#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uk2 n GLY 2 N 0.00 1.53 0.00 5.00 0.00 -1.26 -4.90 105.19 105.56 1uk2 n GLY 2 Ca 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.55 1uk2 n GLY 2 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1uk2 n PHE 3 N -1.45 0.00 -1.32 1.61 7.35 -1.26 -4.64 117.46 117.75 1uk2 n PHE 3 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1uk2 n PHE 3 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 1uk2 n PHE 3 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1uk2 n ARG 4 N 0.00 -2.54 -2.85 -4.13 5.12 -1.26 -4.95 116.66 106.04 1uk2 n ARG 4 Ca 0.00 2.08 -0.41 0.00 -1.93 0.00 0.00 57.85 57.59 1uk2 n ARG 4 Cb 0.00 -2.08 -0.04 0.00 -1.16 0.00 0.00 32.46 29.18 1uk2 n ARG 4 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1uk2 s LYS 5 N -1.79 4.55 0.17 5.56 2.20 -1.26 -5.04 119.74 124.14 1uk2 s LYS 5 Ca 0.00 1.23 0.10 0.00 -0.36 0.00 0.00 55.97 56.94 1uk2 s LYS 5 Cb 0.00 -3.41 -0.04 0.00 -1.51 0.00 0.00 37.83 32.87 1uk2 s LYS 5 CO 0.00 0.12 -0.22 -1.64 -0.36 0.00 0.00 175.35 173.25 1uk2 s MET 6 N 0.44 1.40 0.29 4.03 -1.94 -1.26 -5.00 119.30 117.27 1uk2 s MET 6 Ca 0.44 -1.45 0.07 0.00 -1.71 0.00 0.00 55.69 53.05 1uk2 s MET 6 Cb -0.21 -1.66 -0.03 0.00 2.01 0.00 0.00 34.83 34.94 1uk2 s MET 6 CO 0.25 0.36 0.26 0.00 -0.01 0.00 0.00 175.02 175.88 1uk2 s ALA 7 N -1.70 3.75 0.58 3.03 0.00 -1.26 -4.76 121.76 121.40 1uk2 s ALA 7 Ca 0.18 -1.53 -0.19 0.00 0.00 0.00 0.00 51.96 50.42 1uk2 s ALA 7 Cb -0.08 -1.27 -0.04 0.00 0.00 0.00 0.00 23.12 21.73 1uk2 s ALA 7 CO 0.08 0.12 1.18 -0.06 0.00 0.00 0.00 175.76 177.08 1uk2 s PHE 8 N -2.21 2.48 0.34 0.00 0.08 -1.26 -4.93 117.98 112.48 1uk2 s PHE 8 Ca 0.37 1.53 -0.28 0.00 0.12 0.00 0.00 56.93 58.67 1uk2 s PHE 8 Cb -0.07 -3.40 -0.12 0.00 -0.57 0.00 0.00 43.02 38.86 1uk2 s PHE 8 CO 0.26 -1.99 1.27 -2.30 -0.10 0.00 0.00 175.22 172.37 1uk2 n PRO 9 N -1.58 2.08 0.00 0.24 -0.02 -1.26 -4.89 135.00 129.58 1uk2 n PRO 9 Ca 0.13 0.73 0.13 0.00 -2.02 0.00 0.00 63.50 62.47 1uk2 n PRO 9 Cb 0.50 -2.30 0.39 0.00 -0.02 0.00 0.00 33.50 32.07 1uk2 n PRO 9 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1uk2 n SER 10 N 0.78 1.66 -0.28 2.55 3.41 -1.26 -4.66 113.62 115.81 1uk2 n SER 10 Ca 0.05 -1.44 0.02 0.00 -0.26 0.00 0.00 58.87 57.24 1uk2 n SER 10 Cb 0.36 0.06 0.10 0.00 -0.26 0.00 0.00 64.21 64.47 1uk2 n SER 10 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1uk2 h GLY 11 N 4.85 0.58 2.00 5.00 0.00 -1.99 -0.60 103.07 112.91 1uk2 h GLY 11 Ca 0.00 0.26 -0.06 0.00 0.00 0.00 0.00 47.33 47.54 1uk2 h GLY 11 CO 0.00 -0.30 -0.26 0.50 0.00 0.00 0.00 176.54 176.47 1uk2 h LYS 12 N 0.00 0.00 0.00 4.80 1.57 -1.97 -2.68 116.57 118.29 1uk2 h LYS 12 Ca 0.38 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.93 1uk2 h LYS 12 Cb 0.59 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.86 1uk2 h LYS 12 CO -0.82 0.26 -1.35 0.28 -0.57 0.00 0.00 179.45 177.25 1uk2 h VAL 13 N 0.00 1.12 -0.82 0.50 2.07 -1.66 -3.30 116.25 114.15 1uk2 h VAL 13 Ca -0.00 -2.86 -0.04 0.00 0.82 0.00 0.00 66.70 64.62 1uk2 h VAL 13 Cb 0.55 2.53 -0.04 0.00 -1.52 0.00 0.00 31.29 32.82 1uk2 h VAL 13 CO 0.03 0.64 0.37 -0.33 0.02 0.00 0.00 177.57 178.30 1uk2 h GLU 14 N 0.00 1.20 0.00 1.57 5.08 -0.91 -1.80 114.58 119.72 1uk2 h GLU 14 Ca -0.16 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 1uk2 h GLU 14 Cb 1.85 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.89 1uk2 h GLU 14 CO 0.09 0.94 0.00 0.41 -1.00 0.00 0.00 179.01 179.45 1uk2 n GLY 15 N -0.97 -0.37 0.27 -3.84 0.00 -1.03 -2.15 105.19 97.10 1uk2 n GLY 15 Ca 0.08 -0.01 0.03 0.00 0.00 0.00 0.00 46.02 46.12 1uk2 n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uk2 s MET 17 N -0.59 4.22 0.22 0.00 1.00 -0.91 0.94 119.30 124.17 1uk2 s MET 17 Ca 0.08 0.58 -0.00 0.00 0.00 0.00 0.00 55.69 56.35 1uk2 s MET 17 Cb 0.05 -3.33 -0.04 0.00 0.00 0.00 0.00 34.83 31.51 1uk2 s MET 17 CO 0.08 0.42 0.12 0.14 0.00 0.00 0.00 175.02 175.77 1uk2 s VAL 18 N -0.28 0.19 -0.14 -6.03 -7.23 -0.46 -4.83 120.40 101.62 1uk2 s VAL 18 Ca 0.28 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.41 1uk2 s VAL 18 Cb -0.17 -2.54 -0.03 0.00 0.56 0.00 0.00 36.38 34.19 1uk2 s VAL 18 CO 0.15 -0.00 -0.01 0.00 -0.31 0.00 0.00 175.10 174.92 1uk2 s GLN 19 N -4.12 3.53 -0.14 4.82 -2.07 -0.57 -0.41 119.66 120.70 1uk2 s GLN 19 Ca 0.39 -0.46 -0.01 0.00 -1.82 0.00 0.00 55.36 53.46 1uk2 s GLN 19 Cb 0.07 -2.93 -0.02 0.00 -1.09 0.00 0.00 33.01 29.04 1uk2 s GLN 19 CO 0.13 0.38 -0.11 0.08 -1.32 0.00 0.00 175.29 174.45 1uk2 s VAL 20 N 0.01 3.24 -0.03 3.63 1.01 0.51 -0.98 120.40 127.80 1uk2 s VAL 20 Ca 0.02 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.44 1uk2 s VAL 20 Cb -0.13 -2.38 0.00 0.00 0.00 0.00 0.00 36.38 33.87 1uk2 s VAL 20 CO 0.02 0.51 -0.10 -0.89 0.00 0.00 0.00 175.10 174.64 1uk2 s THR 21 N 0.44 0.86 -0.36 3.92 2.01 0.89 -0.08 115.64 123.33 1uk2 s THR 21 Ca -0.08 -0.40 -0.00 0.00 0.31 0.00 0.00 61.69 61.52 1uk2 s THR 21 Cb -0.15 -0.77 0.13 0.00 0.01 0.00 0.00 72.50 71.72 1uk2 s THR 21 CO 0.04 0.27 0.20 0.00 -0.69 0.00 0.00 174.62 174.44 1uk2 n GLY 23 N 4.16 2.06 0.11 0.00 0.00 -1.26 -3.57 105.19 106.68 1uk2 n GLY 23 Ca 0.08 -0.50 0.01 0.00 0.00 0.00 0.00 46.02 45.61 1uk2 n GLY 23 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1uk2 h THR 24 N 0.00 0.69 -3.34 2.61 1.35 -1.96 -3.46 112.91 108.79 1uk2 h THR 24 Ca 0.00 -2.13 -0.57 0.00 -0.55 0.00 0.00 66.41 63.16 1uk2 h THR 24 Cb 0.00 2.21 -0.07 0.00 -1.73 0.00 0.00 68.15 68.57 1uk2 h THR 24 CO 0.00 0.39 -0.03 -0.89 -0.25 0.00 0.00 175.52 174.74 1uk2 s THR 25 N -2.93 5.11 -0.09 6.82 2.01 -1.23 -5.07 115.64 120.26 1uk2 s THR 25 Ca -0.00 1.20 0.03 0.00 0.31 0.00 0.00 61.69 63.23 1uk2 s THR 25 Cb 0.08 -3.93 0.01 0.00 0.01 0.00 0.00 72.50 68.67 1uk2 s THR 25 CO 0.79 0.29 -0.19 -0.89 -0.69 0.00 0.00 174.62 173.93 1uk2 s THR 26 N 0.68 1.65 0.16 -0.82 2.01 -1.26 -1.38 115.64 116.69 1uk2 s THR 26 Ca 0.32 -0.78 -0.10 0.00 0.31 0.00 0.00 61.69 61.44 1uk2 s THR 26 Cb -0.16 -1.46 -0.01 0.00 0.01 0.00 0.00 72.50 70.88 1uk2 s THR 26 CO 0.14 0.47 0.30 -1.48 -0.69 0.00 0.00 174.62 173.36 1uk2 s LEU 27 N 0.51 0.91 0.48 4.42 0.05 0.89 -4.67 118.68 121.28 1uk2 s LEU 27 Ca -0.17 -0.83 -0.21 0.00 0.05 0.00 0.00 54.13 52.97 1uk2 s LEU 27 Cb -0.17 1.26 -0.08 0.00 -2.05 0.00 0.00 46.19 45.15 1uk2 s LEU 27 CO 0.06 -0.90 1.08 0.20 -0.55 0.00 0.00 176.35 176.25 1uk2 s ASN 28 N -2.96 6.21 0.15 1.48 0.01 -0.72 -0.36 114.94 118.75 1uk2 s ASN 28 Ca 0.16 2.07 0.07 0.00 -0.71 0.00 0.00 52.86 54.45 1uk2 s ASN 28 Cb 0.03 -2.58 -0.04 0.00 0.41 0.00 0.00 41.25 39.07 1uk2 s ASN 28 CO -0.01 -0.88 -0.15 -0.83 -1.51 0.00 0.00 177.10 173.72 1uk2 s GLY 29 N -1.76 1.24 -0.25 0.66 0.00 0.45 -4.28 107.32 103.38 1uk2 s GLY 29 Ca 0.67 -1.43 -0.05 0.00 0.00 0.00 0.00 44.72 43.91 1uk2 s GLY 29 CO 0.25 -1.49 0.01 -2.27 0.00 0.00 0.00 173.10 169.61 1uk2 s LEU 30 N -2.70 3.27 -0.39 0.66 0.20 0.03 -1.35 118.68 118.41 1uk2 s LEU 30 Ca 0.14 -0.44 -0.10 0.00 0.69 0.00 0.00 54.13 54.41 1uk2 s LEU 30 Cb -0.04 -1.82 0.04 0.00 -0.43 0.00 0.00 46.19 43.95 1uk2 s LEU 30 CO 0.05 -0.07 0.22 0.86 -0.29 0.00 0.00 176.35 177.12 1uk2 s TRP 31 N 1.51 3.27 -0.07 5.38 -0.00 0.27 0.37 118.94 129.67 1uk2 s TRP 31 Ca 0.05 -1.14 0.03 0.00 -0.00 0.00 0.00 56.10 55.04 1uk2 s TRP 31 Cb -0.15 -2.59 0.01 0.00 -0.00 0.00 0.00 33.47 30.74 1uk2 s TRP 31 CO -0.00 -0.71 -0.17 -0.51 -0.00 0.00 0.00 176.95 175.56 1uk2 s LEU 32 N 1.51 1.83 0.00 5.86 1.43 -0.81 -4.65 118.68 123.86 1uk2 s LEU 32 Ca 0.02 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.73 1uk2 s LEU 32 Cb -0.20 -1.04 0.00 0.00 0.03 0.00 0.00 46.19 44.98 1uk2 s LEU 32 CO 0.05 0.09 0.00 0.47 0.23 0.00 0.00 176.35 177.20 1uk2 n ASP 33 N 3.61 0.00 -1.38 2.29 8.00 -1.26 -1.88 116.55 125.93 1uk2 n ASP 33 Ca -0.21 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.22 1uk2 n ASP 33 Cb 0.52 0.00 0.20 0.00 -0.02 0.00 0.00 41.12 41.82 1uk2 n ASP 33 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1uk2 n ASP 34 N 3.34 2.83 -4.16 -2.24 3.85 -1.26 0.29 116.55 119.20 1uk2 n ASP 34 Ca 0.00 -3.70 -0.24 0.00 -0.71 0.00 0.00 54.79 50.13 1uk2 n ASP 34 Cb 0.00 -0.67 -0.15 0.00 -1.35 0.00 0.00 41.12 38.94 1uk2 n ASP 34 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 1uk2 s THR 35 N -3.24 1.35 -0.20 2.12 2.01 -0.79 -0.45 115.64 116.44 1uk2 s THR 35 Ca 0.47 -0.74 -0.01 0.00 0.31 0.00 0.00 61.69 61.73 1uk2 s THR 35 Cb 0.42 -1.12 0.01 0.00 0.01 0.00 0.00 72.50 71.82 1uk2 s THR 35 CO 0.03 0.38 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.51 1uk2 s VAL 36 N -0.41 2.55 -0.12 3.82 1.01 0.90 -1.92 120.40 126.24 1uk2 s VAL 36 Ca 0.07 -0.83 -0.10 0.00 0.00 0.00 0.00 61.98 61.11 1uk2 s VAL 36 Cb -0.07 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 34.13 1uk2 s VAL 36 CO -0.01 0.45 0.22 -0.31 0.00 0.00 0.00 175.10 175.45 1uk2 s TYR 37 N 1.35 3.57 0.23 5.22 2.02 0.16 -1.49 117.35 128.40 1uk2 s TYR 37 Ca 0.04 0.60 -0.20 0.00 -0.37 0.00 0.00 57.07 57.15 1uk2 s TYR 37 Cb -0.14 -2.11 0.03 0.00 -0.40 0.00 0.00 41.96 39.34 1uk2 s TYR 37 CO -0.09 0.57 0.61 0.00 -1.57 0.00 0.00 175.55 175.07 1uk2 s PRO 39 N -3.88 4.23 0.52 0.00 0.02 -1.26 -0.56 135.00 134.06 1uk2 s PRO 39 Ca 0.09 2.38 0.34 0.00 0.02 0.00 0.00 61.00 63.83 1uk2 s PRO 39 Cb -0.03 -3.07 1.52 0.00 0.02 0.00 0.00 34.50 32.94 1uk2 s PRO 39 CO -0.00 -0.44 2.01 0.07 -0.33 0.00 0.00 177.00 178.30 1uk2 h ARG 40 N 4.49 0.00 0.00 5.54 0.11 -1.43 -2.81 114.38 120.27 1uk2 h ARG 40 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 1uk2 h ARG 40 Cb 1.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.30 1uk2 h ARG 40 CO 0.74 0.00 0.00 -2.39 0.10 0.00 0.00 179.97 178.42 1uk2 n HIS 41 N -2.91 0.00 0.31 4.08 1.44 -1.26 -2.76 115.22 114.12 1uk2 n HIS 41 Ca -0.00 0.00 0.16 0.00 -2.01 0.00 0.00 57.72 55.87 1uk2 n HIS 41 Cb 0.23 0.00 0.63 0.00 0.12 0.00 0.00 29.99 30.97 1uk2 n HIS 41 CO 0.00 0.00 0.00 -0.24 -2.81 0.00 0.00 176.34 173.29 1uk2 h VAL 42 N 0.00 0.00 0.00 0.61 3.04 -1.89 -2.02 116.25 115.99 1uk2 h VAL 42 Ca 0.00 -0.43 0.00 0.00 -1.01 0.00 0.00 66.70 65.26 1uk2 h VAL 42 Cb 0.00 1.36 0.00 0.00 -2.01 0.00 0.00 31.29 30.64 1uk2 h VAL 42 CO 0.00 0.00 -0.38 2.30 -1.01 0.00 0.00 177.57 178.48 1uk2 n ILE 43 N -2.85 0.36 -3.05 3.17 -5.35 -1.11 -4.42 119.36 106.11 1uk2 n ILE 43 Ca 0.01 -0.23 -0.40 0.00 -0.27 0.00 0.00 62.75 61.86 1uk2 n ILE 43 Cb 0.28 -0.25 -0.05 0.00 -1.74 0.00 0.00 39.64 37.89 1uk2 n ILE 43 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1uk2 s THR 45 N 0.97 2.52 0.59 0.00 -1.32 -1.26 -4.83 115.64 112.31 1uk2 s THR 45 Ca 0.36 0.21 0.43 0.00 -1.21 0.00 0.00 61.69 61.48 1uk2 s THR 45 Cb -0.17 -2.58 0.43 0.00 -1.51 0.00 0.00 72.50 68.67 1uk2 s THR 45 CO 0.17 -0.18 2.32 0.00 -2.21 0.00 0.00 174.62 174.71 1uk2 h ALA 46 N -0.93 1.00 0.27 11.08 0.00 -1.97 -2.73 119.26 125.99 1uk2 h ALA 46 Ca -0.45 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1uk2 h ALA 46 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1uk2 h ALA 46 CO 0.48 0.00 -0.13 1.49 0.00 0.00 0.00 179.25 181.09 1uk2 h GLU 47 N 0.00 -0.35 -0.05 0.00 4.22 -2.03 -3.26 114.58 113.11 1uk2 h GLU 47 Ca 0.00 0.02 -0.04 0.00 0.08 0.00 0.00 59.36 59.43 1uk2 h GLU 47 Cb 0.01 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1uk2 h GLU 47 CO 0.00 0.00 -0.14 -0.44 -2.18 0.00 0.00 179.01 176.25 1uk2 h ASP 48 N -0.85 0.07 -0.37 1.04 3.32 -1.83 -3.24 116.42 114.56 1uk2 h ASP 48 Ca -0.04 -0.01 0.11 0.00 0.02 0.00 0.00 57.03 57.11 1uk2 h ASP 48 Cb 0.51 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1uk2 h ASP 48 CO 0.06 0.22 1.00 0.23 -1.72 0.00 0.00 179.24 179.03 1uk2 n MET 49 N -4.33 0.02 0.31 3.56 2.81 -1.13 -0.85 117.12 117.50 1uk2 n MET 49 Ca -0.02 0.90 -0.12 0.00 -1.81 0.00 0.00 57.70 56.65 1uk2 n MET 49 Cb 0.23 -2.35 -0.06 0.00 -0.71 0.00 0.00 33.22 30.33 1uk2 n MET 49 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1uk2 h LEU 50 N 0.00 -0.66 -5.96 4.03 -0.00 -1.80 -2.46 115.31 108.46 1uk2 h LEU 50 Ca 0.18 0.02 -0.45 0.00 -0.00 0.00 0.00 57.88 57.63 1uk2 h LEU 50 Cb 2.18 0.17 -0.31 0.00 -0.00 0.00 0.00 40.66 42.70 1uk2 h LEU 50 CO -0.00 -0.46 -0.83 0.21 -0.00 0.00 0.00 178.44 177.36 1uk2 s ASN 51 N -3.26 0.56 0.47 -0.43 3.04 -0.03 -2.46 114.94 112.83 1uk2 s ASN 51 Ca -0.11 -2.63 -0.24 0.00 0.04 0.00 0.00 52.86 49.92 1uk2 s ASN 51 Cb 0.01 0.29 -0.07 0.00 -1.54 0.00 0.00 41.25 39.94 1uk2 s ASN 51 CO 0.34 -0.14 1.29 -2.16 -3.04 0.00 0.00 177.10 173.40 1uk2 s PRO 52 N 0.35 3.64 -0.65 0.43 0.04 -1.14 -5.00 135.00 132.67 1uk2 s PRO 52 Ca 0.32 2.10 -0.15 0.00 0.04 0.00 0.00 61.00 63.30 1uk2 s PRO 52 Cb 0.02 -2.50 0.16 0.00 0.04 0.00 0.00 34.50 32.22 1uk2 s PRO 52 CO -0.15 -0.74 0.60 1.21 0.04 0.00 0.00 177.00 177.96 1uk2 s ASN 53 N -0.95 6.41 0.09 6.66 3.04 -1.26 -4.90 114.94 124.02 1uk2 s ASN 53 Ca 0.63 -2.14 -0.15 0.00 0.04 0.00 0.00 52.86 51.24 1uk2 s ASN 53 Cb -0.37 -2.21 -0.12 0.00 -1.54 0.00 0.00 41.25 37.02 1uk2 s ASN 53 CO 0.45 -0.75 1.36 1.88 -3.04 0.00 0.00 177.10 177.01 1uk2 h TYR 54 N 8.46 0.83 -1.00 0.43 0.99 -1.99 -2.63 116.97 122.06 1uk2 h TYR 54 Ca -0.14 -0.29 0.07 0.00 2.00 0.00 0.00 58.73 60.37 1uk2 h TYR 54 Cb 1.08 -0.16 -0.07 0.00 1.00 0.00 0.00 36.73 38.58 1uk2 h TYR 54 CO 0.85 1.05 0.65 0.93 -0.00 0.00 0.00 178.16 181.63 1uk2 h GLU 55 N 0.37 1.11 0.06 4.88 3.07 -2.00 -1.41 114.58 120.67 1uk2 h GLU 55 Ca 0.02 -0.07 -0.22 0.00 -0.50 0.00 0.00 59.36 58.59 1uk2 h GLU 55 Cb 0.98 -0.25 0.02 0.00 -0.84 0.00 0.00 28.75 28.66 1uk2 h GLU 55 CO 0.09 0.74 -0.89 0.22 -1.40 0.00 0.00 179.01 177.77 1uk2 h ASP 56 N 1.15 0.67 -0.81 1.42 3.58 -1.99 -1.69 116.42 118.75 1uk2 h ASP 56 Ca 0.44 -0.81 -0.03 0.00 0.42 0.00 0.00 57.03 57.05 1uk2 h ASP 56 Cb 0.22 -0.21 -0.04 0.00 1.72 0.00 0.00 39.33 41.02 1uk2 h ASP 56 CO -0.19 1.41 0.41 -0.07 -2.88 0.00 0.00 179.24 177.92 1uk2 h LEU 57 N 0.02 1.05 0.36 2.28 3.38 -1.39 -0.73 115.31 120.28 1uk2 h LEU 57 Ca -0.13 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 1uk2 h LEU 57 Cb 1.60 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 42.08 1uk2 h LEU 57 CO 0.17 0.88 -0.17 0.25 0.09 0.00 0.00 178.44 179.66 1uk2 h LEU 58 N 1.16 -0.41 -0.80 1.67 5.85 -1.25 -2.77 115.31 118.77 1uk2 h LEU 58 Ca 0.28 -0.05 0.18 0.00 0.84 0.00 0.00 57.88 59.13 1uk2 h LEU 58 Cb 0.09 0.11 -0.12 0.00 0.37 0.00 0.00 40.66 41.11 1uk2 h LEU 58 CO -0.04 -0.20 0.25 0.40 -0.34 0.00 0.00 178.44 178.51 1uk2 h ILE 59 N -0.59 0.50 0.00 4.05 1.08 -1.07 0.14 117.51 121.61 1uk2 h ILE 59 Ca -0.05 -0.11 0.00 0.00 -0.39 0.00 0.00 64.86 64.31 1uk2 h ILE 59 Cb 0.44 0.15 0.00 0.00 -3.07 0.00 0.00 36.82 34.34 1uk2 h ILE 59 CO 0.08 0.06 0.00 0.54 -0.69 0.00 0.00 178.15 178.14 1uk2 n ARG 60 N -5.12 0.83 -4.79 2.37 1.74 -0.30 -4.77 116.66 106.62 1uk2 n ARG 60 Ca 0.17 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.94 1uk2 n ARG 60 Cb 0.52 -1.09 -0.13 0.00 -1.02 0.00 0.00 32.46 30.74 1uk2 n ARG 60 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1uk2 s LYS 61 N -1.78 2.13 0.34 5.56 -0.14 0.48 -5.04 119.74 121.29 1uk2 s LYS 61 Ca 0.00 -0.93 0.08 0.00 -1.36 0.00 0.00 55.97 53.76 1uk2 s LYS 61 Cb 0.00 -2.19 -0.05 0.00 -1.68 0.00 0.00 37.83 33.91 1uk2 s LYS 61 CO 0.00 0.55 0.10 -1.54 -0.76 0.00 0.00 175.35 173.70 1uk2 s SER 62 N -1.21 4.50 0.36 2.83 1.04 -1.26 -5.00 113.70 114.95 1uk2 s SER 62 Ca 0.13 -0.85 0.09 0.00 0.48 0.00 0.00 55.95 55.80 1uk2 s SER 62 Cb -0.10 -0.66 0.83 0.00 0.10 0.00 0.00 66.02 66.18 1uk2 s SER 62 CO 0.04 -0.28 1.86 0.78 0.98 0.00 0.00 173.24 176.62 1uk2 h ASN 63 N 1.64 0.65 0.36 7.02 2.35 -1.95 -1.53 115.58 124.12 1uk2 h ASN 63 Ca -0.43 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.36 1uk2 h ASN 63 Cb 1.25 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.54 1uk2 h ASN 63 CO 0.65 0.32 0.00 1.57 -1.65 0.00 0.00 177.43 178.32 1uk2 n HIS 64 N -4.57 0.37 0.19 1.19 -0.00 -1.26 -2.25 115.22 108.89 1uk2 n HIS 64 Ca 0.18 0.16 0.09 0.00 0.46 0.00 0.00 57.72 58.61 1uk2 n HIS 64 Cb 0.48 -0.76 0.16 0.00 -0.12 0.00 0.00 29.99 29.75 1uk2 n HIS 64 CO 0.00 0.00 0.00 0.77 0.46 0.00 0.00 176.34 177.57 1uk2 h SER 65 N 0.00 0.00 -3.30 0.26 0.02 -1.67 -3.44 113.55 105.42 1uk2 h SER 65 Ca 0.00 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.36 1uk2 h SER 65 Cb 0.18 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 62.64 1uk2 h SER 65 CO 0.00 0.19 0.51 -0.36 -1.14 0.00 0.00 176.83 176.03 1uk2 s PHE 66 N -3.17 3.28 -0.28 3.45 0.08 -0.96 -4.38 117.98 116.00 1uk2 s PHE 66 Ca 0.05 1.10 -0.08 0.00 0.12 0.00 0.00 56.93 58.12 1uk2 s PHE 66 Cb 0.06 -3.15 -0.02 0.00 -0.57 0.00 0.00 43.02 39.34 1uk2 s PHE 66 CO 0.69 -0.47 0.11 -1.17 -0.10 0.00 0.00 175.22 174.28 1uk2 s LEU 67 N 2.96 3.79 -0.17 -0.37 2.96 -0.13 -4.72 118.68 123.00 1uk2 s LEU 67 Ca 0.36 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 53.88 1uk2 s LEU 67 Cb -0.15 -1.96 0.01 0.00 0.50 0.00 0.00 46.19 44.60 1uk2 s LEU 67 CO 0.09 -0.12 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.12 1uk2 s VAL 68 N 1.60 2.22 -0.06 1.68 1.01 -1.26 -0.08 120.40 125.52 1uk2 s VAL 68 Ca 0.05 -0.90 0.06 0.00 0.00 0.00 0.00 61.98 61.19 1uk2 s VAL 68 Cb -0.16 -1.93 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 1uk2 s VAL 68 CO 0.05 0.53 -0.24 -1.10 0.00 0.00 0.00 175.10 174.34 1uk2 s GLN 69 N 1.16 2.57 -0.31 2.72 -0.21 -0.15 -1.40 119.66 124.05 1uk2 s GLN 69 Ca 0.01 -0.88 0.03 0.00 0.02 0.00 0.00 55.36 54.55 1uk2 s GLN 69 Cb -0.14 -2.13 0.08 0.00 1.00 0.00 0.00 33.01 31.82 1uk2 s GLN 69 CO -0.09 0.33 -0.01 0.00 -2.12 0.00 0.00 175.29 173.41 1uk2 s ALA 70 N -0.05 2.73 0.00 6.09 0.00 0.10 -1.52 121.76 129.11 1uk2 s ALA 70 Ca -0.06 -2.22 0.00 0.00 0.00 0.00 0.00 51.96 49.68 1uk2 s ALA 70 Cb -0.14 -1.81 0.00 0.00 0.00 0.00 0.00 23.12 21.16 1uk2 s ALA 70 CO 0.04 -1.50 0.00 0.41 0.00 0.00 0.00 175.76 174.72 1uk2 n GLY 71 N 4.34 3.22 1.05 0.00 0.00 -1.26 -0.77 105.19 111.77 1uk2 n GLY 71 Ca -0.03 -0.25 0.04 0.00 0.00 0.00 0.00 46.02 45.78 1uk2 n GLY 71 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1uk2 n ASN 72 N 3.05 2.95 -4.43 1.61 5.03 -1.26 -4.84 115.26 117.36 1uk2 n ASN 72 Ca 0.00 -2.34 -0.33 0.00 0.87 0.00 0.00 54.58 52.78 1uk2 n ASN 72 Cb 0.00 -0.50 -0.14 0.00 -1.02 0.00 0.00 39.78 38.12 1uk2 n ASN 72 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1uk2 s VAL 73 N -1.77 3.20 -0.15 2.41 1.01 0.06 -5.09 120.40 120.07 1uk2 s VAL 73 Ca 0.26 -0.63 -0.18 0.00 0.00 0.00 0.00 61.98 61.42 1uk2 s VAL 73 Cb 0.18 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 1uk2 s VAL 73 CO 0.10 0.55 0.50 -1.58 0.00 0.00 0.00 175.10 174.67 1uk2 s GLN 74 N -0.03 4.29 -0.20 2.72 0.74 -1.26 0.02 119.66 125.93 1uk2 s GLN 74 Ca -0.02 0.46 -0.10 0.00 0.05 0.00 0.00 55.36 55.74 1uk2 s GLN 74 Cb -0.14 -3.48 -0.05 0.00 1.10 0.00 0.00 33.01 30.44 1uk2 s GLN 74 CO 0.04 0.04 0.12 -0.51 -0.55 0.00 0.00 175.29 174.42 1uk2 s LEU 75 N 1.02 4.14 0.04 3.68 1.43 -0.49 -4.96 118.68 123.54 1uk2 s LEU 75 Ca 0.26 0.20 -0.27 0.00 -1.03 0.00 0.00 54.13 53.28 1uk2 s LEU 75 Cb -0.15 -2.07 -0.05 0.00 0.03 0.00 0.00 46.19 43.95 1uk2 s LEU 75 CO 0.10 0.17 0.85 -0.60 0.23 0.00 0.00 176.35 177.11 1uk2 s ARG 76 N 0.42 4.56 -0.17 1.70 3.52 -1.26 -4.13 118.95 123.58 1uk2 s ARG 76 Ca 0.07 1.22 -0.14 0.00 -0.13 0.00 0.00 55.73 56.75 1uk2 s ARG 76 Cb -0.11 -3.40 -0.05 0.00 -1.56 0.00 0.00 34.95 29.83 1uk2 s ARG 76 CO -0.01 0.17 0.30 0.54 -0.81 0.00 0.00 175.30 175.49 1uk2 s VAL 77 N 0.28 5.30 -0.03 7.11 0.11 -1.26 -0.06 120.40 131.85 1uk2 s VAL 77 Ca 0.43 0.55 0.04 0.00 -2.93 0.00 0.00 61.98 60.08 1uk2 s VAL 77 Cb -0.21 -3.64 0.06 0.00 -1.53 0.00 0.00 36.38 31.07 1uk2 s VAL 77 CO 0.25 0.38 1.02 2.30 -3.33 0.00 0.00 175.10 175.72 1uk2 n ILE 78 N 3.66 1.17 -3.63 7.04 -5.35 -0.40 -4.65 119.36 117.20 1uk2 n ILE 78 Ca -0.12 -1.25 -0.03 0.00 -0.27 0.00 0.00 62.75 61.08 1uk2 n ILE 78 Cb 0.52 0.35 -0.04 0.00 -1.74 0.00 0.00 39.64 38.72 1uk2 n ILE 78 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1uk2 s GLY 79 N -1.39 0.04 -0.16 3.28 0.00 -1.21 -4.96 107.32 102.91 1uk2 s GLY 79 Ca 0.07 2.73 -0.15 0.00 0.00 0.00 0.00 44.72 47.37 1uk2 s GLY 79 CO 0.01 1.09 0.44 -2.38 0.00 0.00 0.00 173.10 172.25 1uk2 s HIS 80 N -1.04 -0.49 0.20 1.90 -3.43 -1.26 -1.23 115.29 109.93 1uk2 s HIS 80 Ca 0.08 1.18 -0.16 0.00 -0.80 0.00 0.00 55.06 55.36 1uk2 s HIS 80 Cb -0.01 0.18 0.02 0.00 -1.43 0.00 0.00 32.58 31.34 1uk2 s HIS 80 CO -0.07 -0.24 0.49 -1.54 -2.00 0.00 0.00 174.74 171.38 1uk2 s SER 81 N 0.34 -0.21 -0.07 7.38 1.04 -0.31 -5.00 113.70 116.87 1uk2 s SER 81 Ca -0.01 -0.57 -0.00 0.00 0.48 0.00 0.00 55.95 55.85 1uk2 s SER 81 Cb -0.04 0.56 -0.03 0.00 0.10 0.00 0.00 66.02 66.62 1uk2 s SER 81 CO -0.01 -1.05 -0.04 -0.32 0.98 0.00 0.00 173.24 172.81 1uk2 s MET 82 N -3.90 2.85 -0.27 4.02 1.75 -1.26 0.31 119.30 122.79 1uk2 s MET 82 Ca 0.11 -0.49 -0.03 0.00 -1.25 0.00 0.00 55.69 54.03 1uk2 s MET 82 Cb -0.01 -2.68 0.09 0.00 2.84 0.00 0.00 34.83 35.08 1uk2 s MET 82 CO -0.01 0.68 0.11 -1.14 -0.65 0.00 0.00 175.02 174.00 1uk2 s GLN 83 N -0.87 0.36 7.58 4.11 0.74 0.01 -4.94 119.66 126.67 1uk2 s GLN 83 Ca 0.13 -0.62 0.00 0.00 0.05 0.00 0.00 55.36 54.92 1uk2 s GLN 83 Cb -0.11 -1.55 0.00 0.00 1.10 0.00 0.00 33.01 32.45 1uk2 s GLN 83 CO 0.02 -0.94 0.00 0.09 -0.55 0.00 0.00 175.29 173.91 1uk2 n ASN 84 N 5.12 0.00 -0.75 6.67 3.02 -1.26 -1.67 115.26 126.39 1uk2 n ASN 84 Ca -0.05 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.55 1uk2 n ASN 84 Cb 0.43 0.00 0.17 0.00 -0.61 0.00 0.00 39.78 39.77 1uk2 n ASN 84 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1uk2 s LEU 86 N -1.05 2.85 -0.09 0.00 1.43 -0.67 -1.21 118.68 119.94 1uk2 s LEU 86 Ca 0.25 -0.68 -0.02 0.00 -1.03 0.00 0.00 54.13 52.65 1uk2 s LEU 86 Cb 0.14 -1.52 -0.03 0.00 0.03 0.00 0.00 46.19 44.81 1uk2 s LEU 86 CO 0.16 0.09 0.02 -0.22 0.23 0.00 0.00 176.35 176.63 1uk2 s LEU 87 N -2.91 3.69 -0.28 1.79 2.96 0.27 -0.81 118.68 123.39 1uk2 s LEU 87 Ca 0.25 0.18 0.01 0.00 -0.22 0.00 0.00 54.13 54.35 1uk2 s LEU 87 Cb -0.08 -1.87 0.06 0.00 0.50 0.00 0.00 46.19 44.80 1uk2 s LEU 87 CO 0.14 0.38 -0.05 -0.13 -1.32 0.00 0.00 176.35 175.37 1uk2 s ARG 88 N -0.95 2.26 -0.30 1.98 0.52 0.15 -2.21 118.95 120.41 1uk2 s ARG 88 Ca 0.14 -1.36 -0.10 0.00 -0.52 0.00 0.00 55.73 53.89 1uk2 s ARG 88 Cb -0.11 -3.03 -0.02 0.00 0.52 0.00 0.00 34.95 32.30 1uk2 s ARG 88 CO 0.03 -0.62 0.15 -0.51 0.02 0.00 0.00 175.30 174.37 1uk2 s LEU 89 N 1.15 4.00 0.03 2.53 1.43 -0.56 -1.16 118.68 126.11 1uk2 s LEU 89 Ca -0.06 -0.36 -0.30 0.00 -1.03 0.00 0.00 54.13 52.38 1uk2 s LEU 89 Cb -0.20 -2.02 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 1uk2 s LEU 89 CO -0.04 -0.14 0.99 -0.75 0.23 0.00 0.00 176.35 176.64 1uk2 s LYS 90 N 1.65 4.58 0.37 1.70 2.20 -0.37 -0.07 119.74 129.81 1uk2 s LYS 90 Ca 0.06 1.45 0.08 0.00 -0.36 0.00 0.00 55.97 57.20 1uk2 s LYS 90 Cb -0.17 -3.43 -0.06 0.00 -1.51 0.00 0.00 37.83 32.66 1uk2 s LYS 90 CO 0.07 -0.00 0.03 0.14 -0.36 0.00 0.00 175.35 175.23 1uk2 s VAL 91 N 0.77 2.34 -0.23 4.02 -7.23 0.40 -1.28 120.40 119.20 1uk2 s VAL 91 Ca 0.51 -1.96 0.28 0.00 -1.81 0.00 0.00 61.98 59.01 1uk2 s VAL 91 Cb -0.22 -2.87 0.32 0.00 0.56 0.00 0.00 36.38 34.17 1uk2 s VAL 91 CO 0.29 -0.11 1.83 -2.24 -0.31 0.00 0.00 175.10 174.56 1uk2 h ASP 92 N 1.75 0.00 -3.99 4.85 3.04 -0.79 -3.44 116.42 117.84 1uk2 h ASP 92 Ca -0.43 0.00 -0.58 0.00 -3.24 0.00 0.00 57.03 52.78 1uk2 h ASP 92 Cb 1.25 0.00 -0.31 0.00 -1.04 0.00 0.00 39.33 39.23 1uk2 h ASP 92 CO 0.72 0.00 -0.84 -0.89 -2.04 0.00 0.00 179.24 176.18 1uk2 s THR 93 N -3.46 1.52 -0.06 1.15 2.01 -1.26 -5.02 115.64 110.52 1uk2 s THR 93 Ca 0.03 -0.78 -0.24 0.00 0.31 0.00 0.00 61.69 61.01 1uk2 s THR 93 Cb 0.09 -1.30 -0.04 0.00 0.01 0.00 0.00 72.50 71.26 1uk2 s THR 93 CO 0.47 0.44 0.73 -0.55 -0.69 0.00 0.00 174.62 175.02 1uk2 s SER 94 N -0.06 7.03 -0.22 3.53 0.15 -1.26 -4.48 113.70 118.39 1uk2 s SER 94 Ca -0.02 1.25 -0.29 0.00 0.70 0.00 0.00 55.95 57.58 1uk2 s SER 94 Cb -0.11 -2.43 -0.06 0.00 -1.71 0.00 0.00 66.02 61.71 1uk2 s SER 94 CO 0.02 -0.13 2.20 -3.20 1.20 0.00 0.00 173.24 173.34 1uk2 n ASN 95 N 3.75 3.18 0.30 5.45 2.85 0.15 -4.85 115.26 126.09 1uk2 n ASN 95 Ca -0.01 0.28 0.19 0.00 -0.11 0.00 0.00 54.58 54.93 1uk2 n ASN 95 Cb 0.51 -1.52 0.96 0.00 1.24 0.00 0.00 39.78 40.97 1uk2 n ASN 95 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1uk2 h PRO 96 N 14.43 0.00 -0.34 1.20 0.11 -1.93 -2.14 132.00 143.33 1uk2 h PRO 96 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1uk2 h PRO 96 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1uk2 h PRO 96 CO 0.97 0.03 0.00 1.63 -0.21 0.00 0.00 178.00 180.41 1uk2 n LYS 97 N -3.27 2.19 -1.68 1.05 5.02 -1.26 -4.95 118.16 115.27 1uk2 n LYS 97 Ca -0.02 -1.81 -0.55 0.00 -2.02 0.00 0.00 58.31 53.92 1uk2 n LYS 97 Cb 0.17 -1.45 -0.06 0.00 -0.02 0.00 0.00 35.03 33.66 1uk2 n LYS 97 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1uk2 n THR 98 N 1.01 0.26 -2.57 -0.18 -1.04 -0.80 -4.86 114.28 106.10 1uk2 n THR 98 Ca 0.18 -0.05 -0.25 0.00 -2.04 0.00 0.00 64.05 61.89 1uk2 n THR 98 Cb 0.48 -1.23 0.03 0.00 -1.82 0.00 0.00 70.33 67.79 1uk2 n THR 98 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1uk2 s PRO 99 N 2.77 2.89 0.32 -2.82 0.04 -1.26 -5.00 135.00 131.94 1uk2 s PRO 99 Ca 0.93 -0.21 -0.29 0.00 0.04 0.00 0.00 61.00 61.47 1uk2 s PRO 99 Cb -0.98 -2.36 -0.11 0.00 0.04 0.00 0.00 34.50 31.09 1uk2 s PRO 99 CO 0.58 -0.61 1.49 0.15 0.04 0.00 0.00 177.00 178.65 1uk2 s LYS 100 N -4.87 4.17 0.21 4.56 1.02 -1.26 -4.89 119.74 118.68 1uk2 s LYS 100 Ca 0.53 2.48 -0.12 0.00 0.02 0.00 0.00 55.97 58.88 1uk2 s LYS 100 Cb -0.10 -3.02 -0.00 0.00 -0.52 0.00 0.00 37.83 34.18 1uk2 s LYS 100 CO 0.43 -0.50 0.41 1.52 -0.92 0.00 0.00 175.35 176.28 1uk2 s TYR 101 N -0.57 0.30 0.05 3.18 -0.85 -1.26 -1.30 117.35 116.90 1uk2 s TYR 101 Ca 0.57 -0.66 -0.07 0.00 -0.52 0.00 0.00 57.07 56.39 1uk2 s TYR 101 Cb -0.45 0.12 -0.01 0.00 0.38 0.00 0.00 41.96 42.00 1uk2 s TYR 101 CO 0.53 -0.87 0.13 0.15 -1.52 0.00 0.00 175.55 173.97 1uk2 s LYS 102 N -3.98 0.66 -0.20 -3.49 1.02 -0.37 -4.91 119.74 108.47 1uk2 s LYS 102 Ca 0.18 -0.78 -0.05 0.00 0.02 0.00 0.00 55.97 55.35 1uk2 s LYS 102 Cb 0.01 0.26 -0.02 0.00 -0.52 0.00 0.00 37.83 37.56 1uk2 s LYS 102 CO 0.04 -0.18 -0.00 -0.06 -0.92 0.00 0.00 175.35 174.23 1uk2 s PHE 103 N -2.88 3.03 0.10 3.18 2.99 -1.26 -0.90 117.98 122.24 1uk2 s PHE 103 Ca -0.03 -0.50 0.03 0.00 0.00 0.00 0.00 56.93 56.43 1uk2 s PHE 103 Cb 0.00 -2.09 -0.04 0.00 0.00 0.00 0.00 43.02 40.90 1uk2 s PHE 103 CO -0.06 -0.27 -0.09 0.14 -0.00 0.00 0.00 175.22 174.94 1uk2 s VAL 104 N 1.07 0.83 -0.21 -0.44 -7.23 -0.60 -4.95 120.40 108.86 1uk2 s VAL 104 Ca 0.02 -1.71 -0.06 0.00 -1.81 0.00 0.00 61.98 58.42 1uk2 s VAL 104 Cb -0.14 -1.42 -0.03 0.00 0.56 0.00 0.00 36.38 35.35 1uk2 s VAL 104 CO 0.01 -0.66 0.04 -0.60 -0.31 0.00 0.00 175.10 173.59 1uk2 s ARG 105 N -3.07 3.72 0.45 4.82 3.52 -1.26 -4.25 118.95 122.88 1uk2 s ARG 105 Ca 0.07 -0.46 0.06 0.00 -0.13 0.00 0.00 55.73 55.26 1uk2 s ARG 105 Cb -0.01 -3.20 0.01 0.00 -1.56 0.00 0.00 34.95 30.20 1uk2 s ARG 105 CO -0.01 0.01 0.63 0.96 -0.81 0.00 0.00 175.30 176.07 1uk2 s ILE 106 N 1.06 3.04 0.32 4.11 -4.36 -1.26 -5.13 121.20 118.98 1uk2 s ILE 106 Ca 0.03 -0.88 0.09 0.00 -0.26 0.00 0.00 60.65 59.63 1uk2 s ILE 106 Cb -0.14 -3.06 -0.05 0.00 1.25 0.00 0.00 42.46 40.46 1uk2 s ILE 106 CO 0.03 -0.03 0.00 -1.10 0.24 0.00 0.00 174.94 174.08 1uk2 s GLN 107 N -4.46 2.11 0.33 0.37 -1.52 -1.26 -5.07 119.66 110.16 1uk2 s GLN 107 Ca 0.55 -1.67 -0.28 0.00 -1.95 0.00 0.00 55.36 52.01 1uk2 s GLN 107 Cb -0.10 -1.98 -0.13 0.00 -0.22 0.00 0.00 33.01 30.58 1uk2 s GLN 107 CO 0.35 0.19 1.17 -2.30 -0.25 0.00 0.00 175.29 174.45 1uk2 n PRO 108 N -0.93 1.80 0.00 2.91 -0.02 -1.26 -2.09 135.00 135.41 1uk2 n PRO 108 Ca -0.05 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1uk2 n PRO 108 Cb 0.61 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 1uk2 n PRO 108 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uk2 n GLY 109 N 0.95 2.91 3.79 -1.23 0.00 -0.19 -4.94 105.19 106.48 1uk2 n GLY 109 Ca 0.07 -0.03 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 1uk2 n GLY 109 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1uk2 s GLN 110 N 0.00 3.57 0.28 1.61 -0.21 -0.89 -4.64 119.66 119.38 1uk2 s GLN 110 Ca 0.00 1.41 0.07 0.00 0.02 0.00 0.00 55.36 56.85 1uk2 s GLN 110 Cb 0.00 -2.06 -0.03 0.00 1.00 0.00 0.00 33.01 31.92 1uk2 s GLN 110 CO 0.00 -0.63 0.28 0.95 -2.12 0.00 0.00 175.29 173.77 1uk2 s THR 111 N -2.01 4.24 0.05 -0.19 -4.23 -1.26 -1.26 115.64 110.99 1uk2 s THR 111 Ca 0.68 -1.29 -0.27 0.00 -1.18 0.00 0.00 61.69 59.63 1uk2 s THR 111 Cb -0.18 -3.40 0.09 0.00 1.34 0.00 0.00 72.50 70.34 1uk2 s THR 111 CO 0.25 -0.27 0.87 0.72 -0.54 0.00 0.00 174.62 175.65 1uk2 s PHE 112 N -2.17 -0.31 0.20 3.99 -0.12 -0.77 -4.93 117.98 113.87 1uk2 s PHE 112 Ca 0.37 0.13 -0.08 0.00 -0.05 0.00 0.00 56.93 57.29 1uk2 s PHE 112 Cb -0.08 0.57 -0.07 0.00 -0.63 0.00 0.00 43.02 42.81 1uk2 s PHE 112 CO 0.27 -0.65 0.50 -1.12 -0.05 0.00 0.00 175.22 174.17 1uk2 s SER 113 N -2.62 6.60 -0.08 1.98 0.01 -0.46 -1.53 113.70 117.59 1uk2 s SER 113 Ca 0.06 0.84 0.03 0.00 1.31 0.00 0.00 55.95 58.19 1uk2 s SER 113 Cb -0.01 -2.19 0.01 0.00 0.21 0.00 0.00 66.02 64.04 1uk2 s SER 113 CO -0.07 -0.04 -0.16 -0.69 0.41 0.00 0.00 173.24 172.70 1uk2 s VAL 114 N -1.77 1.45 -0.48 3.43 1.01 0.35 -0.17 120.40 124.22 1uk2 s VAL 114 Ca 0.45 -0.65 -0.12 0.00 0.00 0.00 0.00 61.98 61.66 1uk2 s VAL 114 Cb -0.11 -1.30 0.10 0.00 0.00 0.00 0.00 36.38 35.07 1uk2 s VAL 114 CO 0.22 0.43 0.38 -0.22 0.00 0.00 0.00 175.10 175.91 1uk2 s LEU 115 N 0.65 5.71 -0.03 3.92 2.96 -0.61 -1.16 118.68 130.12 1uk2 s LEU 115 Ca -0.14 -1.67 -0.28 0.00 -0.22 0.00 0.00 54.13 51.82 1uk2 s LEU 115 Cb -0.16 -2.10 -0.03 0.00 0.50 0.00 0.00 46.19 44.40 1uk2 s LEU 115 CO 0.04 -0.70 0.92 0.00 -1.32 0.00 0.00 176.35 175.29 1uk2 s ALA 116 N 1.50 3.24 0.00 5.97 0.00 0.10 -3.10 121.76 129.46 1uk2 s ALA 116 Ca 0.04 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.42 1uk2 s ALA 116 Cb -0.26 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.59 1uk2 s ALA 116 CO 0.02 -0.27 0.00 0.00 0.00 0.00 0.00 175.76 175.52 1uk2 s TYR 118 N 0.04 -0.39 -0.61 0.00 -0.85 -1.05 -3.82 117.35 110.68 1uk2 s TYR 118 Ca 0.00 0.07 -0.02 0.00 -0.52 0.00 0.00 57.07 56.60 1uk2 s TYR 118 Cb 0.00 0.07 -0.02 0.00 0.38 0.00 0.00 41.96 42.39 1uk2 s TYR 118 CO 0.00 -0.27 0.52 0.09 -1.52 0.00 0.00 175.55 174.37 1uk2 n ASN 119 N 3.77 -3.52 0.00 -0.18 3.02 -1.03 -3.22 115.26 114.10 1uk2 n ASN 119 Ca 0.06 -0.37 0.00 0.00 -0.03 0.00 0.00 54.58 54.24 1uk2 n ASN 119 Cb 0.63 -3.06 0.00 0.00 -0.61 0.00 0.00 39.78 36.74 1uk2 n ASN 119 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uk2 n GLY 120 N -1.24 0.14 3.12 7.41 0.00 -1.25 -4.59 105.19 108.79 1uk2 n GLY 120 Ca -0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 1uk2 n GLY 120 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uk2 s SER 121 N -2.04 5.27 0.01 1.61 0.15 -1.20 -4.40 113.70 113.12 1uk2 s SER 121 Ca 0.00 -2.02 -0.33 0.00 0.70 0.00 0.00 55.95 54.30 1uk2 s SER 121 Cb 0.00 -1.84 -0.11 0.00 -1.71 0.00 0.00 66.02 62.36 1uk2 s SER 121 CO 0.00 -0.55 1.86 -2.65 1.20 0.00 0.00 173.24 173.11 1uk2 n PRO 122 N 4.61 2.48 0.00 5.44 -0.02 -1.26 -2.52 135.00 143.72 1uk2 n PRO 122 Ca -0.02 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 1uk2 n PRO 122 Cb 0.41 -2.78 0.00 0.00 -0.02 0.00 0.00 33.50 31.11 1uk2 n PRO 122 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1uk2 n SER 123 N 6.31 1.67 -3.62 2.55 3.41 -0.39 -4.99 113.62 118.55 1uk2 n SER 123 Ca 0.20 -0.17 -0.12 0.00 -0.26 0.00 0.00 58.87 58.53 1uk2 n SER 123 Cb 0.34 0.67 -0.05 0.00 -0.26 0.00 0.00 64.21 64.91 1uk2 n SER 123 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1uk2 s GLY 124 N -1.00 -0.32 -0.01 5.00 0.00 -0.95 -5.02 107.32 105.03 1uk2 s GLY 124 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 44.72 44.89 1uk2 s GLY 124 CO 0.00 -0.10 0.01 0.54 0.00 0.00 0.00 173.10 173.55 1uk2 s VAL 125 N -3.23 -0.02 0.18 1.40 0.11 -1.26 0.00 120.40 117.58 1uk2 s VAL 125 Ca -0.01 0.08 -0.07 0.00 -2.93 0.00 0.00 61.98 59.05 1uk2 s VAL 125 Cb 0.01 -0.04 -0.02 0.00 -1.53 0.00 0.00 36.38 34.80 1uk2 s VAL 125 CO -0.08 0.03 0.25 -0.72 -3.33 0.00 0.00 175.10 171.25 1uk2 s TYR 126 N 0.39 0.61 -0.09 1.54 -0.85 -0.31 -4.97 117.35 113.68 1uk2 s TYR 126 Ca -0.03 -0.95 -0.00 0.00 -0.52 0.00 0.00 57.07 55.56 1uk2 s TYR 126 Cb -0.05 -0.18 -0.03 0.00 0.38 0.00 0.00 41.96 42.08 1uk2 s TYR 126 CO -0.01 -0.72 -0.07 -1.14 -1.52 0.00 0.00 175.55 172.09 1uk2 s GLN 127 N -4.03 2.99 0.33 -3.49 2.00 -1.26 0.13 119.66 116.33 1uk2 s GLN 127 Ca 0.23 -0.56 -0.11 0.00 -2.00 0.00 0.00 55.36 52.93 1uk2 s GLN 127 Cb 0.04 -2.66 0.02 0.00 0.80 0.00 0.00 33.01 31.21 1uk2 s GLN 127 CO 0.04 0.54 0.60 0.00 -0.50 0.00 0.00 175.29 175.97 1uk2 s ALA 129 N -3.16 1.92 0.03 0.00 0.00 -1.26 -1.85 121.76 117.43 1uk2 s ALA 129 Ca 0.22 -1.43 -0.30 0.00 0.00 0.00 0.00 51.96 50.45 1uk2 s ALA 129 Cb -0.03 -0.18 -0.05 0.00 0.00 0.00 0.00 23.12 22.87 1uk2 s ALA 129 CO 0.13 0.24 1.13 1.41 0.00 0.00 0.00 175.76 178.68 1uk2 s MET 130 N -2.63 4.46 0.69 0.00 -2.45 -0.39 -4.65 119.30 114.33 1uk2 s MET 130 Ca 0.13 1.65 -0.11 0.00 -1.25 0.00 0.00 55.69 56.12 1uk2 s MET 130 Cb -0.06 -3.40 0.01 0.00 1.25 0.00 0.00 34.83 32.62 1uk2 s MET 130 CO 0.06 -0.22 1.06 1.03 1.05 0.00 0.00 175.02 178.00 1uk2 s ARG 131 N 1.18 2.95 0.62 4.11 1.81 0.15 -1.02 118.95 128.75 1uk2 s ARG 131 Ca 0.56 0.83 0.32 0.00 -1.72 0.00 0.00 55.73 55.72 1uk2 s ARG 131 Cb -0.26 -2.00 1.80 0.00 -0.45 0.00 0.00 34.95 34.03 1uk2 s ARG 131 CO 0.28 -1.05 2.12 -1.35 -0.68 0.00 0.00 175.30 174.62 1uk2 h PRO 132 N -0.68 0.00 -0.84 3.54 0.11 -1.84 -0.12 132.00 132.16 1uk2 h PRO 132 Ca -0.44 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.56 1uk2 h PRO 132 Cb 1.22 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.27 1uk2 h PRO 132 CO 0.59 0.00 0.13 0.27 -0.21 0.00 0.00 178.00 178.78 1uk2 n ASN 133 N -3.53 3.63 -0.69 -2.05 0.23 -1.26 -4.88 115.26 106.71 1uk2 n ASN 133 Ca 0.00 -2.67 -0.09 0.00 -0.53 0.00 0.00 54.58 51.29 1uk2 n ASN 133 Cb 0.28 -0.64 -0.04 0.00 -2.08 0.00 0.00 39.78 37.31 1uk2 n ASN 133 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1uk2 n HIS 134 N 0.08 0.00 -3.68 -2.53 8.25 -0.06 -4.61 115.22 112.68 1uk2 n HIS 134 Ca 0.22 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.43 1uk2 n HIS 134 Cb 0.93 -2.27 0.02 0.00 1.12 0.00 0.00 29.99 29.78 1uk2 n HIS 134 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1uk2 s THR 135 N -1.97 1.66 -0.01 1.59 -4.23 -1.25 -4.55 115.64 106.87 1uk2 s THR 135 Ca 0.00 -1.37 0.02 0.00 -1.18 0.00 0.00 61.69 59.16 1uk2 s THR 135 Cb 0.00 -2.02 -0.00 0.00 1.34 0.00 0.00 72.50 71.82 1uk2 s THR 135 CO 0.00 0.00 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.40 1uk2 s ILE 136 N -2.78 0.44 -0.72 2.99 1.09 -0.43 0.31 121.20 122.09 1uk2 s ILE 136 Ca 0.40 -0.22 -0.19 0.00 -1.10 0.00 0.00 60.65 59.54 1uk2 s ILE 136 Cb -0.03 -0.38 0.12 0.00 -1.06 0.00 0.00 42.46 41.11 1uk2 s ILE 136 CO 0.25 0.13 0.86 -0.54 -0.10 0.00 0.00 174.94 175.55 1uk2 s LYS 137 N -0.03 3.27 0.12 2.79 1.02 -1.26 -0.99 119.74 124.65 1uk2 s LYS 137 Ca 0.01 -1.52 0.05 0.00 0.02 0.00 0.00 55.97 54.54 1uk2 s LYS 137 Cb -0.03 -4.45 -0.04 0.00 -0.52 0.00 0.00 37.83 32.78 1uk2 s LYS 137 CO -0.00 -1.61 0.02 0.20 -0.92 0.00 0.00 175.35 173.03 1uk2 s GLY 138 N 3.44 1.86 -0.47 -3.33 0.00 -1.26 -4.99 107.32 102.57 1uk2 s GLY 138 Ca 0.19 -1.18 -0.19 0.00 0.00 0.00 0.00 44.72 43.55 1uk2 s GLY 138 CO 0.01 -1.17 0.56 -0.45 0.00 0.00 0.00 173.10 172.04 1uk2 s SER 139 N -2.54 6.23 -0.03 1.64 0.15 -1.26 -4.92 113.70 112.96 1uk2 s SER 139 Ca 0.27 -0.78 0.06 0.00 0.70 0.00 0.00 55.95 56.20 1uk2 s SER 139 Cb -0.11 -2.27 -0.02 0.00 -1.71 0.00 0.00 66.02 61.91 1uk2 s SER 139 CO 0.19 -0.77 -0.21 -0.36 1.20 0.00 0.00 173.24 173.30 1uk2 s PHE 140 N 2.44 2.50 0.00 3.44 0.40 -1.26 -5.07 117.98 120.43 1uk2 s PHE 140 Ca 0.15 -0.31 0.00 0.00 -0.60 0.00 0.00 56.93 56.16 1uk2 s PHE 140 Cb -0.18 -1.56 0.00 0.00 0.51 0.00 0.00 43.02 41.79 1uk2 s PHE 140 CO 0.13 0.07 0.00 -0.11 0.70 0.00 0.00 175.22 176.01 1uk2 n LEU 141 N 2.37 0.00 -4.00 -0.37 7.94 -1.26 -5.09 117.00 116.58 1uk2 n LEU 141 Ca -0.17 0.00 -0.14 0.00 -1.11 0.00 0.00 56.01 54.60 1uk2 n LEU 141 Cb 0.52 0.00 -0.13 0.00 0.53 0.00 0.00 43.42 44.34 1uk2 n LEU 141 CO 0.24 0.00 -0.40 0.54 -1.11 0.00 0.00 177.39 176.66 1uk2 s ASN 142 N -1.26 0.67 -0.64 1.96 2.20 -1.26 -4.87 114.94 111.73 1uk2 s ASN 142 Ca 0.00 -0.32 -0.01 0.00 -0.94 0.00 0.00 52.86 51.60 1uk2 s ASN 142 Cb 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 41.25 39.24 1uk2 s ASN 142 CO 0.00 -0.08 0.08 0.61 -2.94 0.00 0.00 177.10 174.77 1uk2 n GLY 143 N 2.21 0.11 0.35 0.45 0.00 -1.26 -4.77 105.19 102.28 1uk2 n GLY 143 Ca -0.18 -0.51 0.07 0.00 0.00 0.00 0.00 46.02 45.40 1uk2 n GLY 143 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1uk2 n SER 144 N 0.37 1.57 -4.70 1.61 2.88 -1.25 -2.45 113.62 111.65 1uk2 n SER 144 Ca -0.07 -1.29 -0.42 0.00 -1.33 0.00 0.00 58.87 55.76 1uk2 n SER 144 Cb 0.56 0.42 -0.03 0.00 -0.75 0.00 0.00 64.21 64.41 1uk2 n SER 144 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1uk2 n GLY 146 N 4.10 1.11 3.81 0.00 0.00 -1.02 -1.75 105.19 111.44 1uk2 n GLY 146 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 1uk2 n GLY 146 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uk2 s SER 147 N -2.00 7.09 0.17 1.61 1.04 0.56 -4.37 113.70 117.79 1uk2 s SER 147 Ca 0.00 1.50 0.11 0.00 0.48 0.00 0.00 55.95 58.04 1uk2 s SER 147 Cb 0.00 -2.45 -0.04 0.00 0.10 0.00 0.00 66.02 63.63 1uk2 s SER 147 CO 0.00 -0.02 -0.25 0.54 0.98 0.00 0.00 173.24 174.50 1uk2 s VAL 148 N -1.60 2.34 0.01 5.02 0.11 -1.18 -1.51 120.40 123.59 1uk2 s VAL 148 Ca 0.46 -1.92 0.04 0.00 -2.93 0.00 0.00 61.98 57.63 1uk2 s VAL 148 Cb -0.16 -2.09 -0.03 0.00 -1.53 0.00 0.00 36.38 32.56 1uk2 s VAL 148 CO 0.21 -0.04 -0.08 -0.83 -3.33 0.00 0.00 175.10 171.03 1uk2 s GLY 149 N -2.44 1.72 0.23 6.54 0.00 0.26 -1.57 107.32 112.06 1uk2 s GLY 149 Ca 0.18 -1.04 -0.22 0.00 0.00 0.00 0.00 44.72 43.64 1uk2 s GLY 149 CO 0.08 -0.91 0.69 -0.11 0.00 0.00 0.00 173.10 172.86 1uk2 s PHE 150 N -0.98 -0.31 0.10 1.90 -0.12 0.76 -1.35 117.98 117.98 1uk2 s PHE 150 Ca 0.17 -0.05 0.07 0.00 -0.05 0.00 0.00 56.93 57.07 1uk2 s PHE 150 Cb -0.11 0.65 -0.03 0.00 -0.63 0.00 0.00 43.02 42.90 1uk2 s PHE 150 CO 0.07 -1.07 -0.17 -0.80 -0.05 0.00 0.00 175.22 173.19 1uk2 s ASN 151 N -2.85 2.16 -0.22 1.98 0.01 0.12 -1.35 114.94 114.79 1uk2 s ASN 151 Ca 0.07 -0.69 -0.00 0.00 -0.71 0.00 0.00 52.86 51.53 1uk2 s ASN 151 Cb -0.04 -0.10 0.02 0.00 0.41 0.00 0.00 41.25 41.54 1uk2 s ASN 151 CO -0.00 -0.03 -0.12 -0.63 -1.51 0.00 0.00 177.10 174.81 1uk2 s ILE 152 N -1.40 2.55 -0.60 0.60 -1.09 -1.26 0.70 121.20 120.70 1uk2 s ILE 152 Ca 0.04 -0.97 -0.03 0.00 -2.23 0.00 0.00 60.65 57.47 1uk2 s ILE 152 Cb -0.09 -2.21 0.15 0.00 -1.58 0.00 0.00 42.46 38.74 1uk2 s ILE 152 CO 0.04 0.35 0.41 -1.81 -1.23 0.00 0.00 174.94 172.70 1uk2 s ASP 153 N 1.31 5.27 0.25 3.58 1.11 0.25 -4.96 116.67 123.48 1uk2 s ASP 153 Ca 0.02 -2.72 0.00 0.00 0.18 0.00 0.00 52.55 50.03 1uk2 s ASP 153 Cb -0.15 -1.86 0.00 0.00 1.07 0.00 0.00 42.92 41.98 1uk2 s ASP 153 CO -0.08 -0.40 0.00 -1.22 1.18 0.00 0.00 175.17 174.65 1uk2 n TYR 154 N 3.67 0.00 0.00 4.23 4.02 -1.26 -1.59 117.16 126.23 1uk2 n TYR 154 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.95 1uk2 n TYR 154 Cb 0.38 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.70 1uk2 n TYR 154 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1uk2 n ASP 155 N 7.71 1.19 -4.67 7.72 5.75 -1.26 -5.02 116.55 127.97 1uk2 n ASP 155 Ca 0.00 -1.19 -0.37 0.00 -0.01 0.00 0.00 54.79 53.22 1uk2 n ASP 155 Cb 0.00 -0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.00 1uk2 n ASP 155 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1uk2 s VAL 157 N 1.02 5.16 -0.48 0.00 1.01 -0.42 -0.58 120.40 126.10 1uk2 s VAL 157 Ca 0.11 0.77 -0.13 0.00 0.00 0.00 0.00 61.98 62.73 1uk2 s VAL 157 Cb -0.13 -3.76 0.10 0.00 0.00 0.00 0.00 36.38 32.58 1uk2 s VAL 157 CO 0.05 0.20 0.38 -0.44 0.00 0.00 0.00 175.10 175.29 1uk2 s SER 158 N 1.22 5.96 -0.12 3.32 0.01 0.22 -1.24 113.70 123.06 1uk2 s SER 158 Ca 0.20 -1.59 -0.28 0.00 1.31 0.00 0.00 55.95 55.59 1uk2 s SER 158 Cb -0.15 -2.11 -0.02 0.00 0.21 0.00 0.00 66.02 63.95 1uk2 s SER 158 CO 0.09 -0.68 0.92 -0.36 0.41 0.00 0.00 173.24 173.61 1uk2 s PHE 159 N 1.53 3.49 0.00 2.43 0.08 -0.08 -0.70 117.98 124.73 1uk2 s PHE 159 Ca 0.04 1.45 0.00 0.00 0.12 0.00 0.00 56.93 58.54 1uk2 s PHE 159 Cb -0.26 -3.09 0.00 0.00 -0.57 0.00 0.00 43.02 39.10 1uk2 s PHE 159 CO 0.03 -0.20 0.09 0.00 -0.10 0.00 0.00 175.22 175.04 1uk2 s TYR 161 N -0.60 -0.41 -0.08 0.00 5.04 -1.04 -4.42 117.35 115.84 1uk2 s TYR 161 Ca 0.00 0.53 -0.04 0.00 -2.44 0.00 0.00 57.07 55.12 1uk2 s TYR 161 Cb 0.00 0.30 0.04 0.00 0.35 0.00 0.00 41.96 42.65 1uk2 s TYR 161 CO 0.00 -0.59 0.19 1.41 -1.34 0.00 0.00 175.55 175.22 1uk2 s MET 162 N -2.04 0.14 0.35 4.97 -2.45 -0.37 -0.57 119.30 119.33 1uk2 s MET 162 Ca -0.08 0.44 -0.27 0.00 -1.25 0.00 0.00 55.69 54.53 1uk2 s MET 162 Cb -0.01 -0.16 -0.09 0.00 1.25 0.00 0.00 34.83 35.82 1uk2 s MET 162 CO 0.01 -0.17 1.16 -1.58 1.05 0.00 0.00 175.02 175.49 1uk2 s HIS 163 N 1.23 3.26 0.10 4.11 2.46 -0.57 -1.16 115.29 124.73 1uk2 s HIS 163 Ca -0.09 1.59 0.00 0.00 0.47 0.00 0.00 55.06 57.03 1uk2 s HIS 163 Cb -0.11 -3.38 0.00 0.00 -0.13 0.00 0.00 32.58 28.96 1uk2 s HIS 163 CO -0.07 -1.07 0.00 0.72 -2.47 0.00 0.00 174.74 171.85 1uk2 n HIS 164 N 0.57 -0.64 -4.38 3.88 8.25 -0.86 -2.43 115.22 119.61 1uk2 n HIS 164 Ca 0.02 0.11 -0.24 0.00 -0.26 0.00 0.00 57.72 57.35 1uk2 n HIS 164 Cb 0.45 0.26 -0.11 0.00 1.12 0.00 0.00 29.99 31.71 1uk2 n HIS 164 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1uk2 s MET 165 N -2.00 1.41 -0.18 -0.41 -1.94 -0.42 -4.92 119.30 110.84 1uk2 s MET 165 Ca 0.00 -1.50 -0.03 0.00 -1.71 0.00 0.00 55.69 52.44 1uk2 s MET 165 Cb 0.00 -1.54 -0.02 0.00 2.01 0.00 0.00 34.83 35.28 1uk2 s MET 165 CO 0.00 0.32 -0.04 -2.00 -0.01 0.00 0.00 175.02 173.28 1uk2 s GLU 166 N -2.89 3.55 0.67 2.03 2.12 -1.26 -2.33 118.70 120.59 1uk2 s GLU 166 Ca 0.19 -0.57 -0.03 0.00 0.36 0.00 0.00 54.97 54.93 1uk2 s GLU 166 Cb -0.06 -2.93 0.08 0.00 0.26 0.00 0.00 34.13 31.48 1uk2 s GLU 166 CO 0.09 0.08 0.95 -0.51 -0.54 0.00 0.00 175.26 175.33 1uk2 s LEU 167 N 0.77 3.01 0.10 2.70 1.02 0.24 -4.98 118.68 121.54 1uk2 s LEU 167 Ca -0.02 0.05 -0.29 0.00 0.02 0.00 0.00 54.13 53.89 1uk2 s LEU 167 Cb -0.15 -2.65 -0.11 0.00 0.02 0.00 0.00 46.19 43.30 1uk2 s LEU 167 CO 0.02 -1.59 1.47 1.55 0.02 0.00 0.00 176.35 177.82 1uk2 h PRO 168 N -0.41 -0.49 0.00 1.29 0.13 -1.85 -1.15 132.00 129.51 1uk2 h PRO 168 Ca -0.41 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1uk2 h PRO 168 Cb 1.29 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.53 1uk2 h PRO 168 CO 0.50 -0.33 0.29 2.41 -0.23 0.00 0.00 178.00 180.64 1uk2 n THR 169 N -5.00 0.80 -0.41 1.56 -1.04 -1.26 -4.72 114.28 104.21 1uk2 n THR 169 Ca -0.05 0.63 0.00 0.00 -2.04 0.00 0.00 64.05 62.59 1uk2 n THR 169 Cb 0.33 -1.63 0.00 0.00 -1.82 0.00 0.00 70.33 67.20 1uk2 n THR 169 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1uk2 n GLY 170 N -1.27 0.71 3.94 3.41 0.00 -0.43 -5.06 105.19 106.48 1uk2 n GLY 170 Ca -0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1uk2 n GLY 170 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uk2 s VAL 171 N -2.74 2.59 0.18 1.61 0.11 -1.26 -4.75 120.40 116.14 1uk2 s VAL 171 Ca 0.00 -0.34 0.07 0.00 -2.93 0.00 0.00 61.98 58.78 1uk2 s VAL 171 Cb 0.00 -3.07 -0.04 0.00 -1.53 0.00 0.00 36.38 31.74 1uk2 s VAL 171 CO 0.00 -0.07 0.05 -1.00 -3.33 0.00 0.00 175.10 170.75 1uk2 s HIS 172 N -3.08 2.95 0.02 1.54 0.09 -0.16 -0.59 115.29 116.05 1uk2 s HIS 172 Ca 0.58 -0.10 0.01 0.00 -0.00 0.00 0.00 55.06 55.55 1uk2 s HIS 172 Cb -0.11 -1.42 -0.02 0.00 -0.00 0.00 0.00 32.58 31.04 1uk2 s HIS 172 CO 0.43 0.52 -0.04 0.00 -0.00 0.00 0.00 174.74 175.65 1uk2 s ALA 173 N -1.76 0.27 0.00 -1.40 0.00 -0.98 -1.31 121.76 116.57 1uk2 s ALA 173 Ca 0.29 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.72 1uk2 s ALA 173 Cb -0.09 0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.10 1uk2 s ALA 173 CO 0.20 -0.07 0.00 0.41 0.00 0.00 0.00 175.76 176.30 1uk2 n GLY 174 N 1.89 2.34 3.54 0.00 0.00 -1.26 -1.30 105.19 110.39 1uk2 n GLY 174 Ca -0.21 -0.89 -0.26 0.00 0.00 0.00 0.00 46.02 44.66 1uk2 n GLY 174 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uk2 s THR 175 N -2.94 0.89 0.42 2.61 -4.23 -0.31 -1.86 115.64 110.22 1uk2 s THR 175 Ca 0.00 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.46 1uk2 s THR 175 Cb 0.00 -2.46 0.09 0.00 1.34 0.00 0.00 72.50 71.47 1uk2 s THR 175 CO 0.00 0.00 0.58 -0.90 -0.54 0.00 0.00 174.62 173.76 1uk2 n ASP 176 N -1.12 0.23 -0.60 3.99 5.68 -0.63 -1.23 116.55 122.87 1uk2 n ASP 176 Ca -0.07 -1.32 0.03 0.00 -0.50 0.00 0.00 54.79 52.92 1uk2 n ASP 176 Cb 0.66 -0.43 0.10 0.00 -1.14 0.00 0.00 41.12 40.32 1uk2 n ASP 176 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1uk2 n LEU 177 N 0.00 1.63 -0.34 -2.12 7.99 -1.26 -2.00 117.00 120.90 1uk2 n LEU 177 Ca 0.08 -0.82 0.04 0.00 -0.01 0.00 0.00 56.01 55.29 1uk2 n LEU 177 Cb 0.27 -0.31 0.06 0.00 -0.11 0.00 0.00 43.42 43.34 1uk2 n LEU 177 CO 0.20 0.31 0.47 -0.62 -1.51 0.00 0.00 177.39 176.24 1uk2 n GLU 178 N 0.15 1.36 -0.55 3.23 1.02 -1.26 -4.99 120.64 119.60 1uk2 n GLU 178 Ca 0.07 -1.36 0.00 0.00 -0.02 0.00 0.00 57.16 55.86 1uk2 n GLU 178 Cb 0.32 -1.15 0.00 0.00 -0.02 0.00 0.00 31.44 30.59 1uk2 n GLU 178 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1uk2 n GLY 179 N 0.28 0.92 3.70 0.62 0.00 -0.85 -4.41 105.19 105.46 1uk2 n GLY 179 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1uk2 n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uk2 s LYS 180 N -0.39 4.43 0.66 1.61 1.02 -1.26 -1.65 119.74 124.16 1uk2 s LYS 180 Ca 0.00 1.04 -0.17 0.00 0.02 0.00 0.00 55.97 56.85 1uk2 s LYS 180 Cb 0.00 -3.48 -0.00 0.00 -0.52 0.00 0.00 37.83 33.82 1uk2 s LYS 180 CO 0.00 -0.07 1.23 -0.06 -0.92 0.00 0.00 175.35 175.54 1uk2 s PHE 181 N 1.21 2.17 -0.13 3.18 0.40 -1.26 -1.60 117.98 121.95 1uk2 s PHE 181 Ca 0.41 1.53 -0.17 0.00 -0.60 0.00 0.00 56.93 58.10 1uk2 s PHE 181 Cb -0.18 -3.55 -0.04 0.00 0.51 0.00 0.00 43.02 39.76 1uk2 s PHE 181 CO 0.19 -2.58 0.43 0.71 0.70 0.00 0.00 175.22 174.67 1uk2 s TYR 182 N -1.67 3.51 0.00 0.36 2.02 -0.78 -4.86 117.35 115.93 1uk2 s TYR 182 Ca 0.78 0.82 0.00 0.00 -0.37 0.00 0.00 57.07 58.30 1uk2 s TYR 182 Cb -0.32 -2.49 0.00 0.00 -0.40 0.00 0.00 41.96 38.75 1uk2 s TYR 182 CO 0.40 0.20 0.00 0.41 -1.57 0.00 0.00 175.55 174.98 1uk2 n GLY 183 N 3.25 -0.69 2.37 0.71 0.00 -1.26 -4.57 105.19 105.01 1uk2 n GLY 183 Ca -0.08 -1.71 -0.35 0.00 0.00 0.00 0.00 46.02 43.88 1uk2 n GLY 183 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1uk2 n PRO 184 N -0.76 3.75 -4.47 1.61 -0.04 -1.26 -4.91 135.00 128.92 1uk2 n PRO 184 Ca 0.00 -2.63 -0.23 0.00 -0.04 0.00 0.00 63.50 60.60 1uk2 n PRO 184 Cb 0.00 -2.56 -0.10 0.00 -0.04 0.00 0.00 33.50 30.79 1uk2 n PRO 184 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1uk2 s PHE 185 N 0.15 2.14 0.08 0.54 0.08 -1.26 -4.99 117.98 114.72 1uk2 s PHE 185 Ca 0.62 -0.57 0.00 0.00 0.12 0.00 0.00 56.93 57.10 1uk2 s PHE 185 Cb 0.22 -1.17 -0.04 0.00 -0.57 0.00 0.00 43.02 41.47 1uk2 s PHE 185 CO -0.09 0.45 -0.04 0.14 -0.10 0.00 0.00 175.22 175.59 1uk2 s VAL 186 N -2.80 0.42 -1.34 -0.44 -7.23 -1.26 -4.83 120.40 102.92 1uk2 s VAL 186 Ca 0.30 -1.87 -0.12 0.00 -1.81 0.00 0.00 61.98 58.48 1uk2 s VAL 186 Cb 0.02 -1.65 0.12 0.00 0.56 0.00 0.00 36.38 35.43 1uk2 s VAL 186 CO 0.13 -0.89 1.98 -0.90 -0.31 0.00 0.00 175.10 175.11 1uk2 n ASP 187 N 0.02 4.64 -3.64 4.85 5.75 -1.26 -4.84 116.55 122.06 1uk2 n ASP 187 Ca -0.12 -3.00 -0.13 0.00 -0.01 0.00 0.00 54.79 51.53 1uk2 n ASP 187 Cb 0.61 -1.56 -0.06 0.00 -1.03 0.00 0.00 41.12 39.08 1uk2 n ASP 187 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1uk2 s ARG 188 N 1.62 0.94 -0.45 0.11 0.52 -1.26 -4.85 118.95 115.58 1uk2 s ARG 188 Ca 0.43 -0.33 -0.24 0.00 -0.52 0.00 0.00 55.73 55.07 1uk2 s ARG 188 Cb 0.10 0.42 0.03 0.00 0.52 0.00 0.00 34.95 36.02 1uk2 s ARG 188 CO -0.03 -0.33 0.82 -0.65 0.02 0.00 0.00 175.30 175.14 1uk2 s GLN 189 N -2.46 3.46 0.28 3.54 -1.52 -0.93 -4.99 119.66 117.05 1uk2 s GLN 189 Ca -0.05 -0.01 -0.05 0.00 -1.95 0.00 0.00 55.36 53.30 1uk2 s GLN 189 Cb -0.01 -3.93 -0.01 0.00 -0.22 0.00 0.00 33.01 28.85 1uk2 s GLN 189 CO -0.02 -1.13 0.40 0.95 -0.25 0.00 0.00 175.29 175.24 1uk2 s THR 190 N 3.40 0.00 0.03 -0.19 -4.23 -1.26 -4.76 115.64 108.63 1uk2 s THR 190 Ca 0.32 -1.63 -0.21 0.00 -1.18 0.00 0.00 61.69 58.99 1uk2 s THR 190 Cb -0.12 -2.46 -0.12 0.00 1.34 0.00 0.00 72.50 71.14 1uk2 s THR 190 CO 0.23 0.00 1.24 0.00 -0.54 0.00 0.00 174.62 175.55 1uk2 h ALA 191 N 2.26 -1.13 -2.29 3.99 0.00 -2.03 -3.48 119.26 116.58 1uk2 h ALA 191 Ca -0.29 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1uk2 h ALA 191 Cb 1.24 0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1uk2 h ALA 191 CO 0.40 -1.08 0.00 0.00 0.00 0.00 0.00 179.25 178.58 1uk2 n GLN 192 N -4.14 -0.12 -4.34 0.00 10.64 -1.26 -4.76 117.38 113.40 1uk2 n GLN 192 Ca -0.09 0.12 -0.31 0.00 -1.83 0.00 0.00 57.00 54.89 1uk2 n GLN 192 Cb 0.30 -0.29 -0.10 0.00 -0.86 0.00 0.00 30.24 29.28 1uk2 n GLN 192 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1uk2 s ALA 193 N 0.00 2.96 0.70 2.61 0.00 -1.26 -4.73 121.76 122.04 1uk2 s ALA 193 Ca 0.00 -1.16 -0.09 0.00 0.00 0.00 0.00 51.96 50.71 1uk2 s ALA 193 Cb 0.00 -0.97 0.04 0.00 0.00 0.00 0.00 23.12 22.19 1uk2 s ALA 193 CO 0.00 0.63 1.05 0.00 0.00 0.00 0.00 175.76 177.44 1uk2 s ALA 194 N -1.12 3.00 1.01 0.00 0.00 -1.26 -5.05 121.76 118.33 1uk2 s ALA 194 Ca 0.20 -0.62 -0.14 0.00 0.00 0.00 0.00 51.96 51.39 1uk2 s ALA 194 Cb -0.11 -2.82 0.19 0.00 0.00 0.00 0.00 23.12 20.39 1uk2 s ALA 194 CO 0.11 -1.21 1.13 0.20 0.00 0.00 0.00 175.76 175.98 1uk2 s GLY 195 N -4.43 1.58 0.24 0.00 0.00 -1.26 -4.93 107.32 98.52 1uk2 s GLY 195 Ca 0.58 -0.59 -0.31 0.00 0.00 0.00 0.00 44.72 44.41 1uk2 s GLY 195 CO 0.48 0.07 1.30 -1.30 0.00 0.00 0.00 173.10 173.65 1uk2 n THR 196 N -4.13 1.16 0.00 0.90 -2.24 -1.26 -4.83 114.28 103.88 1uk2 n THR 196 Ca 0.08 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 1uk2 n THR 196 Cb 0.59 -1.31 0.00 0.00 -2.10 0.00 0.00 70.33 67.51 1uk2 n THR 196 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1uk2 n ASP 197 N 1.88 0.00 -0.09 3.42 4.64 -1.26 -4.57 116.55 120.56 1uk2 n ASP 197 Ca 0.11 0.46 0.00 0.00 -1.38 0.00 0.00 54.79 53.98 1uk2 n ASP 197 Cb 0.31 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.39 1uk2 n ASP 197 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 1uk2 n THR 198 N -0.67 -0.28 -3.26 5.18 -2.24 -1.26 -4.35 114.28 107.40 1uk2 n THR 198 Ca 0.00 0.09 -0.38 0.00 -2.27 0.00 0.00 64.05 61.49 1uk2 n THR 198 Cb 0.00 -0.14 -0.06 0.00 -2.10 0.00 0.00 70.33 68.03 1uk2 n THR 198 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1uk2 s THR 199 N -3.87 4.72 -1.04 4.28 2.01 -0.62 -4.69 115.64 116.43 1uk2 s THR 199 Ca 0.00 1.20 -0.22 0.00 0.31 0.00 0.00 61.69 62.99 1uk2 s THR 199 Cb 0.00 -3.89 0.07 0.00 0.01 0.00 0.00 72.50 68.69 1uk2 s THR 199 CO 0.00 0.50 1.43 -0.63 -0.69 0.00 0.00 174.62 175.23 1uk2 s ILE 200 N -1.17 4.10 0.28 1.82 1.01 -1.26 -1.87 121.20 124.11 1uk2 s ILE 200 Ca 0.31 -1.07 0.02 0.00 0.00 0.00 0.00 60.65 59.91 1uk2 s ILE 200 Cb -0.19 -5.03 0.28 0.00 0.01 0.00 0.00 42.46 37.53 1uk2 s ILE 200 CO 0.19 -1.87 1.68 0.74 0.00 0.00 0.00 174.94 175.69 1uk2 h THR 201 N 6.46 0.45 -0.65 2.92 2.02 -1.93 -1.58 112.91 120.59 1uk2 h THR 201 Ca 0.22 -0.12 0.03 0.00 0.77 0.00 0.00 66.41 67.31 1uk2 h THR 201 Cb 0.99 0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 67.45 1uk2 h THR 201 CO 1.38 0.06 0.41 0.25 0.37 0.00 0.00 175.52 177.98 1uk2 h LEU 202 N 0.34 0.67 -0.46 2.58 5.85 -1.90 -0.14 115.31 122.25 1uk2 h LEU 202 Ca 0.53 -0.00 -0.17 0.00 0.84 0.00 0.00 57.88 59.08 1uk2 h LEU 202 Cb 1.00 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.88 1uk2 h LEU 202 CO -0.55 0.46 -0.64 0.78 -0.34 0.00 0.00 178.44 178.16 1uk2 h ASN 203 N 0.80 0.56 -0.53 1.25 2.35 -1.55 -0.48 115.58 117.98 1uk2 h ASN 203 Ca 0.26 -0.33 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1uk2 h ASN 203 Cb 0.01 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.19 1uk2 h ASN 203 CO -0.10 1.05 0.34 0.58 -1.65 0.00 0.00 177.43 177.65 1uk2 h VAL 204 N 0.35 1.15 -0.70 2.81 2.07 -0.79 0.31 116.25 121.46 1uk2 h VAL 204 Ca -0.01 -0.30 -0.05 0.00 0.82 0.00 0.00 66.70 67.16 1uk2 h VAL 204 Cb 1.20 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1uk2 h VAL 204 CO 0.11 0.15 0.25 -0.07 0.02 0.00 0.00 177.57 178.03 1uk2 h LEU 205 N 0.71 0.99 -1.38 2.57 3.38 -0.95 -0.06 115.31 120.57 1uk2 h LEU 205 Ca 0.19 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1uk2 h LEU 205 Cb -0.05 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 1uk2 h LEU 205 CO -0.04 0.91 -0.11 0.00 0.09 0.00 0.00 178.44 179.29 1uk2 h ALA 206 N 1.12 1.49 -0.33 1.53 0.00 -0.26 -1.55 119.26 121.25 1uk2 h ALA 206 Ca 0.23 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1uk2 h ALA 206 Cb 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1uk2 h ALA 206 CO -0.01 0.36 -0.33 2.35 0.00 0.00 0.00 179.25 181.61 1uk2 h TRP 207 N 0.26 0.98 -0.76 0.00 7.01 0.77 -2.41 115.95 121.79 1uk2 h TRP 207 Ca 0.05 -0.29 0.04 0.00 2.11 0.00 0.00 58.89 60.79 1uk2 h TRP 207 Cb 0.37 -0.20 -0.05 0.00 -2.10 0.00 0.00 29.16 27.17 1uk2 h TRP 207 CO 0.01 1.08 0.48 -0.07 -2.79 0.00 0.00 178.44 177.14 1uk2 h LEU 208 N 0.59 0.78 -0.94 0.65 3.38 -0.61 0.25 115.31 119.41 1uk2 h LEU 208 Ca 0.05 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1uk2 h LEU 208 Cb 0.92 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.45 1uk2 h LEU 208 CO 0.08 0.53 0.61 1.88 0.09 0.00 0.00 178.44 181.64 1uk2 h TYR 209 N 0.92 1.16 -0.29 1.13 0.05 -1.08 -0.06 116.97 118.80 1uk2 h TYR 209 Ca 0.31 0.03 -0.12 0.00 0.05 0.00 0.00 58.73 59.00 1uk2 h TYR 209 Cb 0.04 -0.39 -0.01 0.00 1.01 0.00 0.00 36.73 37.38 1uk2 h TYR 209 CO -0.04 0.69 -0.30 0.00 -1.05 0.00 0.00 178.16 177.46 1uk2 h ALA 210 N 1.37 0.93 -0.24 3.88 0.00 -0.92 0.12 119.26 124.41 1uk2 h ALA 210 Ca 0.36 -0.39 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1uk2 h ALA 210 Cb -0.05 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1uk2 h ALA 210 CO -0.10 0.62 0.11 0.00 0.00 0.00 0.00 179.25 179.87 1uk2 h ALA 211 N 1.15 0.28 -0.88 0.00 0.00 -0.01 -1.68 119.26 118.11 1uk2 h ALA 211 Ca 0.06 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1uk2 h ALA 211 Cb 0.78 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 1uk2 h ALA 211 CO 0.06 -0.30 0.53 0.28 0.00 0.00 0.00 179.25 179.82 1uk2 h VAL 212 N 0.23 1.25 -0.64 0.00 2.07 -0.60 -0.81 116.25 117.76 1uk2 h VAL 212 Ca 0.10 -0.54 0.01 0.00 0.82 0.00 0.00 66.70 67.09 1uk2 h VAL 212 Cb 0.04 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 29.78 1uk2 h VAL 212 CO -0.08 0.26 0.42 0.40 0.02 0.00 0.00 177.57 178.59 1uk2 h ILE 213 N 1.22 1.15 -0.35 4.57 2.04 -0.23 -2.12 117.51 123.78 1uk2 h ILE 213 Ca 0.32 -0.29 -0.07 0.00 1.00 0.00 0.00 64.86 65.82 1uk2 h ILE 213 Cb -0.04 0.23 -0.04 0.00 -0.74 0.00 0.00 36.82 36.22 1uk2 h ILE 213 CO -0.06 0.15 0.09 0.59 0.00 0.00 0.00 178.15 178.93 1uk2 n ASN 214 N -4.44 3.39 0.00 1.72 3.02 -0.68 -4.91 115.26 113.36 1uk2 n ASN 214 Ca 0.07 -2.56 0.00 0.00 -0.03 0.00 0.00 54.58 52.05 1uk2 n ASN 214 Cb 0.06 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 38.61 1uk2 n ASN 214 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uk2 n GLY 215 N 0.14 0.54 3.23 7.41 0.00 -0.80 -4.88 105.19 110.83 1uk2 n GLY 215 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1uk2 n GLY 215 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1uk2 s ASP 216 N -2.17 5.83 -0.01 1.61 2.15 -0.36 -4.88 116.67 118.84 1uk2 s ASP 216 Ca 0.00 -2.05 0.02 0.00 0.43 0.00 0.00 52.55 50.95 1uk2 s ASP 216 Cb 0.00 -2.04 0.03 0.00 -0.30 0.00 0.00 42.92 40.60 1uk2 s ASP 216 CO 0.00 -0.68 0.90 -2.11 -0.17 0.00 0.00 175.17 173.11 1uk2 n ARG 217 N 4.75 0.22 0.31 4.34 1.85 -1.26 -3.01 116.66 123.85 1uk2 n ARG 217 Ca -0.05 -1.04 0.18 0.00 -1.00 0.00 0.00 57.85 55.93 1uk2 n ARG 217 Cb 0.41 -0.61 1.02 0.00 -1.05 0.00 0.00 32.46 32.23 1uk2 n ARG 217 CO 0.00 0.00 0.00 0.11 -0.01 0.00 0.00 177.63 177.73 1uk2 h TRP 218 N 0.00 0.00 0.00 2.89 5.08 -1.96 -2.16 115.95 119.80 1uk2 h TRP 218 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1uk2 h TRP 218 Cb 1.24 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.40 1uk2 h TRP 218 CO 0.06 0.00 0.00 1.97 -1.28 0.00 0.00 178.44 179.19 1uk2 n PHE 219 N -3.59 0.10 -2.09 0.12 1.16 -1.26 -4.83 117.46 107.07 1uk2 n PHE 219 Ca -0.03 0.03 -0.41 0.00 -1.87 0.00 0.00 57.45 55.18 1uk2 n PHE 219 Cb 0.08 -0.55 -0.02 0.00 -1.61 0.00 0.00 39.48 37.38 1uk2 n PHE 219 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1uk2 s LEU 220 N -3.17 4.42 -0.09 5.98 1.43 -0.81 -4.77 118.68 121.66 1uk2 s LEU 220 Ca 0.11 2.69 0.04 0.00 -1.03 0.00 0.00 54.13 55.94 1uk2 s LEU 220 Cb 0.15 -3.65 -0.00 0.00 0.03 0.00 0.00 46.19 42.72 1uk2 s LEU 220 CO 0.43 -0.58 -0.23 0.54 0.23 0.00 0.00 176.35 176.75 1uk2 s ASN 221 N -0.32 3.19 0.00 2.29 4.22 -1.26 -5.01 114.94 118.05 1uk2 s ASN 221 Ca 0.51 -0.52 0.00 0.00 -2.14 0.00 0.00 52.86 50.71 1uk2 s ASN 221 Cb -0.40 -1.28 0.00 0.00 1.28 0.00 0.00 41.25 40.85 1uk2 s ASN 221 CO 0.52 0.19 0.39 -1.14 -2.04 0.00 0.00 177.10 175.01 1uk2 n ARG 222 N 3.35 0.76 -3.59 3.55 0.00 -1.26 -4.54 116.66 114.94 1uk2 n ARG 222 Ca -0.18 0.00 -0.38 0.00 -0.00 0.00 0.00 57.85 57.28 1uk2 n ARG 222 Cb 0.53 -1.37 -0.06 0.00 0.00 0.00 0.00 32.46 31.56 1uk2 n ARG 222 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 1uk2 s PHE 223 N -0.97 3.85 0.71 -0.14 2.99 -1.26 -5.11 117.98 118.04 1uk2 s PHE 223 Ca 0.00 -2.84 -0.10 0.00 0.00 0.00 0.00 56.93 53.98 1uk2 s PHE 223 Cb 0.00 -3.36 0.16 0.00 0.00 0.00 0.00 43.02 39.82 1uk2 s PHE 223 CO 0.00 -0.81 0.36 -2.37 -0.00 0.00 0.00 175.22 172.41 1uk2 n THR 224 N 2.72 0.00 -3.64 0.64 5.66 -1.26 -4.91 114.28 113.49 1uk2 n THR 224 Ca 0.19 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 61.09 1uk2 n THR 224 Cb 0.38 -0.41 -0.03 0.00 -1.55 0.00 0.00 70.33 68.72 1uk2 n THR 224 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1uk2 s THR 225 N -1.51 0.01 0.24 1.09 -1.32 -1.26 -4.93 115.64 107.96 1uk2 s THR 225 Ca 0.28 -0.53 -0.08 0.00 -1.21 0.00 0.00 61.69 60.15 1uk2 s THR 225 Cb -0.05 -1.45 -0.06 0.00 -1.51 0.00 0.00 72.50 69.43 1uk2 s THR 225 CO 0.23 -0.05 0.54 -0.89 -2.21 0.00 0.00 174.62 172.24 1uk2 s THR 226 N -3.84 4.98 0.17 5.08 2.01 -1.26 -4.89 115.64 117.90 1uk2 s THR 226 Ca 0.06 0.30 -0.14 0.00 0.31 0.00 0.00 61.69 62.22 1uk2 s THR 226 Cb -0.02 -3.66 0.05 0.00 0.01 0.00 0.00 72.50 68.89 1uk2 s THR 226 CO -0.05 -0.15 1.82 0.25 -0.69 0.00 0.00 174.62 175.81 1uk2 h LEU 227 N 2.27 0.59 -0.03 4.42 6.46 -1.98 -0.11 115.31 126.92 1uk2 h LEU 227 Ca -0.47 -0.03 0.04 0.00 -0.12 0.00 0.00 57.88 57.30 1uk2 h LEU 227 Cb 1.18 -0.15 -0.05 0.00 -0.73 0.00 0.00 40.66 40.91 1uk2 h LEU 227 CO 0.68 0.45 -0.26 -1.13 -0.62 0.00 0.00 178.44 177.56 1uk2 h ASN 228 N 0.69 -0.77 0.53 1.25 -1.24 -1.96 0.11 115.58 114.19 1uk2 h ASN 228 Ca 0.19 0.11 -0.10 0.00 0.71 0.00 0.00 56.30 57.21 1uk2 h ASN 228 Cb -0.06 0.32 -0.01 0.00 0.73 0.00 0.00 38.32 39.30 1uk2 h ASN 228 CO -0.04 -0.32 -0.45 0.44 -1.29 0.00 0.00 177.43 175.77 1uk2 h ASP 229 N -0.38 0.00 -0.35 1.15 5.19 -1.90 -2.27 116.42 117.86 1uk2 h ASP 229 Ca 0.07 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.43 1uk2 h ASP 229 Cb 0.48 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.98 1uk2 h ASP 229 CO -0.25 0.45 0.00 0.15 -3.12 0.00 0.00 179.24 176.48 1uk2 h PHE 230 N 0.00 0.68 0.00 4.55 3.57 -0.25 -2.76 116.94 122.73 1uk2 h PHE 230 Ca -0.00 -0.12 -0.04 0.00 3.53 0.00 0.00 57.97 61.34 1uk2 h PHE 230 Cb 0.84 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 1uk2 h PHE 230 CO 0.00 0.73 -0.18 -0.91 -2.23 0.00 0.00 178.31 175.71 1uk2 h ASN 231 N 0.44 0.00 0.15 0.41 2.35 -0.52 0.83 115.58 119.23 1uk2 h ASN 231 Ca 0.10 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.66 1uk2 h ASN 231 Cb 0.45 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.82 1uk2 h ASN 231 CO 0.02 0.18 -0.73 -0.07 -1.65 0.00 0.00 177.43 175.18 1uk2 h LEU 232 N 0.00 0.60 -0.25 1.61 3.38 -1.25 -1.21 115.31 118.19 1uk2 h LEU 232 Ca -0.00 -0.39 -0.19 0.00 0.09 0.00 0.00 57.88 57.39 1uk2 h LEU 232 Cb 0.33 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1uk2 h LEU 232 CO 0.02 1.14 -0.59 0.58 0.09 0.00 0.00 178.44 179.68 1uk2 h VAL 233 N 0.35 1.28 -1.00 1.22 2.07 -1.09 -2.57 116.25 116.50 1uk2 h VAL 233 Ca -0.03 -1.78 0.05 0.00 0.82 0.00 0.00 66.70 65.76 1uk2 h VAL 233 Cb 1.31 1.74 -0.06 0.00 -1.52 0.00 0.00 31.29 32.77 1uk2 h VAL 233 CO 0.13 0.57 0.65 0.00 0.02 0.00 0.00 177.57 178.95 1uk2 h ALA 234 N 0.64 1.36 -0.19 1.67 0.00 -0.81 -2.13 119.26 119.81 1uk2 h ALA 234 Ca -0.00 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1uk2 h ALA 234 Cb 1.21 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1uk2 h ALA 234 CO 0.13 0.49 -0.39 0.52 0.00 0.00 0.00 179.25 180.00 1uk2 h MET 235 N 1.22 0.42 -0.82 0.00 2.86 -1.02 0.13 114.93 117.73 1uk2 h MET 235 Ca 0.42 -0.20 0.08 0.00 -2.06 0.00 0.00 59.70 57.93 1uk2 h MET 235 Cb 0.09 -0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.68 1uk2 h MET 235 CO -0.15 0.75 0.48 -0.22 1.06 0.00 0.00 176.91 178.83 1uk2 h LYS 236 N 0.35 0.82 -0.76 1.72 3.64 -1.00 -1.53 116.57 119.81 1uk2 h LYS 236 Ca 0.03 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1uk2 h LYS 236 Cb 0.85 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 1uk2 h LYS 236 CO 0.07 0.54 0.00 0.66 -2.27 0.00 0.00 179.45 178.45 1uk2 n TYR 237 N -4.70 0.94 -2.20 1.91 4.02 -0.94 -4.91 117.16 111.29 1uk2 n TYR 237 Ca 0.12 -0.33 -0.17 0.00 -0.01 0.00 0.00 57.90 57.51 1uk2 n TYR 237 Cb 0.23 -0.27 -0.02 0.00 -0.02 0.00 0.00 39.34 39.26 1uk2 n TYR 237 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1uk2 n ASN 238 N 0.32 -5.07 -4.88 7.72 5.15 -0.58 -4.92 115.26 112.99 1uk2 n ASN 238 Ca 0.13 0.05 -0.35 0.00 -0.60 0.00 0.00 54.58 53.81 1uk2 n ASN 238 Cb 0.66 -4.15 -0.05 0.00 -0.53 0.00 0.00 39.78 35.71 1uk2 n ASN 238 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 1uk2 s TYR 239 N -2.83 3.59 0.51 1.20 1.51 0.42 -1.59 117.35 120.17 1uk2 s TYR 239 Ca 0.00 0.54 -0.22 0.00 -1.01 0.00 0.00 57.07 56.38 1uk2 s TYR 239 Cb 0.00 -1.96 -0.06 0.00 -0.11 0.00 0.00 41.96 39.83 1uk2 s TYR 239 CO 0.00 0.67 1.31 -1.21 -1.11 0.00 0.00 175.55 175.21 1uk2 s GLU 240 N -1.49 3.35 0.31 -0.62 0.41 -0.78 -3.77 118.70 116.10 1uk2 s GLU 240 Ca 0.23 2.13 -0.29 0.00 -0.41 0.00 0.00 54.97 56.62 1uk2 s GLU 240 Cb -0.13 -2.33 -0.10 0.00 -1.78 0.00 0.00 34.13 29.79 1uk2 s GLU 240 CO 0.12 -0.99 1.25 -1.25 -0.49 0.00 0.00 175.26 173.90 1uk2 s PRO 241 N -2.81 4.44 -0.40 0.39 0.04 -1.26 -4.55 135.00 130.85 1uk2 s PRO 241 Ca 0.69 2.09 -0.24 0.00 0.04 0.00 0.00 61.00 63.58 1uk2 s PRO 241 Cb -0.38 -3.11 0.02 0.00 0.04 0.00 0.00 34.50 31.07 1uk2 s PRO 241 CO 0.45 -0.08 0.82 -1.17 0.04 0.00 0.00 177.00 177.06 1uk2 s LEU 242 N -1.60 4.13 0.57 -3.56 2.96 -1.26 -5.00 118.68 114.91 1uk2 s LEU 242 Ca 0.48 0.24 -0.10 0.00 -0.22 0.00 0.00 54.13 54.52 1uk2 s LEU 242 Cb -0.37 -3.06 -0.05 0.00 0.50 0.00 0.00 46.19 43.21 1uk2 s LEU 242 CO 0.49 -0.83 0.96 0.42 -1.32 0.00 0.00 176.35 176.07 1uk2 s THR 243 N 3.27 4.73 0.39 3.68 -4.23 -1.26 -4.91 115.64 117.31 1uk2 s THR 243 Ca 0.32 0.77 0.11 0.00 -1.18 0.00 0.00 61.69 61.72 1uk2 s THR 243 Cb -0.12 -3.84 0.33 0.00 1.34 0.00 0.00 72.50 70.20 1uk2 s THR 243 CO 0.20 -1.00 1.93 -0.61 -0.54 0.00 0.00 174.62 174.60 1uk2 h GLN 244 N 0.03 0.55 -0.28 3.99 5.75 -2.00 0.11 115.11 123.26 1uk2 h GLN 244 Ca -0.45 -0.03 0.06 0.00 -0.15 0.00 0.00 58.65 58.08 1uk2 h GLN 244 Cb 1.19 -0.12 -0.06 0.00 1.07 0.00 0.00 27.48 29.56 1uk2 h GLN 244 CO 0.62 0.36 -0.13 0.22 -2.65 0.00 0.00 178.83 177.26 1uk2 h ASP 245 N 0.57 -0.43 -0.77 -0.69 3.58 -2.00 -1.74 116.42 114.94 1uk2 h ASP 245 Ca 0.35 0.11 -0.04 0.00 0.42 0.00 0.00 57.03 57.87 1uk2 h ASP 245 Cb 0.61 0.24 -0.04 0.00 1.72 0.00 0.00 39.33 41.86 1uk2 h ASP 245 CO -0.13 -0.16 0.33 0.45 -2.88 0.00 0.00 179.24 176.86 1uk2 h HIS 246 N -0.08 1.15 -0.79 0.28 3.86 -1.36 -1.99 115.15 116.22 1uk2 h HIS 246 Ca 0.15 -0.07 0.02 0.00 -1.16 0.00 0.00 60.37 59.31 1uk2 h HIS 246 Cb 0.30 -0.35 -0.05 0.00 1.06 0.00 0.00 27.41 28.38 1uk2 h HIS 246 CO -0.32 0.86 0.51 0.28 0.86 0.00 0.00 177.93 180.11 1uk2 h VAL 247 N 1.12 1.14 -0.60 2.45 2.07 -0.92 -2.24 116.25 119.27 1uk2 h VAL 247 Ca 0.26 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 1uk2 h VAL 247 Cb 0.18 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 29.97 1uk2 h VAL 247 CO -0.03 0.18 0.36 0.44 0.02 0.00 0.00 177.57 178.55 1uk2 h ASP 248 N 1.00 0.73 -0.17 0.57 3.45 -0.64 -2.30 116.42 119.06 1uk2 h ASP 248 Ca 0.31 -0.06 0.03 0.00 0.43 0.00 0.00 57.03 57.74 1uk2 h ASP 248 Cb -0.03 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.55 1uk2 h ASP 248 CO -0.10 0.58 0.12 0.40 -1.57 0.00 0.00 179.24 178.66 1uk2 h ILE 249 N 0.82 0.96 0.00 0.35 2.04 -0.82 -0.15 117.51 120.71 1uk2 h ILE 249 Ca 0.22 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 66.05 1uk2 h ILE 249 Cb -0.02 0.87 0.00 0.00 -0.74 0.00 0.00 36.82 36.93 1uk2 h ILE 249 CO -0.04 0.02 0.00 0.18 0.00 0.00 0.00 178.15 178.31 1uk2 n LEU 250 N -4.50 0.00 -0.09 1.44 4.77 -0.87 -4.20 117.00 113.54 1uk2 n LEU 250 Ca 0.00 0.23 -0.06 0.00 -0.03 0.00 0.00 56.01 56.15 1uk2 n LEU 250 Cb 0.19 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 1uk2 n LEU 250 CO 0.35 -0.02 0.74 1.23 -1.33 0.00 0.00 177.39 178.36 1uk2 h GLY 251 N 4.63 0.07 1.13 -0.72 0.00 -0.96 -0.64 103.07 106.59 1uk2 h GLY 251 Ca 0.00 0.22 0.02 0.00 0.00 0.00 0.00 47.33 47.57 1uk2 h GLY 251 CO 0.00 -0.18 0.56 -2.55 0.00 0.00 0.00 176.54 174.37 1uk2 h PRO 252 N -0.13 1.08 -0.25 4.80 0.11 -1.80 0.32 132.00 136.15 1uk2 h PRO 252 Ca 0.17 -0.06 -0.14 0.00 0.11 0.00 0.00 66.00 66.08 1uk2 h PRO 252 Cb 0.39 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.25 1uk2 h PRO 252 CO -0.42 0.71 -0.43 -0.07 -0.21 0.00 0.00 178.00 177.59 1uk2 h LEU 253 N 1.11 0.65 -0.18 2.35 3.38 -1.69 -0.93 115.31 119.99 1uk2 h LEU 253 Ca 0.32 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1uk2 h LEU 253 Cb -0.08 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1uk2 h LEU 253 CO -0.08 0.99 0.11 -1.28 0.09 0.00 0.00 178.44 178.28 1uk2 h SER 254 N 0.49 0.22 -0.17 -0.43 0.87 -0.38 -2.09 113.55 112.06 1uk2 h SER 254 Ca 0.04 -0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.50 1uk2 h SER 254 Cb 0.95 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.84 1uk2 h SER 254 CO 0.09 0.19 -0.06 0.00 -0.53 0.00 0.00 176.83 176.51 1uk2 h ALA 255 N 1.04 1.33 -0.01 6.23 0.00 -0.72 -0.46 119.26 126.66 1uk2 h ALA 255 Ca 0.07 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 1uk2 h ALA 255 Cb 0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1uk2 h ALA 255 CO -0.01 0.45 -0.72 0.37 0.00 0.00 0.00 179.25 179.34 1uk2 h GLN 256 N 0.46 0.08 0.00 0.00 -0.00 -0.84 -3.29 115.11 111.52 1uk2 h GLN 256 Ca 0.09 -0.07 0.00 0.00 -0.00 0.00 0.00 58.65 58.67 1uk2 h GLN 256 Cb 0.40 0.02 0.00 0.00 0.00 0.00 0.00 27.48 27.89 1uk2 h GLN 256 CO 0.02 0.77 -1.54 0.25 0.00 0.00 0.00 178.83 178.32 1uk2 n THR 257 N -3.72 0.00 -1.06 2.39 -2.24 -0.82 -4.98 114.28 103.86 1uk2 n THR 257 Ca -0.02 -0.29 -0.02 0.00 -2.27 0.00 0.00 64.05 61.45 1uk2 n THR 257 Cb 0.70 0.42 -0.01 0.00 -2.10 0.00 0.00 70.33 69.34 1uk2 n THR 257 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uk2 n GLY 258 N 1.39 0.55 3.29 3.38 0.00 -0.19 -5.00 105.19 108.60 1uk2 n GLY 258 Ca -0.01 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.26 1uk2 n GLY 258 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uk2 s ILE 259 N -1.96 3.69 0.52 -0.61 1.01 -1.15 -5.05 121.20 117.66 1uk2 s ILE 259 Ca 0.00 -0.95 -0.21 0.00 0.00 0.00 0.00 60.65 59.49 1uk2 s ILE 259 Cb 0.00 -2.98 -0.07 0.00 0.01 0.00 0.00 42.46 39.42 1uk2 s ILE 259 CO 0.00 -0.01 1.05 0.00 0.00 0.00 0.00 174.94 175.98 1uk2 n ALA 260 N 4.80 0.46 -0.32 9.38 0.00 -1.26 -4.46 120.51 129.11 1uk2 n ALA 260 Ca -0.14 0.11 0.01 0.00 0.00 0.00 0.00 53.44 53.42 1uk2 n ALA 260 Cb 0.46 -2.14 0.14 0.00 0.00 0.00 0.00 19.45 17.91 1uk2 n ALA 260 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1uk2 h VAL 261 N 1.08 1.06 0.00 0.00 2.07 -1.94 -1.21 116.25 117.31 1uk2 h VAL 261 Ca -0.47 -0.34 -0.05 0.00 0.82 0.00 0.00 66.70 66.65 1uk2 h VAL 261 Cb 1.34 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1uk2 h VAL 261 CO 0.54 0.18 -0.23 -0.07 0.02 0.00 0.00 177.57 178.01 1uk2 h LEU 262 N 1.00 0.00 -0.45 2.57 3.38 -1.91 0.16 115.31 120.06 1uk2 h LEU 262 Ca 0.38 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 58.18 1uk2 h LEU 262 Cb 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1uk2 h LEU 262 CO -0.17 0.23 -0.48 0.44 0.09 0.00 0.00 178.44 178.56 1uk2 h ASP 263 N 0.00 0.82 0.07 -0.43 3.32 -1.59 0.01 116.42 118.63 1uk2 h ASP 263 Ca -0.00 -0.41 -0.10 0.00 0.02 0.00 0.00 57.03 56.54 1uk2 h ASP 263 Cb 0.45 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 1uk2 h ASP 263 CO 0.03 1.16 -0.30 -0.03 -1.72 0.00 0.00 179.24 178.38 1uk2 h MET 264 N 0.60 0.36 -0.73 3.56 4.05 -0.63 -1.16 114.93 120.97 1uk2 h MET 264 Ca 0.03 -0.14 -0.06 0.00 -0.28 0.00 0.00 59.70 59.25 1uk2 h MET 264 Cb 1.05 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.80 1uk2 h MET 264 CO 0.10 0.63 0.24 0.00 0.23 0.00 0.00 176.91 178.11 1uk2 h ALA 266 N 1.12 1.08 -0.31 0.00 0.00 -0.40 -0.74 119.26 120.00 1uk2 h ALA 266 Ca 0.24 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 1uk2 h ALA 266 Cb 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1uk2 h ALA 266 CO -0.01 0.60 -0.09 0.00 0.00 0.00 0.00 179.25 179.75 1uk2 h ALA 267 N 1.35 0.43 0.35 0.00 0.00 -0.59 -2.10 119.26 118.69 1uk2 h ALA 267 Ca 0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 1uk2 h ALA 267 Cb 0.84 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1uk2 h ALA 267 CO 0.07 0.28 -0.17 1.25 0.00 0.00 0.00 179.25 180.68 1uk2 h LEU 268 N 0.38 -0.39 -0.78 0.00 6.46 -0.98 -1.36 115.31 118.63 1uk2 h LEU 268 Ca 0.08 -0.02 0.17 0.00 -0.12 0.00 0.00 57.88 57.98 1uk2 h LEU 268 Cb 0.59 0.10 -0.15 0.00 -0.73 0.00 0.00 40.66 40.48 1uk2 h LEU 268 CO 0.03 -0.24 -0.13 0.50 -0.62 0.00 0.00 178.44 177.98 1uk2 h LYS 269 N -0.51 0.02 -0.65 1.25 3.64 -1.13 0.11 116.57 119.31 1uk2 h LYS 269 Ca -0.05 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.26 1uk2 h LYS 269 Cb 0.39 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 1uk2 h LYS 269 CO 0.08 0.02 0.12 1.49 -2.27 0.00 0.00 179.45 178.88 1uk2 h GLU 270 N 0.03 1.04 -0.12 1.90 4.81 -1.16 -2.57 114.58 118.51 1uk2 h GLU 270 Ca 0.40 -0.26 -0.07 0.00 -0.13 0.00 0.00 59.36 59.29 1uk2 h GLU 270 Cb 0.65 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 1uk2 h GLU 270 CO -0.77 0.95 -0.26 -0.07 -0.73 0.00 0.00 179.01 178.12 1uk2 h LEU 271 N 0.98 0.21 -0.08 1.64 3.38 0.27 0.31 115.31 122.03 1uk2 h LEU 271 Ca 0.20 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 1uk2 h LEU 271 Cb 0.40 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1uk2 h LEU 271 CO 0.01 0.47 -0.15 -0.07 0.09 0.00 0.00 178.44 178.79 1uk2 h LEU 272 N 0.19 0.27 -0.59 1.67 3.38 -0.66 -0.71 115.31 118.86 1uk2 h LEU 272 Ca 0.03 -0.56 -0.12 0.00 0.09 0.00 0.00 57.88 57.33 1uk2 h LEU 272 Cb 0.57 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1uk2 h LEU 272 CO 0.04 0.78 -0.13 1.56 0.09 0.00 0.00 178.44 180.78 1uk2 h GLN 273 N -0.22 0.99 0.00 1.13 4.20 -1.36 -3.34 115.11 116.50 1uk2 h GLN 273 Ca 0.00 -0.37 -0.02 0.00 0.06 0.00 0.00 58.65 58.32 1uk2 h GLN 273 Cb 0.73 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.44 1uk2 h GLN 273 CO 0.03 1.05 -1.96 0.09 -0.67 0.00 0.00 178.83 177.37 1uk2 n ASN 274 N -4.14 0.33 0.00 1.46 5.03 0.09 -5.11 115.26 112.93 1uk2 n ASN 274 Ca 0.01 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.46 1uk2 n ASN 274 Cb 0.41 1.87 0.00 0.00 -1.02 0.00 0.00 39.78 41.04 1uk2 n ASN 274 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1uk2 n GLY 275 N 1.38 -1.24 0.10 7.41 0.00 -0.27 -4.62 105.19 107.95 1uk2 n GLY 275 Ca -0.06 -1.61 0.03 0.00 0.00 0.00 0.00 46.02 44.39 1uk2 n GLY 275 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1uk2 h MET 276 N 0.00 0.00 -6.33 1.61 2.86 -1.92 -3.45 114.93 107.71 1uk2 h MET 276 Ca 0.00 0.00 -0.38 0.00 -2.06 0.00 0.00 59.70 57.26 1uk2 h MET 276 Cb 0.00 0.00 0.03 0.00 0.06 0.00 0.00 31.60 31.69 1uk2 h MET 276 CO 0.00 0.23 -0.81 0.09 1.06 0.00 0.00 176.91 177.48 1uk2 n ASN 277 N -2.87 -5.54 0.00 1.22 5.03 -1.26 -2.85 115.26 108.99 1uk2 n ASN 277 Ca -0.06 -0.84 0.00 0.00 0.87 0.00 0.00 54.58 54.55 1uk2 n ASN 277 Cb 0.76 -2.95 0.00 0.00 -1.02 0.00 0.00 39.78 36.57 1uk2 n ASN 277 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1uk2 n GLY 278 N -1.73 2.03 3.54 7.41 0.00 -1.26 -5.00 105.19 110.17 1uk2 n GLY 278 Ca -0.16 -0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 1uk2 n GLY 278 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uk2 n ARG 279 N 0.00 -1.41 -4.22 1.61 1.74 -1.13 -5.01 116.66 108.24 1uk2 n ARG 279 Ca 0.00 -0.36 -0.27 0.00 -0.77 0.00 0.00 57.85 56.44 1uk2 n ARG 279 Cb 0.00 -2.20 -0.08 0.00 -1.02 0.00 0.00 32.46 29.15 1uk2 n ARG 279 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1uk2 s THR 280 N -2.49 3.57 -0.17 0.55 2.01 -1.26 -4.67 115.64 113.17 1uk2 s THR 280 Ca 0.66 -1.41 -0.05 0.00 0.31 0.00 0.00 61.69 61.20 1uk2 s THR 280 Cb -0.23 -2.76 0.06 0.00 0.01 0.00 0.00 72.50 69.58 1uk2 s THR 280 CO 0.62 -0.05 0.09 -0.63 -0.69 0.00 0.00 174.62 173.96 1uk2 s ILE 281 N -1.59 -0.06 -1.46 1.82 1.01 0.01 -4.77 121.20 116.16 1uk2 s ILE 281 Ca 0.26 -0.18 -0.10 0.00 0.00 0.00 0.00 60.65 60.62 1uk2 s ILE 281 Cb -0.10 -0.59 0.06 0.00 0.01 0.00 0.00 42.46 41.84 1uk2 s ILE 281 CO 0.17 -0.28 0.98 0.18 0.00 0.00 0.00 174.94 175.99 1uk2 n LEU 282 N 5.27 -2.85 0.00 2.97 4.77 -1.26 -1.10 117.00 124.81 1uk2 n LEU 282 Ca -0.07 -0.73 0.00 0.00 -0.03 0.00 0.00 56.01 55.18 1uk2 n LEU 282 Cb 0.49 -2.69 0.00 0.00 -2.33 0.00 0.00 43.42 38.89 1uk2 n LEU 282 CO 0.10 0.50 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 1uk2 n GLY 283 N -1.72 2.47 3.88 -0.72 0.00 -1.26 -4.19 105.19 103.65 1uk2 n GLY 283 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 1uk2 n GLY 283 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uk2 s SER 284 N -1.69 6.57 0.00 1.61 0.15 -0.25 -4.94 113.70 115.15 1uk2 s SER 284 Ca 0.00 0.93 0.24 0.00 0.70 0.00 0.00 55.95 57.81 1uk2 s SER 284 Cb 0.00 -2.23 0.31 0.00 -1.71 0.00 0.00 66.02 62.39 1uk2 s SER 284 CO 0.00 -0.17 1.33 0.35 1.20 0.00 0.00 173.24 175.95 1uk2 n THR 285 N -0.55 0.18 -4.10 6.45 -2.24 -1.26 -0.81 114.28 111.95 1uk2 n THR 285 Ca 0.00 -0.57 -0.14 0.00 -2.27 0.00 0.00 64.05 61.07 1uk2 n THR 285 Cb 0.53 1.27 -0.12 0.00 -2.10 0.00 0.00 70.33 69.91 1uk2 n THR 285 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1uk2 s ILE 286 N -1.82 0.54 0.19 2.28 -1.09 -1.26 -4.95 121.20 115.09 1uk2 s ILE 286 Ca 0.32 -0.88 -0.30 0.00 -2.23 0.00 0.00 60.65 57.56 1uk2 s ILE 286 Cb 0.21 -0.57 -0.08 0.00 -1.58 0.00 0.00 42.46 40.44 1uk2 s ILE 286 CO 0.31 -0.25 1.09 -0.76 -1.23 0.00 0.00 174.94 174.10 1uk2 s LEU 287 N -1.22 4.51 -0.18 2.97 1.43 -1.26 -4.96 118.68 119.97 1uk2 s LEU 287 Ca -0.07 2.10 -0.19 0.00 -1.03 0.00 0.00 54.13 54.95 1uk2 s LEU 287 Cb -0.08 -3.61 -0.03 0.00 0.03 0.00 0.00 46.19 42.50 1uk2 s LEU 287 CO 0.00 -0.18 0.52 -0.70 0.23 0.00 0.00 176.35 176.22 1uk2 s GLU 288 N -0.56 4.23 -0.08 1.70 2.56 -1.26 -4.98 118.70 120.31 1uk2 s GLU 288 Ca 0.48 0.44 0.12 0.00 0.00 0.00 0.00 54.97 56.01 1uk2 s GLU 288 Cb -0.29 -3.53 0.28 0.00 2.00 0.00 0.00 34.13 32.58 1uk2 s GLU 288 CO 0.35 -0.08 1.20 -0.40 -0.56 0.00 0.00 175.26 175.78 1uk2 n ASP 289 N 4.51 2.75 -2.09 -1.70 3.85 -1.26 -3.81 116.55 118.80 1uk2 n ASP 289 Ca -0.05 -2.57 -0.26 0.00 -0.71 0.00 0.00 54.79 51.20 1uk2 n ASP 289 Cb 0.51 -0.31 0.03 0.00 -1.35 0.00 0.00 41.12 40.00 1uk2 n ASP 289 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1uk2 n GLU 290 N -0.57 3.48 -3.73 0.11 1.02 -1.26 -4.64 120.64 115.05 1uk2 n GLU 290 Ca 0.12 -4.06 -0.26 0.00 -0.02 0.00 0.00 57.16 52.94 1uk2 n GLU 290 Cb 0.56 -2.28 -0.17 0.00 -0.02 0.00 0.00 31.44 29.53 1uk2 n GLU 290 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1uk2 s PHE 291 N -3.63 0.85 0.68 -0.32 5.36 -1.26 -4.80 117.98 114.86 1uk2 s PHE 291 Ca 0.53 -0.63 -0.08 0.00 -0.96 0.00 0.00 56.93 55.79 1uk2 s PHE 291 Cb 0.42 -0.94 0.04 0.00 -0.34 0.00 0.00 43.02 42.21 1uk2 s PHE 291 CO 0.02 -0.53 1.01 0.95 -1.46 0.00 0.00 175.22 175.21 1uk2 s THR 292 N 1.92 2.81 0.17 0.12 -4.23 -1.26 -4.44 115.64 110.72 1uk2 s THR 292 Ca 0.01 -0.06 -0.15 0.00 -1.18 0.00 0.00 61.69 60.32 1uk2 s THR 292 Cb -0.16 -3.20 0.05 0.00 1.34 0.00 0.00 72.50 70.54 1uk2 s THR 292 CO -0.07 -0.22 1.77 -0.65 -0.54 0.00 0.00 174.62 174.91 1uk2 h PRO 293 N -0.54 0.39 -0.62 3.99 0.11 -1.91 -0.74 132.00 132.68 1uk2 h PRO 293 Ca -0.45 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1uk2 h PRO 293 Cb 1.29 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 1uk2 h PRO 293 CO 0.62 0.26 0.38 0.35 -0.21 0.00 0.00 178.00 179.39 1uk2 h PHE 294 N 0.40 0.81 0.00 0.65 3.57 -1.94 -0.18 116.94 120.26 1uk2 h PHE 294 Ca 0.19 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 1uk2 h PHE 294 Cb 0.13 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 38.60 1uk2 h PHE 294 CO -0.12 0.55 -0.05 -0.44 -2.23 0.00 0.00 178.31 176.02 1uk2 h ASP 295 N 0.84 0.00 -0.19 0.41 3.32 -1.68 0.12 116.42 119.24 1uk2 h ASP 295 Ca 0.22 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 57.08 1uk2 h ASP 295 Cb -0.03 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.52 1uk2 h ASP 295 CO -0.04 0.05 -0.62 0.58 -1.72 0.00 0.00 179.24 177.49 1uk2 h VAL 296 N 0.00 1.30 0.23 -1.35 2.07 0.37 -1.65 116.25 117.21 1uk2 h VAL 296 Ca -0.00 -1.84 -0.01 0.00 0.82 0.00 0.00 66.70 65.67 1uk2 h VAL 296 Cb 0.12 1.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1uk2 h VAL 296 CO 0.01 0.58 -0.11 0.58 0.02 0.00 0.00 177.57 178.65 1uk2 h VAL 297 N 0.47 0.83 -0.29 2.57 2.07 -0.57 -2.97 116.25 118.36 1uk2 h VAL 297 Ca -0.02 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 1uk2 h VAL 297 Cb 1.25 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 1uk2 h VAL 297 CO 0.13 0.08 0.12 -0.09 0.02 0.00 0.00 177.57 177.83 1uk2 h ARG 298 N -0.48 0.40 -2.11 1.57 2.43 -0.84 -2.77 114.38 112.59 1uk2 h ARG 298 Ca -0.03 -0.04 -0.78 0.00 -0.81 0.00 0.00 59.98 58.31 1uk2 h ARG 298 Cb 0.36 -0.08 -0.27 0.00 -0.42 0.00 0.00 29.97 29.56 1uk2 h ARG 298 CO 0.05 0.33 1.06 1.04 -1.51 0.00 0.00 179.97 180.95 1uk2 n GLN 299 N -4.42 3.85 0.00 0.20 6.02 -0.62 -3.70 117.38 118.70 1uk2 n GLN 299 Ca 0.01 -3.96 0.00 0.00 -0.01 0.00 0.00 57.00 53.04 1uk2 n GLN 299 Cb 0.13 -2.35 0.00 0.00 1.02 0.00 0.00 30.24 29.04 1uk2 n GLN 299 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1uk2 n SER 301 N 0.00 -0.82 0.00 0.00 7.64 -1.16 -4.95 113.62 114.33 1uk2 n SER 301 Ca 0.00 -2.10 0.02 0.00 1.01 0.00 0.00 58.87 57.81 1uk2 n SER 301 Cb 0.00 0.35 0.13 0.00 -1.01 0.00 0.00 64.21 63.68 1uk2 n SER 301 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64