 0.26 0.00 -0.26 0.00 0.00 64.21 63.99 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 -2.03 2.31 0.00 4.04 5.68 -1.26 -1.77 116.55 123.52 1ux2 n ASP 108 Ca -0.01 -1.90 0.00 0.00 -0.50 0.00 0.00 54.79 52.38 1ux2 n ASP 108 Cb 0.03 -0.23 0.00 0.00 -1.14 0.00 0.00 41.12 39.78 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 1.23 0.93 3.69 6.12 0.00 0.06 -4.71 105.19 112.51 1ux2 n GLY 109 Ca 0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 1ux2 n GLY 109 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ux2 n GLU 110 N -2.00 2.47 -4.44 1.61 4.71 -1.25 -0.05 120.64 121.69 1ux2 n GLU 110 Ca 0.00 0.89 -0.31 0.00 -0.01 0.00 0.00 57.16 57.73 1ux2 n GLU 110 Cb 0.00 -2.71 -0.11 0.00 -1.01 0.00 0.00 31.44 27.61 1ux2 n GLU 110 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1ux2 s VAL 111 N 1.44 3.37 -0.05 2.62 1.01 0.93 -0.66 120.40 129.06 1ux2 s VAL 111 Ca 0.79 -1.01 -0.02 0.00 0.00 0.00 0.00 61.98 61.74 1ux2 s VAL 111 Cb -0.59 -2.49 0.04 0.00 0.00 0.00 0.00 36.38 33.34 1ux2 s VAL 111 CO 0.36 0.30 0.09 -0.76 0.00 0.00 0.00 175.10 175.10 1ux2 s LEU 112 N -1.64 0.17 -0.09 3.92 1.02 0.15 -2.62 118.68 119.58 1ux2 s LEU 112 Ca 0.18 0.16 -0.00 0.00 0.02 0.00 0.00 54.13 54.49 1ux2 s LEU 112 Cb -0.11 0.01 0.02 0.00 0.02 0.00 0.00 46.19 46.13 1ux2 s LEU 112 CO 0.09 -0.24 -0.06 -0.47 0.02 0.00 0.00 176.35 175.69 1ux2 s TYR 113 N 2.09 1.16 -0.49 0.29 5.04 0.28 -0.29 117.35 125.43 1ux2 s TYR 113 Ca 0.03 -0.49 0.06 0.00 -2.44 0.00 0.00 57.07 54.23 1ux2 s TYR 113 Cb -0.12 -1.02 0.22 0.00 0.35 0.00 0.00 41.96 41.39 1ux2 s TYR 113 CO -0.04 -0.39 0.52 -0.12 -1.34 0.00 0.00 175.55 174.18 1ux2 n MET 114 N 4.71 1.11 -2.33 4.97 0.00 -1.26 -0.50 117.12 123.82 1ux2 n MET 114 Ca -0.14 -3.70 -0.37 0.00 -0.00 0.00 0.00 57.70 53.49 1ux2 n MET 114 Cb 0.50 -1.71 -0.02 0.00 0.00 0.00 0.00 33.22 32.00 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 -1.16 3.86 -0.22 2.12 0.04 -1.25 -4.74 135.00 133.65 1ux2 s PRO 115 Ca 0.34 1.71 -0.21 0.00 0.04 0.00 0.00 61.00 62.88 1ux2 s PRO 115 Cb 0.10 -2.44 -0.02 0.00 0.04 0.00 0.00 34.50 32.18 1ux2 s PRO 115 CO -0.12 -0.45 0.65 0.45 0.04 0.00 0.00 177.00 177.57 1ux2 s SER 116 N -1.41 6.67 -0.09 6.66 0.15 -1.26 -1.14 113.70 123.28 1ux2 s SER 116 Ca 0.62 0.81 0.04 0.00 0.70 0.00 0.00 55.95 58.12 1ux2 s SER 116 Cb -0.27 -2.36 -0.01 0.00 -1.71 0.00 0.00 66.02 61.68 1ux2 s SER 116 CO 0.33 -0.34 -0.21 -0.63 1.20 0.00 0.00 173.24 173.59 1ux2 s ILE 117 N 2.23 2.39 -0.21 6.45 1.01 0.03 0.52 121.20 133.62 1ux2 s ILE 117 Ca 0.29 -0.92 -0.10 0.00 0.00 0.00 0.00 60.65 59.92 1ux2 s ILE 117 Cb -0.16 -1.93 -0.05 0.00 0.01 0.00 0.00 42.46 40.34 1ux2 s ILE 117 CO 0.09 0.56 0.13 -0.60 0.00 0.00 0.00 174.94 175.12 1ux2 s ARG 118 N 0.07 4.14 -0.04 2.79 3.52 0.82 -1.62 118.95 128.63 1ux2 s ARG 118 Ca -0.09 -0.25 -0.19 0.00 -0.13 0.00 0.00 55.73 55.07 1ux2 s ARG 118 Cb -0.15 -3.42 0.04 0.00 -1.56 0.00 0.00 34.95 29.86 1ux2 s ARG 118 CO 0.06 0.25 0.41 -1.14 -0.81 0.00 0.00 175.30 174.07 1ux2 s GLN 119 N 0.51 0.75 -0.02 5.12 0.74 -0.30 -1.15 119.66 125.31 1ux2 s GLN 119 Ca 0.07 -0.01 -0.03 0.00 0.05 0.00 0.00 55.36 55.45 1ux2 s GLN 119 Cb -0.12 0.34 -0.04 0.00 1.10 0.00 0.00 33.01 34.30 1ux2 s GLN 119 CO -0.00 -0.21 0.14 1.03 -0.55 0.00 0.00 175.29 175.70 1ux2 s ARG 120 N -1.15 3.32 0.05 1.67 0.52 -1.26 -1.50 118.95 120.60 1ux2 s ARG 120 Ca -0.12 -0.35 0.04 0.00 -0.52 0.00 0.00 55.73 54.78 1ux2 s ARG 120 Cb -0.04 -3.03 -0.03 0.00 0.52 0.00 0.00 34.95 32.38 1ux2 s ARG 120 CO 0.05 0.68 -0.11 -0.06 0.02 0.00 0.00 175.30 175.89 1ux2 s PHE 121 N -1.24 0.93 -0.33 -0.53 0.08 0.61 -1.02 117.98 116.47 1ux2 s PHE 121 Ca 0.24 -0.45 -0.14 0.00 0.12 0.00 0.00 56.93 56.70 1ux2 s PHE 121 Cb -0.12 -0.54 -0.02 0.00 -0.57 0.00 0.00 43.02 41.77 1ux2 s PHE 121 CO 0.15 -0.01 0.28 0.45 -0.10 0.00 0.00 175.22 175.99 1ux2 s SER 122 N -1.54 6.10 0.34 1.36 0.15 -0.39 -1.28 113.70 118.44 1ux2 s SER 122 Ca -0.05 -0.31 -0.17 0.00 0.70 0.00 0.00 55.95 56.11 1ux2 s SER 122 Cb -0.09 -2.16 0.06 0.00 -1.71 0.00 0.00 66.02 62.12 1ux2 s SER 122 CO 0.01 -0.26 0.85 0.00 1.20 0.00 0.00 173.24 175.04 1ux2 s ASP 124 N -3.14 6.57 0.00 0.00 -1.08 -1.26 -4.35 116.67 113.41 1ux2 s ASP 124 Ca 0.17 0.50 0.19 0.00 -0.52 0.00 0.00 52.55 52.88 1ux2 s ASP 124 Cb -0.05 -2.55 -0.02 0.00 -1.46 0.00 0.00 42.92 38.85 1ux2 s ASP 124 CO 0.10 -1.30 0.94 0.52 0.52 0.00 0.00 175.17 175.95 1ux2 n VAL 125 N 6.89 0.00 -1.75 1.11 0.31 -1.26 -3.73 118.33 119.89 1ux2 n VAL 125 Ca 0.13 -0.29 -0.42 0.00 -0.01 0.00 0.00 64.34 63.75 1ux2 n VAL 125 Cb 0.49 1.21 -0.01 0.00 -0.91 0.00 0.00 33.84 34.62 1ux2 n VAL 125 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1ux2 n SER 126 N -0.17 3.63 0.00 4.52 3.41 -1.26 -2.19 113.62 121.56 1ux2 n SER 126 Ca 0.07 1.20 0.00 0.00 -0.26 0.00 0.00 58.87 59.88 1ux2 n SER 126 Cb 0.39 -1.59 0.00 0.00 -0.26 0.00 0.00 64.21 62.75 1ux2 n SER 126 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ux2 n GLY 127 N 1.07 0.74 0.37 5.00 0.00 -1.26 -4.12 105.19 106.98 1ux2 n GLY 127 Ca 0.04 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.20 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 0.84 -0.83 1.61 3.04 -1.65 -1.03 116.25 118.23 1ux2 h VAL 128 Ca 0.00 -0.15 -0.35 0.00 -1.01 0.00 0.00 66.70 65.19 1ux2 h VAL 128 Cb 0.00 0.37 -0.21 0.00 -2.01 0.00 0.00 31.29 29.44 1ux2 h VAL 128 CO 0.00 0.08 0.44 -0.67 -1.01 0.00 0.00 177.57 176.41 1ux2 n ASP 129 N -4.48 4.24 -4.71 3.17 2.03 -1.26 -1.02 116.55 114.53 1ux2 n ASP 129 Ca 0.13 -3.34 -0.26 0.00 0.52 0.00 0.00 54.79 51.83 1ux2 n ASP 129 Cb 0.45 -0.78 -0.08 0.00 -0.72 0.00 0.00 41.12 39.99 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 -3.00 2.14 0.26 5.18 -4.23 -0.40 -4.97 115.64 110.62 1ux2 s THR 130 Ca 0.53 -1.80 -0.02 0.00 -1.18 0.00 0.00 61.69 59.23 1ux2 s THR 130 Cb 0.44 -2.94 0.09 0.00 1.34 0.00 0.00 72.50 71.43 1ux2 s THR 130 CO 0.12 0.00 1.73 -0.33 -0.54 0.00 0.00 174.62 175.60 1ux2 h GLU 131 N 1.51 0.73 0.00 3.99 5.08 -1.91 -2.62 114.58 121.35 1ux2 h GLU 131 Ca -0.43 -0.22 -0.08 0.00 -1.00 0.00 0.00 59.36 57.62 1ux2 h GLU 131 Cb 1.25 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 1ux2 h GLU 131 CO 0.73 0.80 -0.39 0.77 -1.00 0.00 0.00 179.01 179.92 1ux2 h SER 132 N 0.67 0.00 -3.95 1.42 0.02 -1.97 -3.49 113.55 106.25 1ux2 h SER 132 Ca 0.12 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 61.10 1ux2 h SER 132 Cb 0.54 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.07 1ux2 h SER 132 CO 0.03 0.39 -0.04 0.61 -1.14 0.00 0.00 176.83 176.68 1ux2 n GLY 133 N -0.35 -1.32 3.91 -3.77 0.00 -0.99 -4.80 105.19 97.87 1ux2 n GLY 133 Ca -0.02 -1.51 -0.29 0.00 0.00 0.00 0.00 46.02 44.21 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 -1.10 3.73 -0.30 4.61 0.00 0.56 -4.41 121.76 124.86 1ux2 s ALA 134 Ca 0.00 -0.66 0.03 0.00 0.00 0.00 0.00 51.96 51.33 1ux2 s ALA 134 Cb 0.00 -2.15 0.08 0.00 0.00 0.00 0.00 23.12 21.04 1ux2 s ALA 134 CO 0.00 0.41 -0.03 0.99 0.00 0.00 0.00 175.76 177.13 1ux2 s THR 135 N -1.91 2.35 -0.26 0.00 2.01 -1.25 -1.22 115.64 115.36 1ux2 s THR 135 Ca 0.41 -1.88 -0.14 0.00 0.31 0.00 0.00 61.69 60.39 1ux2 s THR 135 Cb -0.11 -2.52 -0.04 0.00 0.01 0.00 0.00 72.50 69.84 1ux2 s THR 135 CO 0.28 -0.27 0.34 0.00 -0.69 0.00 0.00 174.62 174.28 1ux2 s ARG 137 N 1.94 3.99 -0.16 0.00 0.52 -1.26 -0.14 118.95 123.84 1ux2 s ARG 137 Ca 0.14 -0.32 0.00 0.00 -0.52 0.00 0.00 55.73 55.03 1ux2 s ARG 137 Cb -0.16 -3.35 -0.00 0.00 0.52 0.00 0.00 34.95 31.96 1ux2 s ARG 137 CO 0.10 0.15 -0.15 0.42 0.02 0.00 0.00 175.30 175.84 1ux2 s ILE 138 N 0.74 2.65 -0.20 1.52 1.01 0.21 -4.87 121.20 122.26 1ux2 s ILE 138 Ca 0.05 -0.77 -0.07 0.00 0.00 0.00 0.00 60.65 59.86 1ux2 s ILE 138 Cb -0.13 -2.12 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 1ux2 s ILE 138 CO 0.02 0.51 0.05 -0.54 0.00 0.00 0.00 174.94 174.98 1ux2 s LYS 139 N 0.90 3.84 -0.12 2.79 1.02 -1.26 -0.22 119.74 126.68 1ux2 s LYS 139 Ca -0.04 -0.40 0.01 0.00 0.02 0.00 0.00 55.97 55.56 1ux2 s LYS 139 Cb -0.15 -3.22 0.02 0.00 -0.52 0.00 0.00 37.83 33.96 1ux2 s LYS 139 CO -0.01 0.13 -0.15 0.42 -0.92 0.00 0.00 175.35 174.81 1ux2 s ILE 140 N 0.76 1.53 0.27 2.17 1.01 -0.30 0.58 121.20 127.23 1ux2 s ILE 140 Ca 0.03 -0.64 -0.13 0.00 0.00 0.00 0.00 60.65 59.91 1ux2 s ILE 140 Cb -0.14 -1.42 0.00 0.00 0.01 0.00 0.00 42.46 40.92 1ux2 s ILE 140 CO 0.02 0.45 0.53 -0.83 0.00 0.00 0.00 174.94 175.11 1ux2 s GLY 141 N 1.18 0.56 0.23 6.18 0.00 -0.82 -0.97 107.32 113.67 1ux2 s GLY 141 Ca -0.02 -0.88 -0.31 0.00 0.00 0.00 0.00 44.72 43.51 1ux2 s GLY 141 CO -0.05 -0.58 1.58 -0.45 0.00 0.00 0.00 173.10 173.60 1ux2 s SER 142 N -3.04 6.50 0.20 1.64 0.15 -1.26 -0.58 113.70 117.32 1ux2 s SER 142 Ca 0.21 2.77 -0.01 0.00 0.70 0.00 0.00 55.95 59.63 1ux2 s SER 142 Cb -0.02 -2.61 0.15 0.00 -1.71 0.00 0.00 66.02 61.83 1ux2 s SER 142 CO 0.10 -0.85 1.51 -0.25 1.20 0.00 0.00 173.24 174.95 1ux2 h TRP 143 N 5.87 0.57 0.00 3.44 2.91 -1.43 -3.39 115.95 123.92 1ux2 h TRP 143 Ca -0.45 -0.21 0.00 0.00 1.13 0.00 0.00 58.89 59.36 1ux2 h TRP 143 Cb 1.21 -0.10 0.00 0.00 -0.51 0.00 0.00 29.16 29.76 1ux2 h TRP 143 CO 0.62 0.92 0.00 0.25 -1.03 0.00 0.00 178.44 179.20 1ux2 n THR 144 N -3.92 0.00 -3.79 2.65 -2.24 -1.26 -5.01 114.28 100.71 1ux2 n THR 144 Ca -0.03 -0.31 -0.36 0.00 -2.27 0.00 0.00 64.05 61.07 1ux2 n THR 144 Cb 0.62 1.14 -0.12 0.00 -2.10 0.00 0.00 70.33 69.87 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 -0.39 3.11 0.85 4.78 3.76 -1.26 -5.10 115.29 121.04 1ux2 s HIS 145 Ca 0.00 -0.31 -0.14 0.00 -0.15 0.00 0.00 55.06 54.45 1ux2 s HIS 145 Cb 0.00 -2.23 0.20 0.00 1.11 0.00 0.00 32.58 31.66 1ux2 s HIS 145 CO 0.00 -0.27 1.09 -2.39 -0.85 0.00 0.00 174.74 172.31 1ux2 n HIS 146 N 4.74 -3.96 0.28 1.40 1.44 -1.26 -4.55 115.22 113.31 1ux2 n HIS 146 Ca -0.16 -0.96 0.14 0.00 -2.01 0.00 0.00 57.72 54.73 1ux2 n HIS 146 Cb 0.52 -0.88 0.81 0.00 0.12 0.00 0.00 29.99 30.56 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 -1.61 0.00 0.79 4.39 4.64 -0.81 0.05 113.55 121.01 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 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1ux2 h SER 147 CO 0.25 0.07 0.00 0.54 -0.87 0.00 0.00 176.83 176.82 1ux2 n ARG 148 N -3.67 0.08 -0.04 4.77 1.74 -1.26 -4.12 116.66 114.16 1ux2 n ARG 148 Ca -0.02 0.06 -0.06 0.00 -0.77 0.00 0.00 57.85 57.06 1ux2 n ARG 148 Cb 0.18 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.09 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 -1.45 0.19 -3.99 5.56 1.02 -0.11 -3.38 120.64 118.48 1ux2 n GLU 149 Ca 0.08 0.05 -0.23 0.00 -0.02 0.00 0.00 57.16 57.03 1ux2 n GLU 149 Cb 0.28 -1.11 -0.17 0.00 -0.02 0.00 0.00 31.44 30.42 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 -2.15 0.68 -0.01 -3.67 1.01 -0.55 -0.21 121.20 116.31 1ux2 s ILE 150 Ca -0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 60.65 60.41 1ux2 s ILE 150 Cb 0.03 -0.74 -0.04 0.00 0.01 0.00 0.00 42.46 41.72 1ux2 s ILE 150 CO 0.17 0.29 0.12 -0.94 0.00 0.00 0.00 174.94 174.58 1ux2 s SER 151 N 1.49 5.95 -0.08 3.58 1.04 -0.64 -4.07 113.70 120.98 1ux2 s SER 151 Ca -0.01 0.23 0.04 0.00 0.48 0.00 0.00 55.95 56.68 1ux2 s SER 151 Cb -0.13 -1.77 0.00 0.00 0.10 0.00 0.00 66.02 64.22 1ux2 s SER 151 CO -0.04 0.27 -0.19 -0.69 0.98 0.00 0.00 173.24 173.57 1ux2 s VAL 152 N -1.24 1.69 0.02 5.02 1.01 -1.26 -1.13 120.40 124.51 1ux2 s VAL 152 Ca 0.24 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.42 1ux2 s VAL 152 Cb -0.12 -1.47 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 1ux2 s VAL 152 CO 0.16 0.48 -0.05 -1.81 0.00 0.00 0.00 175.10 173.87 1ux2 s ASP 153 N 0.38 0.50 0.13 3.32 1.01 -0.40 -4.70 116.67 116.90 1ux2 s ASP 153 Ca -0.15 -0.37 -0.31 0.00 0.71 0.00 0.00 52.55 52.43 1ux2 s ASP 153 Cb -0.16 0.03 -0.08 0.00 1.01 0.00 0.00 42.92 43.72 1ux2 s ASP 153 CO 0.06 -0.15 1.34 -2.16 0.21 0.00 0.00 175.17 174.46 1ux2 s PRO 154 N -1.04 4.36 0.74 8.23 0.04 -1.26 -0.15 135.00 145.92 1ux2 s PRO 154 Ca -0.08 2.02 -0.17 0.00 0.04 0.00 0.00 61.00 62.81 1ux2 s PRO 154 Cb -0.07 -3.25 -0.09 0.00 0.04 0.00 0.00 34.50 31.13 1ux2 s PRO 154 CO -0.00 -0.36 0.03 2.41 0.04 0.00 0.00 177.00 179.12 1ux2 n THR 155 N 3.61 0.76 -1.50 1.26 -1.04 -1.20 -4.78 114.28 111.39 1ux2 n THR 155 Ca 0.10 -0.44 -0.13 0.00 -2.04 0.00 0.00 64.05 61.54 1ux2 n THR 155 Cb 0.43 -0.36 -0.10 0.00 -1.82 0.00 0.00 70.33 68.49 1ux2 n THR 155 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1ux2 n THR 156 N -2.25 0.00 -1.21 12.58 -2.24 -1.26 -4.81 114.28 115.09 1ux2 n THR 156 Ca 0.06 -0.30 -0.06 0.00 -2.27 0.00 0.00 64.05 61.48 1ux2 n THR 156 Cb 0.51 -1.56 -0.06 0.00 -2.10 0.00 0.00 70.33 67.12 1ux2 n THR 156 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ux2 n GLU 157 N 7.70 0.04 -0.10 -0.78 1.02 -1.26 -4.69 120.64 122.57 1ux2 n GLU 157 Ca 0.41 -0.42 -0.23 0.00 -0.02 0.00 0.00 57.16 56.91 1ux2 n GLU 157 Cb 0.42 -1.78 -0.12 0.00 -0.02 0.00 0.00 31.44 29.95 1ux2 n GLU 157 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1ux2 n ASN 158 N 8.73 1.98 0.00 1.62 3.02 -1.26 -5.05 115.26 124.30 1ux2 n ASN 158 Ca 0.19 0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.92 1ux2 n ASN 158 Cb 0.45 -0.73 0.00 0.00 -0.61 0.00 0.00 39.78 38.89 1ux2 n ASN 158 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1ux2 n SER 159 N -3.82 0.00 -3.92 6.41 3.41 -1.26 -5.14 113.62 109.30 1ux2 n SER 159 Ca -0.43 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.08 1ux2 n SER 159 Cb 0.92 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.80 1ux2 n SER 159 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ux2 s ASP 160 N -1.00 0.01 -0.10 4.04 -1.08 -1.26 -5.08 116.67 112.20 1ux2 s ASP 160 Ca 0.00 -0.80 0.13 0.00 -0.52 0.00 0.00 52.55 51.36 1ux2 s ASP 160 Cb 0.00 0.44 0.56 0.00 -1.46 0.00 0.00 42.92 42.46 1ux2 s ASP 160 CO 0.00 -0.90 1.42 0.47 0.52 0.00 0.00 175.17 176.68 1ux2 n ASP 161 N -0.22 3.87 0.00 -0.34 10.43 -1.26 -4.19 116.55 124.85 1ux2 n ASP 161 Ca -0.08 -2.41 0.00 0.00 2.57 0.00 0.00 54.79 54.87 1ux2 n ASP 161 Cb 0.63 -0.53 0.00 0.00 1.84 0.00 0.00 41.12 43.06 1ux2 n ASP 161 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1ux2 n SER 162 N 0.72 0.00 0.30 -2.24 7.64 -1.26 -4.82 113.62 113.97 1ux2 n SER 162 Ca 0.20 -1.00 0.21 0.00 1.01 0.00 0.00 58.87 59.28 1ux2 n SER 162 Cb 0.76 0.00 1.07 0.00 -1.01 0.00 0.00 64.21 65.03 1ux2 n SER 162 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1ux2 h GLU 163 N 0.00 0.00 0.00 1.43 4.81 -1.95 -3.19 114.58 115.67 1ux2 h GLU 163 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1ux2 h GLU 163 Cb 0.65 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.03 1ux2 h GLU 163 CO 0.00 0.00 -1.19 0.66 -0.73 0.00 0.00 179.01 177.75 1ux2 n TYR 164 N -2.94 0.00 -2.48 0.92 4.01 -1.26 -5.07 117.16 110.34 1ux2 n TYR 164 Ca -0.02 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.31 1ux2 n TYR 164 Cb 0.09 -0.10 -0.04 0.00 -0.31 0.00 0.00 39.34 38.98 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 -2.30 3.56 0.16 -0.72 5.36 -1.21 -4.62 117.98 118.22 1ux2 s PHE 165 Ca -0.02 1.57 -0.31 0.00 -0.96 0.00 0.00 56.93 57.21 1ux2 s PHE 165 Cb 0.03 -3.31 -0.11 0.00 -0.34 0.00 0.00 43.02 39.29 1ux2 s PHE 165 CO 0.19 -0.72 1.79 0.45 -1.46 0.00 0.00 175.22 175.47 1ux2 s SER 166 N -0.12 6.40 0.16 6.13 0.15 0.11 -4.87 113.70 121.66 1ux2 s SER 166 Ca 0.50 2.82 0.21 0.00 0.70 0.00 0.00 55.95 60.18 1ux2 s SER 166 Cb -0.30 -2.58 0.87 0.00 -1.71 0.00 0.00 66.02 62.29 1ux2 s SER 166 CO 0.36 -1.00 1.65 0.00 1.20 0.00 0.00 173.24 175.45 1ux2 n GLN 167 N 4.91 0.13 0.00 5.44 10.64 -1.26 -3.09 117.38 134.15 1ux2 n GLN 167 Ca 0.17 0.33 0.12 0.00 -1.83 0.00 0.00 57.00 55.79 1ux2 n GLN 167 Cb 0.37 -1.73 0.19 0.00 -0.86 0.00 0.00 30.24 28.21 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 -1.97 0.00 -1.73 2.61 4.01 -1.26 -4.93 117.16 113.88 1ux2 n TYR 168 Ca 0.03 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.39 1ux2 n TYR 168 Cb 0.23 -0.07 0.05 0.00 -0.31 0.00 0.00 39.34 39.24 1ux2 n TYR 168 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1ux2 n SER 169 N -0.47 2.38 0.12 7.72 2.88 -1.18 -4.88 113.62 120.19 1ux2 n SER 169 Ca 0.10 0.92 0.11 0.00 -1.33 0.00 0.00 58.87 58.67 1ux2 n SER 169 Cb 0.40 -1.56 0.48 0.00 -0.75 0.00 0.00 64.21 62.77 1ux2 n SER 169 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ux2 n ARG 170 N -1.33 0.16 -4.40 -1.46 1.74 -1.26 -4.80 116.66 105.30 1ux2 n ARG 170 Ca 0.13 0.45 -0.24 0.00 -0.77 0.00 0.00 57.85 57.42 1ux2 n ARG 170 Cb 0.46 -1.84 -0.09 0.00 -1.02 0.00 0.00 32.46 29.97 1ux2 n ARG 170 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1ux2 s PHE 171 N -3.32 2.47 0.07 -1.55 0.08 -1.26 -1.45 117.98 113.02 1ux2 s PHE 171 Ca 0.03 -0.35 0.05 0.00 0.12 0.00 0.00 56.93 56.78 1ux2 s PHE 171 Cb 0.08 -1.22 -0.03 0.00 -0.57 0.00 0.00 43.02 41.29 1ux2 s PHE 171 CO 0.33 0.62 -0.14 -1.83 -0.10 0.00 0.00 175.22 174.09 1ux2 s GLU 172 N -3.62 0.83 -0.12 0.44 -1.05 0.09 -4.82 118.70 110.45 1ux2 s GLU 172 Ca 0.32 -0.96 -0.19 0.00 -0.15 0.00 0.00 54.97 53.98 1ux2 s GLU 172 Cb -0.03 -0.85 -0.04 0.00 -0.44 0.00 0.00 34.13 32.77 1ux2 s GLU 172 CO 0.17 0.19 0.53 0.42 0.95 0.00 0.00 175.26 177.53 1ux2 s ILE 173 N -1.26 5.14 -0.22 1.83 1.01 -1.26 -1.46 121.20 124.98 1ux2 s ILE 173 Ca -0.02 1.06 -0.08 0.00 0.00 0.00 0.00 60.65 61.61 1ux2 s ILE 173 Cb -0.10 -3.87 -0.19 0.00 0.01 0.00 0.00 42.46 38.31 1ux2 s ILE 173 CO 0.02 0.28 -0.02 0.18 0.00 0.00 0.00 174.94 175.40 1ux2 n LEU 174 N 3.92 2.46 -3.60 2.97 4.77 0.47 -4.98 117.00 123.01 1ux2 n LEU 174 Ca -0.05 0.16 -0.14 0.00 -0.03 0.00 0.00 56.01 55.94 1ux2 n LEU 174 Cb 0.51 -0.96 -0.07 0.00 -2.33 0.00 0.00 43.42 40.58 1ux2 n LEU 174 CO 0.44 0.72 0.48 -0.62 -1.33 0.00 0.00 177.39 177.08 1ux2 s ASP 175 N -6.95 -0.67 -0.28 -1.43 -1.08 -1.05 -5.03 116.67 100.18 1ux2 s ASP 175 Ca -0.32 1.11 0.01 0.00 -0.52 0.00 0.00 52.55 52.84 1ux2 s ASP 175 Cb 0.09 1.07 0.08 0.00 -1.46 0.00 0.00 42.92 42.70 1ux2 s ASP 175 CO 0.62 -0.35 0.02 -0.69 0.52 0.00 0.00 175.17 175.29 1ux2 s VAL 176 N -0.18 1.55 -0.03 1.11 1.01 -1.26 -0.45 120.40 122.16 1ux2 s VAL 176 Ca -0.03 -1.58 -0.01 0.00 0.00 0.00 0.00 61.98 60.36 1ux2 s VAL 176 Cb -0.03 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.30 1ux2 s VAL 176 CO 0.03 -0.40 0.06 0.42 0.00 0.00 0.00 175.10 175.21 1ux2 s THR 177 N 1.32 4.67 -0.14 3.92 -4.23 -0.96 -4.96 115.64 115.27 1ux2 s THR 177 Ca 0.03 -0.34 -0.01 0.00 -1.18 0.00 0.00 61.69 60.19 1ux2 s THR 177 Cb -0.18 -3.09 -0.02 0.00 1.34 0.00 0.00 72.50 70.55 1ux2 s THR 177 CO -0.12 0.43 -0.11 -1.10 -0.54 0.00 0.00 174.62 173.18 1ux2 s GLN 178 N -1.49 3.43 0.08 3.99 -0.21 -1.26 -0.72 119.66 123.48 1ux2 s GLN 178 Ca 0.20 -0.65 0.04 0.00 0.02 0.00 0.00 55.36 54.97 1ux2 s GLN 178 Cb -0.12 -2.71 -0.03 0.00 1.00 0.00 0.00 33.01 31.15 1ux2 s GLN 178 CO 0.10 0.18 -0.12 0.21 -2.12 0.00 0.00 175.29 173.54 1ux2 s LYS 179 N 0.46 0.82 -0.12 2.91 2.20 -0.03 -4.99 119.74 120.99 1ux2 s LYS 179 Ca -0.08 -1.04 -0.02 0.00 -0.36 0.00 0.00 55.97 54.46 1ux2 s LYS 179 Cb -0.15 -0.67 -0.03 0.00 -1.51 0.00 0.00 37.83 35.47 1ux2 s LYS 179 CO 0.04 0.13 -0.04 0.21 -0.36 0.00 0.00 175.35 175.34 1ux2 s LYS 180 N -2.22 3.35 0.12 4.03 2.36 -1.26 0.55 119.74 126.68 1ux2 s LYS 180 Ca 0.01 -0.50 0.06 0.00 -2.55 0.00 0.00 55.97 52.99 1ux2 s LYS 180 Cb -0.07 -2.82 -0.04 0.00 -1.05 0.00 0.00 37.83 33.85 1ux2 s LYS 180 CO 0.01 0.42 -0.15 -0.80 1.55 0.00 0.00 175.35 176.38 1ux2 s ASN 181 N -0.12 2.08 -0.20 1.43 0.01 -0.43 -4.95 114.94 112.76 1ux2 s ASN 181 Ca 0.03 -0.79 -0.00 0.00 -0.71 0.00 0.00 52.86 51.38 1ux2 s ASN 181 Cb -0.13 -0.08 0.05 0.00 0.41 0.00 0.00 41.25 41.50 1ux2 s ASN 181 CO 0.02 -0.11 -0.04 -0.55 -1.51 0.00 0.00 177.10 174.91 1ux2 s SER 182 N -2.37 3.29 -0.06 -1.22 0.15 -1.26 -1.43 113.70 110.80 1ux2 s SER 182 Ca 0.08 -0.91 0.03 0.00 0.70 0.00 0.00 55.95 55.86 1ux2 s SER 182 Cb -0.06 -0.98 0.00 0.00 -1.71 0.00 0.00 66.02 63.27 1ux2 s SER 182 CO 0.03 -0.22 -0.15 -0.69 1.20 0.00 0.00 173.24 173.41 1ux2 s VAL 183 N 1.56 1.33 -0.27 4.45 1.01 0.09 -4.87 120.40 123.71 1ux2 s VAL 183 Ca -0.02 -0.62 -0.08 0.00 0.00 0.00 0.00 61.98 61.25 1ux2 s VAL 183 Cb -0.17 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 1ux2 s VAL 183 CO -0.07 0.39 0.10 -0.89 0.00 0.00 0.00 175.10 174.63 1ux2 s THR 184 N 0.34 4.47 0.27 3.92 2.01 -1.26 0.42 115.64 125.81 1ux2 s THR 184 Ca -0.10 -0.20 0.06 0.00 0.31 0.00 0.00 61.69 61.75 1ux2 s THR 184 Cb -0.14 -3.14 -0.03 0.00 0.01 0.00 0.00 72.50 69.20 1ux2 s THR 184 CO 0.03 0.26 0.36 -0.31 -0.69 0.00 0.00 174.62 174.28 1ux2 s TYR 185 N 1.63 3.30 0.33 4.92 2.02 -1.26 -5.03 117.35 123.26 1ux2 s TYR 185 Ca 0.06 -0.09 0.04 0.00 -0.37 0.00 0.00 57.07 56.70 1ux2 s TYR 185 Cb -0.16 -1.66 0.58 0.00 -0.40 0.00 0.00 41.96 40.32 1ux2 s TYR 185 CO 0.05 0.33 1.88 1.03 -1.57 0.00 0.00 175.55 177.26 1ux2 h SER 186 N 1.15 0.53 -0.63 2.29 0.87 -1.98 -3.07 113.55 112.71 1ux2 h SER 186 Ca -0.50 -0.09 0.08 0.00 -1.23 0.00 0.00 61.79 60.05 1ux2 h SER 186 Cb 1.24 -0.14 -0.04 0.00 -0.44 0.00 0.00 62.40 63.02 1ux2 h SER 186 CO 0.59 0.58 0.42 0.00 -0.53 0.00 0.00 176.83 177.89 1ux2 h PRO 189 N 6.05 0.00 -7.12 0.00 0.13 -1.87 -3.35 132.00 125.84 1ux2 h PRO 189 Ca -0.24 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.43 1ux2 h PRO 189 Cb 1.21 0.00 0.06 0.00 0.13 0.00 0.00 31.00 32.40 1ux2 h PRO 189 CO 0.49 0.43 0.15 -1.21 -0.23 0.00 0.00 178.00 177.62 1ux2 s GLU 190 N -3.69 2.53 0.03 0.86 8.01 -1.26 -4.96 118.70 120.22 1ux2 s GLU 190 Ca -0.01 -0.29 -0.16 0.00 0.01 0.00 0.00 54.97 54.52 1ux2 s GLU 190 Cb 0.12 -2.28 -0.06 0.00 -4.31 0.00 0.00 34.13 27.60 1ux2 s GLU 190 CO 0.71 -0.92 0.48 0.00 0.01 0.00 0.00 175.26 175.53 1ux2 s ALA 191 N -3.04 3.65 -0.13 5.21 0.00 -1.26 -4.42 121.76 121.77 1ux2 s ALA 191 Ca 0.57 -0.12 0.01 0.00 0.00 0.00 0.00 51.96 52.43 1ux2 s ALA 191 Cb -0.11 -2.49 -0.01 0.00 0.00 0.00 0.00 23.12 20.52 1ux2 s ALA 191 CO 0.43 0.45 -0.17 0.71 0.00 0.00 0.00 175.76 177.18 1ux2 s TYR 192 N -1.11 2.73 0.22 0.00 2.02 0.17 -0.31 117.35 121.06 1ux2 s TYR 192 Ca 0.26 -0.86 -0.16 0.00 -0.37 0.00 0.00 57.07 55.95 1ux2 s TYR 192 Cb -0.18 -1.81 -0.08 0.00 -0.40 0.00 0.00 41.96 39.49 1ux2 s TYR 192 CO 0.16 -0.33 0.65 -1.21 -1.57 0.00 0.00 175.55 173.24 1ux2 s GLU 193 N 0.45 4.06 0.04 -0.62 2.02 -1.26 -0.73 118.70 122.66 1ux2 s GLU 193 Ca -0.12 0.64 -0.06 0.00 0.02 0.00 0.00 54.97 55.45 1ux2 s GLU 193 Cb -0.16 -2.79 -0.01 0.00 0.10 0.00 0.00 34.13 31.27 1ux2 s GLU 193 CO 0.05 0.37 0.10 0.16 0.02 0.00 0.00 175.26 175.96 1ux2 s ASP 194 N -1.87 0.19 -0.20 -0.19 -4.77 -0.52 -4.02 116.67 105.30 1ux2 s ASP 194 Ca 0.44 -0.57 -0.12 0.00 -3.30 0.00 0.00 52.55 49.00 1ux2 s ASP 194 Cb -0.14 0.24 -0.05 0.00 -1.09 0.00 0.00 42.92 41.87 1ux2 s ASP 194 CO 0.20 -0.53 0.20 -0.69 0.70 0.00 0.00 175.17 175.05 1ux2 s VAL 195 N -2.80 5.35 -0.31 2.11 1.01 -0.14 -1.32 120.40 124.30 1ux2 s VAL 195 Ca -0.03 0.33 -0.11 0.00 0.00 0.00 0.00 61.98 62.16 1ux2 s VAL 195 Cb -0.00 -3.54 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 1ux2 s VAL 195 CO -0.05 0.38 0.19 -0.70 0.00 0.00 0.00 175.10 174.92 1ux2 s GLU 196 N 0.66 3.59 -0.25 2.72 2.12 0.19 -1.15 118.70 126.58 1ux2 s GLU 196 Ca 0.11 -0.57 -0.09 0.00 0.36 0.00 0.00 54.97 54.78 1ux2 s GLU 196 Cb -0.12 -3.68 -0.04 0.00 0.26 0.00 0.00 34.13 30.55 1ux2 s GLU 196 CO 0.02 -0.35 0.14 0.08 -0.54 0.00 0.00 175.26 174.61 1ux2 s VAL 197 N 1.70 5.03 -0.40 3.70 1.01 0.69 -0.85 120.40 131.28 1ux2 s VAL 197 Ca 0.06 0.07 -0.11 0.00 0.00 0.00 0.00 61.98 62.00 1ux2 s VAL 197 Cb -0.17 -3.35 0.05 0.00 0.00 0.00 0.00 36.38 32.91 1ux2 s VAL 197 CO 0.09 0.33 0.24 -0.44 0.00 0.00 0.00 175.10 175.32 1ux2 s SER 198 N 1.31 5.74 -0.52 3.32 0.01 0.11 -0.62 113.70 123.04 1ux2 s SER 198 Ca 0.06 -1.18 -0.19 0.00 1.31 0.00 0.00 55.95 55.95 1ux2 s SER 198 Cb -0.14 -2.02 0.07 0.00 0.21 0.00 0.00 66.02 64.13 1ux2 s SER 198 CO 0.06 -0.45 0.64 -0.22 0.41 0.00 0.00 173.24 173.68 1ux2 s LEU 199 N 1.52 5.04 -0.32 2.44 2.96 0.80 -2.26 118.68 128.86 1ux2 s LEU 199 Ca 0.02 -1.01 -0.19 0.00 -0.22 0.00 0.00 54.13 52.73 1ux2 s LEU 199 Cb -0.21 -2.42 -0.01 0.00 0.50 0.00 0.00 46.19 44.05 1ux2 s LEU 199 CO 0.05 -0.94 0.57 0.21 -1.32 0.00 0.00 176.35 174.92 1ux2 s ASN 200 N 2.87 6.41 0.11 3.68 2.47 0.40 -0.53 114.94 130.36 1ux2 s ASN 200 Ca 0.14 0.24 -0.09 0.00 0.42 0.00 0.00 52.86 53.57 1ux2 s ASN 200 Cb -0.20 -2.30 0.00 0.00 -1.45 0.00 0.00 41.25 37.30 1ux2 s ASN 200 CO 0.11 -0.47 0.23 0.72 -3.72 0.00 0.00 177.10 173.97 1ux2 s PHE 201 N 2.50 0.16 0.08 0.43 -0.12 -0.35 -0.40 117.98 120.29 1ux2 s PHE 201 Ca 0.22 -0.57 -0.09 0.00 -0.05 0.00 0.00 56.93 56.43 1ux2 s PHE 201 Cb -0.15 -0.03 0.00 0.00 -0.63 0.00 0.00 43.02 42.21 1ux2 s PHE 201 CO 0.12 -0.59 0.21 -0.98 -0.05 0.00 0.00 175.22 173.93 1ux2 s ARG 202 N -3.87 0.82 0.24 1.99 1.70 -0.53 -0.32 118.95 118.98 1ux2 s ARG 202 Ca 0.07 -0.86 -0.30 0.00 -0.47 0.00 0.00 55.73 54.18 1ux2 s ARG 202 Cb 0.04 0.34 -0.09 0.00 -0.57 0.00 0.00 34.95 34.67 1ux2 s ARG 202 CO -0.09 -0.26 1.25 0.21 -1.08 0.00 0.00 175.30 175.33 1ux2 s LYS 203 N -3.52 4.44 0.45 3.89 2.20 -0.19 -0.73 119.74 126.28 1ux2 s LYS 203 Ca 0.02 2.02 -0.24 0.00 -0.36 0.00 0.00 55.97 57.41 1ux2 s LYS 203 Cb 0.03 -3.17 -0.08 0.00 -1.51 0.00 0.00 37.83 33.10 1ux2 s LYS 203 CO -0.09 -0.12 1.23 0.15 -0.36 0.00 0.00 175.35 176.15 1ux2 s LYS 204 N -0.77 3.78 0.00 4.03 1.02 -0.53 -4.85 119.74 122.41 1ux2 s LYS 204 Ca 0.52 1.95 0.27 0.00 0.02 0.00 0.00 55.97 58.73 1ux2 s LYS 204 Cb -0.36 -2.53 0.79 0.00 -0.52 0.00 0.00 37.83 35.22 1ux2 s LYS 204 CO 0.42 -0.59 1.60 0.41 -0.92 0.00 0.00 175.35 176.27