#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 3.62 -0.01 0.00 5.04 -1.26 -5.02 117.35 119.71 1xik s TYR 2 Ca 0.00 1.29 -0.01 0.00 -2.44 0.00 0.00 57.07 55.92 1xik s TYR 2 Cb 0.00 -2.55 0.00 0.00 0.35 0.00 0.00 41.96 39.76 1xik s TYR 2 CO 0.00 0.34 0.03 -0.08 -1.34 0.00 0.00 175.55 174.49 1xik s THR 3 N -1.55 -0.00 -0.94 4.34 -1.32 -1.26 -5.00 115.64 109.91 1xik s THR 3 Ca 0.43 0.02 0.18 0.00 -1.21 0.00 0.00 61.69 61.10 1xik s THR 3 Cb -0.16 -0.05 0.16 0.00 -1.51 0.00 0.00 72.50 70.94 1xik s THR 3 CO 0.20 0.01 1.57 0.35 -2.21 0.00 0.00 174.62 174.54 1xik n THR 4 N 3.16 0.82 -3.26 5.08 -2.24 -1.26 -4.33 114.28 112.24 1xik n THR 4 Ca -0.13 0.20 -0.05 0.00 -2.27 0.00 0.00 64.05 61.79 1xik n THR 4 Cb 0.59 -0.93 -0.03 0.00 -2.10 0.00 0.00 70.33 67.86 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 -3.04 -1.23 0.23 4.78 5.36 -1.26 -4.89 117.98 117.93 1xik s PHE 5 Ca 0.08 -0.13 -0.31 0.00 -0.96 0.00 0.00 56.93 55.61 1xik s PHE 5 Cb 0.11 0.06 -0.11 0.00 -0.34 0.00 0.00 43.02 42.75 1xik s PHE 5 CO 0.33 -1.11 1.57 -1.54 -1.46 0.00 0.00 175.22 173.01 1xik s SER 6 N 1.70 6.51 0.00 6.13 1.04 -1.26 -4.91 113.70 122.91 1xik s SER 6 Ca 0.16 2.76 0.27 0.00 0.48 0.00 0.00 55.95 59.62 1xik s SER 6 Cb -0.08 -2.61 1.30 0.00 0.10 0.00 0.00 66.02 64.73 1xik s SER 6 CO -0.06 -0.84 1.88 0.00 0.98 0.00 0.00 173.24 175.20 1xik n GLN 7 N 3.07 1.38 -3.40 4.02 1.13 -1.26 -4.76 117.38 117.56 1xik n GLN 7 Ca 0.11 -0.56 -0.38 0.00 -1.94 0.00 0.00 57.00 54.23 1xik n GLN 7 Cb 0.38 -1.45 -0.06 0.00 0.11 0.00 0.00 30.24 29.22 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 -1.97 4.96 -0.59 5.09 2.01 -1.26 -4.99 115.64 118.89 1xik s THR 8 Ca 0.40 0.98 -0.28 0.00 0.31 0.00 0.00 61.69 63.10 1xik s THR 8 Cb 0.20 -3.79 0.03 0.00 0.01 0.00 0.00 72.50 68.95 1xik s THR 8 CO 0.32 0.53 1.19 -0.75 -0.69 0.00 0.00 174.62 175.22 1xik s LYS 9 N -0.78 3.49 0.13 4.92 2.20 -1.26 -4.99 119.74 123.44 1xik s LYS 9 Ca 0.26 0.21 0.09 0.00 -0.36 0.00 0.00 55.97 56.17 1xik s LYS 9 Cb -0.17 -4.02 -0.04 0.00 -1.51 0.00 0.00 37.83 32.08 1xik s LYS 9 CO 0.15 -1.71 -0.19 0.54 -0.36 0.00 0.00 175.35 173.78 1xik s ASN 10 N 3.00 3.82 -0.55 1.43 4.22 -1.26 -5.07 114.94 120.54 1xik s ASN 10 Ca 0.42 -0.60 -0.25 0.00 -2.14 0.00 0.00 52.86 50.29 1xik s ASN 10 Cb -0.08 -0.50 0.04 0.00 1.28 0.00 0.00 41.25 41.99 1xik s ASN 10 CO 0.25 0.17 1.01 -0.62 -2.04 0.00 0.00 177.10 175.86 1xik s ASP 11 N -2.20 6.39 0.57 3.54 -1.08 -1.26 -4.89 116.67 117.75 1xik s ASP 11 Ca 0.18 -0.16 0.38 0.00 -0.52 0.00 0.00 52.55 52.43 1xik s ASP 11 Cb -0.10 -2.47 1.95 0.00 -1.46 0.00 0.00 42.92 40.83 1xik s ASP 11 CO 0.10 -1.27 2.15 1.56 0.52 0.00 0.00 175.17 178.23 1xik h GLN 12 N 9.34 0.00 0.00 4.34 4.20 -1.98 -1.59 115.11 129.43 1xik h GLN 12 Ca -0.25 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.46 1xik h GLN 12 Cb 1.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.85 1xik h GLN 12 CO 1.11 0.00 0.00 -0.07 -0.67 0.00 0.00 178.83 179.20 1xik h LEU 13 N 0.00 0.00 -2.30 1.46 3.38 -1.96 -3.14 115.31 112.76 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 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 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 -2.60 1.97 -2.17 1.13 5.02 -0.60 -4.81 118.16 116.10 1xik n LYS 14 Ca 0.02 -1.74 -0.30 0.00 -2.02 0.00 0.00 58.31 54.27 1xik n LYS 14 Cb 0.27 -1.27 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 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 -1.00 3.60 0.74 1.97 0.41 -1.19 -5.05 118.70 118.18 1xik s GLU 15 Ca 0.21 0.57 -0.11 0.00 -0.41 0.00 0.00 54.97 55.22 1xik s GLU 15 Cb 0.12 -2.19 0.04 0.00 -1.78 0.00 0.00 34.13 30.32 1xik s GLU 15 CO 0.16 -0.42 1.09 -1.25 -0.49 0.00 0.00 175.26 174.35 1xik s PRO 16 N -4.95 2.54 0.23 0.39 0.04 -1.26 -4.92 135.00 127.07 1xik s PRO 16 Ca 0.53 0.59 -0.07 0.00 0.04 0.00 0.00 61.00 62.08 1xik s PRO 16 Cb -0.11 -1.97 0.20 0.00 0.04 0.00 0.00 34.50 32.66 1xik s PRO 16 CO 0.49 -1.29 1.82 0.52 0.04 0.00 0.00 177.00 178.59 1xik h MET 17 N -0.84 1.22 -5.48 4.56 2.86 -1.95 -3.37 114.93 111.93 1xik h MET 17 Ca -0.46 -0.18 -0.43 0.00 -2.06 0.00 0.00 59.70 56.58 1xik h MET 17 Cb 1.25 -0.22 -0.18 0.00 0.06 0.00 0.00 31.60 32.51 1xik h MET 17 CO 0.61 0.94 -0.76 -0.06 1.06 0.00 0.00 176.91 178.70 1xik s PHE 18 N -5.69 1.45 0.00 -0.22 0.08 -1.26 -0.98 117.98 111.36 1xik s PHE 18 Ca -0.12 -0.55 0.00 0.00 0.12 0.00 0.00 56.93 56.37 1xik s PHE 18 Cb 0.16 -0.75 0.00 0.00 -0.57 0.00 0.00 43.02 41.86 1xik s PHE 18 CO 0.83 0.17 0.00 1.19 -0.10 0.00 0.00 175.22 177.31 1xik n PHE 19 N 0.47 0.00 -0.80 0.36 3.72 0.15 -4.84 117.46 116.51 1xik n PHE 19 Ca -0.15 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.25 1xik n PHE 19 Cb 0.57 -0.93 0.00 0.00 -0.94 0.00 0.00 39.48 38.18 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 -1.36 -0.29 3.75 1.37 0.00 -1.26 -5.00 105.19 102.40 1xik n GLY 20 Ca 0.00 -1.74 -0.41 0.00 0.00 0.00 0.00 46.02 43.88 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 -0.63 4.47 0.52 1.61 0.74 -1.26 -4.80 119.66 120.31 1xik s GLN 21 Ca 0.00 2.01 -0.22 0.00 0.05 0.00 0.00 55.36 57.19 1xik s GLN 21 Cb 0.00 -3.16 -0.06 0.00 1.10 0.00 0.00 33.01 30.88 1xik s GLN 21 CO 0.00 -0.08 1.24 -2.30 -0.55 0.00 0.00 175.29 173.60 1xik n PRO 22 N 1.67 1.57 -1.82 1.67 -0.02 -1.26 -4.49 135.00 132.30 1xik n PRO 22 Ca 0.02 0.57 -0.42 0.00 -2.02 0.00 0.00 63.50 61.66 1xik n PRO 22 Cb 0.43 -2.42 -0.02 0.00 -0.02 0.00 0.00 33.50 31.47 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 -1.31 2.23 0.00 -1.45 1.01 -1.25 -4.55 120.40 115.07 1xik s VAL 23 Ca 0.70 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.85 1xik s VAL 23 Cb -0.45 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 32.82 1xik s VAL 23 CO 0.51 0.02 0.00 -0.46 0.00 0.00 0.00 175.10 175.17 1xik n ASN 24 N 2.89 0.00 -4.73 3.32 0.23 -1.26 -4.48 115.26 111.22 1xik n ASN 24 Ca 0.11 0.00 -0.41 0.00 -0.53 0.00 0.00 54.58 53.75 1xik n ASN 24 Cb 0.37 -0.16 -0.04 0.00 -2.08 0.00 0.00 39.78 37.87 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 -0.40 4.59 -0.57 3.53 1.01 -1.26 -4.95 120.40 122.35 1xik s VAL 25 Ca 0.00 1.96 -0.19 0.00 0.00 0.00 0.00 61.98 63.75 1xik s VAL 25 Cb 0.00 -4.27 0.09 0.00 0.00 0.00 0.00 36.38 32.20 1xik s VAL 25 CO 0.00 0.32 0.68 0.00 0.00 0.00 0.00 175.10 176.10 1xik s ALA 26 N 0.06 3.41 0.10 5.51 0.00 -1.26 -4.81 121.76 124.77 1xik s ALA 26 Ca 0.45 -2.13 0.07 0.00 0.00 0.00 0.00 51.96 50.36 1xik s ALA 26 Cb -0.22 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.38 1xik s ALA 26 CO 0.28 -2.26 -0.19 -0.98 0.00 0.00 0.00 175.76 172.61 1xik s ARG 27 N 2.65 1.04 -0.12 0.00 1.70 -1.26 -5.06 118.95 117.90 1xik s ARG 27 Ca 0.12 -1.11 0.15 0.00 -0.47 0.00 0.00 55.73 54.42 1xik s ARG 27 Cb -0.23 -1.22 0.35 0.00 -0.57 0.00 0.00 34.95 33.28 1xik s ARG 27 CO 0.07 0.28 1.17 0.66 -1.08 0.00 0.00 175.30 176.40 1xik n TYR 28 N 1.11 0.00 0.41 5.89 4.01 -1.26 -4.69 117.16 122.63 1xik n TYR 28 Ca -0.20 -0.99 0.12 0.00 -0.16 0.00 0.00 57.90 56.67 1xik n TYR 28 Cb 0.54 -0.18 0.10 0.00 -0.31 0.00 0.00 39.34 39.49 1xik n TYR 28 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1xik h ASP 29 N 0.70 0.00 -5.09 7.72 2.03 -2.03 -3.46 116.42 116.28 1xik h ASP 29 Ca -0.06 -0.16 -0.09 0.00 -0.73 0.00 0.00 57.03 55.99 1xik h ASP 29 Cb 1.27 0.00 -0.16 0.00 -0.83 0.00 0.00 39.33 39.61 1xik h ASP 29 CO 0.02 0.08 -0.30 0.00 -1.03 0.00 0.00 179.24 178.02 1xik s GLN 30 N -3.23 0.82 -0.02 4.15 -2.07 -1.26 -5.17 119.66 112.87 1xik s GLN 30 Ca 0.04 -0.68 -0.07 0.00 -1.82 0.00 0.00 55.36 52.83 1xik s GLN 30 Cb 0.12 0.35 0.01 0.00 -1.09 0.00 0.00 33.01 32.39 1xik s GLN 30 CO 0.75 -0.27 0.15 1.14 -1.32 0.00 0.00 175.29 175.74 1xik s GLN 31 N -3.05 0.37 -0.04 9.60 0.00 -1.26 -4.94 119.66 120.32 1xik s GLN 31 Ca -0.01 -0.14 -0.24 0.00 -0.00 0.00 0.00 55.36 54.97 1xik s GLN 31 Cb 0.01 0.16 -0.24 0.00 0.00 0.00 0.00 33.01 32.94 1xik s GLN 31 CO -0.07 -0.08 1.03 -0.22 0.00 0.00 0.00 175.29 175.96 1xik h LYS 32 N 4.94 0.21 -4.65 9.60 3.64 -1.87 -3.40 116.57 125.03 1xik h LYS 32 Ca -0.28 -0.22 -0.65 0.00 -1.27 0.00 0.00 60.65 58.22 1xik h LYS 32 Cb 1.20 0.06 -0.39 0.00 -0.41 0.00 0.00 32.23 32.69 1xik h LYS 32 CO 0.40 0.96 -0.76 0.71 -2.27 0.00 0.00 179.45 178.49 1xik s TYR 33 N -3.10 3.30 -0.00 1.91 2.02 -1.26 -4.97 117.35 115.24 1xik s TYR 33 Ca -0.15 -2.53 0.31 0.00 -0.37 0.00 0.00 57.07 54.32 1xik s TYR 33 Cb 0.01 -2.32 1.46 0.00 -0.40 0.00 0.00 41.96 40.71 1xik s TYR 33 CO 0.75 -0.90 1.93 0.38 -1.57 0.00 0.00 175.55 176.14 1xik h ASP 34 N 7.74 0.00 -0.82 2.29 2.03 -1.99 -2.66 116.42 123.01 1xik h ASP 34 Ca -0.12 0.00 0.06 0.00 -0.73 0.00 0.00 57.03 56.24 1xik h ASP 34 Cb 1.03 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 39.48 1xik h ASP 34 CO 0.48 0.00 0.54 -0.29 -1.03 0.00 0.00 179.24 178.94 1xik h ILE 35 N 0.00 1.05 -0.57 4.15 6.09 -1.98 -1.29 117.51 124.97 1xik h ILE 35 Ca 0.00 -0.31 -0.07 0.00 -1.37 0.00 0.00 64.86 63.11 1xik h ILE 35 Cb 0.25 0.06 -0.02 0.00 0.47 0.00 0.00 36.82 37.58 1xik h ILE 35 CO 0.00 0.17 0.08 -0.26 -3.07 0.00 0.00 178.15 175.07 1xik h PHE 36 N 0.91 0.96 -0.51 2.19 0.04 -1.81 -0.91 116.94 117.80 1xik h PHE 36 Ca 0.35 -0.12 -0.08 0.00 2.80 0.00 0.00 57.97 60.92 1xik h PHE 36 Cb 0.21 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.07 1xik h PHE 36 CO -0.00 0.83 0.01 1.49 -0.60 0.00 0.00 178.31 180.03 1xik h GLU 37 N 0.86 0.90 -0.71 1.51 4.57 -1.54 -0.59 114.58 119.59 1xik h GLU 37 Ca 0.18 -0.28 -0.05 0.00 -1.18 0.00 0.00 59.36 58.02 1xik h GLU 37 Cb 0.39 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 1xik h GLU 37 CO 0.01 0.93 0.25 0.87 -1.18 0.00 0.00 179.01 179.89 1xik h LYS 38 N 0.77 1.06 -0.45 1.92 1.57 -0.95 -1.68 116.57 118.81 1xik h LYS 38 Ca 0.15 -0.20 -0.12 0.00 -1.87 0.00 0.00 60.65 58.60 1xik h LYS 38 Cb 0.51 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1xik h LYS 38 CO 0.03 0.88 -0.19 -0.07 -0.57 0.00 0.00 179.45 179.53 1xik h LEU 39 N 1.03 0.96 -0.24 2.94 3.38 -0.71 -0.86 115.31 121.82 1xik h LEU 39 Ca 0.23 -0.39 0.05 0.00 0.09 0.00 0.00 57.88 57.86 1xik h LEU 39 Cb 0.24 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 1xik h LEU 39 CO -0.01 1.14 -0.04 0.40 0.09 0.00 0.00 178.44 180.01 1xik h ILE 40 N 0.77 0.78 -0.44 1.22 2.04 -0.74 0.28 117.51 121.42 1xik h ILE 40 Ca 0.10 -0.01 0.04 0.00 1.00 0.00 0.00 64.86 65.99 1xik h ILE 40 Cb 0.76 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 1xik h ILE 40 CO 0.06 0.00 0.21 -0.33 0.00 0.00 0.00 178.15 178.10 1xik h GLU 41 N 0.03 0.41 -0.28 2.37 5.08 -1.09 -0.17 114.58 120.92 1xik h GLU 41 Ca 0.12 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1xik h GLU 41 Cb 0.17 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1xik h GLU 41 CO -0.23 0.27 0.08 -0.22 -1.00 0.00 0.00 179.01 177.91 1xik h LYS 42 N 0.43 0.44 -0.44 2.33 3.64 -0.86 -0.37 116.57 121.74 1xik h LYS 42 Ca 0.19 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1xik h LYS 42 Cb 0.11 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1xik h LYS 42 CO -0.15 0.51 0.28 0.37 -2.27 0.00 0.00 179.45 178.20 1xik h GLN 43 N 0.29 0.58 -0.67 1.90 5.75 -0.61 -1.68 115.11 120.68 1xik h GLN 43 Ca 0.09 -0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.53 1xik h GLN 43 Cb 0.26 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 28.65 1xik h GLN 43 CO -0.00 0.40 0.33 -0.07 -2.65 0.00 0.00 178.83 176.84 1xik h LEU 44 N 0.59 0.85 -2.13 -2.39 3.38 -0.92 -1.13 115.31 113.56 1xik h LEU 44 Ca 0.16 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1xik h LEU 44 Cb -0.05 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.48 1xik h LEU 44 CO -0.03 0.71 -0.03 0.77 0.09 0.00 0.00 178.44 179.95 1xik h SER 45 N 0.94 0.00 -0.16 -0.43 4.64 -0.24 -2.11 113.55 116.19 1xik h SER 45 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1xik h SER 45 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1xik h SER 45 CO -0.03 0.03 0.00 0.49 -0.87 0.00 0.00 176.83 176.45 1xik n PHE 46 N -3.21 0.20 -1.59 4.77 3.72 -0.44 -4.99 117.46 115.91 1xik n PHE 46 Ca -0.01 -0.10 -0.56 0.00 -0.05 0.00 0.00 57.45 56.73 1xik n PHE 46 Cb 0.20 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.67 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 0.83 1.31 -4.01 1.38 7.35 -0.80 -4.97 117.46 118.55 1xik n PHE 47 Ca 0.17 0.81 -0.09 0.00 -0.76 0.00 0.00 57.45 57.58 1xik n PHE 47 Cb 0.47 -2.26 -0.08 0.00 0.35 0.00 0.00 39.48 37.96 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 0.89 0.48 -0.11 -5.13 1.48 -1.26 -5.13 118.94 110.15 1xik s TRP 48 Ca 0.90 -0.89 0.01 0.00 -1.06 0.00 0.00 56.10 55.06 1xik s TRP 48 Cb -1.12 -0.23 0.02 0.00 -1.16 0.00 0.00 33.47 30.98 1xik s TRP 48 CO 0.55 -0.56 -0.14 0.50 -4.06 0.00 0.00 176.95 173.24 1xik s ARG 49 N -3.95 2.15 0.15 3.25 3.52 -1.26 -5.04 118.95 117.77 1xik s ARG 49 Ca 0.14 -0.53 -0.27 0.00 -0.13 0.00 0.00 55.73 54.94 1xik s ARG 49 Cb 0.06 -1.86 -0.01 0.00 -1.56 0.00 0.00 34.95 31.57 1xik s ARG 49 CO -0.04 -0.09 1.58 -1.35 -0.81 0.00 0.00 175.30 174.59 1xik h PRO 50 N 7.51 -0.36 -0.73 5.12 0.11 -1.95 -0.08 132.00 141.63 1xik h PRO 50 Ca -0.32 0.02 0.21 0.00 0.11 0.00 0.00 66.00 66.03 1xik h PRO 50 Cb 1.17 0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 1xik h PRO 50 CO 0.49 -0.24 0.77 0.93 -0.21 0.00 0.00 178.00 179.74 1xik h GLU 51 N -0.37 0.00 -0.72 1.05 3.07 -1.96 2.07 114.58 117.72 1xik h GLU 51 Ca 0.12 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.91 1xik h GLU 51 Cb 0.59 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.47 1xik h GLU 51 CO -0.50 0.00 0.18 1.49 -1.40 0.00 0.00 179.01 178.77 1xik h GLU 52 N 0.00 1.15 -6.46 2.33 4.57 -1.43 -3.42 114.58 111.31 1xik h GLU 52 Ca 0.35 -0.28 -0.53 0.00 -1.18 0.00 0.00 59.36 57.72 1xik h GLU 52 Cb 1.89 -0.15 0.02 0.00 -0.16 0.00 0.00 28.75 30.34 1xik h GLU 52 CO -0.00 1.01 0.86 0.08 -1.18 0.00 0.00 179.01 179.77 1xik s VAL 53 N -5.32 3.30 -0.40 0.32 1.01 0.70 -4.99 120.40 115.03 1xik s VAL 53 Ca -0.12 0.81 -0.25 0.00 0.00 0.00 0.00 61.98 62.41 1xik s VAL 53 Cb 0.15 -3.52 0.02 0.00 0.00 0.00 0.00 36.38 33.03 1xik s VAL 53 CO 0.85 0.02 0.92 -0.62 0.00 0.00 0.00 175.10 176.27 1xik s ASP 54 N 1.77 6.62 -0.11 3.32 2.15 -1.26 -4.87 116.67 124.27 1xik s ASP 54 Ca 0.68 0.43 0.14 0.00 0.43 0.00 0.00 52.55 54.23 1xik s ASP 54 Cb -0.36 -2.46 0.34 0.00 -0.30 0.00 0.00 42.92 40.14 1xik s ASP 54 CO 0.30 -0.91 1.24 1.33 -0.17 0.00 0.00 175.17 176.96 1xik n VAL 55 N 6.10 1.79 -0.10 1.11 0.24 -1.26 -4.55 118.33 121.66 1xik n VAL 55 Ca 0.06 -1.79 -0.08 0.00 -2.04 0.00 0.00 64.34 60.49 1xik n VAL 55 Cb 0.48 -0.05 -0.02 0.00 -1.47 0.00 0.00 33.84 32.78 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 0.89 -1.09 0.63 -1.34 4.64 -1.93 -1.39 113.55 113.97 1xik h SER 56 Ca 0.00 0.18 -0.01 0.00 -0.47 0.00 0.00 61.79 61.49 1xik h SER 56 Cb 1.05 0.50 -0.00 0.00 -0.31 0.00 0.00 62.40 63.64 1xik h SER 56 CO 0.08 -0.33 -0.06 -0.09 -0.87 0.00 0.00 176.83 175.56 1xik h ARG 57 N -0.28 0.00 0.00 4.77 2.43 -1.97 -2.69 114.38 116.64 1xik h ARG 57 Ca 0.16 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1xik h ARG 57 Cb 0.54 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1xik h ARG 57 CO -0.50 0.06 -0.01 -0.44 -1.51 0.00 0.00 179.97 177.56 1xik h ASP 58 N 0.00 0.00 -0.31 -3.80 5.19 -1.61 -1.30 116.42 114.59 1xik h ASP 58 Ca -0.00 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.31 1xik h ASP 58 Cb 0.39 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.90 1xik h ASP 58 CO 0.01 0.01 -0.19 -0.09 -3.12 0.00 0.00 179.24 175.86 1xik h ARG 59 N 0.00 0.68 0.61 3.56 2.43 -1.55 -1.18 114.38 118.93 1xik h ARG 59 Ca -0.00 -0.32 -0.03 0.00 -0.81 0.00 0.00 59.98 58.82 1xik h ARG 59 Cb 0.05 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1xik h ARG 59 CO 0.00 0.91 -0.29 0.82 -1.51 0.00 0.00 179.97 179.90 1xik h ILE 60 N 0.43 0.00 -0.83 1.20 1.08 -1.44 -1.86 117.51 116.10 1xik h ILE 60 Ca 0.06 -0.00 0.18 0.00 -0.39 0.00 0.00 64.86 64.71 1xik h ILE 60 Cb 0.74 0.00 -0.15 0.00 -3.07 0.00 0.00 36.82 34.33 1xik h ILE 60 CO 0.05 0.00 -0.10 0.44 -0.69 0.00 0.00 178.15 177.85 1xik h ASP 61 N -0.83 -0.59 -0.64 1.72 5.19 -1.38 0.63 116.42 120.53 1xik h ASP 61 Ca -0.08 0.24 -0.05 0.00 -0.62 0.00 0.00 57.03 56.51 1xik h ASP 61 Cb 0.63 0.46 -0.03 0.00 0.18 0.00 0.00 39.33 40.57 1xik h ASP 61 CO 0.14 -0.26 0.20 0.22 -3.12 0.00 0.00 179.24 176.42 1xik h TYR 62 N 0.03 1.06 -0.27 4.55 3.20 -1.17 -1.71 116.97 122.66 1xik h TYR 62 Ca 0.43 -0.10 -0.07 0.00 3.14 0.00 0.00 58.73 62.13 1xik h TYR 62 Cb 0.74 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.68 1xik h TYR 62 CO -0.56 0.85 -0.13 -0.56 -1.64 0.00 0.00 178.16 176.12 1xik h GLN 63 N 0.99 0.46 0.00 1.82 3.07 -0.05 -1.99 115.11 119.41 1xik h GLN 63 Ca 0.22 -0.13 -0.04 0.00 0.09 0.00 0.00 58.65 58.78 1xik h GLN 63 Cb 0.29 -0.05 -0.01 0.00 0.08 0.00 0.00 27.48 27.80 1xik h GLN 63 CO -0.01 0.59 -0.19 0.00 0.09 0.00 0.00 178.83 179.32 1xik h ALA 64 N 1.44 0.98 -2.75 0.06 0.00 -0.80 -3.47 119.26 114.73 1xik h ALA 64 Ca 0.08 -0.17 -0.56 0.00 0.00 0.00 0.00 54.91 54.26 1xik h ALA 64 Cb 0.49 -0.03 0.12 0.00 0.00 0.00 0.00 17.79 18.37 1xik h ALA 64 CO 0.03 0.24 0.55 1.28 0.00 0.00 0.00 179.25 181.34 1xik n LEU 65 N -3.29 4.20 -4.76 0.00 4.77 -0.69 -4.97 117.00 112.27 1xik n LEU 65 Ca 0.01 1.13 -0.40 0.00 -0.03 0.00 0.00 56.01 56.72 1xik n LEU 65 Cb 0.45 -1.52 -0.03 0.00 -2.33 0.00 0.00 43.42 39.98 1xik n LEU 65 CO 0.33 -0.49 0.85 -2.84 -1.33 0.00 0.00 177.39 173.91 1xik s PRO 66 N -2.20 4.50 0.43 3.23 0.02 -1.26 -4.70 135.00 135.02 1xik s PRO 66 Ca 0.60 1.91 0.28 0.00 0.02 0.00 0.00 61.00 63.82 1xik s PRO 66 Cb -0.50 -3.10 1.40 0.00 0.02 0.00 0.00 34.50 32.32 1xik s PRO 66 CO 0.59 0.05 1.62 1.49 -0.33 0.00 0.00 177.00 180.42 1xik h GLU 67 N 3.56 0.09 0.00 5.54 4.57 -1.96 1.55 114.58 127.92 1xik h GLU 67 Ca -0.48 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 57.67 1xik h GLU 67 Cb 1.22 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.78 1xik h GLU 67 CO 0.66 0.06 -0.13 1.12 -1.18 0.00 0.00 179.01 179.53 1xik h HIS 68 N 0.09 0.00 0.20 0.92 2.07 -1.90 0.90 115.15 117.43 1xik h HIS 68 Ca 0.82 0.00 -0.32 0.00 -2.85 0.00 0.00 60.37 58.02 1xik h HIS 68 Cb 2.51 0.00 0.03 0.00 2.57 0.00 0.00 27.41 32.52 1xik h HIS 68 CO -0.01 0.13 -1.39 0.93 -3.07 0.00 0.00 177.93 174.53 1xik h GLU 69 N 0.00 0.56 -0.53 5.12 5.08 0.18 -2.12 114.58 122.87 1xik h GLU 69 Ca -0.00 -0.87 -0.03 0.00 -1.00 0.00 0.00 59.36 57.46 1xik h GLU 69 Cb 0.89 0.31 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 1xik h GLU 69 CO 0.02 1.41 0.23 0.87 -1.00 0.00 0.00 179.01 180.53 1xik h LYS 70 N 0.19 0.77 -0.49 2.33 1.57 -0.84 -0.27 116.57 119.82 1xik h LYS 70 Ca -0.23 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.41 1xik h LYS 70 Cb 2.07 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 34.23 1xik h LYS 70 CO 0.26 0.66 0.25 1.25 -0.57 0.00 0.00 179.45 181.31 1xik h HIS 71 N 0.71 0.67 0.25 -1.35 2.76 -0.79 -0.99 115.15 116.40 1xik h HIS 71 Ca 0.18 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.32 1xik h HIS 71 Cb 0.17 -0.22 0.00 0.00 1.55 0.00 0.00 27.41 28.91 1xik h HIS 71 CO 0.00 0.48 -0.12 0.82 -1.30 0.00 0.00 177.93 177.81 1xik h ILE 72 N 0.69 0.75 -0.29 6.26 2.04 -0.81 -1.87 117.51 124.27 1xik h ILE 72 Ca 0.18 -0.80 0.06 0.00 1.00 0.00 0.00 64.86 65.30 1xik h ILE 72 Cb 0.05 1.15 -0.08 0.00 -0.74 0.00 0.00 36.82 37.20 1xik h ILE 72 CO -0.03 0.15 -0.39 0.15 0.00 0.00 0.00 178.15 178.04 1xik h PHE 73 N -0.80 -1.10 -0.23 1.37 3.57 -0.76 -0.63 116.94 118.35 1xik h PHE 73 Ca -0.03 0.06 0.01 0.00 3.53 0.00 0.00 57.97 61.53 1xik h PHE 73 Cb 0.51 0.53 -0.01 0.00 2.79 0.00 0.00 35.95 39.76 1xik h PHE 73 CO 0.05 -0.43 0.14 0.82 -2.23 0.00 0.00 178.31 176.65 1xik h ILE 74 N -0.37 1.04 -0.97 1.41 1.08 -1.28 -0.81 117.51 117.62 1xik h ILE 74 Ca 0.12 -0.10 0.07 0.00 -0.39 0.00 0.00 64.86 64.56 1xik h ILE 74 Cb 0.58 0.72 -0.07 0.00 -3.07 0.00 0.00 36.82 34.99 1xik h ILE 74 CO -0.49 0.05 0.62 0.28 -0.69 0.00 0.00 178.15 177.92 1xik h SER 75 N 0.29 0.98 -0.52 1.72 0.02 -0.96 0.19 113.55 115.28 1xik h SER 75 Ca 0.09 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.97 1xik h SER 75 Cb -0.01 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 1xik h SER 75 CO -0.04 0.63 0.01 -1.13 -1.14 0.00 0.00 176.83 175.16 1xik h ASN 76 N 1.12 0.89 -0.56 3.07 -1.24 -0.55 -2.08 115.58 116.22 1xik h ASN 76 Ca 0.42 -0.30 -0.09 0.00 0.71 0.00 0.00 56.30 57.04 1xik h ASN 76 Cb 0.17 -0.24 -0.02 0.00 0.73 0.00 0.00 38.32 38.96 1xik h ASN 76 CO -0.18 0.97 0.01 0.25 -1.29 0.00 0.00 177.43 177.19 1xik h LEU 77 N 0.78 0.99 -1.31 0.34 5.85 -0.01 -1.15 115.31 120.81 1xik h LEU 77 Ca 0.15 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 1xik h LEU 77 Cb 0.51 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1xik h LEU 77 CO 0.02 1.04 0.34 0.11 -0.34 0.00 0.00 178.44 179.62 1xik h LYS 78 N 0.93 0.81 -0.30 1.25 1.57 -0.35 -0.24 116.57 120.24 1xik h LYS 78 Ca 0.17 -0.08 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 1xik h LYS 78 Cb 0.53 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1xik h LYS 78 CO 0.03 0.59 -0.08 -0.92 -0.57 0.00 0.00 179.45 178.50 1xik h TYR 79 N 0.82 0.65 -0.71 -1.35 3.20 -0.72 -1.72 116.97 117.14 1xik h TYR 79 Ca 0.21 -0.14 0.07 0.00 3.14 0.00 0.00 58.73 62.01 1xik h TYR 79 Cb -0.00 -0.16 -0.06 0.00 1.54 0.00 0.00 36.73 38.05 1xik h TYR 79 CO 0.00 0.77 0.40 1.96 -1.64 0.00 0.00 178.16 179.66 1xik h GLN 80 N 0.34 0.70 -0.45 1.82 4.20 -0.62 -0.26 115.11 120.86 1xik h GLN 80 Ca 0.08 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.76 1xik h GLN 80 Cb 0.56 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.16 1xik h GLN 80 CO 0.03 0.47 0.27 1.15 -0.67 0.00 0.00 178.83 180.08 1xik h THR 81 N 0.73 1.06 0.36 -0.54 2.02 -0.87 -0.51 112.91 115.16 1xik h THR 81 Ca 0.32 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 1xik h THR 81 Cb 0.22 0.46 -0.00 0.00 -1.74 0.00 0.00 68.15 67.09 1xik h THR 81 CO -0.19 0.10 -0.20 0.25 0.37 0.00 0.00 175.52 175.84 1xik h LEU 82 N 0.55 -0.50 -0.72 2.58 5.85 -0.38 0.27 115.31 122.95 1xik h LEU 82 Ca 0.18 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.95 1xik h LEU 82 Cb -0.00 0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 1xik h LEU 82 CO -0.07 -0.33 0.45 -0.07 -0.34 0.00 0.00 178.44 178.08 1xik h LEU 83 N -0.53 0.75 -0.29 2.25 3.38 -0.79 -1.63 115.31 118.45 1xik h LEU 83 Ca -0.04 -0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 1xik h LEU 83 Cb 0.43 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1xik h LEU 83 CO 0.05 0.53 -0.48 0.44 0.09 0.00 0.00 178.44 179.07 1xik h ASP 84 N 0.90 0.00 -0.66 -0.43 3.32 -0.95 -0.47 116.42 118.12 1xik h ASP 84 Ca 0.28 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.35 1xik h ASP 84 Cb -0.01 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 1xik h ASP 84 CO -0.10 0.48 0.42 0.28 -1.72 0.00 0.00 179.24 178.60 1xik h SER 85 N 0.00 0.71 -0.04 6.45 0.02 0.31 -0.15 113.55 120.85 1xik h SER 85 Ca -0.00 -0.01 -0.25 0.00 -0.84 0.00 0.00 61.79 60.69 1xik h SER 85 Cb 1.25 -0.17 0.02 0.00 0.14 0.00 0.00 62.40 63.64 1xik h SER 85 CO 0.06 0.51 -0.95 0.40 -1.14 0.00 0.00 176.83 175.71 1xik h ILE 86 N 0.85 1.28 0.00 3.27 2.04 -1.17 -3.23 117.51 120.55 1xik h ILE 86 Ca 0.25 -2.15 0.00 0.00 1.00 0.00 0.00 64.86 63.96 1xik h ILE 86 Cb -0.04 2.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.27 1xik h ILE 86 CO -0.08 0.67 0.00 0.00 0.00 0.00 0.00 178.15 178.74 1xik n GLN 87 N -3.88 0.23 0.04 2.37 1.13 -0.20 -0.79 117.38 116.28 1xik n GLN 87 Ca -0.10 0.32 -0.20 0.00 -1.94 0.00 0.00 57.00 55.09 1xik n GLN 87 Cb 0.83 -1.84 -0.10 0.00 0.11 0.00 0.00 30.24 29.24 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 3.38 0.77 0.18 1.08 0.00 -1.04 -3.39 103.07 104.05 1xik h GLY 88 Ca 0.00 -1.35 -0.37 0.00 0.00 0.00 0.00 47.33 45.61 1xik h GLY 88 CO 0.00 1.19 -2.31 -0.96 0.00 0.00 0.00 176.54 174.47 1xik n ARG 89 N -3.85 0.68 -0.06 4.80 1.85 -1.13 -4.71 116.66 114.24 1xik n ARG 89 Ca -0.11 0.13 -0.07 0.00 -1.00 0.00 0.00 57.85 56.79 1xik n ARG 89 Cb 0.88 -1.57 -0.02 0.00 -1.05 0.00 0.00 32.46 30.70 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 0.01 -0.25 -0.62 2.89 0.02 -1.15 -0.39 113.55 114.06 1xik h SER 90 Ca -0.52 0.08 0.05 0.00 -0.84 0.00 0.00 61.79 60.56 1xik h SER 90 Cb 2.05 0.16 -0.04 0.00 0.14 0.00 0.00 62.40 64.72 1xik h SER 90 CO -0.01 -0.09 0.41 -0.65 -1.14 0.00 0.00 176.83 175.35 1xik h PRO 91 N -0.01 0.66 -0.03 3.45 0.11 -1.80 0.42 132.00 134.80 1xik h PRO 91 Ca 0.12 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.13 1xik h PRO 91 Cb 0.19 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.16 1xik h PRO 91 CO -0.27 0.43 -0.25 -0.91 -0.21 0.00 0.00 178.00 176.80 1xik h ASN 92 N 0.68 0.27 -0.31 -2.05 2.35 -1.73 -0.65 115.58 114.13 1xik h ASN 92 Ca 0.26 -0.70 -0.14 0.00 -0.55 0.00 0.00 56.30 55.17 1xik h ASN 92 Cb 0.17 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 1xik h ASN 92 CO -0.07 0.93 -0.30 0.58 -1.65 0.00 0.00 177.43 176.91 1xik h VAL 93 N -0.37 1.28 0.20 2.81 2.07 -0.57 -3.05 116.25 118.61 1xik h VAL 93 Ca -0.02 -1.46 -0.34 0.00 0.82 0.00 0.00 66.70 65.71 1xik h VAL 93 Cb 0.94 1.30 0.02 0.00 -1.52 0.00 0.00 31.29 32.03 1xik h VAL 93 CO 0.05 0.49 -1.59 0.00 0.02 0.00 0.00 177.57 176.54 1xik h ALA 94 N 0.95 0.05 0.07 1.67 0.00 -0.25 -3.43 119.26 118.32 1xik h ALA 94 Ca 0.08 -1.02 -0.36 0.00 0.00 0.00 0.00 54.91 53.61 1xik h ALA 94 Cb 0.85 0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1xik h ALA 94 CO 0.07 0.92 -2.06 1.28 0.00 0.00 0.00 179.25 179.46 1xik n LEU 95 N -3.61 2.57 -0.31 0.00 4.77 -0.26 -4.55 117.00 115.60 1xik n LEU 95 Ca -0.19 0.16 0.12 0.00 -0.03 0.00 0.00 56.01 56.06 1xik n LEU 95 Cb 1.08 -1.02 0.29 0.00 -2.33 0.00 0.00 43.42 41.43 1xik n LEU 95 CO 0.55 0.77 1.08 -0.07 -1.33 0.00 0.00 177.39 178.39 1xik h LEU 96 N -0.18 0.44 0.00 2.23 3.38 -1.45 0.01 115.31 119.74 1xik h LEU 96 Ca -0.48 0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1xik h LEU 96 Cb 1.87 0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.69 1xik h LEU 96 CO -0.04 0.09 0.00 -2.65 0.09 0.00 0.00 178.44 175.93 1xik n PRO 97 N -4.96 0.07 -0.00 1.13 -0.02 -1.26 -2.78 135.00 127.18 1xik n PRO 97 Ca 0.21 0.23 0.05 0.00 -2.02 0.00 0.00 63.50 61.97 1xik n PRO 97 Cb 0.59 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.51 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 -1.42 0.33 -4.76 2.45 4.77 -0.06 -4.98 117.00 113.34 1xik n LEU 98 Ca 0.04 -0.36 -0.40 0.00 -0.03 0.00 0.00 56.01 55.26 1xik n LEU 98 Cb 0.13 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.18 1xik n LEU 98 CO 0.11 0.08 0.76 -0.63 -1.33 0.00 0.00 177.39 176.39 1xik s ILE 99 N -2.14 3.62 -0.00 -0.08 1.01 -0.89 -0.68 121.20 122.04 1xik s ILE 99 Ca 0.02 1.62 0.00 0.00 0.00 0.00 0.00 60.65 62.29 1xik s ILE 99 Cb 0.07 -4.03 0.00 0.00 0.01 0.00 0.00 42.46 38.51 1xik s ILE 99 CO 0.41 0.38 0.91 -1.54 0.00 0.00 0.00 174.94 175.10 1xik n SER 100 N 1.33 1.64 -4.06 3.58 3.41 -0.15 -3.77 113.62 115.60 1xik n SER 100 Ca -0.01 -1.83 -0.23 0.00 -0.26 0.00 0.00 58.87 56.54 1xik n SER 100 Cb 0.45 -0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.24 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 -0.83 1.11 0.28 -1.33 -4.36 -1.26 -4.63 121.20 110.19 1xik s ILE 101 Ca 0.00 -0.53 -0.03 0.00 -0.26 0.00 0.00 60.65 59.83 1xik s ILE 101 Cb 0.00 -0.97 0.23 0.00 1.25 0.00 0.00 42.46 42.97 1xik s ILE 101 CO 0.00 0.33 1.92 1.55 0.24 0.00 0.00 174.94 178.98 1xik h PRO 102 N 6.38 1.06 -0.52 0.37 0.13 -1.90 -1.41 132.00 136.11 1xik h PRO 102 Ca -0.33 -0.11 -0.04 0.00 -0.87 0.00 0.00 66.00 64.66 1xik h PRO 102 Cb 1.17 -0.22 -0.02 0.00 0.13 0.00 0.00 31.00 32.06 1xik h PRO 102 CO 0.48 0.76 0.16 1.05 -0.23 0.00 0.00 178.00 180.22 1xik h GLU 103 N 1.07 0.77 0.06 0.86 9.09 -1.92 0.30 114.58 124.81 1xik h GLU 103 Ca 0.28 -0.14 -0.25 0.00 0.05 0.00 0.00 59.36 59.30 1xik h GLU 103 Cb -0.01 -0.13 0.00 0.00 -1.65 0.00 0.00 28.75 26.97 1xik h GLU 103 CO -0.05 0.67 -1.07 1.25 0.05 0.00 0.00 179.01 179.87 1xik h LEU 104 N 0.75 0.49 -0.26 3.06 5.85 -1.88 -1.93 115.31 121.39 1xik h LEU 104 Ca 0.17 -0.44 -0.00 0.00 0.84 0.00 0.00 57.88 58.45 1xik h LEU 104 Cb 0.23 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1xik h LEU 104 CO -0.01 1.28 0.15 -0.08 -0.34 0.00 0.00 178.44 179.44 1xik h GLU 105 N 0.16 0.35 -0.19 1.25 4.81 -0.44 -1.59 114.58 118.93 1xik h GLU 105 Ca -0.10 -0.03 -0.13 0.00 -0.13 0.00 0.00 59.36 58.96 1xik h GLU 105 Cb 1.74 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 31.04 1xik h GLU 105 CO 0.18 0.28 -0.45 1.15 -0.73 0.00 0.00 179.01 179.44 1xik h THR 106 N 0.32 1.31 -0.43 0.32 2.02 -0.98 -2.53 112.91 112.95 1xik h THR 106 Ca 0.09 -1.63 0.06 0.00 0.77 0.00 0.00 66.41 65.69 1xik h THR 106 Cb 0.02 1.65 -0.05 0.00 -1.74 0.00 0.00 68.15 68.03 1xik h THR 106 CO -0.02 0.51 0.14 -0.25 0.37 0.00 0.00 175.52 176.27 1xik h TRP 107 N 0.39 0.25 -0.69 3.16 -0.00 -1.06 0.38 115.95 118.38 1xik h TRP 107 Ca 0.03 0.02 0.01 0.00 -0.00 0.00 0.00 58.89 58.95 1xik h TRP 107 Cb 0.94 -0.05 -0.03 0.00 -0.00 0.00 0.00 29.16 30.01 1xik h TRP 107 CO 0.03 0.09 0.46 0.28 -0.00 0.00 0.00 178.44 179.30 1xik h VAL 108 N 0.30 1.18 -0.56 2.65 2.07 -1.11 0.72 116.25 121.50 1xik h VAL 108 Ca 0.20 -0.32 -0.07 0.00 0.82 0.00 0.00 66.70 67.33 1xik h VAL 108 Cb 0.20 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 1xik h VAL 108 CO -0.21 0.17 0.07 -0.33 0.02 0.00 0.00 177.57 177.28 1xik h GLU 109 N 0.93 0.91 -0.16 1.57 5.08 -0.88 0.24 114.58 122.28 1xik h GLU 109 Ca 0.25 -0.23 -0.09 0.00 -1.00 0.00 0.00 59.36 58.29 1xik h GLU 109 Cb -0.11 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.03 1xik h GLU 109 CO -0.05 0.86 -0.25 1.15 -1.00 0.00 0.00 179.01 179.72 1xik h THR 110 N 0.86 1.35 0.15 1.13 2.02 0.96 -0.97 112.91 118.41 1xik h THR 110 Ca 0.17 -1.47 0.01 0.00 0.77 0.00 0.00 66.41 65.89 1xik h THR 110 Cb 0.41 1.93 -0.03 0.00 -1.74 0.00 0.00 68.15 68.72 1xik h THR 110 CO 0.01 0.44 -0.23 -0.25 0.37 0.00 0.00 175.52 175.86 1xik h TRP 111 N 0.08 -0.62 -0.82 3.16 7.01 0.60 0.13 115.95 125.48 1xik h TRP 111 Ca 0.01 0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.08 1xik h TRP 111 Cb 0.82 0.26 -0.06 0.00 -2.10 0.00 0.00 29.16 28.08 1xik h TRP 111 CO 0.09 -0.34 0.50 0.00 -2.79 0.00 0.00 178.44 175.91 1xik h ALA 112 N 0.30 1.12 -0.75 2.65 0.00 -0.52 -2.02 119.26 120.04 1xik h ALA 112 Ca 0.02 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1xik h ALA 112 Cb 0.46 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1xik h ALA 112 CO -0.11 0.24 0.39 0.35 0.00 0.00 0.00 179.25 180.12 1xik h PHE 113 N 0.92 1.04 0.00 0.00 3.57 -0.16 -1.68 116.94 120.63 1xik h PHE 113 Ca 0.36 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.81 1xik h PHE 113 Cb 0.17 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 38.58 1xik h PHE 113 CO -0.04 0.75 -0.04 0.66 -2.23 0.00 0.00 178.31 177.40 1xik h SER 114 N 1.04 0.00 0.34 0.41 4.64 -0.07 -0.66 113.55 119.24 1xik h SER 114 Ca 0.26 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.49 1xik h SER 114 Cb 0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 1xik h SER 114 CO -0.04 0.04 -0.40 -0.33 -0.87 0.00 0.00 176.83 175.24 1xik h GLU 115 N 0.00 0.09 -0.07 4.77 4.39 -0.91 -2.36 114.58 120.48 1xik h GLU 115 Ca -0.00 -0.04 -0.11 0.00 0.34 0.00 0.00 59.36 59.55 1xik h GLU 115 Cb 0.09 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 1xik h GLU 115 CO 0.01 0.48 -0.46 1.79 -1.16 0.00 0.00 179.01 179.66 1xik h THR 116 N 0.07 1.33 -0.49 1.13 1.35 -0.92 -0.74 112.91 114.64 1xik h THR 116 Ca 0.01 -1.64 -0.05 0.00 -0.55 0.00 0.00 66.41 64.18 1xik h THR 116 Cb 0.74 1.79 -0.02 0.00 -1.73 0.00 0.00 68.15 68.93 1xik h THR 116 CO 0.06 0.48 0.12 0.40 -0.25 0.00 0.00 175.52 176.33 1xik h ILE 117 N 0.15 1.24 -0.26 6.82 1.08 -1.24 0.97 117.51 126.26 1xik h ILE 117 Ca 0.01 -0.84 0.04 0.00 -0.39 0.00 0.00 64.86 63.68 1xik h ILE 117 Cb 0.88 0.85 -0.04 0.00 -3.07 0.00 0.00 36.82 35.44 1xik h ILE 117 CO 0.07 0.30 0.04 0.45 -0.69 0.00 0.00 178.15 178.32 1xik h HIS 118 N 0.67 0.06 -0.95 1.37 3.86 -1.05 0.33 115.15 119.45 1xik h HIS 118 Ca 0.15 0.02 0.07 0.00 -1.16 0.00 0.00 60.37 59.45 1xik h HIS 118 Cb 0.33 0.01 -0.07 0.00 1.06 0.00 0.00 27.41 28.74 1xik h HIS 118 CO 0.02 0.01 0.60 0.77 0.86 0.00 0.00 177.93 180.19 1xik h SER 119 N 0.13 0.96 -0.59 2.45 0.02 -0.81 0.12 113.55 115.82 1xik h SER 119 Ca 0.12 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.05 1xik h SER 119 Cb 0.13 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.46 1xik h SER 119 CO -0.17 0.60 0.22 0.03 -1.14 0.00 0.00 176.83 176.38 1xik h ARG 120 N 1.09 0.90 -0.33 3.45 3.08 0.51 -2.34 114.38 120.74 1xik h ARG 120 Ca 0.41 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 60.28 1xik h ARG 120 Cb 0.19 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 1xik h ARG 120 CO -0.18 0.78 0.13 0.66 -1.07 0.00 0.00 179.97 180.29 1xik h SER 121 N 0.83 0.42 -0.12 7.04 4.64 0.16 -1.26 113.55 125.26 1xik h SER 121 Ca 0.20 -0.04 -0.11 0.00 -0.47 0.00 0.00 61.79 61.37 1xik h SER 121 Cb 0.23 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 1xik h SER 121 CO -0.01 0.38 -0.29 1.88 -0.87 0.00 0.00 176.83 177.92 1xik h TYR 122 N 0.47 0.68 -0.63 4.77 0.05 -0.82 0.13 116.97 121.62 1xik h TYR 122 Ca 0.12 -0.16 -0.02 0.00 0.05 0.00 0.00 58.73 58.71 1xik h TYR 122 Cb 0.10 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 37.65 1xik h TYR 122 CO 0.00 0.82 0.31 1.15 -1.05 0.00 0.00 178.16 179.40 1xik h THR 123 N 0.51 1.21 -0.56 -2.88 2.02 -0.85 0.16 112.91 112.52 1xik h THR 123 Ca 0.06 -0.58 -0.00 0.00 0.77 0.00 0.00 66.41 66.66 1xik h THR 123 Cb 0.76 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 67.59 1xik h THR 123 CO 0.06 0.24 0.33 -0.74 0.37 0.00 0.00 175.52 175.78 1xik h HIS 124 N 0.86 0.74 0.24 3.16 -0.00 -0.45 -0.95 115.15 118.74 1xik h HIS 124 Ca 0.22 -0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.57 1xik h HIS 124 Cb 0.10 -0.24 0.00 0.00 -0.00 0.00 0.00 27.41 27.27 1xik h HIS 124 CO -0.00 0.52 -0.12 0.82 -0.00 0.00 0.00 177.93 179.15 1xik h ILE 125 N 0.75 0.82 -0.02 6.26 2.04 -0.36 -2.92 117.51 124.08 1xik h ILE 125 Ca 0.20 -0.51 0.03 0.00 1.00 0.00 0.00 64.86 65.57 1xik h ILE 125 Cb -0.00 1.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 1xik h ILE 125 CO -0.04 0.11 -0.14 0.40 0.00 0.00 0.00 178.15 178.48 1xik h ILE 126 N -0.59 0.65 0.00 -0.67 2.04 -0.53 0.44 117.51 118.84 1xik h ILE 126 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1xik h ILE 126 Cb 0.43 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1xik h ILE 126 CO 0.05 0.00 0.00 0.08 0.00 0.00 0.00 178.15 178.28 1xik h ARG 127 N -0.22 0.00 -0.15 2.37 0.11 -1.26 0.91 114.38 116.13 1xik h ARG 127 Ca 0.06 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.14 1xik h ARG 127 Cb 0.30 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.38 1xik h ARG 127 CO -0.15 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.01 1xik n ASN 128 N -3.01 2.06 0.00 0.08 3.02 0.11 -4.30 115.26 113.23 1xik n ASN 128 Ca -0.02 -1.74 0.00 0.00 -0.03 0.00 0.00 54.58 52.79 1xik n ASN 128 Cb 0.09 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1xik n ASN 128 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1xik n ILE 129 N 0.59 0.00 -3.68 2.41 -5.35 0.20 -4.23 119.36 109.30 1xik n ILE 129 Ca 0.17 0.00 -0.24 0.00 -0.27 0.00 0.00 62.75 62.41 1xik n ILE 129 Cb 0.41 0.07 -0.00 0.00 -1.74 0.00 0.00 39.64 38.38 1xik n ILE 129 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1xik s VAL 130 N -1.05 1.96 -0.17 7.28 1.01 -0.51 -4.92 120.40 124.01 1xik s VAL 130 Ca 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 61.98 60.60 1xik s VAL 130 Cb 0.00 -2.34 -0.23 0.00 0.00 0.00 0.00 36.38 33.81 1xik s VAL 130 CO 0.00 0.00 0.17 0.59 0.00 0.00 0.00 175.10 175.86 1xik n ASN 131 N -1.79 1.77 -3.92 3.32 3.02 -1.26 -4.84 115.26 111.57 1xik n ASN 131 Ca 0.02 0.10 -0.23 0.00 -0.03 0.00 0.00 54.58 54.44 1xik n ASN 131 Cb 0.63 -0.48 -0.17 0.00 -0.61 0.00 0.00 39.78 39.16 1xik n ASN 131 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1xik s ASP 132 N -6.64 1.47 0.26 6.41 2.15 -1.26 -5.00 116.67 114.06 1xik s ASP 132 Ca -0.24 -0.20 0.15 0.00 0.43 0.00 0.00 52.55 52.69 1xik s ASP 132 Cb 0.07 -0.62 0.03 0.00 -0.30 0.00 0.00 42.92 42.11 1xik s ASP 132 CO 0.72 -0.06 1.40 -0.65 -0.17 0.00 0.00 175.17 176.41 1xik h PRO 133 N 7.43 0.00 -0.28 4.34 0.11 -1.90 -3.24 132.00 138.46 1xik h PRO 133 Ca -0.32 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.87 1xik h PRO 133 Cb 1.16 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1xik h PRO 133 CO 0.44 0.52 0.45 0.77 -0.21 0.00 0.00 178.00 179.96 1xik h SER 134 N 0.00 0.00 0.11 -2.05 0.02 -1.97 0.49 113.55 110.15 1xik h SER 134 Ca -0.01 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1xik h SER 134 Cb 1.42 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.96 1xik h SER 134 CO 0.07 0.00 -0.05 0.58 -1.14 0.00 0.00 176.83 176.28 1xik h VAL 135 N 0.00 1.09 0.99 2.27 2.07 -1.97 0.29 116.25 120.99 1xik h VAL 135 Ca 0.13 -1.03 -0.05 0.00 0.82 0.00 0.00 66.70 66.57 1xik h VAL 135 Cb 1.03 1.72 0.01 0.00 -1.52 0.00 0.00 31.29 32.52 1xik h VAL 135 CO -0.00 0.24 -0.47 0.58 0.02 0.00 0.00 177.57 177.93 1xik h VAL 136 N -0.66 0.00 -0.69 2.57 2.07 -1.19 -2.17 116.25 116.18 1xik h VAL 136 Ca -0.02 -0.01 0.10 0.00 0.82 0.00 0.00 66.70 67.59 1xik h VAL 136 Cb 0.51 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 1xik h VAL 136 CO 0.03 0.00 0.45 -0.26 0.02 0.00 0.00 177.57 177.81 1xik h PHE 137 N -1.33 0.59 0.00 1.57 0.04 -1.11 0.52 116.94 117.21 1xik h PHE 137 Ca -0.14 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.65 1xik h PHE 137 Cb 1.02 -0.19 0.00 0.00 2.20 0.00 0.00 35.95 38.98 1xik h PHE 137 CO 0.01 0.28 0.00 -0.44 -0.60 0.00 0.00 178.31 177.56 1xik h ASP 138 N 0.55 0.00 -0.29 2.17 3.32 -0.39 -3.13 116.42 118.65 1xik h ASP 138 Ca 0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.37 1xik h ASP 138 Cb 0.50 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.05 1xik h ASP 138 CO -0.10 0.00 0.00 -0.67 -1.72 0.00 0.00 179.24 176.75 1xik n ASP 139 N -2.81 2.50 -0.10 6.45 2.03 0.17 -4.30 116.55 120.49 1xik n ASP 139 Ca 0.04 -2.22 -0.19 0.00 0.52 0.00 0.00 54.79 52.93 1xik n ASP 139 Cb 0.44 -0.42 -0.09 0.00 -0.72 0.00 0.00 41.12 40.33 1xik n ASP 139 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 1xik n ILE 140 N 0.37 1.51 -0.35 5.18 5.41 -1.18 -3.30 119.36 127.00 1xik n ILE 140 Ca 0.12 -0.01 0.01 0.00 1.00 0.00 0.00 62.75 63.87 1xik n ILE 140 Cb 0.49 -2.10 0.14 0.00 -0.71 0.00 0.00 39.64 37.47 1xik n ILE 140 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1xik h VAL 141 N -1.00 1.12 -0.02 1.39 2.07 -1.79 -2.86 116.25 115.16 1xik h VAL 141 Ca -0.31 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 66.82 1xik h VAL 141 Cb 1.18 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1xik h VAL 141 CO -0.19 0.21 -0.25 0.35 0.02 0.00 0.00 177.57 177.71 1xik n THR 142 N -4.51 0.00 -2.17 2.57 -2.24 -1.26 -4.85 114.28 101.82 1xik n THR 142 Ca 0.13 -0.31 -0.40 0.00 -2.27 0.00 0.00 64.05 61.21 1xik n THR 142 Cb 0.13 1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 69.44 1xik n THR 142 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1xik s ASN 143 N -2.29 5.59 0.32 3.42 3.84 -1.08 -4.83 114.94 119.91 1xik s ASN 143 Ca 0.24 0.27 0.07 0.00 0.21 0.00 0.00 52.86 53.66 1xik s ASN 143 Cb 0.19 -2.54 0.77 0.00 -0.55 0.00 0.00 41.25 39.12 1xik s ASN 143 CO 0.46 -2.14 1.81 -0.08 -2.79 0.00 0.00 177.10 174.36 1xik h GLU 144 N 13.40 0.73 -0.67 0.43 4.81 -1.88 0.55 114.58 131.95 1xik h GLU 144 Ca -0.27 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 58.85 1xik h GLU 144 Cb 1.13 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 30.32 1xik h GLU 144 CO 1.21 0.48 0.17 0.37 -0.73 0.00 0.00 179.01 180.51 1xik h GLN 145 N 0.75 1.05 0.06 1.92 5.75 -1.97 0.34 115.11 123.00 1xik h GLN 145 Ca 0.53 -0.24 -0.00 0.00 -0.15 0.00 0.00 58.65 58.79 1xik h GLN 145 Cb 0.84 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 29.24 1xik h GLN 145 CO -0.30 0.92 -0.03 0.82 -2.65 0.00 0.00 178.83 177.59 1xik h ILE 146 N 1.00 1.23 0.00 2.39 1.08 -1.01 -0.09 117.51 122.10 1xik h ILE 146 Ca 0.21 -1.02 -0.00 0.00 -0.39 0.00 0.00 64.86 63.66 1xik h ILE 146 Cb 0.34 1.89 -0.00 0.00 -3.07 0.00 0.00 36.82 35.98 1xik h ILE 146 CO -0.00 0.25 -0.01 0.06 -0.69 0.00 0.00 178.15 177.76 1xik h GLN 147 N -0.54 0.00 -0.00 2.37 3.07 0.15 0.59 115.11 120.75 1xik h GLN 147 Ca -0.01 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.66 1xik h GLN 147 Cb 0.47 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.04 1xik h GLN 147 CO 0.01 0.01 -0.30 -0.22 0.09 0.00 0.00 178.83 178.43 1xik h LYS 148 N 0.00 0.21 0.00 0.06 1.63 -0.03 -0.44 116.57 117.99 1xik h LYS 148 Ca -0.00 -0.22 -0.06 0.00 -0.85 0.00 0.00 60.65 59.52 1xik h LYS 148 Cb 0.21 0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.90 1xik h LYS 148 CO 0.00 0.94 -0.29 -0.09 -3.45 0.00 0.00 179.45 176.56 1xik h ARG 149 N -0.44 0.00 -0.23 1.90 2.43 -0.27 -2.82 114.38 114.95 1xik h ARG 149 Ca -0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1xik h ARG 149 Cb 1.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 1xik h ARG 149 CO 0.06 0.29 0.00 0.00 -1.51 0.00 0.00 179.97 178.81 1xik n ALA 150 N -2.36 2.44 -1.78 2.80 0.00 0.13 -4.80 120.51 116.94 1xik n ALA 150 Ca -0.01 -0.86 -0.41 0.00 0.00 0.00 0.00 53.44 52.16 1xik n ALA 150 Cb 0.38 -0.83 -0.00 0.00 0.00 0.00 0.00 19.45 19.00 1xik n ALA 150 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1xik s GLU 151 N -1.69 4.11 0.00 0.00 2.12 -0.18 -2.83 118.70 120.24 1xik s GLU 151 Ca 0.34 2.57 0.00 0.00 0.36 0.00 0.00 54.97 58.23 1xik s GLU 151 Cb 0.21 -2.97 0.00 0.00 0.26 0.00 0.00 34.13 31.63 1xik s GLU 151 CO 0.31 -0.53 0.00 0.41 -0.54 0.00 0.00 175.26 174.91 1xik n GLY 152 N 0.47 3.42 0.23 -1.50 0.00 -1.26 -4.96 105.19 101.59 1xik n GLY 152 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 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 0.59 -0.10 -0.61 2.04 -1.94 -2.85 117.51 114.63 1xik h ILE 153 Ca 0.00 -0.51 0.03 0.00 1.00 0.00 0.00 64.86 65.38 1xik h ILE 153 Cb 0.00 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1xik h ILE 153 CO 0.00 0.09 0.11 0.77 0.00 0.00 0.00 178.15 179.12 1xik h SER 154 N -0.81 0.00 0.03 1.72 4.64 -1.93 -2.92 113.55 114.27 1xik h SER 154 Ca -0.05 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1xik h SER 154 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1xik h SER 154 CO 0.08 0.00 -0.01 0.28 -0.87 0.00 0.00 176.83 176.31 1xik h SER 155 N 0.00 -0.03 -0.34 4.97 0.02 -1.90 0.59 113.55 116.86 1xik h SER 155 Ca 0.05 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 1xik h SER 155 Cb 0.27 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 1xik h SER 155 CO -0.00 0.15 0.22 1.88 -1.14 0.00 0.00 176.83 177.93 1xik h TYR 156 N -0.20 0.43 0.75 3.45 0.05 -1.33 -2.06 116.97 118.06 1xik h TYR 156 Ca -0.00 0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.75 1xik h TYR 156 Cb 0.19 -0.14 0.00 0.00 1.01 0.00 0.00 36.73 37.79 1xik h TYR 156 CO -0.02 0.29 -0.40 1.88 -1.05 0.00 0.00 178.16 178.86 1xik h TYR 157 N 0.45 -1.06 -0.51 4.88 0.05 -1.53 -0.94 116.97 118.30 1xik h TYR 157 Ca 0.12 -0.02 0.09 0.00 0.05 0.00 0.00 58.73 58.97 1xik h TYR 157 Cb -0.03 0.36 -0.03 0.00 1.01 0.00 0.00 36.73 38.04 1xik h TYR 157 CO -0.05 -0.63 0.35 -0.44 -1.05 0.00 0.00 178.16 176.34 1xik h ASP 158 N -1.06 0.29 0.31 3.88 3.32 -0.82 0.64 116.42 122.98 1xik h ASP 158 Ca -0.10 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.70 1xik h ASP 158 Cb 0.83 -0.06 0.01 0.00 0.22 0.00 0.00 39.33 40.34 1xik h ASP 158 CO 0.14 0.18 -1.08 -0.33 -1.72 0.00 0.00 179.24 176.43 1xik h GLU 159 N 0.32 0.46 -0.60 3.56 5.08 -1.17 -1.24 114.58 120.99 1xik h GLU 159 Ca 0.24 -0.56 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1xik h GLU 159 Cb 0.51 0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.91 1xik h GLU 159 CO -0.05 1.21 0.38 1.25 -1.00 0.00 0.00 179.01 180.80 1xik h LEU 160 N 0.23 0.70 -0.13 1.33 5.85 -0.01 -1.20 115.31 122.07 1xik h LEU 160 Ca -0.12 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.57 1xik h LEU 160 Cb 1.74 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.59 1xik h LEU 160 CO 0.19 0.52 0.07 0.40 -0.34 0.00 0.00 178.44 179.29 1xik h ILE 161 N 0.81 1.08 -0.22 4.05 2.04 -0.84 -0.66 117.51 123.77 1xik h ILE 161 Ca 0.22 -0.22 0.01 0.00 1.00 0.00 0.00 64.86 65.87 1xik h ILE 161 Cb -0.07 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 1xik h ILE 161 CO -0.04 0.08 0.10 -0.08 0.00 0.00 0.00 178.15 178.20 1xik h GLU 162 N 0.12 0.21 -0.36 2.37 4.81 -0.94 -1.07 114.58 119.72 1xik h GLU 162 Ca 0.05 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.18 1xik h GLU 162 Cb 0.06 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1xik h GLU 162 CO -0.01 0.14 -0.12 0.52 -0.73 0.00 0.00 179.01 178.82 1xik h MET 163 N 0.22 0.63 -0.75 1.92 0.00 -1.11 -2.16 114.93 113.67 1xik h MET 163 Ca 0.09 -0.19 -0.05 0.00 0.00 0.00 0.00 59.70 59.55 1xik h MET 163 Cb 0.03 -0.06 -0.03 0.00 0.00 0.00 0.00 31.60 31.54 1xik h MET 163 CO -0.07 0.73 0.29 1.15 0.00 0.00 0.00 176.91 179.01 1xik h THR 164 N 0.58 1.26 -0.51 2.22 2.02 -0.76 0.13 112.91 117.84 1xik h THR 164 Ca 0.10 -0.82 -0.01 0.00 0.77 0.00 0.00 66.41 66.46 1xik h THR 164 Cb 0.54 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 1xik h THR 164 CO 0.03 0.33 0.29 0.28 0.37 0.00 0.00 175.52 176.82 1xik h SER 165 N 1.09 0.62 -0.29 4.18 0.02 -0.89 0.21 113.55 118.49 1xik h SER 165 Ca 0.25 -0.08 -0.06 0.00 -0.84 0.00 0.00 61.79 61.06 1xik h SER 165 Cb 0.23 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 1xik h SER 165 CO -0.02 0.52 -0.02 1.88 -1.14 0.00 0.00 176.83 178.06 1xik h TYR 166 N 0.67 0.68 -0.53 3.45 0.05 -1.02 0.39 116.97 120.67 1xik h TYR 166 Ca 0.18 -0.09 -0.10 0.00 0.05 0.00 0.00 58.73 58.78 1xik h TYR 166 Cb 0.03 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 37.56 1xik h TYR 166 CO -0.02 0.66 -0.05 2.35 -1.05 0.00 0.00 178.16 180.05 1xik h TRP 167 N 0.61 1.03 -0.22 4.88 7.01 0.21 0.13 115.95 129.60 1xik h TRP 167 Ca 0.12 -0.18 -0.21 0.00 2.11 0.00 0.00 58.89 60.73 1xik h TRP 167 Cb 0.41 -0.27 0.01 0.00 -2.10 0.00 0.00 29.16 27.21 1xik h TRP 167 CO 0.02 0.94 -0.68 0.45 -2.79 0.00 0.00 178.44 176.39 1xik h HIS 168 N 0.86 1.10 0.06 2.65 3.86 0.06 -0.54 115.15 123.19 1xik h HIS 168 Ca 0.15 -0.44 -0.00 0.00 -1.16 0.00 0.00 60.37 58.91 1xik h HIS 168 Cb 0.57 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.85 1xik h HIS 168 CO 0.04 1.28 -0.03 -0.07 0.86 0.00 0.00 177.93 180.01 1xik h LEU 169 N 0.61 -0.07 0.00 2.43 3.38 -0.11 -1.26 115.31 120.29 1xik h LEU 169 Ca -0.02 -0.44 -0.11 0.00 0.09 0.00 0.00 57.88 57.40 1xik h LEU 169 Cb 1.30 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 42.05 1xik h LEU 169 CO 0.14 0.42 -2.08 0.18 0.09 0.00 0.00 178.44 177.20 1xik n LEU 170 N -4.89 0.00 -0.01 1.67 4.77 0.44 -4.82 117.00 114.15 1xik n LEU 170 Ca -0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1xik n LEU 170 Cb 0.26 0.14 -0.00 0.00 -2.33 0.00 0.00 43.42 41.49 1xik n LEU 170 CO 0.32 0.14 -0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1xik n GLY 171 N 1.44 -2.09 3.76 -0.72 0.00 -0.21 -4.89 105.19 102.47 1xik n GLY 171 Ca -0.12 -1.49 -0.39 0.00 0.00 0.00 0.00 46.02 44.03 1xik n GLY 171 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xik s GLU 172 N -2.22 3.39 0.00 1.61 2.02 -1.26 -4.68 118.70 117.55 1xik s GLU 172 Ca 0.00 2.20 0.00 0.00 0.02 0.00 0.00 54.97 57.19 1xik s GLU 172 Cb 0.00 -2.39 0.00 0.00 0.10 0.00 0.00 34.13 31.84 1xik s GLU 172 CO 0.00 -0.98 0.00 0.41 0.02 0.00 0.00 175.26 174.71 1xik n GLY 173 N 0.66 0.85 3.35 -1.39 0.00 0.29 -4.91 105.19 104.03 1xik n GLY 173 Ca 0.08 -1.99 -0.32 0.00 0.00 0.00 0.00 46.02 43.80 1xik n GLY 173 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xik s THR 174 N -1.84 2.36 0.23 2.61 -4.23 -1.26 0.18 115.64 113.70 1xik s THR 174 Ca 0.00 -0.98 0.00 0.00 -1.18 0.00 0.00 61.69 59.53 1xik s THR 174 Cb 0.00 -1.86 -0.05 0.00 1.34 0.00 0.00 72.50 71.93 1xik s THR 174 CO 0.00 0.58 0.10 -1.00 -0.54 0.00 0.00 174.62 173.76 1xik s HIS 175 N -0.56 1.37 -0.22 3.99 3.76 0.32 -4.93 115.29 119.01 1xik s HIS 175 Ca 0.08 -1.24 0.02 0.00 -0.15 0.00 0.00 55.06 53.77 1xik s HIS 175 Cb -0.11 -0.76 0.04 0.00 1.11 0.00 0.00 32.58 32.87 1xik s HIS 175 CO 0.00 -0.44 -0.15 0.99 -0.85 0.00 0.00 174.74 174.29 1xik s THR 176 N -3.90 2.17 -0.21 1.30 2.01 -1.26 0.01 115.64 115.75 1xik s THR 176 Ca 0.37 -1.29 0.02 0.00 0.31 0.00 0.00 61.69 61.10 1xik s THR 176 Cb 0.07 -2.10 0.04 0.00 0.01 0.00 0.00 72.50 70.52 1xik s THR 176 CO 0.12 0.24 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.44 1xik s VAL 177 N 1.20 2.13 -1.54 3.82 1.01 0.86 -4.70 120.40 123.18 1xik s VAL 177 Ca -0.02 -1.22 -0.12 0.00 0.00 0.00 0.00 61.98 60.62 1xik s VAL 177 Cb -0.17 -2.04 0.09 0.00 0.00 0.00 0.00 36.38 34.26 1xik s VAL 177 CO -0.09 0.31 0.82 0.59 0.00 0.00 0.00 175.10 176.74 1xik n ASN 178 N 4.55 -3.39 0.00 3.32 3.02 -1.26 -0.57 115.26 120.93 1xik n ASN 178 Ca -0.18 -0.88 0.00 0.00 -0.03 0.00 0.00 54.58 53.49 1xik n ASN 178 Cb 0.47 -3.48 0.00 0.00 -0.61 0.00 0.00 39.78 36.16 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 -1.64 0.62 3.48 7.41 0.00 -1.26 -5.03 105.19 108.78 1xik n GLY 179 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 1xik n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xik s LYS 180 N -0.20 1.95 0.10 1.61 -0.14 0.27 -5.10 119.74 118.22 1xik s LYS 180 Ca 0.00 -1.07 -0.23 0.00 -1.36 0.00 0.00 55.97 53.31 1xik s LYS 180 Cb 0.00 -2.17 -0.07 0.00 -1.68 0.00 0.00 37.83 33.92 1xik s LYS 180 CO 0.00 0.51 0.70 0.99 -0.76 0.00 0.00 175.35 176.79 1xik s THR 181 N -1.05 4.60 -0.04 2.17 2.01 -1.26 -0.10 115.64 121.97 1xik s THR 181 Ca 0.17 1.52 0.01 0.00 0.31 0.00 0.00 61.69 63.69 1xik s THR 181 Cb -0.11 -4.05 0.02 0.00 0.01 0.00 0.00 72.50 68.38 1xik s THR 181 CO 0.08 0.49 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.77 1xik s VAL 182 N -0.80 0.51 -0.12 3.82 1.01 0.10 -4.92 120.40 120.00 1xik s VAL 182 Ca 0.34 -0.10 -0.03 0.00 0.00 0.00 0.00 61.98 62.18 1xik s VAL 182 Cb -0.21 -0.54 -0.03 0.00 0.00 0.00 0.00 36.38 35.60 1xik s VAL 182 CO 0.23 0.22 -0.01 -0.89 0.00 0.00 0.00 175.10 174.65 1xik s THR 183 N 0.94 4.19 -0.30 3.92 2.01 -1.26 0.12 115.64 125.26 1xik s THR 183 Ca -0.11 -0.27 0.03 0.00 0.31 0.00 0.00 61.69 61.65 1xik s THR 183 Cb -0.14 -2.80 0.08 0.00 0.01 0.00 0.00 72.50 69.65 1xik s THR 183 CO -0.00 0.54 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.78 1xik s VAL 184 N -0.25 1.98 -0.14 3.82 1.01 0.48 -4.95 120.40 122.36 1xik s VAL 184 Ca 0.05 -1.88 -0.03 0.00 0.00 0.00 0.00 61.98 60.13 1xik s VAL 184 Cb -0.12 -2.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 1xik s VAL 184 CO 0.02 -0.37 -0.06 -0.55 0.00 0.00 0.00 175.10 174.14 1xik s SER 185 N 1.11 4.62 0.20 3.32 0.15 -1.26 0.10 113.70 121.94 1xik s SER 185 Ca 0.03 -0.16 -0.01 0.00 0.70 0.00 0.00 55.95 56.51 1xik s SER 185 Cb -0.19 -1.70 0.13 0.00 -1.71 0.00 0.00 66.02 62.55 1xik s SER 185 CO -0.09 0.19 1.49 0.25 1.20 0.00 0.00 173.24 176.28 1xik h LEU 186 N 6.57 0.49 -0.92 3.45 5.85 -1.97 -2.31 115.31 126.48 1xik h LEU 186 Ca -0.31 -0.29 0.06 0.00 0.84 0.00 0.00 57.88 58.18 1xik h LEU 186 Cb 1.19 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 42.02 1xik h LEU 186 CO 0.60 0.99 0.58 -0.09 -0.34 0.00 0.00 178.44 180.19 1xik h ARG 187 N 0.32 1.04 -0.29 1.25 2.43 -1.99 0.02 114.38 117.16 1xik h ARG 187 Ca -0.01 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.00 1xik h ARG 187 Cb 1.17 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.47 1xik h ARG 187 CO 0.11 0.69 -0.24 1.49 -1.51 0.00 0.00 179.97 180.50 1xik h GLU 188 N 1.07 0.56 -0.17 0.20 4.57 -1.94 -1.31 114.58 117.57 1xik h GLU 188 Ca 0.39 -0.22 -0.16 0.00 -1.18 0.00 0.00 59.36 58.19 1xik h GLU 188 Cb 0.14 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 1xik h GLU 188 CO -0.16 0.76 -0.58 1.25 -1.18 0.00 0.00 179.01 179.11 1xik h LEU 189 N 0.50 0.59 -1.16 1.64 5.85 -0.75 -0.71 115.31 121.26 1xik h LEU 189 Ca 0.07 -0.32 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 1xik h LEU 189 Cb 0.69 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1xik h LEU 189 CO 0.05 1.04 0.06 0.11 -0.34 0.00 0.00 178.44 179.36 1xik h LYS 190 N 0.40 0.65 -0.30 1.25 1.57 -0.76 0.17 116.57 119.55 1xik h LYS 190 Ca 0.00 -0.13 -0.07 0.00 -1.87 0.00 0.00 60.65 58.58 1xik h LYS 190 Cb 1.12 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 1xik h LYS 190 CO 0.11 0.63 -0.10 -0.22 -0.57 0.00 0.00 179.45 179.29 1xik h LYS 191 N 0.63 0.59 -0.32 3.15 3.64 -0.90 0.70 116.57 124.06 1xik h LYS 191 Ca 0.14 -0.24 -0.05 0.00 -1.27 0.00 0.00 60.65 59.23 1xik h LYS 191 Cb 0.30 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 1xik h LYS 191 CO 0.00 0.80 0.00 0.87 -2.27 0.00 0.00 179.45 178.86 1xik h LYS 192 N 0.35 0.49 -0.08 1.90 1.79 -0.33 -1.09 116.57 119.61 1xik h LYS 192 Ca 0.07 -0.10 -0.02 0.00 -2.18 0.00 0.00 60.65 58.42 1xik h LYS 192 Cb 0.60 -0.07 -0.00 0.00 -1.58 0.00 0.00 32.23 31.17 1xik h LYS 192 CO 0.03 0.52 -0.03 1.25 -1.08 0.00 0.00 179.45 180.14 1xik h LEU 193 N 0.47 0.16 -0.64 2.94 5.85 -0.41 -1.66 115.31 122.02 1xik h LEU 193 Ca 0.10 -0.40 0.13 0.00 0.84 0.00 0.00 57.88 58.55 1xik h LEU 193 Cb 0.31 -0.04 -0.09 0.00 0.37 0.00 0.00 40.66 41.20 1xik h LEU 193 CO 0.01 0.52 0.15 0.22 -0.34 0.00 0.00 178.44 179.00 1xik h TYR 194 N -0.21 0.23 -0.31 1.25 3.20 -0.48 -0.18 116.97 120.47 1xik h TYR 194 Ca 0.02 0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.83 1xik h TYR 194 Cb 0.46 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.71 1xik h TYR 194 CO 0.06 -0.04 -0.19 -0.07 -1.64 0.00 0.00 178.16 176.28 1xik h LEU 195 N 0.27 0.57 -0.30 2.82 3.38 -1.16 -1.87 115.31 119.03 1xik h LEU 195 Ca 0.34 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 58.05 1xik h LEU 195 Cb 0.53 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1xik h LEU 195 CO -0.43 0.78 -0.13 0.00 0.09 0.00 0.00 178.44 178.74 1xik h LEU 197 N 0.37 0.76 -0.67 0.00 3.38 -0.90 0.16 115.31 118.41 1xik h LEU 197 Ca 0.07 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1xik h LEU 197 Cb 0.65 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 1xik h LEU 197 CO 0.04 0.62 0.22 -0.03 0.09 0.00 0.00 178.44 179.38 1xik h MET 198 N 0.84 1.03 -0.79 1.13 4.05 -1.26 0.25 114.93 120.19 1xik h MET 198 Ca 0.22 -0.22 -0.02 0.00 -0.28 0.00 0.00 59.70 59.40 1xik h MET 198 Cb 0.01 -0.15 -0.04 0.00 -0.80 0.00 0.00 31.60 30.62 1xik h MET 198 CO -0.04 0.89 0.40 1.03 0.23 0.00 0.00 176.91 179.42 1xik h SER 199 N 0.97 1.01 -0.25 1.39 0.87 -0.52 0.15 113.55 117.17 1xik h SER 199 Ca 0.22 -0.10 -0.16 0.00 -1.23 0.00 0.00 61.79 60.51 1xik h SER 199 Cb 0.28 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 61.98 1xik h SER 199 CO -0.01 0.84 -0.46 0.58 -0.53 0.00 0.00 176.83 177.25 1xik h VAL 200 N 1.12 1.28 -0.91 2.23 2.07 -0.25 -0.61 116.25 121.18 1xik h VAL 200 Ca 0.28 -1.65 0.02 0.00 0.82 0.00 0.00 66.70 66.17 1xik h VAL 200 Cb 0.08 1.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.33 1xik h VAL 200 CO -0.04 0.54 0.60 -1.13 0.02 0.00 0.00 177.57 177.56 1xik h ASN 201 N 0.65 1.02 -0.47 0.57 -0.73 0.33 0.12 115.58 117.08 1xik h ASN 201 Ca 0.04 -0.02 -0.11 0.00 1.87 0.00 0.00 56.30 58.07 1xik h ASN 201 Cb 1.04 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 39.36 1xik h ASN 201 CO 0.10 0.73 -0.14 0.00 -0.37 0.00 0.00 177.43 177.75 1xik h ALA 202 N 1.45 0.80 0.12 1.57 0.00 -0.50 0.32 119.26 123.02 1xik h ALA 202 Ca 0.34 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1xik h ALA 202 Cb -0.08 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1xik h ALA 202 CO -0.09 0.66 -0.06 1.25 0.00 0.00 0.00 179.25 181.01 1xik h LEU 203 N 0.84 -0.14 -0.52 0.00 6.46 -0.17 0.34 115.31 122.13 1xik h LEU 203 Ca 0.13 -0.06 -0.06 0.00 -0.12 0.00 0.00 57.88 57.77 1xik h LEU 203 Cb 0.69 0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.64 1xik h LEU 203 CO 0.05 -0.03 0.08 -0.33 -0.62 0.00 0.00 178.44 177.58 1xik h GLU 204 N -0.23 0.86 0.00 1.25 4.39 -0.65 -2.80 114.58 117.40 1xik h GLU 204 Ca -0.02 -0.24 -0.16 0.00 0.34 0.00 0.00 59.36 59.29 1xik h GLU 204 Cb 0.18 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.71 1xik h GLU 204 CO 0.03 0.85 -1.16 0.00 -1.16 0.00 0.00 179.01 177.57 1xik h ALA 205 N 0.98 0.65 0.00 3.43 0.00 -0.31 -3.41 119.26 120.60 1xik h ALA 205 Ca 0.16 -0.76 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 1xik h ALA 205 Cb 0.41 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1xik h ALA 205 CO 0.01 0.87 -0.99 -0.89 0.00 0.00 0.00 179.25 178.25 1xik n ILE 206 N -3.01 0.27 -0.30 0.00 5.41 0.12 -4.42 119.36 117.43 1xik n ILE 206 Ca -0.06 0.02 0.07 0.00 1.00 0.00 0.00 62.75 63.78 1xik n ILE 206 Cb 0.82 -1.55 0.22 0.00 -0.71 0.00 0.00 39.64 38.43 1xik n ILE 206 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 1xik h ARG 207 N -0.08 0.62 -0.10 0.38 3.08 -1.25 -1.25 114.38 115.78 1xik h ARG 207 Ca -0.05 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 59.87 1xik h ARG 207 Cb 0.93 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.84 1xik h ARG 207 CO -0.03 0.41 -0.30 0.74 -1.07 0.00 0.00 179.97 179.72 1xik h PHE 208 N 0.64 0.50 -0.47 3.04 0.04 -1.72 -2.95 116.94 116.01 1xik h PHE 208 Ca 0.46 -0.20 0.05 0.00 2.80 0.00 0.00 57.97 61.08 1xik h PHE 208 Cb 0.64 -0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.67 1xik h PHE 208 CO -0.09 0.91 0.32 1.88 -0.60 0.00 0.00 178.31 180.73 1xik h TYR 209 N -0.06 0.42 -0.60 -0.55 -1.99 -1.64 0.28 116.97 112.82 1xik h TYR 209 Ca -0.01 0.01 -0.10 0.00 2.00 0.00 0.00 58.73 60.63 1xik h TYR 209 Cb 0.92 -0.14 -0.02 0.00 2.00 0.00 0.00 36.73 39.49 1xik h TYR 209 CO 0.11 0.23 -0.02 0.28 -0.00 0.00 0.00 178.16 178.76 1xik h VAL 210 N 0.42 1.27 -0.40 -2.88 2.07 -1.24 -2.22 116.25 113.27 1xik h VAL 210 Ca 0.20 -1.18 -0.11 0.00 0.82 0.00 0.00 66.70 66.42 1xik h VAL 210 Cb 0.26 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1xik h VAL 210 CO -0.05 0.43 -0.21 0.77 0.02 0.00 0.00 177.57 178.53 1xik h SER 211 N 0.98 0.80 -0.91 0.57 4.64 -0.64 -2.70 113.55 116.28 1xik h SER 211 Ca 0.17 -0.28 0.07 0.00 -0.47 0.00 0.00 61.79 61.28 1xik h SER 211 Cb 0.59 -0.22 -0.06 0.00 -0.31 0.00 0.00 62.40 62.40 1xik h SER 211 CO 0.04 0.99 0.59 -0.26 -0.87 0.00 0.00 176.83 177.32 1xik h PHE 212 N 0.70 1.03 -0.60 4.77 0.04 -0.14 -2.08 116.94 120.66 1xik h PHE 212 Ca 0.10 0.03 0.04 0.00 2.80 0.00 0.00 57.97 60.93 1xik h PHE 212 Cb 0.72 -0.34 -0.04 0.00 2.20 0.00 0.00 35.95 38.49 1xik h PHE 212 CO 0.04 0.52 0.35 0.00 -0.60 0.00 0.00 178.31 178.62 1xik h ALA 213 N 1.52 0.78 -0.37 2.45 0.00 -1.08 0.33 119.26 122.89 1xik h ALA 213 Ca 0.40 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 1xik h ALA 213 Cb 0.26 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1xik h ALA 213 CO -0.16 0.05 0.18 0.00 0.00 0.00 0.00 179.25 179.33 1xik h SER 215 N 0.47 0.00 0.83 0.00 0.02 -1.01 -1.45 113.55 112.41 1xik h SER 215 Ca 0.13 0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 61.09 1xik h SER 215 Cb 0.11 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1xik h SER 215 CO -0.02 0.04 -0.18 -0.26 -1.14 0.00 0.00 176.83 175.27 1xik h PHE 216 N 0.16 0.00 -0.43 3.45 0.04 -0.21 -3.03 116.94 116.92 1xik h PHE 216 Ca 0.14 0.00 0.08 0.00 2.80 0.00 0.00 57.97 60.98 1xik h PHE 216 Cb 0.15 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.23 1xik h PHE 216 CO -0.17 0.18 0.03 0.00 -0.60 0.00 0.00 178.31 177.74 1xik h ALA 217 N 1.82 0.42 -0.53 2.45 0.00 -0.09 -0.06 119.26 123.27 1xik h ALA 217 Ca -0.00 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1xik h ALA 217 Cb 0.64 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1xik h ALA 217 CO 0.02 -0.37 0.27 0.74 0.00 0.00 0.00 179.25 179.91 1xik h PHE 218 N 0.14 0.76 -0.87 0.00 0.04 -1.49 -2.73 116.94 112.78 1xik h PHE 218 Ca 0.21 -0.03 0.04 0.00 2.80 0.00 0.00 57.97 60.99 1xik h PHE 218 Cb 0.30 -0.24 -0.05 0.00 2.20 0.00 0.00 35.95 38.16 1xik h PHE 218 CO -0.26 0.58 0.55 0.00 -0.60 0.00 0.00 178.31 178.58 1xik h ALA 219 N 1.10 1.15 0.00 2.45 0.00 -1.24 -0.45 119.26 122.28 1xik h ALA 219 Ca 0.18 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1xik h ALA 219 Cb 0.10 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1xik h ALA 219 CO -0.03 0.37 -0.07 0.93 0.00 0.00 0.00 179.25 180.46 1xik h GLU 220 N 1.06 0.00 -0.52 0.00 4.39 -0.74 0.25 114.58 119.02 1xik h GLU 220 Ca 0.35 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.05 1xik h GLU 220 Cb 0.05 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 1xik h GLU 220 CO -0.13 0.07 0.00 0.54 -1.16 0.00 0.00 179.01 178.32 1xik n ARG 221 N -3.42 2.26 -1.65 2.33 1.74 -0.32 -4.91 116.66 112.70 1xik n ARG 221 Ca -0.02 -1.85 -0.12 0.00 -0.77 0.00 0.00 57.85 55.10 1xik n ARG 221 Cb 0.21 -1.43 -0.04 0.00 -1.02 0.00 0.00 32.46 30.18 1xik n ARG 221 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1xik n GLU 222 N 0.95 -0.88 -4.20 5.56 1.02 0.89 -5.03 120.64 118.96 1xik n GLU 222 Ca 0.17 0.81 -0.28 0.00 -0.02 0.00 0.00 57.16 57.84 1xik n GLU 222 Cb 0.46 -4.87 -0.08 0.00 -0.02 0.00 0.00 31.44 26.92 1xik n GLU 222 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1xik s LEU 223 N -2.97 3.26 -1.23 -4.62 1.43 -0.39 -4.75 118.68 109.42 1xik s LEU 223 Ca 0.00 -0.36 -0.18 0.00 -1.03 0.00 0.00 54.13 52.56 1xik s LEU 223 Cb 0.00 -1.97 0.00 0.00 0.03 0.00 0.00 46.19 44.25 1xik s LEU 223 CO 0.00 0.13 0.66 0.23 0.23 0.00 0.00 176.35 177.60 1xik n MET 224 N 0.23 -1.50 0.11 1.70 2.81 -1.26 -3.02 117.12 116.19 1xik n MET 224 Ca -0.11 0.36 0.13 0.00 -1.81 0.00 0.00 57.70 56.26 1xik n MET 224 Cb 0.54 -3.88 0.44 0.00 -0.71 0.00 0.00 33.22 29.61 1xik n MET 224 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1xik n GLU 225 N -4.42 0.23 -0.02 0.03 -0.58 -1.26 -1.97 120.64 112.64 1xik n GLU 225 Ca -0.15 0.29 -0.11 0.00 -0.42 0.00 0.00 57.16 56.77 1xik n GLU 225 Cb 0.61 -1.82 -0.09 0.00 -0.57 0.00 0.00 31.44 29.57 1xik n GLU 225 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1xik h GLY 226 N 3.66 -0.07 0.37 0.62 0.00 -1.90 -2.30 103.07 103.46 1xik h GLY 226 Ca 0.00 0.03 0.12 0.00 0.00 0.00 0.00 47.33 47.48 1xik h GLY 226 CO 0.00 -0.03 0.49 -0.57 0.00 0.00 0.00 176.54 176.43 1xik h ASN 227 N -0.90 0.66 -0.47 0.19 -1.24 -1.90 -0.98 115.58 110.94 1xik h ASN 227 Ca -0.01 0.07 -0.08 0.00 0.71 0.00 0.00 56.30 56.99 1xik h ASN 227 Cb 0.63 -0.05 -0.02 0.00 0.73 0.00 0.00 38.32 39.61 1xik h ASN 227 CO 0.01 0.33 0.01 0.00 -1.29 0.00 0.00 177.43 176.49 1xik h ALA 228 N 1.52 1.03 -0.68 1.57 0.00 -1.36 0.15 119.26 121.49 1xik h ALA 228 Ca 0.45 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1xik h ALA 228 Cb 0.53 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1xik h ALA 228 CO -0.30 0.60 0.27 0.87 0.00 0.00 0.00 179.25 180.69 1xik h LYS 229 N 0.82 1.01 -0.01 0.00 1.57 -0.63 0.12 116.57 119.46 1xik h LYS 229 Ca 0.16 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1xik h LYS 229 Cb 0.47 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 1xik h LYS 229 CO 0.02 0.85 0.01 0.82 -0.57 0.00 0.00 179.45 180.57 1xik h ILE 230 N 0.96 1.06 -0.88 1.86 2.04 -0.80 -1.99 117.51 119.76 1xik h ILE 230 Ca 0.23 -0.17 0.06 0.00 1.00 0.00 0.00 64.86 65.97 1xik h ILE 230 Cb 0.21 1.15 -0.06 0.00 -0.74 0.00 0.00 36.82 37.39 1xik h ILE 230 CO -0.02 0.05 0.57 0.40 0.00 0.00 0.00 178.15 179.15 1xik h ILE 231 N -0.05 1.08 -0.86 -0.67 1.08 -0.33 0.30 117.51 118.06 1xik h ILE 231 Ca 0.00 -0.35 -0.03 0.00 -0.39 0.00 0.00 64.86 64.10 1xik h ILE 231 Cb 0.07 -0.02 -0.04 0.00 -3.07 0.00 0.00 36.82 33.76 1xik h ILE 231 CO -0.00 0.18 0.42 0.03 -0.69 0.00 0.00 178.15 178.10 1xik h ARG 232 N 1.01 1.24 -0.28 2.37 3.08 -0.46 0.38 114.38 121.73 1xik h ARG 232 Ca 0.37 -0.18 -0.03 0.00 0.07 0.00 0.00 59.98 60.21 1xik h ARG 232 Cb 0.16 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1xik h ARG 232 CO -0.13 0.94 0.04 -0.07 -1.07 0.00 0.00 179.97 179.68 1xik h LEU 233 N 1.23 0.44 -0.47 3.04 3.38 -0.00 -0.30 115.31 122.63 1xik h LEU 233 Ca 0.30 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1xik h LEU 233 Cb 0.11 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1xik h LEU 233 CO -0.04 0.59 0.28 0.40 0.09 0.00 0.00 178.44 179.77 1xik h ILE 234 N 0.28 1.05 -0.93 1.22 2.04 -0.18 -2.34 117.51 118.65 1xik h ILE 234 Ca 0.08 -0.20 0.01 0.00 1.00 0.00 0.00 64.86 65.76 1xik h ILE 234 Cb 0.34 0.44 -0.05 0.00 -0.74 0.00 0.00 36.82 36.81 1xik h ILE 234 CO 0.01 0.10 0.62 0.00 0.00 0.00 0.00 178.15 178.88 1xik h ALA 235 N 1.21 1.33 -0.45 1.87 0.00 0.03 0.89 119.26 124.15 1xik h ALA 235 Ca 0.19 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1xik h ALA 235 Cb 0.01 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.40 1xik h ALA 235 CO -0.08 0.62 0.26 -0.09 0.00 0.00 0.00 179.25 179.96 1xik h ARG 236 N 1.26 0.60 -0.00 0.00 2.43 -0.53 -2.32 114.38 115.82 1xik h ARG 236 Ca 0.34 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.44 1xik h ARG 236 Cb -0.15 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.28 1xik h ARG 236 CO -0.07 0.43 -0.07 -0.44 -1.51 0.00 0.00 179.97 178.32 1xik h ASP 237 N 0.62 0.06 -0.21 -3.80 3.32 -0.64 -3.22 116.42 112.55 1xik h ASP 237 Ca 0.16 -0.76 0.06 0.00 0.02 0.00 0.00 57.03 56.51 1xik h ASP 237 Cb -0.01 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1xik h ASP 237 CO -0.03 0.81 0.20 -0.33 -1.72 0.00 0.00 179.24 178.17 1xik h GLU 238 N -0.68 0.00 -0.66 3.56 4.39 -0.71 0.12 114.58 120.60 1xik h GLU 238 Ca -0.01 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.64 1xik h GLU 238 Cb 0.82 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.44 1xik h GLU 238 CO 0.01 0.00 0.22 0.00 -1.16 0.00 0.00 179.01 178.08 1xik h ALA 239 N 1.80 1.14 -0.34 3.43 0.00 -1.43 0.82 119.26 124.67 1xik h ALA 239 Ca 0.10 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 1xik h ALA 239 Cb 0.50 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1xik h ALA 239 CO -0.00 0.60 -0.22 -0.07 0.00 0.00 0.00 179.25 179.56 1xik h LEU 240 N 0.98 0.79 -0.44 0.00 3.38 -0.82 -2.06 115.31 117.14 1xik h LEU 240 Ca 0.22 -0.43 0.06 0.00 0.09 0.00 0.00 57.88 57.82 1xik h LEU 240 Cb 0.26 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 1xik h LEU 240 CO -0.01 1.05 0.12 0.45 0.09 0.00 0.00 178.44 180.14 1xik h HIS 241 N 0.54 0.20 -0.00 1.13 3.86 -0.06 -0.55 115.15 120.27 1xik h HIS 241 Ca 0.07 0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.22 1xik h HIS 241 Cb 0.78 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 29.21 1xik h HIS 241 CO 0.06 0.05 -0.39 1.37 0.86 0.00 0.00 177.93 179.88 1xik h LEU 242 N 0.26 0.00 -0.83 2.43 8.10 -0.89 -0.19 115.31 124.20 1xik h LEU 242 Ca 0.21 -0.00 -0.08 0.00 0.11 0.00 0.00 57.88 58.11 1xik h LEU 242 Cb 0.24 -0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.44 1xik h LEU 242 CO -0.25 0.40 -0.03 0.74 -4.11 0.00 0.00 178.44 175.19 1xik h THR 243 N 0.00 1.25 -0.35 0.15 2.02 -0.52 -1.08 112.91 114.38 1xik h THR 243 Ca -0.00 -1.08 -0.09 0.00 0.77 0.00 0.00 66.41 66.00 1xik h THR 243 Cb 0.70 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 68.00 1xik h THR 243 CO 0.05 0.38 -0.15 1.23 0.37 0.00 0.00 175.52 177.40 1xik h GLY 244 N 0.98 0.77 1.26 2.16 0.00 0.22 -1.87 103.07 106.60 1xik h GLY 244 Ca 0.14 -0.68 -0.13 0.00 0.00 0.00 0.00 47.33 46.66 1xik h GLY 244 CO 0.03 0.62 -0.29 -0.91 0.00 0.00 0.00 176.54 175.99 1xik h THR 245 N 0.50 1.28 -0.55 4.70 1.35 -0.88 -1.42 112.91 117.88 1xik h THR 245 Ca 0.08 -1.44 0.02 0.00 -0.55 0.00 0.00 66.41 64.51 1xik h THR 245 Cb 0.68 1.29 -0.03 0.00 -1.73 0.00 0.00 68.15 68.35 1xik h THR 245 CO 0.05 0.48 0.35 1.56 -0.25 0.00 0.00 175.52 177.71 1xik h GLN 246 N 0.71 0.68 -0.55 4.72 4.20 -1.15 0.32 115.11 124.03 1xik h GLN 246 Ca 0.08 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 1xik h GLN 246 Cb 0.84 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.44 1xik h GLN 246 CO 0.07 0.45 0.32 0.45 -0.67 0.00 0.00 178.83 179.45 1xik h HIS 247 N 0.70 0.74 -0.55 2.96 3.86 -1.16 0.48 115.15 122.17 1xik h HIS 247 Ca 0.21 -0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.43 1xik h HIS 247 Cb -0.02 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 28.17 1xik h HIS 247 CO -0.05 0.52 0.35 0.52 0.86 0.00 0.00 177.93 180.13 1xik h MET 248 N 0.74 0.69 0.06 2.45 2.86 -0.73 0.40 114.93 121.40 1xik h MET 248 Ca 0.20 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1xik h MET 248 Cb 0.01 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.52 1xik h MET 248 CO -0.03 0.46 -0.03 -0.07 1.06 0.00 0.00 176.91 178.29 1xik h LEU 249 N 0.71 -0.07 -0.67 1.22 3.38 -0.44 0.10 115.31 119.54 1xik h LEU 249 Ca 0.21 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1xik h LEU 249 Cb -0.04 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1xik h LEU 249 CO -0.07 0.14 0.30 0.78 0.09 0.00 0.00 178.44 179.68 1xik h ASN 250 N -0.28 0.90 -0.72 -0.43 -0.26 0.21 -1.05 115.58 113.96 1xik h ASN 250 Ca -0.01 -0.15 -0.05 0.00 -0.56 0.00 0.00 56.30 55.53 1xik h ASN 250 Cb 0.24 -0.23 -0.03 0.00 -1.06 0.00 0.00 38.32 37.24 1xik h ASN 250 CO 0.01 0.81 0.25 -0.07 -1.06 0.00 0.00 177.43 177.37 1xik h LEU 251 N 0.94 1.04 -0.76 1.61 3.38 -0.08 0.14 115.31 121.58 1xik h LEU 251 Ca 0.23 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1xik h LEU 251 Cb 0.16 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 1xik h LEU 251 CO -0.02 0.95 0.37 -0.07 0.09 0.00 0.00 178.44 179.76 1xik h LEU 252 N 1.08 0.99 -0.72 1.67 3.38 -0.45 -2.84 115.31 118.41 1xik h LEU 252 Ca 0.24 -0.13 -0.13 0.00 0.09 0.00 0.00 57.88 57.94 1xik h LEU 252 Cb 0.27 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1xik h LEU 252 CO -0.01 0.84 -0.64 -0.09 0.09 0.00 0.00 178.44 178.63 1xik h ARG 253 N 1.07 0.00 0.00 1.13 9.65 -0.68 -2.68 114.38 122.87 1xik h ARG 253 Ca 0.26 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.14 1xik h ARG 253 Cb 0.11 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.69 1xik h ARG 253 CO -0.03 0.64 0.00 -1.13 2.80 0.00 0.00 179.97 182.25 1xik n SER 254 N -3.78 0.16 0.00 -3.80 3.41 -0.01 -4.64 113.62 104.96 1xik n SER 254 Ca -0.01 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 1xik n SER 254 Cb 0.63 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 1xik n SER 254 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xik n GLY 255 N -1.07 0.92 0.25 5.00 0.00 -1.02 -4.85 105.19 104.42 1xik n GLY 255 Ca 0.01 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 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 1.00 -3.00 4.61 0.00 -1.83 -3.38 119.26 116.66 1xik h ALA 256 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xik h ALA 256 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1xik h ALA 256 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 179.25 175.78 1xik n ASP 257 N -2.93 0.00 -4.63 0.00 2.03 -1.26 -4.95 116.55 104.80 1xik n ASP 257 Ca 0.01 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.89 1xik n ASP 257 Cb 0.28 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.65 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 -0.97 6.88 0.40 1.67 2.15 -1.26 -4.91 116.67 120.64 1xik s ASP 258 Ca 0.00 0.99 0.10 0.00 0.43 0.00 0.00 52.55 54.06 1xik s ASP 258 Cb 0.00 -2.51 0.85 0.00 -0.30 0.00 0.00 42.92 40.96 1xik s ASP 258 CO 0.00 -0.80 1.96 -0.65 -0.17 0.00 0.00 175.17 175.52 1xik h PRO 259 N 8.04 0.26 0.00 4.34 0.11 -1.92 -0.02 132.00 142.80 1xik h PRO 259 Ca -0.21 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.82 1xik h PRO 259 Cb 1.07 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1xik h PRO 259 CO 0.99 0.33 -0.17 1.49 -0.21 0.00 0.00 178.00 180.44 1xik h GLU 260 N 0.25 0.00 0.00 1.05 4.81 -1.93 -2.61 114.58 116.15 1xik h GLU 260 Ca 0.06 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.21 1xik h GLU 260 Cb 0.27 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 1xik h GLU 260 CO 0.01 0.17 -0.37 0.52 -0.73 0.00 0.00 179.01 178.61 1xik h MET 261 N 0.00 0.00 0.05 1.92 2.86 -1.29 -1.69 114.93 116.78 1xik h MET 261 Ca -0.00 0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.41 1xik h MET 261 Cb 0.46 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 1xik h MET 261 CO 0.02 0.37 -1.04 0.00 1.06 0.00 0.00 176.91 177.32 1xik h ALA 262 N 1.63 0.32 -0.11 6.32 0.00 -1.40 -1.15 119.26 124.86 1xik h ALA 262 Ca -0.00 -0.81 -0.13 0.00 0.00 0.00 0.00 54.91 53.96 1xik h ALA 262 Cb 0.84 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1xik h ALA 262 CO 0.05 0.98 -0.52 0.93 0.00 0.00 0.00 179.25 180.70 1xik h GLU 263 N 0.09 0.31 -0.34 0.00 5.08 -1.39 -2.30 114.58 116.02 1xik h GLU 263 Ca -0.07 -0.18 -0.12 0.00 -1.00 0.00 0.00 59.36 57.98 1xik h GLU 263 Cb 1.73 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.99 1xik h GLU 263 CO 0.16 0.75 -0.27 0.82 -1.00 0.00 0.00 179.01 179.48 1xik h ILE 264 N 0.24 1.29 -0.95 3.13 2.04 -1.22 -0.26 117.51 121.78 1xik h ILE 264 Ca 0.01 -1.42 0.08 0.00 1.00 0.00 0.00 64.86 64.52 1xik h ILE 264 Cb 0.99 1.44 -0.07 0.00 -0.74 0.00 0.00 36.82 38.45 1xik h ILE 264 CO 0.08 0.47 0.60 0.00 0.00 0.00 0.00 178.15 179.30 1xik h ALA 265 N 0.75 1.34 0.93 1.87 0.00 -1.02 0.28 119.26 123.42 1xik h ALA 265 Ca 0.06 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1xik h ALA 265 Cb 0.83 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.38 1xik h ALA 265 CO 0.07 0.33 -0.45 1.49 0.00 0.00 0.00 179.25 180.69 1xik h GLU 266 N 1.06 -1.20 -0.72 0.00 4.57 -1.16 -2.11 114.58 115.02 1xik h GLU 266 Ca 0.43 0.08 0.11 0.00 -1.18 0.00 0.00 59.36 58.80 1xik h GLU 266 Cb 0.25 0.27 -0.05 0.00 -0.16 0.00 0.00 28.75 29.06 1xik h GLU 266 CO -0.20 -0.80 0.47 0.93 -1.18 0.00 0.00 179.01 178.24 1xik h GLU 267 N -1.31 0.53 -0.66 1.92 5.08 -0.35 -2.41 114.58 117.37 1xik h GLU 267 Ca -0.13 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1xik h GLU 267 Cb 0.96 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1xik h GLU 267 CO 0.21 0.35 0.00 0.00 -1.00 0.00 0.00 179.01 178.57 1xik h LYS 269 N 4.16 0.34 -0.06 0.00 3.64 -0.85 0.86 116.57 124.67 1xik h LYS 269 Ca 0.00 -0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 59.20 1xik h LYS 269 Cb 1.48 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 33.21 1xik h LYS 269 CO 0.24 0.23 -0.68 0.37 -2.27 0.00 0.00 179.45 177.34 1xik h GLN 270 N 0.35 0.26 -0.54 1.90 5.75 -1.85 -1.21 115.11 119.76 1xik h GLN 270 Ca 0.55 -0.20 -0.12 0.00 -0.15 0.00 0.00 58.65 58.73 1xik h GLN 270 Cb 1.47 0.04 -0.02 0.00 1.07 0.00 0.00 27.48 30.04 1xik h GLN 270 CO -0.22 0.84 -0.13 0.93 -2.65 0.00 0.00 178.83 177.60 1xik h GLU 271 N 0.18 1.04 -0.05 1.69 3.07 -1.23 0.21 114.58 119.49 1xik h GLU 271 Ca -0.02 -0.39 0.00 0.00 -0.50 0.00 0.00 59.36 58.45 1xik h GLU 271 Cb 1.22 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 29.07 1xik h GLU 271 CO 0.11 1.09 0.03 0.00 -1.40 0.00 0.00 179.01 178.83 1xik h TYR 273 N 0.04 -0.15 -0.90 0.00 3.20 -0.85 -2.57 116.97 115.73 1xik h TYR 273 Ca 0.02 0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.98 1xik h TYR 273 Cb 0.02 0.11 -0.06 0.00 1.54 0.00 0.00 36.73 38.34 1xik h TYR 273 CO -0.07 -0.12 0.56 -0.44 -1.64 0.00 0.00 178.16 176.45 1xik h ASP 274 N -0.00 0.89 -0.06 -2.11 3.32 -0.31 -1.92 116.42 116.23 1xik h ASP 274 Ca 0.13 0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.12 1xik h ASP 274 Cb 0.21 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1xik h ASP 274 CO -0.29 0.56 -0.21 0.17 -1.72 0.00 0.00 179.24 177.76 1xik h LEU 275 N 1.02 0.45 -0.44 1.55 8.10 -0.98 0.47 115.31 125.47 1xik h LEU 275 Ca 0.39 -0.14 -0.15 0.00 0.11 0.00 0.00 57.88 58.10 1xik h LEU 275 Cb 0.18 -0.12 -0.01 0.00 -0.44 0.00 0.00 40.66 40.27 1xik h LEU 275 CO -0.18 0.66 -0.30 -0.26 -4.11 0.00 0.00 178.44 174.26 1xik h PHE 276 N 0.41 1.14 -0.40 0.17 0.04 -1.37 0.34 116.94 117.27 1xik h PHE 276 Ca 0.07 -0.31 -0.03 0.00 2.80 0.00 0.00 57.97 60.49 1xik h PHE 276 Cb 0.59 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 38.47 1xik h PHE 276 CO 0.02 1.14 0.12 0.28 -0.60 0.00 0.00 178.31 179.27 1xik h VAL 277 N 0.82 1.22 -0.71 -0.55 2.07 -0.85 0.15 116.25 118.39 1xik h VAL 277 Ca 0.09 -0.72 -0.04 0.00 0.82 0.00 0.00 66.70 66.85 1xik h VAL 277 Cb 0.89 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 1xik h VAL 277 CO 0.08 0.25 0.30 -0.61 0.02 0.00 0.00 177.57 177.61 1xik h GLN 278 N 0.51 1.04 0.38 1.57 4.15 0.34 -0.26 115.11 122.84 1xik h GLN 278 Ca 0.13 -0.17 -0.02 0.00 0.77 0.00 0.00 58.65 59.36 1xik h GLN 278 Cb 0.27 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.78 1xik h GLN 278 CO -0.00 0.84 -0.18 0.00 -1.93 0.00 0.00 178.83 177.55 1xik h ALA 279 N 1.30 -0.51 -1.00 3.38 0.00 0.42 -0.48 119.26 122.37 1xik h ALA 279 Ca 0.24 -0.16 0.20 0.00 0.00 0.00 0.00 54.91 55.19 1xik h ALA 279 Cb 0.17 0.20 -0.11 0.00 0.00 0.00 0.00 17.79 18.05 1xik h ALA 279 CO -0.02 -0.70 0.61 0.00 0.00 0.00 0.00 179.25 179.14 1xik h ALA 280 N -0.14 1.74 -0.48 0.00 0.00 -0.58 0.01 119.26 119.80 1xik h ALA 280 Ca -0.05 0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 1xik h ALA 280 Cb 0.49 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1xik h ALA 280 CO 0.09 -0.12 -0.17 0.37 0.00 0.00 0.00 179.25 179.42 1xik h GLN 281 N 0.71 0.97 -0.70 0.00 5.75 -0.70 -2.46 115.11 118.69 1xik h GLN 281 Ca 0.58 -0.39 0.02 0.00 -0.15 0.00 0.00 58.65 58.70 1xik h GLN 281 Cb 0.97 -0.04 -0.04 0.00 1.07 0.00 0.00 27.48 29.44 1xik h GLN 281 CO -0.37 1.06 0.46 1.96 -2.65 0.00 0.00 178.83 179.29 1xik h GLN 282 N 0.82 0.87 -0.02 1.69 4.20 0.67 -1.05 115.11 122.28 1xik h GLN 282 Ca 0.12 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.67 1xik h GLN 282 Cb 0.74 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 1xik h GLN 282 CO 0.06 0.57 -0.47 0.93 -0.67 0.00 0.00 178.83 179.25 1xik h GLU 283 N 0.89 0.04 0.20 1.46 4.39 -1.08 -1.90 114.58 118.58 1xik h GLU 283 Ca 0.27 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.94 1xik h GLU 283 Cb -0.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.62 1xik h GLU 283 CO -0.07 0.50 -0.10 0.87 -1.16 0.00 0.00 179.01 179.06 1xik h LYS 284 N 0.03 -0.26 -0.60 2.33 1.57 -0.89 -2.79 116.57 115.97 1xik h LYS 284 Ca -0.00 0.02 0.17 0.00 -1.87 0.00 0.00 60.65 58.97 1xik h LYS 284 Cb 0.84 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.19 1xik h LYS 284 CO 0.06 0.11 0.47 -0.44 -0.57 0.00 0.00 179.45 179.08 1xik h ASP 285 N -0.70 0.00 -0.68 0.86 3.32 -1.11 0.30 116.42 118.41 1xik h ASP 285 Ca -0.03 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 1xik h ASP 285 Cb 0.49 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.01 1xik h ASP 285 CO 0.04 0.00 0.35 -0.25 -1.72 0.00 0.00 179.24 177.66 1xik h TRP 286 N 0.00 0.96 -1.15 4.55 2.91 -1.07 -2.43 115.95 119.71 1xik h TRP 286 Ca 0.28 -0.04 0.38 0.00 1.13 0.00 0.00 58.89 60.64 1xik h TRP 286 Cb 1.22 -0.30 -0.13 0.00 -0.51 0.00 0.00 29.16 29.43 1xik h TRP 286 CO 0.00 0.70 0.71 0.00 -1.03 0.00 0.00 178.44 178.82 1xik h ALA 287 N 1.17 2.38 0.00 2.65 0.00 -0.29 0.74 119.26 125.90 1xik h ALA 287 Ca 0.24 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1xik h ALA 287 Cb 0.08 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1xik h ALA 287 CO -0.03 -0.99 0.00 -0.44 0.00 0.00 0.00 179.25 177.79 1xik h ASP 288 N 0.19 0.00 0.15 0.00 3.32 -1.52 -0.61 116.42 117.96 1xik h ASP 288 Ca 0.77 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 57.46 1xik h ASP 288 Cb 2.13 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 41.64 1xik h ASP 288 CO -0.49 0.00 -2.07 0.00 -1.72 0.00 0.00 179.24 174.95 1xik n TYR 289 N -3.01 0.88 0.09 4.55 9.36 0.24 -4.13 117.16 125.15 1xik n TYR 289 Ca 0.02 0.21 -0.13 0.00 3.32 0.00 0.00 57.90 61.32 1xik n TYR 289 Cb 0.36 -1.12 -0.07 0.00 -0.63 0.00 0.00 39.34 37.87 1xik n TYR 289 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 1xik h LEU 290 N 0.04 -0.15 -3.94 2.98 5.85 -1.03 -3.15 115.31 115.92 1xik h LEU 290 Ca -0.44 0.01 -0.41 0.00 0.84 0.00 0.00 57.88 57.87 1xik h LEU 290 Cb 2.02 0.04 -0.16 0.00 0.37 0.00 0.00 40.66 42.93 1xik h LEU 290 CO 0.05 -0.10 0.43 0.49 -0.34 0.00 0.00 178.44 178.96 1xik n PHE 291 N -5.17 1.65 -0.06 1.25 3.72 -0.25 -4.61 117.46 113.99 1xik n PHE 291 Ca -0.08 -2.01 -0.14 0.00 -0.05 0.00 0.00 57.45 55.17 1xik n PHE 291 Cb 0.10 -1.16 -0.06 0.00 -0.94 0.00 0.00 39.48 37.41 1xik n PHE 291 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1xik h ARG 292 N 2.13 0.60 -0.40 -1.08 1.12 -1.70 -3.15 114.38 111.91 1xik h ARG 292 Ca 0.35 -0.38 0.00 0.00 -1.11 0.00 0.00 59.98 58.84 1xik h ARG 292 Cb 0.83 0.04 0.00 0.00 -0.01 0.00 0.00 29.97 30.84 1xik h ARG 292 CO 0.85 0.99 0.00 -0.25 -3.11 0.00 0.00 179.97 178.45 1xik n ASP 293 N -4.27 3.26 0.00 -3.80 8.00 -1.26 -5.03 116.55 113.44 1xik n ASP 293 Ca -0.06 -1.93 0.00 0.00 0.71 0.00 0.00 54.79 53.51 1xik n ASP 293 Cb 0.52 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 1xik n ASP 293 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xik n GLY 294 N 1.21 2.62 0.00 0.44 0.00 -1.19 -4.83 105.19 103.44 1xik n GLY 294 Ca 0.17 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 44.06 1xik n GLY 294 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xik n SER 295 N 0.00 0.00 -4.52 1.61 3.41 -1.26 -4.49 113.62 108.37 1xik n SER 295 Ca 0.00 -0.44 -0.26 0.00 -0.26 0.00 0.00 58.87 57.92 1xik n SER 295 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 1xik n SER 295 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1xik s MET 296 N 0.52 1.85 -0.15 4.33 1.00 -0.60 -4.92 119.30 121.33 1xik s MET 296 Ca 0.00 -2.06 0.01 0.00 0.00 0.00 0.00 55.69 53.63 1xik s MET 296 Cb 0.00 -1.20 0.19 0.00 0.00 0.00 0.00 34.83 33.82 1xik s MET 296 CO 0.00 -0.18 1.44 -0.89 0.00 0.00 0.00 175.02 175.38 1xik n ILE 297 N -0.87 1.85 -1.87 2.53 2.08 -1.26 -3.09 119.36 118.72 1xik n ILE 297 Ca -0.05 -0.72 0.00 0.00 0.56 0.00 0.00 62.75 62.53 1xik n ILE 297 Cb 0.67 -0.96 0.00 0.00 -0.75 0.00 0.00 39.64 38.60 1xik n ILE 297 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1xik n GLY 298 N 0.16 0.94 3.61 7.39 0.00 -1.26 -5.11 105.19 110.92 1xik n GLY 298 Ca 0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.75 0.28 0.99 2.96 -1.18 -5.05 118.68 115.93 1xik s LEU 299 Ca 0.00 1.43 -0.15 0.00 -0.22 0.00 0.00 54.13 55.20 1xik s LEU 299 Cb 0.00 2.37 0.01 0.00 0.50 0.00 0.00 46.19 49.07 1xik s LEU 299 CO 0.00 -0.24 0.57 0.54 -1.32 0.00 0.00 176.35 175.90 1xik s ASN 300 N 0.82 -0.06 0.54 3.68 2.20 -1.26 -1.55 114.94 119.30 1xik s ASN 300 Ca -0.04 -0.89 0.25 0.00 -0.94 0.00 0.00 52.86 51.24 1xik s ASN 300 Cb -0.05 0.66 1.41 0.00 -2.00 0.00 0.00 41.25 41.27 1xik s ASN 300 CO -0.06 -1.26 2.01 0.50 -2.94 0.00 0.00 177.10 175.35 1xik h LYS 301 N 2.15 0.00 0.45 3.55 3.64 -1.98 -2.51 116.57 121.87 1xik h LYS 301 Ca -0.25 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.11 1xik h LYS 301 Cb 1.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1xik h LYS 301 CO 0.32 0.00 -0.22 -0.44 -2.27 0.00 0.00 179.45 176.85 1xik h ASP 302 N 0.00 -0.51 -0.68 4.20 5.19 -1.98 0.95 116.42 123.59 1xik h ASP 302 Ca 0.21 -0.08 -0.05 0.00 -0.62 0.00 0.00 57.03 56.49 1xik h ASP 302 Cb 0.89 0.13 -0.03 0.00 0.18 0.00 0.00 39.33 40.50 1xik h ASP 302 CO -0.00 -0.20 0.24 0.40 -3.12 0.00 0.00 179.24 176.56 1xik h ILE 303 N -0.84 1.25 0.03 0.35 2.04 -1.93 -0.67 117.51 117.74 1xik h ILE 303 Ca -0.06 -0.83 0.01 0.00 1.00 0.00 0.00 64.86 64.97 1xik h ILE 303 Cb 0.56 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1xik h ILE 303 CO 0.10 0.33 -0.20 0.25 0.00 0.00 0.00 178.15 178.63 1xik h LEU 304 N 0.99 -0.61 -1.03 1.44 7.12 -1.47 0.14 115.31 121.89 1xik h LEU 304 Ca 0.22 0.06 0.29 0.00 0.13 0.00 0.00 57.88 58.58 1xik h LEU 304 Cb 0.26 0.23 -0.13 0.00 -0.53 0.00 0.00 40.66 40.48 1xik h LEU 304 CO -0.01 -0.20 0.59 0.00 -0.13 0.00 0.00 178.44 178.69 1xik h GLN 306 N 0.45 0.68 -0.44 0.00 4.20 -0.49 -2.52 115.11 116.98 1xik h GLN 306 Ca 0.69 -0.57 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1xik h GLN 306 Cb 1.47 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 29.35 1xik h GLN 306 CO -0.52 1.18 0.28 -0.92 -0.67 0.00 0.00 178.83 178.18 1xik h TYR 307 N 0.36 0.57 -0.82 2.96 3.20 0.12 -0.49 116.97 122.87 1xik h TYR 307 Ca -0.05 0.01 0.12 0.00 3.14 0.00 0.00 58.73 61.95 1xik h TYR 307 Cb 1.32 -0.19 -0.08 0.00 1.54 0.00 0.00 36.73 39.31 1xik h TYR 307 CO 0.10 0.38 0.43 0.28 -1.64 0.00 0.00 178.16 177.71 1xik h VAL 308 N 0.60 0.80 -0.38 1.81 2.07 -0.77 0.21 116.25 120.58 1xik h VAL 308 Ca 0.16 -0.23 -0.14 0.00 0.82 0.00 0.00 66.70 67.31 1xik h VAL 308 Cb -0.04 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.80 1xik h VAL 308 CO -0.03 0.12 -0.32 -0.33 0.02 0.00 0.00 177.57 177.02 1xik h GLU 309 N 0.67 0.86 0.23 1.57 5.08 -1.01 -1.22 114.58 120.75 1xik h GLU 309 Ca 0.42 -0.41 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1xik h GLU 309 Cb 0.52 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 1xik h GLU 309 CO -0.31 1.05 -0.45 -0.92 -1.00 0.00 0.00 179.01 177.38 1xik h TYR 310 N 0.72 -1.27 -0.67 4.33 3.20 0.10 -0.89 116.97 122.48 1xik h TYR 310 Ca 0.07 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.89 1xik h TYR 310 Cb 0.89 0.53 -0.03 0.00 1.54 0.00 0.00 36.73 39.66 1xik h TYR 310 CO 0.05 -0.54 0.10 0.97 -1.64 0.00 0.00 178.16 177.10 1xik h ILE 311 N -0.73 1.26 -0.94 1.81 6.09 -0.62 -2.70 117.51 121.68 1xik h ILE 311 Ca -0.02 -1.05 0.04 0.00 -1.37 0.00 0.00 64.86 62.45 1xik h ILE 311 Cb 0.69 0.64 -0.06 0.00 0.47 0.00 0.00 36.82 38.56 1xik h ILE 311 CO -0.17 0.40 0.61 0.74 -3.07 0.00 0.00 178.15 176.65 1xik h THR 312 N 1.04 1.15 -0.72 2.19 2.02 -1.06 -0.51 112.91 117.02 1xik h THR 312 Ca 0.20 -0.40 -0.06 0.00 0.77 0.00 0.00 66.41 66.92 1xik h THR 312 Cb 0.46 -0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 66.70 1xik h THR 312 CO 0.01 0.21 0.23 0.78 0.37 0.00 0.00 175.52 177.13 1xik h ASN 313 N 1.17 1.04 -0.13 4.18 4.21 -0.92 -1.19 115.58 123.94 1xik h ASN 313 Ca 0.38 -0.21 0.01 0.00 1.21 0.00 0.00 56.30 57.70 1xik h ASN 313 Cb 0.03 -0.27 -0.01 0.00 -1.12 0.00 0.00 38.32 36.94 1xik h ASN 313 CO -0.13 0.97 0.04 0.40 -1.29 0.00 0.00 177.43 177.43 1xik h ILE 314 N 1.06 0.97 -0.18 2.81 2.04 -0.83 -2.26 117.51 121.12 1xik h ILE 314 Ca 0.23 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 66.04 1xik h ILE 314 Cb 0.30 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1xik h ILE 314 CO -0.01 0.02 0.04 0.03 0.00 0.00 0.00 178.15 178.23 1xik h ARG 315 N 0.11 0.29 -0.68 2.37 2.47 -1.03 -2.22 114.38 115.69 1xik h ARG 315 Ca 0.06 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 1xik h ARG 315 Cb 0.03 -0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.28 1xik h ARG 315 CO -0.06 0.42 0.44 0.52 0.56 0.00 0.00 179.97 181.85 1xik h MET 316 N 0.10 0.90 0.00 0.04 2.86 -1.21 -0.12 114.93 117.49 1xik h MET 316 Ca 0.06 -0.06 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 1xik h MET 316 Cb 0.27 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 1xik h MET 316 CO 0.00 0.60 -0.50 0.37 1.06 0.00 0.00 176.91 178.44 1xik h GLN 317 N 0.92 0.00 0.00 1.72 4.15 -1.25 0.70 115.11 121.36 1xik h GLN 317 Ca 0.25 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.64 1xik h GLN 317 Cb -0.09 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.60 1xik h GLN 317 CO -0.05 0.50 -0.15 0.00 -1.93 0.00 0.00 178.83 177.20 1xik h ALA 318 N 1.50 1.29 -0.44 3.38 0.00 -0.40 -1.70 119.26 122.89 1xik h ALA 318 Ca -0.01 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 1xik h ALA 318 Cb 0.91 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 1xik h ALA 318 CO 0.07 0.19 0.06 1.33 0.00 0.00 0.00 179.25 180.89 1xik n VAL 319 N -3.68 2.56 -1.48 0.00 0.24 -0.92 -4.97 118.33 110.09 1xik n VAL 319 Ca -0.02 -1.90 -0.10 0.00 -2.04 0.00 0.00 64.34 60.28 1xik n VAL 319 Cb 0.27 -0.30 -0.03 0.00 -1.47 0.00 0.00 33.84 32.31 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 -0.39 0.87 3.95 7.63 0.00 -0.64 -4.97 105.19 111.64 1xik n GLY 320 Ca 0.29 -0.57 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.31 4.09 0.47 0.99 1.43 0.19 -5.00 118.68 118.54 1xik s LEU 321 Ca 0.00 0.35 -0.21 0.00 -1.03 0.00 0.00 54.13 53.25 1xik s LEU 321 Cb 0.00 -3.20 -0.09 0.00 0.03 0.00 0.00 46.19 42.93 1xik s LEU 321 CO 0.00 -0.23 1.01 -1.81 0.23 0.00 0.00 176.35 175.54 1xik s ASP 322 N -4.00 6.56 -0.13 2.29 1.01 -1.26 -4.14 116.67 116.99 1xik s ASP 322 Ca 0.38 1.84 -0.29 0.00 0.71 0.00 0.00 52.55 55.20 1xik s ASP 322 Cb -0.09 -2.55 -0.01 0.00 1.01 0.00 0.00 42.92 41.27 1xik s ASP 322 CO 0.34 -0.63 0.98 -0.76 0.21 0.00 0.00 175.17 175.31 1xik s LEU 323 N -3.37 4.22 0.20 1.23 1.43 -1.26 -4.89 118.68 116.23 1xik s LEU 323 Ca 0.65 1.44 0.16 0.00 -1.03 0.00 0.00 54.13 55.35 1xik s LEU 323 Cb -0.14 -3.49 -0.01 0.00 0.03 0.00 0.00 46.19 42.58 1xik s LEU 323 CO 0.17 -0.46 1.21 1.55 0.23 0.00 0.00 176.35 179.05 1xik h PRO 324 N 7.18 0.00 -6.22 1.29 0.13 -1.94 -3.47 132.00 128.97 1xik h PRO 324 Ca -0.29 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.35 1xik h PRO 324 Cb 1.13 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.23 1xik h PRO 324 CO 0.87 0.41 -0.44 -0.06 -0.23 0.00 0.00 178.00 178.55 1xik s PHE 325 N -2.96 2.97 0.31 1.56 0.08 -1.26 -5.08 117.98 113.60 1xik s PHE 325 Ca 0.01 -0.27 -0.29 0.00 0.12 0.00 0.00 56.93 56.51 1xik s PHE 325 Cb 0.08 -1.79 -0.10 0.00 -0.57 0.00 0.00 43.02 40.64 1xik s PHE 325 CO 0.77 0.18 1.29 -1.14 -0.10 0.00 0.00 175.22 176.23 1xik s GLN 326 N -4.01 4.38 0.45 0.44 2.00 -1.26 -4.94 119.66 116.72 1xik s GLN 326 Ca 0.41 2.17 -0.25 0.00 -2.00 0.00 0.00 55.36 55.69 1xik s GLN 326 Cb -0.07 -3.09 -0.08 0.00 0.80 0.00 0.00 33.01 30.57 1xik s GLN 326 CO 0.27 -0.16 1.34 0.99 -0.50 0.00 0.00 175.29 177.23 1xik s THR 327 N -1.01 2.40 0.30 -0.34 2.01 -1.26 -4.92 115.64 112.83 1xik s THR 327 Ca 0.49 0.34 -0.17 0.00 0.31 0.00 0.00 61.69 62.67 1xik s THR 327 Cb -0.39 -3.19 0.02 0.00 0.01 0.00 0.00 72.50 68.95 1xik s THR 327 CO 0.50 0.03 0.66 0.00 -0.69 0.00 0.00 174.62 175.13 1xik s ARG 328 N -2.47 1.85 0.30 4.92 1.70 -1.26 -5.15 118.95 118.83 1xik s ARG 328 Ca 0.62 -1.21 -0.00 0.00 -0.47 0.00 0.00 55.73 54.66 1xik s ARG 328 Cb -0.39 0.57 -0.04 0.00 -0.57 0.00 0.00 34.95 34.52 1xik s ARG 328 CO 0.49 -0.83 0.51 0.45 -1.08 0.00 0.00 175.30 174.84 1xik s SER 329 N -3.00 6.34 -0.37 -2.89 0.15 -1.26 -4.96 113.70 107.70 1xik s SER 329 Ca 0.16 0.46 -0.40 0.00 0.70 0.00 0.00 55.95 56.86 1xik s SER 329 Cb -0.04 -2.03 -0.16 0.00 -1.71 0.00 0.00 66.02 62.08 1xik s SER 329 CO 0.09 -0.21 1.95 -3.20 1.20 0.00 0.00 173.24 173.07 1xik n ASN 330 N -1.41 1.83 0.00 5.45 2.85 -1.26 -4.81 115.26 117.92 1xik n ASN 330 Ca -0.05 0.80 0.05 0.00 -0.11 0.00 0.00 54.58 55.28 1xik n ASN 330 Cb 0.55 -1.10 0.24 0.00 1.24 0.00 0.00 39.78 40.72 1xik n ASN 330 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1xik n PRO 331 N 6.56 0.06 -2.89 1.20 -0.04 -1.26 -3.96 135.00 134.68 1xik n PRO 331 Ca 0.38 0.27 -0.12 0.00 -0.04 0.00 0.00 63.50 63.98 1xik n PRO 331 Cb 0.10 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.07 1xik n PRO 331 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1xik n ILE 332 N -1.41 -0.24 0.58 0.52 -5.35 -1.26 -5.00 119.36 107.20 1xik n ILE 332 Ca 0.04 -2.04 0.08 0.00 -0.27 0.00 0.00 62.75 60.56 1xik n ILE 332 Cb 0.11 0.45 0.35 0.00 -1.74 0.00 0.00 39.64 38.81 1xik n ILE 332 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1xik n PRO 333 N 1.99 0.02 -0.14 6.28 -0.04 -1.25 -2.08 135.00 139.77 1xik n PRO 333 Ca 0.15 0.21 -0.06 0.00 -0.04 0.00 0.00 63.50 63.77 1xik n PRO 333 Cb 0.58 -1.50 0.12 0.00 -0.04 0.00 0.00 33.50 32.66 1xik n PRO 333 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 1xik h TRP 334 N 0.00 0.94 -0.22 0.54 5.08 -1.95 -1.28 115.95 119.06 1xik h TRP 334 Ca 0.00 -0.14 0.06 0.00 1.08 0.00 0.00 58.89 59.89 1xik h TRP 334 Cb 0.27 -0.25 -0.01 0.00 -3.00 0.00 0.00 29.16 26.16 1xik h TRP 334 CO 0.00 0.86 0.49 0.97 -1.28 0.00 0.00 178.44 179.48 1xik h ILE 335 N 0.82 0.14 0.00 0.12 2.10 -1.85 0.63 117.51 119.46 1xik h ILE 335 Ca 0.15 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.09 1xik h ILE 335 Cb 0.49 0.55 0.00 0.00 -1.09 0.00 0.00 36.82 36.77 1xik h ILE 335 CO 0.02 0.00 0.00 0.78 -1.08 0.00 0.00 178.15 177.87 1xik h ASN 336 N 0.00 0.00 0.56 2.19 2.35 -1.41 -1.72 115.58 117.55 1xik h ASN 336 Ca 0.10 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1xik h ASN 336 Cb 1.09 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.47 1xik h ASN 336 CO -0.00 0.00 -0.27 0.74 -1.65 0.00 0.00 177.43 176.25 1xik h THR 337 N 0.00 0.43 -0.11 2.81 2.02 0.14 -2.84 112.91 115.36 1xik h THR 337 Ca 0.00 -0.14 -0.17 0.00 0.77 0.00 0.00 66.41 66.88 1xik h THR 337 Cb 0.47 0.49 0.01 0.00 -1.74 0.00 0.00 68.15 67.37 1xik h THR 337 CO 0.00 0.02 -0.59 -0.50 0.37 0.00 0.00 175.52 174.82 1xik h TRP 338 N -0.83 0.81 -0.09 3.16 4.06 -1.69 -3.36 115.95 118.00 1xik h TRP 338 Ca -0.08 -0.36 0.03 0.00 2.06 0.00 0.00 58.89 60.55 1xik h TRP 338 Cb 0.61 -0.12 -0.06 0.00 -1.00 0.00 0.00 29.16 28.58 1xik h TRP 338 CO -0.02 1.16 -0.49 -0.07 -3.56 0.00 0.00 178.44 175.46 1xik h LEU 339 N 0.23 -1.54 0.00 -4.49 4.07 -1.34 -3.47 115.31 108.77 1xik h LEU 339 Ca -0.04 0.19 0.00 0.00 0.08 0.00 0.00 57.88 58.10 1xik h LEU 339 Cb 1.23 0.60 0.00 0.00 1.08 0.00 0.00 40.66 43.58 1xik h LEU 339 CO 0.12 -0.48 0.00 0.52 -1.08 0.00 0.00 178.44 177.53