#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xik s TYR 2 N 0.00 3.76 -0.00 0.00 5.04 -1.26 -4.98 117.35 119.90 1xik s TYR 2 Ca 0.00 1.21 0.03 0.00 -2.44 0.00 0.00 57.07 55.87 1xik s TYR 2 Cb 0.00 -2.51 -0.01 0.00 0.35 0.00 0.00 41.96 39.79 1xik s TYR 2 CO 0.00 0.51 -0.09 -0.08 -1.34 0.00 0.00 175.55 174.56 1xik s THR 3 N -0.79 0.67 -1.01 4.34 -1.32 -1.26 -5.01 115.64 111.26 1xik s THR 3 Ca 0.29 -0.41 0.22 0.00 -1.21 0.00 0.00 61.69 60.58 1xik s THR 3 Cb -0.19 -0.57 0.19 0.00 -1.51 0.00 0.00 72.50 70.42 1xik s THR 3 CO 0.18 0.15 1.70 0.35 -2.21 0.00 0.00 174.62 174.79 1xik n THR 4 N 2.78 0.50 -3.07 5.08 -2.24 -1.26 -4.35 114.28 111.71 1xik n THR 4 Ca -0.14 0.12 -0.03 0.00 -2.27 0.00 0.00 64.05 61.74 1xik n THR 4 Cb 0.57 -0.75 -0.01 0.00 -2.10 0.00 0.00 70.33 68.04 1xik n THR 4 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1xik s PHE 5 N -2.99 -1.54 0.10 4.78 2.19 -1.26 -4.87 117.98 114.39 1xik s PHE 5 Ca 0.11 -0.16 -0.31 0.00 0.33 0.00 0.00 56.93 56.89 1xik s PHE 5 Cb 0.14 0.24 -0.11 0.00 -1.31 0.00 0.00 43.02 41.99 1xik s PHE 5 CO 0.40 -1.19 1.85 -1.13 1.83 0.00 0.00 175.22 176.97 1xik n SER 6 N 3.86 3.97 -0.00 6.13 3.41 -1.26 -4.89 113.62 124.84 1xik n SER 6 Ca 0.14 0.98 0.14 0.00 -0.26 0.00 0.00 58.87 59.87 1xik n SER 6 Cb 0.56 -1.53 0.70 0.00 -0.26 0.00 0.00 64.21 63.68 1xik n SER 6 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xik n GLN 7 N 5.81 0.26 -2.69 4.33 1.13 -1.26 -4.76 117.38 120.20 1xik n GLN 7 Ca 0.19 -0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.83 1xik n GLN 7 Cb 0.37 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 29.18 1xik n GLN 7 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1xik s THR 8 N -2.74 4.49 -0.12 5.09 2.01 -1.26 -4.99 115.64 118.11 1xik s THR 8 Ca 0.23 2.00 -0.29 0.00 0.31 0.00 0.00 61.69 63.93 1xik s THR 8 Cb 0.20 -4.28 -0.01 0.00 0.01 0.00 0.00 72.50 68.42 1xik s THR 8 CO 0.49 0.28 1.12 -0.75 -0.69 0.00 0.00 174.62 175.07 1xik s LYS 9 N 0.19 4.33 0.12 4.92 2.20 -1.26 -4.99 119.74 125.25 1xik s LYS 9 Ca 0.49 1.52 0.04 0.00 -0.36 0.00 0.00 55.97 57.65 1xik s LYS 9 Cb -0.24 -3.61 -0.04 0.00 -1.51 0.00 0.00 37.83 32.44 1xik s LYS 9 CO 0.30 -0.49 -0.09 0.54 -0.36 0.00 0.00 175.35 175.25 1xik s ASN 10 N 1.39 1.54 -0.53 1.43 4.22 -1.26 -5.10 114.94 116.64 1xik s ASN 10 Ca 0.51 -0.96 -0.21 0.00 -2.14 0.00 0.00 52.86 50.06 1xik s ASN 10 Cb -0.20 0.02 0.05 0.00 1.28 0.00 0.00 41.25 42.40 1xik s ASN 10 CO 0.16 -0.34 0.76 -0.62 -2.04 0.00 0.00 177.10 175.02 1xik s ASP 11 N -2.94 6.27 0.49 3.54 -1.08 -1.26 -4.90 116.67 116.79 1xik s ASP 11 Ca 0.12 -0.69 0.33 0.00 -0.52 0.00 0.00 52.55 51.79 1xik s ASP 11 Cb 0.02 -2.35 1.55 0.00 -1.46 0.00 0.00 42.92 40.67 1xik s ASP 11 CO -0.01 -1.04 1.98 1.56 0.52 0.00 0.00 175.17 178.18 1xik h GLN 12 N 9.14 0.00 0.00 4.34 4.20 -1.97 -1.89 115.11 128.92 1xik h GLN 12 Ca -0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.44 1xik h GLN 12 Cb 1.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1xik h GLN 12 CO 1.02 0.00 0.00 -0.07 -0.67 0.00 0.00 178.83 179.11 1xik h LEU 13 N 0.00 0.00 -2.95 1.46 3.38 -1.95 -3.24 115.31 112.01 1xik h LEU 13 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xik h LEU 13 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1xik h LEU 13 CO 0.00 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.82 1xik n LYS 14 N -2.38 2.88 -2.33 1.13 5.02 -0.71 -4.76 118.16 117.00 1xik n LYS 14 Ca 0.04 -1.91 -0.31 0.00 -2.02 0.00 0.00 58.31 54.11 1xik n LYS 14 Cb 0.37 -1.21 -0.01 0.00 -0.02 0.00 0.00 35.03 34.16 1xik n LYS 14 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1xik s GLU 15 N -1.14 3.73 0.94 1.97 0.41 -1.23 -5.05 118.70 118.33 1xik s GLU 15 Ca 0.16 0.67 -0.12 0.00 -0.41 0.00 0.00 54.97 55.27 1xik s GLU 15 Cb 0.09 -2.20 0.15 0.00 -1.78 0.00 0.00 34.13 30.39 1xik s GLU 15 CO 0.10 -0.32 1.10 -1.25 -0.49 0.00 0.00 175.26 174.40 1xik s PRO 16 N -4.53 0.92 0.22 0.39 0.04 -1.26 -4.90 135.00 125.88 1xik s PRO 16 Ca 0.54 0.52 -0.06 0.00 0.04 0.00 0.00 61.00 62.04 1xik s PRO 16 Cb -0.10 -1.79 0.20 0.00 0.04 0.00 0.00 34.50 32.84 1xik s PRO 16 CO 0.42 -2.40 1.77 0.52 0.04 0.00 0.00 177.00 177.35 1xik h MET 17 N -1.65 1.11 -5.42 4.56 2.86 -1.93 -3.38 114.93 111.09 1xik h MET 17 Ca -0.52 -0.22 -0.41 0.00 -2.06 0.00 0.00 59.70 56.48 1xik h MET 17 Cb 1.32 -0.17 -0.16 0.00 0.06 0.00 0.00 31.60 32.64 1xik h MET 17 CO 0.58 0.93 -0.74 -0.06 1.06 0.00 0.00 176.91 178.68 1xik s PHE 18 N -5.41 1.48 0.00 -0.22 0.08 -1.26 -0.62 117.98 112.03 1xik s PHE 18 Ca -0.12 -0.60 0.00 0.00 0.12 0.00 0.00 56.93 56.33 1xik s PHE 18 Cb 0.15 -0.74 0.00 0.00 -0.57 0.00 0.00 43.02 41.86 1xik s PHE 18 CO 0.83 0.20 0.00 1.19 -0.10 0.00 0.00 175.22 177.34 1xik n PHE 19 N 0.12 0.00 -0.78 0.36 3.72 0.14 -4.82 117.46 116.20 1xik n PHE 19 Ca -0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.28 1xik n PHE 19 Cb 0.59 -1.06 0.00 0.00 -0.94 0.00 0.00 39.48 38.07 1xik n PHE 19 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xik n GLY 20 N -1.16 1.31 3.73 1.37 0.00 -1.26 -5.00 105.19 104.17 1xik n GLY 20 Ca 0.00 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 1xik n GLY 20 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xik s GLN 21 N 2.21 4.43 0.53 1.61 0.74 -1.26 -4.82 119.66 123.09 1xik s GLN 21 Ca 0.00 1.92 -0.20 0.00 0.05 0.00 0.00 55.36 57.13 1xik s GLN 21 Cb 0.00 -3.26 -0.08 0.00 1.10 0.00 0.00 33.01 30.77 1xik s GLN 21 CO 0.00 -0.22 0.85 -2.30 -0.55 0.00 0.00 175.29 173.07 1xik n PRO 22 N 3.09 0.93 -2.33 1.67 -0.02 -1.26 -4.48 135.00 132.60 1xik n PRO 22 Ca 0.07 0.35 -0.41 0.00 -2.02 0.00 0.00 63.50 61.49 1xik n PRO 22 Cb 0.44 -1.98 -0.03 0.00 -0.02 0.00 0.00 33.50 31.91 1xik n PRO 22 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1xik s VAL 23 N -1.49 3.22 0.00 -1.45 1.01 -1.24 -4.56 120.40 115.89 1xik s VAL 23 Ca 0.69 1.20 0.00 0.00 0.00 0.00 0.00 61.98 63.87 1xik s VAL 23 Cb -0.48 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.14 1xik s VAL 23 CO 0.52 0.27 0.00 -0.46 0.00 0.00 0.00 175.10 175.44 1xik n ASN 24 N 1.27 0.00 -4.72 3.32 0.23 -1.26 -4.50 115.26 109.59 1xik n ASN 24 Ca 0.00 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.63 1xik n ASN 24 Cb 0.44 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.10 1xik n ASN 24 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1xik s VAL 25 N 0.00 4.16 -0.57 3.53 1.01 -1.26 -4.95 120.40 122.31 1xik s VAL 25 Ca 0.00 1.61 -0.21 0.00 0.00 0.00 0.00 61.98 63.38 1xik s VAL 25 Cb 0.00 -4.03 0.06 0.00 0.00 0.00 0.00 36.38 32.41 1xik s VAL 25 CO 0.00 0.16 0.81 0.00 0.00 0.00 0.00 175.10 176.07 1xik s ALA 26 N 0.73 3.26 0.06 5.51 0.00 -1.26 -4.83 121.76 125.24 1xik s ALA 26 Ca 0.55 -1.71 0.04 0.00 0.00 0.00 0.00 51.96 50.84 1xik s ALA 26 Cb -0.28 -3.61 -0.03 0.00 0.00 0.00 0.00 23.12 19.21 1xik s ALA 26 CO 0.30 -2.35 -0.12 -0.98 0.00 0.00 0.00 175.76 172.61 1xik s ARG 27 N 3.34 0.76 -0.12 0.00 1.70 -1.26 -5.05 118.95 118.33 1xik s ARG 27 Ca 0.20 -0.85 0.14 0.00 -0.47 0.00 0.00 55.73 54.76 1xik s ARG 27 Cb -0.18 -0.71 0.29 0.00 -0.57 0.00 0.00 34.95 33.79 1xik s ARG 27 CO 0.12 0.16 1.15 0.66 -1.08 0.00 0.00 175.30 176.31 1xik n TYR 28 N 1.49 0.00 0.80 5.89 4.01 -1.26 -4.67 117.16 123.41 1xik n TYR 28 Ca -0.21 -0.92 0.12 0.00 -0.16 0.00 0.00 57.90 56.73 1xik n TYR 28 Cb 0.54 -0.16 0.27 0.00 -0.31 0.00 0.00 39.34 39.68 1xik n TYR 28 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1xik n ASP 29 N -0.96 0.54 -3.59 7.72 5.75 -1.26 -4.90 116.55 119.85 1xik n ASP 29 Ca 0.13 0.04 -0.14 0.00 -0.01 0.00 0.00 54.79 54.82 1xik n ASP 29 Cb 0.71 0.07 -0.05 0.00 -1.03 0.00 0.00 41.12 40.81 1xik n ASP 29 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xik s GLN 30 N -3.08 1.02 -0.03 0.11 -2.07 -1.26 -5.18 119.66 109.17 1xik s GLN 30 Ca 0.09 -0.28 -0.18 0.00 -1.82 0.00 0.00 55.36 53.18 1xik s GLN 30 Cb 0.16 0.46 0.03 0.00 -1.09 0.00 0.00 33.01 32.57 1xik s GLN 30 CO 0.68 -0.37 0.38 1.14 -1.32 0.00 0.00 175.29 175.81 1xik s GLN 31 N -2.52 0.72 0.03 9.60 0.00 -1.26 -4.91 119.66 121.32 1xik s GLN 31 Ca -0.05 -0.04 -0.21 0.00 -0.00 0.00 0.00 55.36 55.06 1xik s GLN 31 Cb -0.01 0.33 -0.16 0.00 0.00 0.00 0.00 33.01 33.17 1xik s GLN 31 CO -0.02 -0.20 1.28 -0.22 0.00 0.00 0.00 175.29 176.13 1xik h LYS 32 N 3.86 0.35 -4.10 9.60 3.64 -1.86 -3.41 116.57 124.65 1xik h LYS 32 Ca -0.29 -0.22 -0.60 0.00 -1.27 0.00 0.00 60.65 58.27 1xik h LYS 32 Cb 1.17 0.02 -0.39 0.00 -0.41 0.00 0.00 32.23 32.62 1xik h LYS 32 CO 0.38 0.81 -0.76 0.71 -2.27 0.00 0.00 179.45 178.32 1xik s TYR 33 N -4.04 2.34 -0.85 1.91 2.02 -1.26 -5.01 117.35 112.46 1xik s TYR 33 Ca -0.14 -1.92 0.12 0.00 -0.37 0.00 0.00 57.07 54.76 1xik s TYR 33 Cb 0.05 -1.84 0.55 0.00 -0.40 0.00 0.00 41.96 40.31 1xik s TYR 33 CO 0.76 -0.83 1.39 -0.40 -1.57 0.00 0.00 175.55 174.90 1xik n ASP 34 N 4.67 0.15 -0.31 2.29 5.68 -1.26 -2.39 116.55 125.39 1xik n ASP 34 Ca -0.05 0.55 0.06 0.00 -0.50 0.00 0.00 54.79 54.85 1xik n ASP 34 Cb 0.43 -0.58 0.27 0.00 -1.14 0.00 0.00 41.12 40.10 1xik n ASP 34 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 1xik h ILE 35 N 0.00 0.98 -0.46 2.12 6.09 -1.99 -0.65 117.51 123.61 1xik h ILE 35 Ca 0.00 -0.33 -0.09 0.00 -1.37 0.00 0.00 64.86 63.08 1xik h ILE 35 Cb 0.17 -0.05 -0.02 0.00 0.47 0.00 0.00 36.82 37.39 1xik h ILE 35 CO 0.00 0.17 -0.07 -0.26 -3.07 0.00 0.00 178.15 174.92 1xik h PHE 36 N 0.95 0.87 -0.34 2.19 0.04 -1.82 0.22 116.94 119.04 1xik h PHE 36 Ca 0.43 -0.15 -0.13 0.00 2.80 0.00 0.00 57.97 60.92 1xik h PHE 36 Cb 0.38 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.30 1xik h PHE 36 CO -0.00 0.84 -0.31 1.49 -0.60 0.00 0.00 178.31 179.72 1xik h GLU 37 N 0.73 0.81 -0.80 1.51 4.57 -1.58 -1.06 114.58 118.75 1xik h GLU 37 Ca 0.13 -0.42 0.03 0.00 -1.18 0.00 0.00 59.36 57.92 1xik h GLU 37 Cb 0.55 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.10 1xik h GLU 37 CO 0.03 1.05 0.51 0.87 -1.18 0.00 0.00 179.01 180.30 1xik h LYS 38 N 0.59 0.98 -0.60 1.92 6.56 -0.61 0.14 116.57 125.55 1xik h LYS 38 Ca 0.06 -0.06 -0.07 0.00 -1.06 0.00 0.00 60.65 59.52 1xik h LYS 38 Cb 0.89 -0.22 -0.03 0.00 -0.57 0.00 0.00 32.23 32.31 1xik h LYS 38 CO 0.08 0.65 0.09 -0.07 -2.06 0.00 0.00 179.45 178.14 1xik h LEU 39 N 1.01 0.93 -0.26 2.94 3.38 -0.31 -1.07 115.31 121.93 1xik h LEU 39 Ca 0.31 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1xik h LEU 39 Cb -0.01 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1xik h LEU 39 CO -0.10 0.94 0.07 0.40 0.09 0.00 0.00 178.44 179.84 1xik h ILE 40 N 0.92 1.20 -0.74 1.22 2.04 -0.30 -1.33 117.51 120.52 1xik h ILE 40 Ca 0.19 -0.66 -0.03 0.00 1.00 0.00 0.00 64.86 65.36 1xik h ILE 40 Cb 0.41 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.61 1xik h ILE 40 CO 0.01 0.21 0.35 -0.33 0.00 0.00 0.00 178.15 178.40 1xik h GLU 41 N 0.25 1.07 -0.62 2.37 5.08 -0.64 -1.40 114.58 120.69 1xik h GLU 41 Ca 0.08 -0.16 -0.09 0.00 -1.00 0.00 0.00 59.36 58.19 1xik h GLU 41 Cb 0.26 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 1xik h GLU 41 CO -0.00 0.84 0.04 0.87 -1.00 0.00 0.00 179.01 179.76 1xik h LYS 42 N 1.04 1.07 -0.82 2.33 1.79 -1.01 -1.63 116.57 119.34 1xik h LYS 42 Ca 0.25 -0.32 -0.01 0.00 -2.18 0.00 0.00 60.65 58.40 1xik h LYS 42 Cb 0.13 -0.11 -0.04 0.00 -1.58 0.00 0.00 32.23 30.63 1xik h LYS 42 CO -0.03 1.02 0.49 0.37 -1.08 0.00 0.00 179.45 180.22 1xik h GLN 43 N 0.97 1.12 -0.29 3.15 5.75 -1.03 0.18 115.11 124.97 1xik h GLN 43 Ca 0.18 -0.10 -0.08 0.00 -0.15 0.00 0.00 58.65 58.50 1xik h GLN 43 Cb 0.51 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.81 1xik h GLN 43 CO 0.02 0.79 -0.14 -0.07 -2.65 0.00 0.00 178.83 176.78 1xik h LEU 44 N 1.13 0.48 -0.95 -2.39 3.38 -0.98 -1.73 115.31 114.25 1xik h LEU 44 Ca 0.29 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1xik h LEU 44 Cb -0.04 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1xik h LEU 44 CO -0.05 0.65 0.00 0.77 0.09 0.00 0.00 178.44 179.90 1xik h SER 45 N 0.45 0.00 -0.08 -0.43 4.64 -0.25 -2.88 113.55 115.00 1xik h SER 45 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1xik h SER 45 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1xik h SER 45 CO 0.03 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.48 1xik n PHE 46 N -2.84 0.09 -1.59 4.77 3.72 -0.07 -4.97 117.46 116.57 1xik n PHE 46 Ca 0.02 -0.04 -0.55 0.00 -0.05 0.00 0.00 57.45 56.82 1xik n PHE 46 Cb 0.33 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.81 1xik n PHE 46 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1xik n PHE 47 N 0.27 1.36 -4.06 1.38 7.35 -1.09 -4.97 117.46 117.70 1xik n PHE 47 Ca 0.18 0.76 -0.07 0.00 -0.76 0.00 0.00 57.45 57.55 1xik n PHE 47 Cb 0.35 -2.28 -0.10 0.00 0.35 0.00 0.00 39.48 37.81 1xik n PHE 47 CO 0.00 0.00 0.00 1.67 -0.76 0.00 0.00 176.76 177.67 1xik s TRP 48 N 0.84 0.47 -0.31 -5.13 1.48 -1.26 -5.14 118.94 109.89 1xik s TRP 48 Ca 0.89 -0.98 -0.01 0.00 -1.06 0.00 0.00 56.10 54.94 1xik s TRP 48 Cb -1.08 -0.34 0.06 0.00 -1.16 0.00 0.00 33.47 30.95 1xik s TRP 48 CO 0.53 -0.39 0.01 1.03 -4.06 0.00 0.00 176.95 174.08 1xik s ARG 49 N -3.76 2.29 0.19 3.25 0.52 -1.26 -5.02 118.95 115.16 1xik s ARG 49 Ca 0.05 -1.39 -0.22 0.00 -0.52 0.00 0.00 55.73 53.66 1xik s ARG 49 Cb 0.07 -3.18 0.12 0.00 0.52 0.00 0.00 34.95 32.47 1xik s ARG 49 CO -0.10 -0.69 1.57 -1.35 0.02 0.00 0.00 175.30 174.75 1xik h PRO 50 N 7.94 -0.11 0.00 3.54 0.11 -1.96 0.73 132.00 142.25 1xik h PRO 50 Ca -0.19 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.93 1xik h PRO 50 Cb 1.05 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1xik h PRO 50 CO 0.54 -0.08 0.22 0.93 -0.21 0.00 0.00 178.00 179.41 1xik h GLU 51 N -0.12 0.00 0.00 1.05 3.07 -1.95 0.48 114.58 117.11 1xik h GLU 51 Ca 0.25 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.11 1xik h GLU 51 Cb 0.56 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.47 1xik h GLU 51 CO -0.80 0.00 0.00 -1.91 -1.40 0.00 0.00 179.01 174.90 1xik n GLU 52 N -2.70 0.44 -3.96 2.33 2.13 0.26 -4.74 120.64 114.40 1xik n GLU 52 Ca -0.02 0.05 -0.35 0.00 0.66 0.00 0.00 57.16 57.50 1xik n GLU 52 Cb 0.27 -1.50 -0.09 0.00 0.27 0.00 0.00 31.44 30.39 1xik n GLU 52 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1xik s VAL 53 N -2.44 4.92 -0.20 6.31 1.01 0.17 -5.06 120.40 125.10 1xik s VAL 53 Ca 0.26 0.01 -0.29 0.00 0.00 0.00 0.00 61.98 61.96 1xik s VAL 53 Cb 0.16 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.33 1xik s VAL 53 CO 0.35 0.46 1.06 -0.62 0.00 0.00 0.00 175.10 176.35 1xik s ASP 54 N 0.31 7.11 -0.01 3.32 2.15 -1.26 -4.84 116.67 123.45 1xik s ASP 54 Ca 0.04 1.45 0.02 0.00 0.43 0.00 0.00 52.55 54.49 1xik s ASP 54 Cb -0.12 -2.54 0.03 0.00 -0.30 0.00 0.00 42.92 39.99 1xik s ASP 54 CO -0.00 -0.64 0.95 1.33 -0.17 0.00 0.00 175.17 176.64 1xik n VAL 55 N 5.17 0.93 -0.26 1.11 0.24 -1.26 -4.31 118.33 119.95 1xik n VAL 55 Ca 0.12 -0.97 0.14 0.00 -2.04 0.00 0.00 64.34 61.58 1xik n VAL 55 Cb 0.46 0.49 0.41 0.00 -1.47 0.00 0.00 33.84 33.74 1xik n VAL 55 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1xik h SER 56 N 0.00 0.59 0.51 -1.34 4.64 -1.91 -1.65 113.55 114.39 1xik h SER 56 Ca 0.00 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1xik h SER 56 Cb 0.64 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1xik h SER 56 CO 0.00 0.28 -0.17 0.54 -0.87 0.00 0.00 176.83 176.61 1xik n ARG 57 N -4.56 0.43 0.24 4.77 1.74 -1.26 -3.83 116.66 114.18 1xik n ARG 57 Ca 0.18 -0.16 0.11 0.00 -0.77 0.00 0.00 57.85 57.22 1xik n ARG 57 Cb 0.53 -1.50 0.55 0.00 -1.02 0.00 0.00 32.46 31.02 1xik n ARG 57 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1xik h ASP 58 N 0.38 0.00 0.33 0.55 5.19 -1.63 -3.11 116.42 118.13 1xik h ASP 58 Ca 0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 1xik h ASP 58 Cb 0.42 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.93 1xik h ASP 58 CO 0.00 0.19 -0.16 -0.09 -3.12 0.00 0.00 179.24 176.06 1xik h ARG 59 N 0.00 -0.42 -0.21 3.56 2.43 -1.71 -0.31 114.38 117.71 1xik h ARG 59 Ca -0.00 0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 1xik h ARG 59 Cb 0.63 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 1xik h ARG 59 CO 0.02 -0.27 -0.29 -0.84 -1.51 0.00 0.00 179.97 177.09 1xik h ILE 60 N -0.46 1.27 -0.22 1.20 3.07 -1.83 -0.50 117.51 120.04 1xik h ILE 60 Ca -0.04 -1.31 -0.01 0.00 1.55 0.00 0.00 64.86 65.05 1xik h ILE 60 Cb 0.35 1.43 -0.01 0.00 -0.27 0.00 0.00 36.82 38.32 1xik h ILE 60 CO 0.07 0.41 0.12 0.44 -1.05 0.00 0.00 178.15 178.14 1xik h ASP 61 N 0.37 0.28 -0.50 2.16 5.19 -1.45 0.61 116.42 123.09 1xik h ASP 61 Ca 0.05 -0.09 -0.05 0.00 -0.62 0.00 0.00 57.03 56.31 1xik h ASP 61 Cb 0.70 -0.07 -0.03 0.00 0.18 0.00 0.00 39.33 40.11 1xik h ASP 61 CO 0.05 0.29 0.12 0.22 -3.12 0.00 0.00 179.24 176.81 1xik h TYR 62 N 0.25 0.89 -0.35 4.55 3.20 -0.82 -1.27 116.97 123.41 1xik h TYR 62 Ca 0.08 -0.09 -0.12 0.00 3.14 0.00 0.00 58.73 61.74 1xik h TYR 62 Cb 0.08 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.08 1xik h TYR 62 CO -0.03 0.75 -0.27 0.37 -1.64 0.00 0.00 178.16 177.33 1xik h GLN 63 N 0.82 0.72 0.00 1.82 5.75 -0.28 -2.58 115.11 121.36 1xik h GLN 63 Ca 0.18 -0.31 0.00 0.00 -0.15 0.00 0.00 58.65 58.37 1xik h GLN 63 Cb 0.32 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.84 1xik h GLN 63 CO 0.00 0.91 0.00 0.00 -2.65 0.00 0.00 178.83 177.09 1xik h ALA 64 N 1.08 1.00 -2.51 3.38 0.00 0.68 -3.46 119.26 119.43 1xik h ALA 64 Ca 0.08 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.46 1xik h ALA 64 Cb 0.78 0.00 0.15 0.00 0.00 0.00 0.00 17.79 18.72 1xik h ALA 64 CO 0.06 0.00 0.34 -0.51 0.00 0.00 0.00 179.25 179.15 1xik s LEU 65 N -5.76 3.19 0.45 0.00 1.43 -0.52 -4.97 118.68 112.49 1xik s LEU 65 Ca 0.05 2.19 -0.23 0.00 -1.03 0.00 0.00 54.13 55.11 1xik s LEU 65 Cb 0.08 -4.57 -0.08 0.00 0.03 0.00 0.00 46.19 41.65 1xik s LEU 65 CO 0.57 -2.32 1.11 -2.84 0.23 0.00 0.00 176.35 173.11 1xik s PRO 66 N -4.23 3.87 0.45 1.29 0.02 -1.26 -4.75 135.00 130.39 1xik s PRO 66 Ca 0.70 1.64 0.23 0.00 0.02 0.00 0.00 61.00 63.59 1xik s PRO 66 Cb -0.25 -2.40 1.22 0.00 0.02 0.00 0.00 34.50 33.09 1xik s PRO 66 CO 0.49 -0.42 1.83 1.49 -0.33 0.00 0.00 177.00 180.06 1xik h GLU 67 N 2.11 0.27 -0.12 5.54 4.57 -1.96 0.34 114.58 125.33 1xik h GLU 67 Ca -0.49 -0.02 -0.13 0.00 -1.18 0.00 0.00 59.36 57.54 1xik h GLU 67 Cb 1.23 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.75 1xik h GLU 67 CO 0.61 0.18 -0.50 1.12 -1.18 0.00 0.00 179.01 179.24 1xik h HIS 68 N 0.28 0.38 -0.02 0.92 2.07 -1.89 -2.20 115.15 114.68 1xik h HIS 68 Ca 0.51 -0.12 -0.22 0.00 -2.85 0.00 0.00 60.37 57.69 1xik h HIS 68 Cb 1.51 -0.08 0.00 0.00 2.57 0.00 0.00 27.41 31.42 1xik h HIS 68 CO -0.00 0.75 -0.91 0.93 -3.07 0.00 0.00 177.93 175.62 1xik h GLU 69 N 0.25 0.47 -0.37 5.12 5.08 -0.69 -2.12 114.58 122.31 1xik h GLU 69 Ca 0.01 -0.47 -0.02 0.00 -1.00 0.00 0.00 59.36 57.87 1xik h GLU 69 Cb 0.97 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 1xik h GLU 69 CO 0.08 1.12 0.14 0.87 -1.00 0.00 0.00 179.01 180.22 1xik h LYS 70 N 0.27 0.55 -0.59 2.33 1.57 -1.09 -0.67 116.57 118.95 1xik h LYS 70 Ca -0.08 -0.11 0.06 0.00 -1.87 0.00 0.00 60.65 58.66 1xik h LYS 70 Cb 1.54 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 33.71 1xik h LYS 70 CO 0.16 0.55 0.29 1.25 -0.57 0.00 0.00 179.45 181.13 1xik h HIS 71 N 0.45 0.53 -0.26 -1.35 2.76 -1.39 0.13 115.15 116.01 1xik h HIS 71 Ca 0.12 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.29 1xik h HIS 71 Cb 0.20 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.00 1xik h HIS 71 CO 0.00 0.23 0.06 0.82 -1.30 0.00 0.00 177.93 177.74 1xik h ILE 72 N 0.54 1.21 -0.03 6.26 2.04 -1.05 0.14 117.51 126.62 1xik h ILE 72 Ca 0.27 -0.70 -0.00 0.00 1.00 0.00 0.00 64.86 65.43 1xik h ILE 72 Cb 0.22 1.18 -0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1xik h ILE 72 CO -0.21 0.23 0.02 0.15 0.00 0.00 0.00 178.15 178.34 1xik h PHE 73 N 0.24 0.05 -0.48 1.37 3.57 -0.62 -1.70 116.94 119.37 1xik h PHE 73 Ca 0.08 -0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.46 1xik h PHE 73 Cb 0.28 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 1xik h PHE 73 CO 0.01 0.13 -0.16 0.82 -2.23 0.00 0.00 178.31 176.88 1xik h ILE 74 N -0.05 1.27 -0.67 1.41 1.08 -0.75 -0.33 117.51 119.47 1xik h ILE 74 Ca 0.01 -1.30 -0.06 0.00 -0.39 0.00 0.00 64.86 63.13 1xik h ILE 74 Cb 0.10 1.07 -0.03 0.00 -3.07 0.00 0.00 36.82 34.89 1xik h ILE 74 CO -0.00 0.45 0.19 -1.28 -0.69 0.00 0.00 178.15 176.82 1xik h SER 75 N 0.81 0.96 -0.42 1.72 0.87 -0.59 -0.91 113.55 115.99 1xik h SER 75 Ca 0.12 -0.18 -0.07 0.00 -1.23 0.00 0.00 61.79 60.43 1xik h SER 75 Cb 0.71 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 1xik h SER 75 CO 0.05 0.91 -0.02 -1.13 -0.53 0.00 0.00 176.83 176.11 1xik h ASN 76 N 0.99 0.75 -0.44 6.23 -0.00 -0.97 -1.76 115.58 120.38 1xik h ASN 76 Ca 0.22 -0.32 -0.05 0.00 -0.00 0.00 0.00 56.30 56.15 1xik h ASN 76 Cb 0.30 -0.20 -0.02 0.00 -0.00 0.00 0.00 38.32 38.40 1xik h ASN 76 CO -0.01 0.89 0.11 0.25 -0.00 0.00 0.00 177.43 178.68 1xik h LEU 77 N 0.59 0.72 -0.72 0.34 5.85 -0.72 -1.18 115.31 120.19 1xik h LEU 77 Ca 0.12 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 1xik h LEU 77 Cb 0.52 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 1xik h LEU 77 CO 0.03 0.72 0.24 0.11 -0.34 0.00 0.00 178.44 179.19 1xik h LYS 78 N 0.75 1.10 -0.44 1.25 1.57 -0.93 0.97 116.57 120.85 1xik h LYS 78 Ca 0.17 -0.23 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 1xik h LYS 78 Cb 0.29 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1xik h LYS 78 CO -0.00 0.94 -0.14 -0.92 -0.57 0.00 0.00 179.45 178.75 1xik h TYR 79 N 1.05 0.99 -0.23 -1.35 3.20 -0.79 -0.52 116.97 119.32 1xik h TYR 79 Ca 0.23 -0.23 0.01 0.00 3.14 0.00 0.00 58.73 61.88 1xik h TYR 79 Cb 0.28 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 1xik h TYR 79 CO 0.02 0.99 0.14 1.96 -1.64 0.00 0.00 178.16 179.63 1xik h GLN 80 N 0.70 0.28 -0.75 1.82 4.20 -0.81 -0.92 115.11 119.64 1xik h GLN 80 Ca 0.11 -0.02 0.11 0.00 0.06 0.00 0.00 58.65 58.91 1xik h GLN 80 Cb 0.70 -0.06 -0.08 0.00 0.30 0.00 0.00 27.48 28.34 1xik h GLN 80 CO 0.05 0.18 0.37 1.15 -0.67 0.00 0.00 178.83 179.92 1xik h THR 81 N 0.29 0.82 0.07 -0.54 2.02 -0.56 -0.60 112.91 114.40 1xik h THR 81 Ca 0.09 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 67.05 1xik h THR 81 Cb -0.02 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.55 1xik h THR 81 CO -0.03 0.11 -0.03 0.25 0.37 0.00 0.00 175.52 176.18 1xik h LEU 82 N 0.61 -0.08 -0.21 2.58 6.46 -0.53 0.30 115.31 124.44 1xik h LEU 82 Ca 0.38 -0.13 0.03 0.00 -0.12 0.00 0.00 57.88 58.04 1xik h LEU 82 Cb 0.43 0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.35 1xik h LEU 82 CO -0.29 0.08 0.01 -0.07 -0.62 0.00 0.00 178.44 177.54 1xik h LEU 83 N -0.24 -0.07 -1.41 2.25 3.38 -0.74 -1.47 115.31 117.01 1xik h LEU 83 Ca -0.01 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1xik h LEU 83 Cb 0.21 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1xik h LEU 83 CO 0.02 -0.01 -0.23 0.44 0.09 0.00 0.00 178.44 178.75 1xik h ASP 84 N 0.07 0.00 0.09 -0.43 3.32 -1.04 -0.64 116.42 117.79 1xik h ASP 84 Ca 0.10 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 1xik h ASP 84 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1xik h ASP 84 CO -0.16 0.23 -0.04 0.28 -1.72 0.00 0.00 179.24 177.82 1xik h SER 85 N 0.00 -0.10 -0.61 6.45 0.02 -0.17 -0.95 113.55 118.19 1xik h SER 85 Ca -0.00 -0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 60.77 1xik h SER 85 Cb 0.61 0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.14 1xik h SER 85 CO 0.03 0.09 0.29 0.40 -1.14 0.00 0.00 176.83 176.51 1xik h ILE 86 N -0.30 1.21 0.00 3.27 2.04 -1.12 -3.04 117.51 119.58 1xik h ILE 86 Ca -0.01 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.24 1xik h ILE 86 Cb 0.25 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 1xik h ILE 86 CO 0.02 0.25 0.00 0.00 0.00 0.00 0.00 178.15 178.42 1xik n GLN 87 N -4.51 0.21 0.05 2.37 1.13 -0.26 -0.37 117.38 115.99 1xik n GLN 87 Ca 0.04 0.22 -0.14 0.00 -1.94 0.00 0.00 57.00 55.18 1xik n GLN 87 Cb 0.13 -1.77 -0.05 0.00 0.11 0.00 0.00 30.24 28.66 1xik n GLN 87 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1xik h GLY 88 N 4.13 0.57 0.00 1.08 0.00 -1.05 -3.39 103.07 104.41 1xik h GLY 88 Ca 0.00 -0.93 -0.33 0.00 0.00 0.00 0.00 47.33 46.06 1xik h GLY 88 CO 0.00 0.83 -2.26 -0.96 0.00 0.00 0.00 176.54 174.15 1xik n ARG 89 N -3.81 0.70 -0.25 4.80 1.85 -1.12 -4.68 116.66 114.15 1xik n ARG 89 Ca -0.07 0.10 -0.04 0.00 -1.00 0.00 0.00 57.85 56.83 1xik n ARG 89 Cb 0.81 -1.45 0.07 0.00 -1.05 0.00 0.00 32.46 30.84 1xik n ARG 89 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 1xik h SER 90 N 0.00 0.77 -0.76 2.89 0.02 -0.90 -1.85 113.55 113.72 1xik h SER 90 Ca -0.49 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.44 1xik h SER 90 Cb 1.85 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 64.17 1xik h SER 90 CO -0.05 0.55 0.47 -0.65 -1.14 0.00 0.00 176.83 176.00 1xik h PRO 91 N 0.92 1.04 0.87 3.45 0.11 -1.79 0.37 132.00 136.96 1xik h PRO 91 Ca 0.27 -0.09 -0.04 0.00 0.11 0.00 0.00 66.00 66.25 1xik h PRO 91 Cb -0.05 -0.22 0.01 0.00 0.11 0.00 0.00 31.00 30.84 1xik h PRO 91 CO -0.08 0.73 -0.42 -0.91 -0.21 0.00 0.00 178.00 177.11 1xik h ASN 92 N 1.06 -0.99 -0.52 -2.05 2.35 -1.78 0.43 115.58 114.07 1xik h ASN 92 Ca 0.28 0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 56.01 1xik h ASN 92 Cb -0.05 0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 1xik h ASN 92 CO -0.05 -0.65 0.17 0.58 -1.65 0.00 0.00 177.43 175.82 1xik h VAL 93 N -1.27 1.22 0.17 2.81 2.07 -1.20 -2.42 116.25 117.63 1xik h VAL 93 Ca -0.12 -0.78 -0.28 0.00 0.82 0.00 0.00 66.70 66.34 1xik h VAL 93 Cb 0.90 0.61 0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1xik h VAL 93 CO 0.20 0.30 -1.34 0.00 0.02 0.00 0.00 177.57 176.74 1xik h ALA 94 N 1.35 0.02 0.04 1.67 0.00 -0.27 -3.42 119.26 118.65 1xik h ALA 94 Ca 0.19 -0.94 -0.38 0.00 0.00 0.00 0.00 54.91 53.78 1xik h ALA 94 Cb 0.26 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1xik h ALA 94 CO -0.01 0.72 -2.29 1.28 0.00 0.00 0.00 179.25 178.95 1xik n LEU 95 N -3.86 2.47 -0.34 0.00 4.77 0.15 -4.47 117.00 115.71 1xik n LEU 95 Ca -0.20 0.00 0.20 0.00 -0.03 0.00 0.00 56.01 55.98 1xik n LEU 95 Cb 0.96 -0.77 0.42 0.00 -2.33 0.00 0.00 43.42 41.70 1xik n LEU 95 CO 0.50 0.84 1.15 -0.07 -1.33 0.00 0.00 177.39 178.48 1xik h LEU 96 N 0.02 0.62 0.00 2.23 3.38 -1.39 0.28 115.31 120.45 1xik h LEU 96 Ca -0.52 0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1xik h LEU 96 Cb 1.98 0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.80 1xik h LEU 96 CO -0.02 0.02 0.00 -2.65 0.09 0.00 0.00 178.44 175.88 1xik n PRO 97 N -4.94 0.12 0.00 1.13 -0.02 -1.26 -3.28 135.00 126.75 1xik n PRO 97 Ca 0.29 0.16 0.03 0.00 -2.02 0.00 0.00 63.50 61.96 1xik n PRO 97 Cb 0.83 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.78 1xik n PRO 97 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1xik n LEU 98 N -1.39 0.32 -4.73 2.45 4.77 0.95 -4.96 117.00 114.40 1xik n LEU 98 Ca 0.06 -0.52 -0.41 0.00 -0.03 0.00 0.00 56.01 55.11 1xik n LEU 98 Cb 0.17 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.22 1xik n LEU 98 CO 0.15 0.08 0.87 -0.63 -1.33 0.00 0.00 177.39 176.53 1xik s ILE 99 N -1.51 3.70 -0.34 -0.08 1.01 -0.94 0.27 121.20 123.32 1xik s ILE 99 Ca 0.02 1.38 0.03 0.00 0.00 0.00 0.00 60.65 62.09 1xik s ILE 99 Cb 0.04 -3.88 0.05 0.00 0.01 0.00 0.00 42.46 38.68 1xik s ILE 99 CO 0.23 0.20 0.82 -1.54 0.00 0.00 0.00 174.94 174.64 1xik n SER 100 N 2.82 1.72 -4.13 3.58 3.41 0.21 -3.70 113.62 117.53 1xik n SER 100 Ca 0.05 -1.53 -0.26 0.00 -0.26 0.00 0.00 58.87 56.88 1xik n SER 100 Cb 0.45 -0.03 -0.16 0.00 -0.26 0.00 0.00 64.21 64.21 1xik n SER 100 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1xik s ILE 101 N -0.60 1.39 0.28 -1.33 -4.36 -1.25 -4.62 121.20 110.71 1xik s ILE 101 Ca 0.05 -0.70 -0.02 0.00 -0.26 0.00 0.00 60.65 59.71 1xik s ILE 101 Cb 0.03 -1.19 0.21 0.00 1.25 0.00 0.00 42.46 42.76 1xik s ILE 101 CO 0.04 0.40 1.90 1.55 0.24 0.00 0.00 174.94 179.07 1xik h PRO 102 N 6.18 1.01 -0.69 0.37 0.13 -1.89 -2.26 132.00 134.86 1xik h PRO 102 Ca -0.33 -0.12 -0.06 0.00 -0.87 0.00 0.00 66.00 64.62 1xik h PRO 102 Cb 1.17 -0.20 -0.03 0.00 0.13 0.00 0.00 31.00 32.07 1xik h PRO 102 CO 0.48 0.75 0.18 1.05 -0.23 0.00 0.00 178.00 180.24 1xik h GLU 103 N 1.01 1.08 -0.20 0.86 9.09 -1.91 -0.73 114.58 123.79 1xik h GLU 103 Ca 0.25 -0.24 -0.16 0.00 0.05 0.00 0.00 59.36 59.26 1xik h GLU 103 Cb 0.05 -0.15 -0.01 0.00 -1.65 0.00 0.00 28.75 26.99 1xik h GLU 103 CO -0.04 0.94 -0.54 1.25 0.05 0.00 0.00 179.01 180.67 1xik h LEU 104 N 1.03 0.64 -0.46 3.06 5.85 -1.89 0.79 115.31 124.32 1xik h LEU 104 Ca 0.22 -0.34 -0.04 0.00 0.84 0.00 0.00 57.88 58.56 1xik h LEU 104 Cb 0.33 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1xik h LEU 104 CO -0.00 1.05 0.14 -0.08 -0.34 0.00 0.00 178.44 179.21 1xik h GLU 105 N 0.45 0.72 -0.02 1.25 4.81 -0.93 -0.87 114.58 120.00 1xik h GLU 105 Ca 0.01 -0.16 -0.14 0.00 -0.13 0.00 0.00 59.36 58.95 1xik h GLU 105 Cb 1.08 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.34 1xik h GLU 105 CO 0.10 0.69 -0.62 1.15 -0.73 0.00 0.00 179.01 179.60 1xik h THR 106 N 0.61 1.43 -0.27 0.32 2.02 -1.00 -2.28 112.91 113.74 1xik h THR 106 Ca 0.15 -2.11 -0.03 0.00 0.77 0.00 0.00 66.41 65.19 1xik h THR 106 Cb 0.28 2.12 -0.01 0.00 -1.74 0.00 0.00 68.15 68.80 1xik h THR 106 CO -0.00 0.61 0.06 -0.25 0.37 0.00 0.00 175.52 176.30 1xik h TRP 107 N 0.04 0.47 -0.94 3.16 2.91 -0.38 -0.66 115.95 120.54 1xik h TRP 107 Ca -0.01 -0.06 0.07 0.00 1.13 0.00 0.00 58.89 60.02 1xik h TRP 107 Cb 1.11 -0.13 -0.06 0.00 -0.51 0.00 0.00 29.16 29.57 1xik h TRP 107 CO 0.01 0.53 0.61 0.28 -1.03 0.00 0.00 178.44 178.84 1xik h VAL 108 N 0.27 1.07 -0.16 2.65 2.07 -0.96 0.73 116.25 121.93 1xik h VAL 108 Ca 0.08 -0.37 -0.14 0.00 0.82 0.00 0.00 66.70 67.09 1xik h VAL 108 Cb 0.31 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 29.96 1xik h VAL 108 CO 0.00 0.20 -0.51 -0.33 0.02 0.00 0.00 177.57 176.95 1xik h GLU 109 N 1.09 0.43 -0.08 1.57 5.08 -1.18 -0.46 114.58 121.02 1xik h GLU 109 Ca 0.41 -0.25 -0.20 0.00 -1.00 0.00 0.00 59.36 58.32 1xik h GLU 109 Cb 0.19 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.47 1xik h GLU 109 CO -0.16 0.84 -0.71 1.15 -1.00 0.00 0.00 179.01 179.13 1xik h THR 110 N 0.34 1.33 0.53 1.13 2.02 0.47 -1.56 112.91 117.16 1xik h THR 110 Ca 0.01 -1.99 -0.02 0.00 0.77 0.00 0.00 66.41 65.19 1xik h THR 110 Cb 1.01 2.23 -0.02 0.00 -1.74 0.00 0.00 68.15 69.63 1xik h THR 110 CO 0.09 0.61 -0.44 -0.25 0.37 0.00 0.00 175.52 175.90 1xik h TRP 111 N 0.27 -1.21 -1.00 3.16 7.01 0.46 -0.52 115.95 124.13 1xik h TRP 111 Ca -0.07 0.00 0.07 0.00 2.11 0.00 0.00 58.89 61.01 1xik h TRP 111 Cb 1.36 0.46 -0.07 0.00 -2.10 0.00 0.00 29.16 28.81 1xik h TRP 111 CO 0.11 -0.62 0.65 0.00 -2.79 0.00 0.00 178.44 175.78 1xik h ALA 112 N -0.71 1.42 -0.65 2.65 0.00 -1.11 -1.93 119.26 118.93 1xik h ALA 112 Ca -0.06 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1xik h ALA 112 Cb 0.82 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1xik h ALA 112 CO -0.02 0.42 0.40 0.35 0.00 0.00 0.00 179.25 180.41 1xik h PHE 113 N 1.15 0.76 -0.36 0.00 3.57 -0.91 -1.84 116.94 119.30 1xik h PHE 113 Ca 0.44 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.98 1xik h PHE 113 Cb 0.20 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 1xik h PHE 113 CO -0.00 0.44 0.24 0.66 -2.23 0.00 0.00 178.31 177.42 1xik h SER 114 N 0.80 0.36 0.27 0.41 4.64 -0.31 -0.51 113.55 119.21 1xik h SER 114 Ca 0.26 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.50 1xik h SER 114 Cb 0.01 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 1xik h SER 114 CO -0.10 0.26 -0.32 -0.33 -0.87 0.00 0.00 176.83 175.47 1xik h GLU 115 N 0.43 0.08 0.00 4.77 4.39 -1.01 -1.56 114.58 121.68 1xik h GLU 115 Ca 0.14 -0.03 -0.10 0.00 0.34 0.00 0.00 59.36 59.72 1xik h GLU 115 Cb 0.05 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 1xik h GLU 115 CO -0.03 0.39 -0.48 1.79 -1.16 0.00 0.00 179.01 179.52 1xik h THR 116 N 0.07 1.12 -0.39 1.13 1.35 -0.77 -1.32 112.91 114.11 1xik h THR 116 Ca 0.01 -1.78 -0.12 0.00 -0.55 0.00 0.00 66.41 63.97 1xik h THR 116 Cb 0.60 2.02 -0.01 0.00 -1.73 0.00 0.00 68.15 69.03 1xik h THR 116 CO 0.04 0.47 -0.25 0.40 -0.25 0.00 0.00 175.52 175.93 1xik h ILE 117 N 0.00 1.27 -0.18 6.82 1.08 -1.01 -1.84 117.51 123.65 1xik h ILE 117 Ca -0.00 -1.38 0.02 0.00 -0.39 0.00 0.00 64.86 63.11 1xik h ILE 117 Cb 0.98 1.24 -0.02 0.00 -3.07 0.00 0.00 36.82 35.95 1xik h ILE 117 CO 0.06 0.46 0.03 0.45 -0.69 0.00 0.00 178.15 178.46 1xik h HIS 118 N 0.68 0.05 -0.87 1.37 3.86 -0.80 -0.59 115.15 118.85 1xik h HIS 118 Ca 0.09 0.01 0.09 0.00 -1.16 0.00 0.00 60.37 59.40 1xik h HIS 118 Cb 0.77 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 29.17 1xik h HIS 118 CO 0.04 0.02 0.52 0.77 0.86 0.00 0.00 177.93 180.14 1xik h SER 119 N 0.10 0.78 -0.80 2.45 0.02 -0.91 -0.81 113.55 114.38 1xik h SER 119 Ca 0.08 0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 61.02 1xik h SER 119 Cb 0.07 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 1xik h SER 119 CO -0.11 0.46 0.32 -0.09 -1.14 0.00 0.00 176.83 176.26 1xik h ARG 120 N 0.89 1.20 -0.79 3.45 2.43 -0.95 -2.34 114.38 118.27 1xik h ARG 120 Ca 0.41 -0.22 -0.00 0.00 -0.81 0.00 0.00 59.98 59.36 1xik h ARG 120 Cb 0.32 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.64 1xik h ARG 120 CO -0.23 0.97 0.48 0.66 -1.51 0.00 0.00 179.97 180.35 1xik h SER 121 N 1.17 0.93 -0.60 -3.80 4.64 0.32 -1.10 113.55 115.10 1xik h SER 121 Ca 0.27 -0.05 -0.07 0.00 -0.47 0.00 0.00 61.79 61.47 1xik h SER 121 Cb 0.22 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.05 1xik h SER 121 CO -0.02 0.71 0.13 1.88 -0.87 0.00 0.00 176.83 178.65 1xik h TYR 122 N 1.08 1.06 -0.62 4.77 0.05 -0.89 0.12 116.97 122.54 1xik h TYR 122 Ca 0.28 -0.13 -0.07 0.00 0.05 0.00 0.00 58.73 58.87 1xik h TYR 122 Cb -0.06 -0.30 -0.03 0.00 1.01 0.00 0.00 36.73 37.35 1xik h TYR 122 CO 0.00 0.88 0.09 1.15 -1.05 0.00 0.00 178.16 179.24 1xik h THR 123 N 0.96 1.26 -0.24 -2.88 2.02 -0.94 0.12 112.91 113.20 1xik h THR 123 Ca 0.20 -1.00 0.03 0.00 0.77 0.00 0.00 66.41 66.41 1xik h THR 123 Cb 0.38 0.68 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 1xik h THR 123 CO 0.01 0.37 0.05 -0.74 0.37 0.00 0.00 175.52 175.57 1xik h HIS 124 N 0.95 0.08 0.77 3.16 -0.00 -0.35 0.12 115.15 119.87 1xik h HIS 124 Ca 0.19 0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.54 1xik h HIS 124 Cb 0.42 0.00 0.01 0.00 -0.00 0.00 0.00 27.41 27.84 1xik h HIS 124 CO 0.03 0.02 -0.37 0.82 -0.00 0.00 0.00 177.93 178.43 1xik h ILE 125 N 0.14 0.19 -0.57 6.26 2.04 -0.31 -2.24 117.51 123.02 1xik h ILE 125 Ca 0.11 -0.09 0.11 0.00 1.00 0.00 0.00 64.86 65.99 1xik h ILE 125 Cb 0.11 0.21 -0.09 0.00 -0.74 0.00 0.00 36.82 36.31 1xik h ILE 125 CO -0.15 0.01 0.06 0.40 0.00 0.00 0.00 178.15 178.47 1xik h ILE 126 N -1.11 0.59 -0.24 -0.67 2.04 -0.63 0.26 117.51 117.75 1xik h ILE 126 Ca -0.11 -0.06 0.03 0.00 1.00 0.00 0.00 64.86 65.72 1xik h ILE 126 Cb 0.81 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1xik h ILE 126 CO 0.17 0.03 0.16 0.03 0.00 0.00 0.00 178.15 178.55 1xik h ARG 127 N 0.18 0.19 -0.01 2.37 2.47 -0.72 -2.23 114.38 116.62 1xik h ARG 127 Ca 0.30 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 59.01 1xik h ARG 127 Cb 0.45 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.73 1xik h ARG 127 CO -0.44 0.12 -0.04 0.09 0.56 0.00 0.00 179.97 180.27 1xik n ASN 128 N -4.50 1.18 0.00 7.04 4.13 0.89 -4.37 115.26 119.64 1xik n ASN 128 Ca 0.02 -1.30 0.00 0.00 1.68 0.00 0.00 54.58 54.97 1xik n ASN 128 Cb 0.17 0.01 0.00 0.00 -1.54 0.00 0.00 39.78 38.43 1xik n ASN 128 CO 0.00 0.00 0.00 2.30 0.28 0.00 0.00 177.26 179.84 1xik n ILE 129 N -0.15 0.00 -4.37 2.41 -5.35 -0.88 -4.10 119.36 106.92 1xik n ILE 129 Ca 0.19 -0.10 -0.24 0.00 -0.27 0.00 0.00 62.75 62.32 1xik n ILE 129 Cb 0.32 0.57 -0.09 0.00 -1.74 0.00 0.00 39.64 38.70 1xik n ILE 129 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1xik s VAL 130 N -1.49 3.02 0.12 7.28 -7.23 -0.99 -4.85 120.40 116.25 1xik s VAL 130 Ca 0.00 -2.08 -0.06 0.00 -1.81 0.00 0.00 61.98 58.03 1xik s VAL 130 Cb 0.00 -2.59 -0.19 0.00 0.56 0.00 0.00 36.38 34.16 1xik s VAL 130 CO 0.00 -0.35 1.28 0.78 -0.31 0.00 0.00 175.10 176.50 1xik h ASN 131 N 2.18 0.59 -3.15 4.85 -0.26 -1.90 -3.42 115.58 114.47 1xik h ASN 131 Ca -0.43 -0.48 -0.58 0.00 -0.56 0.00 0.00 56.30 54.26 1xik h ASN 131 Cb 1.25 -0.18 -0.40 0.00 -1.06 0.00 0.00 38.32 37.93 1xik h ASN 131 CO 0.59 1.28 -0.76 -0.62 -1.06 0.00 0.00 177.43 176.86 1xik s ASP 132 N -7.12 3.93 0.61 5.81 2.15 -1.26 -5.02 116.67 115.77 1xik s ASP 132 Ca -0.06 -1.56 0.29 0.00 0.43 0.00 0.00 52.55 51.65 1xik s ASP 132 Cb 0.08 -0.83 1.53 0.00 -0.30 0.00 0.00 42.92 43.41 1xik s ASP 132 CO 0.88 -0.41 1.93 -0.65 -0.17 0.00 0.00 175.17 176.75 1xik h PRO 133 N 8.11 0.00 -0.01 4.34 0.11 -1.86 0.09 132.00 142.78 1xik h PRO 133 Ca -0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.97 1xik h PRO 133 Cb 1.02 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1xik h PRO 133 CO 0.46 0.00 0.01 0.77 -0.21 0.00 0.00 178.00 179.03 1xik h SER 134 N 0.00 0.00 -0.41 -2.05 0.02 -1.97 0.86 113.55 110.00 1xik h SER 134 Ca 0.14 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 1xik h SER 134 Cb 0.95 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.48 1xik h SER 134 CO -0.00 0.00 0.22 0.58 -1.14 0.00 0.00 176.83 176.49 1xik h VAL 135 N 0.00 1.16 0.36 2.27 2.07 -1.39 0.36 116.25 121.08 1xik h VAL 135 Ca 0.01 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 1xik h VAL 135 Cb 0.03 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1xik h VAL 135 CO -0.00 0.16 -0.17 0.58 0.02 0.00 0.00 177.57 178.16 1xik h VAL 136 N 0.54 0.47 -0.40 2.57 2.07 -1.03 -3.28 116.25 117.19 1xik h VAL 136 Ca 0.15 -0.68 0.01 0.00 0.82 0.00 0.00 66.70 67.00 1xik h VAL 136 Cb 0.06 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1xik h VAL 136 CO -0.02 0.10 0.27 -0.26 0.02 0.00 0.00 177.57 177.67 1xik h PHE 137 N -0.94 0.47 0.00 1.57 0.04 -1.22 -1.94 116.94 114.91 1xik h PHE 137 Ca -0.05 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.73 1xik h PHE 137 Cb 0.53 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.52 1xik h PHE 137 CO 0.03 0.29 0.00 -0.25 -0.60 0.00 0.00 178.31 177.78 1xik n ASP 138 N -4.48 0.00 -0.18 2.17 8.00 0.12 -3.15 116.55 119.03 1xik n ASP 138 Ca 0.03 -1.01 0.03 0.00 0.71 0.00 0.00 54.79 54.56 1xik n ASP 138 Cb 0.09 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.20 1xik n ASP 138 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1xik n ASP 139 N -0.84 1.14 -0.01 -2.24 2.03 -0.73 -4.69 116.55 111.21 1xik n ASP 139 Ca 0.12 -1.07 -0.16 0.00 0.52 0.00 0.00 54.79 54.20 1xik n ASP 139 Cb 0.06 0.35 -0.11 0.00 -0.72 0.00 0.00 41.12 40.70 1xik n ASP 139 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1xik h ILE 140 N 0.90 1.45 -0.63 5.18 2.04 -1.60 -1.84 117.51 123.01 1xik h ILE 140 Ca 0.00 -1.97 0.08 0.00 1.00 0.00 0.00 64.86 63.97 1xik h ILE 140 Cb 0.24 2.56 -0.07 0.00 -0.74 0.00 0.00 36.82 38.81 1xik h ILE 140 CO 0.00 0.57 0.29 0.58 0.00 0.00 0.00 178.15 179.59 1xik h VAL 141 N -0.18 0.84 -0.02 1.67 2.07 -1.84 -2.99 116.25 115.82 1xik h VAL 141 Ca -0.05 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1xik h VAL 141 Cb 1.18 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1xik h VAL 141 CO 0.09 0.09 -0.18 0.35 0.02 0.00 0.00 177.57 177.95 1xik n THR 142 N -4.91 0.00 -1.65 2.57 -2.24 -1.25 -4.87 114.28 101.92 1xik n THR 142 Ca 0.09 -0.41 -0.46 0.00 -2.27 0.00 0.00 64.05 61.00 1xik n THR 142 Cb 0.24 1.25 -0.04 0.00 -2.10 0.00 0.00 70.33 69.69 1xik n THR 142 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1xik n ASN 143 N 0.34 3.56 -0.34 3.42 2.85 -0.69 -4.83 115.26 119.56 1xik n ASN 143 Ca 0.08 0.82 0.01 0.00 -0.11 0.00 0.00 54.58 55.38 1xik n ASN 143 Cb 0.36 -1.43 0.14 0.00 1.24 0.00 0.00 39.78 40.09 1xik n ASN 143 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 1xik h GLU 144 N 10.55 1.09 -0.36 1.20 4.81 -1.90 -0.59 114.58 129.39 1xik h GLU 144 Ca -0.47 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 58.58 1xik h GLU 144 Cb 1.26 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 30.38 1xik h GLU 144 CO 0.95 0.72 -0.27 1.96 -0.73 0.00 0.00 179.01 181.65 1xik h GLN 145 N 1.12 0.74 0.01 1.92 1.08 -1.97 -1.84 115.11 116.17 1xik h GLN 145 Ca 0.39 -0.31 -0.24 0.00 -1.45 0.00 0.00 58.65 57.03 1xik h GLN 145 Cb 0.09 -0.03 0.01 0.00 -0.05 0.00 0.00 27.48 27.50 1xik h GLN 145 CO -0.15 0.92 -0.99 0.82 -0.95 0.00 0.00 178.83 178.48 1xik h ILE 146 N 0.64 1.36 -0.00 2.54 1.08 -1.68 -1.98 117.51 119.46 1xik h ILE 146 Ca 0.08 -2.40 -0.09 0.00 -0.39 0.00 0.00 64.86 62.06 1xik h ILE 146 Cb 0.78 2.43 -0.01 0.00 -3.07 0.00 0.00 36.82 36.95 1xik h ILE 146 CO 0.06 0.73 -0.42 1.56 -0.69 0.00 0.00 178.15 179.39 1xik h GLN 147 N 0.28 0.00 -0.01 2.37 4.20 -1.08 -0.90 115.11 119.97 1xik h GLN 147 Ca -0.10 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 1xik h GLN 147 Cb 1.64 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.42 1xik h GLN 147 CO 0.18 0.42 -0.01 0.87 -0.67 0.00 0.00 178.83 179.63 1xik h LYS 148 N 0.00 0.02 0.00 1.46 1.57 -1.27 0.12 116.57 118.48 1xik h LYS 148 Ca -0.00 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 1xik h LYS 148 Cb 0.75 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.05 1xik h LYS 148 CO 0.05 0.47 -0.22 -0.09 -0.57 0.00 0.00 179.45 179.09 1xik h ARG 149 N -0.42 0.00 -0.02 3.15 2.43 -1.12 -2.33 114.38 116.06 1xik h ARG 149 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1xik h ARG 149 Cb 0.46 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1xik h ARG 149 CO 0.00 0.22 -0.26 0.00 -1.51 0.00 0.00 179.97 178.42 1xik n ALA 150 N -2.45 3.09 -1.58 2.80 0.00 -0.36 -4.78 120.51 117.23 1xik n ALA 150 Ca -0.02 -0.59 -0.54 0.00 0.00 0.00 0.00 53.44 52.29 1xik n ALA 150 Cb 0.29 -0.90 -0.06 0.00 0.00 0.00 0.00 19.45 18.77 1xik n ALA 150 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1xik n GLU 151 N 0.24 0.93 0.00 0.00 0.00 0.42 -2.84 120.64 119.37 1xik n GLU 151 Ca 0.12 0.33 0.00 0.00 0.00 0.00 0.00 57.16 57.61 1xik n GLU 151 Cb 0.47 -1.95 0.00 0.00 0.00 0.00 0.00 31.44 29.96 1xik n GLU 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1xik n GLY 152 N 2.47 1.66 0.31 8.31 0.00 -1.26 -4.93 105.19 111.75 1xik n GLY 152 Ca 0.19 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.07 1xik n GLY 152 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1xik h ILE 153 N 0.00 0.35 -0.41 -0.61 2.04 -1.94 -2.68 117.51 114.26 1xik h ILE 153 Ca 0.00 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 1xik h ILE 153 Cb 0.00 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 1xik h ILE 153 CO 0.00 0.04 0.24 0.77 0.00 0.00 0.00 178.15 179.20 1xik h SER 154 N -0.98 0.49 -0.36 1.72 4.64 -1.92 -2.59 113.55 114.55 1xik h SER 154 Ca -0.07 -0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.17 1xik h SER 154 Cb 0.63 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.58 1xik h SER 154 CO 0.12 0.38 0.08 0.77 -0.87 0.00 0.00 176.83 177.32 1xik h SER 155 N 0.56 0.62 -0.52 4.97 4.64 -1.93 0.35 113.55 122.24 1xik h SER 155 Ca 0.15 -0.11 -0.09 0.00 -0.47 0.00 0.00 61.79 61.27 1xik h SER 155 Cb -0.01 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 61.90 1xik h SER 155 CO -0.03 0.64 -0.02 1.88 -0.87 0.00 0.00 176.83 178.43 1xik h TYR 156 N 0.64 1.03 0.04 4.77 0.05 -1.12 -1.71 116.97 120.68 1xik h TYR 156 Ca 0.14 -0.19 -0.00 0.00 0.05 0.00 0.00 58.73 58.73 1xik h TYR 156 Cb 0.29 -0.27 0.00 0.00 1.01 0.00 0.00 36.73 37.76 1xik h TYR 156 CO 0.01 0.95 -0.02 1.88 -1.05 0.00 0.00 178.16 179.94 1xik h TYR 157 N 0.81 -0.05 -0.81 4.88 0.05 -1.29 -2.54 116.97 118.02 1xik h TYR 157 Ca 0.15 -0.00 0.06 0.00 0.05 0.00 0.00 58.73 58.99 1xik h TYR 157 Cb 0.56 0.02 -0.05 0.00 1.01 0.00 0.00 36.73 38.26 1xik h TYR 157 CO 0.04 0.31 0.53 -0.44 -1.05 0.00 0.00 178.16 177.55 1xik h ASP 158 N -0.42 0.79 0.55 3.88 3.32 -0.24 -1.20 116.42 123.09 1xik h ASP 158 Ca -0.01 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.89 1xik h ASP 158 Cb 0.38 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 1xik h ASP 158 CO 0.01 0.51 -0.70 -0.33 -1.72 0.00 0.00 179.24 177.01 1xik h GLU 159 N 0.90 0.13 -0.30 3.56 5.08 -1.32 -0.83 114.58 121.81 1xik h GLU 159 Ca 0.35 -0.11 -0.09 0.00 -1.00 0.00 0.00 59.36 58.51 1xik h GLU 159 Cb 0.21 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1xik h GLU 159 CO -0.12 0.77 -0.16 1.25 -1.00 0.00 0.00 179.01 179.76 1xik h LEU 160 N 0.09 0.66 -0.06 1.33 5.85 -0.84 -2.09 115.31 120.25 1xik h LEU 160 Ca -0.02 -0.41 -0.00 0.00 0.84 0.00 0.00 57.88 58.29 1xik h LEU 160 Cb 1.24 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 1xik h LEU 160 CO 0.10 0.93 0.03 0.40 -0.34 0.00 0.00 178.44 179.56 1xik h ILE 161 N 0.39 1.06 -0.19 4.05 2.04 -1.20 0.13 117.51 123.80 1xik h ILE 161 Ca 0.07 -0.18 0.05 0.00 1.00 0.00 0.00 64.86 65.79 1xik h ILE 161 Cb 0.68 1.08 -0.05 0.00 -0.74 0.00 0.00 36.82 37.80 1xik h ILE 161 CO 0.05 0.05 -0.10 -0.08 0.00 0.00 0.00 178.15 178.07 1xik h GLU 162 N 0.02 -0.09 -0.56 2.37 4.81 -1.09 -0.16 114.58 119.89 1xik h GLU 162 Ca 0.02 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.22 1xik h GLU 162 Cb 0.06 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 1xik h GLU 162 CO -0.00 -0.06 0.20 0.52 -0.73 0.00 0.00 179.01 178.94 1xik h MET 163 N -0.09 0.82 -0.55 1.92 2.86 -1.16 -1.78 114.93 116.96 1xik h MET 163 Ca 0.11 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 1xik h MET 163 Cb 0.25 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.74 1xik h MET 163 CO -0.25 0.69 0.28 1.15 1.06 0.00 0.00 176.91 179.85 1xik h THR 164 N 0.81 1.19 -0.18 2.22 2.02 0.09 0.10 112.91 119.17 1xik h THR 164 Ca 0.19 -0.51 0.02 0.00 0.77 0.00 0.00 66.41 66.88 1xik h THR 164 Cb 0.19 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 1xik h THR 164 CO -0.01 0.21 0.04 0.28 0.37 0.00 0.00 175.52 176.41 1xik h SER 165 N 0.73 0.02 -0.72 4.18 0.02 -0.50 0.13 113.55 117.41 1xik h SER 165 Ca 0.19 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.15 1xik h SER 165 Cb 0.08 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.62 1xik h SER 165 CO -0.03 0.04 0.39 1.88 -1.14 0.00 0.00 176.83 177.97 1xik h TYR 166 N 0.11 1.01 -0.09 3.45 0.05 -1.02 0.23 116.97 120.71 1xik h TYR 166 Ca 0.08 -0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.82 1xik h TYR 166 Cb 0.07 -0.32 -0.00 0.00 1.01 0.00 0.00 36.73 37.48 1xik h TYR 166 CO -0.13 0.71 0.01 2.35 -1.05 0.00 0.00 178.16 180.05 1xik h TRP 167 N 1.03 0.16 -0.42 4.88 7.01 0.11 0.66 115.95 129.38 1xik h TRP 167 Ca 0.26 -0.02 -0.05 0.00 2.11 0.00 0.00 58.89 61.19 1xik h TRP 167 Cb 0.05 -0.04 -0.02 0.00 -2.10 0.00 0.00 29.16 27.05 1xik h TRP 167 CO 0.01 0.36 0.05 0.45 -2.79 0.00 0.00 178.44 176.52 1xik h HIS 168 N -0.09 0.66 0.01 2.65 3.86 -0.49 0.11 115.15 121.86 1xik h HIS 168 Ca 0.03 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 1xik h HIS 168 Cb 0.29 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.57 1xik h HIS 168 CO 0.02 0.60 -0.04 -0.07 0.86 0.00 0.00 177.93 179.30 1xik h LEU 169 N 0.62 0.02 0.00 2.43 4.07 -0.84 -2.97 115.31 118.63 1xik h LEU 169 Ca 0.13 -1.00 0.00 0.00 0.08 0.00 0.00 57.88 57.10 1xik h LEU 169 Cb 0.31 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.04 1xik h LEU 169 CO 0.01 1.02 -1.86 0.18 -1.08 0.00 0.00 178.44 176.70 1xik n LEU 170 N -4.59 0.08 -0.22 1.67 4.32 0.21 -4.92 117.00 113.55 1xik n LEU 170 Ca -0.10 -0.04 0.03 0.00 -0.02 0.00 0.00 56.01 55.87 1xik n LEU 170 Cb 0.49 0.00 -0.01 0.00 -1.62 0.00 0.00 43.42 42.28 1xik n LEU 170 CO 0.34 0.02 -0.06 0.61 -1.22 0.00 0.00 177.39 177.08 1xik n GLY 171 N 1.34 -1.88 3.76 -0.72 0.00 0.38 -4.85 105.19 103.23 1xik n GLY 171 Ca -0.03 -1.45 -0.38 0.00 0.00 0.00 0.00 46.02 44.15 1xik n GLY 171 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xik s GLU 172 N -1.94 3.75 0.00 1.61 2.56 -1.26 -4.76 118.70 118.66 1xik s GLU 172 Ca 0.00 2.05 0.00 0.00 0.00 0.00 0.00 54.97 57.02 1xik s GLU 172 Cb 0.00 -2.55 0.00 0.00 2.00 0.00 0.00 34.13 33.58 1xik s GLU 172 CO 0.00 -0.64 0.00 0.41 -0.56 0.00 0.00 175.26 174.47 1xik n GLY 173 N 0.61 0.29 3.51 -1.50 0.00 -0.08 -4.96 105.19 103.07 1xik n GLY 173 Ca 0.06 -1.81 -0.35 0.00 0.00 0.00 0.00 46.02 43.93 1xik n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xik s THR 174 N -1.51 4.17 0.36 2.61 2.01 -1.26 0.37 115.64 122.39 1xik s THR 174 Ca 0.00 -0.25 0.06 0.00 0.31 0.00 0.00 61.69 61.82 1xik s THR 174 Cb 0.00 -2.87 -0.02 0.00 0.01 0.00 0.00 72.50 69.61 1xik s THR 174 CO 0.00 0.45 0.23 1.41 -0.69 0.00 0.00 174.62 176.01 1xik n HIS 175 N 3.91 -0.41 -4.53 4.92 8.25 0.06 -4.96 115.22 122.46 1xik n HIS 175 Ca -0.17 -2.74 -0.23 0.00 -0.26 0.00 0.00 57.72 54.33 1xik n HIS 175 Cb 0.52 0.17 -0.14 0.00 1.12 0.00 0.00 29.99 31.66 1xik n HIS 175 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1xik s THR 176 N -3.25 1.36 -0.13 1.59 -4.23 -1.26 -0.25 115.64 109.48 1xik s THR 176 Ca 0.32 -1.03 -0.04 0.00 -1.18 0.00 0.00 61.69 59.76 1xik s THR 176 Cb 0.02 -1.20 0.06 0.00 1.34 0.00 0.00 72.50 72.72 1xik s THR 176 CO 0.23 0.14 0.24 -0.69 -0.54 0.00 0.00 174.62 174.00 1xik s VAL 177 N -0.75 -0.38 -1.59 2.29 1.01 0.36 -4.92 120.40 116.41 1xik s VAL 177 Ca 0.05 0.27 -0.12 0.00 0.00 0.00 0.00 61.98 62.18 1xik s VAL 177 Cb -0.08 -0.43 0.10 0.00 0.00 0.00 0.00 36.38 35.97 1xik s VAL 177 CO 0.01 0.10 0.70 0.59 0.00 0.00 0.00 175.10 176.51 1xik n ASN 178 N 5.34 -2.58 0.00 3.32 3.02 -1.26 -1.62 115.26 121.48 1xik n ASN 178 Ca -0.06 -0.98 0.00 0.00 -0.03 0.00 0.00 54.58 53.52 1xik n ASN 178 Cb 0.50 -3.01 0.00 0.00 -0.61 0.00 0.00 39.78 36.66 1xik n ASN 178 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xik n GLY 179 N -1.63 1.33 3.40 7.41 0.00 -1.26 -5.04 105.19 109.41 1xik n GLY 179 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 1xik n GLY 179 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xik s LYS 180 N -0.42 1.82 0.20 1.61 0.00 -0.64 -5.13 119.74 117.18 1xik s LYS 180 Ca 0.00 -1.12 -0.30 0.00 0.00 0.00 0.00 55.97 54.55 1xik s LYS 180 Cb 0.00 -2.05 -0.08 0.00 0.00 0.00 0.00 37.83 35.70 1xik s LYS 180 CO 0.00 0.51 0.95 0.99 0.00 0.00 0.00 175.35 177.80 1xik s THR 181 N -0.93 4.20 -0.19 3.79 2.01 -1.26 -0.49 115.64 122.77 1xik s THR 181 Ca 0.14 2.07 -0.02 0.00 0.31 0.00 0.00 61.69 64.20 1xik s THR 181 Cb -0.10 -4.32 0.06 0.00 0.01 0.00 0.00 72.50 68.14 1xik s THR 181 CO 0.05 0.44 0.00 -0.69 -0.69 0.00 0.00 174.62 173.73 1xik s VAL 182 N -0.79 0.82 -0.03 3.82 1.01 0.66 -4.91 120.40 120.98 1xik s VAL 182 Ca 0.43 -0.68 -0.17 0.00 0.00 0.00 0.00 61.98 61.56 1xik s VAL 182 Cb -0.25 -1.21 -0.05 0.00 0.00 0.00 0.00 36.38 34.86 1xik s VAL 182 CO 0.31 -0.11 0.47 -0.89 0.00 0.00 0.00 175.10 174.88 1xik s THR 183 N 1.73 5.03 -0.14 3.92 2.01 -1.26 -0.76 115.64 126.17 1xik s THR 183 Ca -0.02 0.96 0.00 0.00 0.31 0.00 0.00 61.69 62.95 1xik s THR 183 Cb -0.17 -3.79 0.02 0.00 0.01 0.00 0.00 72.50 68.57 1xik s THR 183 CO -0.07 0.48 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.52 1xik s VAL 184 N -0.44 1.46 -0.07 3.82 1.01 0.16 -4.98 120.40 121.35 1xik s VAL 184 Ca 0.26 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1xik s VAL 184 Cb -0.17 -1.38 0.02 0.00 0.00 0.00 0.00 36.38 34.86 1xik s VAL 184 CO 0.13 0.44 -0.07 -0.55 0.00 0.00 0.00 175.10 175.05 1xik s SER 185 N 1.47 1.61 0.28 3.32 0.15 -1.26 -0.90 113.70 118.37 1xik s SER 185 Ca 0.04 -0.23 -0.03 0.00 0.70 0.00 0.00 55.95 56.43 1xik s SER 185 Cb -0.13 -0.68 0.38 0.00 -1.71 0.00 0.00 66.02 63.88 1xik s SER 185 CO -0.09 -0.06 1.87 0.25 1.20 0.00 0.00 173.24 176.41 1xik h LEU 186 N 7.50 0.90 -0.81 3.45 6.46 -1.98 -1.63 115.31 129.19 1xik h LEU 186 Ca -0.31 -0.10 0.01 0.00 -0.12 0.00 0.00 57.88 57.35 1xik h LEU 186 Cb 1.16 -0.23 -0.04 0.00 -0.73 0.00 0.00 40.66 40.81 1xik h LEU 186 CO 0.43 0.77 0.54 -0.09 -0.62 0.00 0.00 178.44 179.47 1xik h ARG 187 N 0.99 1.07 -0.33 1.25 2.43 -1.99 0.43 114.38 118.22 1xik h ARG 187 Ca 0.24 -0.06 -0.11 0.00 -0.81 0.00 0.00 59.98 59.24 1xik h ARG 187 Cb 0.12 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 1xik h ARG 187 CO -0.03 0.70 -0.23 1.49 -1.51 0.00 0.00 179.97 180.39 1xik h GLU 188 N 1.10 0.65 -0.31 0.20 4.57 -1.87 -0.82 114.58 118.10 1xik h GLU 188 Ca 0.30 -0.26 -0.14 0.00 -1.18 0.00 0.00 59.36 58.08 1xik h GLU 188 Cb -0.12 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.43 1xik h GLU 188 CO -0.07 0.83 -0.38 1.25 -1.18 0.00 0.00 179.01 179.46 1xik h LEU 189 N 0.57 0.76 -0.82 1.64 5.85 -0.66 -0.11 115.31 122.54 1xik h LEU 189 Ca 0.08 -0.33 -0.06 0.00 0.84 0.00 0.00 57.88 58.41 1xik h LEU 189 Cb 0.70 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 1xik h LEU 189 CO 0.05 1.05 0.22 0.11 -0.34 0.00 0.00 178.44 179.53 1xik h LYS 190 N 0.59 1.10 -0.44 1.25 1.57 0.24 -1.17 116.57 119.71 1xik h LYS 190 Ca 0.05 -0.23 -0.07 0.00 -1.87 0.00 0.00 60.65 58.53 1xik h LYS 190 Cb 0.91 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.05 1xik h LYS 190 CO 0.08 0.94 -0.01 -0.22 -0.57 0.00 0.00 179.45 179.67 1xik h LYS 191 N 1.06 0.78 -0.29 3.15 3.64 -0.80 -1.68 116.57 122.44 1xik h LYS 191 Ca 0.23 -0.25 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 1xik h LYS 191 Cb 0.30 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 1xik h LYS 191 CO -0.01 0.85 0.08 0.87 -2.27 0.00 0.00 179.45 178.97 1xik h LYS 192 N 0.61 0.40 -0.34 1.90 1.57 -0.65 -0.66 116.57 119.41 1xik h LYS 192 Ca 0.12 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 1xik h LYS 192 Cb 0.50 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1xik h LYS 192 CO 0.02 0.37 -0.14 1.25 -0.57 0.00 0.00 179.45 180.37 1xik h LEU 193 N 0.40 0.72 -0.15 2.94 5.85 -0.85 -1.23 115.31 122.99 1xik h LEU 193 Ca 0.10 -0.40 -0.00 0.00 0.84 0.00 0.00 57.88 58.42 1xik h LEU 193 Cb 0.14 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1xik h LEU 193 CO -0.01 0.95 0.09 0.22 -0.34 0.00 0.00 178.44 179.36 1xik h TYR 194 N 0.48 0.19 -0.86 1.25 3.20 -0.46 0.23 116.97 121.00 1xik h TYR 194 Ca 0.08 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 1xik h TYR 194 Cb 0.67 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.84 1xik h TYR 194 CO 0.06 0.15 0.49 -0.07 -1.64 0.00 0.00 178.16 177.15 1xik h LEU 195 N 0.17 1.05 -0.96 2.82 3.38 -1.15 0.13 115.31 120.75 1xik h LEU 195 Ca 0.05 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 1xik h LEU 195 Cb 0.02 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 1xik h LEU 195 CO -0.01 0.83 -0.15 0.00 0.09 0.00 0.00 178.44 179.20 1xik h LEU 197 N 0.53 0.64 -0.53 0.00 3.38 -0.43 -0.21 115.31 118.69 1xik h LEU 197 Ca 0.09 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 1xik h LEU 197 Cb 0.56 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1xik h LEU 197 CO 0.04 1.06 0.27 -0.03 0.09 0.00 0.00 178.44 179.87 1xik h MET 198 N 0.44 0.75 -0.56 1.13 4.05 -0.15 0.17 114.93 120.77 1xik h MET 198 Ca 0.01 -0.10 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 1xik h MET 198 Cb 1.10 -0.14 -0.03 0.00 -0.80 0.00 0.00 31.60 31.73 1xik h MET 198 CO 0.11 0.61 0.35 1.03 0.23 0.00 0.00 176.91 179.23 1xik h SER 199 N 0.71 0.66 0.42 1.39 0.87 -0.77 -1.02 113.55 115.80 1xik h SER 199 Ca 0.18 -0.04 -0.13 0.00 -1.23 0.00 0.00 61.79 60.58 1xik h SER 199 Cb 0.09 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 1xik h SER 199 CO -0.03 0.50 -0.56 0.58 -0.53 0.00 0.00 176.83 176.80 1xik h VAL 200 N 0.76 1.38 -0.75 2.23 2.07 -0.61 -1.80 116.25 119.52 1xik h VAL 200 Ca 0.20 -1.89 -0.05 0.00 0.82 0.00 0.00 66.70 65.78 1xik h VAL 200 Cb -0.05 1.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 1xik h VAL 200 CO -0.04 0.55 0.27 -1.13 0.02 0.00 0.00 177.57 177.24 1xik h ASN 201 N 0.11 1.07 -0.23 0.57 -0.73 0.06 0.46 115.58 116.89 1xik h ASN 201 Ca -0.00 -0.19 -0.09 0.00 1.87 0.00 0.00 56.30 57.89 1xik h ASN 201 Cb 1.02 -0.28 -0.02 0.00 0.27 0.00 0.00 38.32 39.31 1xik h ASN 201 CO 0.08 0.98 -0.15 0.00 -0.37 0.00 0.00 177.43 177.97 1xik h ALA 202 N 1.14 1.06 0.07 1.57 0.00 -0.97 0.60 119.26 122.73 1xik h ALA 202 Ca 0.25 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1xik h ALA 202 Cb 0.27 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1xik h ALA 202 CO -0.01 0.57 -0.03 1.25 0.00 0.00 0.00 179.25 181.03 1xik h LEU 203 N 0.59 -0.08 -0.58 0.00 6.46 -0.78 0.71 115.31 121.64 1xik h LEU 203 Ca 0.10 -0.14 -0.13 0.00 -0.12 0.00 0.00 57.88 57.58 1xik h LEU 203 Cb 0.59 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.53 1xik h LEU 203 CO 0.04 0.10 -0.30 -0.33 -0.62 0.00 0.00 178.44 177.33 1xik h GLU 204 N -0.25 0.81 -0.01 1.25 4.39 -0.61 -2.49 114.58 117.68 1xik h GLU 204 Ca -0.01 -0.37 -0.10 0.00 0.34 0.00 0.00 59.36 59.22 1xik h GLU 204 Cb 0.21 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 28.86 1xik h GLU 204 CO 0.02 1.00 -0.37 0.00 -1.16 0.00 0.00 179.01 178.49 1xik h ALA 205 N 0.97 0.06 0.00 3.43 0.00 0.39 -3.40 119.26 120.70 1xik h ALA 205 Ca 0.08 -0.50 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 1xik h ALA 205 Cb 0.84 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1xik h ALA 205 CO 0.07 0.18 -1.19 0.44 0.00 0.00 0.00 179.25 178.76 1xik n ILE 206 N -4.40 0.19 -0.37 0.00 -5.35 0.24 -4.43 119.36 105.23 1xik n ILE 206 Ca -0.10 -0.07 0.05 0.00 -0.27 0.00 0.00 62.75 62.36 1xik n ILE 206 Cb 0.56 -0.70 0.21 0.00 -1.74 0.00 0.00 39.64 37.97 1xik n ILE 206 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 1xik h ARG 207 N -0.01 1.06 0.01 6.28 3.08 -1.05 -1.61 114.38 122.14 1xik h ARG 207 Ca -0.07 -0.06 -0.22 0.00 0.07 0.00 0.00 59.98 59.69 1xik h ARG 207 Cb 1.11 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.92 1xik h ARG 207 CO -0.02 0.70 -0.95 0.74 -1.07 0.00 0.00 179.97 179.38 1xik h PHE 208 N 1.10 0.56 -0.26 3.04 0.04 -1.67 -3.12 116.94 116.63 1xik h PHE 208 Ca 0.46 -0.31 -0.05 0.00 2.80 0.00 0.00 57.97 60.87 1xik h PHE 208 Cb 0.32 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 1xik h PHE 208 CO -0.00 1.13 -0.07 1.88 -0.60 0.00 0.00 178.31 180.65 1xik h TYR 209 N 0.21 0.42 -0.52 -0.55 -1.99 -1.54 -0.17 116.97 112.83 1xik h TYR 209 Ca -0.08 -0.05 -0.07 0.00 2.00 0.00 0.00 58.73 60.53 1xik h TYR 209 Cb 1.58 -0.12 -0.02 0.00 2.00 0.00 0.00 36.73 40.17 1xik h TYR 209 CO 0.06 0.48 0.05 0.28 -0.00 0.00 0.00 178.16 179.02 1xik h VAL 210 N 0.38 1.26 -0.07 -2.88 2.07 -1.38 -1.91 116.25 113.72 1xik h VAL 210 Ca 0.08 -1.01 -0.08 0.00 0.82 0.00 0.00 66.70 66.50 1xik h VAL 210 Cb 0.37 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1xik h VAL 210 CO 0.02 0.36 -0.35 0.77 0.02 0.00 0.00 177.57 178.39 1xik h SER 211 N 0.76 0.13 -0.56 0.57 4.64 -1.28 -2.49 113.55 115.32 1xik h SER 211 Ca 0.15 -0.04 -0.10 0.00 -0.47 0.00 0.00 61.79 61.33 1xik h SER 211 Cb 0.46 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.49 1xik h SER 211 CO 0.02 0.47 -0.03 -0.26 -0.87 0.00 0.00 176.83 176.16 1xik h PHE 212 N 0.11 1.11 -0.52 4.77 0.04 -0.70 -2.36 116.94 119.39 1xik h PHE 212 Ca 0.01 -0.20 0.06 0.00 2.80 0.00 0.00 57.97 60.64 1xik h PHE 212 Cb 0.67 -0.28 -0.05 0.00 2.20 0.00 0.00 35.95 38.49 1xik h PHE 212 CO 0.01 1.00 0.22 0.00 -0.60 0.00 0.00 178.31 178.94 1xik h ALA 213 N 0.96 0.65 0.15 2.45 0.00 -0.89 0.40 119.26 122.98 1xik h ALA 213 Ca 0.16 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1xik h ALA 213 Cb 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1xik h ALA 213 CO 0.03 -0.15 -0.07 0.00 0.00 0.00 0.00 179.25 179.06 1xik h SER 215 N -0.22 0.66 0.92 0.00 0.02 -1.05 -1.89 113.55 112.00 1xik h SER 215 Ca -0.02 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 1xik h SER 215 Cb 0.17 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1xik h SER 215 CO 0.03 0.60 0.00 -0.26 -1.14 0.00 0.00 176.83 176.07 1xik h PHE 216 N 0.67 0.00 -0.26 3.45 0.04 0.13 -2.21 116.94 118.75 1xik h PHE 216 Ca 0.17 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.94 1xik h PHE 216 Cb 0.12 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.26 1xik h PHE 216 CO -0.01 0.00 0.14 0.00 -0.60 0.00 0.00 178.31 177.84 1xik h ALA 217 N 2.02 0.34 -0.75 2.45 0.00 0.07 0.43 119.26 123.81 1xik h ALA 217 Ca 0.00 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1xik h ALA 217 Cb 0.46 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1xik h ALA 217 CO 0.00 -0.12 0.29 0.74 0.00 0.00 0.00 179.25 180.16 1xik h PHE 218 N 0.30 1.15 -0.05 0.00 -1.00 -1.18 -2.87 116.94 113.30 1xik h PHE 218 Ca 0.09 -0.09 -0.05 0.00 2.81 0.00 0.00 57.97 60.73 1xik h PHE 218 Cb 0.09 -0.34 -0.01 0.00 3.61 0.00 0.00 35.95 39.30 1xik h PHE 218 CO -0.03 0.88 -0.22 0.00 -1.61 0.00 0.00 178.31 177.33 1xik h ALA 219 N 1.15 1.54 -0.87 2.45 0.00 -0.92 -1.66 119.26 120.94 1xik h ALA 219 Ca 0.25 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.97 1xik h ALA 219 Cb 0.23 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 1xik h ALA 219 CO -0.02 0.34 0.57 0.93 0.00 0.00 0.00 179.25 181.07 1xik h GLU 220 N 0.08 1.01 -0.16 0.00 4.39 -0.73 0.11 114.58 119.28 1xik h GLU 220 Ca 0.01 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1xik h GLU 220 Cb 0.44 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.86 1xik h GLU 220 CO 0.03 0.67 0.00 0.54 -1.16 0.00 0.00 179.01 179.09 1xik n ARG 221 N -4.46 1.25 -1.95 2.33 1.74 -0.80 -4.89 116.66 109.88 1xik n ARG 221 Ca 0.12 -0.36 -0.14 0.00 -0.77 0.00 0.00 57.85 56.70 1xik n ARG 221 Cb 0.15 -1.12 -0.03 0.00 -1.02 0.00 0.00 32.46 30.44 1xik n ARG 221 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1xik n GLU 222 N -0.19 -1.04 -4.38 5.56 0.00 0.37 -5.02 120.64 115.94 1xik n GLU 222 Ca 0.03 0.78 -0.28 0.00 0.00 0.00 0.00 57.16 57.69 1xik n GLU 222 Cb 0.11 -4.97 -0.12 0.00 0.00 0.00 0.00 31.44 26.46 1xik n GLU 222 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1xik s LEU 223 N -3.63 2.51 -1.34 4.31 1.43 -0.69 -4.70 118.68 116.56 1xik s LEU 223 Ca 0.00 -0.75 -0.06 0.00 -1.03 0.00 0.00 54.13 52.29 1xik s LEU 223 Cb 0.00 -1.30 0.00 0.00 0.03 0.00 0.00 46.19 44.92 1xik s LEU 223 CO 0.00 0.15 0.51 0.23 0.23 0.00 0.00 176.35 177.46 1xik n MET 224 N 0.51 -2.72 0.17 1.70 2.81 -1.26 -3.19 117.12 115.14 1xik n MET 224 Ca -0.14 0.40 0.04 0.00 -1.81 0.00 0.00 57.70 56.19 1xik n MET 224 Cb 0.54 -4.35 0.26 0.00 -0.71 0.00 0.00 33.22 28.96 1xik n MET 224 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1xik h GLU 225 N -1.88 0.00 0.11 0.03 5.08 -1.92 -2.04 114.58 113.96 1xik h GLU 225 Ca -0.64 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.71 1xik h GLU 225 Cb 1.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1xik h GLU 225 CO 0.59 0.43 -0.05 0.78 -1.00 0.00 0.00 179.01 179.75 1xik h GLY 226 N 2.35 -0.16 0.51 -3.84 0.00 -1.89 -1.89 103.07 98.15 1xik h GLY 226 Ca -0.00 0.06 0.15 0.00 0.00 0.00 0.00 47.33 47.53 1xik h GLY 226 CO 0.06 -0.06 0.58 -0.57 0.00 0.00 0.00 176.54 176.54 1xik h ASN 227 N -0.52 0.66 -0.54 0.19 -0.73 -1.86 -1.79 115.58 110.99 1xik h ASN 227 Ca -0.02 0.04 -0.08 0.00 1.87 0.00 0.00 56.30 58.12 1xik h ASN 227 Cb 0.42 -0.09 -0.02 0.00 0.27 0.00 0.00 38.32 38.90 1xik h ASN 227 CO 0.03 0.33 0.02 0.00 -0.37 0.00 0.00 177.43 177.44 1xik h ALA 228 N 1.60 0.72 -0.81 1.57 0.00 -1.02 0.16 119.26 121.48 1xik h ALA 228 Ca 0.45 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1xik h ALA 228 Cb 0.73 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1xik h ALA 228 CO -0.21 0.52 0.45 0.87 0.00 0.00 0.00 179.25 180.88 1xik h LYS 229 N 0.81 1.12 -0.17 0.00 1.57 -0.52 0.18 116.57 119.56 1xik h LYS 229 Ca 0.16 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1xik h LYS 229 Cb 0.50 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1xik h LYS 229 CO 0.02 0.83 0.05 0.82 -0.57 0.00 0.00 179.45 180.60 1xik h ILE 230 N 1.12 1.19 -0.28 1.86 2.04 -1.06 -2.10 117.51 120.27 1xik h ILE 230 Ca 0.28 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 1xik h ILE 230 Cb 0.02 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1xik h ILE 230 CO -0.05 0.18 0.10 0.40 0.00 0.00 0.00 178.15 178.78 1xik h ILE 231 N 0.10 1.12 -0.59 -0.67 1.08 -0.33 0.11 117.51 118.33 1xik h ILE 231 Ca 0.06 -0.39 -0.09 0.00 -0.39 0.00 0.00 64.86 64.05 1xik h ILE 231 Cb 0.23 0.80 -0.02 0.00 -3.07 0.00 0.00 36.82 34.75 1xik h ILE 231 CO -0.00 0.15 0.02 -0.09 -0.69 0.00 0.00 178.15 177.54 1xik h ARG 232 N 0.40 1.02 -0.50 2.37 2.43 -0.27 0.20 114.38 120.03 1xik h ARG 232 Ca 0.10 -0.30 -0.10 0.00 -0.81 0.00 0.00 59.98 58.87 1xik h ARG 232 Cb 0.10 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 1xik h ARG 232 CO -0.01 0.98 -0.09 -0.07 -1.51 0.00 0.00 179.97 179.28 1xik h LEU 233 N 0.94 0.91 -0.41 3.80 3.38 -0.49 -2.25 115.31 121.19 1xik h LEU 233 Ca 0.17 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1xik h LEU 233 Cb 0.51 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1xik h LEU 233 CO 0.02 1.02 0.20 0.40 0.09 0.00 0.00 178.44 180.17 1xik h ILE 234 N 0.83 1.17 -0.54 1.22 2.04 -0.41 -2.73 117.51 119.09 1xik h ILE 234 Ca 0.14 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.52 1xik h ILE 234 Cb 0.61 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 1xik h ILE 234 CO 0.04 0.18 0.35 0.00 0.00 0.00 0.00 178.15 178.72 1xik h ALA 235 N 1.05 1.59 -0.52 1.87 0.00 -0.39 -0.25 119.26 122.60 1xik h ALA 235 Ca 0.14 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1xik h ALA 235 Cb 0.11 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1xik h ALA 235 CO -0.02 0.37 0.07 -0.09 0.00 0.00 0.00 179.25 179.58 1xik h ARG 236 N 0.74 0.83 -0.19 0.00 2.43 -1.11 -2.28 114.38 114.80 1xik h ARG 236 Ca 0.20 -0.20 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 1xik h ARG 236 Cb -0.06 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.38 1xik h ARG 236 CO -0.04 0.79 -0.24 -0.44 -1.51 0.00 0.00 179.97 178.53 1xik h ASP 237 N 0.78 0.53 -0.75 -3.80 3.32 -1.09 -3.14 116.42 112.27 1xik h ASP 237 Ca 0.16 -0.50 0.10 0.00 0.02 0.00 0.00 57.03 56.81 1xik h ASP 237 Cb 0.38 -0.15 -0.05 0.00 0.22 0.00 0.00 39.33 39.73 1xik h ASP 237 CO 0.01 0.93 0.49 -0.33 -1.72 0.00 0.00 179.24 178.62 1xik h GLU 238 N 0.14 0.61 -0.80 3.56 4.39 -0.93 -0.68 114.58 120.88 1xik h GLU 238 Ca 0.02 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1xik h GLU 238 Cb 0.80 -0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 29.28 1xik h GLU 238 CO 0.06 0.40 0.50 0.00 -1.16 0.00 0.00 179.01 178.81 1xik h ALA 239 N 1.63 1.01 -0.44 3.43 0.00 -1.37 0.16 119.26 123.69 1xik h ALA 239 Ca 0.35 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 1xik h ALA 239 Cb 0.51 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1xik h ALA 239 CO -0.13 0.45 -0.05 -0.07 0.00 0.00 0.00 179.25 179.46 1xik h LEU 240 N 1.08 0.80 -0.84 0.00 3.38 -1.17 -2.03 115.31 116.54 1xik h LEU 240 Ca 0.29 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 57.96 1xik h LEU 240 Cb -0.08 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.40 1xik h LEU 240 CO -0.06 0.94 0.53 0.45 0.09 0.00 0.00 178.44 180.40 1xik h HIS 241 N 0.64 1.00 -0.40 1.13 3.86 -0.57 -1.77 115.15 119.04 1xik h HIS 241 Ca 0.12 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.27 1xik h HIS 241 Cb 0.56 -0.33 -0.02 0.00 1.06 0.00 0.00 27.41 28.68 1xik h HIS 241 CO 0.04 0.57 -0.10 1.25 0.86 0.00 0.00 177.93 180.56 1xik h LEU 242 N 1.03 0.68 -0.95 2.43 6.46 -0.90 -1.42 115.31 122.65 1xik h LEU 242 Ca 0.34 -0.19 -0.02 0.00 -0.12 0.00 0.00 57.88 57.89 1xik h LEU 242 Cb 0.02 -0.18 -0.04 0.00 -0.73 0.00 0.00 40.66 39.73 1xik h LEU 242 CO -0.12 0.81 0.46 0.74 -0.62 0.00 0.00 178.44 179.71 1xik h THR 243 N 0.64 1.25 0.19 1.05 2.02 -0.59 -0.41 112.91 117.05 1xik h THR 243 Ca 0.11 -0.65 -0.01 0.00 0.77 0.00 0.00 66.41 66.64 1xik h THR 243 Cb 0.54 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 1xik h THR 243 CO 0.03 0.29 -0.09 1.23 0.37 0.00 0.00 175.52 177.35 1xik h GLY 244 N 1.22 -0.27 1.64 2.16 0.00 -0.71 -1.04 103.07 106.07 1xik h GLY 244 Ca 0.30 0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.68 1xik h GLY 244 CO -0.05 -0.10 -0.04 -0.91 0.00 0.00 0.00 176.54 175.45 1xik h THR 245 N -0.38 1.19 -0.24 4.70 1.35 -1.01 -0.87 112.91 117.65 1xik h THR 245 Ca -0.03 -0.79 -0.02 0.00 -0.55 0.00 0.00 66.41 65.03 1xik h THR 245 Cb 0.30 1.02 -0.01 0.00 -1.73 0.00 0.00 68.15 67.72 1xik h THR 245 CO 0.04 0.26 0.08 1.56 -0.25 0.00 0.00 175.52 177.22 1xik h GLN 246 N 0.43 0.37 -0.75 4.72 4.20 -0.82 -0.37 115.11 122.88 1xik h GLN 246 Ca 0.09 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.69 1xik h GLN 246 Cb 0.35 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.04 1xik h GLN 246 CO 0.01 0.43 0.33 0.45 -0.67 0.00 0.00 178.83 179.38 1xik h HIS 247 N 0.23 1.10 -0.12 2.96 3.86 -0.92 0.01 115.15 122.26 1xik h HIS 247 Ca 0.08 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1xik h HIS 247 Cb 0.21 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 1xik h HIS 247 CO -0.00 0.82 0.04 0.52 0.86 0.00 0.00 177.93 180.17 1xik h MET 248 N 1.08 0.19 -0.66 2.45 2.86 -0.72 -0.08 114.93 120.05 1xik h MET 248 Ca 0.26 -0.04 -0.07 0.00 -2.06 0.00 0.00 59.70 57.79 1xik h MET 248 Cb 0.16 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.77 1xik h MET 248 CO -0.03 0.31 0.13 -0.07 1.06 0.00 0.00 176.91 178.32 1xik h LEU 249 N 0.02 1.00 -0.61 1.22 3.38 -0.75 -0.87 115.31 118.70 1xik h LEU 249 Ca 0.04 -0.22 -0.12 0.00 0.09 0.00 0.00 57.88 57.67 1xik h LEU 249 Cb 0.20 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1xik h LEU 249 CO -0.00 0.98 -0.23 0.78 0.09 0.00 0.00 178.44 180.06 1xik h ASN 250 N 1.00 0.88 -0.60 -0.43 2.35 -0.88 0.71 115.58 118.60 1xik h ASN 250 Ca 0.20 -0.33 -0.09 0.00 -0.55 0.00 0.00 56.30 55.54 1xik h ASN 250 Cb 0.39 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 1xik h ASN 250 CO 0.01 1.07 0.02 -0.07 -1.65 0.00 0.00 177.43 176.80 1xik h LEU 251 N 0.74 1.04 0.01 1.61 3.38 -0.86 -1.94 115.31 119.30 1xik h LEU 251 Ca 0.10 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 1xik h LEU 251 Cb 0.77 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1xik h LEU 251 CO 0.06 1.07 -0.01 -0.07 0.09 0.00 0.00 178.44 179.59 1xik h LEU 252 N 0.98 -0.02 -0.98 1.67 3.38 -0.54 -3.24 115.31 116.55 1xik h LEU 252 Ca 0.18 -0.38 -0.10 0.00 0.09 0.00 0.00 57.88 57.67 1xik h LEU 252 Cb 0.53 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1xik h LEU 252 CO 0.03 0.37 -0.46 0.08 0.09 0.00 0.00 178.44 178.54 1xik h ARG 253 N -0.41 0.00 0.00 1.13 0.11 -0.89 -3.00 114.38 111.33 1xik h ARG 253 Ca -0.00 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.07 1xik h ARG 253 Cb 0.39 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.47 1xik h ARG 253 CO 0.00 0.46 -0.03 0.66 0.10 0.00 0.00 179.97 181.16 1xik h SER 254 N 0.00 0.00 0.00 0.08 4.64 -1.38 -3.41 113.55 113.48 1xik h SER 254 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xik h SER 254 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1xik h SER 254 CO 0.06 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.66 1xik n GLY 255 N -0.95 2.12 0.32 -0.77 0.00 -1.14 -4.91 105.19 99.86 1xik n GLY 255 Ca -0.02 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.01 1xik n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xik h ALA 256 N 0.00 1.52 0.04 4.61 0.00 -1.85 -3.27 119.26 120.30 1xik h ALA 256 Ca 0.00 -0.08 -0.37 0.00 0.00 0.00 0.00 54.91 54.45 1xik h ALA 256 Cb 0.00 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.53 1xik h ALA 256 CO 0.00 0.40 -2.25 -3.47 0.00 0.00 0.00 179.25 173.93 1xik n ASP 257 N -4.40 1.74 -3.24 0.00 2.03 -1.25 -4.89 116.55 106.54 1xik n ASP 257 Ca 0.05 0.03 -0.04 0.00 0.52 0.00 0.00 54.79 55.35 1xik n ASP 257 Cb 0.10 -0.39 -0.03 0.00 -0.72 0.00 0.00 41.12 40.08 1xik n ASP 257 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1xik s ASP 258 N -6.56 -0.52 0.28 1.67 2.15 -1.24 -4.72 116.67 107.72 1xik s ASP 258 Ca -0.26 -0.30 0.01 0.00 0.43 0.00 0.00 52.55 52.43 1xik s ASP 258 Cb 0.08 1.51 0.62 0.00 -0.30 0.00 0.00 42.92 44.83 1xik s ASP 258 CO 0.70 -0.31 1.73 -0.65 -0.17 0.00 0.00 175.17 176.47 1xik h PRO 259 N 7.89 0.49 -0.20 4.34 0.11 -1.90 0.21 132.00 142.95 1xik h PRO 259 Ca -0.03 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.96 1xik h PRO 259 Cb 1.15 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1xik h PRO 259 CO 0.20 0.33 -0.26 1.49 -0.21 0.00 0.00 178.00 179.54 1xik h GLU 260 N 0.51 0.38 -0.48 1.05 4.81 -1.95 -1.70 114.58 117.20 1xik h GLU 260 Ca 0.51 -0.14 -0.06 0.00 -0.13 0.00 0.00 59.36 59.54 1xik h GLU 260 Cb 0.85 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.18 1xik h GLU 260 CO -0.44 0.62 0.08 1.98 -0.73 0.00 0.00 179.01 180.51 1xik h MET 261 N 0.34 0.79 -0.73 1.92 4.05 -0.96 -0.15 114.93 120.19 1xik h MET 261 Ca 0.05 -0.21 0.08 0.00 -0.28 0.00 0.00 59.70 59.34 1xik h MET 261 Cb 0.64 -0.09 -0.07 0.00 -0.80 0.00 0.00 31.60 31.29 1xik h MET 261 CO 0.05 0.80 0.40 0.00 0.23 0.00 0.00 176.91 178.38 1xik h ALA 262 N 0.96 1.01 -0.60 0.39 0.00 -0.26 0.98 119.26 121.73 1xik h ALA 262 Ca 0.15 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1xik h ALA 262 Cb 0.39 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1xik h ALA 262 CO 0.01 0.03 0.27 0.93 0.00 0.00 0.00 179.25 180.49 1xik h GLU 263 N 0.69 0.88 -0.37 0.00 5.08 -0.97 -2.10 114.58 117.79 1xik h GLU 263 Ca 0.35 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.53 1xik h GLU 263 Cb 0.30 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 1xik h GLU 263 CO -0.23 0.73 0.10 0.82 -1.00 0.00 0.00 179.01 179.43 1xik h ILE 264 N 0.83 1.22 -0.48 3.13 2.04 0.53 -2.50 117.51 122.28 1xik h ILE 264 Ca 0.20 -0.75 0.02 0.00 1.00 0.00 0.00 64.86 65.34 1xik h ILE 264 Cb 0.16 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 1xik h ILE 264 CO -0.02 0.26 0.29 0.00 0.00 0.00 0.00 178.15 178.67 1xik h ALA 265 N 0.94 0.61 -0.80 1.87 0.00 -0.69 -0.70 119.26 120.49 1xik h ALA 265 Ca 0.12 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.08 1xik h ALA 265 Cb 0.29 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 1xik h ALA 265 CO -0.00 -0.01 0.48 1.49 0.00 0.00 0.00 179.25 181.21 1xik h GLU 266 N 0.58 0.85 0.00 0.00 4.57 -1.32 -1.69 114.58 117.57 1xik h GLU 266 Ca 0.19 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 58.28 1xik h GLU 266 Cb 0.01 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 1xik h GLU 266 CO -0.08 0.56 -0.20 1.49 -1.18 0.00 0.00 179.01 179.59 1xik h GLU 267 N 0.87 0.00 -0.39 1.92 4.81 -0.91 -3.06 114.58 117.83 1xik h GLU 267 Ca 0.36 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.59 1xik h GLU 267 Cb 0.20 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 1xik h GLU 267 CO -0.18 0.20 0.00 0.00 -0.73 0.00 0.00 179.01 178.30 1xik h LYS 269 N 2.66 -0.12 -0.85 0.00 1.57 -1.24 0.13 116.57 118.73 1xik h LYS 269 Ca 0.00 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.81 1xik h LYS 269 Cb 1.67 0.03 -0.05 0.00 0.08 0.00 0.00 32.23 33.96 1xik h LYS 269 CO 0.33 -0.08 0.56 0.37 -0.57 0.00 0.00 179.45 180.06 1xik h GLN 270 N -0.12 1.06 -0.53 3.15 5.75 -1.86 0.14 115.11 122.70 1xik h GLN 270 Ca 0.20 -0.06 -0.07 0.00 -0.15 0.00 0.00 58.65 58.56 1xik h GLN 270 Cb 0.43 -0.24 -0.02 0.00 1.07 0.00 0.00 27.48 28.73 1xik h GLN 270 CO -0.49 0.70 0.05 1.49 -2.65 0.00 0.00 178.83 177.93 1xik h GLU 271 N 1.10 0.90 -0.49 1.69 4.81 -1.59 -0.04 114.58 120.96 1xik h GLU 271 Ca 0.32 -0.26 -0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1xik h GLU 271 Cb -0.05 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 1xik h GLU 271 CO -0.08 0.90 0.14 0.00 -0.73 0.00 0.00 179.01 179.24 1xik h TYR 273 N 0.66 -0.11 -0.99 0.00 5.03 -0.55 -1.80 116.97 119.21 1xik h TYR 273 Ca 0.16 0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.49 1xik h TYR 273 Cb 0.29 0.05 -0.05 0.00 1.55 0.00 0.00 36.73 38.57 1xik h TYR 273 CO 0.02 -0.07 0.65 -0.44 -1.32 0.00 0.00 178.16 177.00 1xik h ASP 274 N -0.07 1.11 0.51 -2.11 3.32 -0.89 0.30 116.42 118.59 1xik h ASP 274 Ca 0.03 -0.02 -0.16 0.00 0.02 0.00 0.00 57.03 56.90 1xik h ASP 274 Cb 0.11 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 1xik h ASP 274 CO -0.06 0.78 -0.69 0.17 -1.72 0.00 0.00 179.24 177.73 1xik h LEU 275 N 1.30 0.18 -0.34 1.55 8.10 -1.11 0.23 115.31 125.22 1xik h LEU 275 Ca 0.38 -0.11 -0.06 0.00 0.11 0.00 0.00 57.88 58.19 1xik h LEU 275 Cb -0.09 -0.05 -0.01 0.00 -0.44 0.00 0.00 40.66 40.07 1xik h LEU 275 CO -0.10 0.81 -0.03 0.15 -4.11 0.00 0.00 178.44 175.16 1xik h PHE 276 N 0.10 0.69 -0.68 0.17 3.04 -0.60 -0.55 116.94 119.12 1xik h PHE 276 Ca -0.01 -0.13 -0.04 0.00 3.98 0.00 0.00 57.97 61.76 1xik h PHE 276 Cb 1.22 -0.18 -0.03 0.00 2.56 0.00 0.00 35.95 39.52 1xik h PHE 276 CO 0.02 0.76 0.26 0.28 -2.02 0.00 0.00 178.31 177.60 1xik h VAL 277 N 0.43 1.24 -0.42 1.41 2.07 -0.80 -2.22 116.25 117.96 1xik h VAL 277 Ca 0.09 -0.78 -0.03 0.00 0.82 0.00 0.00 66.70 66.80 1xik h VAL 277 Cb 0.50 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1xik h VAL 277 CO 0.02 0.31 0.14 -0.61 0.02 0.00 0.00 177.57 177.45 1xik h GLN 278 N 0.97 0.60 -0.46 1.57 5.75 -0.29 0.12 115.11 123.38 1xik h GLN 278 Ca 0.22 -0.09 -0.07 0.00 -0.15 0.00 0.00 58.65 58.57 1xik h GLN 278 Cb 0.23 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.65 1xik h GLN 278 CO -0.02 0.52 0.03 0.00 -2.65 0.00 0.00 178.83 176.71 1xik h ALA 279 N 1.56 0.61 -0.18 3.38 0.00 -0.53 -1.78 119.26 122.32 1xik h ALA 279 Ca 0.14 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.81 1xik h ALA 279 Cb 0.17 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1xik h ALA 279 CO -0.01 0.38 0.08 0.00 0.00 0.00 0.00 179.25 179.71 1xik h ALA 280 N 0.93 0.21 -0.48 0.00 0.00 -0.83 -2.27 119.26 116.82 1xik h ALA 280 Ca 0.13 0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.15 1xik h ALA 280 Cb 0.46 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.15 1xik h ALA 280 CO 0.02 -0.34 -0.03 0.37 0.00 0.00 0.00 179.25 179.26 1xik h GLN 281 N 0.18 0.08 -0.63 0.00 5.75 -0.59 -0.81 115.11 119.10 1xik h GLN 281 Ca 0.08 -0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.58 1xik h GLN 281 Cb 0.03 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.53 1xik h GLN 281 CO -0.06 0.05 0.42 1.96 -2.65 0.00 0.00 178.83 178.55 1xik h GLN 282 N 0.08 0.83 -0.27 1.69 4.20 -0.83 0.32 115.11 121.13 1xik h GLN 282 Ca 0.24 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.78 1xik h GLN 282 Cb 0.37 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 1xik h GLN 282 CO -0.43 0.55 -0.34 0.93 -0.67 0.00 0.00 178.83 178.87 1xik h GLU 283 N 0.85 0.58 0.32 1.46 4.39 -0.77 -0.05 114.58 121.38 1xik h GLU 283 Ca 0.23 -0.27 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 1xik h GLU 283 Cb -0.09 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.55 1xik h GLU 283 CO -0.05 0.84 -0.16 0.87 -1.16 0.00 0.00 179.01 179.35 1xik h LYS 284 N 0.49 -0.42 -0.66 2.33 1.57 0.34 -2.22 116.57 118.01 1xik h LYS 284 Ca 0.06 0.03 0.19 0.00 -1.87 0.00 0.00 60.65 59.06 1xik h LYS 284 Cb 0.82 0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.20 1xik h LYS 284 CO 0.07 -0.09 0.58 -0.44 -0.57 0.00 0.00 179.45 179.00 1xik h ASP 285 N -0.83 0.00 0.50 0.86 3.32 -0.30 0.27 116.42 120.24 1xik h ASP 285 Ca -0.04 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 1xik h ASP 285 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 1xik h ASP 285 CO 0.07 0.00 -0.24 -0.25 -1.72 0.00 0.00 179.24 177.10 1xik h TRP 286 N 0.00 -0.62 -0.97 4.55 7.01 -0.54 -3.00 115.95 122.37 1xik h TRP 286 Ca 0.31 -0.01 0.26 0.00 2.11 0.00 0.00 58.89 61.56 1xik h TRP 286 Cb 1.48 0.21 -0.06 0.00 -2.10 0.00 0.00 29.16 28.69 1xik h TRP 286 CO 0.00 -0.35 0.68 0.00 -2.79 0.00 0.00 178.44 175.98 1xik h ALA 287 N -1.04 2.64 0.19 2.65 0.00 -0.44 0.34 119.26 123.60 1xik h ALA 287 Ca -0.07 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1xik h ALA 287 Cb 0.56 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1xik h ALA 287 CO 0.11 -0.95 -0.09 -0.44 0.00 0.00 0.00 179.25 177.88 1xik h ASP 288 N 0.16 -0.21 0.89 0.00 3.32 -0.92 -2.71 116.42 116.95 1xik h ASP 288 Ca 0.49 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.46 1xik h ASP 288 Cb 1.65 0.05 0.01 0.00 0.22 0.00 0.00 39.33 41.27 1xik h ASP 288 CO -0.10 -0.11 -0.43 0.22 -1.72 0.00 0.00 179.24 177.11 1xik h TYR 289 N -0.30 -1.11 -0.47 4.55 3.20 -0.88 -3.16 116.97 118.81 1xik h TYR 289 Ca -0.03 -0.03 0.08 0.00 3.14 0.00 0.00 58.73 61.90 1xik h TYR 289 Cb 0.23 0.37 -0.08 0.00 1.54 0.00 0.00 36.73 38.79 1xik h TYR 289 CO -0.05 -0.69 -0.15 -0.11 -1.64 0.00 0.00 178.16 175.52 1xik n LEU 290 N -5.26 -0.24 -0.67 2.82 -0.00 -0.38 -0.72 117.00 112.54 1xik n LEU 290 Ca -0.15 0.81 0.11 0.00 -0.00 0.00 0.00 56.01 56.79 1xik n LEU 290 Cb 0.47 -0.21 0.35 0.00 -0.00 0.00 0.00 43.42 44.03 1xik n LEU 290 CO 0.36 -0.75 0.77 0.49 -0.00 0.00 0.00 177.39 178.26 1xik n PHE 291 N -4.72 0.20 0.14 1.96 3.01 -1.03 -4.45 117.46 112.58 1xik n PHE 291 Ca 0.06 -0.10 -0.01 0.00 1.01 0.00 0.00 57.45 58.41 1xik n PHE 291 Cb 0.21 0.00 0.19 0.00 -0.01 0.00 0.00 39.48 39.87 1xik n PHE 291 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 1xik h ARG 292 N 2.82 0.01 -0.02 -1.08 1.12 -0.89 -3.03 114.38 113.32 1xik h ARG 292 Ca 0.00 -0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.86 1xik h ARG 292 Cb 0.61 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.57 1xik h ARG 292 CO 0.00 0.59 -0.04 -0.40 -3.11 0.00 0.00 179.97 177.01 1xik n ASP 293 N -3.85 1.69 0.00 -3.80 5.68 -1.26 -4.97 116.55 110.04 1xik n ASP 293 Ca -0.01 -1.51 0.00 0.00 -0.50 0.00 0.00 54.79 52.77 1xik n ASP 293 Cb 0.59 0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.59 1xik n ASP 293 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1xik n GLY 294 N 1.23 4.11 3.68 6.12 0.00 -1.15 -4.82 105.19 114.36 1xik n GLY 294 Ca 0.17 -0.59 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 1xik n GLY 294 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xik s SER 295 N 0.00 6.79 1.01 1.61 1.04 -1.22 -4.66 113.70 118.27 1xik s SER 295 Ca 0.00 0.96 -0.23 0.00 0.48 0.00 0.00 55.95 57.16 1xik s SER 295 Cb 0.00 -2.37 -0.16 0.00 0.10 0.00 0.00 66.02 63.59 1xik s SER 295 CO 0.00 -0.22 -1.17 0.80 0.98 0.00 0.00 173.24 173.63 1xik n MET 296 N 4.63 -0.10 -2.81 4.02 1.56 -1.24 -4.87 117.12 118.30 1xik n MET 296 Ca -0.01 -0.03 -0.43 0.00 -0.27 0.00 0.00 57.70 56.96 1xik n MET 296 Cb 0.50 -1.07 -0.04 0.00 2.15 0.00 0.00 33.22 34.77 1xik n MET 296 CO 0.00 0.00 0.00 0.96 -0.73 0.00 0.00 175.97 176.20 1xik s ILE 297 N -2.03 4.31 0.00 1.12 -4.36 -1.26 -3.72 121.20 115.26 1xik s ILE 297 Ca 0.39 0.13 0.00 0.00 -0.26 0.00 0.00 60.65 60.91 1xik s ILE 297 Cb -0.01 -4.62 0.00 0.00 1.25 0.00 0.00 42.46 39.09 1xik s ILE 297 CO 0.72 -1.28 0.00 0.61 0.24 0.00 0.00 174.94 175.23 1xik n GLY 298 N 5.20 1.58 2.95 6.27 0.00 -1.26 -4.91 105.19 115.01 1xik n GLY 298 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 1xik n GLY 298 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xik s LEU 299 N 0.00 2.03 0.25 0.99 2.96 -1.24 -5.08 118.68 118.58 1xik s LEU 299 Ca 0.00 -0.22 -0.11 0.00 -0.22 0.00 0.00 54.13 53.58 1xik s LEU 299 Cb 0.00 0.13 -0.01 0.00 0.50 0.00 0.00 46.19 46.82 1xik s LEU 299 CO 0.00 -0.17 0.45 0.54 -1.32 0.00 0.00 176.35 175.85 1xik s ASN 300 N -0.76 -0.05 0.25 3.68 2.20 -1.26 -3.70 114.94 115.30 1xik s ASN 300 Ca -0.08 -0.99 -0.04 0.00 -0.94 0.00 0.00 52.86 50.81 1xik s ASN 300 Cb -0.05 0.57 0.48 0.00 -2.00 0.00 0.00 41.25 40.25 1xik s ASN 300 CO -0.00 -1.12 1.69 0.07 -2.94 0.00 0.00 177.10 174.80 1xik h LYS 301 N 2.28 0.28 -0.18 3.55 -0.00 -1.93 -1.29 116.57 119.29 1xik h LYS 301 Ca -0.27 -0.02 -0.01 0.00 -0.00 0.00 0.00 60.65 60.35 1xik h LYS 301 Cb 1.25 -0.06 -0.01 0.00 -0.00 0.00 0.00 32.23 33.41 1xik h LYS 301 CO 0.37 0.19 0.07 -0.44 -0.00 0.00 0.00 179.45 179.64 1xik h ASP 302 N 0.29 0.25 -0.50 7.07 3.32 -1.96 0.53 116.42 125.42 1xik h ASP 302 Ca 0.43 -0.17 -0.08 0.00 0.02 0.00 0.00 57.03 57.22 1xik h ASP 302 Cb 0.73 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.19 1xik h ASP 302 CO -0.50 0.35 -0.01 0.40 -1.72 0.00 0.00 179.24 177.75 1xik h ILE 303 N 0.13 1.26 -0.16 0.35 2.04 -1.90 -1.41 117.51 117.82 1xik h ILE 303 Ca 0.06 -1.10 0.00 0.00 1.00 0.00 0.00 64.86 64.82 1xik h ILE 303 Cb 0.18 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1xik h ILE 303 CO -0.00 0.39 0.10 0.25 0.00 0.00 0.00 178.15 178.88 1xik h LEU 304 N 0.76 0.16 -1.25 1.44 5.85 -1.05 -0.24 115.31 120.98 1xik h LEU 304 Ca 0.14 -0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.90 1xik h LEU 304 Cb 0.54 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.49 1xik h LEU 304 CO 0.03 0.12 0.53 0.00 -0.34 0.00 0.00 178.44 178.77 1xik h GLN 306 N 0.95 1.02 -0.55 0.00 1.08 -0.46 -2.00 115.11 115.16 1xik h GLN 306 Ca 0.33 -0.37 0.01 0.00 -1.45 0.00 0.00 58.65 57.17 1xik h GLN 306 Cb 0.10 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.43 1xik h GLN 306 CO -0.10 1.06 0.35 -0.92 -0.95 0.00 0.00 178.83 178.27 1xik h TYR 307 N 0.91 0.66 -0.47 2.96 3.20 -0.25 0.12 116.97 124.11 1xik h TYR 307 Ca 0.14 0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.07 1xik h TYR 307 Cb 0.67 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.68 1xik h TYR 307 CO 0.04 0.40 0.21 0.28 -1.64 0.00 0.00 178.16 177.46 1xik h VAL 308 N 0.71 0.93 -0.79 1.81 2.07 -0.93 0.15 116.25 120.20 1xik h VAL 308 Ca 0.21 -0.15 -0.04 0.00 0.82 0.00 0.00 66.70 67.54 1xik h VAL 308 Cb -0.04 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.16 1xik h VAL 308 CO -0.06 0.08 0.33 -0.33 0.02 0.00 0.00 177.57 177.61 1xik h GLU 309 N 0.43 1.17 0.16 1.57 5.08 -0.76 0.27 114.58 122.50 1xik h GLU 309 Ca 0.21 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1xik h GLU 309 Cb 0.15 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1xik h GLU 309 CO -0.17 0.94 -0.08 -0.92 -1.00 0.00 0.00 179.01 177.78 1xik h TYR 310 N 1.14 -0.20 -0.17 4.33 3.20 0.00 -1.24 116.97 124.03 1xik h TYR 310 Ca 0.27 -0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.97 1xik h TYR 310 Cb 0.19 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 1xik h TYR 310 CO 0.02 -0.05 -0.57 -0.84 -1.64 0.00 0.00 178.16 175.08 1xik h ILE 311 N -0.31 1.33 -0.77 1.81 3.07 -0.54 -2.89 117.51 119.21 1xik h ILE 311 Ca -0.02 -1.83 0.08 0.00 1.55 0.00 0.00 64.86 64.64 1xik h ILE 311 Cb 0.25 1.81 -0.07 0.00 -0.27 0.00 0.00 36.82 38.54 1xik h ILE 311 CO 0.04 0.57 0.43 0.74 -1.05 0.00 0.00 178.15 178.87 1xik h THR 312 N 0.40 0.93 -0.51 0.16 2.02 -0.86 0.26 112.91 115.31 1xik h THR 312 Ca 0.00 -0.26 -0.03 0.00 0.77 0.00 0.00 66.41 66.90 1xik h THR 312 Cb 1.11 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 1xik h THR 312 CO 0.10 0.14 0.22 0.78 0.37 0.00 0.00 175.52 177.13 1xik h ASN 313 N 0.75 0.69 -0.32 4.18 4.21 -1.10 0.36 115.58 124.36 1xik h ASN 313 Ca 0.36 -0.15 -0.02 0.00 1.21 0.00 0.00 56.30 57.69 1xik h ASN 313 Cb 0.30 -0.18 -0.01 0.00 -1.12 0.00 0.00 38.32 37.30 1xik h ASN 313 CO -0.23 0.65 0.10 0.40 -1.29 0.00 0.00 177.43 177.07 1xik h ILE 314 N 0.68 1.20 -0.27 2.81 2.04 -1.00 -2.15 117.51 120.82 1xik h ILE 314 Ca 0.17 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 1xik h ILE 314 Cb 0.17 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 1xik h ILE 314 CO -0.02 0.22 0.11 0.03 0.00 0.00 0.00 178.15 178.50 1xik h ARG 315 N 0.36 0.41 -1.01 2.37 2.47 -0.34 -2.51 114.38 116.12 1xik h ARG 315 Ca 0.10 -0.07 0.01 0.00 -1.26 0.00 0.00 59.98 58.76 1xik h ARG 315 Cb 0.24 -0.07 -0.05 0.00 -1.65 0.00 0.00 29.97 28.44 1xik h ARG 315 CO -0.00 0.43 0.67 0.52 0.56 0.00 0.00 179.97 182.14 1xik h MET 316 N 0.30 1.32 -0.57 0.04 2.86 -0.87 -2.47 114.93 115.54 1xik h MET 316 Ca 0.09 -0.08 -0.05 0.00 -2.06 0.00 0.00 59.70 57.60 1xik h MET 316 Cb 0.17 -0.30 -0.02 0.00 0.06 0.00 0.00 31.60 31.51 1xik h MET 316 CO -0.01 0.88 0.16 0.37 1.06 0.00 0.00 176.91 179.36 1xik h GLN 317 N 1.36 0.89 -0.37 1.72 4.15 -1.28 0.57 115.11 122.16 1xik h GLN 317 Ca 0.37 -0.20 0.11 0.00 0.77 0.00 0.00 58.65 59.69 1xik h GLN 317 Cb -0.16 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.40 1xik h GLN 317 CO -0.08 0.82 0.35 0.00 -1.93 0.00 0.00 178.83 177.99 1xik h ALA 318 N 1.03 2.11 -0.26 3.38 0.00 -0.99 -0.60 119.26 123.93 1xik h ALA 318 Ca 0.18 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 1xik h ALA 318 Cb 0.31 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.06 1xik h ALA 318 CO -0.00 -0.54 -0.16 1.33 0.00 0.00 0.00 179.25 179.88 1xik n VAL 319 N -3.89 2.44 -2.13 0.00 0.24 -1.11 -4.96 118.33 108.92 1xik n VAL 319 Ca 0.06 -2.78 -0.10 0.00 -2.04 0.00 0.00 64.34 59.48 1xik n VAL 319 Cb 0.52 -0.30 -0.01 0.00 -1.47 0.00 0.00 33.84 32.59 1xik n VAL 319 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xik n GLY 320 N -1.10 0.04 3.76 7.63 0.00 -0.23 -4.96 105.19 110.32 1xik n GLY 320 Ca 0.29 -0.46 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 1xik n GLY 320 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xik s LEU 321 N -2.93 3.67 0.52 0.99 1.43 0.18 -5.00 118.68 117.53 1xik s LEU 321 Ca 0.00 -0.18 -0.21 0.00 -1.03 0.00 0.00 54.13 52.71 1xik s LEU 321 Cb 0.00 -2.30 -0.06 0.00 0.03 0.00 0.00 46.19 43.86 1xik s LEU 321 CO 0.00 0.09 1.22 -1.81 0.23 0.00 0.00 176.35 176.08 1xik s ASP 322 N -2.93 5.67 0.11 2.29 1.01 -1.26 -3.75 116.67 117.82 1xik s ASP 322 Ca 0.30 2.42 -0.31 0.00 0.71 0.00 0.00 52.55 55.67 1xik s ASP 322 Cb -0.10 -2.61 -0.07 0.00 1.01 0.00 0.00 42.92 41.15 1xik s ASP 322 CO 0.22 -1.27 1.27 -0.76 0.21 0.00 0.00 175.17 174.84 1xik s LEU 323 N -3.47 4.39 0.18 1.23 1.43 -1.26 -4.85 118.68 116.32 1xik s LEU 323 Ca 0.70 2.18 0.22 0.00 -1.03 0.00 0.00 54.13 56.21 1xik s LEU 323 Cb -0.31 -3.59 -0.03 0.00 0.03 0.00 0.00 46.19 42.28 1xik s LEU 323 CO 0.37 -0.52 0.99 -0.81 0.23 0.00 0.00 176.35 176.61 1xik n PRO 324 N 3.58 0.61 -4.50 1.29 -0.04 -1.26 -4.98 135.00 129.69 1xik n PRO 324 Ca 0.09 0.09 -0.30 0.00 -0.04 0.00 0.00 63.50 63.33 1xik n PRO 324 Cb 0.44 -1.79 -0.06 0.00 -0.04 0.00 0.00 33.50 32.05 1xik n PRO 324 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1xik n PHE 325 N -2.63 1.08 -2.46 0.54 3.72 -1.26 -5.10 117.46 111.35 1xik n PHE 325 Ca -0.00 -2.35 -0.42 0.00 -0.05 0.00 0.00 57.45 54.62 1xik n PHE 325 Cb 0.55 -0.31 -0.03 0.00 -0.94 0.00 0.00 39.48 38.76 1xik n PHE 325 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1xik s GLN 326 N -3.71 4.42 0.11 -1.08 0.74 -1.26 -4.98 119.66 113.89 1xik s GLN 326 Ca 0.01 1.70 -0.31 0.00 0.05 0.00 0.00 55.36 56.81 1xik s GLN 326 Cb 0.00 -3.43 -0.10 0.00 1.10 0.00 0.00 33.01 30.58 1xik s GLN 326 CO 0.00 -0.30 1.87 2.41 -0.55 0.00 0.00 175.29 178.72 1xik n THR 327 N 4.16 0.45 -3.99 -0.34 -1.04 -1.26 -4.88 114.28 107.39 1xik n THR 327 Ca 0.09 -0.08 -0.10 0.00 -2.04 0.00 0.00 64.05 61.93 1xik n THR 327 Cb 0.47 -2.17 -0.06 0.00 -1.82 0.00 0.00 70.33 66.74 1xik n THR 327 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xik s ARG 328 N 3.10 1.33 0.58 -2.82 1.70 -1.26 -5.17 118.95 116.42 1xik s ARG 328 Ca 0.83 -1.23 -0.01 0.00 -0.47 0.00 0.00 55.73 54.85 1xik s ARG 328 Cb -0.47 0.41 0.04 0.00 -0.57 0.00 0.00 34.95 34.36 1xik s ARG 328 CO 0.38 -0.52 0.84 -1.54 -1.08 0.00 0.00 175.30 173.38 1xik s SER 329 N -3.00 5.22 0.21 -2.89 1.04 -1.26 -4.98 113.70 108.04 1xik s SER 329 Ca 0.21 0.18 -0.32 0.00 0.48 0.00 0.00 55.95 56.50 1xik s SER 329 Cb 0.02 -1.04 -0.12 0.00 0.10 0.00 0.00 66.02 64.98 1xik s SER 329 CO 0.05 -1.22 1.73 -3.20 0.98 0.00 0.00 173.24 171.57 1xik n ASN 330 N -2.48 4.02 0.20 7.02 2.85 -1.26 -4.87 115.26 120.73 1xik n ASN 330 Ca 0.07 1.06 0.13 0.00 -0.11 0.00 0.00 54.58 55.74 1xik n ASN 330 Cb 0.60 -1.58 0.33 0.00 1.24 0.00 0.00 39.78 40.37 1xik n ASN 330 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1xik h PRO 331 N 6.75 0.00 -2.08 1.20 0.13 -1.93 -3.36 132.00 132.71 1xik h PRO 331 Ca -0.43 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.18 1xik h PRO 331 Cb 1.20 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.93 1xik h PRO 331 CO 0.96 0.00 -1.03 0.44 -0.23 0.00 0.00 178.00 178.14 1xik n ILE 332 N -2.85 0.62 0.28 -3.56 -5.35 -1.26 -4.93 119.36 102.31 1xik n ILE 332 Ca 0.04 -4.76 0.15 0.00 -0.27 0.00 0.00 62.75 57.90 1xik n ILE 332 Cb 0.45 -0.87 0.71 0.00 -1.74 0.00 0.00 39.64 38.19 1xik n ILE 332 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1xik h PRO 333 N 3.21 0.00 0.00 6.28 0.13 -1.99 0.36 132.00 139.99 1xik h PRO 333 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1xik h PRO 333 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1xik h PRO 333 CO 0.58 0.00 0.00 0.11 -0.23 0.00 0.00 178.00 178.46 1xik h TRP 334 N 0.00 0.00 -0.60 1.56 5.08 -1.96 -2.17 115.95 117.87 1xik h TRP 334 Ca 0.05 0.00 0.01 0.00 1.08 0.00 0.00 58.89 60.03 1xik h TRP 334 Cb 0.93 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 27.06 1xik h TRP 334 CO 0.00 0.00 0.40 0.97 -1.28 0.00 0.00 178.44 178.53 1xik h ILE 335 N 0.00 1.13 -0.06 0.12 2.10 -0.70 -2.28 117.51 117.82 1xik h ILE 335 Ca 0.00 -0.27 0.02 0.00 1.08 0.00 0.00 64.86 65.69 1xik h ILE 335 Cb 0.26 0.28 -0.00 0.00 -1.09 0.00 0.00 36.82 36.28 1xik h ILE 335 CO 0.00 0.14 0.39 0.78 -1.08 0.00 0.00 178.15 178.38 1xik h ASN 336 N 0.78 0.00 0.94 2.19 2.35 -1.58 0.25 115.58 120.51 1xik h ASN 336 Ca 0.22 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.95 1xik h ASN 336 Cb -0.04 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.32 1xik h ASN 336 CO -0.05 0.00 -0.11 0.74 -1.65 0.00 0.00 177.43 176.35 1xik h THR 337 N 0.00 0.30 0.00 2.81 2.02 -1.62 -2.94 112.91 113.47 1xik h THR 337 Ca 0.03 -0.80 -0.14 0.00 0.77 0.00 0.00 66.41 66.26 1xik h THR 337 Cb 0.80 1.62 -0.03 0.00 -1.74 0.00 0.00 68.15 68.80 1xik h THR 337 CO -0.00 0.11 -2.15 0.79 0.37 0.00 0.00 175.52 174.64 1xik n TRP 338 N -3.27 0.00 -3.27 3.16 7.02 0.84 -4.66 117.44 117.26 1xik n TRP 338 Ca 0.00 0.00 -0.46 0.00 -1.02 0.00 0.00 57.50 56.02 1xik n TRP 338 Cb 0.36 -0.70 -0.02 0.00 -2.42 0.00 0.00 31.31 28.54 1xik n TRP 338 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1xik s LEU 339 N -4.90 6.40 0.11 -0.99 1.43 -0.84 -4.80 118.68 115.09 1xik s LEU 339 Ca -0.09 -2.81 0.07 0.00 -1.03 0.00 0.00 54.13 50.27 1xik s LEU 339 Cb 0.11 -2.24 0.39 0.00 0.03 0.00 0.00 46.19 44.48 1xik s LEU 339 CO 0.88 -0.58 1.20 1.33 0.23 0.00 0.00 176.35 179.41 1xik n VAL 340 N 3.92 1.59 1.24 -1.59 0.24 -1.26 -4.85 118.33 117.62 1xik n VAL 340 Ca 0.18 0.58 0.13 0.00 -2.04 0.00 0.00 64.34 63.19 1xik n VAL 340 Cb 0.46 -1.58 0.30 0.00 -1.47 0.00 0.00 33.84 31.55 1xik n VAL 340 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49