#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 3.22 0.96 4.31 0.08 -1.26 -5.07 117.98 120.22 1ux2 s PHE 1 Ca 0.00 0.15 -0.15 0.00 0.12 0.00 0.00 56.93 57.05 1ux2 s PHE 1 Cb 0.00 -2.58 0.21 0.00 -0.57 0.00 0.00 43.02 40.08 1ux2 s PHE 1 CO 0.00 -0.31 1.31 0.16 -0.10 0.00 0.00 175.22 176.28 1ux2 s ASP 2 N 1.71 3.00 0.37 1.36 1.47 -1.26 -4.22 116.67 119.10 1ux2 s ASP 2 Ca 0.12 0.08 0.07 0.00 1.18 0.00 0.00 52.55 54.00 1ux2 s ASP 2 Cb -0.16 -0.07 0.73 0.00 -0.34 0.00 0.00 42.92 43.08 1ux2 s ASP 2 CO 0.11 -2.79 1.93 0.03 0.68 0.00 0.00 175.17 175.13 1ux2 h ARG 3 N -1.62 0.40 -0.76 2.11 3.08 -1.98 -1.92 114.38 113.69 1ux2 h ARG 3 Ca -0.43 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 59.52 1ux2 h ARG 3 Cb 1.22 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 31.17 1ux2 h ARG 3 CO 0.33 0.44 0.37 0.00 -1.07 0.00 0.00 179.97 180.03 1ux2 h ALA 4 N 1.61 1.21 -0.27 0.04 0.00 -1.99 -1.78 119.26 118.07 1ux2 h ALA 4 Ca 0.09 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 1ux2 h ALA 4 Cb 0.27 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1ux2 h ALA 4 CO 0.01 0.61 -0.45 -0.44 0.00 0.00 0.00 179.25 178.97 1ux2 h ASP 5 N 1.09 0.87 -0.08 0.00 3.32 -1.73 -1.38 116.42 118.51 1ux2 h ASP 5 Ca 0.26 -0.52 -0.00 0.00 0.02 0.00 0.00 57.03 56.79 1ux2 h ASP 5 Cb 0.11 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.41 1ux2 h ASP 5 CO -0.03 1.23 0.04 0.40 -1.72 0.00 0.00 179.24 179.15 1ux2 h ILE 6 N 0.54 1.10 -0.52 0.35 2.04 -1.30 -1.09 117.51 118.63 1ux2 h ILE 6 Ca 0.02 -0.28 -0.10 0.00 1.00 0.00 0.00 64.86 65.50 1ux2 h ILE 6 Cb 1.05 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 38.26 1ux2 h ILE 6 CO 0.10 0.08 -0.08 -0.07 0.00 0.00 0.00 178.15 178.19 1ux2 h LEU 7 N 0.01 0.94 0.08 1.44 3.38 -1.35 -1.11 115.31 118.70 1ux2 h LEU 7 Ca 0.03 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1ux2 h LEU 7 Cb 0.10 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1ux2 h LEU 7 CO -0.00 1.04 -0.09 0.22 0.09 0.00 0.00 178.44 179.70 1ux2 h TYR 8 N 0.86 -0.22 -0.71 1.13 3.20 -1.18 -0.17 116.97 119.87 1ux2 h TYR 8 Ca 0.14 0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.03 1ux2 h TYR 8 Cb 0.61 0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.93 1ux2 h TYR 8 CO 0.04 -0.14 0.47 -0.91 -1.64 0.00 0.00 178.16 175.98 1ux2 h ASN 9 N -0.19 0.80 -0.34 -2.11 2.35 -0.94 0.14 115.58 115.28 1ux2 h ASN 9 Ca 0.01 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1ux2 h ASN 9 Cb 0.19 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 1ux2 h ASN 9 CO -0.03 0.57 0.18 0.40 -1.65 0.00 0.00 177.43 176.90 1ux2 h ILE 10 N 0.94 1.15 -0.34 2.81 2.04 -1.10 -2.30 117.51 120.72 1ux2 h ILE 10 Ca 0.27 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 65.70 1ux2 h ILE 10 Cb -0.08 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 36.78 1ux2 h ILE 10 CO -0.07 0.15 0.15 -0.09 0.00 0.00 0.00 178.15 178.29 1ux2 h ARG 11 N 0.42 0.50 0.00 2.37 2.43 -0.52 0.27 114.38 119.85 1ux2 h ARG 11 Ca 0.12 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 59.14 1ux2 h ARG 11 Cb 0.09 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 1ux2 h ARG 11 CO -0.02 0.48 -0.29 1.96 -1.51 0.00 0.00 179.97 180.58 1ux2 h GLN 12 N 0.40 0.00 0.00 0.20 1.08 -0.97 -3.37 115.11 112.46 1ux2 h GLN 12 Ca 0.11 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.31 1ux2 h GLN 12 Cb 0.16 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 1ux2 h GLN 12 CO -0.01 0.29 -0.05 0.25 -0.95 0.00 0.00 178.83 178.36 1ux2 n THR 13 N -4.07 0.00 -2.34 -0.54 -2.24 -0.87 -5.00 114.28 99.23 1ux2 n THR 13 Ca -0.02 -0.35 -0.42 0.00 -2.27 0.00 0.00 64.05 60.99 1ux2 n THR 13 Cb 0.35 0.96 -0.03 0.00 -2.10 0.00 0.00 70.33 69.51 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 -0.81 7.00 -0.60 3.42 0.15 0.93 -4.97 113.70 118.82 1ux2 s SER 14 Ca 0.00 2.14 -0.08 0.00 0.70 0.00 0.00 55.95 58.71 1ux2 s SER 14 Cb 0.00 -2.58 0.15 0.00 -1.71 0.00 0.00 66.02 61.88 1ux2 s SER 14 CO 0.00 -0.52 0.46 -0.13 1.20 0.00 0.00 173.24 174.26 1ux2 s ARG 15 N 0.92 2.73 0.15 5.44 0.52 -1.26 -4.95 118.95 122.50 1ux2 s ARG 15 Ca 0.60 -2.18 0.18 0.00 -0.52 0.00 0.00 55.73 53.81 1ux2 s ARG 15 Cb -0.32 -3.95 0.80 0.00 0.52 0.00 0.00 34.95 31.99 1ux2 s ARG 15 CO 0.30 -1.20 1.57 -2.30 0.02 0.00 0.00 175.30 173.69 1ux2 n PRO 16 N 4.20 0.11 0.00 3.54 -0.02 -1.26 -1.22 135.00 140.35 1ux2 n PRO 16 Ca 0.02 0.39 0.13 0.00 -2.02 0.00 0.00 63.50 62.02 1ux2 n PRO 16 Cb 0.41 -1.72 0.30 0.00 -0.02 0.00 0.00 33.50 32.47 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 -1.92 2.18 -4.32 2.55 8.00 -1.26 -3.87 116.55 117.91 1ux2 n ASP 17 Ca 0.02 -1.70 -0.38 0.00 0.71 0.00 0.00 54.79 53.44 1ux2 n ASP 17 Cb 0.17 0.03 -0.12 0.00 -0.02 0.00 0.00 41.12 41.18 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 -2.04 4.00 0.11 2.53 1.01 -0.36 -5.06 120.40 120.59 1ux2 s VAL 18 Ca 0.32 -0.92 -0.31 0.00 0.00 0.00 0.00 61.98 61.07 1ux2 s VAL 18 Cb 0.20 -3.18 -0.10 0.00 0.00 0.00 0.00 36.38 33.30 1ux2 s VAL 18 CO 0.34 -0.09 1.81 -0.51 0.00 0.00 0.00 175.10 176.64 1ux2 s ILE 19 N 1.47 2.63 -0.34 2.22 2.07 -1.26 -4.82 121.20 123.17 1ux2 s ILE 19 Ca 0.01 0.12 -0.06 0.00 -1.41 0.00 0.00 60.65 59.30 1ux2 s ILE 19 Cb -0.19 -3.07 -0.20 0.00 0.13 0.00 0.00 42.46 39.13 1ux2 s ILE 19 CO 0.03 -0.00 3.10 -0.81 -1.91 0.00 0.00 174.94 175.35 1ux2 n PRO 20 N 5.75 2.09 -2.05 3.50 -0.04 -1.26 -4.93 135.00 138.05 1ux2 n PRO 20 Ca 0.18 -1.13 -0.42 0.00 -0.04 0.00 0.00 63.50 62.08 1ux2 n PRO 20 Cb 0.39 -2.12 -0.03 0.00 -0.04 0.00 0.00 33.50 31.70 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 1.57 2.98 -0.13 0.52 -4.23 -1.26 -4.83 115.64 110.27 1ux2 s THR 21 Ca 0.59 0.70 -0.00 0.00 -1.18 0.00 0.00 61.69 61.80 1ux2 s THR 21 Cb 0.25 -3.45 -0.02 0.00 1.34 0.00 0.00 72.50 70.63 1ux2 s THR 21 CO -0.01 0.05 -0.13 -1.10 -0.54 0.00 0.00 174.62 172.89 1ux2 s GLN 22 N 1.18 3.34 -1.63 3.99 -1.52 -1.26 -4.71 119.66 119.05 1ux2 s GLN 22 Ca 0.67 -0.68 -0.02 0.00 -1.95 0.00 0.00 55.36 53.38 1ux2 s GLN 22 Cb -0.40 -2.63 0.01 0.00 -0.22 0.00 0.00 33.01 29.77 1ux2 s GLN 22 CO 0.31 0.24 0.28 -2.13 -0.25 0.00 0.00 175.29 173.73 1ux2 n ARG 23 N 3.44 -3.15 -1.89 2.91 0.63 -1.26 -1.94 116.66 115.41 1ux2 n ARG 23 Ca -0.18 0.92 -0.17 0.00 -0.92 0.00 0.00 57.85 57.51 1ux2 n ARG 23 Cb 0.53 -5.68 -0.04 0.00 0.45 0.00 0.00 32.46 27.72 1ux2 n ARG 23 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1ux2 n ASP 24 N -2.23 -4.66 -4.90 6.15 2.03 -1.26 -4.98 116.55 106.69 1ux2 n ASP 24 Ca -0.18 0.27 -0.30 0.00 0.52 0.00 0.00 54.79 55.11 1ux2 n ASP 24 Cb 0.65 -4.08 -0.04 0.00 -0.72 0.00 0.00 41.12 36.93 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 -4.11 3.61 0.63 -0.67 0.52 -0.82 -4.98 118.95 113.13 1ux2 s ARG 25 Ca 0.00 -0.10 -0.18 0.00 -0.52 0.00 0.00 55.73 54.94 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 0.39 1.19 -1.25 0.02 0.00 0.00 175.30 175.65 1ux2 s PRO 26 N -2.99 2.79 -0.04 3.54 0.04 -1.15 -4.12 135.00 133.07 1ux2 s PRO 26 Ca 0.42 1.75 -0.30 0.00 0.04 0.00 0.00 61.00 62.91 1ux2 s PRO 26 Cb -0.11 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 1ux2 s PRO 26 CO 0.26 -1.33 1.30 0.08 0.04 0.00 0.00 177.00 177.36 1ux2 s VAL 27 N -1.78 4.00 -0.54 -0.36 1.01 0.95 -4.79 120.40 118.90 1ux2 s VAL 27 Ca 0.75 1.34 -0.25 0.00 0.00 0.00 0.00 61.98 63.82 1ux2 s VAL 27 Cb -0.29 -3.86 0.04 0.00 0.00 0.00 0.00 36.38 32.27 1ux2 s VAL 27 CO 0.36 -0.01 0.99 0.00 0.00 0.00 0.00 175.10 176.44 1ux2 s ALA 28 N 2.45 3.14 -0.23 5.51 0.00 -1.26 -1.61 121.76 129.77 1ux2 s ALA 28 Ca 0.60 -1.08 -0.10 0.00 0.00 0.00 0.00 51.96 51.37 1ux2 s ALA 28 Cb -0.28 -3.78 -0.05 0.00 0.00 0.00 0.00 23.12 19.02 1ux2 s ALA 28 CO 0.23 -2.38 0.15 0.08 0.00 0.00 0.00 175.76 173.84 1ux2 s VAL 29 N 4.11 5.37 -0.19 0.00 1.01 0.17 -4.44 120.40 126.44 1ux2 s VAL 29 Ca 0.34 0.18 -0.12 0.00 0.00 0.00 0.00 61.98 62.39 1ux2 s VAL 29 Cb -0.11 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1ux2 s VAL 29 CO 0.22 0.38 0.20 -0.44 0.00 0.00 0.00 175.10 175.45 1ux2 s SER 30 N 0.83 6.29 -0.07 3.32 0.01 0.48 -1.06 113.70 123.50 1ux2 s SER 30 Ca 0.08 0.33 0.03 0.00 1.31 0.00 0.00 55.95 57.70 1ux2 s SER 30 Cb -0.13 -2.13 0.01 0.00 0.21 0.00 0.00 66.02 63.98 1ux2 s SER 30 CO 0.02 0.14 -0.17 -0.69 0.41 0.00 0.00 173.24 172.96 1ux2 s VAL 31 N 0.44 1.47 -0.09 3.43 1.01 -0.41 -1.70 120.40 124.54 1ux2 s VAL 31 Ca 0.11 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.37 1ux2 s VAL 31 Cb -0.12 -1.30 0.05 0.00 0.00 0.00 0.00 36.38 35.01 1ux2 s VAL 31 CO 0.00 0.43 0.19 -0.55 0.00 0.00 0.00 175.10 175.17 1ux2 s SER 32 N 0.44 0.12 -0.16 3.32 0.15 -0.10 -3.63 113.70 113.84 1ux2 s SER 32 Ca -0.14 0.41 -0.14 0.00 0.70 0.00 0.00 55.95 56.78 1ux2 s SER 32 Cb -0.16 0.34 -0.05 0.00 -1.71 0.00 0.00 66.02 64.45 1ux2 s SER 32 CO 0.05 -0.19 0.31 -0.76 1.20 0.00 0.00 173.24 173.86 1ux2 s LEU 33 N 1.64 4.24 -0.28 3.45 1.43 -1.26 -0.61 118.68 127.30 1ux2 s LEU 33 Ca -0.05 0.54 -0.02 0.00 -1.03 0.00 0.00 54.13 53.57 1ux2 s LEU 33 Cb -0.11 -2.41 0.04 0.00 0.03 0.00 0.00 46.19 43.73 1ux2 s LEU 33 CO -0.07 0.08 -0.02 -0.54 0.23 0.00 0.00 176.35 176.03 1ux2 s LYS 34 N 0.50 2.66 0.18 1.70 -0.14 -0.48 -4.96 119.74 119.20 1ux2 s LYS 34 Ca 0.18 -1.11 -0.30 0.00 -1.36 0.00 0.00 55.97 53.38 1ux2 s LYS 34 Cb -0.13 -3.10 -0.07 0.00 -1.68 0.00 0.00 37.83 32.84 1ux2 s LYS 34 CO 0.05 -0.51 1.01 -0.06 -0.76 0.00 0.00 175.35 175.07 1ux2 s PHE 35 N 1.30 3.78 -0.09 3.18 0.08 -1.26 -0.50 117.98 124.47 1ux2 s PHE 35 Ca -0.02 1.77 0.00 0.00 0.12 0.00 0.00 56.93 58.80 1ux2 s PHE 35 Cb -0.18 -3.12 -0.06 0.00 -0.57 0.00 0.00 43.02 39.10 1ux2 s PHE 35 CO -0.02 -0.02 -0.08 -0.89 -0.10 0.00 0.00 175.22 174.11 1ux2 n ILE 36 N 2.20 0.50 -3.68 0.64 2.08 0.61 -3.38 119.36 118.33 1ux2 n ILE 36 Ca 0.01 -0.19 -0.14 0.00 0.56 0.00 0.00 62.75 62.99 1ux2 n ILE 36 Cb 0.47 -0.87 -0.07 0.00 -0.75 0.00 0.00 39.64 38.42 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 -4.92 -0.33 -0.24 4.38 3.84 -0.83 -0.19 114.94 116.65 1ux2 s ASN 37 Ca -0.12 0.20 0.02 0.00 0.21 0.00 0.00 52.86 53.18 1ux2 s ASN 37 Cb 0.03 0.40 0.05 0.00 -0.55 0.00 0.00 41.25 41.18 1ux2 s ASN 37 CO 0.20 -0.55 -0.13 -0.63 -2.79 0.00 0.00 177.10 173.20 1ux2 s ILE 38 N -1.65 2.19 -0.21 -5.21 1.01 -1.26 -0.87 121.20 115.19 1ux2 s ILE 38 Ca -0.10 -1.43 -0.01 0.00 0.00 0.00 0.00 60.65 59.11 1ux2 s ILE 38 Cb -0.03 -2.19 -0.20 0.00 0.01 0.00 0.00 42.46 40.06 1ux2 s ILE 38 CO 0.04 0.13 -0.03 0.18 0.00 0.00 0.00 174.94 175.25 1ux2 n LEU 39 N 4.49 2.85 -3.73 2.97 4.77 0.24 -4.58 117.00 124.01 1ux2 n LEU 39 Ca -0.16 -0.02 -0.13 0.00 -0.03 0.00 0.00 56.01 55.67 1ux2 n LEU 39 Cb 0.44 -0.97 -0.10 0.00 -2.33 0.00 0.00 43.42 40.46 1ux2 n LEU 39 CO 0.23 0.91 0.06 -0.70 -1.33 0.00 0.00 177.39 176.56 1ux2 s GLU 40 N -2.53 0.44 0.00 3.23 2.12 -1.18 -4.99 118.70 115.79 1ux2 s GLU 40 Ca -0.31 0.60 0.01 0.00 0.36 0.00 0.00 54.97 55.64 1ux2 s GLU 40 Cb 0.08 0.16 -0.01 0.00 0.26 0.00 0.00 34.13 34.63 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 0.48 0.38 -0.19 3.70 1.01 -1.26 -0.60 120.40 123.92 1ux2 s VAL 41 Ca -0.02 -0.35 -0.04 0.00 0.00 0.00 0.00 61.98 61.57 1ux2 s VAL 41 Cb -0.04 -0.35 0.06 0.00 0.00 0.00 0.00 36.38 36.06 1ux2 s VAL 41 CO -0.02 0.01 0.08 0.21 0.00 0.00 0.00 175.10 175.37 1ux2 s ASN 42 N -0.37 2.68 0.45 3.32 3.84 -0.70 -5.02 114.94 119.13 1ux2 s ASN 42 Ca -0.01 -0.77 0.24 0.00 0.21 0.00 0.00 52.86 52.54 1ux2 s ASN 42 Cb -0.03 -0.38 0.58 0.00 -0.55 0.00 0.00 41.25 40.87 1ux2 s ASN 42 CO -0.00 -0.35 1.69 -0.08 -2.79 0.00 0.00 177.10 175.57 1ux2 h GLU 43 N 8.36 0.00 -0.01 0.43 4.81 -1.88 0.04 114.58 126.33 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 1.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.51 1ux2 h GLU 43 CO 0.32 0.08 -0.15 0.82 -0.73 0.00 0.00 179.01 179.36 1ux2 h ILE 44 N 0.00 1.54 0.00 2.32 1.08 -1.97 -3.33 117.51 117.15 1ux2 h ILE 44 Ca -0.00 -1.79 0.00 0.00 -0.39 0.00 0.00 64.86 62.68 1ux2 h ILE 44 Cb 0.92 2.67 0.00 0.00 -3.07 0.00 0.00 36.82 37.34 1ux2 h ILE 44 CO 0.01 0.48 -0.51 0.35 -0.69 0.00 0.00 178.15 177.79 1ux2 n THR 45 N -4.60 0.06 -3.40 -0.27 -2.24 -1.21 -4.97 114.28 97.65 1ux2 n THR 45 Ca -0.09 -0.05 -0.17 0.00 -2.27 0.00 0.00 64.05 61.47 1ux2 n THR 45 Cb 0.43 0.15 0.08 0.00 -2.10 0.00 0.00 70.33 68.89 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 -1.62 -3.37 -4.06 3.42 3.02 -0.03 -4.93 115.26 107.69 1ux2 n ASN 46 Ca 0.05 -0.67 -0.22 0.00 -0.03 0.00 0.00 54.58 53.72 1ux2 n ASN 46 Cb 0.36 -5.05 -0.15 0.00 -0.61 0.00 0.00 39.78 34.32 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 -5.13 1.13 0.11 3.52 2.02 -1.03 -2.04 118.70 117.27 1ux2 s GLU 47 Ca 0.14 -0.42 0.09 0.00 0.02 0.00 0.00 54.97 54.80 1ux2 s GLU 47 Cb -0.02 -1.05 -0.04 0.00 0.10 0.00 0.00 34.13 33.12 1ux2 s GLU 47 CO 0.74 0.21 -0.22 0.14 0.02 0.00 0.00 175.26 176.15 1ux2 s VAL 48 N -0.05 1.78 -0.18 2.63 -7.23 -0.39 -1.73 120.40 115.23 1ux2 s VAL 48 Ca 0.00 -1.57 0.00 0.00 -1.81 0.00 0.00 61.98 58.61 1ux2 s VAL 48 Cb -0.07 -1.61 0.01 0.00 0.56 0.00 0.00 36.38 35.27 1ux2 s VAL 48 CO 0.00 -0.04 -0.17 -0.62 -0.31 0.00 0.00 175.10 173.96 1ux2 s ASP 49 N -1.92 3.35 0.12 4.85 -1.08 0.24 -0.35 116.67 121.88 1ux2 s ASP 49 Ca 0.07 -0.59 0.04 0.00 -0.52 0.00 0.00 52.55 51.55 1ux2 s ASP 49 Cb -0.10 -1.53 -0.04 0.00 -1.46 0.00 0.00 42.92 39.79 1ux2 s ASP 49 CO 0.04 0.01 -0.11 -0.69 0.52 0.00 0.00 175.17 174.94 1ux2 s VAL 50 N 1.27 1.10 -0.13 1.11 1.01 -0.55 -0.60 120.40 123.62 1ux2 s VAL 50 Ca 0.04 -1.82 0.02 0.00 0.00 0.00 0.00 61.98 60.21 1ux2 s VAL 50 Cb -0.13 -1.59 0.01 0.00 0.00 0.00 0.00 36.38 34.67 1ux2 s VAL 50 CO -0.10 -0.61 -0.18 -0.69 0.00 0.00 0.00 175.10 173.52 1ux2 s VAL 51 N -2.75 1.73 -0.03 2.92 1.01 -0.05 -1.76 120.40 121.47 1ux2 s VAL 51 Ca 0.11 -0.78 -0.09 0.00 0.00 0.00 0.00 61.98 61.22 1ux2 s VAL 51 Cb -0.01 -1.56 0.01 0.00 0.00 0.00 0.00 36.38 34.82 1ux2 s VAL 51 CO 0.01 0.49 0.20 0.72 0.00 0.00 0.00 175.10 176.51 1ux2 s PHE 52 N 0.98 -0.11 -0.16 5.22 -0.12 -0.19 -0.29 117.98 123.31 1ux2 s PHE 52 Ca -0.05 0.21 -0.29 0.00 -0.05 0.00 0.00 56.93 56.75 1ux2 s PHE 52 Cb -0.15 0.03 -0.00 0.00 -0.63 0.00 0.00 43.02 42.27 1ux2 s PHE 52 CO -0.03 -0.24 1.01 -1.58 -0.05 0.00 0.00 175.22 174.33 1ux2 s TRP 53 N -0.81 3.43 -1.07 3.49 0.51 0.35 -0.43 118.94 124.42 1ux2 s TRP 53 Ca -0.09 1.53 -0.13 0.00 -2.12 0.00 0.00 56.10 55.29 1ux2 s TRP 53 Cb -0.05 -3.22 0.22 0.00 -0.81 0.00 0.00 33.47 29.61 1ux2 s TRP 53 CO 0.02 -0.34 1.15 -1.14 -0.51 0.00 0.00 176.95 176.13 1ux2 s GLN 54 N 2.53 3.99 -0.27 4.98 0.74 -0.26 -1.38 119.66 129.99 1ux2 s GLN 54 Ca 0.46 -2.71 -0.29 0.00 0.05 0.00 0.00 55.36 52.87 1ux2 s GLN 54 Cb -0.17 -4.73 -0.01 0.00 1.10 0.00 0.00 33.01 29.20 1ux2 s GLN 54 CO 0.13 -1.47 1.49 -1.14 -0.55 0.00 0.00 175.29 173.74 1ux2 s GLN 55 N 0.33 3.80 -0.09 1.67 0.74 0.22 -4.05 119.66 122.29 1ux2 s GLN 55 Ca 0.32 1.43 0.01 0.00 0.05 0.00 0.00 55.36 57.18 1ux2 s GLN 55 Cb -0.07 -3.98 0.02 0.00 1.10 0.00 0.00 33.01 30.07 1ux2 s GLN 55 CO -0.06 -1.27 -0.11 0.99 -0.55 0.00 0.00 175.29 174.28 1ux2 s THR 56 N 4.97 1.19 0.02 -0.34 2.01 0.04 -0.92 115.64 122.61 1ux2 s THR 56 Ca 0.65 -0.46 0.05 0.00 0.31 0.00 0.00 61.69 62.24 1ux2 s THR 56 Cb -0.21 -1.12 -0.02 0.00 0.01 0.00 0.00 72.50 71.17 1ux2 s THR 56 CO 0.27 0.38 -0.14 0.42 -0.69 0.00 0.00 174.62 174.86 1ux2 s THR 57 N 1.07 1.08 0.27 -0.82 -4.23 -0.69 -0.38 115.64 111.94 1ux2 s THR 57 Ca -0.07 -0.86 -0.19 0.00 -1.18 0.00 0.00 61.69 59.40 1ux2 s THR 57 Cb -0.15 -0.96 0.01 0.00 1.34 0.00 0.00 72.50 72.75 1ux2 s THR 57 CO -0.01 0.09 0.66 -1.66 -0.54 0.00 0.00 174.62 173.16 1ux2 s TRP 58 N -0.68 -0.05 -0.10 3.99 -2.14 -1.08 -0.39 118.94 118.49 1ux2 s TRP 58 Ca 0.03 -0.38 -0.03 0.00 2.66 0.00 0.00 56.10 58.38 1ux2 s TRP 58 Cb -0.07 0.57 -0.03 0.00 -3.10 0.00 0.00 33.47 30.84 1ux2 s TRP 58 CO 0.01 -1.17 0.01 0.45 -2.66 0.00 0.00 176.95 173.59 1ux2 s SER 59 N -2.94 5.32 -0.33 -2.66 0.15 -1.26 -0.81 113.70 111.17 1ux2 s SER 59 Ca 0.14 0.14 -0.02 0.00 0.70 0.00 0.00 55.95 56.91 1ux2 s SER 59 Cb -0.05 -1.59 0.12 0.00 -1.71 0.00 0.00 66.02 62.80 1ux2 s SER 59 CO 0.07 0.35 0.17 -0.62 1.20 0.00 0.00 173.24 174.41 1ux2 s ASP 60 N -0.68 3.32 0.00 5.45 -1.08 0.62 -4.89 116.67 119.41 1ux2 s ASP 60 Ca 0.11 -1.81 0.15 0.00 -0.52 0.00 0.00 52.55 50.48 1ux2 s ASP 60 Cb -0.12 -0.45 0.64 0.00 -1.46 0.00 0.00 42.92 41.53 1ux2 s ASP 60 CO 0.02 -0.37 1.48 0.54 0.52 0.00 0.00 175.17 177.36 1ux2 n ARG 61 N 4.56 0.00 0.05 4.34 5.12 -1.26 -1.75 116.66 127.72 1ux2 n ARG 61 Ca 0.03 0.25 0.10 0.00 -1.93 0.00 0.00 57.85 56.31 1ux2 n ARG 61 Cb 0.39 -1.51 0.42 0.00 -1.16 0.00 0.00 32.46 30.61 1ux2 n ARG 61 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1ux2 n THR 62 N -1.51 0.74 0.47 0.55 -2.24 -1.26 -2.55 114.28 108.47 1ux2 n THR 62 Ca 0.04 0.15 0.12 0.00 -2.27 0.00 0.00 64.05 62.08 1ux2 n THR 62 Cb 0.17 -0.91 0.14 0.00 -2.10 0.00 0.00 70.33 67.63 1ux2 n THR 62 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1ux2 h LEU 63 N 0.00 0.00-10.06 3.22 3.38 -1.68 -3.47 115.31 106.70 1ux2 h LEU 63 Ca 0.00 -0.17 -0.54 0.00 0.09 0.00 0.00 57.88 57.26 1ux2 h LEU 63 Cb 0.37 0.00 0.13 0.00 0.09 0.00 0.00 40.66 41.25 1ux2 h LEU 63 CO 0.00 0.08 0.56 0.00 0.09 0.00 0.00 178.44 179.17 1ux2 s ALA 64 N -3.21 2.73 0.06 1.53 0.00 -1.06 -4.75 121.76 117.07 1ux2 s ALA 64 Ca 0.05 1.23 -0.01 0.00 0.00 0.00 0.00 51.96 53.23 1ux2 s ALA 64 Cb 0.12 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 1ux2 s ALA 64 CO 0.73 -1.29 -0.03 1.67 0.00 0.00 0.00 175.76 176.84 1ux2 s TRP 65 N -1.38 0.57 -0.45 0.00 -2.14 -0.75 -4.98 118.94 109.81 1ux2 s TRP 65 Ca 0.73 -1.05 -0.28 0.00 2.66 0.00 0.00 56.10 58.16 1ux2 s TRP 65 Cb -0.37 -0.41 0.00 0.00 -3.10 0.00 0.00 33.47 29.59 1ux2 s TRP 65 CO 0.43 -0.35 1.55 1.21 -2.66 0.00 0.00 176.95 177.13 1ux2 s ASN 66 N -2.94 6.06 -0.27 -2.66 3.84 -1.26 -4.67 114.94 113.05 1ux2 s ASN 66 Ca 0.08 0.74 0.12 0.00 0.21 0.00 0.00 52.86 54.01 1ux2 s ASN 66 Cb 0.08 -2.54 0.61 0.00 -0.55 0.00 0.00 41.25 38.85 1ux2 s ASN 66 CO -0.09 -1.68 1.59 -1.54 -2.79 0.00 0.00 177.10 172.59 1ux2 n SER 67 N 9.80 3.95 0.19 -4.21 3.41 -1.26 -4.59 113.62 120.91 1ux2 n SER 67 Ca 0.17 -3.28 0.06 0.00 -0.26 0.00 0.00 58.87 55.57 1ux2 n SER 67 Cb 0.48 -0.65 0.55 0.00 -0.26 0.00 0.00 64.21 64.33 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 1.96 0.12 -0.13 4.04 4.64 -1.95 -3.01 113.55 119.22 1ux2 h SER 68 Ca 0.16 -0.01 -0.17 0.00 -0.47 0.00 0.00 61.79 61.30 1ux2 h SER 68 Cb 1.86 -0.03 -0.29 0.00 -0.31 0.00 0.00 62.40 63.64 1ux2 h SER 68 CO 0.48 0.14 -0.89 1.41 -0.87 0.00 0.00 176.83 177.10 1ux2 n HIS 69 N -4.47 0.43 -4.04 4.77 8.25 -1.26 -5.08 115.22 113.82 1ux2 n HIS 69 Ca -0.01 -1.17 -0.08 0.00 -0.26 0.00 0.00 57.72 56.20 1ux2 n HIS 69 Cb 0.13 -0.21 -0.09 0.00 1.12 0.00 0.00 29.99 30.94 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 -2.75 0.37 0.30 0.41 0.01 -1.14 -3.11 113.70 107.79 1ux2 s SER 70 Ca 0.35 -0.94 -0.28 0.00 1.31 0.00 0.00 55.95 56.39 1ux2 s SER 70 Cb 0.38 0.25 -0.13 0.00 0.21 0.00 0.00 66.02 66.72 1ux2 s SER 70 CO -0.11 -0.65 1.14 -2.65 0.41 0.00 0.00 173.24 171.38 1ux2 n PRO 71 N 0.04 1.68 -0.24 12.44 -0.02 -1.26 -4.76 135.00 142.88 1ux2 n PRO 71 Ca -0.13 0.59 0.12 0.00 -2.02 0.00 0.00 63.50 62.06 1ux2 n PRO 71 Cb 0.62 -2.06 0.24 0.00 -0.02 0.00 0.00 33.50 32.28 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 1.13 3.61 -3.75 2.55 3.85 -1.26 -4.84 116.55 117.83 1ux2 n ASP 72 Ca 0.08 -1.99 -0.13 0.00 -0.71 0.00 0.00 54.79 52.04 1ux2 n ASP 72 Cb 0.33 -0.32 -0.10 0.00 -1.35 0.00 0.00 41.12 39.68 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 -1.34 0.46 0.05 0.11 -0.21 -1.26 -0.30 119.66 117.17 1ux2 s GLN 73 Ca 0.41 0.40 -0.02 0.00 0.02 0.00 0.00 55.36 56.18 1ux2 s GLN 73 Cb 0.23 0.22 -0.03 0.00 1.00 0.00 0.00 33.01 34.43 1ux2 s GLN 73 CO 0.32 -0.07 -0.01 0.14 -2.12 0.00 0.00 175.29 173.55 1ux2 s VAL 74 N -0.04 0.19 -0.13 1.09 -7.23 -0.31 -4.99 120.40 108.98 1ux2 s VAL 74 Ca -0.02 -1.56 -0.14 0.00 -1.81 0.00 0.00 61.98 58.45 1ux2 s VAL 74 Cb -0.03 -1.25 -0.05 0.00 0.56 0.00 0.00 36.38 35.62 1ux2 s VAL 74 CO 0.01 -0.86 0.32 -0.44 -0.31 0.00 0.00 175.10 173.82 1ux2 s SER 75 N -2.61 6.52 -0.04 4.85 0.01 -1.26 -0.35 113.70 120.82 1ux2 s SER 75 Ca 0.02 0.62 0.02 0.00 1.31 0.00 0.00 55.95 57.92 1ux2 s SER 75 Cb 0.04 -2.20 0.01 0.00 0.21 0.00 0.00 66.02 64.08 1ux2 s SER 75 CO -0.08 0.15 -0.08 -0.69 0.41 0.00 0.00 173.24 172.94 1ux2 s VAL 76 N 0.13 0.79 0.27 3.43 1.01 0.26 -4.94 120.40 121.36 1ux2 s VAL 76 Ca 0.19 -0.32 -0.30 0.00 0.00 0.00 0.00 61.98 61.55 1ux2 s VAL 76 Cb -0.14 -0.74 -0.11 0.00 0.00 0.00 0.00 36.38 35.39 1ux2 s VAL 76 CO 0.06 0.27 1.60 -2.84 0.00 0.00 0.00 175.10 174.19 1ux2 s PRO 77 N 0.53 4.13 0.63 2.72 0.02 -1.26 -0.64 135.00 141.13 1ux2 s PRO 77 Ca -0.09 2.56 0.40 0.00 0.02 0.00 0.00 61.00 63.89 1ux2 s PRO 77 Cb -0.12 -3.04 2.13 0.00 0.02 0.00 0.00 34.50 33.49 1ux2 s PRO 77 CO 0.01 -0.63 2.29 -0.84 -0.33 0.00 0.00 177.00 177.49 1ux2 h ILE 78 N 3.48 0.13 0.00 2.83 3.07 -1.73 -0.38 117.51 124.91 1ux2 h ILE 78 Ca -0.46 -0.11 0.00 0.00 1.55 0.00 0.00 64.86 65.84 1ux2 h ILE 78 Cb 1.22 1.09 0.00 0.00 -0.27 0.00 0.00 36.82 38.86 1ux2 h ILE 78 CO 0.82 0.01 0.00 0.77 -1.05 0.00 0.00 178.15 178.70 1ux2 h SER 79 N 0.00 0.00 0.01 2.16 4.64 -1.88 -1.16 113.55 117.32 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 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1ux2 h SER 79 CO 0.00 0.00 -0.13 -1.20 -0.87 0.00 0.00 176.83 174.63 1ux2 n SER 80 N -2.74 2.16 -4.39 4.97 7.64 -0.15 -4.91 113.62 116.20 1ux2 n SER 80 Ca -0.01 -1.63 -0.25 0.00 1.01 0.00 0.00 58.87 57.99 1ux2 n SER 80 Cb 0.14 0.12 -0.12 0.00 -1.01 0.00 0.00 64.21 63.34 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 -2.17 2.44 0.19 -3.43 1.43 -0.44 -4.62 118.68 112.08 1ux2 s LEU 81 Ca 0.28 -0.87 -0.30 0.00 -1.03 0.00 0.00 54.13 52.21 1ux2 s LEU 81 Cb 0.20 -1.05 -0.08 0.00 0.03 0.00 0.00 46.19 45.29 1ux2 s LEU 81 CO 0.39 0.07 1.30 0.86 0.23 0.00 0.00 176.35 179.20 1ux2 s TRP 82 N -1.81 3.28 0.01 0.29 -0.00 -1.25 -4.62 118.94 114.84 1ux2 s TRP 82 Ca 0.19 1.23 0.06 0.00 -0.00 0.00 0.00 56.10 57.58 1ux2 s TRP 82 Cb -0.07 -3.58 -0.02 0.00 -0.00 0.00 0.00 33.47 29.80 1ux2 s TRP 82 CO 0.09 -1.81 -0.17 0.08 -0.00 0.00 0.00 176.95 175.14 1ux2 s VAL 83 N 0.19 1.38 0.45 5.86 1.01 -1.26 -5.05 120.40 122.98 1ux2 s VAL 83 Ca 0.57 -0.87 -0.25 0.00 0.00 0.00 0.00 61.98 61.43 1ux2 s VAL 83 Cb -0.36 -1.17 -0.08 0.00 0.00 0.00 0.00 36.38 34.77 1ux2 s VAL 83 CO 0.37 0.29 1.40 -2.16 0.00 0.00 0.00 175.10 175.00 1ux2 s PRO 84 N -0.67 3.68 -0.98 2.72 0.04 -1.26 -4.87 135.00 133.64 1ux2 s PRO 84 Ca 0.06 2.35 -0.06 0.00 0.04 0.00 0.00 61.00 63.39 1ux2 s PRO 84 Cb -0.07 -2.63 0.01 0.00 0.04 0.00 0.00 34.50 31.84 1ux2 s PRO 84 CO 0.00 -0.80 2.78 -0.40 0.04 0.00 0.00 177.00 178.62 1ux2 n ASP 85 N -0.23 7.42 -4.78 6.66 5.75 -1.26 -4.96 116.55 125.15 1ux2 n ASP 85 Ca 0.05 -2.94 -0.36 0.00 -0.01 0.00 0.00 54.79 51.53 1ux2 n ASP 85 Cb 0.42 -1.38 -0.04 0.00 -1.03 0.00 0.00 41.12 39.10 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 -1.36 4.08 -0.11 -2.12 1.43 -1.26 -0.77 118.68 118.56 1ux2 s LEU 86 Ca 0.60 2.04 -0.12 0.00 -1.03 0.00 0.00 54.13 55.62 1ux2 s LEU 86 Cb 0.25 -4.26 0.03 0.00 0.03 0.00 0.00 46.19 42.25 1ux2 s LEU 86 CO -0.11 -0.58 0.34 0.00 0.23 0.00 0.00 176.35 176.23 1ux2 s ALA 87 N -1.71 -0.84 -0.25 4.21 0.00 -0.10 -4.84 121.76 118.23 1ux2 s ALA 87 Ca 0.60 0.87 -0.27 0.00 0.00 0.00 0.00 51.96 53.16 1ux2 s ALA 87 Cb -0.22 -0.47 0.01 0.00 0.00 0.00 0.00 23.12 22.44 1ux2 s ALA 87 CO 0.27 -0.18 0.96 0.00 0.00 0.00 0.00 175.76 176.81 1ux2 s ALA 88 N -0.05 3.65 0.35 0.00 0.00 -1.26 -2.22 121.76 122.23 1ux2 s ALA 88 Ca -0.02 0.02 0.03 0.00 0.00 0.00 0.00 51.96 51.99 1ux2 s ALA 88 Cb -0.03 -3.46 0.65 0.00 0.00 0.00 0.00 23.12 20.28 1ux2 s ALA 88 CO 0.01 -1.06 2.01 1.88 0.00 0.00 0.00 175.76 178.61 1ux2 h TYR 89 N 7.62 0.77 -0.43 0.00 0.05 -0.71 -2.64 116.97 121.64 1ux2 h TYR 89 Ca -0.21 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.59 1ux2 h TYR 89 Cb 1.07 -0.26 0.00 0.00 1.01 0.00 0.00 36.73 38.55 1ux2 h TYR 89 CO 0.76 0.49 0.00 0.27 -1.05 0.00 0.00 178.16 178.63 1ux2 n ASN 90 N -4.44 4.86 -4.77 3.88 6.94 -1.26 -4.98 115.26 115.49 1ux2 n ASN 90 Ca 0.06 -2.95 -0.41 0.00 -0.02 0.00 0.00 54.58 51.27 1ux2 n ASN 90 Cb 0.04 -0.62 -0.03 0.00 -2.36 0.00 0.00 39.78 36.82 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 -2.75 3.47 -0.34 -2.53 0.00 -1.00 -1.24 121.76 117.37 1ux2 s ALA 91 Ca 0.49 1.15 0.04 0.00 0.00 0.00 0.00 51.96 53.64 1ux2 s ALA 91 Cb 0.38 -3.43 0.11 0.00 0.00 0.00 0.00 23.12 20.17 1ux2 s ALA 91 CO 0.13 -0.50 1.07 0.44 0.00 0.00 0.00 175.76 176.90 1ux2 n ILE 92 N 0.90 0.96 -3.96 0.00 -5.35 0.30 -4.87 119.36 107.35 1ux2 n ILE 92 Ca -0.00 -0.98 -0.09 0.00 -0.27 0.00 0.00 62.75 61.41 1ux2 n ILE 92 Cb 0.43 0.52 -0.10 0.00 -1.74 0.00 0.00 39.64 38.75 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 -0.97 0.23 0.38 7.28 1.04 -1.24 -4.94 113.70 115.48 1ux2 s SER 93 Ca 0.08 -0.59 -0.28 0.00 0.48 0.00 0.00 55.95 55.64 1ux2 s SER 93 Cb 0.04 0.20 -0.11 0.00 0.10 0.00 0.00 66.02 66.25 1ux2 s SER 93 CO 0.06 -0.48 1.49 -0.54 0.98 0.00 0.00 173.24 174.75 1ux2 s LYS 94 N -2.56 4.10 -0.00 4.02 1.02 -1.26 -4.65 119.74 120.41 1ux2 s LYS 94 Ca -0.05 2.58 -0.30 0.00 0.02 0.00 0.00 55.97 58.22 1ux2 s LYS 94 Cb -0.02 -2.97 -0.08 0.00 -0.52 0.00 0.00 37.83 34.25 1ux2 s LYS 94 CO -0.05 -0.54 1.87 -1.25 -0.92 0.00 0.00 175.35 174.46 1ux2 s PRO 95 N -2.08 4.12 -0.52 -1.68 0.04 -1.26 -4.85 135.00 128.77 1ux2 s PRO 95 Ca 0.53 2.44 -0.23 0.00 0.04 0.00 0.00 61.00 63.79 1ux2 s PRO 95 Cb -0.47 -4.11 0.04 0.00 0.04 0.00 0.00 34.50 30.00 1ux2 s PRO 95 CO 0.63 -0.96 0.83 -2.00 0.04 0.00 0.00 177.00 175.54 1ux2 s GLU 96 N 4.39 3.29 -0.24 4.56 2.12 -0.45 -4.95 118.70 127.41 1ux2 s GLU 96 Ca 0.84 -0.41 -0.27 0.00 0.36 0.00 0.00 54.97 55.49 1ux2 s GLU 96 Cb -0.39 -4.04 0.01 0.00 0.26 0.00 0.00 34.13 29.96 1ux2 s GLU 96 CO 0.37 -1.35 0.96 0.08 -0.54 0.00 0.00 175.26 174.79 1ux2 s VAL 97 N 3.47 4.72 -0.35 3.70 1.01 -1.26 -0.70 120.40 130.99 1ux2 s VAL 97 Ca 0.26 1.83 0.23 0.00 0.00 0.00 0.00 61.98 64.30 1ux2 s VAL 97 Cb -0.14 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 31.98 1ux2 s VAL 97 CO 0.18 -0.17 1.08 0.18 0.00 0.00 0.00 175.10 176.37 1ux2 n LEU 98 N 6.25 0.77 -4.71 3.92 4.77 0.10 -4.97 117.00 123.13 1ux2 n LEU 98 Ca 0.10 0.26 -0.23 0.00 -0.03 0.00 0.00 56.01 56.11 1ux2 n LEU 98 Cb 0.47 -0.09 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 1ux2 n LEU 98 CO 0.51 -0.13 -0.24 0.42 -1.33 0.00 0.00 177.39 176.62 1ux2 s THR 99 N -3.31 3.39 0.26 -5.08 -4.23 -1.26 -5.00 115.64 100.41 1ux2 s THR 99 Ca 0.01 -1.73 -0.30 0.00 -1.18 0.00 0.00 61.69 58.49 1ux2 s THR 99 Cb 0.11 -2.99 -0.14 0.00 1.34 0.00 0.00 72.50 70.82 1ux2 s THR 99 CO 0.78 -0.28 1.24 -2.65 -0.54 0.00 0.00 174.62 173.18 1ux2 n PRO 100 N -1.06 1.75 -2.10 3.99 -0.02 -1.26 -4.86 135.00 131.43 1ux2 n PRO 100 Ca -0.05 0.62 -0.41 0.00 -2.02 0.00 0.00 63.50 61.64 1ux2 n PRO 100 Cb 0.60 -2.16 -0.00 0.00 -0.02 0.00 0.00 33.50 31.92 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 1.33 4.00 -4.93 -0.52 6.02 -1.26 -4.90 117.38 117.13 1ux2 n GLN 101 Ca 0.10 -3.38 -0.30 0.00 -0.01 0.00 0.00 57.00 53.41 1ux2 n GLN 101 Cb 0.31 -2.81 -0.15 0.00 1.02 0.00 0.00 30.24 28.62 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 -0.86 2.21 0.30 1.08 1.43 -1.26 -1.95 118.68 119.62 1ux2 s LEU 102 Ca 0.48 -0.55 0.10 0.00 -1.03 0.00 0.00 54.13 53.12 1ux2 s LEU 102 Cb 0.14 -1.32 -0.05 0.00 0.03 0.00 0.00 46.19 44.99 1ux2 s LEU 102 CO -0.04 0.27 -0.02 0.00 0.23 0.00 0.00 176.35 176.79 1ux2 s ALA 103 N -0.79 3.14 -0.20 4.21 0.00 0.19 -4.68 121.76 123.63 1ux2 s ALA 103 Ca 0.12 -1.81 -0.08 0.00 0.00 0.00 0.00 51.96 50.18 1ux2 s ALA 103 Cb -0.10 -0.55 -0.04 0.00 0.00 0.00 0.00 23.12 22.43 1ux2 s ALA 103 CO 0.02 0.18 0.09 0.50 0.00 0.00 0.00 175.76 176.55 1ux2 s ARG 104 N -3.68 3.97 -0.14 0.00 6.06 0.23 -0.57 118.95 124.82 1ux2 s ARG 104 Ca 0.33 -0.34 0.02 0.00 -2.50 0.00 0.00 55.73 53.24 1ux2 s ARG 104 Cb -0.04 -3.31 0.00 0.00 0.06 0.00 0.00 34.95 31.66 1ux2 s ARG 104 CO 0.19 0.17 -0.19 0.08 -2.50 0.00 0.00 175.30 173.05 1ux2 s VAL 105 N 0.68 2.42 0.18 7.11 1.01 0.52 0.36 120.40 132.69 1ux2 s VAL 105 Ca 0.05 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.13 1ux2 s VAL 105 Cb -0.13 -1.99 -0.05 0.00 0.00 0.00 0.00 36.38 34.21 1ux2 s VAL 105 CO 0.02 0.53 0.40 -0.69 0.00 0.00 0.00 175.10 175.36 1ux2 s VAL 106 N 0.65 5.17 -0.29 2.92 1.01 0.56 -1.16 120.40 129.26 1ux2 s VAL 106 Ca -0.09 -0.13 0.20 0.00 0.00 0.00 0.00 61.98 61.96 1ux2 s VAL 106 Cb -0.16 -3.68 0.20 0.00 0.00 0.00 0.00 36.38 32.74 1ux2 s VAL 106 CO 0.02 -0.09 1.62 -1.54 0.00 0.00 0.00 175.10 175.11 1ux2 n SER 107 N -0.34 0.53 -0.52 3.32 3.41 0.59 -0.29 113.62 120.32 1ux2 n SER 107 Ca -0.03 0.73 0.11 0.00 -0.26 0.00 0.00 58.87 59.42 1ux2 n SER 107 Cb 0.53 -0.81 0.41 0.00 -0.26 0.00 0.00 64.21 64.09 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 -2.19 1.58 0.00 4.04 5.68 -1.26 -1.80 116.55 122.59 1ux2 n ASP 108 Ca -0.01 -1.65 0.00 0.00 -0.50 0.00 0.00 54.79 52.63 1ux2 n ASP 108 Cb 0.05 -0.08 0.00 0.00 -1.14 0.00 0.00 41.12 39.95 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 1.13 0.74 3.75 6.12 0.00 0.60 -4.68 105.19 112.85 1ux2 n GLY 109 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.90 4.60 -0.10 1.61 2.56 -1.22 -0.28 118.70 124.97 1ux2 s GLU 110 Ca 0.00 1.78 0.04 0.00 0.00 0.00 0.00 54.97 56.79 1ux2 s GLU 110 Cb 0.00 -3.23 0.00 0.00 2.00 0.00 0.00 34.13 32.90 1ux2 s GLU 110 CO 0.00 0.11 -0.23 0.08 -0.56 0.00 0.00 175.26 174.66 1ux2 s VAL 111 N -0.61 2.01 -0.24 3.70 1.01 0.01 -0.32 120.40 125.96 1ux2 s VAL 111 Ca 0.48 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 61.45 1ux2 s VAL 111 Cb -0.31 -1.74 0.02 0.00 0.00 0.00 0.00 36.38 34.35 1ux2 s VAL 111 CO 0.38 0.55 -0.07 -0.22 0.00 0.00 0.00 175.10 175.73 1ux2 s LEU 112 N 0.38 3.03 -0.20 3.92 2.96 0.16 -2.64 118.68 126.29 1ux2 s LEU 112 Ca -0.18 -0.78 0.01 0.00 -0.22 0.00 0.00 54.13 52.96 1ux2 s LEU 112 Cb -0.18 -1.65 0.03 0.00 0.50 0.00 0.00 46.19 44.89 1ux2 s LEU 112 CO 0.08 -0.10 -0.15 -0.47 -1.32 0.00 0.00 176.35 174.39 1ux2 s TYR 113 N 1.34 2.78 -0.55 5.38 5.04 0.49 -0.60 117.35 131.23 1ux2 s TYR 113 Ca 0.01 -1.77 0.06 0.00 -2.44 0.00 0.00 57.07 52.93 1ux2 s TYR 113 Cb -0.16 -1.84 0.22 0.00 0.35 0.00 0.00 41.96 40.53 1ux2 s TYR 113 CO -0.05 -0.80 0.57 -0.12 -1.34 0.00 0.00 175.55 173.80 1ux2 n MET 114 N 4.60 1.52 -2.31 4.97 0.00 -1.26 -0.78 117.12 123.86 1ux2 n MET 114 Ca -0.18 -4.01 -0.37 0.00 -0.00 0.00 0.00 57.70 53.15 1ux2 n MET 114 Cb 0.47 -1.89 -0.01 0.00 0.00 0.00 0.00 33.22 31.79 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 -1.51 3.80 -0.14 2.12 0.04 -1.26 -4.76 135.00 133.29 1ux2 s PRO 115 Ca 0.34 1.72 -0.21 0.00 0.04 0.00 0.00 61.00 62.89 1ux2 s PRO 115 Cb 0.10 -2.40 -0.03 0.00 0.04 0.00 0.00 34.50 32.20 1ux2 s PRO 115 CO -0.10 -0.50 0.60 0.45 0.04 0.00 0.00 177.00 177.48 1ux2 s SER 116 N -1.43 6.75 -0.06 6.66 0.15 -1.26 -1.11 113.70 123.41 1ux2 s SER 116 Ca 0.63 0.91 0.04 0.00 0.70 0.00 0.00 55.95 58.23 1ux2 s SER 116 Cb -0.27 -2.34 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 1ux2 s SER 116 CO 0.33 -0.15 -0.18 -0.63 1.20 0.00 0.00 173.24 173.81 1ux2 s ILE 117 N 1.24 1.57 -0.22 6.45 1.01 0.42 0.01 121.20 131.68 1ux2 s ILE 117 Ca 0.30 -0.77 -0.09 0.00 0.00 0.00 0.00 60.65 60.09 1ux2 s ILE 117 Cb -0.16 -1.36 -0.04 0.00 0.01 0.00 0.00 42.46 40.90 1ux2 s ILE 117 CO 0.12 0.45 0.12 -0.60 0.00 0.00 0.00 174.94 175.03 1ux2 s ARG 118 N 0.23 4.00 -0.02 2.79 3.52 0.12 -1.02 118.95 128.57 1ux2 s ARG 118 Ca -0.10 -0.32 -0.16 0.00 -0.13 0.00 0.00 55.73 55.02 1ux2 s ARG 118 Cb -0.14 -3.40 0.03 0.00 -1.56 0.00 0.00 34.95 29.87 1ux2 s ARG 118 CO 0.04 0.11 0.34 -1.14 -0.81 0.00 0.00 175.30 173.85 1ux2 s GLN 119 N 0.86 0.70 -0.07 5.12 0.74 -0.72 -1.34 119.66 124.95 1ux2 s GLN 119 Ca 0.06 -0.16 -0.04 0.00 0.05 0.00 0.00 55.36 55.27 1ux2 s GLN 119 Cb -0.13 0.31 -0.04 0.00 1.10 0.00 0.00 33.01 34.25 1ux2 s GLN 119 CO 0.03 -0.20 0.12 1.03 -0.55 0.00 0.00 175.29 175.72 1ux2 s ARG 120 N -1.32 3.32 0.06 1.67 0.52 -1.26 -1.48 118.95 120.47 1ux2 s ARG 120 Ca -0.13 -0.27 0.05 0.00 -0.52 0.00 0.00 55.73 54.86 1ux2 s ARG 120 Cb -0.05 -3.07 -0.03 0.00 0.52 0.00 0.00 34.95 32.33 1ux2 s ARG 120 CO 0.05 0.72 -0.14 -0.06 0.02 0.00 0.00 175.30 175.89 1ux2 s PHE 121 N -1.11 1.22 -0.28 -0.53 0.08 0.53 -0.54 117.98 117.36 1ux2 s PHE 121 Ca 0.19 -0.42 -0.14 0.00 0.12 0.00 0.00 56.93 56.69 1ux2 s PHE 121 Cb -0.12 -0.70 -0.04 0.00 -0.57 0.00 0.00 43.02 41.59 1ux2 s PHE 121 CO 0.09 0.05 0.31 0.45 -0.10 0.00 0.00 175.22 176.02 1ux2 s SER 122 N -1.51 6.17 0.23 1.36 0.15 -0.38 -1.26 113.70 118.46 1ux2 s SER 122 Ca -0.01 0.14 -0.21 0.00 0.70 0.00 0.00 55.95 56.57 1ux2 s SER 122 Cb -0.09 -2.18 0.06 0.00 -1.71 0.00 0.00 66.02 62.10 1ux2 s SER 122 CO 0.02 -0.15 0.94 0.00 1.20 0.00 0.00 173.24 175.25 1ux2 s ASP 124 N -3.17 6.23 0.00 0.00 -1.08 -1.26 -4.38 116.67 113.00 1ux2 s ASP 124 Ca 0.17 0.98 0.18 0.00 -0.52 0.00 0.00 52.55 53.36 1ux2 s ASP 124 Cb -0.03 -2.54 -0.03 0.00 -1.46 0.00 0.00 42.92 38.86 1ux2 s ASP 124 CO 0.06 -1.50 0.89 0.52 0.52 0.00 0.00 175.17 175.66 1ux2 n VAL 125 N 7.14 0.00 -1.73 1.11 0.31 -1.26 -3.73 118.33 120.16 1ux2 n VAL 125 Ca 0.18 -0.28 -0.42 0.00 -0.01 0.00 0.00 64.34 63.81 1ux2 n VAL 125 Cb 0.48 1.18 -0.02 0.00 -0.91 0.00 0.00 33.84 34.57 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 -0.28 3.62 0.00 4.52 3.41 -1.26 -2.24 113.62 121.39 1ux2 n SER 126 Ca 0.07 1.16 0.00 0.00 -0.26 0.00 0.00 58.87 59.84 1ux2 n SER 126 Cb 0.36 -1.56 0.00 0.00 -0.26 0.00 0.00 64.21 62.74 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 1.90 0.77 0.38 5.00 0.00 -1.26 -4.20 105.19 107.78 1ux2 n GLY 127 Ca 0.08 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.26 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 0.78 -0.86 1.61 3.04 -1.65 -0.89 116.25 118.28 1ux2 h VAL 128 Ca 0.00 -0.16 -0.35 0.00 -1.01 0.00 0.00 66.70 65.18 1ux2 h VAL 128 Cb 0.00 0.28 -0.21 0.00 -2.01 0.00 0.00 31.29 29.35 1ux2 h VAL 128 CO 0.00 0.08 0.44 -0.67 -1.01 0.00 0.00 177.57 176.42 1ux2 n ASP 129 N -4.50 4.38 -4.74 3.17 2.03 -1.26 -0.88 116.55 114.75 1ux2 n ASP 129 Ca 0.16 -3.38 -0.25 0.00 0.52 0.00 0.00 54.79 51.84 1ux2 n ASP 129 Cb 0.56 -0.79 -0.07 0.00 -0.72 0.00 0.00 41.12 40.09 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 -3.11 2.22 0.29 5.18 -4.23 -0.34 -4.97 115.64 110.68 1ux2 s THR 130 Ca 0.56 -1.71 0.03 0.00 -1.18 0.00 0.00 61.69 59.39 1ux2 s THR 130 Cb 0.46 -2.93 0.07 0.00 1.34 0.00 0.00 72.50 71.44 1ux2 s THR 130 CO 0.12 0.00 1.73 -0.33 -0.54 0.00 0.00 174.62 175.61 1ux2 h GLU 131 N 1.41 0.45 -0.01 3.99 5.08 -1.91 -2.75 114.58 120.85 1ux2 h GLU 131 Ca -0.43 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 57.65 1ux2 h GLU 131 Cb 1.26 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.46 1ux2 h GLU 131 CO 0.70 0.67 -0.57 0.77 -1.00 0.00 0.00 179.01 179.58 1ux2 h SER 132 N 0.40 0.03 -4.02 1.42 0.02 -1.97 -3.49 113.55 105.94 1ux2 h SER 132 Ca 0.06 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1ux2 h SER 132 Cb 0.65 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1ux2 h SER 132 CO 0.05 0.59 0.00 0.61 -1.14 0.00 0.00 176.83 176.94 1ux2 n GLY 133 N 0.12 -2.28 3.92 -3.77 0.00 -1.04 -4.81 105.19 97.34 1ux2 n GLY 133 Ca -0.01 -1.54 -0.28 0.00 0.00 0.00 0.00 46.02 44.19 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 -1.00 3.85 -0.31 4.61 0.00 0.10 -4.40 121.76 124.62 1ux2 s ALA 134 Ca 0.00 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.18 1ux2 s ALA 134 Cb 0.00 -1.98 0.09 0.00 0.00 0.00 0.00 23.12 21.23 1ux2 s ALA 134 CO 0.00 0.51 -0.00 0.99 0.00 0.00 0.00 175.76 177.25 1ux2 s THR 135 N -1.80 2.22 -0.23 0.00 2.01 -1.25 -1.11 115.64 115.48 1ux2 s THR 135 Ca 0.38 -2.09 -0.17 0.00 0.31 0.00 0.00 61.69 60.12 1ux2 s THR 135 Cb -0.11 -2.53 -0.03 0.00 0.01 0.00 0.00 72.50 69.83 1ux2 s THR 135 CO 0.28 -0.40 0.45 0.00 -0.69 0.00 0.00 174.62 174.26 1ux2 s ARG 137 N 1.80 3.83 -0.17 0.00 0.52 -1.26 0.07 118.95 123.74 1ux2 s ARG 137 Ca 0.20 -0.40 -0.01 0.00 -0.52 0.00 0.00 55.73 55.00 1ux2 s ARG 137 Cb -0.15 -3.32 -0.01 0.00 0.52 0.00 0.00 34.95 31.99 1ux2 s ARG 137 CO 0.09 0.02 -0.11 0.42 0.02 0.00 0.00 175.30 175.74 1ux2 s ILE 138 N 1.08 3.04 -0.24 1.52 1.01 0.29 -4.87 121.20 123.02 1ux2 s ILE 138 Ca 0.05 -0.64 -0.09 0.00 0.00 0.00 0.00 60.65 59.97 1ux2 s ILE 138 Cb -0.14 -2.31 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 1ux2 s ILE 138 CO 0.03 0.49 0.11 -0.54 0.00 0.00 0.00 174.94 175.04 1ux2 s LYS 139 N 0.86 3.85 -0.11 2.79 1.02 -1.26 0.15 119.74 127.04 1ux2 s LYS 139 Ca -0.03 -0.38 0.03 0.00 0.02 0.00 0.00 55.97 55.61 1ux2 s LYS 139 Cb -0.15 -3.41 0.00 0.00 -0.52 0.00 0.00 37.83 33.75 1ux2 s LYS 139 CO 0.00 -0.05 -0.23 0.42 -0.92 0.00 0.00 175.35 174.57 1ux2 s ILE 140 N 1.31 2.05 0.28 2.17 1.01 -0.07 0.11 121.20 128.06 1ux2 s ILE 140 Ca 0.06 -1.00 -0.16 0.00 0.00 0.00 0.00 60.65 59.55 1ux2 s ILE 140 Cb -0.15 -1.78 0.01 0.00 0.01 0.00 0.00 42.46 40.55 1ux2 s ILE 140 CO 0.05 0.55 0.62 -0.83 0.00 0.00 0.00 174.94 175.33 1ux2 s GLY 141 N 0.50 0.31 0.21 6.18 0.00 -0.94 -0.59 107.32 112.99 1ux2 s GLY 141 Ca -0.15 -0.67 -0.31 0.00 0.00 0.00 0.00 44.72 43.60 1ux2 s GLY 141 CO 0.05 -0.39 1.48 -0.45 0.00 0.00 0.00 173.10 173.80 1ux2 s SER 142 N -3.00 6.64 0.18 1.64 0.15 -1.26 -0.92 113.70 117.14 1ux2 s SER 142 Ca 0.17 2.62 -0.06 0.00 0.70 0.00 0.00 55.95 59.38 1ux2 s SER 142 Cb -0.03 -2.61 0.08 0.00 -1.71 0.00 0.00 66.02 61.75 1ux2 s SER 142 CO 0.09 -0.74 1.52 -0.25 1.20 0.00 0.00 173.24 175.06 1ux2 h TRP 143 N 5.81 0.88 0.00 3.44 2.91 -1.28 -3.39 115.95 124.32 1ux2 h TRP 143 Ca -0.44 -0.27 0.00 0.00 1.13 0.00 0.00 58.89 59.31 1ux2 h TRP 143 Cb 1.21 -0.18 0.00 0.00 -0.51 0.00 0.00 29.16 29.68 1ux2 h TRP 143 CO 0.62 1.03 0.00 0.25 -1.03 0.00 0.00 178.44 179.31 1ux2 n THR 144 N -4.03 0.00 -3.86 2.65 -2.24 -1.26 -5.01 114.28 100.53 1ux2 n THR 144 Ca -0.02 -0.36 -0.36 0.00 -2.27 0.00 0.00 64.05 61.04 1ux2 n THR 144 Cb 0.55 1.12 -0.12 0.00 -2.10 0.00 0.00 70.33 69.78 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 -0.42 3.09 0.93 4.78 3.76 -1.26 -5.10 115.29 121.07 1ux2 s HIS 145 Ca 0.00 -0.37 -0.16 0.00 -0.15 0.00 0.00 55.06 54.38 1ux2 s HIS 145 Cb 0.00 -2.18 0.22 0.00 1.11 0.00 0.00 32.58 31.72 1ux2 s HIS 145 CO 0.00 -0.27 1.22 -2.39 -0.85 0.00 0.00 174.74 172.44 1ux2 n HIS 146 N 4.60 -3.98 0.33 1.40 1.44 -1.26 -4.53 115.22 113.21 1ux2 n HIS 146 Ca -0.16 -1.07 0.21 0.00 -2.01 0.00 0.00 57.72 54.68 1ux2 n HIS 146 Cb 0.52 -0.96 1.12 0.00 0.12 0.00 0.00 29.99 30.78 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 -1.71 0.00 1.26 4.39 4.64 -0.59 0.31 113.55 121.84 1ux2 h SER 147 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1ux2 h SER 147 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1ux2 h SER 147 CO 0.28 0.01 -0.08 0.54 -0.87 0.00 0.00 176.83 176.71 1ux2 n ARG 148 N -3.22 0.18 -0.07 4.77 1.74 -1.26 -4.21 116.66 114.60 1ux2 n ARG 148 Ca -0.03 0.14 -0.11 0.00 -0.77 0.00 0.00 57.85 57.08 1ux2 n ARG 148 Cb 0.10 -1.70 -0.06 0.00 -1.02 0.00 0.00 32.46 29.78 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 -2.01 0.31 -4.19 5.56 1.02 -0.03 -2.96 120.64 118.34 1ux2 n GLU 149 Ca 0.06 0.09 -0.27 0.00 -0.02 0.00 0.00 57.16 57.02 1ux2 n GLU 149 Cb 0.40 -1.16 -0.17 0.00 -0.02 0.00 0.00 31.44 30.50 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 -2.26 1.18 -0.10 -3.67 1.01 -0.47 -0.04 121.20 116.86 1ux2 s ILE 150 Ca -0.18 -0.43 -0.04 0.00 0.00 0.00 0.00 60.65 59.99 1ux2 s ILE 150 Cb 0.06 -1.14 -0.04 0.00 0.01 0.00 0.00 42.46 41.35 1ux2 s ILE 150 CO 0.28 0.38 0.07 -0.94 0.00 0.00 0.00 174.94 174.73 1ux2 s SER 151 N 1.28 5.80 -0.14 3.58 1.04 -0.63 -4.02 113.70 120.61 1ux2 s SER 151 Ca -0.02 0.30 0.02 0.00 0.48 0.00 0.00 55.95 56.73 1ux2 s SER 151 Cb -0.14 -1.76 0.00 0.00 0.10 0.00 0.00 66.02 64.22 1ux2 s SER 151 CO -0.04 0.39 -0.20 -0.69 0.98 0.00 0.00 173.24 173.68 1ux2 s VAL 152 N -0.95 2.26 -0.00 5.02 1.01 -1.26 -0.65 120.40 125.83 1ux2 s VAL 152 Ca 0.14 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 61.23 1ux2 s VAL 152 Cb -0.12 -1.91 -0.01 0.00 0.00 0.00 0.00 36.38 34.34 1ux2 s VAL 152 CO 0.03 0.54 -0.09 -1.81 0.00 0.00 0.00 175.10 173.77 1ux2 s ASP 153 N 0.73 1.02 0.38 3.32 1.01 -0.23 -4.71 116.67 118.20 1ux2 s ASP 153 Ca -0.08 -0.18 -0.27 0.00 0.71 0.00 0.00 52.55 52.72 1ux2 s ASP 153 Cb -0.16 -0.10 -0.09 0.00 1.01 0.00 0.00 42.92 43.57 1ux2 s ASP 153 CO 0.00 0.09 1.32 -2.16 0.21 0.00 0.00 175.17 174.63 1ux2 s PRO 154 N -0.30 4.09 0.00 8.23 0.04 -1.26 -1.29 135.00 144.51 1ux2 s PRO 154 Ca 0.03 2.21 0.00 0.00 0.04 0.00 0.00 61.00 63.27 1ux2 s PRO 154 Cb -0.04 -2.86 0.00 0.00 0.04 0.00 0.00 34.50 31.64 1ux2 s PRO 154 CO -0.00 -0.41 0.00 2.41 0.04 0.00 0.00 177.00 179.04 1ux2 n THR 155 N 0.35 0.00 -4.44 1.26 -1.04 -1.24 -4.89 114.28 104.28 1ux2 n THR 155 Ca 0.02 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.82 1ux2 n THR 155 Cb 0.43 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 68.83 1ux2 n THR 155 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1ux2 s THR 156 N 0.00 1.18 -1.20 12.58 2.01 -1.26 -5.08 115.64 123.87 1ux2 s THR 156 Ca 0.00 -2.00 -0.08 0.00 0.31 0.00 0.00 61.69 59.92 1ux2 s THR 156 Cb 0.00 -2.78 0.22 0.00 0.01 0.00 0.00 72.50 69.95 1ux2 s THR 156 CO 0.00 -0.01 1.64 1.21 -0.69 0.00 0.00 174.62 176.77 1ux2 n GLU 157 N -0.67 3.86 0.31 4.92 4.07 -1.26 -4.76 120.64 127.10 1ux2 n GLU 157 Ca -0.02 -3.96 0.21 0.00 -0.06 0.00 0.00 57.16 53.32 1ux2 n GLU 157 Cb 0.66 -2.78 1.03 0.00 -0.06 0.00 0.00 31.44 30.30 1ux2 n GLU 157 CO 0.00 0.00 0.00 -0.91 -0.06 0.00 0.00 177.13 176.16 1ux2 h ASN 158 N 5.88 0.00 -5.04 4.31 -0.26 -2.06 -3.45 115.58 114.96 1ux2 h ASN 158 Ca 0.31 0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 55.96 1ux2 h ASN 158 Cb 0.67 0.00 -0.17 0.00 -1.06 0.00 0.00 38.32 37.76 1ux2 h ASN 158 CO 1.44 0.00 -0.22 -0.94 -1.06 0.00 0.00 177.43 176.66 1ux2 s SER 159 N -5.20 -0.17 0.76 5.81 1.04 -1.26 -5.16 113.70 109.52 1ux2 s SER 159 Ca -0.03 -0.12 -0.14 0.00 0.48 0.00 0.00 55.95 56.14 1ux2 s SER 159 Cb 0.11 0.37 0.05 0.00 0.10 0.00 0.00 66.02 66.66 1ux2 s SER 159 CO 0.43 -0.61 1.19 1.51 0.98 0.00 0.00 173.24 176.73 1ux2 s ASP 160 N -1.99 4.07 0.52 7.02 1.47 -1.26 -4.92 116.67 121.58 1ux2 s ASP 160 Ca -0.06 2.28 0.24 0.00 1.18 0.00 0.00 52.55 56.19 1ux2 s ASP 160 Cb -0.01 -2.58 1.42 0.00 -0.34 0.00 0.00 42.92 41.41 1ux2 s ASP 160 CO -0.02 -2.35 2.11 0.44 0.68 0.00 0.00 175.17 176.03 1ux2 h ASP 161 N -0.57 0.00 -0.54 2.11 3.32 -1.97 -1.81 116.42 116.96 1ux2 h ASP 161 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1ux2 h ASP 161 Cb 1.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.83 1ux2 h ASP 161 CO 0.49 0.10 0.00 -1.20 -1.72 0.00 0.00 179.24 176.90 1ux2 n SER 162 N -3.94 2.89 -0.30 6.45 7.64 -1.26 -4.55 113.62 120.56 1ux2 n SER 162 Ca -0.02 -2.00 0.16 0.00 1.01 0.00 0.00 58.87 58.02 1ux2 n SER 162 Cb 0.19 -0.36 0.43 0.00 -1.01 0.00 0.00 64.21 63.45 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 3.17 0.55 -0.06 1.43 4.57 -1.67 -1.06 114.58 121.52 1ux2 h GLU 163 Ca 0.00 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1ux2 h GLU 163 Cb 0.72 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.19 1ux2 h GLU 163 CO 0.00 0.37 0.00 0.66 -1.18 0.00 0.00 179.01 178.86 1ux2 n TYR 164 N -4.62 0.08 -2.54 0.92 4.01 -1.26 -5.03 117.16 108.72 1ux2 n TYR 164 Ca 0.21 -0.36 -0.41 0.00 -0.16 0.00 0.00 57.90 57.19 1ux2 n TYR 164 Cb 0.65 -0.03 -0.04 0.00 -0.31 0.00 0.00 39.34 39.60 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 -0.78 3.64 0.14 -0.72 5.36 -0.40 -4.53 117.98 120.68 1ux2 s PHE 165 Ca 0.05 1.66 -0.31 0.00 -0.96 0.00 0.00 56.93 57.36 1ux2 s PHE 165 Cb 0.03 -3.24 -0.10 0.00 -0.34 0.00 0.00 43.02 39.36 1ux2 s PHE 165 CO 0.03 -0.46 1.71 0.45 -1.46 0.00 0.00 175.22 175.50 1ux2 s SER 166 N -0.38 6.49 0.06 6.13 0.15 0.74 -4.87 113.70 122.01 1ux2 s SER 166 Ca 0.47 2.69 0.18 0.00 0.70 0.00 0.00 55.95 59.99 1ux2 s SER 166 Cb -0.29 -2.58 0.75 0.00 -1.71 0.00 0.00 66.02 62.19 1ux2 s SER 166 CO 0.36 -0.93 1.56 0.00 1.20 0.00 0.00 173.24 175.43 1ux2 n GLN 167 N 4.97 0.04 0.00 5.44 10.64 -1.26 -2.97 117.38 134.25 1ux2 n GLN 167 Ca 0.16 0.26 0.11 0.00 -1.83 0.00 0.00 57.00 55.70 1ux2 n GLN 167 Cb 0.38 -1.58 0.00 0.00 -0.86 0.00 0.00 30.24 28.19 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 -1.66 0.00 -1.69 2.61 4.01 -1.26 -4.94 117.16 114.22 1ux2 n TYR 168 Ca 0.04 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.39 1ux2 n TYR 168 Cb 0.20 0.00 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 n SER 169 N 0.09 1.98 0.15 7.72 2.88 -1.16 -4.88 113.62 120.40 1ux2 n SER 169 Ca 0.09 0.93 0.12 0.00 -1.33 0.00 0.00 58.87 58.69 1ux2 n SER 169 Cb 0.47 -1.50 0.54 0.00 -0.75 0.00 0.00 64.21 62.97 1ux2 n SER 169 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1ux2 h ARG 170 N 1.14 0.00 -6.09 -1.46 3.08 -1.92 -3.45 114.38 105.67 1ux2 h ARG 170 Ca -0.49 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 58.98 1ux2 h ARG 170 Cb 1.33 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 31.27 1ux2 h ARG 170 CO 0.55 0.00 -0.63 -0.06 -1.07 0.00 0.00 179.97 178.76 1ux2 s PHE 171 N -3.40 2.57 0.08 3.04 0.08 -1.26 -1.39 117.98 117.69 1ux2 s PHE 171 Ca 0.03 -0.36 0.04 0.00 0.12 0.00 0.00 56.93 56.76 1ux2 s PHE 171 Cb 0.09 -1.37 -0.03 0.00 -0.57 0.00 0.00 43.02 41.14 1ux2 s PHE 171 CO 0.38 0.53 -0.12 -1.83 -0.10 0.00 0.00 175.22 174.07 1ux2 s GLU 172 N -3.69 0.79 -0.14 0.44 -1.05 -0.13 -4.81 118.70 110.11 1ux2 s GLU 172 Ca 0.34 -0.98 -0.17 0.00 -0.15 0.00 0.00 54.97 54.00 1ux2 s GLU 172 Cb -0.03 -0.70 -0.04 0.00 -0.44 0.00 0.00 34.13 32.93 1ux2 s GLU 172 CO 0.19 0.14 0.43 0.42 0.95 0.00 0.00 175.26 177.40 1ux2 s ILE 173 N -1.56 5.21 -0.20 1.83 1.01 -1.26 -1.69 121.20 124.54 1ux2 s ILE 173 Ca -0.01 0.84 -0.04 0.00 0.00 0.00 0.00 60.65 61.44 1ux2 s ILE 173 Cb -0.08 -3.77 -0.21 0.00 0.01 0.00 0.00 42.46 38.41 1ux2 s ILE 173 CO 0.02 0.32 0.04 0.18 0.00 0.00 0.00 174.94 175.50 1ux2 n LEU 174 N 3.82 2.69 -3.58 2.97 4.77 0.58 -4.91 117.00 123.34 1ux2 n LEU 174 Ca -0.08 0.08 -0.13 0.00 -0.03 0.00 0.00 56.01 55.86 1ux2 n LEU 174 Cb 0.51 -1.00 -0.06 0.00 -2.33 0.00 0.00 43.42 40.55 1ux2 n LEU 174 CO 0.42 0.84 0.64 -0.62 -1.33 0.00 0.00 177.39 177.34 1ux2 s ASP 175 N -6.84 -0.50 -0.11 -1.43 -1.08 -1.05 -5.03 116.67 100.64 1ux2 s ASP 175 Ca -0.29 0.69 -0.02 0.00 -0.52 0.00 0.00 52.55 52.41 1ux2 s ASP 175 Cb 0.08 0.61 0.04 0.00 -1.46 0.00 0.00 42.92 42.19 1ux2 s ASP 175 CO 0.66 -0.36 -0.00 -0.69 0.52 0.00 0.00 175.17 175.30 1ux2 s VAL 176 N -0.69 0.52 -0.00 1.11 1.01 -1.26 -0.57 120.40 120.52 1ux2 s VAL 176 Ca -0.03 -0.12 0.07 0.00 0.00 0.00 0.00 61.98 61.90 1ux2 s VAL 176 Cb -0.02 -0.74 -0.03 0.00 0.00 0.00 0.00 36.38 35.59 1ux2 s VAL 176 CO 0.02 0.16 -0.22 0.42 0.00 0.00 0.00 175.10 175.49 1ux2 s THR 177 N 1.90 2.46 -0.25 3.92 -4.23 -0.78 -4.95 115.64 113.71 1ux2 s THR 177 Ca 0.03 -1.08 0.02 0.00 -1.18 0.00 0.00 61.69 59.49 1ux2 s THR 177 Cb -0.13 -1.94 0.06 0.00 1.34 0.00 0.00 72.50 71.83 1ux2 s THR 177 CO -0.06 0.50 -0.10 -1.10 -0.54 0.00 0.00 174.62 173.32 1ux2 s GLN 178 N -0.91 2.09 0.39 3.99 -0.21 -1.26 0.27 119.66 124.02 1ux2 s GLN 178 Ca 0.12 -1.24 0.07 0.00 0.02 0.00 0.00 55.36 54.33 1ux2 s GLN 178 Cb -0.10 -2.80 -0.07 0.00 1.00 0.00 0.00 33.01 31.04 1ux2 s GLN 178 CO 0.01 -0.57 -0.01 -1.59 -2.12 0.00 0.00 175.29 171.01 1ux2 s LYS 179 N 1.18 1.89 -0.07 2.91 -2.85 -0.44 -4.80 119.74 117.57 1ux2 s LYS 179 Ca -0.08 -2.05 -0.04 0.00 -1.00 0.00 0.00 55.97 52.80 1ux2 s LYS 179 Cb -0.19 -1.57 -0.04 0.00 -2.06 0.00 0.00 37.83 33.96 1ux2 s LYS 179 CO -0.06 -0.02 0.11 0.15 0.10 0.00 0.00 175.35 175.64 1ux2 s LYS 180 N -3.71 3.29 0.12 1.78 1.02 -1.26 0.33 119.74 121.32 1ux2 s LYS 180 Ca 0.34 -0.28 0.08 0.00 0.02 0.00 0.00 55.97 56.14 1ux2 s LYS 180 Cb 0.08 -3.04 -0.04 0.00 -0.52 0.00 0.00 37.83 34.31 1ux2 s LYS 180 CO 0.17 0.72 -0.19 -0.80 -0.92 0.00 0.00 175.35 174.34 1ux2 s ASN 181 N -1.29 2.48 -0.24 2.83 0.01 0.77 -4.90 114.94 114.60 1ux2 s ASN 181 Ca 0.18 -0.74 -0.02 0.00 -0.71 0.00 0.00 52.86 51.57 1ux2 s ASN 181 Cb -0.12 -0.13 0.08 0.00 0.41 0.00 0.00 41.25 41.49 1ux2 s ASN 181 CO 0.08 0.00 0.07 -0.55 -1.51 0.00 0.00 177.10 175.19 1ux2 s SER 182 N -2.17 3.37 -0.16 -1.22 0.15 -1.26 -0.84 113.70 111.57 1ux2 s SER 182 Ca 0.09 -1.15 -0.04 0.00 0.70 0.00 0.00 55.95 55.54 1ux2 s SER 182 Cb -0.08 -0.66 -0.03 0.00 -1.71 0.00 0.00 66.02 63.54 1ux2 s SER 182 CO 0.05 -0.36 -0.02 -0.69 1.20 0.00 0.00 173.24 173.42 1ux2 s VAL 183 N 1.81 4.04 -0.57 4.45 1.01 0.18 -4.83 120.40 126.50 1ux2 s VAL 183 Ca 0.04 -0.30 -0.20 0.00 0.00 0.00 0.00 61.98 61.52 1ux2 s VAL 183 Cb -0.17 -2.79 0.08 0.00 0.00 0.00 0.00 36.38 33.50 1ux2 s VAL 183 CO -0.17 0.48 0.74 -0.89 0.00 0.00 0.00 175.10 175.26 1ux2 s THR 184 N 0.43 4.71 0.76 3.92 2.01 -1.26 -0.21 115.64 126.00 1ux2 s THR 184 Ca -0.02 -0.58 -0.12 0.00 0.31 0.00 0.00 61.69 61.28 1ux2 s THR 184 Cb -0.14 -4.46 0.05 0.00 0.01 0.00 0.00 72.50 67.96 1ux2 s THR 184 CO 0.02 -1.07 1.14 -0.31 -0.69 0.00 0.00 174.62 173.72 1ux2 s TYR 185 N 3.02 3.12 -0.02 4.92 2.02 -1.26 -5.02 117.35 124.13 1ux2 s TYR 185 Ca 0.16 0.90 0.11 0.00 -0.37 0.00 0.00 57.07 57.88 1ux2 s TYR 185 Cb -0.20 -3.29 -0.11 0.00 -0.40 0.00 0.00 41.96 37.96 1ux2 s TYR 185 CO 0.10 -1.51 1.21 0.77 -1.57 0.00 0.00 175.55 174.55 1ux2 h SER 186 N -0.88 0.00 -0.67 2.29 0.02 -1.97 -3.30 113.55 109.04 1ux2 h SER 186 Ca -0.46 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 60.59 1ux2 h SER 186 Cb 1.29 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.76 1ux2 h SER 186 CO 0.65 0.78 0.31 0.00 -1.14 0.00 0.00 176.83 177.43 1ux2 n PRO 189 N 1.69 0.04 -3.39 0.00 -0.04 -1.26 -4.30 135.00 127.74 1ux2 n PRO 189 Ca -0.21 -0.01 -0.19 0.00 -0.04 0.00 0.00 63.50 63.05 1ux2 n PRO 189 Cb 0.55 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.51 1ux2 n PRO 189 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1ux2 s GLU 190 N -2.97 3.06 0.01 0.54 0.41 -1.26 -5.02 118.70 113.48 1ux2 s GLU 190 Ca 0.14 -1.06 -0.17 0.00 -0.41 0.00 0.00 54.97 53.47 1ux2 s GLU 190 Cb 0.19 -2.81 -0.06 0.00 -1.78 0.00 0.00 34.13 29.67 1ux2 s GLU 190 CO 0.59 0.00 0.48 0.00 -0.49 0.00 0.00 175.26 175.84 1ux2 s ALA 191 N -2.21 3.63 -0.14 5.21 0.00 -1.26 -4.32 121.76 122.66 1ux2 s ALA 191 Ca 0.47 -0.11 -0.01 0.00 0.00 0.00 0.00 51.96 52.31 1ux2 s ALA 191 Cb -0.10 -2.52 -0.01 0.00 0.00 0.00 0.00 23.12 20.49 1ux2 s ALA 191 CO 0.31 0.39 -0.12 0.71 0.00 0.00 0.00 175.76 177.05 1ux2 s TYR 192 N -0.86 2.83 0.19 0.00 2.02 0.70 -0.03 117.35 122.19 1ux2 s TYR 192 Ca 0.26 -0.72 -0.17 0.00 -0.37 0.00 0.00 57.07 56.07 1ux2 s TYR 192 Cb -0.18 -1.88 -0.08 0.00 -0.40 0.00 0.00 41.96 39.43 1ux2 s TYR 192 CO 0.15 -0.27 0.65 -1.21 -1.57 0.00 0.00 175.55 173.30 1ux2 s GLU 193 N 0.52 4.13 0.07 -0.62 2.02 -1.26 0.51 118.70 124.07 1ux2 s GLU 193 Ca -0.08 0.71 -0.04 0.00 0.02 0.00 0.00 54.97 55.57 1ux2 s GLU 193 Cb -0.16 -2.90 -0.02 0.00 0.10 0.00 0.00 34.13 31.15 1ux2 s GLU 193 CO 0.04 0.43 0.06 0.16 0.02 0.00 0.00 175.26 175.97 1ux2 s ASP 194 N -1.68 0.34 -0.20 -0.19 -4.77 -0.02 -4.05 116.67 106.10 1ux2 s ASP 194 Ca 0.41 -0.86 -0.07 0.00 -3.30 0.00 0.00 52.55 48.73 1ux2 s ASP 194 Cb -0.16 0.26 -0.04 0.00 -1.09 0.00 0.00 42.92 41.90 1ux2 s ASP 194 CO 0.20 -0.66 0.05 -0.69 0.70 0.00 0.00 175.17 174.77 1ux2 s VAL 195 N -3.90 4.50 -0.38 2.11 1.01 0.25 -0.17 120.40 123.82 1ux2 s VAL 195 Ca 0.07 -0.13 -0.14 0.00 0.00 0.00 0.00 61.98 61.78 1ux2 s VAL 195 Cb 0.07 -3.04 0.01 0.00 0.00 0.00 0.00 36.38 33.41 1ux2 s VAL 195 CO -0.10 0.43 0.26 -0.70 0.00 0.00 0.00 175.10 174.99 1ux2 s GLU 196 N 0.72 3.16 -0.24 2.72 2.12 0.15 -0.89 118.70 126.45 1ux2 s GLU 196 Ca 0.02 -0.88 -0.16 0.00 0.36 0.00 0.00 54.97 54.31 1ux2 s GLU 196 Cb -0.14 -3.88 -0.03 0.00 0.26 0.00 0.00 34.13 30.34 1ux2 s GLU 196 CO 0.02 -0.62 0.44 0.08 -0.54 0.00 0.00 175.26 174.64 1ux2 s VAL 197 N 1.68 5.15 -0.36 3.70 1.01 0.12 -1.32 120.40 130.38 1ux2 s VAL 197 Ca 0.05 0.75 -0.12 0.00 0.00 0.00 0.00 61.98 62.66 1ux2 s VAL 197 Cb -0.18 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.44 1ux2 s VAL 197 CO 0.10 0.17 0.23 -0.44 0.00 0.00 0.00 175.10 175.15 1ux2 s SER 198 N 1.35 5.86 -0.48 3.32 0.01 0.14 -0.55 113.70 123.36 1ux2 s SER 198 Ca 0.19 -0.74 -0.17 0.00 1.31 0.00 0.00 55.95 56.55 1ux2 s SER 198 Cb -0.15 -2.08 0.06 0.00 0.21 0.00 0.00 66.02 64.06 1ux2 s SER 198 CO 0.09 -0.33 0.46 -0.22 0.41 0.00 0.00 173.24 173.65 1ux2 s LEU 199 N 1.64 5.40 -0.35 2.44 2.96 0.11 -1.87 118.68 129.01 1ux2 s LEU 199 Ca 0.04 -1.17 -0.18 0.00 -0.22 0.00 0.00 54.13 52.60 1ux2 s LEU 199 Cb -0.18 -2.26 -0.00 0.00 0.50 0.00 0.00 46.19 44.24 1ux2 s LEU 199 CO 0.08 -0.70 0.51 0.21 -1.32 0.00 0.00 176.35 175.13 1ux2 s ASN 200 N 2.56 6.32 0.07 3.68 2.47 0.26 -0.62 114.94 129.68 1ux2 s ASN 200 Ca 0.07 -0.01 -0.08 0.00 0.42 0.00 0.00 52.86 53.27 1ux2 s ASN 200 Cb -0.22 -2.27 -0.01 0.00 -1.45 0.00 0.00 41.25 37.30 1ux2 s ASN 200 CO 0.08 -0.47 0.16 0.72 -3.72 0.00 0.00 177.10 173.87 1ux2 s PHE 201 N 2.38 0.18 0.07 0.43 -0.12 -0.27 -0.31 117.98 120.35 1ux2 s PHE 201 Ca 0.19 -0.59 -0.08 0.00 -0.05 0.00 0.00 56.93 56.40 1ux2 s PHE 201 Cb -0.15 -0.10 -0.00 0.00 -0.63 0.00 0.00 43.02 42.13 1ux2 s PHE 201 CO 0.13 -0.49 0.17 -0.98 -0.05 0.00 0.00 175.22 174.00 1ux2 s ARG 202 N -3.57 0.78 0.28 1.99 1.70 -0.68 0.03 118.95 119.48 1ux2 s ARG 202 Ca 0.03 -0.88 -0.29 0.00 -0.47 0.00 0.00 55.73 54.11 1ux2 s ARG 202 Cb 0.04 0.32 -0.10 0.00 -0.57 0.00 0.00 34.95 34.63 1ux2 s ARG 202 CO -0.09 -0.23 1.37 0.21 -1.08 0.00 0.00 175.30 175.48 1ux2 s LYS 203 N -3.48 4.31 0.42 3.89 2.20 -0.06 -0.96 119.74 126.07 1ux2 s LYS 203 Ca 0.02 2.25 -0.25 0.00 -0.36 0.00 0.00 55.97 57.63 1ux2 s LYS 203 Cb 0.03 -3.10 -0.08 0.00 -1.51 0.00 0.00 37.83 33.18 1ux2 s LYS 203 CO -0.09 -0.31 1.27 0.15 -0.36 0.00 0.00 175.35 176.01 1ux2 s LYS 204 N -1.02 3.89 0.00 4.03 1.02 -0.48 -4.83 119.74 122.34 1ux2 s LYS 204 Ca 0.54 2.06 0.28 0.00 0.02 0.00 0.00 55.97 58.88 1ux2 s LYS 204 Cb -0.41 -2.66 1.13 0.00 -0.52 0.00 0.00 37.83 35.38 1ux2 s LYS 204 CO 0.48 -0.53 1.79 0.41 -0.92 0.00 0.00 175.35 176.58