#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xin s GLN 4 N 0.00 1.96 0.31 7.34 1.03 -1.26 -4.99 119.66 124.06 1xin s GLN 4 Ca 0.00 -1.07 -0.28 0.00 0.04 0.00 0.00 55.36 54.05 1xin s GLN 4 Cb 0.00 -2.18 -0.09 0.00 0.03 0.00 0.00 33.01 30.76 1xin s GLN 4 CO 0.00 0.51 1.02 0.00 -2.54 0.00 0.00 175.29 174.28 1xin s ALA 5 N -1.08 3.27 0.26 2.60 0.00 -1.26 -5.08 121.76 120.47 1xin s ALA 5 Ca 0.17 0.70 0.11 0.00 0.00 0.00 0.00 51.96 52.94 1xin s ALA 5 Cb -0.11 -3.26 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 1xin s ALA 5 CO 0.09 -0.02 -0.18 0.95 0.00 0.00 0.00 175.76 176.61 1xin s THR 6 N -1.39 2.24 0.51 0.00 -4.23 -1.26 -4.92 115.64 106.59 1xin s THR 6 Ca 0.48 -2.34 0.27 0.00 -1.18 0.00 0.00 61.69 58.92 1xin s THR 6 Cb -0.25 -2.25 0.31 0.00 1.34 0.00 0.00 72.50 71.65 1xin s THR 6 CO 0.32 -0.45 2.15 0.03 -0.54 0.00 0.00 174.62 176.14 1xin h ARG 7 N 2.34 0.00 0.00 3.99 2.47 -1.95 -1.38 114.38 119.85 1xin h ARG 7 Ca -0.40 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.31 1xin h ARG 7 Cb 1.25 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.57 1xin h ARG 7 CO 0.61 0.06 -0.09 1.49 0.56 0.00 0.00 179.97 182.60 1xin h GLU 8 N 0.00 0.00 0.00 0.04 4.81 -1.96 -2.41 114.58 115.06 1xin h GLU 8 Ca -0.00 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.12 1xin h GLU 8 Cb 0.16 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 1xin h GLU 8 CO 0.01 0.09 -0.53 -0.44 -0.73 0.00 0.00 179.01 177.41 1xin h ASP 9 N 0.00 0.00 -5.68 1.04 3.32 -1.65 -3.48 116.42 109.96 1xin h ASP 9 Ca -0.00 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.72 1xin h ASP 9 Cb 0.47 0.00 0.16 0.00 0.22 0.00 0.00 39.33 40.18 1xin h ASP 9 CO 0.01 0.53 -0.80 0.29 -1.72 0.00 0.00 179.24 177.55 1xin n LYS 10 N -3.59 -5.48 -2.94 3.56 5.02 -0.91 -4.58 118.16 109.24 1xin n LYS 10 Ca -0.00 0.81 -0.41 0.00 -2.02 0.00 0.00 58.31 56.69 1xin n LYS 10 Cb 0.61 -5.73 -0.04 0.00 -0.02 0.00 0.00 35.03 29.84 1xin n LYS 10 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1xin s PHE 11 N -3.41 3.55 0.19 2.13 0.08 -1.26 -1.01 117.98 118.24 1xin s PHE 11 Ca 0.09 1.33 0.07 0.00 0.12 0.00 0.00 56.93 58.55 1xin s PHE 11 Cb -0.01 -2.92 -0.05 0.00 -0.57 0.00 0.00 43.02 39.47 1xin s PHE 11 CO 0.75 -0.02 -0.14 -1.54 -0.10 0.00 0.00 175.22 174.17 1xin s SER 12 N 0.94 2.40 0.02 1.36 1.04 -0.63 -0.43 113.70 118.41 1xin s SER 12 Ca 0.40 -1.00 0.01 0.00 0.48 0.00 0.00 55.95 55.84 1xin s SER 12 Cb -0.18 -0.11 -0.02 0.00 0.10 0.00 0.00 66.02 65.81 1xin s SER 12 CO 0.18 -0.19 -0.04 -0.36 0.98 0.00 0.00 173.24 173.82 1xin s PHE 13 N -2.93 0.31 0.31 5.02 0.40 -1.04 -0.99 117.98 119.06 1xin s PHE 13 Ca 0.20 -0.40 -0.20 0.00 -0.60 0.00 0.00 56.93 55.94 1xin s PHE 13 Cb -0.01 -0.21 -0.09 0.00 0.51 0.00 0.00 43.02 43.22 1xin s PHE 13 CO 0.05 -0.12 0.81 0.20 0.70 0.00 0.00 175.22 176.86 1xin s GLY 14 N -1.13 2.52 0.33 4.36 0.00 -1.24 -2.05 107.32 110.10 1xin s GLY 14 Ca -0.11 0.24 0.04 0.00 0.00 0.00 0.00 44.72 44.89 1xin s GLY 14 CO -0.00 0.55 1.91 -2.00 0.00 0.00 0.00 173.10 173.55 1xin h LEU 15 N 2.74 0.79 0.00 0.66 5.85 -1.30 -1.67 115.31 122.38 1xin h LEU 15 Ca -0.48 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.26 1xin h LEU 15 Cb 1.18 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.06 1xin h LEU 15 CO 0.64 0.48 0.00 -2.67 -0.34 0.00 0.00 178.44 176.56 1xin n TRP 16 N -4.51 0.00 0.00 1.25 2.14 -1.26 -2.05 117.44 113.01 1xin n TRP 16 Ca 0.14 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.71 1xin n TRP 16 Cb 0.28 -0.46 0.00 0.00 -0.81 0.00 0.00 31.31 30.32 1xin n TRP 16 CO 0.00 0.00 0.00 0.25 2.07 0.00 0.00 177.69 180.01 1xin n THR 17 N -1.46 0.00 0.27 -1.67 -2.24 -0.63 -3.02 114.28 105.53 1xin n THR 17 Ca 0.05 0.35 0.10 0.00 -2.27 0.00 0.00 64.05 62.28 1xin n THR 17 Cb 0.20 -1.07 0.72 0.00 -2.10 0.00 0.00 70.33 68.08 1xin n THR 17 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 1xin h VAL 18 N 0.00 0.82 -0.01 2.28 -1.51 -1.71 -1.70 116.25 114.43 1xin h VAL 18 Ca 0.00 -0.16 0.00 0.00 -1.23 0.00 0.00 66.70 65.31 1xin h VAL 18 Cb 0.00 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 30.25 1xin h VAL 18 CO 0.00 0.04 -0.02 0.61 -1.23 0.00 0.00 177.57 176.97 1xin n GLY 19 N -1.29 -0.52 3.65 5.19 0.00 -0.87 -4.90 105.19 106.45 1xin n GLY 19 Ca -0.03 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 1xin n GLY 19 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1xin s TRP 20 N -2.08 1.87 -1.77 1.61 -0.00 -0.64 -4.57 118.94 113.36 1xin s TRP 20 Ca 0.40 0.21 0.23 0.00 -0.00 0.00 0.00 56.10 56.94 1xin s TRP 20 Cb 0.21 -3.97 1.28 0.00 -0.00 0.00 0.00 33.47 30.99 1xin s TRP 20 CO 0.37 -3.88 1.74 1.04 -0.00 0.00 0.00 176.95 176.22 1xin n GLN 21 N 7.39 0.56 -3.09 5.86 6.02 -1.26 -4.90 117.38 127.97 1xin n GLN 21 Ca 0.19 0.03 -0.16 0.00 -0.01 0.00 0.00 57.00 57.04 1xin n GLN 21 Cb 0.43 -1.50 0.04 0.00 1.02 0.00 0.00 30.24 30.24 1xin n GLN 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xin n ALA 22 N -1.11 -0.83 -2.59 -1.58 0.00 -1.26 -1.28 120.51 111.85 1xin n ALA 22 Ca 0.15 0.26 -0.42 0.00 0.00 0.00 0.00 53.44 53.42 1xin n ALA 22 Cb 0.12 -3.62 -0.05 0.00 0.00 0.00 0.00 19.45 15.90 1xin n ALA 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1xin s ARG 23 N -5.71 3.78 0.05 0.00 3.52 -1.26 -3.97 118.95 115.37 1xin s ARG 23 Ca 0.34 0.40 0.00 0.00 -0.13 0.00 0.00 55.73 56.34 1xin s ARG 23 Cb -0.15 -3.81 0.00 0.00 -1.56 0.00 0.00 34.95 29.44 1xin s ARG 23 CO 0.42 -0.89 0.04 -0.40 -0.81 0.00 0.00 175.30 173.66 1xin n ASP 24 N 6.55 1.16 0.29 -2.12 5.68 -0.53 -4.91 116.55 122.67 1xin n ASP 24 Ca 0.04 -1.19 0.19 0.00 -0.50 0.00 0.00 54.79 53.34 1xin n ASP 24 Cb 0.48 -0.00 0.91 0.00 -1.14 0.00 0.00 41.12 41.37 1xin n ASP 24 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1xin h ALA 25 N 0.74 1.00 0.00 2.12 0.00 -2.00 -3.16 119.26 117.97 1xin h ALA 25 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1xin h ALA 25 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1xin h ALA 25 CO 0.05 0.00 -0.10 1.19 0.00 0.00 0.00 179.25 180.39 1xin n PHE 26 N -2.99 0.00 -3.56 0.00 3.01 -1.26 -5.10 117.46 107.56 1xin n PHE 26 Ca -0.01 -0.61 -0.07 0.00 1.01 0.00 0.00 57.45 57.77 1xin n PHE 26 Cb 0.18 -0.10 -0.02 0.00 -0.01 0.00 0.00 39.48 39.54 1xin n PHE 26 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1xin s GLY 27 N -1.88 -0.41 0.82 1.37 0.00 -1.19 -5.16 107.32 100.87 1xin s GLY 27 Ca 0.16 0.83 -0.12 0.00 0.00 0.00 0.00 44.72 45.60 1xin s GLY 27 CO 0.02 0.26 1.11 0.99 0.00 0.00 0.00 173.10 175.48 1xin s ASP 28 N -2.58 4.31 0.32 1.64 1.01 -1.26 -1.45 116.67 118.65 1xin s ASP 28 Ca 0.07 1.20 -0.29 0.00 0.71 0.00 0.00 52.55 54.24 1xin s ASP 28 Cb -0.01 -1.89 -0.10 0.00 1.01 0.00 0.00 42.92 41.92 1xin s ASP 28 CO -0.06 -2.07 1.40 0.00 0.21 0.00 0.00 175.17 174.64 1xin s ALA 29 N -3.21 3.56 -1.66 5.23 0.00 -1.26 -4.35 121.76 120.07 1xin s ALA 29 Ca 0.61 1.37 0.14 0.00 0.00 0.00 0.00 51.96 54.09 1xin s ALA 29 Cb -0.14 -3.54 0.08 0.00 0.00 0.00 0.00 23.12 19.52 1xin s ALA 29 CO 0.54 -0.79 0.90 0.25 0.00 0.00 0.00 175.76 176.67 1xin n THR 30 N 1.12 0.00 -4.15 0.00 -2.24 -0.40 -4.90 114.28 103.71 1xin n THR 30 Ca 0.02 -0.45 -0.17 0.00 -2.27 0.00 0.00 64.05 61.18 1xin n THR 30 Cb 0.41 1.26 -0.12 0.00 -2.10 0.00 0.00 70.33 69.78 1xin n THR 30 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1xin s ARG 31 N -1.38 0.77 0.74 -0.78 0.52 -0.92 -4.97 118.95 112.93 1xin s ARG 31 Ca 0.15 -0.95 -0.10 0.00 -0.52 0.00 0.00 55.73 54.31 1xin s ARG 31 Cb 0.12 -0.67 0.05 0.00 0.52 0.00 0.00 34.95 34.97 1xin s ARG 31 CO 0.24 0.14 1.10 0.95 0.02 0.00 0.00 175.30 177.75 1xin s THR 32 N -1.50 2.54 0.44 0.02 -4.23 -1.26 -4.74 115.64 106.90 1xin s THR 32 Ca -0.02 0.05 -0.25 0.00 -1.18 0.00 0.00 61.69 60.29 1xin s THR 32 Cb -0.09 -3.15 -0.08 0.00 1.34 0.00 0.00 72.50 70.53 1xin s THR 32 CO 0.02 -0.18 1.33 0.00 -0.54 0.00 0.00 174.62 175.24 1xin s ALA 33 N -3.41 3.17 -0.16 3.99 0.00 -1.26 -4.85 121.76 119.24 1xin s ALA 33 Ca 0.60 1.27 -0.10 0.00 0.00 0.00 0.00 51.96 53.74 1xin s ALA 33 Cb -0.11 -3.51 -0.05 0.00 0.00 0.00 0.00 23.12 19.45 1xin s ALA 33 CO 0.48 -0.97 0.16 -1.17 0.00 0.00 0.00 175.76 174.27 1xin s LEU 34 N -2.70 4.29 0.03 0.00 2.96 -1.26 -5.08 118.68 116.91 1xin s LEU 34 Ca 0.60 0.38 -0.28 0.00 -0.22 0.00 0.00 54.13 54.61 1xin s LEU 34 Cb -0.39 -2.13 -0.04 0.00 0.50 0.00 0.00 46.19 44.12 1xin s LEU 34 CO 0.49 0.26 0.90 -0.62 -1.32 0.00 0.00 176.35 176.06 1xin s ASP 35 N -0.18 7.32 0.33 3.68 2.15 -1.26 -4.96 116.67 123.76 1xin s ASP 35 Ca 0.12 1.59 0.04 0.00 0.43 0.00 0.00 52.55 54.73 1xin s ASP 35 Cb -0.12 -2.53 0.64 0.00 -0.30 0.00 0.00 42.92 40.61 1xin s ASP 35 CO 0.01 -0.14 1.92 -0.65 -0.17 0.00 0.00 175.17 176.14 1xin h PRO 36 N 6.27 0.86 -0.36 4.34 0.11 -1.96 0.30 132.00 141.55 1xin h PRO 36 Ca -0.42 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 65.49 1xin h PRO 36 Cb 1.21 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 1xin h PRO 36 CO 0.73 0.57 -0.38 0.28 -0.21 0.00 0.00 178.00 179.00 1xin h VAL 37 N 0.88 1.28 -0.03 3.15 2.07 -1.93 -1.87 116.25 119.80 1xin h VAL 37 Ca 0.37 -1.55 -0.00 0.00 0.82 0.00 0.00 66.70 66.34 1xin h VAL 37 Cb 0.30 1.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1xin h VAL 37 CO -0.14 0.51 0.01 -0.08 0.02 0.00 0.00 177.57 177.90 1xin h GLU 38 N 0.71 0.04 -0.73 1.57 4.81 -1.74 -1.61 114.58 117.64 1xin h GLU 38 Ca 0.06 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.36 1xin h GLU 38 Cb 0.95 -0.01 -0.06 0.00 0.63 0.00 0.00 28.75 30.26 1xin h GLU 38 CO 0.09 0.15 0.40 0.00 -0.73 0.00 0.00 179.01 178.93 1xin h ALA 39 N 0.89 1.00 -0.67 2.92 0.00 -0.24 0.15 119.26 123.31 1xin h ALA 39 Ca 0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1xin h ALA 39 Cb 0.12 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1xin h ALA 39 CO -0.00 0.05 0.42 0.28 0.00 0.00 0.00 179.25 180.01 1xin h VAL 40 N 0.71 1.18 -0.07 0.00 2.07 -1.15 0.49 116.25 119.49 1xin h VAL 40 Ca 0.34 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 1xin h VAL 40 Cb 0.27 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 30.27 1xin h VAL 40 CO -0.22 0.18 -0.01 0.45 0.02 0.00 0.00 177.57 177.99 1xin h HIS 41 N 0.90 0.15 -0.64 1.57 -0.00 -0.44 -0.88 115.15 115.82 1xin h HIS 41 Ca 0.24 -0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 60.56 1xin h HIS 41 Cb -0.07 -0.04 -0.03 0.00 -0.00 0.00 0.00 27.41 27.28 1xin h HIS 41 CO -0.02 0.44 0.30 0.87 -0.00 0.00 0.00 177.93 179.51 1xin h LYS 42 N -0.18 0.93 -0.45 2.45 1.79 -0.55 -2.58 116.57 117.98 1xin h LYS 42 Ca 0.02 -0.14 -0.12 0.00 -2.18 0.00 0.00 60.65 58.23 1xin h LYS 42 Cb 0.39 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.86 1xin h LYS 42 CO 0.01 0.75 -0.19 -0.07 -1.08 0.00 0.00 179.45 178.86 1xin h LEU 43 N 0.88 0.89 -0.99 2.94 3.38 -0.92 -2.67 115.31 118.83 1xin h LEU 43 Ca 0.22 -0.32 0.05 0.00 0.09 0.00 0.00 57.88 57.92 1xin h LEU 43 Cb 0.14 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.58 1xin h LEU 43 CO -0.03 1.06 0.64 0.00 0.09 0.00 0.00 178.44 180.21 1xin h ALA 44 N 1.00 1.34 -0.55 1.53 0.00 -0.94 -2.20 119.26 119.45 1xin h ALA 44 Ca 0.11 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1xin h ALA 44 Cb 0.73 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1xin h ALA 44 CO 0.06 0.48 -0.01 1.49 0.00 0.00 0.00 179.25 181.26 1xin h GLU 45 N 1.20 0.95 -0.00 0.00 4.81 -1.23 -3.07 114.58 117.24 1xin h GLU 45 Ca 0.41 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1xin h GLU 45 Cb 0.09 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1xin h GLU 45 CO -0.15 0.95 -0.08 0.44 -0.73 0.00 0.00 179.01 179.44 1xin n ILE 46 N -4.18 0.00 0.00 2.32 -5.35 -1.03 -4.92 119.36 106.20 1xin n ILE 46 Ca 0.03 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1xin n ILE 46 Cb 0.34 -0.27 0.00 0.00 -1.74 0.00 0.00 39.64 37.97 1xin n ILE 46 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1xin n GLY 47 N 1.31 1.04 3.76 3.28 0.00 -1.14 -4.85 105.19 108.59 1xin n GLY 47 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1xin n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xin s ALA 48 N -2.00 2.93 -0.03 4.61 0.00 -0.86 -4.63 121.76 121.78 1xin s ALA 48 Ca 0.00 1.06 0.21 0.00 0.00 0.00 0.00 51.96 53.23 1xin s ALA 48 Cb 0.00 -3.44 -0.32 0.00 0.00 0.00 0.00 23.12 19.36 1xin s ALA 48 CO 0.00 -0.88 0.45 2.48 0.00 0.00 0.00 175.76 177.80 1xin n TYR 49 N -0.65 0.00 -3.75 0.00 4.11 0.43 -4.60 117.16 112.70 1xin n TYR 49 Ca 0.08 0.00 -0.10 0.00 -0.00 0.00 0.00 57.90 57.88 1xin n TYR 49 Cb 0.47 -0.48 -0.05 0.00 -0.00 0.00 0.00 39.34 39.28 1xin n TYR 49 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.86 177.06 1xin s GLY 50 N -4.40 -0.04 0.06 -7.48 0.00 -1.19 -2.23 107.32 92.03 1xin s GLY 50 Ca -0.08 -0.32 0.05 0.00 0.00 0.00 0.00 44.72 44.37 1xin s GLY 50 CO 0.86 -0.45 -0.14 -1.50 0.00 0.00 0.00 173.10 171.86 1xin s ILE 51 N -3.86 1.12 0.21 0.90 2.07 0.00 -2.49 121.20 119.15 1xin s ILE 51 Ca 0.07 -1.18 0.04 0.00 -1.41 0.00 0.00 60.65 58.17 1xin s ILE 51 Cb 0.02 -1.05 -0.05 0.00 0.13 0.00 0.00 42.46 41.50 1xin s ILE 51 CO -0.07 -0.12 -0.02 0.42 -1.91 0.00 0.00 174.94 173.23 1xin s THR 52 N -1.09 1.04 0.09 4.00 -4.23 -0.87 -4.09 115.64 110.49 1xin s THR 52 Ca -0.00 -2.04 -0.26 0.00 -1.18 0.00 0.00 61.69 58.21 1xin s THR 52 Cb -0.09 -2.23 0.08 0.00 1.34 0.00 0.00 72.50 71.60 1xin s THR 52 CO 0.02 -0.42 0.71 0.72 -0.54 0.00 0.00 174.62 175.11 1xin s PHE 53 N -3.42 -0.47 0.33 3.99 -0.71 -1.26 -0.70 117.98 115.75 1xin s PHE 53 Ca 0.26 0.33 -0.06 0.00 -1.04 0.00 0.00 56.93 56.41 1xin s PHE 53 Cb 0.05 0.54 -0.05 0.00 -1.21 0.00 0.00 43.02 42.35 1xin s PHE 53 CO 0.07 -0.72 0.62 -1.01 -1.34 0.00 0.00 175.22 172.83 1xin s HIS 54 N -3.37 3.48 0.14 3.49 3.76 -1.26 -1.94 115.29 119.59 1xin s HIS 54 Ca 0.02 0.73 -0.28 0.00 -0.15 0.00 0.00 55.06 55.37 1xin s HIS 54 Cb -0.01 -2.18 -0.04 0.00 1.11 0.00 0.00 32.58 31.46 1xin s HIS 54 CO -0.10 0.08 1.59 0.38 -0.85 0.00 0.00 174.74 175.83 1xin h ASP 55 N 1.44 -1.24 0.20 1.40 2.03 -1.80 -1.43 116.42 117.02 1xin h ASP 55 Ca -0.48 0.17 0.00 0.00 -0.73 0.00 0.00 57.03 55.99 1xin h ASP 55 Cb 1.19 0.51 0.00 0.00 -0.83 0.00 0.00 39.33 40.20 1xin h ASP 55 CO 0.65 -0.40 0.00 0.47 -1.03 0.00 0.00 179.24 178.93 1xin n ASP 56 N -5.43 0.00 0.07 4.15 8.00 -1.25 -1.91 116.55 120.18 1xin n ASP 56 Ca -0.03 0.45 -0.14 0.00 0.71 0.00 0.00 54.79 55.77 1xin n ASP 56 Cb 0.35 -0.46 -0.14 0.00 -0.02 0.00 0.00 41.12 40.85 1xin n ASP 56 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1xin h ASP 57 N 0.00 0.32 0.00 -2.24 3.32 -1.64 -3.39 116.42 112.78 1xin h ASP 57 Ca 0.00 -0.39 -0.16 0.00 0.02 0.00 0.00 57.03 56.50 1xin h ASP 57 Cb 0.10 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 1xin h ASP 57 CO 0.00 1.31 -0.93 0.25 -1.72 0.00 0.00 179.24 178.15 1xin h LEU 58 N 0.06 0.00 -8.08 1.55 5.85 -1.47 -3.46 115.31 109.76 1xin h LEU 58 Ca -0.16 -0.55 -0.68 0.00 0.84 0.00 0.00 57.88 57.33 1xin h LEU 58 Cb 1.96 0.00 -0.32 0.00 0.37 0.00 0.00 40.66 42.67 1xin h LEU 58 CO 0.17 1.32 -0.71 -0.69 -0.34 0.00 0.00 178.44 178.19 1xin s VAL 59 N -2.31 3.01 0.33 1.05 1.01 -0.80 -5.01 120.40 117.69 1xin s VAL 59 Ca -0.25 -1.26 -0.28 0.00 0.00 0.00 0.00 61.98 60.18 1xin s VAL 59 Cb 0.04 -2.68 -0.12 0.00 0.00 0.00 0.00 36.38 33.62 1xin s VAL 59 CO 0.57 -0.03 1.30 -2.65 0.00 0.00 0.00 175.10 174.29 1xin n PRO 60 N 4.65 2.11 -1.61 2.72 -0.02 -1.26 -3.95 135.00 137.64 1xin n PRO 60 Ca -0.14 0.74 -0.50 0.00 -2.02 0.00 0.00 63.50 61.58 1xin n PRO 60 Cb 0.44 -2.33 -0.05 0.00 -0.02 0.00 0.00 33.50 31.54 1xin n PRO 60 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1xin n PHE 61 N 0.51 1.64 -1.09 6.00 -0.00 -1.26 -1.82 117.46 121.44 1xin n PHE 61 Ca 0.05 0.57 -0.03 0.00 -0.00 0.00 0.00 57.45 58.04 1xin n PHE 61 Cb 0.36 -2.37 -0.01 0.00 -0.00 0.00 0.00 39.48 37.46 1xin n PHE 61 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1xin n GLY 62 N 2.54 0.62 3.77 7.13 0.00 -1.26 -5.04 105.19 112.95 1xin n GLY 62 Ca 0.17 -0.81 -0.40 0.00 0.00 0.00 0.00 46.02 44.98 1xin n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xin s SER 63 N -2.85 6.87 0.76 1.61 0.01 -0.75 -5.01 113.70 114.35 1xin s SER 63 Ca 0.00 2.52 -0.11 0.00 1.31 0.00 0.00 55.95 59.67 1xin s SER 63 Cb 0.00 -2.64 0.05 0.00 0.21 0.00 0.00 66.02 63.64 1xin s SER 63 CO 0.00 -0.45 1.08 1.51 0.41 0.00 0.00 173.24 175.79 1xin s ASP 64 N -0.69 4.75 0.33 2.44 1.47 -1.26 -4.67 116.67 119.03 1xin s ASP 64 Ca 0.49 1.53 0.06 0.00 1.18 0.00 0.00 52.55 55.81 1xin s ASP 64 Cb -0.36 -2.31 0.73 0.00 -0.34 0.00 0.00 42.92 40.64 1xin s ASP 64 CO 0.47 -1.83 1.85 0.00 0.68 0.00 0.00 175.17 176.34 1xin h ALA 65 N -0.99 1.72 0.05 2.11 0.00 -1.98 0.19 119.26 120.36 1xin h ALA 65 Ca -0.45 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 1xin h ALA 65 Cb 1.24 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1xin h ALA 65 CO 0.57 0.02 -0.02 -0.56 0.00 0.00 0.00 179.25 179.26 1xin h GLN 66 N 0.79 -0.06 0.52 0.00 -0.00 -1.98 0.56 115.11 114.93 1xin h GLN 66 Ca 0.47 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 59.10 1xin h GLN 66 Cb 0.66 0.01 0.01 0.00 -0.00 0.00 0.00 27.48 28.15 1xin h GLN 66 CO -0.23 0.01 -0.25 1.15 -0.00 0.00 0.00 178.83 179.50 1xin h THR 67 N -0.11 0.48 -0.46 1.86 2.02 -1.65 -0.52 112.91 114.53 1xin h THR 67 Ca -0.01 -0.10 0.09 0.00 0.77 0.00 0.00 66.41 67.16 1xin h THR 67 Cb 0.09 0.53 -0.07 0.00 -1.74 0.00 0.00 68.15 66.95 1xin h THR 67 CO 0.01 0.02 0.01 -0.09 0.37 0.00 0.00 175.52 175.84 1xin h ARG 68 N -0.75 0.13 -0.84 6.66 2.43 -0.53 -1.36 114.38 120.11 1xin h ARG 68 Ca -0.07 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.12 1xin h ARG 68 Cb 0.56 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.03 1xin h ARG 68 CO 0.12 0.08 0.54 -0.44 -1.51 0.00 0.00 179.97 178.76 1xin h ASP 69 N 0.13 0.91 -0.31 -3.80 3.32 0.25 -2.41 116.42 114.51 1xin h ASP 69 Ca 0.23 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.28 1xin h ASP 69 Cb 0.34 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 1xin h ASP 69 CO -0.37 0.63 0.20 1.23 -1.72 0.00 0.00 179.24 179.21 1xin h GLY 70 N 1.06 0.43 0.99 2.75 0.00 -0.03 -2.63 103.07 105.65 1xin h GLY 70 Ca 0.33 -0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.50 1xin h GLY 70 CO -0.11 0.16 0.28 -2.22 0.00 0.00 0.00 176.54 174.65 1xin h ILE 71 N 0.41 1.14 -0.67 2.60 2.04 -1.01 -2.38 117.51 119.64 1xin h ILE 71 Ca 0.11 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 1xin h ILE 71 Cb -0.04 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 36.53 1xin h ILE 71 CO -0.02 0.14 0.41 0.40 0.00 0.00 0.00 178.15 179.07 1xin h ILE 72 N 0.60 1.19 -0.65 -0.67 2.04 -1.39 -1.42 117.51 117.22 1xin h ILE 72 Ca 0.16 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.60 1xin h ILE 72 Cb -0.02 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.29 1xin h ILE 72 CO -0.03 0.20 0.42 0.00 0.00 0.00 0.00 178.15 178.74 1xin h ALA 73 N 1.21 0.82 -0.53 1.87 0.00 -1.27 0.58 119.26 121.95 1xin h ALA 73 Ca 0.24 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1xin h ALA 73 Cb -0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1xin h ALA 73 CO -0.05 0.26 0.24 0.78 0.00 0.00 0.00 179.25 180.48 1xin h GLY 74 N 0.88 0.82 1.00 0.00 0.00 -1.05 -2.17 103.07 102.55 1xin h GLY 74 Ca 0.24 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 1xin h GLY 74 CO -0.05 0.40 -0.14 -2.75 0.00 0.00 0.00 176.54 174.00 1xin h PHE 75 N 0.70 -0.36 -0.80 5.60 3.57 -1.01 -1.67 116.94 122.98 1xin h PHE 75 Ca 0.18 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.73 1xin h PHE 75 Cb 0.14 0.12 -0.05 0.00 2.79 0.00 0.00 35.95 38.95 1xin h PHE 75 CO -0.00 -0.22 0.52 0.87 -2.23 0.00 0.00 178.31 177.25 1xin h LYS 76 N -0.38 0.87 -0.61 1.11 1.57 -0.80 -1.34 116.57 116.98 1xin h LYS 76 Ca -0.04 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.63 1xin h LYS 76 Cb 0.29 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.38 1xin h LYS 76 CO 0.06 0.58 0.15 -0.22 -0.57 0.00 0.00 179.45 179.45 1xin h LYS 77 N 0.90 0.98 -0.67 3.15 3.64 -1.03 -1.46 116.57 122.07 1xin h LYS 77 Ca 0.34 -0.23 -0.06 0.00 -1.27 0.00 0.00 60.65 59.42 1xin h LYS 77 Cb 0.18 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 1xin h LYS 77 CO -0.11 0.89 0.19 0.00 -2.27 0.00 0.00 179.45 178.15 1xin h ALA 78 N 1.04 1.07 0.02 5.00 0.00 -0.55 -0.86 119.26 124.99 1xin h ALA 78 Ca 0.19 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xin h ALA 78 Cb 0.35 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1xin h ALA 78 CO 0.00 0.63 -0.04 -0.07 0.00 0.00 0.00 179.25 179.77 1xin h LEU 79 N 1.00 -0.11 -0.29 0.00 3.38 -0.97 -1.24 115.31 117.09 1xin h LEU 79 Ca 0.22 0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.27 1xin h LEU 79 Cb 0.31 0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.03 1xin h LEU 79 CO -0.00 -0.06 -0.24 -0.78 0.09 0.00 0.00 178.44 177.44 1xin h ASP 80 N -0.08 -0.80 -0.50 -0.43 1.82 -1.02 0.25 116.42 115.66 1xin h ASP 80 Ca 0.01 0.15 -0.05 0.00 -0.39 0.00 0.00 57.03 56.75 1xin h ASP 80 Cb 0.09 0.38 -0.02 0.00 0.68 0.00 0.00 39.33 40.47 1xin h ASP 80 CO -0.03 -0.28 0.12 -0.33 -1.61 0.00 0.00 179.24 177.12 1xin h GLU 81 N -0.23 0.80 0.00 0.28 5.08 -1.06 -3.24 114.58 116.22 1xin h GLU 81 Ca 0.15 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1xin h GLU 81 Cb 0.46 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 1xin h GLU 81 CO -0.42 0.78 -0.57 1.79 -1.00 0.00 0.00 179.01 179.58 1xin h THR 82 N 0.69 0.08 0.00 1.13 1.35 -0.91 -3.48 112.91 111.77 1xin h THR 82 Ca 0.16 -1.13 0.00 0.00 -0.55 0.00 0.00 66.41 64.89 1xin h THR 82 Cb 0.33 1.79 0.00 0.00 -1.73 0.00 0.00 68.15 68.55 1xin h THR 82 CO 0.00 0.04 0.00 0.61 -0.25 0.00 0.00 175.52 175.93 1xin n GLY 83 N 1.16 0.50 3.80 5.82 0.00 0.83 -5.03 105.19 112.28 1xin n GLY 83 Ca 0.01 -0.90 -0.38 0.00 0.00 0.00 0.00 46.02 44.76 1xin n GLY 83 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xin s LEU 84 N 0.00 4.45 0.43 0.99 1.02 -0.96 -4.97 118.68 119.64 1xin s LEU 84 Ca 0.00 1.45 0.07 0.00 0.02 0.00 0.00 54.13 55.67 1xin s LEU 84 Cb 0.00 -3.36 -0.02 0.00 0.02 0.00 0.00 46.19 42.83 1xin s LEU 84 CO 0.00 0.13 0.32 0.27 0.02 0.00 0.00 176.35 177.09 1xin s ILE 85 N -1.33 2.44 -0.52 -0.59 -4.36 -0.95 -4.63 121.20 111.26 1xin s ILE 85 Ca 0.38 -1.47 0.02 0.00 -0.26 0.00 0.00 60.65 59.32 1xin s ILE 85 Cb -0.19 -2.91 0.13 0.00 1.25 0.00 0.00 42.46 40.74 1xin s ILE 85 CO 0.22 0.00 0.28 -0.69 0.24 0.00 0.00 174.94 174.99 1xin s VAL 86 N -2.54 2.91 0.13 8.37 1.01 -1.26 -0.82 120.40 128.20 1xin s VAL 86 Ca 0.45 -3.01 0.14 0.00 0.00 0.00 0.00 61.98 59.55 1xin s VAL 86 Cb -0.01 -2.99 0.02 0.00 0.00 0.00 0.00 36.38 33.39 1xin s VAL 86 CO 0.26 -0.79 1.56 1.55 0.00 0.00 0.00 175.10 177.68 1xin h PRO 87 N 6.89 0.00 -3.15 2.72 0.13 -1.89 -3.12 132.00 133.58 1xin h PRO 87 Ca -0.06 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.98 1xin h PRO 87 Cb 0.93 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 31.89 1xin h PRO 87 CO 0.67 0.58 -0.21 1.41 -0.23 0.00 0.00 178.00 180.22 1xin s MET 88 N -3.32 0.80 0.07 0.86 -2.45 -1.26 -1.85 119.30 112.15 1xin s MET 88 Ca 0.01 -0.38 0.00 0.00 -1.25 0.00 0.00 55.69 54.06 1xin s MET 88 Cb 0.11 0.35 -0.04 0.00 1.25 0.00 0.00 34.83 36.50 1xin s MET 88 CO 0.74 -0.25 -0.04 0.14 1.05 0.00 0.00 175.02 176.65 1xin s VAL 89 N -2.21 0.39 0.26 10.11 -7.23 -0.94 -4.17 120.40 116.61 1xin s VAL 89 Ca -0.07 -1.82 -0.08 0.00 -1.81 0.00 0.00 61.98 58.20 1xin s VAL 89 Cb -0.02 -1.53 -0.01 0.00 0.56 0.00 0.00 36.38 35.38 1xin s VAL 89 CO -0.01 -0.93 0.41 0.28 -0.31 0.00 0.00 175.10 174.53 1xin s THR 90 N -3.71 0.00 -0.05 5.32 -1.32 -0.82 -1.78 115.64 113.28 1xin s THR 90 Ca 0.08 -1.58 0.05 0.00 -1.21 0.00 0.00 61.69 59.03 1xin s THR 90 Cb 0.06 -2.39 -0.01 0.00 -1.51 0.00 0.00 72.50 68.66 1xin s THR 90 CO -0.08 0.00 -0.20 -0.89 -2.21 0.00 0.00 174.62 171.24 1xin s THR 91 N -3.78 1.68 -0.56 5.08 2.01 -1.26 -2.25 115.64 116.56 1xin s THR 91 Ca 0.28 -0.85 -0.25 0.00 0.31 0.00 0.00 61.69 61.18 1xin s THR 91 Cb 0.01 -1.43 0.04 0.00 0.01 0.00 0.00 72.50 71.12 1xin s THR 91 CO 0.13 0.48 1.00 0.21 -0.69 0.00 0.00 174.62 175.74 1xin s ASN 92 N -0.02 6.36 -0.28 3.53 3.84 -1.26 -4.83 114.94 122.27 1xin s ASN 92 Ca -0.04 -0.26 0.09 0.00 0.21 0.00 0.00 52.86 52.85 1xin s ASN 92 Cb -0.13 -2.46 0.47 0.00 -0.55 0.00 0.00 41.25 38.58 1xin s ASN 92 CO 0.03 -1.29 1.36 0.18 -2.79 0.00 0.00 177.10 174.60 1xin n LEU 93 N 7.69 3.96 0.00 3.21 4.77 -1.26 -4.73 117.00 130.63 1xin n LEU 93 Ca 0.03 -4.02 0.00 0.00 -0.03 0.00 0.00 56.01 51.99 1xin n LEU 93 Cb 0.48 -0.57 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1xin n LEU 93 CO 0.65 1.47 -0.05 2.22 -1.33 0.00 0.00 177.39 180.36 1xin n PHE 94 N -1.05 0.00 -0.03 -1.77 1.16 -1.26 -4.44 117.46 110.07 1xin n PHE 94 Ca 0.32 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.78 1xin n PHE 94 Cb 0.90 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.66 1xin n PHE 94 CO 0.00 0.00 0.00 1.15 -1.87 0.00 0.00 176.76 176.04 1xin h THR 95 N 0.00 1.39 -3.76 1.97 2.02 -1.94 -3.46 112.91 109.14 1xin h THR 95 Ca 0.00 -1.75 -0.53 0.00 0.77 0.00 0.00 66.41 64.89 1xin h THR 95 Cb 0.05 2.50 0.09 0.00 -1.74 0.00 0.00 68.15 69.05 1xin h THR 95 CO 0.00 0.42 0.77 -2.28 0.37 0.00 0.00 175.52 174.80 1xin s HIS 96 N -2.84 2.76 0.55 3.16 2.46 -1.26 -4.90 115.29 115.22 1xin s HIS 96 Ca -0.16 1.14 0.31 0.00 0.47 0.00 0.00 55.06 56.82 1xin s HIS 96 Cb -0.01 -3.94 1.48 0.00 -0.13 0.00 0.00 32.58 29.98 1xin s HIS 96 CO 0.59 -2.83 1.88 -1.35 -2.47 0.00 0.00 174.74 170.57 1xin h PRO 97 N 3.63 0.00 -0.01 2.88 0.11 -2.02 -0.59 132.00 136.00 1xin h PRO 97 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1xin h PRO 97 Cb 1.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1xin h PRO 97 CO 0.69 0.00 0.01 -0.24 -0.21 0.00 0.00 178.00 178.25 1xin h VAL 98 N 0.00 0.68 -0.34 3.15 3.04 -1.97 -1.91 116.25 118.90 1xin h VAL 98 Ca 0.39 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.08 1xin h VAL 98 Cb 1.65 0.99 0.00 0.00 -2.01 0.00 0.00 31.29 31.92 1xin h VAL 98 CO -0.00 0.00 0.00 0.49 -1.01 0.00 0.00 177.57 177.05 1xin n PHE 99 N -4.08 0.72 0.27 3.17 3.72 -0.23 -4.53 117.46 116.50 1xin n PHE 99 Ca -0.03 -0.29 0.16 0.00 -0.05 0.00 0.00 57.45 57.24 1xin n PHE 99 Cb 0.10 -0.12 0.91 0.00 -0.94 0.00 0.00 39.48 39.42 1xin n PHE 99 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1xin h LYS 100 N 2.09 0.00 -0.25 -1.08 2.10 -1.49 -0.75 116.57 117.19 1xin h LYS 100 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xin h LYS 100 Cb 0.80 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.13 1xin h LYS 100 CO 0.10 0.00 0.00 -3.47 -2.00 0.00 0.00 179.45 174.08 1xin n ASP 101 N -3.77 2.98 0.00 7.07 2.03 -1.26 -5.02 116.55 118.58 1xin n ASP 101 Ca -0.02 -2.30 0.00 0.00 0.52 0.00 0.00 54.79 52.99 1xin n ASP 101 Cb 0.16 -0.28 0.00 0.00 -0.72 0.00 0.00 41.12 40.28 1xin n ASP 101 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xin n GLY 102 N 0.01 2.39 0.00 0.27 0.00 -0.29 -3.84 105.19 103.74 1xin n GLY 102 Ca 0.12 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 43.98 1xin n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xin n GLY 103 N -1.01 -0.06 0.28 -0.02 0.00 -1.26 -4.18 105.19 98.94 1xin n GLY 103 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1xin n GLY 103 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1xin h PHE 104 N 0.00 0.00 -0.06 1.61 0.04 -1.87 -3.12 116.94 113.54 1xin h PHE 104 Ca 0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1xin h PHE 104 Cb 0.00 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.15 1xin h PHE 104 CO 0.00 0.00 -0.05 0.25 -0.60 0.00 0.00 178.31 177.91 1xin n THR 105 N -4.09 2.02 -1.88 -1.55 -2.24 -1.26 -4.48 114.28 100.80 1xin n THR 105 Ca -0.03 -2.32 -0.38 0.00 -2.27 0.00 0.00 64.05 59.06 1xin n THR 105 Cb 0.08 -0.25 0.04 0.00 -2.10 0.00 0.00 70.33 68.10 1xin n THR 105 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xin s SER 106 N -2.73 5.28 0.39 3.42 0.15 -1.18 -4.82 113.70 114.21 1xin s SER 106 Ca 0.35 2.62 0.08 0.00 0.70 0.00 0.00 55.95 59.70 1xin s SER 106 Cb 0.31 -2.62 0.78 0.00 -1.71 0.00 0.00 66.02 62.77 1xin s SER 106 CO 0.03 -1.55 1.95 0.78 1.20 0.00 0.00 173.24 175.65 1xin h ASN 107 N 1.31 0.35 -3.04 5.45 2.35 -1.92 -3.41 115.58 116.67 1xin h ASN 107 Ca -0.51 -0.05 -0.57 0.00 -0.55 0.00 0.00 56.30 54.63 1xin h ASN 107 Cb 1.30 -0.09 -0.04 0.00 0.05 0.00 0.00 38.32 39.53 1xin h ASN 107 CO 0.57 0.40 1.00 -0.62 -1.65 0.00 0.00 177.43 177.13 1xin s ASP 108 N -6.80 6.62 0.33 5.81 -1.08 -1.26 -4.94 116.67 115.35 1xin s ASP 108 Ca -0.07 1.34 0.02 0.00 -0.52 0.00 0.00 52.55 53.32 1xin s ASP 108 Cb 0.16 -2.54 0.60 0.00 -1.46 0.00 0.00 42.92 39.68 1xin s ASP 108 CO 0.74 -1.10 1.95 -0.09 0.52 0.00 0.00 175.17 177.19 1xin h ARG 109 N 9.55 0.90 -0.34 4.34 2.43 -2.00 -2.66 114.38 126.60 1xin h ARG 109 Ca -0.28 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 58.76 1xin h ARG 109 Cb 1.11 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.44 1xin h ARG 109 CO 1.02 0.60 -0.10 0.66 -1.51 0.00 0.00 179.97 180.64 1xin h SER 110 N 0.93 0.56 -0.22 -3.80 4.64 -1.95 -2.43 113.55 111.27 1xin h SER 110 Ca 0.32 -0.15 -0.11 0.00 -0.47 0.00 0.00 61.79 61.38 1xin h SER 110 Cb 0.11 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 1xin h SER 110 CO -0.10 0.70 -0.25 0.58 -0.87 0.00 0.00 176.83 176.89 1xin h VAL 111 N 0.54 1.27 -0.25 0.95 2.07 -1.83 -1.61 116.25 117.39 1xin h VAL 111 Ca 0.10 -1.35 -0.00 0.00 0.82 0.00 0.00 66.70 66.27 1xin h VAL 111 Cb 0.50 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 1xin h VAL 111 CO 0.03 0.44 0.14 0.03 0.02 0.00 0.00 177.57 178.23 1xin h ARG 112 N 0.60 0.34 -0.17 1.57 3.08 -1.41 0.29 114.38 118.68 1xin h ARG 112 Ca 0.08 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.09 1xin h ARG 112 Cb 0.74 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 1xin h ARG 112 CO 0.06 0.30 0.10 0.00 -1.07 0.00 0.00 179.97 179.35 1xin h ARG 113 N 0.30 0.24 -0.75 0.04 3.08 -1.34 -2.22 114.38 113.72 1xin h ARG 113 Ca 0.09 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 1xin h ARG 113 Cb 0.05 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 1xin h ARG 113 CO -0.01 0.22 0.35 -0.92 -1.07 0.00 0.00 179.97 178.54 1xin h TYR 114 N 0.19 1.07 -0.42 3.04 3.20 -1.05 -2.59 116.97 120.40 1xin h TYR 114 Ca 0.06 -0.05 0.03 0.00 3.14 0.00 0.00 58.73 61.92 1xin h TYR 114 Cb 0.05 -0.33 -0.04 0.00 1.54 0.00 0.00 36.73 37.95 1xin h TYR 114 CO -0.05 0.78 0.21 0.00 -1.64 0.00 0.00 178.16 177.46 1xin h ALA 115 N 1.33 0.53 -0.19 1.82 0.00 -0.02 -0.90 119.26 121.82 1xin h ALA 115 Ca 0.26 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 1xin h ALA 115 Cb 0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1xin h ALA 115 CO -0.03 -0.15 0.10 0.82 0.00 0.00 0.00 179.25 179.99 1xin h ILE 116 N 0.43 1.12 -0.76 0.00 2.04 -1.21 -2.39 117.51 116.74 1xin h ILE 116 Ca 0.18 -0.33 0.06 0.00 1.00 0.00 0.00 64.86 65.77 1xin h ILE 116 Cb 0.09 0.99 -0.06 0.00 -0.74 0.00 0.00 36.82 37.10 1xin h ILE 116 CO -0.13 0.11 0.45 0.03 0.00 0.00 0.00 178.15 178.61 1xin h ARG 117 N 0.19 0.79 -0.95 2.37 2.47 -1.11 -0.27 114.38 117.87 1xin h ARG 117 Ca 0.07 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.74 1xin h ARG 117 Cb 0.09 -0.18 -0.05 0.00 -1.65 0.00 0.00 29.97 28.19 1xin h ARG 117 CO -0.01 0.53 0.62 -0.22 0.56 0.00 0.00 179.97 181.44 1xin h LYS 118 N 0.82 1.27 -0.12 0.04 3.64 -0.89 -2.16 116.57 119.17 1xin h LYS 118 Ca 0.34 -0.09 -0.12 0.00 -1.27 0.00 0.00 60.65 59.51 1xin h LYS 118 Cb 0.19 -0.28 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1xin h LYS 118 CO -0.18 0.86 -0.40 0.28 -2.27 0.00 0.00 179.45 177.74 1xin h VAL 119 N 1.30 1.37 -0.67 2.00 2.07 -0.91 -2.83 116.25 118.59 1xin h VAL 119 Ca 0.35 -1.71 0.09 0.00 0.82 0.00 0.00 66.70 66.25 1xin h VAL 119 Cb -0.12 2.13 -0.07 0.00 -1.52 0.00 0.00 31.29 31.71 1xin h VAL 119 CO -0.07 0.51 0.32 -0.07 0.02 0.00 0.00 177.57 178.27 1xin h LEU 120 N 0.07 0.40 -0.74 2.57 3.38 -0.84 0.84 115.31 120.99 1xin h LEU 120 Ca -0.02 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1xin h LEU 120 Cb 1.02 -0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.72 1xin h LEU 120 CO 0.08 0.24 0.47 -0.09 0.09 0.00 0.00 178.44 179.23 1xin h ARG 121 N 0.55 0.88 -0.06 1.13 2.43 -1.42 -1.69 114.38 116.21 1xin h ARG 121 Ca 0.33 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.34 1xin h ARG 121 Cb 0.34 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 1xin h ARG 121 CO -0.26 0.59 -0.44 0.37 -1.51 0.00 0.00 179.97 178.71 1xin h GLN 122 N 0.91 0.13 -0.67 0.20 5.75 -0.91 -2.93 115.11 117.59 1xin h GLN 122 Ca 0.30 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.72 1xin h GLN 122 Cb 0.01 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.53 1xin h GLN 122 CO -0.11 0.55 0.36 0.52 -2.65 0.00 0.00 178.83 177.50 1xin h MET 123 N 0.11 0.94 -0.39 1.69 2.86 -0.01 0.19 114.93 120.32 1xin h MET 123 Ca 0.01 -0.12 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 1xin h MET 123 Cb 0.83 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.29 1xin h MET 123 CO 0.06 0.71 0.20 -0.44 1.06 0.00 0.00 176.91 178.51 1xin h ASP 124 N 0.91 0.49 -0.47 1.22 3.32 -1.29 0.47 116.42 121.07 1xin h ASP 124 Ca 0.23 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 57.11 1xin h ASP 124 Cb 0.06 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 1xin h ASP 124 CO -0.04 0.45 0.02 0.25 -1.72 0.00 0.00 179.24 178.20 1xin h LEU 125 N 0.49 0.80 -0.59 1.55 5.85 -1.27 -0.70 115.31 121.45 1xin h LEU 125 Ca 0.13 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 1xin h LEU 125 Cb 0.08 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 1xin h LEU 125 CO -0.02 0.90 0.33 1.23 -0.34 0.00 0.00 178.44 180.54 1xin h GLY 126 N 0.68 0.89 0.70 3.75 0.00 -0.79 -0.95 103.07 107.34 1xin h GLY 126 Ca 0.14 -0.40 0.03 0.00 0.00 0.00 0.00 47.33 47.10 1xin h GLY 126 CO 0.02 0.39 0.03 0.00 0.00 0.00 0.00 176.54 176.98 1xin h ALA 127 N 1.15 0.23 -0.91 3.60 0.00 -0.70 0.21 119.26 122.84 1xin h ALA 127 Ca 0.21 0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.25 1xin h ALA 127 Cb 0.04 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 1xin h ALA 127 CO -0.03 -0.39 0.59 1.49 0.00 0.00 0.00 179.25 180.91 1xin h GLU 128 N 0.12 0.95 -0.01 0.00 4.81 -0.65 -2.19 114.58 117.62 1xin h GLU 128 Ca 0.11 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1xin h GLU 128 Cb 0.12 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.28 1xin h GLU 128 CO -0.16 0.63 -0.19 1.28 -0.73 0.00 0.00 179.01 179.84 1xin n LEU 129 N -4.51 0.92 0.00 1.64 4.77 -0.41 -4.95 117.00 114.47 1xin n LEU 129 Ca 0.15 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1xin n LEU 129 Cb 0.25 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1xin n LEU 129 CO 0.32 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1xin n GLY 130 N 1.31 0.74 3.77 -0.72 0.00 -0.56 -4.59 105.19 105.13 1xin n GLY 130 Ca 0.14 -0.14 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1xin n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xin s ALA 131 N -2.00 3.15 -0.06 4.61 0.00 0.62 -4.86 121.76 123.23 1xin s ALA 131 Ca 0.00 1.22 0.19 0.00 0.00 0.00 0.00 51.96 53.37 1xin s ALA 131 Cb 0.00 -3.49 -0.29 0.00 0.00 0.00 0.00 23.12 19.34 1xin s ALA 131 CO 0.00 -0.90 0.36 1.63 0.00 0.00 0.00 175.76 176.85 1xin n LYS 132 N -0.15 0.68 -4.76 0.00 5.02 -0.77 -4.62 118.16 113.56 1xin n LYS 132 Ca 0.05 -0.15 -0.25 0.00 -2.02 0.00 0.00 58.31 55.95 1xin n LYS 132 Cb 0.44 -1.47 -0.15 0.00 -0.02 0.00 0.00 35.03 33.83 1xin n LYS 132 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1xin s THR 133 N -3.19 1.47 -0.26 -0.18 2.01 -1.02 -1.64 115.64 112.82 1xin s THR 133 Ca -0.08 -0.92 -0.03 0.00 0.31 0.00 0.00 61.69 60.97 1xin s THR 133 Cb 0.11 -1.25 0.02 0.00 0.01 0.00 0.00 72.50 71.39 1xin s THR 133 CO 0.81 0.31 -0.02 -0.22 -0.69 0.00 0.00 174.62 174.81 1xin s LEU 134 N -0.71 3.35 -0.06 4.42 2.96 -0.37 -2.22 118.68 126.05 1xin s LEU 134 Ca 0.07 -0.78 -0.14 0.00 -0.22 0.00 0.00 54.13 53.05 1xin s LEU 134 Cb -0.08 -1.73 -0.05 0.00 0.50 0.00 0.00 46.19 44.83 1xin s LEU 134 CO 0.00 -0.14 0.37 -0.69 -1.32 0.00 0.00 176.35 174.58 1xin s VAL 135 N 1.39 5.16 -0.27 1.68 1.01 -0.73 -1.51 120.40 127.12 1xin s VAL 135 Ca 0.01 0.74 0.03 0.00 0.00 0.00 0.00 61.98 62.76 1xin s VAL 135 Cb -0.17 -3.68 0.06 0.00 0.00 0.00 0.00 36.38 32.60 1xin s VAL 135 CO -0.02 0.50 -0.08 -0.76 0.00 0.00 0.00 175.10 174.74 1xin s LEU 136 N -0.49 3.64 -0.43 3.92 1.02 -0.31 -4.35 118.68 121.68 1xin s LEU 136 Ca 0.22 -1.47 -0.09 0.00 0.02 0.00 0.00 54.13 52.81 1xin s LEU 136 Cb -0.15 -1.58 0.09 0.00 0.02 0.00 0.00 46.19 44.57 1xin s LEU 136 CO 0.10 -0.22 0.28 0.86 0.02 0.00 0.00 176.35 177.39 1xin s TRP 137 N 1.10 3.36 -1.45 0.29 -0.00 -1.26 -0.89 118.94 120.08 1xin s TRP 137 Ca -0.07 -1.61 -0.09 0.00 -0.00 0.00 0.00 56.10 54.34 1xin s TRP 137 Cb -0.20 -3.10 0.04 0.00 -0.00 0.00 0.00 33.47 30.21 1xin s TRP 137 CO -0.05 -0.88 2.53 0.41 -0.00 0.00 0.00 176.95 178.96 1xin n GLY 138 N 4.92 4.70 0.25 5.86 0.00 -1.26 -4.75 105.19 114.91 1xin n GLY 138 Ca -0.09 -1.79 0.06 0.00 0.00 0.00 0.00 46.02 44.20 1xin n GLY 138 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1xin h GLY 139 N 6.89 0.07 -2.07 -0.02 0.00 -1.91 -2.60 103.07 103.43 1xin h GLY 139 Ca 0.72 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 48.02 1xin h GLY 139 CO 1.66 0.03 0.00 0.54 0.00 0.00 0.00 176.54 178.77 1xin n ARG 140 N -4.44 2.40 -2.92 4.80 5.12 -1.26 -4.10 116.66 116.25 1xin n ARG 140 Ca -0.02 -2.07 -0.42 0.00 -1.93 0.00 0.00 57.85 53.41 1xin n ARG 140 Cb 0.15 -1.49 -0.05 0.00 -1.16 0.00 0.00 32.46 29.92 1xin n ARG 140 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1xin s GLU 141 N -1.76 3.74 0.00 5.56 0.41 -0.98 -2.58 118.70 123.09 1xin s GLU 141 Ca 0.33 0.34 0.00 0.00 -0.41 0.00 0.00 54.97 55.23 1xin s GLU 141 Cb 0.21 -3.82 0.00 0.00 -1.78 0.00 0.00 34.13 28.74 1xin s GLU 141 CO 0.31 -0.91 0.00 0.41 -0.49 0.00 0.00 175.26 174.58 1xin n GLY 142 N 4.54 -0.04 3.73 -1.39 0.00 -1.26 -0.66 105.19 110.12 1xin n GLY 142 Ca 0.04 -1.01 -0.04 0.00 0.00 0.00 0.00 46.02 45.01 1xin n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xin s ALA 143 N -1.00 -1.68 -0.06 4.61 0.00 -0.10 -4.90 121.76 118.63 1xin s ALA 143 Ca 0.00 0.20 0.14 0.00 0.00 0.00 0.00 51.96 52.30 1xin s ALA 143 Cb 0.00 0.62 -0.22 0.00 0.00 0.00 0.00 23.12 23.52 1xin s ALA 143 CO 0.00 -1.02 0.23 0.39 0.00 0.00 0.00 175.76 175.36 1xin n GLU 144 N -0.46 0.91 -4.53 0.00 4.71 -1.26 -2.00 120.64 118.01 1xin n GLU 144 Ca -0.06 -0.09 -0.22 0.00 -0.01 0.00 0.00 57.16 56.78 1xin n GLU 144 Cb 0.61 -1.37 -0.16 0.00 -1.01 0.00 0.00 31.44 29.52 1xin n GLU 144 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 1xin s TYR 145 N -2.81 1.17 0.33 -0.32 2.02 -1.26 -4.90 117.35 111.58 1xin s TYR 145 Ca -0.06 -0.30 0.01 0.00 -0.37 0.00 0.00 57.07 56.35 1xin s TYR 145 Cb 0.08 -0.81 0.56 0.00 -0.40 0.00 0.00 41.96 41.39 1xin s TYR 145 CO 0.62 -0.10 1.95 -0.44 -1.57 0.00 0.00 175.55 176.01 1xin h ASP 146 N 6.27 0.74 0.54 2.29 3.32 -1.94 -2.68 116.42 124.96 1xin h ASP 146 Ca -0.33 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.66 1xin h ASP 146 Cb 1.17 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.53 1xin h ASP 146 CO 0.49 0.60 0.00 -1.54 -1.72 0.00 0.00 179.24 177.07 1xin n SER 147 N -4.38 0.00 0.19 6.45 3.41 -1.26 -3.61 113.62 114.41 1xin n SER 147 Ca 0.06 0.02 0.11 0.00 -0.26 0.00 0.00 58.87 58.80 1xin n SER 147 Cb 0.10 -0.32 0.13 0.00 -0.26 0.00 0.00 64.21 63.86 1xin n SER 147 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xin h ALA 148 N 3.14 0.88 -3.32 7.33 0.00 -1.92 -3.45 119.26 121.93 1xin h ALA 148 Ca 0.00 -0.05 -0.48 0.00 0.00 0.00 0.00 54.91 54.39 1xin h ALA 148 Cb 0.27 -0.00 -0.36 0.00 0.00 0.00 0.00 17.79 17.70 1xin h ALA 148 CO 0.00 0.06 -0.79 0.21 0.00 0.00 0.00 179.25 178.73 1xin s LYS 149 N -3.21 1.21 -0.65 0.00 2.47 -1.24 -5.03 119.74 113.29 1xin s LYS 149 Ca 0.05 -0.18 -0.23 0.00 -1.56 0.00 0.00 55.97 54.06 1xin s LYS 149 Cb 0.06 -1.23 0.07 0.00 -1.46 0.00 0.00 37.83 35.26 1xin s LYS 149 CO 0.70 -0.16 0.96 0.34 0.16 0.00 0.00 175.35 177.35 1xin s ASP 150 N 1.33 6.19 0.22 1.43 -1.08 -1.26 -4.92 116.67 118.58 1xin s ASP 150 Ca -0.03 -0.90 -0.08 0.00 -0.52 0.00 0.00 52.55 51.02 1xin s ASP 150 Cb -0.14 -2.42 0.26 0.00 -1.46 0.00 0.00 42.92 39.16 1xin s ASP 150 CO -0.03 -1.42 1.82 0.58 0.52 0.00 0.00 175.17 176.64 1xin h VAL 151 N 5.98 0.99 0.31 1.11 2.07 -1.98 0.92 116.25 125.64 1xin h VAL 151 Ca -0.28 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 66.97 1xin h VAL 151 Cb 1.07 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 1xin h VAL 151 CO 1.17 0.14 -0.23 -1.28 0.02 0.00 0.00 177.57 177.38 1xin h SER 152 N 0.75 -0.61 -0.84 0.57 0.87 -2.00 0.02 113.55 112.32 1xin h SER 152 Ca 0.32 0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.90 1xin h SER 152 Cb 0.18 0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.29 1xin h SER 152 CO -0.18 -0.36 0.44 0.00 -0.53 0.00 0.00 176.83 176.20 1xin h ALA 153 N 0.09 1.18 -0.65 6.23 0.00 -1.93 -1.61 119.26 122.57 1xin h ALA 153 Ca -0.02 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.77 1xin h ALA 153 Cb 0.48 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1xin h ALA 153 CO -0.01 0.64 0.41 0.00 0.00 0.00 0.00 179.25 180.30 1xin h ALA 154 N 1.29 0.85 -0.46 0.00 0.00 -0.15 -1.26 119.26 119.53 1xin h ALA 154 Ca 0.29 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 1xin h ALA 154 Cb 0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1xin h ALA 154 CO -0.04 0.18 0.09 -0.07 0.00 0.00 0.00 179.25 179.40 1xin h LEU 155 N 0.81 0.66 -0.42 0.00 3.38 -0.51 0.29 115.31 119.52 1xin h LEU 155 Ca 0.26 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1xin h LEU 155 Cb -0.00 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1xin h LEU 155 CO -0.10 0.68 0.18 0.44 0.09 0.00 0.00 178.44 179.73 1xin h ASP 156 N 0.69 0.56 0.40 -0.43 3.32 -0.64 -0.09 116.42 120.23 1xin h ASP 156 Ca 0.15 -0.15 -0.15 0.00 0.02 0.00 0.00 57.03 56.90 1xin h ASP 156 Cb 0.30 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1xin h ASP 156 CO 0.00 0.56 -0.65 0.03 -1.72 0.00 0.00 179.24 177.46 1xin h ARG 157 N 0.53 0.23 -0.37 3.56 2.47 -0.94 0.26 114.38 120.12 1xin h ARG 157 Ca 0.14 -0.17 -0.08 0.00 -1.26 0.00 0.00 59.98 58.61 1xin h ARG 157 Cb 0.16 0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.50 1xin h ARG 157 CO -0.01 0.80 -0.09 -0.92 0.56 0.00 0.00 179.97 180.31 1xin h TYR 158 N 0.17 0.80 -0.28 3.04 5.03 -0.72 -2.48 116.97 122.51 1xin h TYR 158 Ca -0.01 -0.17 -0.04 0.00 2.58 0.00 0.00 58.73 61.08 1xin h TYR 158 Cb 1.17 -0.19 -0.01 0.00 1.55 0.00 0.00 36.73 39.25 1xin h TYR 158 CO 0.02 0.86 0.01 -0.09 -1.32 0.00 0.00 178.16 177.64 1xin h ARG 159 N 0.51 0.50 -0.54 1.82 2.43 -0.90 -2.06 114.38 116.13 1xin h ARG 159 Ca 0.09 -0.15 0.09 0.00 -0.81 0.00 0.00 59.98 59.20 1xin h ARG 159 Cb 0.60 -0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 30.03 1xin h ARG 159 CO 0.04 0.64 0.15 1.49 -1.51 0.00 0.00 179.97 180.78 1xin h GLU 160 N 0.29 0.30 -0.16 0.20 4.81 -0.40 -0.58 114.58 119.04 1xin h GLU 160 Ca 0.08 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1xin h GLU 160 Cb 0.41 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1xin h GLU 160 CO 0.01 0.20 0.03 0.00 -0.73 0.00 0.00 179.01 178.52 1xin h ALA 161 N 1.40 0.22 -0.64 2.92 0.00 -1.36 -3.10 119.26 118.70 1xin h ALA 161 Ca 0.27 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1xin h ALA 161 Cb 0.35 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1xin h ALA 161 CO -0.32 -0.12 0.16 -0.07 0.00 0.00 0.00 179.25 178.90 1xin h LEU 162 N 0.06 0.96 -1.13 0.00 3.38 -1.06 -2.64 115.31 114.88 1xin h LEU 162 Ca 0.05 -0.23 0.09 0.00 0.09 0.00 0.00 57.88 57.88 1xin h LEU 162 Cb 0.30 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.73 1xin h LEU 162 CO 0.00 0.94 0.60 0.78 0.09 0.00 0.00 178.44 180.85 1xin h ASN 163 N 0.94 0.88 -0.33 -0.43 2.35 -1.14 -1.47 115.58 116.38 1xin h ASN 163 Ca 0.20 0.02 -0.06 0.00 -0.55 0.00 0.00 56.30 55.91 1xin h ASN 163 Cb 0.35 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 1xin h ASN 163 CO 0.00 0.52 -0.04 0.25 -1.65 0.00 0.00 177.43 176.52 1xin h LEU 164 N 0.97 0.60 -0.57 1.61 6.46 -1.43 -2.01 115.31 120.94 1xin h LEU 164 Ca 0.43 -0.34 -0.01 0.00 -0.12 0.00 0.00 57.88 57.84 1xin h LEU 164 Cb 0.36 -0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 40.10 1xin h LEU 164 CO -0.19 0.79 0.31 -0.07 -0.62 0.00 0.00 178.44 178.67 1xin h LEU 165 N 0.40 0.72 -0.62 2.25 3.38 -1.09 -1.17 115.31 119.18 1xin h LEU 165 Ca 0.09 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1xin h LEU 165 Cb 0.51 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1xin h LEU 165 CO 0.02 0.61 -0.07 0.00 0.09 0.00 0.00 178.44 179.09 1xin h ALA 166 N 1.14 0.82 -0.05 1.53 0.00 -1.25 -1.79 119.26 119.66 1xin h ALA 166 Ca 0.20 -0.34 0.03 0.00 0.00 0.00 0.00 54.91 54.80 1xin h ALA 166 Cb 0.05 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1xin h ALA 166 CO -0.03 0.66 -0.13 0.37 0.00 0.00 0.00 179.25 180.12 1xin h GLN 167 N 0.91 -0.19 -0.41 0.00 5.75 -0.91 0.06 115.11 120.32 1xin h GLN 167 Ca 0.15 0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.66 1xin h GLN 167 Cb 0.63 0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.20 1xin h GLN 167 CO 0.04 -0.13 0.24 -0.92 -2.65 0.00 0.00 178.83 175.42 1xin h TYR 168 N -0.20 0.54 -0.13 3.99 3.20 -1.12 0.86 116.97 124.11 1xin h TYR 168 Ca 0.06 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 1xin h TYR 168 Cb 0.28 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 1xin h TYR 168 CO -0.21 0.39 0.08 1.03 -1.64 0.00 0.00 178.16 177.81 1xin h SER 169 N 0.53 0.16 -0.33 -2.11 0.87 -1.05 -2.21 113.55 109.42 1xin h SER 169 Ca 0.15 -0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.62 1xin h SER 169 Cb 0.01 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 1xin h SER 169 CO -0.03 0.18 0.12 -0.33 -0.53 0.00 0.00 176.83 176.24 1xin h GLU 170 N 0.13 0.49 -0.35 2.24 4.39 -0.80 -0.55 114.58 120.14 1xin h GLU 170 Ca 0.05 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1xin h GLU 170 Cb 0.05 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 1xin h GLU 170 CO -0.01 0.51 0.23 -0.44 -1.16 0.00 0.00 179.01 178.14 1xin h ASP 171 N 0.37 0.39 0.83 1.42 3.32 -0.71 -2.65 116.42 119.40 1xin h ASP 171 Ca 0.11 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1xin h ASP 171 Cb 0.21 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1xin h ASP 171 CO -0.01 0.29 0.00 0.03 -1.72 0.00 0.00 179.24 177.83 1xin h ARG 172 N 0.47 0.00 -0.56 3.56 2.47 -1.38 -3.47 114.38 115.47 1xin h ARG 172 Ca 0.13 0.00 -0.10 0.00 -1.26 0.00 0.00 59.98 58.74 1xin h ARG 172 Cb -0.05 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.25 1xin h ARG 172 CO -0.03 0.00 -0.12 0.41 0.56 0.00 0.00 179.97 180.79 1xin n GLY 173 N 0.10 0.38 0.21 0.04 0.00 -0.60 -4.96 105.19 100.36 1xin n GLY 173 Ca 0.02 -0.73 0.07 0.00 0.00 0.00 0.00 46.02 45.39 1xin n GLY 173 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1xin h TYR 174 N 0.00 0.00 -0.61 1.61 0.05 -1.41 -3.47 116.97 113.14 1xin h TYR 174 Ca -0.12 0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.40 1xin h TYR 174 Cb 0.82 0.00 -0.10 0.00 1.01 0.00 0.00 36.73 38.46 1xin h TYR 174 CO 0.14 0.29 -0.24 0.41 -1.05 0.00 0.00 178.16 177.72 1xin n GLY 175 N -0.13 1.36 3.78 3.88 0.00 -1.26 -4.99 105.19 107.83 1xin n GLY 175 Ca -0.01 -0.36 -0.34 0.00 0.00 0.00 0.00 46.02 45.31 1xin n GLY 175 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xin s LEU 176 N -2.93 3.61 -0.00 0.99 1.43 -1.26 -4.95 118.68 115.57 1xin s LEU 176 Ca 0.00 2.02 0.04 0.00 -1.03 0.00 0.00 54.13 55.16 1xin s LEU 176 Cb 0.00 -4.56 -0.03 0.00 0.03 0.00 0.00 46.19 41.63 1xin s LEU 176 CO 0.00 -1.27 -0.09 -0.13 0.23 0.00 0.00 176.35 175.09 1xin s ARG 177 N -3.66 2.50 -0.17 1.70 0.52 -0.65 -5.01 118.95 114.17 1xin s ARG 177 Ca 0.69 -0.74 -0.03 0.00 -0.52 0.00 0.00 55.73 55.13 1xin s ARG 177 Cb -0.20 -2.45 -0.02 0.00 0.52 0.00 0.00 34.95 32.80 1xin s ARG 177 CO 0.32 0.60 -0.07 -0.06 0.02 0.00 0.00 175.30 176.12 1xin s PHE 178 N -0.94 2.93 -0.27 -0.53 0.40 -0.39 -1.23 117.98 117.95 1xin s PHE 178 Ca 0.16 -0.66 0.03 0.00 -0.60 0.00 0.00 56.93 55.85 1xin s PHE 178 Cb -0.11 -1.99 0.07 0.00 0.51 0.00 0.00 43.02 41.50 1xin s PHE 178 CO 0.06 -0.30 -0.08 0.00 0.70 0.00 0.00 175.22 175.60 1xin s ALA 179 N 0.83 2.54 0.14 5.36 0.00 -0.57 -0.57 121.76 129.48 1xin s ALA 179 Ca -0.02 -1.82 -0.30 0.00 0.00 0.00 0.00 51.96 49.82 1xin s ALA 179 Cb -0.15 -1.62 -0.07 0.00 0.00 0.00 0.00 23.12 21.29 1xin s ALA 179 CO 0.01 -1.26 1.05 0.42 0.00 0.00 0.00 175.76 175.97 1xin s ILE 180 N 1.11 4.17 -0.34 0.00 -1.09 -0.13 -1.17 121.20 123.75 1xin s ILE 180 Ca -0.06 1.81 -0.09 0.00 -2.23 0.00 0.00 60.65 60.08 1xin s ILE 180 Cb -0.20 -4.15 0.02 0.00 -1.58 0.00 0.00 42.46 36.55 1xin s ILE 180 CO -0.06 0.28 0.15 -0.70 -1.23 0.00 0.00 174.94 173.39 1xin s GLU 181 N -0.09 2.87 0.35 2.79 2.12 -0.07 -0.28 118.70 126.40 1xin s GLU 181 Ca 0.49 -1.03 -0.18 0.00 0.36 0.00 0.00 54.97 54.61 1xin s GLU 181 Cb -0.27 -3.58 -0.10 0.00 0.26 0.00 0.00 34.13 30.45 1xin s GLU 181 CO 0.32 -0.62 0.82 -1.25 -0.54 0.00 0.00 175.26 173.99 1xin s PRO 182 N 1.51 4.13 -0.28 4.30 0.04 -1.26 -4.29 135.00 139.14 1xin s PRO 182 Ca 0.01 0.87 -0.19 0.00 0.04 0.00 0.00 61.00 61.74 1xin s PRO 182 Cb -0.19 -2.39 0.09 0.00 0.04 0.00 0.00 34.50 32.04 1xin s PRO 182 CO 0.05 0.12 0.74 0.21 0.04 0.00 0.00 177.00 178.15 1xin s LYS 183 N -2.93 0.70 0.17 4.56 2.20 -1.23 -4.66 119.74 118.55 1xin s LYS 183 Ca 0.56 1.09 0.02 0.00 -0.36 0.00 0.00 55.97 57.28 1xin s LYS 183 Cb -0.11 0.20 0.02 0.00 -1.51 0.00 0.00 37.83 36.43 1xin s LYS 183 CO 0.16 -0.13 1.39 -1.00 -0.36 0.00 0.00 175.35 175.42 1xin h PRO 184 N 6.30 0.21 -2.30 4.03 0.13 -1.68 -3.37 132.00 135.32 1xin h PRO 184 Ca -0.30 -0.22 0.18 0.00 -0.87 0.00 0.00 66.00 64.80 1xin h PRO 184 Cb 1.21 0.06 -0.08 0.00 0.13 0.00 0.00 31.00 32.31 1xin h PRO 184 CO 0.13 0.94 0.50 0.54 -0.23 0.00 0.00 178.00 179.88 1xin s ASN 185 N -6.93 -0.18 0.00 1.44 4.22 -1.26 -1.88 114.94 110.36 1xin s ASN 185 Ca -0.03 -0.39 -0.00 0.00 -2.14 0.00 0.00 52.86 50.30 1xin s ASN 185 Cb 0.10 0.47 0.00 0.00 1.28 0.00 0.00 41.25 43.11 1xin s ASN 185 CO 0.83 -0.87 0.00 1.21 -2.04 0.00 0.00 177.10 176.23 1xin n GLU 186 N -0.47 -1.64 0.27 3.55 2.13 -1.26 -4.84 120.64 118.38 1xin n GLU 186 Ca -0.06 1.53 0.16 0.00 0.66 0.00 0.00 57.16 59.46 1xin n GLU 186 Cb 0.61 -1.85 0.61 0.00 0.27 0.00 0.00 31.44 31.08 1xin n GLU 186 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 1xin h PRO 187 N 1.35 0.00 -6.86 5.31 0.13 -2.00 -3.50 132.00 126.43 1xin h PRO 187 Ca -0.01 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.64 1xin h PRO 187 Cb 0.01 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.13 1xin h PRO 187 CO 0.00 0.00 0.16 1.03 -0.23 0.00 0.00 178.00 178.97 1xin s ARG 188 N -3.61 3.94 0.22 0.86 1.81 -1.26 -4.98 118.95 115.94 1xin s ARG 188 Ca 0.02 0.68 -0.08 0.00 -1.72 0.00 0.00 55.73 54.63 1xin s ARG 188 Cb 0.08 -2.36 0.34 0.00 -0.45 0.00 0.00 34.95 32.57 1xin s ARG 188 CO 0.56 0.02 1.73 0.78 -0.68 0.00 0.00 175.30 177.71 1xin h GLY 189 N 1.71 0.93 -6.34 -3.53 0.00 -1.87 -3.40 103.07 90.57 1xin h GLY 189 Ca -0.48 -0.11 -0.32 0.00 0.00 0.00 0.00 47.33 46.43 1xin h GLY 189 CO 0.64 -0.07 -0.74 0.99 0.00 0.00 0.00 176.54 177.36 1xin s ASP 190 N -5.35 0.25 -0.04 0.19 1.01 -0.85 -4.62 116.67 107.26 1xin s ASP 190 Ca -0.13 -0.00 -0.04 0.00 0.71 0.00 0.00 52.55 53.10 1xin s ASP 190 Cb 0.18 -0.14 -0.04 0.00 1.01 0.00 0.00 42.92 43.94 1xin s ASP 190 CO 0.75 -0.10 0.15 -0.63 0.21 0.00 0.00 175.17 175.55 1xin s ILE 191 N 0.92 5.34 0.46 0.77 1.01 -0.79 -0.92 121.20 127.99 1xin s ILE 191 Ca -0.09 -0.08 -0.24 0.00 0.00 0.00 0.00 60.65 60.25 1xin s ILE 191 Cb -0.12 -3.43 -0.07 0.00 0.01 0.00 0.00 42.46 38.85 1xin s ILE 191 CO -0.02 0.43 1.24 -0.76 0.00 0.00 0.00 174.94 175.82 1xin s LEU 192 N -1.61 4.04 -0.81 2.97 1.43 0.17 -3.79 118.68 121.08 1xin s LEU 192 Ca 0.23 2.49 -0.03 0.00 -1.03 0.00 0.00 54.13 55.79 1xin s LEU 192 Cb -0.12 -4.15 -0.03 0.00 0.03 0.00 0.00 46.19 41.91 1xin s LEU 192 CO 0.13 -1.03 0.73 0.18 0.23 0.00 0.00 176.35 176.59 1xin n LEU 193 N -0.43 -5.90 0.25 1.79 4.77 -1.26 -4.80 117.00 111.43 1xin n LEU 193 Ca 0.07 -0.34 0.14 0.00 -0.03 0.00 0.00 56.01 55.85 1xin n LEU 193 Cb 0.46 -3.05 0.52 0.00 -2.33 0.00 0.00 43.42 39.02 1xin n LEU 193 CO 0.51 -0.51 0.89 1.55 -1.33 0.00 0.00 177.39 178.50 1xin h PRO 194 N -0.24 0.00 -4.85 3.23 0.13 -1.72 -3.27 132.00 125.28 1xin h PRO 194 Ca -0.26 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.54 1xin h PRO 194 Cb 1.13 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.12 1xin h PRO 194 CO 0.33 0.10 -0.62 0.95 -0.23 0.00 0.00 178.00 178.53 1xin s THR 195 N -3.59 0.54 0.25 1.56 -4.23 -1.26 -2.21 115.64 106.69 1xin s THR 195 Ca 0.02 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.50 1xin s THR 195 Cb 0.09 -2.53 0.22 0.00 1.34 0.00 0.00 72.50 71.62 1xin s THR 195 CO 0.60 -0.09 1.77 0.00 -0.54 0.00 0.00 174.62 176.36 1xin h ALA 196 N 2.46 1.17 -0.01 3.99 0.00 -1.92 -2.04 119.26 122.92 1xin h ALA 196 Ca -0.38 0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.62 1xin h ALA 196 Cb 1.24 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1xin h ALA 196 CO 0.61 -0.07 -0.05 0.78 0.00 0.00 0.00 179.25 180.51 1xin h GLY 197 N 0.61 -0.04 1.07 0.00 0.00 -1.96 -0.53 103.07 102.22 1xin h GLY 197 Ca 0.42 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.81 1xin h GLY 197 CO -0.33 -0.06 0.59 0.45 0.00 0.00 0.00 176.54 177.19 1xin h HIS 198 N -0.08 1.20 -0.32 5.60 -0.00 -1.78 -1.00 115.15 118.76 1xin h HIS 198 Ca 0.02 0.02 -0.12 0.00 -0.00 0.00 0.00 60.37 60.29 1xin h HIS 198 Cb 0.11 -0.40 -0.01 0.00 -0.00 0.00 0.00 27.41 27.12 1xin h HIS 198 CO -0.13 0.77 -0.27 0.00 -0.00 0.00 0.00 177.93 178.31 1xin h ALA 199 N 1.38 0.46 -0.14 2.45 0.00 -1.10 -1.98 119.26 120.34 1xin h ALA 199 Ca 0.34 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1xin h ALA 199 Cb -0.11 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1xin h ALA 199 CO -0.07 0.46 0.04 0.82 0.00 0.00 0.00 179.25 180.50 1xin h ILE 200 N 0.51 1.19 -0.70 0.00 2.04 -0.83 -2.36 117.51 117.36 1xin h ILE 200 Ca 0.06 -0.60 0.08 0.00 1.00 0.00 0.00 64.86 65.39 1xin h ILE 200 Cb 0.83 1.33 -0.07 0.00 -0.74 0.00 0.00 36.82 38.18 1xin h ILE 200 CO 0.07 0.18 0.36 0.00 0.00 0.00 0.00 178.15 178.76 1xin h ALA 201 N 0.84 0.95 -0.20 1.87 0.00 -1.20 -2.46 119.26 119.07 1xin h ALA 201 Ca 0.04 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1xin h ALA 201 Cb 0.25 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1xin h ALA 201 CO -0.00 -0.01 0.11 0.35 0.00 0.00 0.00 179.25 179.70 1xin h PHE 202 N 0.63 0.28 -0.84 0.00 3.57 -1.17 -3.05 116.94 116.37 1xin h PHE 202 Ca 0.33 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.91 1xin h PHE 202 Cb 0.30 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 38.90 1xin h PHE 202 CO -0.10 0.26 0.54 0.28 -2.23 0.00 0.00 178.31 177.07 1xin h VAL 203 N 0.22 0.99 0.00 1.41 2.07 -1.20 -0.42 116.25 119.32 1xin h VAL 203 Ca 0.07 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.30 1xin h VAL 203 Cb 0.07 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.92 1xin h VAL 203 CO -0.01 0.15 0.00 0.00 0.02 0.00 0.00 177.57 177.73 1xin n GLN 204 N -4.51 0.13 -0.06 1.57 6.02 -0.95 -2.17 117.38 117.41 1xin n GLN 204 Ca 0.14 0.56 0.12 0.00 -0.01 0.00 0.00 57.00 57.81 1xin n GLN 204 Cb 0.28 -1.87 0.13 0.00 1.02 0.00 0.00 30.24 29.81 1xin n GLN 204 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1xin n GLU 205 N -2.13 2.32 -1.99 -1.09 -0.58 -0.17 -4.95 120.64 112.05 1xin n GLU 205 Ca -0.00 -2.02 -0.28 0.00 -0.42 0.00 0.00 57.16 54.44 1xin n GLU 205 Cb 0.07 -1.47 0.08 0.00 -0.57 0.00 0.00 31.44 29.56 1xin n GLU 205 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1xin s LEU 206 N -1.79 2.64 0.09 -4.62 1.43 -0.92 -5.02 118.68 110.49 1xin s LEU 206 Ca 0.31 0.72 -0.19 0.00 -1.03 0.00 0.00 54.13 53.94 1xin s LEU 206 Cb 0.20 -3.29 -0.07 0.00 0.03 0.00 0.00 46.19 43.06 1xin s LEU 206 CO 0.30 -1.75 1.56 -0.08 0.23 0.00 0.00 176.35 176.60 1xin h GLU 207 N -0.88 0.43 -2.52 1.70 4.81 -1.93 -3.35 114.58 112.85 1xin h GLU 207 Ca -0.45 -0.12 -0.61 0.00 -0.13 0.00 0.00 59.36 58.05 1xin h GLU 207 Cb 1.32 -0.05 -0.42 0.00 0.63 0.00 0.00 28.75 30.23 1xin h GLU 207 CO 0.64 0.56 -0.55 0.54 -0.73 0.00 0.00 179.01 179.47 1xin n ARG 208 N -4.67 2.35 0.19 1.92 1.74 -1.26 -4.94 116.66 111.99 1xin n ARG 208 Ca -0.03 -4.61 0.14 0.00 -0.77 0.00 0.00 57.85 52.57 1xin n ARG 208 Cb 0.21 -2.28 0.73 0.00 -1.02 0.00 0.00 32.46 30.10 1xin n ARG 208 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1xin h PRO 209 N 4.63 0.00 0.00 5.56 0.13 -1.82 -1.24 132.00 139.26 1xin h PRO 209 Ca 0.18 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1xin h PRO 209 Cb 0.69 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.82 1xin h PRO 209 CO 0.81 0.00 -0.01 1.05 -0.23 0.00 0.00 178.00 179.62 1xin h GLU 210 N 0.00 0.00 -0.00 0.86 9.09 -1.92 0.46 114.58 123.07 1xin h GLU 210 Ca 0.08 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.49 1xin h GLU 210 Cb 0.34 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.44 1xin h GLU 210 CO -0.00 0.01 -0.35 1.28 0.05 0.00 0.00 179.01 180.00 1xin n LEU 211 N -3.65 0.35 -4.47 3.06 4.77 -0.47 -4.90 117.00 111.69 1xin n LEU 211 Ca -0.03 0.15 -0.32 0.00 -0.03 0.00 0.00 56.01 55.78 1xin n LEU 211 Cb 0.10 -0.33 -0.13 0.00 -2.33 0.00 0.00 43.42 40.73 1xin n LEU 211 CO 0.26 0.09 -0.46 -0.36 -1.33 0.00 0.00 177.39 175.58 1xin s PHE 212 N -3.00 2.66 0.00 -1.77 0.40 0.15 -1.26 117.98 115.16 1xin s PHE 212 Ca 0.12 -0.19 0.00 0.00 -0.60 0.00 0.00 56.93 56.26 1xin s PHE 212 Cb 0.18 -1.59 0.00 0.00 0.51 0.00 0.00 43.02 42.12 1xin s PHE 212 CO 0.65 0.20 0.00 0.41 0.70 0.00 0.00 175.22 177.18 1xin n GLY 213 N 2.11 4.28 3.34 4.36 0.00 0.27 -4.97 105.19 114.58 1xin n GLY 213 Ca -0.17 -1.23 -0.18 0.00 0.00 0.00 0.00 46.02 44.44 1xin n GLY 213 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1xin s ILE 214 N -1.78 1.68 -0.59 -0.61 -4.36 -0.26 -0.95 121.20 114.33 1xin s ILE 214 Ca 0.00 -2.20 0.05 0.00 -0.26 0.00 0.00 60.65 58.25 1xin s ILE 214 Cb 0.00 -2.03 0.20 0.00 1.25 0.00 0.00 42.46 41.88 1xin s ILE 214 CO 0.00 -0.60 0.53 -3.20 0.24 0.00 0.00 174.94 171.91 1xin n ASN 215 N -0.37 2.17 -4.78 4.36 5.15 0.62 -2.67 115.26 119.75 1xin n ASN 215 Ca -0.08 -3.04 -0.36 0.00 -0.60 0.00 0.00 54.58 50.49 1xin n ASN 215 Cb 0.60 -0.68 -0.02 0.00 -0.53 0.00 0.00 39.78 39.15 1xin n ASN 215 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1xin s PRO 216 N -1.39 3.85 -0.09 1.20 0.04 -1.26 -4.27 135.00 133.08 1xin s PRO 216 Ca 0.32 1.65 0.04 0.00 0.04 0.00 0.00 61.00 63.04 1xin s PRO 216 Cb 0.05 -2.39 -0.01 0.00 0.04 0.00 0.00 34.50 32.19 1xin s PRO 216 CO -0.13 -0.44 -0.20 -2.00 0.04 0.00 0.00 177.00 174.26 1xin s GLU 217 N -2.73 2.92 0.13 4.56 2.12 -1.26 -1.88 118.70 122.57 1xin s GLU 217 Ca 0.63 -0.82 -0.28 0.00 0.36 0.00 0.00 54.97 54.86 1xin s GLU 217 Cb -0.25 -2.35 -0.07 0.00 0.26 0.00 0.00 34.13 31.71 1xin s GLU 217 CO 0.31 0.30 1.48 1.15 -0.54 0.00 0.00 175.26 177.96 1xin h THR 218 N 5.27 0.00 -0.96 -1.70 2.02 -1.63 -1.48 112.91 114.43 1xin h THR 218 Ca -0.28 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.02 1xin h THR 218 Cb 1.20 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.54 1xin h THR 218 CO 0.50 0.00 0.61 1.23 0.37 0.00 0.00 175.52 178.23 1xin h GLY 219 N -0.10 1.47 1.00 2.16 0.00 -1.87 -2.91 103.07 102.82 1xin h GLY 219 Ca 0.12 -0.39 -0.03 0.00 0.00 0.00 0.00 47.33 47.03 1xin h GLY 219 CO -0.75 0.17 0.27 3.43 0.00 0.00 0.00 176.54 179.65 1xin h ASN 220 N 0.92 0.84 -0.34 0.19 4.21 -1.61 -1.73 115.58 118.07 1xin h ASN 220 Ca 0.46 -0.16 -0.15 0.00 1.21 0.00 0.00 56.30 57.66 1xin h ASN 220 Cb 0.49 -0.22 -0.01 0.00 -1.12 0.00 0.00 38.32 37.47 1xin h ASN 220 CO -0.23 0.76 -0.38 -0.33 -1.29 0.00 0.00 177.43 175.97 1xin h GLU 221 N 0.86 0.89 0.00 0.81 4.39 -1.46 -3.07 114.58 117.00 1xin h GLU 221 Ca 0.21 -0.46 -0.01 0.00 0.34 0.00 0.00 59.36 59.43 1xin h GLU 221 Cb 0.17 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1xin h GLU 221 CO -0.02 1.11 -0.07 1.96 -1.16 0.00 0.00 179.01 180.83 1xin h GLN 222 N 0.73 0.00 0.00 2.33 4.20 -1.34 -2.13 115.11 118.89 1xin h GLN 222 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1xin h GLN 222 Cb 0.96 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.74 1xin h GLN 222 CO 0.09 0.07 0.00 0.52 -0.67 0.00 0.00 178.83 178.84 1xin h MET 223 N 0.00 0.00 -0.18 1.46 2.86 -1.21 -0.58 114.93 117.28 1xin h MET 223 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1xin h MET 223 Cb 0.35 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.01 1xin h MET 223 CO 0.01 0.00 0.00 0.43 1.06 0.00 0.00 176.91 178.41 1xin n SER 224 N -2.99 2.71 -1.43 1.22 7.64 -0.87 -4.11 113.62 115.79 1xin n SER 224 Ca -0.00 -1.79 -0.13 0.00 1.01 0.00 0.00 58.87 57.96 1xin n SER 224 Cb 0.24 -0.11 -0.01 0.00 -1.01 0.00 0.00 64.21 63.32 1xin n SER 224 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1xin n ASN 225 N 0.97 -4.11 -4.90 6.43 5.15 -0.23 -5.01 115.26 113.55 1xin n ASN 225 Ca 0.12 0.02 -0.28 0.00 -0.60 0.00 0.00 54.58 53.85 1xin n ASN 225 Cb 0.45 -3.25 0.00 0.00 -0.53 0.00 0.00 39.78 36.45 1xin n ASN 225 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1xin s LEU 226 N -3.65 3.55 -0.46 1.20 1.43 -0.86 -4.98 118.68 114.91 1xin s LEU 226 Ca 0.00 1.01 -0.26 0.00 -1.03 0.00 0.00 54.13 53.85 1xin s LEU 226 Cb 0.00 -3.98 0.03 0.00 0.03 0.00 0.00 46.19 42.27 1xin s LEU 226 CO 0.00 -0.64 0.97 0.21 0.23 0.00 0.00 176.35 177.11 1xin s ASN 227 N -4.13 6.54 0.04 2.29 3.84 -1.26 -4.30 114.94 117.95 1xin s ASN 227 Ca 0.49 0.22 -0.25 0.00 0.21 0.00 0.00 52.86 53.53 1xin s ASN 227 Cb -0.10 -2.47 -0.17 0.00 -0.55 0.00 0.00 41.25 37.95 1xin s ASN 227 CO 0.47 -1.07 1.49 0.15 -2.79 0.00 0.00 177.10 175.35 1xin h PHE 228 N 9.06 -0.08 -0.56 0.43 3.57 -1.92 -1.97 116.94 125.47 1xin h PHE 228 Ca -0.24 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.37 1xin h PHE 228 Cb 1.07 0.03 -0.10 0.00 2.79 0.00 0.00 35.95 39.74 1xin h PHE 228 CO 0.89 0.16 -0.04 1.15 -2.23 0.00 0.00 178.31 178.24 1xin h THR 229 N -0.31 0.52 -0.63 4.41 2.02 -1.92 -1.21 112.91 115.78 1xin h THR 229 Ca -0.01 -0.03 -0.04 0.00 0.77 0.00 0.00 66.41 67.11 1xin h THR 229 Cb 0.27 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 1xin h THR 229 CO 0.01 0.01 0.25 1.56 0.37 0.00 0.00 175.52 177.73 1xin h GLN 230 N 0.08 0.92 -0.08 6.66 4.20 -1.96 -1.06 115.11 123.87 1xin h GLN 230 Ca 0.28 -0.15 -0.15 0.00 0.06 0.00 0.00 58.65 58.69 1xin h GLN 230 Cb 0.44 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 1xin h GLN 230 CO -0.50 0.76 -0.62 0.78 -0.67 0.00 0.00 178.83 178.58 1xin h GLY 231 N 1.01 0.33 1.38 3.46 0.00 -0.50 -2.70 103.07 106.05 1xin h GLY 231 Ca 0.21 -0.41 -0.09 0.00 0.00 0.00 0.00 47.33 47.04 1xin h GLY 231 CO -0.02 0.37 -0.13 -2.22 0.00 0.00 0.00 176.54 174.54 1xin h ILE 232 N 0.22 1.26 -0.55 2.60 1.08 -0.65 -1.13 117.51 120.34 1xin h ILE 232 Ca -0.01 -1.18 0.00 0.00 -0.39 0.00 0.00 64.86 63.28 1xin h ILE 232 Cb 1.13 1.09 -0.03 0.00 -3.07 0.00 0.00 36.82 35.95 1xin h ILE 232 CO 0.10 0.40 0.35 0.00 -0.69 0.00 0.00 178.15 178.31 1xin h ALA 233 N 1.19 0.70 -0.59 1.87 0.00 -1.06 0.49 119.26 121.86 1xin h ALA 233 Ca 0.11 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1xin h ALA 233 Cb 0.60 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1xin h ALA 233 CO 0.04 0.15 -0.03 0.37 0.00 0.00 0.00 179.25 179.78 1xin h GLN 234 N 0.74 1.06 -0.75 0.00 4.15 -1.18 -0.65 115.11 118.47 1xin h GLN 234 Ca 0.20 -0.35 -0.03 0.00 0.77 0.00 0.00 58.65 59.24 1xin h GLN 234 Cb -0.06 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.51 1xin h GLN 234 CO -0.04 1.05 0.37 0.00 -1.93 0.00 0.00 178.83 178.28 1xin h ALA 235 N 0.99 0.97 -0.50 3.38 0.00 -0.63 -1.44 119.26 122.04 1xin h ALA 235 Ca 0.16 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1xin h ALA 235 Cb 0.60 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1xin h ALA 235 CO 0.04 0.53 0.00 -0.07 0.00 0.00 0.00 179.25 179.75 1xin h LEU 236 N 1.06 0.79 -0.89 0.00 3.38 -0.62 -0.57 115.31 118.47 1xin h LEU 236 Ca 0.26 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1xin h LEU 236 Cb 0.11 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1xin h LEU 236 CO -0.03 0.86 0.48 -0.25 0.09 0.00 0.00 178.44 179.59 1xin h TRP 237 N 0.77 1.23 -0.00 1.13 7.01 -0.45 -0.65 115.95 124.99 1xin h TRP 237 Ca 0.15 -0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.12 1xin h TRP 237 Cb 0.46 -0.39 0.00 0.00 -2.10 0.00 0.00 29.16 27.13 1xin h TRP 237 CO 0.03 0.85 -0.10 0.72 -2.79 0.00 0.00 178.44 177.15 1xin n HIS 238 N -4.33 0.00 -3.45 2.65 8.25 -0.60 -4.93 115.22 112.81 1xin n HIS 238 Ca 0.09 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.35 1xin n HIS 238 Cb 0.10 -0.33 0.07 0.00 1.12 0.00 0.00 29.99 30.95 1xin n HIS 238 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1xin n LYS 239 N -1.31 -6.92 -0.04 -0.41 5.02 -0.25 -4.92 118.16 109.33 1xin n LYS 239 Ca 0.10 0.72 0.02 0.00 -2.02 0.00 0.00 58.31 57.14 1xin n LYS 239 Cb 0.30 -5.43 0.04 0.00 -0.02 0.00 0.00 35.03 29.92 1xin n LYS 239 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1xin n LYS 240 N -4.40 2.72 -2.67 1.97 4.76 -0.34 -4.90 118.16 115.30 1xin n LYS 240 Ca 0.01 -1.76 -0.42 0.00 -2.87 0.00 0.00 58.31 53.27 1xin n LYS 240 Cb 0.55 -1.13 -0.03 0.00 -1.84 0.00 0.00 35.03 32.59 1xin n LYS 240 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1xin s LEU 241 N -1.33 3.94 0.18 -0.35 2.96 -1.24 -1.10 118.68 121.73 1xin s LEU 241 Ca 0.08 -1.57 0.20 0.00 -0.22 0.00 0.00 54.13 52.62 1xin s LEU 241 Cb 0.06 -2.52 -0.02 0.00 0.50 0.00 0.00 46.19 44.21 1xin s LEU 241 CO 0.02 -1.40 1.03 -0.26 -1.32 0.00 0.00 176.35 174.43 1xin h PHE 242 N 9.53 0.00 -2.32 5.38 -1.00 -1.86 -3.48 116.94 123.20 1xin h PHE 242 Ca 0.16 0.00 0.15 0.00 2.81 0.00 0.00 57.97 61.09 1xin h PHE 242 Cb 1.02 0.00 -0.11 0.00 3.61 0.00 0.00 35.95 40.47 1xin h PHE 242 CO 1.24 0.23 0.49 -1.58 -1.61 0.00 0.00 178.31 177.07 1xin s HIS 243 N -3.18 -0.21 -0.09 -0.55 2.46 -1.20 -4.90 115.29 107.62 1xin s HIS 243 Ca -0.01 -0.03 -0.08 0.00 0.47 0.00 0.00 55.06 55.41 1xin s HIS 243 Cb 0.09 0.60 0.02 0.00 -0.13 0.00 0.00 32.58 33.16 1xin s HIS 243 CO 0.79 -0.72 0.24 -1.50 -2.47 0.00 0.00 174.74 171.07 1xin s ILE 244 N -3.22 -0.00 -0.27 0.89 2.07 -1.26 -4.08 121.20 115.32 1xin s ILE 244 Ca 0.10 0.01 -0.04 0.00 -1.41 0.00 0.00 60.65 59.30 1xin s ILE 244 Cb -0.01 -0.34 0.01 0.00 0.13 0.00 0.00 42.46 42.25 1xin s ILE 244 CO -0.02 0.00 0.01 -1.81 -1.91 0.00 0.00 174.94 171.21 1xin s ASP 245 N 0.22 4.71 -0.14 4.50 1.11 -0.79 -3.20 116.67 123.08 1xin s ASP 245 Ca -0.01 -0.74 -0.07 0.00 0.18 0.00 0.00 52.55 51.92 1xin s ASP 245 Cb -0.02 -1.78 -0.04 0.00 1.07 0.00 0.00 42.92 42.15 1xin s ASP 245 CO -0.00 -0.14 0.10 -0.76 1.18 0.00 0.00 175.17 175.54 1xin s LEU 246 N 1.43 4.11 0.00 1.23 1.43 0.94 -1.77 118.68 126.04 1xin s LEU 246 Ca 0.02 0.30 -0.06 0.00 -1.03 0.00 0.00 54.13 53.36 1xin s LEU 246 Cb -0.17 -2.01 0.02 0.00 0.03 0.00 0.00 46.19 44.07 1xin s LEU 246 CO -0.01 0.32 0.28 -0.46 0.23 0.00 0.00 176.35 176.71 1xin n ASN 247 N 2.58 -0.40 -4.23 2.29 0.23 -1.26 -2.35 115.26 112.12 1xin n ASN 247 Ca -0.18 -1.18 -0.18 0.00 -0.53 0.00 0.00 54.58 52.50 1xin n ASN 247 Cb 0.54 0.64 -0.11 0.00 -2.08 0.00 0.00 39.78 38.77 1xin n ASN 247 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1xin s GLY 248 N -2.49 1.04 -0.01 4.83 0.00 -0.09 -4.28 107.32 106.32 1xin s GLY 248 Ca 0.06 -1.22 -0.25 0.00 0.00 0.00 0.00 44.72 43.31 1xin s GLY 248 CO 0.01 -1.27 0.56 1.62 0.00 0.00 0.00 173.10 174.02 1xin s GLN 249 N -2.42 0.98 -0.88 2.90 2.00 -1.26 -1.45 119.66 119.53 1xin s GLN 249 Ca 0.06 0.02 -0.00 0.00 -2.00 0.00 0.00 55.36 53.44 1xin s GLN 249 Cb -0.06 0.45 0.26 0.00 0.80 0.00 0.00 33.01 34.46 1xin s GLN 249 CO 0.03 -0.32 1.03 0.72 -0.50 0.00 0.00 175.29 176.26 1xin n HIS 250 N 0.82 3.34 -4.88 1.67 8.25 -1.26 -3.27 115.22 119.89 1xin n HIS 250 Ca -0.19 -3.57 0.00 0.00 -0.26 0.00 0.00 57.72 53.69 1xin n HIS 250 Cb 0.58 -0.99 0.00 0.00 1.12 0.00 0.00 29.99 30.69 1xin n HIS 250 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xin n GLY 251 N 1.45 0.33 3.58 -1.41 0.00 -1.26 -4.62 105.19 103.26 1xin n GLY 251 Ca 0.26 -0.92 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 1xin n GLY 251 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xin s PRO 252 N 0.00 3.25 0.11 1.61 0.04 -1.22 -4.25 135.00 134.54 1xin s PRO 252 Ca 0.00 0.68 -0.18 0.00 0.04 0.00 0.00 61.00 61.54 1xin s PRO 252 Cb 0.00 -4.16 0.06 0.00 0.04 0.00 0.00 34.50 30.44 1xin s PRO 252 CO 0.00 -1.99 0.83 0.36 0.04 0.00 0.00 177.00 176.24 1xin n LYS 253 N 8.62 0.42 -0.77 4.56 2.85 -1.26 -5.08 118.16 127.51 1xin n LYS 253 Ca 0.15 -1.02 -0.33 0.00 -1.05 0.00 0.00 58.31 56.07 1xin n LYS 253 Cb 0.49 1.42 0.13 0.00 -0.65 0.00 0.00 35.03 36.42 1xin n LYS 253 CO 0.00 0.00 0.00 1.97 -0.05 0.00 0.00 177.40 179.32 1xin n PHE 254 N -0.59 -1.10 -1.90 5.58 -1.74 -1.26 -4.85 117.46 111.61 1xin n PHE 254 Ca -0.01 0.25 -0.43 0.00 -0.56 0.00 0.00 57.45 56.71 1xin n PHE 254 Cb 0.44 -1.81 -0.03 0.00 1.52 0.00 0.00 39.48 39.61 1xin n PHE 254 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 1xin s ASP 255 N -2.11 6.16 0.01 5.98 2.15 -1.26 -4.91 116.67 122.69 1xin s ASP 255 Ca 0.58 1.89 0.10 0.00 0.43 0.00 0.00 52.55 55.56 1xin s ASP 255 Cb -0.21 -2.53 -0.23 0.00 -0.30 0.00 0.00 42.92 39.66 1xin s ASP 255 CO 0.66 -1.40 0.87 1.56 -0.17 0.00 0.00 175.17 176.69 1xin h GLN 256 N 11.80 0.01 -6.06 4.34 4.20 -1.89 -3.49 115.11 124.02 1xin h GLN 256 Ca -0.39 -0.02 -0.42 0.00 0.06 0.00 0.00 58.65 57.89 1xin h GLN 256 Cb 1.19 0.01 0.05 0.00 0.30 0.00 0.00 27.48 29.03 1xin h GLN 256 CO 0.98 0.68 -0.79 -0.25 -0.67 0.00 0.00 178.83 178.79 1xin n ASP 257 N -3.16 -2.87 -4.60 1.46 8.00 -1.22 -4.75 116.55 109.40 1xin n ASP 257 Ca -0.11 -0.75 -0.29 0.00 0.71 0.00 0.00 54.79 54.35 1xin n ASP 257 Cb 1.01 -4.26 0.15 0.00 -0.02 0.00 0.00 41.12 38.00 1xin n ASP 257 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xin s LEU 258 N -6.88 2.07 0.60 0.64 1.43 -0.53 -0.38 118.68 115.64 1xin s LEU 258 Ca 0.25 0.79 -0.19 0.00 -1.03 0.00 0.00 54.13 53.95 1xin s LEU 258 Cb -0.12 -3.03 -0.03 0.00 0.03 0.00 0.00 46.19 43.03 1xin s LEU 258 CO 0.80 -2.64 1.29 -0.69 0.23 0.00 0.00 176.35 175.34 1xin s VAL 259 N -3.40 2.24 0.20 -1.59 1.01 -1.26 -0.91 120.40 116.68 1xin s VAL 259 Ca 0.66 0.16 -0.33 0.00 0.00 0.00 0.00 61.98 62.47 1xin s VAL 259 Cb -0.12 -3.07 -0.13 0.00 0.00 0.00 0.00 36.38 33.06 1xin s VAL 259 CO 0.53 -0.02 1.62 0.33 0.00 0.00 0.00 175.10 177.56 1xin n PHE 260 N -1.53 2.49 -0.09 5.22 7.35 -1.26 -1.43 117.46 128.21 1xin n PHE 260 Ca 0.13 0.19 0.00 0.00 -0.76 0.00 0.00 57.45 57.02 1xin n PHE 260 Cb 0.48 -2.59 0.00 0.00 0.35 0.00 0.00 39.48 37.72 1xin n PHE 260 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1xin n GLY 261 N 3.41 1.20 0.07 7.13 0.00 -1.26 -4.79 105.19 110.95 1xin n GLY 261 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 1xin n GLY 261 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xin n HIS 262 N -2.00 0.00 0.00 1.61 8.25 -0.51 -4.29 115.22 118.27 1xin n HIS 262 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1xin n HIS 262 Cb 0.00 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 30.85 1xin n HIS 262 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xin n GLY 263 N 1.40 0.01 3.46 -1.41 0.00 -1.26 -4.87 105.19 102.51 1xin n GLY 263 Ca 0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 1xin n GLY 263 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xin s ASP 264 N -0.74 6.53 0.18 1.61 -1.08 -1.20 -4.89 116.67 117.08 1xin s ASP 264 Ca 0.00 -1.80 -0.13 0.00 -0.52 0.00 0.00 52.55 50.10 1xin s ASP 264 Cb 0.00 -2.41 0.08 0.00 -1.46 0.00 0.00 42.92 39.13 1xin s ASP 264 CO 0.00 -1.16 1.79 0.25 0.52 0.00 0.00 175.17 176.57 1xin h LEU 265 N 10.74 0.74 -0.65 -1.34 5.85 -1.91 -1.88 115.31 126.86 1xin h LEU 265 Ca 0.07 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.73 1xin h LEU 265 Cb 1.03 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.83 1xin h LEU 265 CO 1.14 0.62 0.40 -0.07 -0.34 0.00 0.00 178.44 180.19 1xin h LEU 266 N 0.80 0.64 -0.86 2.25 3.38 -1.94 -0.92 115.31 118.67 1xin h LEU 266 Ca 0.21 0.01 -0.12 0.00 0.09 0.00 0.00 57.88 58.06 1xin h LEU 266 Cb 0.04 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1xin h LEU 266 CO -0.03 0.44 -0.56 -1.13 0.09 0.00 0.00 178.44 177.25 1xin h ASN 267 N 0.78 0.05 -0.70 -0.43 -0.73 -1.95 -2.26 115.58 110.34 1xin h ASN 267 Ca 0.27 -0.03 -0.05 0.00 1.87 0.00 0.00 56.30 58.36 1xin h ASN 267 Cb 0.04 -0.01 -0.03 0.00 0.27 0.00 0.00 38.32 38.59 1xin h ASN 267 CO -0.12 0.60 0.23 0.00 -0.37 0.00 0.00 177.43 177.77 1xin h ALA 268 N 1.40 0.91 -0.02 1.57 0.00 -0.66 -1.46 119.26 121.01 1xin h ALA 268 Ca -0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1xin h ALA 268 Cb 0.99 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1xin h ALA 268 CO 0.07 0.58 0.01 0.35 0.00 0.00 0.00 179.25 180.27 1xin h PHE 269 N 1.02 0.03 -0.22 0.00 3.57 -0.76 -2.53 116.94 118.05 1xin h PHE 269 Ca 0.23 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.66 1xin h PHE 269 Cb 0.28 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 1xin h PHE 269 CO 0.02 0.15 -0.17 0.66 -2.23 0.00 0.00 178.31 176.75 1xin h SER 270 N -0.11 0.36 -0.44 0.41 4.64 -1.38 -1.89 113.55 115.15 1xin h SER 270 Ca 0.01 -0.09 -0.03 0.00 -0.47 0.00 0.00 61.79 61.20 1xin h SER 270 Cb 0.14 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.11 1xin h SER 270 CO -0.00 0.55 0.15 0.25 -0.87 0.00 0.00 176.83 176.92 1xin h LEU 271 N 0.34 0.62 -0.69 5.97 5.85 -1.14 -0.81 115.31 125.45 1xin h LEU 271 Ca 0.06 -0.19 -0.12 0.00 0.84 0.00 0.00 57.88 58.48 1xin h LEU 271 Cb 0.50 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1xin h LEU 271 CO 0.03 0.64 -0.23 0.58 -0.34 0.00 0.00 178.44 179.12 1xin h VAL 272 N 0.56 1.27 -0.08 1.05 2.07 -1.23 -1.16 116.25 118.73 1xin h VAL 272 Ca 0.14 -1.34 -0.00 0.00 0.82 0.00 0.00 66.70 66.32 1xin h VAL 272 Cb 0.23 1.22 -0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1xin h VAL 272 CO -0.01 0.45 0.05 -0.78 0.02 0.00 0.00 177.57 177.30 1xin h ASP 273 N 0.67 0.10 -0.04 0.57 3.58 -1.20 -1.89 116.42 118.22 1xin h ASP 273 Ca 0.09 -0.04 0.02 0.00 0.42 0.00 0.00 57.03 57.52 1xin h ASP 273 Cb 0.74 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.74 1xin h ASP 273 CO 0.06 0.11 -0.08 0.25 -2.88 0.00 0.00 179.24 176.70 1xin h LEU 274 N 0.08 -0.24 -0.86 2.28 5.85 -0.84 -0.17 115.31 121.41 1xin h LEU 274 Ca 0.03 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.68 1xin h LEU 274 Cb 0.03 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1xin h LEU 274 CO -0.01 -0.11 -0.30 -0.07 -0.34 0.00 0.00 178.44 177.61 1xin h LEU 275 N -0.12 0.50 0.07 2.25 3.38 -1.13 -3.38 115.31 116.88 1xin h LEU 275 Ca 0.04 -0.19 -0.37 0.00 0.09 0.00 0.00 57.88 57.45 1xin h LEU 275 Cb 0.18 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1xin h LEU 275 CO -0.11 0.79 -2.20 -0.62 0.09 0.00 0.00 178.44 176.39 1xin n GLU 276 N -4.09 0.71 -2.40 1.13 -0.58 -0.72 -1.33 120.64 113.36 1xin n GLU 276 Ca -0.01 0.21 -0.41 0.00 -0.42 0.00 0.00 57.16 56.53 1xin n GLU 276 Cb 0.44 -1.63 0.01 0.00 -0.57 0.00 0.00 31.44 29.69 1xin n GLU 276 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1xin n ASN 277 N -3.37 7.21 -4.11 1.62 3.02 -0.08 -3.26 115.26 116.30 1xin n ASN 277 Ca -0.37 -3.37 -0.29 0.00 -0.03 0.00 0.00 54.58 50.52 1xin n ASN 277 Cb 1.03 -1.30 0.19 0.00 -0.61 0.00 0.00 39.78 39.09 1xin n ASN 277 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1xin s GLY 278 N -0.46 1.80 0.00 7.41 0.00 -0.60 -4.81 107.32 110.66 1xin s GLY 278 Ca 0.44 -1.33 0.00 0.00 0.00 0.00 0.00 44.72 43.83 1xin s GLY 278 CO -0.07 -0.55 0.31 -1.05 0.00 0.00 0.00 173.10 171.74 1xin n PRO 279 N -3.72 0.00 0.00 2.90 -0.01 -1.21 -3.62 135.00 129.34 1xin n PRO 279 Ca 0.16 0.31 0.00 0.00 -0.01 0.00 0.00 63.50 63.96 1xin n PRO 279 Cb 0.59 -0.49 0.00 0.00 -0.01 0.00 0.00 33.50 33.60 1xin n PRO 279 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 175.50 175.24 1xin n ASP 280 N -1.89 0.00 0.00 2.55 8.00 -1.26 -4.81 116.55 119.14 1xin n ASP 280 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1xin n ASP 280 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1xin n ASP 280 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xin n GLY 281 N 0.63 0.40 3.76 0.44 0.00 -1.24 -5.08 105.19 104.10 1xin n GLY 281 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1xin n GLY 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xin s ALA 282 N -0.05 2.51 0.55 4.61 0.00 -1.26 -4.29 121.76 123.83 1xin s ALA 282 Ca 0.00 0.73 -0.21 0.00 0.00 0.00 0.00 51.96 52.49 1xin s ALA 282 Cb 0.00 -3.37 -0.06 0.00 0.00 0.00 0.00 23.12 19.70 1xin s ALA 282 CO 0.00 -1.16 1.14 -2.30 0.00 0.00 0.00 175.76 173.44 1xin n PRO 283 N -1.98 1.31 0.11 0.00 -0.02 -1.20 -1.55 135.00 131.66 1xin n PRO 283 Ca 0.12 0.49 0.12 0.00 -2.02 0.00 0.00 63.50 62.20 1xin n PRO 283 Cb 0.51 -2.32 0.18 0.00 -0.02 0.00 0.00 33.50 31.84 1xin n PRO 283 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xin h ALA 284 N 1.06 0.72 -3.43 3.55 0.00 -1.41 -3.43 119.26 116.31 1xin h ALA 284 Ca -0.49 0.00 -0.42 0.00 0.00 0.00 0.00 54.91 54.00 1xin h ALA 284 Cb 1.33 0.00 -0.34 0.00 0.00 0.00 0.00 17.79 18.78 1xin h ALA 284 CO 0.54 0.00 -0.78 -0.47 0.00 0.00 0.00 179.25 178.55 1xin s TYR 285 N -3.21 0.82 -1.79 0.00 5.04 -1.19 -5.03 117.35 111.99 1xin s TYR 285 Ca 0.06 -0.24 0.14 0.00 -2.44 0.00 0.00 57.07 54.58 1xin s TYR 285 Cb 0.11 -0.72 0.11 0.00 0.35 0.00 0.00 41.96 41.81 1xin s TYR 285 CO 0.70 -0.22 0.95 -0.40 -1.34 0.00 0.00 175.55 175.25 1xin n ASP 286 N 4.15 2.19 -3.07 4.32 5.75 -1.26 -4.92 116.55 123.72 1xin n ASP 286 Ca -0.23 -1.59 -0.12 0.00 -0.01 0.00 0.00 54.79 52.84 1xin n ASP 286 Cb 0.51 0.00 0.07 0.00 -1.03 0.00 0.00 41.12 40.67 1xin n ASP 286 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1xin n GLY 287 N 0.80 -0.18 3.76 6.12 0.00 -1.26 -5.05 105.19 109.38 1xin n GLY 287 Ca 0.08 -1.86 -0.39 0.00 0.00 0.00 0.00 46.02 43.86 1xin n GLY 287 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1xin s PRO 288 N -3.98 3.50 -0.84 1.61 0.02 -1.26 -4.94 135.00 129.11 1xin s PRO 288 Ca 0.33 2.20 -0.12 0.00 0.02 0.00 0.00 61.00 63.44 1xin s PRO 288 Cb -0.01 -2.46 0.22 0.00 0.02 0.00 0.00 34.50 32.27 1xin s PRO 288 CO 0.23 -0.89 0.78 1.03 -0.33 0.00 0.00 177.00 177.81 1xin s ARG 289 N -2.66 3.56 -0.17 5.54 3.00 -0.18 -4.33 118.95 123.71 1xin s ARG 289 Ca 0.65 -2.60 -0.17 0.00 0.00 0.00 0.00 55.73 53.62 1xin s ARG 289 Cb -0.39 -4.35 -0.04 0.00 0.00 0.00 0.00 34.95 30.17 1xin s ARG 289 CO 0.48 -1.27 0.43 -1.58 0.00 0.00 0.00 175.30 173.36 1xin s HIS 290 N -0.10 3.42 -0.36 -0.53 2.46 -1.19 -1.60 115.29 117.39 1xin s HIS 290 Ca 0.20 0.71 -0.16 0.00 0.47 0.00 0.00 55.06 56.28 1xin s HIS 290 Cb -0.11 -2.53 -0.00 0.00 -0.13 0.00 0.00 32.58 29.80 1xin s HIS 290 CO -0.08 0.05 0.39 -0.06 -2.47 0.00 0.00 174.74 172.58 1xin s PHE 291 N 1.07 3.20 -0.81 3.88 0.08 -0.16 -0.04 117.98 125.20 1xin s PHE 291 Ca 0.21 -0.06 -0.01 0.00 0.12 0.00 0.00 56.93 57.19 1xin s PHE 291 Cb -0.15 -2.74 0.20 0.00 -0.57 0.00 0.00 43.02 39.76 1xin s PHE 291 CO 0.08 -0.49 0.67 0.34 -0.10 0.00 0.00 175.22 175.72 1xin s ASP 292 N 1.75 5.70 0.40 1.36 -1.08 -0.99 -3.72 116.67 120.09 1xin s ASP 292 Ca 0.13 -3.54 0.05 0.00 -0.52 0.00 0.00 52.55 48.66 1xin s ASP 292 Cb -0.16 -1.87 -0.02 0.00 -1.46 0.00 0.00 42.92 39.41 1xin s ASP 292 CO 0.12 -0.21 0.17 0.00 0.52 0.00 0.00 175.17 175.77 1xin n TYR 293 N 2.55 -0.01 -4.09 -5.34 4.11 -1.26 -4.61 117.16 108.51 1xin n TYR 293 Ca 0.18 -2.69 -0.20 0.00 -0.00 0.00 0.00 57.90 55.19 1xin n TYR 293 Cb 0.37 0.04 -0.17 0.00 -0.00 0.00 0.00 39.34 39.59 1xin n TYR 293 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.86 177.01 1xin s LYS 294 N -3.55 0.80 0.09 -3.48 1.02 0.49 -4.37 119.74 110.75 1xin s LYS 294 Ca 0.24 -0.07 -0.31 0.00 0.02 0.00 0.00 55.97 55.85 1xin s LYS 294 Cb 0.01 -0.87 -0.08 0.00 -0.52 0.00 0.00 37.83 36.37 1xin s LYS 294 CO 0.17 -0.12 1.58 -2.14 -0.92 0.00 0.00 175.35 173.92 1xin s PRO 295 N 1.10 4.22 0.40 -1.68 0.02 -1.26 -4.65 135.00 133.15 1xin s PRO 295 Ca -0.08 2.27 -0.24 0.00 0.02 0.00 0.00 61.00 62.97 1xin s PRO 295 Cb -0.14 -3.44 -0.12 0.00 0.02 0.00 0.00 34.50 30.83 1xin s PRO 295 CO -0.01 -0.65 0.84 0.43 -0.33 0.00 0.00 177.00 177.28 1xin n SER 296 N 4.96 0.45 0.28 2.53 7.64 -1.26 -4.86 113.62 123.37 1xin n SER 296 Ca 0.15 1.01 0.18 0.00 1.01 0.00 0.00 58.87 61.21 1xin n SER 296 Cb 0.40 -1.25 0.91 0.00 -1.01 0.00 0.00 64.21 63.26 1xin n SER 296 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1xin h ARG 297 N 1.29 0.00 0.00 1.43 2.43 -1.91 -1.87 114.38 115.76 1xin h ARG 297 Ca -0.42 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 1xin h ARG 297 Cb 1.36 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.91 1xin h ARG 297 CO 0.55 0.00 0.00 0.25 -1.51 0.00 0.00 179.97 179.26 1xin n THR 298 N -3.26 0.11 -3.97 0.20 -2.24 -1.26 -4.80 114.28 99.06 1xin n THR 298 Ca -0.00 0.03 -0.30 0.00 -2.27 0.00 0.00 64.05 61.50 1xin n THR 298 Cb 0.32 -0.57 -0.05 0.00 -2.10 0.00 0.00 70.33 67.93 1xin n THR 298 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1xin s GLU 299 N -2.56 3.25 0.00 -0.78 0.41 -0.70 -5.11 118.70 113.21 1xin s GLU 299 Ca 0.26 -0.54 0.00 0.00 -0.41 0.00 0.00 54.97 54.28 1xin s GLU 299 Cb 0.18 -2.93 0.00 0.00 -1.78 0.00 0.00 34.13 29.61 1xin s GLU 299 CO 0.42 0.58 0.00 -0.40 -0.49 0.00 0.00 175.26 175.37 1xin n ASP 300 N 0.24 0.12 0.27 -0.19 5.68 -1.26 -4.87 116.55 116.54 1xin n ASP 300 Ca -0.06 -0.75 0.12 0.00 -0.50 0.00 0.00 54.79 53.60 1xin n ASP 300 Cb 0.52 0.00 0.77 0.00 -1.14 0.00 0.00 41.12 41.26 1xin n ASP 300 CO 0.00 0.00 0.00 1.88 -1.33 0.00 0.00 177.20 177.75 1xin h TYR 301 N 0.04 0.00 -0.51 2.11 0.05 -1.99 -0.74 116.97 115.93 1xin h TYR 301 Ca 0.00 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.66 1xin h TYR 301 Cb 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 1xin h TYR 301 CO 0.00 0.06 -0.15 -0.44 -1.05 0.00 0.00 178.16 176.58 1xin h ASP 302 N 0.00 1.01 -0.60 3.88 3.32 -2.00 -2.47 116.42 119.56 1xin h ASP 302 Ca -0.00 -0.35 -0.06 0.00 0.02 0.00 0.00 57.03 56.64 1xin h ASP 302 Cb 0.13 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1xin h ASP 302 CO 0.01 1.14 0.16 1.23 -1.72 0.00 0.00 179.24 180.05 1xin h GLY 303 N 0.92 1.02 0.52 2.75 0.00 -1.52 -1.94 103.07 104.81 1xin h GLY 303 Ca 0.13 -0.63 0.02 0.00 0.00 0.00 0.00 47.33 46.85 1xin h GLY 303 CO 0.05 0.59 -0.26 -2.08 0.00 0.00 0.00 176.54 174.84 1xin h VAL 304 N 0.86 0.43 -0.21 4.60 2.07 -1.12 0.63 116.25 123.50 1xin h VAL 304 Ca 0.19 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.64 1xin h VAL 304 Cb 0.33 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 1xin h VAL 304 CO -0.00 0.00 -0.19 -0.50 0.02 0.00 0.00 177.57 176.90 1xin h TRP 305 N -0.45 0.39 -0.66 1.57 4.06 -1.37 -1.77 115.95 117.72 1xin h TRP 305 Ca 0.04 -0.06 -0.06 0.00 2.06 0.00 0.00 58.89 60.86 1xin h TRP 305 Cb 0.49 -0.10 -0.03 0.00 -1.00 0.00 0.00 29.16 28.52 1xin h TRP 305 CO -0.25 0.54 0.18 0.93 -3.56 0.00 0.00 178.44 176.28 1xin h GLU 306 N 0.33 1.04 -0.12 0.49 4.39 -0.92 -2.28 114.58 117.51 1xin h GLU 306 Ca 0.06 -0.24 -0.14 0.00 0.34 0.00 0.00 59.36 59.38 1xin h GLU 306 Cb 0.53 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 1xin h GLU 306 CO 0.03 0.92 -0.52 0.66 -1.16 0.00 0.00 179.01 178.94 1xin h SER 307 N 0.97 0.38 -0.10 1.42 4.64 -0.47 -0.38 113.55 120.02 1xin h SER 307 Ca 0.21 -0.20 -0.01 0.00 -0.47 0.00 0.00 61.79 61.32 1xin h SER 307 Cb 0.33 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1xin h SER 307 CO -0.00 0.84 0.02 0.00 -0.87 0.00 0.00 176.83 176.82 1xin h ALA 308 N 1.17 0.13 -0.56 5.18 0.00 -1.09 -2.66 119.26 121.43 1xin h ALA 308 Ca 0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1xin h ALA 308 Cb 1.01 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 1xin h ALA 308 CO 0.09 -0.23 0.22 0.87 0.00 0.00 0.00 179.25 180.19 1xin h LYS 309 N -0.06 0.82 -0.85 0.00 1.57 -1.32 -2.50 116.57 114.23 1xin h LYS 309 Ca 0.03 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1xin h LYS 309 Cb 0.27 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.39 1xin h LYS 309 CO 0.00 0.68 0.51 0.00 -0.57 0.00 0.00 179.45 180.07 1xin h ALA 310 N 1.43 1.30 0.05 3.86 0.00 -0.84 -0.13 119.26 124.92 1xin h ALA 310 Ca 0.19 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1xin h ALA 310 Cb 0.17 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1xin h ALA 310 CO -0.02 0.60 -0.08 -0.91 0.00 0.00 0.00 179.25 178.84 1xin h ASN 311 N 1.17 -0.22 -0.80 0.00 2.35 -1.10 0.89 115.58 117.88 1xin h ASN 311 Ca 0.30 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 56.07 1xin h ASN 311 Cb -0.05 0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.37 1xin h ASN 311 CO -0.06 -0.12 0.45 0.40 -1.65 0.00 0.00 177.43 176.45 1xin h ILE 312 N -0.16 1.23 -0.36 2.81 2.04 -1.46 -2.63 117.51 118.99 1xin h ILE 312 Ca 0.02 -0.57 -0.02 0.00 1.00 0.00 0.00 64.86 65.29 1xin h ILE 312 Cb 0.17 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 1xin h ILE 312 CO -0.05 0.26 0.16 -0.09 0.00 0.00 0.00 178.15 178.43 1xin h ARG 313 N 1.10 0.53 -0.01 2.37 2.43 -0.58 -1.85 114.38 118.37 1xin h ARG 313 Ca 0.28 -0.09 0.01 0.00 -0.81 0.00 0.00 59.98 59.37 1xin h ARG 313 Cb 0.02 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1xin h ARG 313 CO -0.05 0.50 -0.05 0.52 -1.51 0.00 0.00 179.97 179.38 1xin h MET 314 N 0.43 -0.08 -0.11 0.20 2.86 -0.69 -0.02 114.93 117.52 1xin h MET 314 Ca 0.12 0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.80 1xin h MET 314 Cb 0.16 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.80 1xin h MET 314 CO -0.01 -0.05 -0.10 -0.92 1.06 0.00 0.00 176.91 176.89 1xin h TYR 315 N -0.08 -0.25 -0.80 -0.22 5.03 -1.21 -0.86 116.97 118.58 1xin h TYR 315 Ca 0.02 0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.30 1xin h TYR 315 Cb 0.11 0.13 -0.04 0.00 1.55 0.00 0.00 36.73 38.48 1xin h TYR 315 CO -0.12 -0.16 0.32 -0.07 -1.32 0.00 0.00 178.16 176.81 1xin h LEU 316 N -0.12 1.11 -0.48 2.82 3.38 -1.27 0.39 115.31 121.14 1xin h LEU 316 Ca 0.08 -0.18 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 1xin h LEU 316 Cb 0.23 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1xin h LEU 316 CO -0.19 0.98 -0.05 -0.07 0.09 0.00 0.00 178.44 179.20 1xin h LEU 317 N 1.16 0.88 -0.63 1.67 3.38 -0.68 -2.25 115.31 118.84 1xin h LEU 317 Ca 0.27 -0.33 -0.12 0.00 0.09 0.00 0.00 57.88 57.78 1xin h LEU 317 Cb 0.22 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1xin h LEU 317 CO -0.02 1.01 -0.23 -0.07 0.09 0.00 0.00 178.44 179.21 1xin h LEU 318 N 0.74 0.85 -0.47 1.67 3.38 -0.81 -2.90 115.31 117.76 1xin h LEU 318 Ca 0.13 -0.31 0.02 0.00 0.09 0.00 0.00 57.88 57.81 1xin h LEU 318 Cb 0.59 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1xin h LEU 318 CO 0.04 1.04 0.28 0.50 0.09 0.00 0.00 178.44 180.39 1xin h LYS 319 N 0.72 0.54 -0.71 1.13 3.64 -0.77 -0.39 116.57 120.73 1xin h LYS 319 Ca 0.10 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.47 1xin h LYS 319 Cb 0.76 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.42 1xin h LYS 319 CO 0.06 0.36 0.45 1.49 -2.27 0.00 0.00 179.45 179.54 1xin h GLU 320 N 0.56 0.85 0.00 1.90 4.81 -1.33 -0.45 114.58 120.92 1xin h GLU 320 Ca 0.19 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.22 1xin h GLU 320 Cb 0.01 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.18 1xin h GLU 320 CO -0.08 0.56 -0.68 0.00 -0.73 0.00 0.00 179.01 178.08 1xin h ARG 321 N 0.87 0.00 -0.24 1.92 3.08 -1.29 -2.45 114.38 116.27 1xin h ARG 321 Ca 0.29 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.23 1xin h ARG 321 Cb 0.02 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.06 1xin h ARG 321 CO -0.11 0.68 -0.25 0.00 -1.07 0.00 0.00 179.97 179.22 1xin h ALA 322 N 1.32 0.35 0.11 0.04 0.00 -0.57 -0.63 119.26 119.88 1xin h ALA 322 Ca -0.01 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1xin h ALA 322 Cb 1.39 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1xin h ALA 322 CO 0.09 0.32 -0.05 0.87 0.00 0.00 0.00 179.25 180.48 1xin h LYS 323 N 0.28 -0.14 -0.99 0.00 1.79 -1.10 -2.25 116.57 114.17 1xin h LYS 323 Ca 0.04 0.01 0.04 0.00 -2.18 0.00 0.00 60.65 58.56 1xin h LYS 323 Cb 0.80 0.03 -0.06 0.00 -1.58 0.00 0.00 32.23 31.43 1xin h LYS 323 CO 0.06 -0.05 0.65 0.00 -1.08 0.00 0.00 179.45 179.02 1xin h ALA 324 N 0.71 1.37 -0.03 3.86 0.00 -1.36 -1.75 119.26 122.05 1xin h ALA 324 Ca -0.01 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1xin h ALA 324 Cb 0.15 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1xin h ALA 324 CO 0.02 0.53 -0.09 0.35 0.00 0.00 0.00 179.25 180.06 1xin h PHE 325 N 1.24 -0.23 -0.00 0.00 3.57 -0.74 -2.55 116.94 118.22 1xin h PHE 325 Ca 0.40 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.83 1xin h PHE 325 Cb 0.02 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 1xin h PHE 325 CO -0.00 -0.14 -0.37 0.00 -2.23 0.00 0.00 178.31 175.57 1xin h ARG 326 N -0.14 0.00 -0.00 1.11 2.47 -0.98 -2.79 114.38 114.04 1xin h ARG 326 Ca 0.05 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 1xin h ARG 326 Cb 0.21 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.53 1xin h ARG 326 CO -0.12 0.37 -0.05 0.00 0.56 0.00 0.00 179.97 180.73 1xin n ALA 327 N -2.47 2.60 -2.68 0.04 0.00 -0.70 -4.76 120.51 112.54 1xin n ALA 327 Ca -0.02 -0.19 -0.42 0.00 0.00 0.00 0.00 53.44 52.82 1xin n ALA 327 Cb 0.41 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.40 1xin n ALA 327 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1xin s ASP 328 N -2.58 7.09 0.39 0.00 2.15 -0.99 -4.93 116.67 117.81 1xin s ASP 328 Ca 0.27 1.34 0.13 0.00 0.43 0.00 0.00 52.55 54.72 1xin s ASP 328 Cb 0.20 -2.50 0.96 0.00 -0.30 0.00 0.00 42.92 41.28 1xin s ASP 328 CO 0.48 -0.40 1.88 -0.65 -0.17 0.00 0.00 175.17 176.31 1xin h PRO 329 N 7.19 0.51 -0.04 4.34 0.11 -1.89 0.15 132.00 142.37 1xin h PRO 329 Ca -0.31 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.66 1xin h PRO 329 Cb 1.14 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 1xin h PRO 329 CO 0.84 0.34 -0.49 0.93 -0.21 0.00 0.00 178.00 179.41 1xin h GLU 330 N 0.53 0.10 -0.02 1.05 5.08 -1.95 -1.21 114.58 118.16 1xin h GLU 330 Ca 0.42 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.71 1xin h GLU 330 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1xin h GLU 330 CO -0.17 0.57 -0.05 0.28 -1.00 0.00 0.00 179.01 178.64 1xin h VAL 331 N 0.08 1.46 -0.59 3.13 2.07 -1.34 -1.75 116.25 119.31 1xin h VAL 331 Ca 0.00 -1.45 0.12 0.00 0.82 0.00 0.00 66.70 66.20 1xin h VAL 331 Cb 0.89 2.38 -0.10 0.00 -1.52 0.00 0.00 31.29 32.95 1xin h VAL 331 CO 0.07 0.39 0.00 1.56 0.02 0.00 0.00 177.57 179.61 1xin h GLN 332 N -0.50 0.12 -0.34 1.57 1.08 -0.91 0.45 115.11 116.58 1xin h GLN 332 Ca -0.00 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1xin h GLN 332 Cb 0.66 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.04 1xin h GLN 332 CO 0.01 0.08 0.20 1.49 -0.95 0.00 0.00 178.83 179.66 1xin h GLU 333 N 0.12 0.47 -0.69 1.46 4.81 -1.21 -0.06 114.58 119.47 1xin h GLU 333 Ca 0.31 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.42 1xin h GLU 333 Cb 0.49 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.75 1xin h GLU 333 CO -0.50 0.37 0.17 0.00 -0.73 0.00 0.00 179.01 178.32 1xin h ALA 334 N 1.07 0.99 -0.66 2.92 0.00 -0.10 -0.54 119.26 122.94 1xin h ALA 334 Ca 0.12 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1xin h ALA 334 Cb 0.03 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1xin h ALA 334 CO -0.02 0.65 0.16 -0.07 0.00 0.00 0.00 179.25 179.98 1xin h LEU 335 N 1.05 0.98 -0.09 0.00 3.38 0.20 -1.05 115.31 119.78 1xin h LEU 335 Ca 0.22 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1xin h LEU 335 Cb 0.36 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1xin h LEU 335 CO 0.00 0.94 0.01 0.00 0.09 0.00 0.00 178.44 179.48 1xin h ALA 336 N 1.18 0.12 -0.19 1.53 0.00 -0.59 -2.39 119.26 118.92 1xin h ALA 336 Ca 0.21 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1xin h ALA 336 Cb 0.35 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1xin h ALA 336 CO 0.00 -0.21 0.02 0.00 0.00 0.00 0.00 179.25 179.06 1xin h ALA 337 N 0.76 1.70 -0.00 0.00 0.00 -0.72 -2.53 119.26 118.46 1xin h ALA 337 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1xin h ALA 337 Cb 0.32 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1xin h ALA 337 CO 0.00 0.23 -0.14 0.43 0.00 0.00 0.00 179.25 179.77 1xin n SER 338 N -4.40 0.40 -1.62 0.00 7.64 -0.43 -4.76 113.62 110.44 1xin n SER 338 Ca -0.00 -0.36 -0.16 0.00 1.01 0.00 0.00 58.87 59.36 1xin n SER 338 Cb 0.16 -0.10 -0.03 0.00 -1.01 0.00 0.00 64.21 63.23 1xin n SER 338 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1xin n LYS 339 N -1.12 -1.22 -0.16 1.43 5.02 -0.92 -4.92 118.16 116.28 1xin n LYS 339 Ca 0.12 0.86 -0.02 0.00 -2.02 0.00 0.00 58.31 57.26 1xin n LYS 339 Cb 0.29 -5.18 0.07 0.00 -0.02 0.00 0.00 35.03 30.19 1xin n LYS 339 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1xin h VAL 340 N 0.00 0.63 0.00 -0.18 2.07 -1.77 -1.32 116.25 115.68 1xin h VAL 340 Ca -0.36 -0.05 -0.05 0.00 0.82 0.00 0.00 66.70 67.06 1xin h VAL 340 Cb 1.20 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 1xin h VAL 340 CO 0.46 0.03 -0.23 0.00 0.02 0.00 0.00 177.57 177.84 1xin h ALA 341 N 1.44 1.03 0.00 1.67 0.00 -1.91 -2.97 119.26 118.53 1xin h ALA 341 Ca 0.26 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1xin h ALA 341 Cb 0.39 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1xin h ALA 341 CO -0.40 0.29 -0.03 1.49 0.00 0.00 0.00 179.25 180.59 1xin h GLU 342 N 0.00 0.00 0.00 0.00 4.81 -1.62 -1.59 114.58 116.18 1xin h GLU 342 Ca -0.00 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 1xin h GLU 342 Cb 0.73 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 1xin h GLU 342 CO 0.03 0.03 -0.22 1.25 -0.73 0.00 0.00 179.01 179.38 1xin h LEU 343 N 0.00 0.00 -0.10 1.64 5.85 -1.55 -2.72 115.31 118.43 1xin h LEU 343 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1xin h LEU 343 Cb 0.12 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.15 1xin h LEU 343 CO 0.00 0.22 0.00 0.29 -0.34 0.00 0.00 178.44 178.61 1xin n LYS 344 N -3.54 0.20 -2.98 1.25 5.02 -0.60 -4.71 118.16 112.80 1xin n LYS 344 Ca -0.01 0.20 -0.40 0.00 -2.02 0.00 0.00 58.31 56.08 1xin n LYS 344 Cb 0.37 -1.75 -0.04 0.00 -0.02 0.00 0.00 35.03 33.59 1xin n LYS 344 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1xin s THR 345 N -3.11 4.98 0.45 -0.18 2.01 -1.03 -5.02 115.64 113.75 1xin s THR 345 Ca 0.10 1.53 -0.22 0.00 0.31 0.00 0.00 61.69 63.41 1xin s THR 345 Cb 0.13 -4.09 -0.10 0.00 0.01 0.00 0.00 72.50 68.45 1xin s THR 345 CO 0.55 0.17 0.81 -2.65 -0.69 0.00 0.00 174.62 172.80 1xin n PRO 346 N 4.31 0.96 -0.15 4.92 -0.02 -1.26 -4.89 135.00 138.86 1xin n PRO 346 Ca 0.01 0.35 -0.05 0.00 -2.02 0.00 0.00 63.50 61.79 1xin n PRO 346 Cb 0.50 -1.85 0.13 0.00 -0.02 0.00 0.00 33.50 32.27 1xin n PRO 346 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1xin h THR 347 N 1.05 1.25 -3.21 3.45 2.02 -1.94 -3.44 112.91 112.08 1xin h THR 347 Ca -0.44 -0.99 -0.57 0.00 0.77 0.00 0.00 66.41 65.18 1xin h THR 347 Cb 1.37 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 68.53 1xin h THR 347 CO 0.53 0.36 -0.28 -0.76 0.37 0.00 0.00 175.52 175.74 1xin s LEU 348 N -9.27 4.25 0.50 2.58 1.43 -1.26 -5.08 118.68 111.83 1xin s LEU 348 Ca -0.10 0.65 -0.17 0.00 -1.03 0.00 0.00 54.13 53.47 1xin s LEU 348 Cb 0.15 -3.38 -0.08 0.00 0.03 0.00 0.00 46.19 42.91 1xin s LEU 348 CO 0.82 0.03 0.98 0.20 0.23 0.00 0.00 176.35 178.60 1xin s ASN 349 N -2.44 6.66 0.15 2.29 0.01 -1.26 -4.95 114.94 115.41 1xin s ASN 349 Ca 0.42 1.57 -0.34 0.00 -0.71 0.00 0.00 52.86 53.80 1xin s ASN 349 Cb -0.12 -2.51 -0.14 0.00 0.41 0.00 0.00 41.25 38.89 1xin s ASN 349 CO 0.24 -0.56 1.56 -2.65 -1.51 0.00 0.00 177.10 174.19 1xin n PRO 350 N -1.46 2.08 -0.99 -0.60 -0.02 -1.26 -1.20 135.00 131.55 1xin n PRO 350 Ca 0.07 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 1xin n PRO 350 Cb 0.54 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1xin n PRO 350 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xin n GLY 351 N 3.36 0.63 3.76 -1.23 0.00 -1.26 -5.02 105.19 105.42 1xin n GLY 351 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1xin n GLY 351 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xin s GLU 352 N -0.11 4.25 0.00 1.61 2.12 -0.34 -5.01 118.70 121.21 1xin s GLU 352 Ca 0.00 0.56 0.00 0.00 0.36 0.00 0.00 54.97 55.89 1xin s GLU 352 Cb 0.00 -3.36 0.00 0.00 0.26 0.00 0.00 34.13 31.03 1xin s GLU 352 CO 0.00 0.34 0.00 0.41 -0.54 0.00 0.00 175.26 175.47 1xin n GLY 353 N 2.68 4.29 0.29 -1.50 0.00 -1.26 -4.79 105.19 104.90 1xin n GLY 353 Ca -0.08 -2.14 -0.01 0.00 0.00 0.00 0.00 46.02 43.79 1xin n GLY 353 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1xin h TYR 354 N 0.97 0.69 -0.58 1.61 -0.00 -1.99 -1.16 116.97 116.51 1xin h TYR 354 Ca 0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 58.73 58.65 1xin h TYR 354 Cb 0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 36.73 36.50 1xin h TYR 354 CO 0.00 0.60 0.28 0.00 -0.00 0.00 0.00 178.16 179.04 1xin h ALA 355 N 1.45 0.74 -0.44 0.10 0.00 -1.99 -0.37 119.26 118.75 1xin h ALA 355 Ca 0.15 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 1xin h ALA 355 Cb 0.27 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1xin h ALA 355 CO -0.00 0.30 -0.29 0.93 0.00 0.00 0.00 179.25 180.19 1xin h GLU 356 N 0.78 0.98 -0.37 0.00 3.07 -1.87 -2.61 114.58 114.56 1xin h GLU 356 Ca 0.20 -0.46 -0.01 0.00 -0.50 0.00 0.00 59.36 58.59 1xin h GLU 356 Cb 0.11 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 27.99 1xin h GLU 356 CO -0.03 1.13 0.20 1.25 -1.40 0.00 0.00 179.01 180.17 1xin h LEU 357 N 0.83 0.47 -2.02 1.33 5.85 -0.97 -1.83 115.31 118.96 1xin h LEU 357 Ca 0.09 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1xin h LEU 357 Cb 0.88 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.79 1xin h LEU 357 CO 0.08 0.43 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.52 1xin h LEU 358 N 0.47 0.00 -0.03 2.25 3.38 -1.04 -0.66 115.31 119.69 1xin h LEU 358 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1xin h LEU 358 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1xin h LEU 358 CO -0.02 0.02 -0.11 0.00 0.09 0.00 0.00 178.44 178.43 1xin n ALA 359 N -2.50 2.63 -2.88 1.53 0.00 -0.72 -4.68 120.51 113.89 1xin n ALA 359 Ca -0.03 -0.17 -0.43 0.00 0.00 0.00 0.00 53.44 52.81 1xin n ALA 359 Cb 0.11 -1.39 -0.04 0.00 0.00 0.00 0.00 19.45 18.13 1xin n ALA 359 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1xin s ASP 360 N -2.89 6.20 0.50 0.00 2.15 -0.25 -4.87 116.67 117.51 1xin s ASP 360 Ca 0.17 -1.09 0.16 0.00 0.43 0.00 0.00 52.55 52.22 1xin s ASP 360 Cb 0.19 -2.41 1.21 0.00 -0.30 0.00 0.00 42.92 41.61 1xin s ASP 360 CO 0.55 -1.40 2.11 0.03 -0.17 0.00 0.00 175.17 176.29 1xin h ARG 361 N 9.50 0.00 0.00 4.34 3.08 -1.84 -0.91 114.38 128.55 1xin h ARG 361 Ca -0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.79 1xin h ARG 361 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.12 1xin h ARG 361 CO 1.17 0.05 0.00 0.66 -1.07 0.00 0.00 179.97 180.78 1xin h SER 362 N 0.00 0.00 -0.04 7.04 4.64 -1.89 0.63 113.55 123.93 1xin h SER 362 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xin h SER 362 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1xin h SER 362 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 1xin n ALA 363 N -1.99 2.60 0.04 5.18 0.00 -0.34 -3.99 120.51 122.00 1xin n ALA 363 Ca 0.02 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1xin n ALA 363 Cb 0.33 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1xin n ALA 363 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1xin n PHE 364 N -0.31 -2.38 -0.28 0.00 7.35 -0.94 -4.89 117.46 116.00 1xin n PHE 364 Ca 0.19 0.26 -0.01 0.00 -0.76 0.00 0.00 57.45 57.12 1xin n PHE 364 Cb 0.22 0.96 0.11 0.00 0.35 0.00 0.00 39.48 41.12 1xin n PHE 364 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1xin h GLU 365 N 0.00 0.90 -0.39 -4.13 3.07 -1.46 -2.51 114.58 110.06 1xin h GLU 365 Ca 0.00 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1xin h GLU 365 Cb 0.00 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 27.71 1xin h GLU 365 CO 0.00 0.59 0.00 -0.25 -1.40 0.00 0.00 179.01 177.95 1xin n ASP 366 N -4.64 3.95 -4.70 1.42 8.00 0.21 -4.99 116.55 115.80 1xin n ASP 366 Ca 0.10 -2.61 -0.42 0.00 0.71 0.00 0.00 54.79 52.57 1xin n ASP 366 Cb 0.12 -0.48 -0.03 0.00 -0.02 0.00 0.00 41.12 40.72 1xin n ASP 366 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1xin s TYR 367 N -2.10 3.41 -1.02 1.24 5.04 -0.95 -4.88 117.35 118.09 1xin s TYR 367 Ca 0.40 1.41 -0.13 0.00 -2.44 0.00 0.00 57.07 56.31 1xin s TYR 367 Cb 0.28 -3.31 0.21 0.00 0.35 0.00 0.00 41.96 39.49 1xin s TYR 367 CO 0.15 -0.81 1.09 0.34 -1.34 0.00 0.00 175.55 174.98 1xin s ASP 368 N 1.21 6.98 0.30 4.32 2.15 -1.26 -4.87 116.67 125.51 1xin s ASP 368 Ca 0.54 -2.92 0.02 0.00 0.43 0.00 0.00 52.55 50.62 1xin s ASP 368 Cb -0.24 -2.29 0.47 0.00 -0.30 0.00 0.00 42.92 40.57 1xin s ASP 368 CO 0.24 -0.61 1.81 0.00 -0.17 0.00 0.00 175.17 176.44 1xin h ALA 369 N 7.50 1.24 -0.68 3.66 0.00 -1.96 -2.69 119.26 126.33 1xin h ALA 369 Ca 0.18 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1xin h ALA 369 Cb 0.95 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 1xin h ALA 369 CO 1.01 0.50 0.42 -0.44 0.00 0.00 0.00 179.25 180.74 1xin h ASP 370 N 0.59 0.80 -0.07 0.00 3.32 -1.97 0.23 116.42 119.32 1xin h ASP 370 Ca 0.12 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1xin h ASP 370 Cb 0.41 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.75 1xin h ASP 370 CO 0.02 0.61 -0.04 0.00 -1.72 0.00 0.00 179.24 178.11 1xin h ALA 371 N 1.22 0.10 -0.43 3.45 0.00 -1.96 -2.93 119.26 118.71 1xin h ALA 371 Ca 0.24 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1xin h ALA 371 Cb -0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1xin h ALA 371 CO -0.05 -0.13 0.19 0.28 0.00 0.00 0.00 179.25 179.54 1xin h VAL 372 N -0.24 1.19 0.00 0.00 2.07 -1.32 -2.42 116.25 115.54 1xin h VAL 372 Ca 0.02 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 66.95 1xin h VAL 372 Cb 0.50 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1xin h VAL 372 CO 0.01 0.22 0.00 0.61 0.02 0.00 0.00 177.57 178.43 1xin n GLY 373 N -0.82 -0.78 0.05 2.17 0.00 0.79 -2.15 105.19 104.46 1xin n GLY 373 Ca 0.01 0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.25 1xin n GLY 373 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xin n ALA 374 N -1.67 3.18 -2.07 4.61 0.00 -0.91 -4.90 120.51 118.75 1xin n ALA 374 Ca -0.00 -0.34 -0.40 0.00 0.00 0.00 0.00 53.44 52.69 1xin n ALA 374 Cb 0.04 -1.05 -0.05 0.00 0.00 0.00 0.00 19.45 18.39 1xin n ALA 374 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1xin s LYS 375 N -3.20 4.70 0.46 0.00 1.02 -0.91 -5.05 119.74 116.75 1xin s LYS 375 Ca 0.04 1.35 -0.14 0.00 0.02 0.00 0.00 55.97 57.25 1xin s LYS 375 Cb 0.14 -3.32 -0.07 0.00 -0.52 0.00 0.00 37.83 34.05 1xin s LYS 375 CO 0.77 0.39 0.88 0.20 -0.92 0.00 0.00 175.35 176.67 1xin s GLY 376 N -0.60 2.04 0.03 -3.33 0.00 -1.26 -5.00 107.32 99.19 1xin s GLY 376 Ca 0.42 0.02 0.23 0.00 0.00 0.00 0.00 44.72 45.38 1xin s GLY 376 CO 0.29 0.25 1.04 0.69 0.00 0.00 0.00 173.10 175.37 1xin n PHE 377 N -1.37 0.16 -2.94 1.90 3.72 -1.26 -4.99 117.46 112.68 1xin n PHE 377 Ca 0.05 0.05 -0.21 0.00 -0.05 0.00 0.00 57.45 57.29 1xin n PHE 377 Cb 0.54 -0.33 0.03 0.00 -0.94 0.00 0.00 39.48 38.78 1xin n PHE 377 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xin n GLY 378 N 1.41 -0.44 0.17 1.37 0.00 -1.26 -3.57 105.19 102.87 1xin n GLY 378 Ca 0.03 0.06 -0.07 0.00 0.00 0.00 0.00 46.02 46.04 1xin n GLY 378 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1xin h PHE 379 N -1.25 0.40 -0.11 1.61 0.04 -1.95 -2.99 116.94 112.70 1xin h PHE 379 Ca -0.50 -0.16 -0.01 0.00 2.80 0.00 0.00 57.97 60.10 1xin h PHE 379 Cb 1.34 -0.07 -0.00 0.00 2.20 0.00 0.00 35.95 39.42 1xin h PHE 379 CO 0.49 0.86 0.04 0.28 -0.60 0.00 0.00 178.31 179.38 1xin h VAL 380 N 0.22 1.16 -0.77 -0.55 2.07 -1.99 -0.39 116.25 116.01 1xin h VAL 380 Ca -0.01 -0.49 0.04 0.00 0.82 0.00 0.00 66.70 67.05 1xin h VAL 380 Cb 1.17 1.28 -0.05 0.00 -1.52 0.00 0.00 31.29 32.18 1xin h VAL 380 CO 0.10 0.15 0.48 0.50 0.02 0.00 0.00 177.57 178.82 1xin h LYS 381 N 0.01 0.90 -0.47 1.57 3.64 -1.97 0.23 116.57 120.47 1xin h LYS 381 Ca 0.04 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 1xin h LYS 381 Cb 0.19 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 1xin h LYS 381 CO -0.00 0.59 0.17 1.25 -2.27 0.00 0.00 179.45 179.19 1xin h LEU 382 N 0.93 0.66 -0.54 5.20 5.85 -1.36 -1.81 115.31 124.24 1xin h LEU 382 Ca 0.31 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1xin h LEU 382 Cb 0.05 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1xin h LEU 382 CO -0.13 0.67 0.30 -1.13 -0.34 0.00 0.00 178.44 177.81 1xin h ASN 383 N 0.62 0.67 -0.80 1.25 -1.24 -0.19 -2.22 115.58 113.66 1xin h ASN 383 Ca 0.15 -0.09 0.01 0.00 0.71 0.00 0.00 56.30 57.08 1xin h ASN 383 Cb 0.22 -0.17 -0.04 0.00 0.73 0.00 0.00 38.32 39.06 1xin h ASN 383 CO -0.01 0.57 0.53 -0.61 -1.29 0.00 0.00 177.43 176.62 1xin h GLN 384 N 0.72 1.07 -0.55 6.67 5.75 -0.29 -1.56 115.11 126.91 1xin h GLN 384 Ca 0.19 -0.07 -0.06 0.00 -0.15 0.00 0.00 58.65 58.56 1xin h GLN 384 Cb 0.04 -0.24 -0.02 0.00 1.07 0.00 0.00 27.48 28.33 1xin h GLN 384 CO -0.03 0.71 0.09 -0.07 -2.65 0.00 0.00 178.83 176.88 1xin h LEU 385 N 1.09 0.83 0.12 -2.39 3.38 -1.07 -1.55 115.31 115.72 1xin h LEU 385 Ca 0.29 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1xin h LEU 385 Cb -0.11 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.42 1xin h LEU 385 CO -0.06 0.84 -0.06 0.00 0.09 0.00 0.00 178.44 179.25 1xin h ALA 386 N 1.26 -0.16 -0.85 1.53 0.00 -0.90 -1.97 119.26 118.16 1xin h ALA 386 Ca 0.17 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1xin h ALA 386 Cb 0.37 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1xin h ALA 386 CO 0.01 -0.54 0.49 0.82 0.00 0.00 0.00 179.25 180.02 1xin h ILE 387 N -0.27 1.24 -0.11 0.00 2.04 -1.13 -0.79 117.51 118.50 1xin h ILE 387 Ca -0.02 -0.57 -0.06 0.00 1.00 0.00 0.00 64.86 65.21 1xin h ILE 387 Cb 0.22 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.36 1xin h ILE 387 CO 0.03 0.26 -0.20 -0.33 0.00 0.00 0.00 178.15 177.91 1xin h GLU 388 N 1.18 0.19 -0.23 2.37 5.08 -1.15 -0.29 114.58 121.73 1xin h GLU 388 Ca 0.30 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.53 1xin h GLU 388 Cb -0.01 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 1xin h GLU 388 CO -0.05 0.39 -0.16 0.45 -1.00 0.00 0.00 179.01 178.63 1xin h HIS 389 N 0.17 0.60 -0.86 4.33 3.86 -0.60 0.14 115.15 122.79 1xin h HIS 389 Ca 0.03 -0.16 0.05 0.00 -1.16 0.00 0.00 60.37 59.13 1xin h HIS 389 Cb 0.46 -0.13 -0.06 0.00 1.06 0.00 0.00 27.41 28.74 1xin h HIS 389 CO 0.01 0.82 0.54 1.25 0.86 0.00 0.00 177.93 181.41 1xin h LEU 390 N 0.21 0.88 -0.12 2.43 5.85 -0.15 -1.77 115.31 122.64 1xin h LEU 390 Ca 0.04 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1xin h LEU 390 Cb 0.69 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.54 1xin h LEU 390 CO 0.04 0.58 0.00 0.18 -0.34 0.00 0.00 178.44 178.90 1xin n LEU 391 N -4.59 0.19 -1.87 2.25 4.77 -0.22 -4.88 117.00 112.65 1xin n LEU 391 Ca 0.12 -0.07 -0.16 0.00 -0.03 0.00 0.00 56.01 55.86 1xin n LEU 391 Cb 0.14 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.21 1xin n LEU 391 CO 0.32 0.04 -0.21 0.61 -1.33 0.00 0.00 177.39 176.82 1xin n GLY 392 N 0.89 -0.29 0.18 -0.72 0.00 -0.67 -4.88 105.19 99.71 1xin n GLY 392 Ca 0.17 -0.19 0.14 0.00 0.00 0.00 0.00 46.02 46.14 1xin n GLY 392 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xin n ALA 393 N -1.76 2.82 -1.45 4.61 0.00 0.46 -5.02 120.51 120.16 1xin n ALA 393 Ca -0.20 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1xin n ALA 393 Cb 0.65 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.82 1xin n ALA 393 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39