#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xle s GLN 3 N 0.00 0.90 0.44 7.34 -1.52 -1.26 -4.92 119.66 120.65 1xle s GLN 3 Ca 0.00 -0.04 -0.24 0.00 -1.95 0.00 0.00 55.36 53.13 1xle s GLN 3 Cb 0.00 -1.09 -0.08 0.00 -0.22 0.00 0.00 33.01 31.62 1xle s GLN 3 CO 0.00 -0.23 1.22 -1.25 -0.25 0.00 0.00 175.29 174.78 1xle s PRO 4 N 1.61 3.82 0.08 2.91 0.04 -1.26 -5.04 135.00 137.16 1xle s PRO 4 Ca 0.00 1.94 0.02 0.00 0.04 0.00 0.00 61.00 63.00 1xle s PRO 4 Cb -0.13 -2.55 -0.04 0.00 0.04 0.00 0.00 34.50 31.82 1xle s PRO 4 CO -0.04 -0.54 -0.07 0.95 0.04 0.00 0.00 177.00 177.33 1xle s THR 5 N -1.41 0.67 0.57 1.26 -4.23 -1.26 -4.62 115.64 106.62 1xle s THR 5 Ca 0.61 -1.66 0.39 0.00 -1.18 0.00 0.00 61.69 59.86 1xle s THR 5 Cb -0.33 -1.34 0.58 0.00 1.34 0.00 0.00 72.50 72.75 1xle s THR 5 CO 0.41 -0.70 1.61 -0.65 -0.54 0.00 0.00 174.62 174.75 1xle h PRO 6 N 3.47 0.00 0.00 3.99 0.11 -1.79 0.20 132.00 137.98 1xle h PRO 6 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1xle h PRO 6 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1xle h PRO 6 CO 0.57 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.36 1xle n ALA 7 N -2.68 1.57 0.14 -0.75 0.00 -1.26 -2.84 120.51 114.70 1xle n ALA 7 Ca 0.31 0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.85 1xle n ALA 7 Cb 1.57 -1.28 0.05 0.00 0.00 0.00 0.00 19.45 19.78 1xle n ALA 7 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1xle h ASP 8 N 0.00 0.00 -5.23 0.00 3.32 -1.32 -3.48 116.42 109.71 1xle h ASP 8 Ca 0.00 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.73 1xle h ASP 8 Cb 0.26 0.00 0.14 0.00 0.22 0.00 0.00 39.33 39.95 1xle h ASP 8 CO 0.00 0.22 -0.64 1.41 -1.72 0.00 0.00 179.24 178.52 1xle n HIS 9 N -2.99 -2.23 -2.94 4.55 8.25 -1.13 -4.67 115.22 114.06 1xle n HIS 9 Ca 0.00 0.86 -0.41 0.00 -0.26 0.00 0.00 57.72 57.92 1xle n HIS 9 Cb 0.64 -4.63 -0.04 0.00 1.12 0.00 0.00 29.99 27.08 1xle n HIS 9 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1xle s PHE 10 N -3.30 3.54 0.14 4.41 0.08 -1.26 -0.79 117.98 120.80 1xle s PHE 10 Ca 0.26 1.32 0.09 0.00 0.12 0.00 0.00 56.93 58.72 1xle s PHE 10 Cb -0.11 -2.93 -0.04 0.00 -0.57 0.00 0.00 43.02 39.37 1xle s PHE 10 CO 0.64 -0.04 -0.20 0.95 -0.10 0.00 0.00 175.22 176.47 1xle s THR 11 N 1.30 1.85 0.01 0.64 -4.23 -0.79 -0.86 115.64 113.57 1xle s THR 11 Ca 0.40 -1.78 -0.01 0.00 -1.18 0.00 0.00 61.69 59.13 1xle s THR 11 Cb -0.18 -1.77 -0.01 0.00 1.34 0.00 0.00 72.50 71.88 1xle s THR 11 CO 0.18 -0.18 -0.01 -0.36 -0.54 0.00 0.00 174.62 173.71 1xle s PHE 12 N -1.62 0.20 0.32 3.99 0.40 -0.98 -1.34 117.98 118.94 1xle s PHE 12 Ca 0.12 -0.41 -0.03 0.00 -0.60 0.00 0.00 56.93 56.01 1xle s PHE 12 Cb -0.08 -0.15 -0.04 0.00 0.51 0.00 0.00 43.02 43.26 1xle s PHE 12 CO 0.06 -0.18 0.56 0.20 0.70 0.00 0.00 175.22 176.56 1xle s GLY 13 N -1.26 1.68 0.27 4.36 0.00 -1.25 -1.01 107.32 110.11 1xle s GLY 13 Ca -0.14 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 43.92 1xle s GLY 13 CO -0.01 -0.57 1.73 -2.00 0.00 0.00 0.00 173.10 172.25 1xle h LEU 14 N 1.32 0.61 -1.90 0.66 5.85 -1.05 -2.15 115.31 118.66 1xle h LEU 14 Ca -0.48 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.05 1xle h LEU 14 Cb 1.20 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 1xle h LEU 14 CO 0.65 0.78 -0.02 4.11 -0.34 0.00 0.00 178.44 183.61 1xle h TRP 15 N 0.56 0.00 0.07 1.25 0.09 -1.91 -0.11 115.95 115.90 1xle h TRP 15 Ca 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 58.89 59.07 1xle h TRP 15 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.82 1xle h TRP 15 CO 0.02 0.02 -0.04 1.79 0.09 0.00 0.00 178.44 180.33 1xle h THR 16 N 0.00 0.00 -0.04 0.12 1.35 -1.59 -1.80 112.91 110.95 1xle h THR 16 Ca -0.00 -0.14 -0.11 0.00 -0.55 0.00 0.00 66.41 65.61 1xle h THR 16 Cb 0.37 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 66.78 1xle h THR 16 CO 0.00 0.00 -0.46 -0.37 -0.25 0.00 0.00 175.52 174.44 1xle h VAL 17 N -0.24 1.33 0.00 6.82 -1.51 -1.70 -2.45 116.25 118.51 1xle h VAL 17 Ca -0.01 -1.62 0.00 0.00 -1.23 0.00 0.00 66.70 63.84 1xle h VAL 17 Cb 0.08 1.82 0.00 0.00 -2.13 0.00 0.00 31.29 31.06 1xle h VAL 17 CO 0.02 0.47 0.00 0.61 -1.23 0.00 0.00 177.57 177.44 1xle n GLY 18 N -0.14 -0.98 3.63 5.19 0.00 -0.05 -4.82 105.19 108.00 1xle n GLY 18 Ca -0.02 -0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 1xle n GLY 18 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1xle s TRP 19 N -2.18 1.42 -0.64 1.61 -0.00 -0.67 -4.66 118.94 113.81 1xle s TRP 19 Ca 0.37 0.21 0.25 0.00 -0.00 0.00 0.00 56.10 56.94 1xle s TRP 19 Cb 0.19 -4.05 0.86 0.00 -0.00 0.00 0.00 33.47 30.47 1xle s TRP 19 CO 0.36 -4.30 1.76 2.41 -0.00 0.00 0.00 176.95 177.17 1xle n THR 20 N 6.74 0.67 0.00 5.86 -1.04 -1.26 -4.87 114.28 120.38 1xle n THR 20 Ca 0.24 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 1xle n THR 20 Cb 0.44 -0.77 0.00 0.00 -1.82 0.00 0.00 70.33 68.18 1xle n THR 20 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xle n GLY 21 N 0.89 0.74 3.68 3.41 0.00 -1.26 -0.24 105.19 112.41 1xle n GLY 21 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1xle n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xle s ALA 22 N -2.02 3.65 0.06 4.61 0.00 -1.26 -4.43 121.76 122.38 1xle s ALA 22 Ca 0.00 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.10 1xle s ALA 22 Cb 0.00 -3.72 -0.00 0.00 0.00 0.00 0.00 23.12 19.40 1xle s ALA 22 CO 0.00 -1.23 0.01 -0.40 0.00 0.00 0.00 175.76 174.14 1xle n ASP 23 N 6.24 1.38 0.21 0.00 5.68 -0.84 -4.94 116.55 124.28 1xle n ASP 23 Ca 0.17 -1.32 0.06 0.00 -0.50 0.00 0.00 54.79 53.20 1xle n ASP 23 Cb 0.41 0.12 0.44 0.00 -1.14 0.00 0.00 41.12 40.96 1xle n ASP 23 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 1xle h PRO 24 N 0.00 0.00 -0.36 0.11 0.11 -2.01 -3.20 132.00 126.65 1xle h PRO 24 Ca -0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1xle h PRO 24 Cb 0.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.29 1xle h PRO 24 CO 0.08 0.31 0.00 1.19 -0.21 0.00 0.00 178.00 179.37 1xle n PHE 25 N -3.77 0.47 -3.81 0.65 3.72 -1.26 -5.05 117.46 108.40 1xle n PHE 25 Ca -0.01 -0.32 -0.04 0.00 -0.05 0.00 0.00 57.45 57.03 1xle n PHE 25 Cb 0.40 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.93 1xle n PHE 25 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1xle s GLY 26 N -1.16 -0.05 0.57 1.37 0.00 -1.21 -5.18 107.32 101.66 1xle s GLY 26 Ca 0.30 -0.13 0.01 0.00 0.00 0.00 0.00 44.72 44.91 1xle s GLY 26 CO 0.24 0.90 0.80 -1.34 0.00 0.00 0.00 173.10 173.70 1xle s VAL 27 N -2.77 2.62 0.32 1.40 -7.23 -1.26 -1.99 120.40 111.47 1xle s VAL 27 Ca 0.16 -0.65 -0.26 0.00 -1.81 0.00 0.00 61.98 59.42 1xle s VAL 27 Cb -0.02 -2.97 -0.14 0.00 0.56 0.00 0.00 36.38 33.81 1xle s VAL 27 CO 0.04 0.00 0.80 0.00 -0.31 0.00 0.00 175.10 175.63 1xle n ALA 28 N -2.39 -1.04 0.43 1.32 0.00 -1.26 -4.15 120.51 113.41 1xle n ALA 28 Ca 0.08 0.33 0.04 0.00 0.00 0.00 0.00 53.44 53.90 1xle n ALA 28 Cb 0.60 -1.88 -0.05 0.00 0.00 0.00 0.00 19.45 18.11 1xle n ALA 28 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1xle n THR 29 N -0.15 0.00 -4.28 0.00 -2.24 0.66 -4.82 114.28 103.45 1xle n THR 29 Ca 0.12 -0.28 -0.23 0.00 -2.27 0.00 0.00 64.05 61.38 1xle n THR 29 Cb 0.33 0.99 -0.12 0.00 -2.10 0.00 0.00 70.33 69.43 1xle n THR 29 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1xle s ARG 30 N -1.87 1.13 0.78 -0.78 0.52 -0.98 -5.03 118.95 112.72 1xle s ARG 30 Ca 0.03 -1.19 -0.11 0.00 -0.52 0.00 0.00 55.73 53.94 1xle s ARG 30 Cb 0.07 -1.33 0.06 0.00 0.52 0.00 0.00 34.95 34.27 1xle s ARG 30 CO 0.38 0.30 1.08 -1.59 0.02 0.00 0.00 175.30 175.49 1xle s LYS 31 N -2.07 2.23 0.59 3.54 0.00 -1.26 -4.78 119.74 117.99 1xle s LYS 31 Ca 0.07 0.96 -0.20 0.00 0.00 0.00 0.00 55.97 56.81 1xle s LYS 31 Cb -0.09 -1.91 -0.03 0.00 0.00 0.00 0.00 37.83 35.80 1xle s LYS 31 CO 0.04 -1.61 1.30 -0.80 0.00 0.00 0.00 175.35 174.29 1xle s ASN 32 N -3.59 5.04 -0.11 0.03 -0.87 -1.26 -4.88 114.94 109.30 1xle s ASN 32 Ca 0.61 2.63 -0.16 0.00 -1.57 0.00 0.00 52.86 54.37 1xle s ASN 32 Cb -0.16 -2.62 -0.05 0.00 -0.02 0.00 0.00 41.25 38.40 1xle s ASN 32 CO 0.56 -1.71 0.39 -0.22 -2.57 0.00 0.00 177.10 173.54 1xle s LEU 33 N -3.92 4.31 0.08 0.60 2.96 -1.26 -5.06 118.68 116.39 1xle s LEU 33 Ca 0.76 0.72 -0.30 0.00 -0.22 0.00 0.00 54.13 55.09 1xle s LEU 33 Cb -0.37 -2.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.73 1xle s LEU 33 CO 0.41 0.11 1.03 -0.62 -1.32 0.00 0.00 176.35 175.97 1xle s ASP 34 N 0.19 7.35 0.25 3.68 -1.08 -1.26 -4.94 116.67 120.86 1xle s ASP 34 Ca 0.22 1.84 -0.03 0.00 -0.52 0.00 0.00 52.55 54.06 1xle s ASP 34 Cb -0.15 -2.58 0.43 0.00 -1.46 0.00 0.00 42.92 39.16 1xle s ASP 34 CO 0.08 -0.22 1.81 -0.65 0.52 0.00 0.00 175.17 176.72 1xle h PRO 35 N 6.06 0.79 -0.32 4.34 0.11 -1.97 -2.31 132.00 138.71 1xle h PRO 35 Ca -0.42 -0.05 0.07 0.00 0.11 0.00 0.00 66.00 65.71 1xle h PRO 35 Cb 1.21 -0.18 -0.07 0.00 0.11 0.00 0.00 31.00 32.08 1xle h PRO 35 CO 0.74 0.52 -0.13 0.28 -0.21 0.00 0.00 178.00 179.21 1xle h VAL 36 N 0.82 0.57 -0.09 3.15 2.07 -1.92 -1.44 116.25 119.41 1xle h VAL 36 Ca 0.42 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.90 1xle h VAL 36 Cb 0.40 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1xle h VAL 36 CO -0.26 0.00 -0.14 -0.08 0.02 0.00 0.00 177.57 177.12 1xle h GLU 37 N -0.08 0.13 -0.13 1.57 4.81 -1.84 -2.81 114.58 116.24 1xle h GLU 37 Ca 0.16 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.34 1xle h GLU 37 Cb 0.32 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 1xle h GLU 37 CO -0.37 0.27 -0.01 0.00 -0.73 0.00 0.00 179.01 178.17 1xle h ALA 38 N 1.74 0.18 -0.17 2.92 0.00 -0.84 -2.32 119.26 120.77 1xle h ALA 38 Ca 0.03 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.76 1xle h ALA 38 Cb 0.32 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1xle h ALA 38 CO 0.02 -0.10 -0.05 0.28 0.00 0.00 0.00 179.25 179.40 1xle h VAL 39 N -0.04 0.82 0.04 0.00 2.07 -1.32 -2.77 116.25 115.05 1xle h VAL 39 Ca 0.04 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.55 1xle h VAL 39 Cb 0.41 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1xle h VAL 39 CO 0.01 0.00 -0.02 0.45 0.02 0.00 0.00 177.57 178.03 1xle h HIS 40 N -0.01 -0.05 -0.73 1.57 -0.00 -1.52 -2.83 115.15 111.58 1xle h HIS 40 Ca 0.08 -0.00 0.01 0.00 -0.00 0.00 0.00 60.37 60.47 1xle h HIS 40 Cb 0.13 0.02 -0.04 0.00 -0.00 0.00 0.00 27.41 27.52 1xle h HIS 40 CO -0.20 0.24 0.48 -0.22 -0.00 0.00 0.00 177.93 178.23 1xle h LYS 41 N -0.34 0.94 0.00 2.45 1.63 -1.42 -2.53 116.57 117.30 1xle h LYS 41 Ca -0.01 -0.06 -0.16 0.00 -0.85 0.00 0.00 60.65 59.57 1xle h LYS 41 Cb 0.31 -0.21 -0.02 0.00 -0.60 0.00 0.00 32.23 31.71 1xle h LYS 41 CO 0.01 0.62 -0.78 -0.07 -3.45 0.00 0.00 179.45 175.78 1xle h LEU 42 N 0.97 0.00 -0.31 5.20 3.38 -1.58 -2.80 115.31 120.17 1xle h LEU 42 Ca 0.27 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.23 1xle h LEU 42 Cb -0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1xle h LEU 42 CO -0.07 0.78 0.12 0.00 0.09 0.00 0.00 178.44 179.36 1xle h ALA 43 N 1.22 0.40 0.00 1.53 0.00 -1.27 -0.63 119.26 120.51 1xle h ALA 43 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1xle h ALA 43 Cb 1.43 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1xle h ALA 43 CO 0.10 0.00 0.00 1.05 0.00 0.00 0.00 179.25 180.40 1xle h GLU 44 N 0.35 0.00 0.04 0.00 4.11 -1.40 -3.19 114.58 114.49 1xle h GLU 44 Ca 0.10 0.00 -0.23 0.00 0.07 0.00 0.00 59.36 59.30 1xle h GLU 44 Cb 0.19 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 1xle h GLU 44 CO -0.01 0.00 -1.02 -0.07 0.07 0.00 0.00 179.01 177.99 1xle h LEU 45 N 0.00 0.41 0.00 3.06 3.38 -1.22 -3.47 115.31 117.47 1xle h LEU 45 Ca 0.00 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1xle h LEU 45 Cb 0.75 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1xle h LEU 45 CO 0.00 1.20 0.00 0.61 0.09 0.00 0.00 178.44 180.34 1xle n GLY 46 N 1.11 0.71 3.57 0.83 0.00 -0.89 -4.70 105.19 105.82 1xle n GLY 46 Ca -0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 1xle n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xle n ALA 47 N 0.00 -0.24 -0.08 4.61 0.00 -0.29 -3.19 120.51 121.31 1xle n ALA 47 Ca 0.00 0.12 -0.13 0.00 0.00 0.00 0.00 53.44 53.43 1xle n ALA 47 Cb 0.00 -2.01 -0.07 0.00 0.00 0.00 0.00 19.45 17.37 1xle n ALA 47 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1xle h TYR 48 N 0.95 0.00 -3.45 0.00 3.20 -1.27 -3.42 116.97 112.99 1xle h TYR 48 Ca -0.45 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.30 1xle h TYR 48 Cb 1.36 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 39.60 1xle h TYR 48 CO 0.39 0.75 0.09 0.20 -1.64 0.00 0.00 178.16 177.95 1xle s GLY 49 N -4.45 0.81 0.17 1.82 0.00 -0.99 -3.07 107.32 101.62 1xle s GLY 49 Ca -0.20 -1.05 0.11 0.00 0.00 0.00 0.00 44.72 43.58 1xle s GLY 49 CO 0.41 -0.58 -0.21 -1.50 0.00 0.00 0.00 173.10 171.21 1xle s ILE 50 N -2.63 2.55 0.10 0.90 2.07 -0.93 -2.33 121.20 120.92 1xle s ILE 50 Ca 0.21 -1.86 0.03 0.00 -1.41 0.00 0.00 60.65 57.62 1xle s ILE 50 Cb -0.03 -2.21 -0.04 0.00 0.13 0.00 0.00 42.46 40.31 1xle s ILE 50 CO 0.15 -0.06 -0.08 0.42 -1.91 0.00 0.00 174.94 173.46 1xle s THR 51 N -1.52 0.85 0.22 4.00 -4.23 -0.18 -4.01 115.64 110.77 1xle s THR 51 Ca 0.20 -1.82 -0.18 0.00 -1.18 0.00 0.00 61.69 58.71 1xle s THR 51 Cb -0.09 -1.55 0.03 0.00 1.34 0.00 0.00 72.50 72.23 1xle s THR 51 CO 0.10 -0.72 0.57 0.72 -0.54 0.00 0.00 174.62 174.75 1xle s PHE 52 N -3.06 -0.12 -0.10 3.99 -0.71 -1.25 -0.29 117.98 116.45 1xle s PHE 52 Ca 0.09 -0.25 -0.06 0.00 -1.04 0.00 0.00 56.93 55.68 1xle s PHE 52 Cb 0.01 0.46 -0.04 0.00 -1.21 0.00 0.00 43.02 42.24 1xle s PHE 52 CO -0.02 -1.00 0.14 -1.01 -1.34 0.00 0.00 175.22 171.99 1xle s HIS 53 N -3.89 3.56 0.14 3.49 3.76 -1.25 -0.94 115.29 120.15 1xle s HIS 53 Ca 0.10 0.47 -0.32 0.00 -0.15 0.00 0.00 55.06 55.17 1xle s HIS 53 Cb -0.02 -1.91 -0.09 0.00 1.11 0.00 0.00 32.58 31.67 1xle s HIS 53 CO 0.00 0.70 1.54 0.38 -0.85 0.00 0.00 174.74 176.51 1xle h ASP 54 N 4.78 -1.99 0.03 1.40 2.03 -1.63 0.08 116.42 121.12 1xle h ASP 54 Ca -0.54 0.28 0.00 0.00 -0.73 0.00 0.00 57.03 56.05 1xle h ASP 54 Cb 1.22 0.85 0.00 0.00 -0.83 0.00 0.00 39.33 40.57 1xle h ASP 54 CO 0.60 -0.32 0.00 0.59 -1.03 0.00 0.00 179.24 179.08 1xle n ASN 55 N -5.29 0.00 0.01 4.15 5.03 -1.25 -1.20 115.26 116.72 1xle n ASN 55 Ca -0.01 -0.49 -0.17 0.00 0.87 0.00 0.00 54.58 54.78 1xle n ASN 55 Cb 0.30 -0.03 -0.07 0.00 -1.02 0.00 0.00 39.78 38.96 1xle n ASN 55 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 1xle h ASP 56 N 0.00 0.86 0.00 6.41 3.32 -1.38 -3.38 116.42 122.25 1xle h ASP 56 Ca 0.00 -0.62 -0.09 0.00 0.02 0.00 0.00 57.03 56.34 1xle h ASP 56 Cb 0.01 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.29 1xle h ASP 56 CO 0.00 1.41 -1.01 -0.11 -1.72 0.00 0.00 179.24 177.82 1xle n LEU 57 N -3.88 1.87 -4.47 1.55 7.94 -1.08 -4.91 117.00 114.03 1xle n LEU 57 Ca -0.08 0.48 -0.39 0.00 -1.11 0.00 0.00 56.01 54.90 1xle n LEU 57 Cb 0.80 -0.84 -0.11 0.00 0.53 0.00 0.00 43.42 43.79 1xle n LEU 57 CO 0.53 -0.17 -0.18 -0.63 -1.11 0.00 0.00 177.39 175.83 1xle s ILE 58 N -2.49 4.83 0.64 1.96 1.01 -0.34 -5.02 121.20 121.79 1xle s ILE 58 Ca -0.24 -0.38 -0.17 0.00 0.00 0.00 0.00 60.65 59.86 1xle s ILE 58 Cb 0.05 -3.48 -0.06 0.00 0.01 0.00 0.00 42.46 38.97 1xle s ILE 58 CO 0.37 0.02 0.59 -2.65 0.00 0.00 0.00 174.94 173.28 1xle n PRO 59 N 5.02 0.48 -0.20 2.79 -0.02 -1.26 -3.75 135.00 138.07 1xle n PRO 59 Ca -0.13 0.20 -0.04 0.00 -2.02 0.00 0.00 63.50 61.50 1xle n PRO 59 Cb 0.49 -1.83 0.06 0.00 -0.02 0.00 0.00 33.50 32.20 1xle n PRO 59 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1xle h PHE 60 N 0.02 0.64 -0.42 6.00 3.04 -1.96 -2.70 116.94 121.56 1xle h PHE 60 Ca -0.46 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.51 1xle h PHE 60 Cb 1.37 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 39.68 1xle h PHE 60 CO 0.33 0.36 0.00 -0.40 -2.02 0.00 0.00 178.31 176.58 1xle n ASP 61 N -4.77 2.94 -4.69 0.41 5.68 -1.26 -5.02 116.55 109.84 1xle n ASP 61 Ca 0.05 -2.19 -0.44 0.00 -0.50 0.00 0.00 54.79 51.71 1xle n ASP 61 Cb 0.09 -0.41 -0.03 0.00 -1.14 0.00 0.00 41.12 39.64 1xle n ASP 61 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1xle n ALA 62 N 0.69 1.50 -1.78 2.12 0.00 -1.02 -5.02 120.51 117.00 1xle n ALA 62 Ca 0.16 0.41 -0.29 0.00 0.00 0.00 0.00 53.44 53.72 1xle n ALA 62 Cb 0.54 -2.33 0.11 0.00 0.00 0.00 0.00 19.45 17.76 1xle n ALA 62 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1xle s THR 63 N 0.17 1.99 0.20 0.00 -4.23 -1.26 -4.80 115.64 107.72 1xle s THR 63 Ca 0.69 0.00 -0.10 0.00 -1.18 0.00 0.00 61.69 61.11 1xle s THR 63 Cb -0.62 -2.92 0.13 0.00 1.34 0.00 0.00 72.50 70.43 1xle s THR 63 CO 0.47 0.00 1.79 1.05 -0.54 0.00 0.00 174.62 177.39 1xle h GLU 64 N -1.26 1.04 0.77 3.99 9.09 -1.98 -0.83 114.58 125.40 1xle h GLU 64 Ca -0.47 -0.15 -0.04 0.00 0.05 0.00 0.00 59.36 58.75 1xle h GLU 64 Cb 1.32 -0.19 0.01 0.00 -1.65 0.00 0.00 28.75 28.24 1xle h GLU 64 CO 0.62 0.81 -0.37 0.00 0.05 0.00 0.00 179.01 180.13 1xle h ALA 65 N 1.17 -1.26 -0.65 1.06 0.00 -1.99 -0.53 119.26 117.06 1xle h ALA 65 Ca 0.25 -0.23 0.12 0.00 0.00 0.00 0.00 54.91 55.05 1xle h ALA 65 Cb 0.11 0.40 -0.12 0.00 0.00 0.00 0.00 17.79 18.18 1xle h ALA 65 CO -0.03 -1.19 -0.31 0.93 0.00 0.00 0.00 179.25 178.65 1xle h GLU 66 N -1.04 -0.12 -0.57 0.00 5.08 -1.88 -0.87 114.58 115.18 1xle h GLU 66 Ca -0.11 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.35 1xle h GLU 66 Cb 0.79 0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.99 1xle h GLU 66 CO 0.17 -0.08 0.18 -0.09 -1.00 0.00 0.00 179.01 178.20 1xle h ARG 67 N -0.12 0.34 -0.59 2.33 2.43 -1.05 -1.32 114.38 116.39 1xle h ARG 67 Ca 0.26 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.39 1xle h ARG 67 Cb 0.55 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 30.00 1xle h ARG 67 CO -0.72 0.22 0.28 1.49 -1.51 0.00 0.00 179.97 179.74 1xle h GLU 68 N 0.35 0.86 0.60 0.20 4.57 0.24 -1.36 114.58 120.04 1xle h GLU 68 Ca 0.29 -0.13 -0.03 0.00 -1.18 0.00 0.00 59.36 58.31 1xle h GLU 68 Cb 0.37 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 1xle h GLU 68 CO -0.31 0.70 -0.32 -0.22 -1.18 0.00 0.00 179.01 177.67 1xle h LYS 69 N 0.81 -0.82 -0.45 1.92 3.11 -0.51 -0.83 116.57 119.79 1xle h LYS 69 Ca 0.20 0.06 0.08 0.00 -2.81 0.00 0.00 60.65 58.18 1xle h LYS 69 Cb 0.13 0.19 -0.07 0.00 -1.00 0.00 0.00 32.23 31.48 1xle h LYS 69 CO -0.02 -0.55 0.05 0.82 -2.81 0.00 0.00 179.45 176.94 1xle h ILE 70 N -0.86 0.71 -0.72 2.00 2.04 -1.27 -0.16 117.51 119.25 1xle h ILE 70 Ca -0.08 -0.06 -0.03 0.00 1.00 0.00 0.00 64.86 65.69 1xle h ILE 70 Cb 0.67 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 1xle h ILE 70 CO 0.11 0.03 0.34 -0.07 0.00 0.00 0.00 178.15 178.56 1xle h LEU 71 N 0.18 0.94 -0.82 1.44 3.38 -1.09 -1.91 115.31 117.42 1xle h LEU 71 Ca 0.22 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.96 1xle h LEU 71 Cb 0.30 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1xle h LEU 71 CO -0.32 0.80 -0.46 1.23 0.09 0.00 0.00 178.44 179.77 1xle h GLY 72 N 1.08 0.32 0.83 0.83 0.00 0.05 -1.36 103.07 104.81 1xle h GLY 72 Ca 0.25 -0.33 -0.10 0.00 0.00 0.00 0.00 47.33 47.15 1xle h GLY 72 CO -0.03 0.30 -0.30 -0.55 0.00 0.00 0.00 176.54 175.95 1xle h ASP 73 N 0.24 0.54 -0.18 0.19 3.32 -0.98 -2.26 116.42 117.30 1xle h ASP 73 Ca 0.02 -0.55 -0.16 0.00 0.02 0.00 0.00 57.03 56.35 1xle h ASP 73 Cb 0.91 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.31 1xle h ASP 73 CO 0.07 0.99 -0.53 0.15 -1.72 0.00 0.00 179.24 178.21 1xle h PHE 74 N 0.11 0.88 0.00 4.55 3.57 -1.22 -2.66 116.94 122.18 1xle h PHE 74 Ca 0.01 -0.35 -0.07 0.00 3.53 0.00 0.00 57.97 61.09 1xle h PHE 74 Cb 0.89 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 1xle h PHE 74 CO 0.10 1.14 -0.31 -0.91 -2.23 0.00 0.00 178.31 176.09 1xle h ASN 75 N 0.37 0.00 0.70 0.41 -0.26 -1.35 -1.86 115.58 113.59 1xle h ASN 75 Ca -0.01 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.69 1xle h ASN 75 Cb 1.15 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 38.41 1xle h ASN 75 CO 0.11 0.31 -0.34 -0.61 -1.06 0.00 0.00 177.43 175.85 1xle h GLN 76 N 0.00 -0.91 -0.43 0.81 5.75 -1.33 -2.59 115.11 116.41 1xle h GLN 76 Ca -0.00 0.06 0.09 0.00 -0.15 0.00 0.00 58.65 58.64 1xle h GLN 76 Cb 0.56 0.21 -0.09 0.00 1.07 0.00 0.00 27.48 29.22 1xle h GLN 76 CO 0.04 -0.58 -0.30 0.00 -2.65 0.00 0.00 178.83 175.35 1xle h ALA 77 N -0.87 -0.09 -0.41 3.38 0.00 -1.20 0.18 119.26 120.25 1xle h ALA 77 Ca -0.10 0.12 0.04 0.00 0.00 0.00 0.00 54.91 54.98 1xle h ALA 77 Cb 0.75 0.66 -0.04 0.00 0.00 0.00 0.00 17.79 19.16 1xle h ALA 77 CO 0.16 -0.68 0.17 -0.07 0.00 0.00 0.00 179.25 178.83 1xle h LEU 78 N -0.21 0.21 -0.16 0.00 3.38 -1.43 0.15 115.31 117.24 1xle h LEU 78 Ca 0.19 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 1xle h LEU 78 Cb 0.52 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1xle h LEU 78 CO -0.55 0.16 0.07 0.11 0.09 0.00 0.00 178.44 178.32 1xle h LYS 79 N 0.35 0.23 -0.26 1.13 1.57 -0.81 0.35 116.57 119.13 1xle h LYS 79 Ca 0.19 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.95 1xle h LYS 79 Cb 0.15 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1xle h LYS 79 CO -0.17 0.28 0.12 -0.44 -0.57 0.00 0.00 179.45 178.67 1xle h ASP 80 N 0.12 0.17 0.85 0.86 3.32 -0.32 -3.27 116.42 118.15 1xle h ASP 80 Ca 0.05 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.06 1xle h ASP 80 Cb 0.13 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1xle h ASP 80 CO -0.01 0.13 -1.19 0.35 -1.72 0.00 0.00 179.24 176.80 1xle n THR 81 N -4.99 0.78 -0.53 0.35 -2.24 0.48 -5.00 114.28 103.14 1xle n THR 81 Ca -0.01 -0.60 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 1xle n THR 81 Cb 0.07 -0.45 0.00 0.00 -2.10 0.00 0.00 70.33 67.85 1xle n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xle n GLY 82 N 1.26 0.76 3.75 3.38 0.00 0.12 -5.01 105.19 109.44 1xle n GLY 82 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 1xle n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xle s LEU 83 N 0.00 4.38 0.51 0.99 1.02 -1.18 -5.02 118.68 119.38 1xle s LEU 83 Ca 0.00 2.74 -0.01 0.00 0.02 0.00 0.00 54.13 56.87 1xle s LEU 83 Cb 0.00 -3.63 0.01 0.00 0.02 0.00 0.00 46.19 42.59 1xle s LEU 83 CO 0.00 -0.72 0.76 -0.75 0.02 0.00 0.00 176.35 175.66 1xle s LYS 84 N -0.68 2.93 -0.56 1.70 2.20 -1.17 -4.81 119.74 119.35 1xle s LYS 84 Ca 0.58 -0.39 0.04 0.00 -0.36 0.00 0.00 55.97 55.85 1xle s LYS 84 Cb -0.43 -2.46 0.16 0.00 -1.51 0.00 0.00 37.83 33.60 1xle s LYS 84 CO 0.46 -0.48 0.39 0.08 -0.36 0.00 0.00 175.35 175.44 1xle s VAL 85 N -2.72 1.83 0.01 4.02 1.01 -1.26 -2.20 120.40 121.08 1xle s VAL 85 Ca 0.51 -3.41 0.18 0.00 0.00 0.00 0.00 61.98 59.26 1xle s VAL 85 Cb -0.10 -2.23 0.11 0.00 0.00 0.00 0.00 36.38 34.16 1xle s VAL 85 CO 0.40 -1.04 1.60 -0.65 0.00 0.00 0.00 175.10 175.41 1xle h PRO 86 N 5.78 0.00 -3.41 2.72 0.11 -1.87 -2.59 132.00 132.74 1xle h PRO 86 Ca 0.14 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.09 1xle h PRO 86 Cb 0.84 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 31.72 1xle h PRO 86 CO 0.57 0.42 -0.48 1.41 -0.21 0.00 0.00 178.00 179.70 1xle s MET 87 N -3.29 0.39 0.02 1.05 -2.45 -1.26 -1.55 119.30 112.22 1xle s MET 87 Ca 0.02 -0.15 0.03 0.00 -1.25 0.00 0.00 55.69 54.33 1xle s MET 87 Cb 0.09 0.17 -0.02 0.00 1.25 0.00 0.00 34.83 36.33 1xle s MET 87 CO 0.71 -0.09 -0.08 0.08 1.05 0.00 0.00 175.02 176.69 1xle s VAL 88 N -0.84 0.61 0.19 10.11 1.01 -1.10 -3.75 120.40 126.62 1xle s VAL 88 Ca -0.09 -0.74 -0.04 0.00 0.00 0.00 0.00 61.98 61.11 1xle s VAL 88 Cb -0.05 -0.60 -0.03 0.00 0.00 0.00 0.00 36.38 35.70 1xle s VAL 88 CO 0.01 -0.11 0.18 0.28 0.00 0.00 0.00 175.10 175.46 1xle s THR 89 N -0.80 0.03 0.04 3.92 -1.32 -0.12 -3.06 115.64 114.34 1xle s THR 89 Ca -0.03 -1.81 0.03 0.00 -1.21 0.00 0.00 61.69 58.66 1xle s THR 89 Cb -0.07 -2.26 -0.04 0.00 -1.51 0.00 0.00 72.50 68.63 1xle s THR 89 CO 0.00 -0.15 0.02 -0.89 -2.21 0.00 0.00 174.62 171.39 1xle s THR 90 N -4.09 4.21 -0.52 5.08 2.01 -1.26 -1.61 115.64 119.46 1xle s THR 90 Ca 0.30 -0.75 -0.17 0.00 0.31 0.00 0.00 61.69 61.38 1xle s THR 90 Cb 0.06 -2.95 0.09 0.00 0.01 0.00 0.00 72.50 69.70 1xle s THR 90 CO 0.08 0.24 0.55 0.21 -0.69 0.00 0.00 174.62 175.01 1xle s ASN 91 N -1.97 6.18 -0.37 3.53 3.84 -1.26 -4.85 114.94 120.05 1xle s ASN 91 Ca 0.24 -1.34 0.06 0.00 0.21 0.00 0.00 52.86 52.02 1xle s ASN 91 Cb -0.12 -2.24 0.49 0.00 -0.55 0.00 0.00 41.25 38.83 1xle s ASN 91 CO 0.15 -0.86 1.52 0.18 -2.79 0.00 0.00 177.10 175.30 1xle n LEU 92 N 5.71 5.16 0.00 3.21 4.77 -1.26 -4.67 117.00 129.92 1xle n LEU 92 Ca -0.11 -4.15 0.00 0.00 -0.03 0.00 0.00 56.01 51.72 1xle n LEU 92 Cb 0.43 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1xle n LEU 92 CO 0.53 1.54 -0.02 2.22 -1.33 0.00 0.00 177.39 180.33 1xle n PHE 93 N -0.97 0.00 0.09 -1.77 -1.74 -1.26 -4.46 117.46 107.34 1xle n PHE 93 Ca 0.43 0.00 -0.22 0.00 -0.56 0.00 0.00 57.45 57.10 1xle n PHE 93 Cb 0.98 0.00 -0.15 0.00 1.52 0.00 0.00 39.48 41.83 1xle n PHE 93 CO 0.00 0.00 0.00 0.77 -0.56 0.00 0.00 176.76 176.97 1xle h SER 94 N 0.00 0.63 -3.98 5.98 0.02 -1.95 -3.45 113.55 110.80 1xle h SER 94 Ca 0.00 -0.87 -0.53 0.00 -0.84 0.00 0.00 61.79 59.55 1xle h SER 94 Cb 0.01 -0.20 0.09 0.00 0.14 0.00 0.00 62.40 62.44 1xle h SER 94 CO 0.00 1.73 0.59 -2.28 -1.14 0.00 0.00 176.83 175.73 1xle s HIS 95 N -2.59 2.70 0.41 3.45 5.65 -1.26 -4.94 115.29 118.71 1xle s HIS 95 Ca -0.14 1.41 0.20 0.00 0.25 0.00 0.00 55.06 56.78 1xle s HIS 95 Cb 0.05 -3.66 1.13 0.00 -1.18 0.00 0.00 32.58 28.93 1xle s HIS 95 CO 0.87 -2.20 1.80 -1.35 -0.65 0.00 0.00 174.74 173.20 1xle h PRO 96 N 2.29 0.36 -0.80 2.88 0.11 -2.02 -0.61 132.00 134.20 1xle h PRO 96 Ca -0.50 -0.02 0.18 0.00 0.11 0.00 0.00 66.00 65.77 1xle h PRO 96 Cb 1.26 -0.08 -0.11 0.00 0.11 0.00 0.00 31.00 32.18 1xle h PRO 96 CO 0.61 0.24 0.27 -0.24 -0.21 0.00 0.00 178.00 178.67 1xle h VAL 97 N 0.37 0.53 0.00 3.15 3.04 -1.97 -1.68 116.25 119.69 1xle h VAL 97 Ca 0.56 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 66.13 1xle h VAL 97 Cb 1.47 0.15 0.00 0.00 -2.01 0.00 0.00 31.29 30.90 1xle h VAL 97 CO -0.24 0.06 0.00 0.49 -1.01 0.00 0.00 177.57 176.87 1xle n PHE 98 N -5.09 0.00 0.24 3.17 3.72 -0.24 -4.49 117.46 114.77 1xle n PHE 98 Ca 0.17 0.00 0.18 0.00 -0.05 0.00 0.00 57.45 57.75 1xle n PHE 98 Cb 0.51 -0.00 0.87 0.00 -0.94 0.00 0.00 39.48 39.92 1xle n PHE 98 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1xle h LYS 99 N 0.01 0.00 -0.14 -1.08 2.10 -1.44 0.61 116.57 116.62 1xle h LYS 99 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xle h LYS 99 Cb 0.01 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.34 1xle h LYS 99 CO 0.00 0.00 0.00 -3.47 -2.00 0.00 0.00 179.45 173.98 1xle n ASP 100 N -3.47 2.26 0.00 7.07 2.03 -1.26 -5.04 116.55 118.14 1xle n ASP 100 Ca 0.01 -1.85 0.00 0.00 0.52 0.00 0.00 54.79 53.47 1xle n ASP 100 Cb 0.35 -0.09 0.00 0.00 -0.72 0.00 0.00 41.12 40.66 1xle n ASP 100 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xle n GLY 101 N 0.06 1.06 0.00 0.27 0.00 0.20 -3.73 105.19 103.05 1xle n GLY 101 Ca 0.05 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 43.80 1xle n GLY 101 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xle n GLY 102 N -1.11 0.42 0.39 -0.02 0.00 -1.26 -4.43 105.19 99.19 1xle n GLY 102 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.21 1xle n GLY 102 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1xle h PHE 103 N 0.00 0.73 -0.27 1.61 -1.00 -1.90 -2.74 116.94 113.38 1xle h PHE 103 Ca 0.00 0.02 -0.11 0.00 2.81 0.00 0.00 57.97 60.70 1xle h PHE 103 Cb 0.00 -0.22 -0.06 0.00 3.61 0.00 0.00 35.95 39.28 1xle h PHE 103 CO 0.00 0.13 -0.09 0.25 -1.61 0.00 0.00 178.31 176.99 1xle n THR 104 N -4.63 2.40 -1.41 -1.55 -2.24 -1.26 -4.41 114.28 101.19 1xle n THR 104 Ca 0.23 -2.56 -0.35 0.00 -2.27 0.00 0.00 64.05 59.11 1xle n THR 104 Cb 0.74 -0.29 0.10 0.00 -2.10 0.00 0.00 70.33 68.78 1xle n THR 104 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xle s SER 105 N -2.50 4.10 0.13 3.42 0.15 -1.03 -4.82 113.70 113.16 1xle s SER 105 Ca 0.42 2.42 -0.02 0.00 0.70 0.00 0.00 55.95 59.47 1xle s SER 105 Cb 0.38 -2.60 -0.12 0.00 -1.71 0.00 0.00 66.02 61.97 1xle s SER 105 CO 0.01 -2.33 1.29 0.78 1.20 0.00 0.00 173.24 174.19 1xle h ASN 106 N -0.29 0.39 -3.14 5.45 4.21 -1.92 -3.44 115.58 116.84 1xle h ASN 106 Ca -0.48 -0.34 -0.55 0.00 1.21 0.00 0.00 56.30 56.14 1xle h ASN 106 Cb 1.30 -0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 38.37 1xle h ASN 106 CO 0.49 1.18 0.64 -0.62 -1.29 0.00 0.00 177.43 177.83 1xle s ASP 107 N -7.03 7.08 0.15 5.81 -1.08 -1.26 -4.96 116.67 115.37 1xle s ASP 107 Ca -0.04 1.87 -0.04 0.00 -0.52 0.00 0.00 52.55 53.82 1xle s ASP 107 Cb 0.09 -2.57 -0.02 0.00 -1.46 0.00 0.00 42.92 38.96 1xle s ASP 107 CO 0.86 -0.53 1.37 -0.09 0.52 0.00 0.00 175.17 177.30 1xle h ARG 108 N 7.22 0.46 -0.12 4.34 2.43 -2.00 -2.87 114.38 123.85 1xle h ARG 108 Ca -0.37 -0.41 -0.02 0.00 -0.81 0.00 0.00 59.98 58.37 1xle h ARG 108 Cb 1.18 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.83 1xle h ARG 108 CO 0.85 1.06 0.00 0.66 -1.51 0.00 0.00 179.97 181.03 1xle h SER 109 N 0.30 0.20 -0.63 -3.80 4.64 -1.98 -2.53 113.55 109.74 1xle h SER 109 Ca -0.05 -0.30 0.13 0.00 -0.47 0.00 0.00 61.79 61.10 1xle h SER 109 Cb 1.41 -0.05 -0.12 0.00 -0.31 0.00 0.00 62.40 63.33 1xle h SER 109 CO 0.14 0.45 -0.12 0.40 -0.87 0.00 0.00 176.83 176.84 1xle h ILE 110 N -0.06 0.39 -0.82 0.95 2.04 -1.95 -0.48 117.51 117.58 1xle h ILE 110 Ca 0.03 -0.01 0.06 0.00 1.00 0.00 0.00 64.86 65.95 1xle h ILE 110 Cb 0.35 0.36 -0.06 0.00 -0.74 0.00 0.00 36.82 36.73 1xle h ILE 110 CO 0.01 0.00 0.50 0.03 0.00 0.00 0.00 178.15 178.69 1xle h ARG 111 N 0.02 0.88 -0.30 2.37 3.08 -1.25 0.71 114.38 119.88 1xle h ARG 111 Ca 0.31 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.27 1xle h ARG 111 Cb 0.49 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 1xle h ARG 111 CO -0.63 0.58 0.02 0.00 -1.07 0.00 0.00 179.97 178.87 1xle h ARG 112 N 0.90 0.52 0.07 0.04 3.08 -0.71 -1.64 114.38 116.64 1xle h ARG 112 Ca 0.36 -0.16 0.02 0.00 0.07 0.00 0.00 59.98 60.28 1xle h ARG 112 Cb 0.20 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.15 1xle h ARG 112 CO -0.18 0.65 -0.29 0.35 -1.07 0.00 0.00 179.97 179.43 1xle h PHE 113 N 0.33 -0.78 -0.61 3.04 3.57 -0.50 0.15 116.94 122.14 1xle h PHE 113 Ca 0.09 0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.71 1xle h PHE 113 Cb 0.40 0.34 -0.08 0.00 2.79 0.00 0.00 35.95 39.40 1xle h PHE 113 CO 0.03 -0.39 0.20 0.00 -2.23 0.00 0.00 178.31 175.93 1xle h ALA 114 N 0.25 0.77 -0.66 2.41 0.00 -0.85 0.19 119.26 121.37 1xle h ALA 114 Ca 0.04 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1xle h ALA 114 Cb 0.53 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1xle h ALA 114 CO -0.20 -0.23 0.08 1.25 0.00 0.00 0.00 179.25 180.16 1xle h LEU 115 N 0.37 1.08 -0.06 0.00 5.85 -0.77 -2.17 115.31 119.60 1xle h LEU 115 Ca 0.31 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1xle h LEU 115 Cb 0.41 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 1xle h LEU 115 CO -0.33 1.08 -0.06 0.00 -0.34 0.00 0.00 178.44 178.79 1xle h ALA 116 N 1.04 -0.00 -0.72 1.25 0.00 0.87 -1.05 119.26 120.66 1xle h ALA 116 Ca 0.20 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.25 1xle h ALA 116 Cb 0.47 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.34 1xle h ALA 116 CO 0.02 -0.53 0.48 -0.22 0.00 0.00 0.00 179.25 178.99 1xle h LYS 117 N -0.07 0.53 0.10 0.00 3.64 -0.55 -1.64 116.57 118.58 1xle h LYS 117 Ca 0.05 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1xle h LYS 117 Cb 0.14 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1xle h LYS 117 CO -0.11 0.35 -0.05 0.28 -2.27 0.00 0.00 179.45 177.66 1xle h VAL 118 N 0.55 1.13 0.02 2.00 2.07 -0.87 -2.88 116.25 118.26 1xle h VAL 118 Ca 0.34 -1.19 0.03 0.00 0.82 0.00 0.00 66.70 66.70 1xle h VAL 118 Cb 0.58 1.85 -0.05 0.00 -1.52 0.00 0.00 31.29 32.15 1xle h VAL 118 CO -0.12 0.27 -0.38 -0.07 0.02 0.00 0.00 177.57 177.30 1xle h LEU 119 N -0.71 -1.15 -0.59 2.57 3.38 -0.60 -0.70 115.31 117.50 1xle h LEU 119 Ca -0.01 0.14 0.12 0.00 0.09 0.00 0.00 57.88 58.21 1xle h LEU 119 Cb 0.55 0.45 -0.09 0.00 0.09 0.00 0.00 40.66 41.66 1xle h LEU 119 CO 0.02 -0.44 0.06 0.45 0.09 0.00 0.00 178.44 178.62 1xle h HIS 120 N -0.55 0.07 -0.29 1.13 3.86 -1.46 0.25 115.15 118.15 1xle h HIS 120 Ca 0.05 0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.29 1xle h HIS 120 Cb 0.63 0.06 -0.02 0.00 1.06 0.00 0.00 27.41 29.14 1xle h HIS 120 CO -0.39 -0.10 0.13 -0.97 0.86 0.00 0.00 177.93 177.47 1xle h ASN 121 N 0.18 0.36 -0.53 2.45 -1.24 -1.11 -2.11 115.58 113.57 1xle h ASN 121 Ca 0.31 -0.03 0.03 0.00 0.71 0.00 0.00 56.30 57.32 1xle h ASN 121 Cb 0.48 -0.09 -0.04 0.00 0.73 0.00 0.00 38.32 39.40 1xle h ASN 121 CO -0.45 0.32 0.32 0.40 -1.29 0.00 0.00 177.43 176.72 1xle h ILE 122 N 0.41 1.05 0.13 2.57 2.04 0.53 0.20 117.51 124.44 1xle h ILE 122 Ca 0.10 -0.22 0.02 0.00 1.00 0.00 0.00 64.86 65.77 1xle h ILE 122 Cb 0.06 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 36.46 1xle h ILE 122 CO -0.01 0.12 -0.39 0.44 0.00 0.00 0.00 178.15 178.30 1xle h ASP 123 N 0.63 -1.13 -0.26 1.72 3.32 -1.28 0.16 116.42 119.58 1xle h ASP 123 Ca 0.22 0.13 0.04 0.00 0.02 0.00 0.00 57.03 57.43 1xle h ASP 123 Cb 0.03 0.43 -0.04 0.00 0.22 0.00 0.00 39.33 39.96 1xle h ASP 123 CO -0.10 -0.47 0.02 0.25 -1.72 0.00 0.00 179.24 177.23 1xle h LEU 124 N -0.63 -0.05 -0.77 1.55 5.85 -1.14 0.76 115.31 120.89 1xle h LEU 124 Ca 0.02 0.05 0.12 0.00 0.84 0.00 0.00 57.88 58.91 1xle h LEU 124 Cb 0.65 0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.68 1xle h LEU 124 CO -0.22 0.01 0.37 0.00 -0.34 0.00 0.00 178.44 178.26 1xle h ALA 125 N 1.21 1.09 -0.17 1.25 0.00 -0.52 0.47 119.26 122.59 1xle h ALA 125 Ca 0.12 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1xle h ALA 125 Cb 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1xle h ALA 125 CO -0.19 -0.08 -0.04 0.00 0.00 0.00 0.00 179.25 178.95 1xle h ALA 126 N 1.49 0.23 -0.95 0.00 0.00 -0.30 -2.70 119.26 117.03 1xle h ALA 126 Ca 0.40 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1xle h ALA 126 Cb 0.50 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 1xle h ALA 126 CO -0.32 -0.01 0.58 0.93 0.00 0.00 0.00 179.25 180.43 1xle h GLU 127 N 0.03 1.27 0.00 0.00 5.08 0.67 -2.56 114.58 119.07 1xle h GLU 127 Ca 0.04 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1xle h GLU 127 Cb 0.47 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1xle h GLU 127 CO 0.02 0.88 0.00 -1.33 -1.00 0.00 0.00 179.01 177.57 1xle n MET 128 N -4.37 0.11 -0.84 2.33 2.81 0.00 -4.91 117.12 112.25 1xle n MET 128 Ca 0.11 0.48 0.00 0.00 -1.81 0.00 0.00 57.70 56.47 1xle n MET 128 Cb 0.05 -1.78 0.00 0.00 -0.71 0.00 0.00 33.22 30.78 1xle n MET 128 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1xle n GLY 129 N -0.66 0.55 3.77 3.03 0.00 -0.96 -4.54 105.19 106.38 1xle n GLY 129 Ca 0.01 -0.31 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 1xle n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xle s ALA 130 N -2.00 3.50 -0.09 4.61 0.00 -0.98 -4.79 121.76 122.02 1xle s ALA 130 Ca 0.00 1.33 0.15 0.00 0.00 0.00 0.00 51.96 53.45 1xle s ALA 130 Cb 0.00 -3.51 -0.18 0.00 0.00 0.00 0.00 23.12 19.43 1xle s ALA 130 CO 0.00 -0.74 0.71 0.39 0.00 0.00 0.00 175.76 176.11 1xle n GLU 131 N 0.69 0.63 -5.16 0.00 -0.58 -0.70 -4.73 120.64 110.79 1xle n GLU 131 Ca 0.00 0.23 -0.31 0.00 -0.42 0.00 0.00 57.16 56.66 1xle n GLU 131 Cb 0.41 -1.78 -0.15 0.00 -0.57 0.00 0.00 31.44 29.35 1xle n GLU 131 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1xle s THR 132 N -2.78 2.29 -0.32 2.62 2.01 -0.60 -2.10 115.64 116.75 1xle s THR 132 Ca -0.04 -1.07 0.03 0.00 0.31 0.00 0.00 61.69 60.92 1xle s THR 132 Cb 0.08 -1.83 0.09 0.00 0.01 0.00 0.00 72.50 70.85 1xle s THR 132 CO 0.82 0.55 0.03 0.12 -0.69 0.00 0.00 174.62 175.45 1xle s PHE 133 N -0.67 3.38 -0.11 4.92 5.36 -0.12 -2.72 117.98 128.02 1xle s PHE 133 Ca 0.11 -2.70 -0.18 0.00 -0.96 0.00 0.00 56.93 53.20 1xle s PHE 133 Cb -0.10 -2.58 -0.04 0.00 -0.34 0.00 0.00 43.02 39.96 1xle s PHE 133 CO -0.00 -0.92 0.48 0.08 -1.46 0.00 0.00 175.22 173.40 1xle s VAL 134 N 1.04 5.17 -0.30 3.12 1.01 -1.17 0.01 120.40 129.28 1xle s VAL 134 Ca 0.07 0.96 -0.05 0.00 0.00 0.00 0.00 61.98 62.97 1xle s VAL 134 Cb -0.19 -3.82 0.03 0.00 0.00 0.00 0.00 36.38 32.40 1xle s VAL 134 CO -0.10 0.34 0.04 -0.04 0.00 0.00 0.00 175.10 175.35 1xle s MET 135 N 0.50 2.76 -0.39 2.72 1.00 0.26 -4.15 119.30 121.99 1xle s MET 135 Ca 0.26 -1.06 -0.02 0.00 0.00 0.00 0.00 55.69 54.86 1xle s MET 135 Cb -0.15 -3.28 0.10 0.00 0.00 0.00 0.00 34.83 31.50 1xle s MET 135 CO 0.11 -0.54 0.18 -0.46 0.00 0.00 0.00 175.02 174.31 1xle s TRP 136 N 1.38 3.57 -1.52 -0.03 -0.00 -1.26 -0.72 118.94 120.37 1xle s TRP 136 Ca -0.01 -2.39 -0.08 0.00 -0.00 0.00 0.00 56.10 53.62 1xle s TRP 136 Cb -0.18 -3.10 -0.01 0.00 -0.00 0.00 0.00 33.47 30.17 1xle s TRP 136 CO 0.00 -0.95 2.75 0.41 -0.00 0.00 0.00 176.95 179.16 1xle n GLY 137 N 4.58 4.61 0.08 5.86 0.00 -1.26 -4.78 105.19 114.28 1xle n GLY 137 Ca -0.03 -1.70 0.07 0.00 0.00 0.00 0.00 46.02 44.36 1xle n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xle n GLY 138 N 2.90 -0.87 0.35 -0.02 0.00 -1.26 -2.41 105.19 103.88 1xle n GLY 138 Ca 0.73 0.08 0.04 0.00 0.00 0.00 0.00 46.02 46.86 1xle n GLY 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xle n ARG 139 N -1.91 0.60 -2.68 1.61 5.12 -1.26 -4.10 116.66 114.05 1xle n ARG 139 Ca 0.01 -1.14 -0.42 0.00 -1.93 0.00 0.00 57.85 54.36 1xle n ARG 139 Cb 0.09 -1.16 -0.03 0.00 -1.16 0.00 0.00 32.46 30.19 1xle n ARG 139 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1xle s GLU 140 N -0.73 3.40 0.00 5.56 0.41 -1.01 -2.72 118.70 123.60 1xle s GLU 140 Ca 0.11 -0.03 0.00 0.00 -0.41 0.00 0.00 54.97 54.64 1xle s GLU 140 Cb 0.07 -4.05 0.00 0.00 -1.78 0.00 0.00 34.13 28.37 1xle s GLU 140 CO 0.10 -1.66 0.00 0.41 -0.49 0.00 0.00 175.26 173.62 1xle n GLY 141 N 5.12 -0.50 3.81 -1.39 0.00 -1.26 -0.96 105.19 110.02 1xle n GLY 141 Ca 0.05 -0.92 -0.08 0.00 0.00 0.00 0.00 46.02 45.08 1xle n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xle s SER 142 N -4.00 -0.29 -0.20 1.61 1.04 -0.91 -4.97 113.70 105.98 1xle s SER 142 Ca 0.00 -0.55 0.13 0.00 0.48 0.00 0.00 55.95 56.00 1xle s SER 142 Cb 0.00 0.71 -0.21 0.00 0.10 0.00 0.00 66.02 66.62 1xle s SER 142 CO 0.00 -1.31 -0.00 -0.62 0.98 0.00 0.00 173.24 172.29 1xle n GLU 143 N -0.45 0.88 -5.19 4.02 4.71 -1.26 -1.41 120.64 121.94 1xle n GLU 143 Ca -0.05 0.03 -0.32 0.00 -0.01 0.00 0.00 57.16 56.81 1xle n GLU 143 Cb 0.60 -1.47 -0.15 0.00 -1.01 0.00 0.00 31.44 29.40 1xle n GLU 143 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 1xle s TYR 144 N -2.45 2.44 0.31 -0.32 2.02 -1.26 -4.90 117.35 113.19 1xle s TYR 144 Ca -0.15 -0.38 0.25 0.00 -0.37 0.00 0.00 57.07 56.42 1xle s TYR 144 Cb 0.06 -1.54 1.20 0.00 -0.40 0.00 0.00 41.96 41.28 1xle s TYR 144 CO 0.71 0.01 1.96 -0.44 -1.57 0.00 0.00 175.55 176.22 1xle h ASP 145 N 5.49 0.00 -0.14 2.29 3.32 -1.98 -3.17 116.42 122.23 1xle h ASP 145 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1xle h ASP 145 Cb 1.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1xle h ASP 145 CO 0.48 0.18 0.00 0.61 -1.72 0.00 0.00 179.24 178.79 1xle n GLY 146 N -0.36 0.52 0.21 2.75 0.00 -1.26 -4.37 105.19 102.69 1xle n GLY 146 Ca -0.01 -0.51 0.15 0.00 0.00 0.00 0.00 46.02 45.65 1xle n GLY 146 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xle h SER 147 N 2.94 0.00 -4.64 1.61 0.02 -1.99 -3.45 113.55 108.04 1xle h SER 147 Ca 0.00 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.62 1xle h SER 147 Cb 0.64 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 62.96 1xle h SER 147 CO 0.00 0.00 -0.75 -0.54 -1.14 0.00 0.00 176.83 174.40 1xle s LYS 148 N -3.49 0.66 -0.51 3.45 -0.14 -1.26 -5.03 119.74 113.42 1xle s LYS 148 Ca 0.03 -0.86 -0.18 0.00 -1.36 0.00 0.00 55.97 53.60 1xle s LYS 148 Cb 0.09 -0.51 0.07 0.00 -1.68 0.00 0.00 37.83 35.80 1xle s LYS 148 CO 0.50 0.10 0.58 0.34 -0.76 0.00 0.00 175.35 176.11 1xle s ASP 149 N -1.69 6.20 0.47 2.83 -1.08 -1.26 -4.95 116.67 117.19 1xle s ASP 149 Ca -0.06 -1.11 0.20 0.00 -0.52 0.00 0.00 52.55 51.06 1xle s ASP 149 Cb -0.10 -2.26 1.17 0.00 -1.46 0.00 0.00 42.92 40.27 1xle s ASP 149 CO 0.01 -0.86 2.01 0.25 0.52 0.00 0.00 175.17 177.10 1xle h LEU 150 N 9.49 0.00 -0.15 -1.34 7.12 -1.98 0.23 115.31 128.68 1xle h LEU 150 Ca -0.28 0.00 -0.12 0.00 0.13 0.00 0.00 57.88 57.61 1xle h LEU 150 Cb 1.10 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.23 1xle h LEU 150 CO 0.97 0.18 -0.36 0.00 -0.13 0.00 0.00 178.44 179.09 1xle h ALA 151 N 1.82 0.25 -0.42 1.25 0.00 -2.01 -3.02 119.26 117.14 1xle h ALA 151 Ca -0.00 -0.44 -0.10 0.00 0.00 0.00 0.00 54.91 54.37 1xle h ALA 151 Cb 0.37 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1xle h ALA 151 CO 0.02 0.32 -0.14 0.00 0.00 0.00 0.00 179.25 179.46 1xle h ALA 152 N 0.55 0.98 -0.70 0.00 0.00 -1.84 -2.09 119.26 116.16 1xle h ALA 152 Ca -0.00 -0.33 0.04 0.00 0.00 0.00 0.00 54.91 54.62 1xle h ALA 152 Cb 0.97 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 1xle h ALA 152 CO 0.08 0.60 0.43 0.00 0.00 0.00 0.00 179.25 180.36 1xle h ALA 153 N 1.16 0.93 -0.27 0.00 0.00 -0.52 -1.18 119.26 119.39 1xle h ALA 153 Ca 0.11 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.85 1xle h ALA 153 Cb 0.62 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1xle h ALA 153 CO 0.04 0.18 -0.48 -0.07 0.00 0.00 0.00 179.25 178.92 1xle h LEU 154 N 0.82 0.79 -0.37 0.00 3.38 -1.34 -1.34 115.31 117.25 1xle h LEU 154 Ca 0.29 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1xle h LEU 154 Cb 0.07 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1xle h LEU 154 CO -0.13 1.14 0.19 0.44 0.09 0.00 0.00 178.44 180.17 1xle h ASP 155 N 0.57 0.48 -0.72 -0.43 3.32 -0.98 0.93 116.42 119.59 1xle h ASP 155 Ca 0.03 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 1xle h ASP 155 Cb 1.04 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.44 1xle h ASP 155 CO 0.10 0.45 0.35 0.03 -1.72 0.00 0.00 179.24 178.45 1xle h ARG 156 N 0.47 1.04 0.30 3.56 2.47 -1.19 0.14 114.38 121.17 1xle h ARG 156 Ca 0.13 -0.15 -0.01 0.00 -1.26 0.00 0.00 59.98 58.69 1xle h ARG 156 Cb 0.09 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 28.21 1xle h ARG 156 CO -0.02 0.81 -0.22 1.98 0.56 0.00 0.00 179.97 183.09 1xle h MET 157 N 1.01 -0.50 -0.46 0.04 4.05 -0.83 -2.40 114.93 115.85 1xle h MET 157 Ca 0.25 0.03 0.08 0.00 -0.28 0.00 0.00 59.70 59.79 1xle h MET 157 Cb 0.11 0.11 -0.07 0.00 -0.80 0.00 0.00 31.60 30.95 1xle h MET 157 CO -0.03 -0.33 0.02 -0.09 0.23 0.00 0.00 176.91 176.71 1xle h ARG 158 N -0.52 0.14 -0.30 0.39 2.43 -0.50 -1.59 114.38 114.43 1xle h ARG 158 Ca -0.02 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.18 1xle h ARG 158 Cb 0.45 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.92 1xle h ARG 158 CO 0.00 0.09 0.04 1.49 -1.51 0.00 0.00 179.97 180.09 1xle h GLU 159 N 0.14 0.14 -0.11 0.20 4.81 -0.58 0.44 114.58 119.62 1xle h GLU 159 Ca 0.23 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.44 1xle h GLU 159 Cb 0.33 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 1xle h GLU 159 CO -0.36 0.09 0.04 0.78 -0.73 0.00 0.00 179.01 178.84 1xle h GLY 160 N 0.15 0.18 1.00 1.92 0.00 -1.11 -1.11 103.07 104.09 1xle h GLY 160 Ca 0.14 -0.10 -0.10 0.00 0.00 0.00 0.00 47.33 47.27 1xle h GLY 160 CO -0.20 0.09 -0.14 -2.08 0.00 0.00 0.00 176.54 174.21 1xle h VAL 161 N 0.00 1.28 -0.11 4.60 2.07 -0.98 -1.81 116.25 121.31 1xle h VAL 161 Ca 0.04 -1.25 -0.13 0.00 0.82 0.00 0.00 66.70 66.17 1xle h VAL 161 Cb 0.19 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1xle h VAL 161 CO -0.00 0.42 -0.51 0.44 0.02 0.00 0.00 177.57 177.94 1xle h ASP 162 N 0.60 0.33 -0.74 0.57 3.32 -0.16 -2.12 116.42 118.23 1xle h ASP 162 Ca 0.09 -0.16 -0.04 0.00 0.02 0.00 0.00 57.03 56.94 1xle h ASP 162 Cb 0.68 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.10 1xle h ASP 162 CO 0.05 0.78 0.30 0.74 -1.72 0.00 0.00 179.24 179.39 1xle h THR 163 N 0.24 1.25 -0.46 0.35 2.02 -0.90 0.93 112.91 116.34 1xle h THR 163 Ca 0.01 -0.78 -0.11 0.00 0.77 0.00 0.00 66.41 66.30 1xle h THR 163 Cb 0.98 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 1xle h THR 163 CO 0.08 0.32 -0.17 0.00 0.37 0.00 0.00 175.52 176.11 1xle h ALA 164 N 1.15 0.83 -0.18 6.16 0.00 -1.24 -2.31 119.26 123.68 1xle h ALA 164 Ca 0.25 -0.36 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 1xle h ALA 164 Cb 0.20 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1xle h ALA 164 CO -0.02 0.65 -0.46 0.00 0.00 0.00 0.00 179.25 179.41 1xle h ALA 165 N 1.02 0.29 0.24 0.00 0.00 -1.12 -2.34 119.26 117.35 1xle h ALA 165 Ca 0.11 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1xle h ALA 165 Cb 0.71 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1xle h ALA 165 CO 0.05 0.44 -0.17 0.78 0.00 0.00 0.00 179.25 180.35 1xle h GLY 166 N 0.30 -0.42 0.41 0.00 0.00 -0.79 -1.85 103.07 100.73 1xle h GLY 166 Ca -0.01 0.19 0.06 0.00 0.00 0.00 0.00 47.33 47.58 1xle h GLY 166 CO 0.10 -0.17 -0.03 -1.82 0.00 0.00 0.00 176.54 174.61 1xle h TYR 167 N -0.41 -0.08 -0.21 5.60 3.20 -1.46 0.94 116.97 124.54 1xle h TYR 167 Ca -0.02 0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.94 1xle h TYR 167 Cb 0.36 0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.66 1xle h TYR 167 CO -0.11 -0.09 -0.19 0.82 -1.64 0.00 0.00 178.16 176.95 1xle h ILE 168 N 0.06 0.49 0.57 1.81 2.04 -0.95 -1.73 117.51 119.80 1xle h ILE 168 Ca 0.16 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.00 1xle h ILE 168 Cb 0.23 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 1xle h ILE 168 CO -0.30 0.00 -0.44 0.11 0.00 0.00 0.00 178.15 177.52 1xle h LYS 169 N -0.20 -0.95 -0.96 2.37 1.57 -0.93 -2.70 116.57 114.78 1xle h LYS 169 Ca 0.13 0.06 0.19 0.00 -1.87 0.00 0.00 60.65 59.16 1xle h LYS 169 Cb 0.39 0.21 -0.11 0.00 0.08 0.00 0.00 32.23 32.81 1xle h LYS 169 CO -0.33 -0.63 0.55 -0.44 -0.57 0.00 0.00 179.45 178.03 1xle h ASP 170 N -0.98 0.67 1.09 0.86 3.32 -0.47 -2.47 116.42 118.43 1xle h ASP 170 Ca -0.07 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1xle h ASP 170 Cb 0.82 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.37 1xle h ASP 170 CO 0.01 0.21 0.00 0.29 -1.72 0.00 0.00 179.24 178.04 1xle n LYS 171 N -4.83 0.09 -1.01 3.56 4.76 -0.68 -4.95 118.16 115.09 1xle n LYS 171 Ca 0.22 0.11 -0.00 0.00 -2.87 0.00 0.00 58.31 55.77 1xle n LYS 171 Cb 0.57 -1.62 -0.00 0.00 -1.84 0.00 0.00 35.03 32.14 1xle n LYS 171 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xle n GLY 172 N 1.22 0.44 3.74 0.72 0.00 -0.93 -5.01 105.19 105.38 1xle n GLY 172 Ca 0.06 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1xle n GLY 172 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xle s TYR 173 N -1.86 3.22 -1.32 1.61 2.02 -1.10 -4.94 117.35 114.98 1xle s TYR 173 Ca 0.00 1.22 -0.09 0.00 -0.37 0.00 0.00 57.07 57.83 1xle s TYR 173 Cb 0.00 -3.63 0.14 0.00 -0.40 0.00 0.00 41.96 38.07 1xle s TYR 173 CO 0.00 -1.95 2.09 0.09 -1.57 0.00 0.00 175.55 174.21 1xle n ASN 174 N 2.45 5.98 -3.87 2.29 5.03 -1.26 -4.74 115.26 121.15 1xle n ASN 174 Ca 0.06 -3.08 -0.14 0.00 0.87 0.00 0.00 54.58 52.29 1xle n ASN 174 Cb 0.42 -1.46 -0.15 0.00 -1.02 0.00 0.00 39.78 37.58 1xle n ASN 174 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1xle s LEU 175 N -0.54 1.75 0.10 3.41 1.43 -1.26 -4.47 118.68 119.09 1xle s LEU 175 Ca 0.45 -0.02 0.10 0.00 -1.03 0.00 0.00 54.13 53.64 1xle s LEU 175 Cb 0.13 -0.10 -0.04 0.00 0.03 0.00 0.00 46.19 46.21 1xle s LEU 175 CO -0.03 -0.02 -0.26 -0.13 0.23 0.00 0.00 176.35 176.14 1xle s ARG 176 N 0.28 1.60 -0.07 1.70 0.52 -0.89 -4.96 118.95 117.12 1xle s ARG 176 Ca -0.02 -1.24 -0.14 0.00 -0.52 0.00 0.00 55.73 53.81 1xle s ARG 176 Cb -0.04 -1.96 -0.05 0.00 0.52 0.00 0.00 34.95 33.42 1xle s ARG 176 CO -0.01 0.48 0.34 0.42 0.02 0.00 0.00 175.30 176.55 1xle s ILE 177 N -0.97 5.19 -0.15 1.52 1.01 -0.04 -0.94 121.20 126.82 1xle s ILE 177 Ca 0.14 0.68 0.00 0.00 0.00 0.00 0.00 60.65 61.47 1xle s ILE 177 Cb -0.10 -3.65 0.02 0.00 0.01 0.00 0.00 42.46 38.74 1xle s ILE 177 CO 0.05 0.51 -0.14 0.00 0.00 0.00 0.00 174.94 175.35 1xle s ALA 178 N -0.47 1.89 0.25 9.38 0.00 0.10 0.10 121.76 133.01 1xle s ALA 178 Ca 0.21 -0.93 -0.17 0.00 0.00 0.00 0.00 51.96 51.07 1xle s ALA 178 Cb -0.15 -1.07 -0.08 0.00 0.00 0.00 0.00 23.12 21.82 1xle s ALA 178 CO 0.09 -0.39 0.71 -0.51 0.00 0.00 0.00 175.76 175.65 1xle s LEU 179 N 1.48 4.23 -0.22 0.00 1.43 0.11 -0.58 118.68 125.13 1xle s LEU 179 Ca 0.05 1.31 -0.00 0.00 -1.03 0.00 0.00 54.13 54.46 1xle s LEU 179 Cb -0.13 -3.75 0.06 0.00 0.03 0.00 0.00 46.19 42.40 1xle s LEU 179 CO -0.11 -0.06 -0.04 -0.70 0.23 0.00 0.00 176.35 175.68 1xle s GLU 180 N -2.39 1.41 0.64 1.70 2.12 0.10 0.13 118.70 122.40 1xle s GLU 180 Ca 0.47 -0.81 -0.13 0.00 0.36 0.00 0.00 54.97 54.86 1xle s GLU 180 Cb -0.14 -2.42 -0.02 0.00 0.26 0.00 0.00 34.13 31.81 1xle s GLU 180 CO 0.19 -0.58 1.05 -1.25 -0.54 0.00 0.00 175.26 174.13 1xle s PRO 181 N 1.52 3.24 -0.29 4.30 0.05 -1.26 -4.28 135.00 138.28 1xle s PRO 181 Ca -0.04 1.01 -0.16 0.00 0.05 0.00 0.00 61.00 61.86 1xle s PRO 181 Cb -0.18 -2.03 0.14 0.00 0.05 0.00 0.00 34.50 32.49 1xle s PRO 181 CO -0.07 -0.86 0.95 0.21 0.05 0.00 0.00 177.00 177.29 1xle s LYS 182 N -4.65 0.39 0.20 4.56 2.20 -1.16 -4.67 119.74 116.60 1xle s LYS 182 Ca 0.59 0.72 0.04 0.00 -0.36 0.00 0.00 55.97 56.97 1xle s LYS 182 Cb -0.14 0.16 0.12 0.00 -1.51 0.00 0.00 37.83 36.46 1xle s LYS 182 CO 0.47 -0.09 1.47 -1.00 -0.36 0.00 0.00 175.35 175.83 1xle h PRO 183 N 6.40 0.17 -2.64 4.03 0.13 -1.74 -3.39 132.00 134.98 1xle h PRO 183 Ca -0.26 -0.16 0.10 0.00 -0.87 0.00 0.00 66.00 64.81 1xle h PRO 183 Cb 1.18 0.04 -0.09 0.00 0.13 0.00 0.00 31.00 32.25 1xle h PRO 183 CO 0.17 0.85 0.36 0.54 -0.23 0.00 0.00 178.00 179.69 1xle s ASN 184 N -6.90 -0.31 0.01 1.44 4.22 -1.26 -0.70 114.94 111.44 1xle s ASN 184 Ca -0.03 -0.31 0.00 0.00 -2.14 0.00 0.00 52.86 50.39 1xle s ASN 184 Cb 0.11 0.56 0.00 0.00 1.28 0.00 0.00 41.25 43.20 1xle s ASN 184 CO 0.81 -0.98 0.00 1.21 -2.04 0.00 0.00 177.10 176.09 1xle n GLU 185 N -0.41 -1.58 0.27 3.55 2.13 -1.26 -4.84 120.64 118.50 1xle n GLU 185 Ca -0.08 1.50 0.17 0.00 0.66 0.00 0.00 57.16 59.40 1xle n GLU 185 Cb 0.61 -1.74 0.66 0.00 0.27 0.00 0.00 31.44 31.24 1xle n GLU 185 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 1xle h PRO 186 N 1.29 0.00 -6.98 5.31 0.13 -2.01 -3.49 132.00 126.24 1xle h PRO 186 Ca 0.00 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.66 1xle h PRO 186 Cb 0.00 0.00 0.05 0.00 0.13 0.00 0.00 31.00 31.18 1xle h PRO 186 CO 0.00 0.01 0.08 1.03 -0.23 0.00 0.00 178.00 178.89 1xle s ARG 187 N -3.65 2.91 0.27 0.86 1.81 -1.26 -4.98 118.95 114.91 1xle s ARG 187 Ca 0.01 -0.21 0.01 0.00 -1.72 0.00 0.00 55.73 53.82 1xle s ARG 187 Cb 0.09 -2.37 0.37 0.00 -0.45 0.00 0.00 34.95 32.60 1xle s ARG 187 CO 0.55 -0.60 1.73 0.78 -0.68 0.00 0.00 175.30 177.08 1xle h GLY 188 N -0.01 0.64 -6.55 -3.53 0.00 -1.89 -3.42 103.07 88.31 1xle h GLY 188 Ca -0.45 -0.49 -0.33 0.00 0.00 0.00 0.00 47.33 46.06 1xle h GLY 188 CO 0.59 0.45 -0.74 0.99 0.00 0.00 0.00 176.54 177.83 1xle s ASP 189 N -6.77 0.35 -0.02 0.19 1.01 -0.50 -4.67 116.67 106.26 1xle s ASP 189 Ca -0.08 0.01 0.02 0.00 0.71 0.00 0.00 52.55 53.21 1xle s ASP 189 Cb 0.14 -0.15 -0.03 0.00 1.01 0.00 0.00 42.92 43.89 1xle s ASP 189 CO 0.80 -0.13 -0.04 -0.63 0.21 0.00 0.00 175.17 175.38 1xle s ILE 190 N 1.16 3.89 0.52 0.77 1.01 0.12 -2.15 121.20 126.52 1xle s ILE 190 Ca -0.08 -0.60 -0.22 0.00 0.00 0.00 0.00 60.65 59.75 1xle s ILE 190 Cb -0.13 -2.68 -0.06 0.00 0.01 0.00 0.00 42.46 39.60 1xle s ILE 190 CO -0.02 0.45 1.24 -0.36 0.00 0.00 0.00 174.94 176.25 1xle s PHE 191 N -0.97 2.57 -0.89 3.97 0.08 -0.13 -3.30 117.98 119.31 1xle s PHE 191 Ca 0.16 1.47 -0.05 0.00 0.12 0.00 0.00 56.93 58.63 1xle s PHE 191 Cb -0.11 -3.55 -0.01 0.00 -0.57 0.00 0.00 43.02 38.78 1xle s PHE 191 CO 0.06 -2.14 0.73 1.28 -0.10 0.00 0.00 175.22 175.05 1xle n LEU 192 N -0.91 -4.80 0.20 -0.37 4.77 -1.26 -4.82 117.00 109.81 1xle n LEU 192 Ca 0.10 -0.55 0.05 0.00 -0.03 0.00 0.00 56.01 55.58 1xle n LEU 192 Cb 0.47 -2.76 0.41 0.00 -2.33 0.00 0.00 43.42 39.21 1xle n LEU 192 CO 0.49 -0.31 0.75 1.55 -1.33 0.00 0.00 177.39 178.54 1xle h PRO 193 N -0.41 0.00 -5.05 3.23 0.13 -1.74 -3.36 132.00 124.80 1xle h PRO 193 Ca -0.36 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.28 1xle h PRO 193 Cb 1.20 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 1xle h PRO 193 CO 0.37 0.34 -0.56 0.95 -0.23 0.00 0.00 178.00 178.87 1xle s THR 194 N -3.98 0.71 0.21 1.56 -4.23 -1.26 -2.50 115.64 106.16 1xle s THR 194 Ca -0.02 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.40 1xle s THR 194 Cb 0.13 -2.52 0.17 0.00 1.34 0.00 0.00 72.50 71.62 1xle s THR 194 CO 0.69 0.00 1.70 0.58 -0.54 0.00 0.00 174.62 177.05 1xle h VAL 195 N 1.99 0.62 -0.22 2.29 2.07 -1.94 -1.64 116.25 119.42 1xle h VAL 195 Ca -0.37 -0.09 0.06 0.00 0.82 0.00 0.00 66.70 67.12 1xle h VAL 195 Cb 1.26 0.34 -0.07 0.00 -1.52 0.00 0.00 31.29 31.30 1xle h VAL 195 CO 0.60 0.05 -0.36 1.23 0.02 0.00 0.00 177.57 179.11 1xle h GLY 196 N 0.25 -0.48 1.02 2.17 0.00 -1.96 0.13 103.07 104.20 1xle h GLY 196 Ca 0.33 0.45 -0.02 0.00 0.00 0.00 0.00 47.33 48.09 1xle h GLY 196 CO -0.42 -0.21 0.43 0.45 0.00 0.00 0.00 176.54 176.78 1xle h HIS 197 N -0.38 1.12 0.48 5.60 -0.00 -1.81 -1.38 115.15 118.78 1xle h HIS 197 Ca 0.11 -0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.42 1xle h HIS 197 Cb 0.57 -0.36 0.00 0.00 -0.00 0.00 0.00 27.41 27.63 1xle h HIS 197 CO -0.48 0.79 -0.23 0.78 -0.00 0.00 0.00 177.93 178.79 1xle h GLY 198 N 1.13 -0.68 0.29 2.45 0.00 -0.78 -1.57 103.07 103.91 1xle h GLY 198 Ca 0.28 0.25 0.09 0.00 0.00 0.00 0.00 47.33 47.96 1xle h GLY 198 CO -0.04 -0.25 0.10 1.41 0.00 0.00 0.00 176.54 177.77 1xle h LEU 199 N -0.79 -0.01 0.03 3.11 3.38 -0.60 -2.05 115.31 118.37 1xle h LEU 199 Ca -0.07 0.10 0.03 0.00 0.09 0.00 0.00 57.88 58.03 1xle h LEU 199 Cb 0.56 0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.41 1xle h LEU 199 CO 0.11 0.02 -0.25 0.00 0.09 0.00 0.00 178.44 178.41 1xle h ALA 200 N 1.42 -0.36 -0.46 1.53 0.00 -1.24 -3.01 119.26 117.14 1xle h ALA 200 Ca 0.27 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.23 1xle h ALA 200 Cb 0.38 0.43 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 1xle h ALA 200 CO -0.36 -0.76 0.17 0.35 0.00 0.00 0.00 179.25 178.65 1xle h PHE 201 N -0.40 0.29 -0.85 0.00 3.57 -0.82 -2.29 116.94 116.44 1xle h PHE 201 Ca 0.05 0.02 0.19 0.00 3.53 0.00 0.00 57.97 61.76 1xle h PHE 201 Cb 0.47 -0.06 -0.11 0.00 2.79 0.00 0.00 35.95 39.04 1xle h PHE 201 CO -0.27 0.10 0.36 0.82 -2.23 0.00 0.00 178.31 177.09 1xle h ILE 202 N 0.34 0.55 0.00 1.41 2.04 -1.25 -1.71 117.51 118.89 1xle h ILE 202 Ca 0.22 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.93 1xle h ILE 202 Cb 0.21 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.38 1xle h ILE 202 CO -0.22 0.08 0.00 -0.62 0.00 0.00 0.00 178.15 177.39 1xle n GLU 203 N -5.02 0.04 0.00 2.37 -0.58 -0.86 -2.19 120.64 114.40 1xle n GLU 203 Ca 0.19 0.31 0.11 0.00 -0.42 0.00 0.00 57.16 57.35 1xle n GLU 203 Cb 0.55 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.91 1xle n GLU 203 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1xle n GLN 204 N -1.39 1.23 -2.99 3.49 1.13 -0.64 -4.97 117.38 113.24 1xle n GLN 204 Ca 0.02 -0.92 -0.36 0.00 -1.94 0.00 0.00 57.00 53.80 1xle n GLN 204 Cb 0.06 -1.45 -0.06 0.00 0.11 0.00 0.00 30.24 28.90 1xle n GLN 204 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1xle s LEU 205 N -2.44 4.34 0.15 1.08 1.43 -0.93 -4.99 118.68 117.31 1xle s LEU 205 Ca 0.17 1.56 -0.16 0.00 -1.03 0.00 0.00 54.13 54.68 1xle s LEU 205 Cb 0.17 -3.75 0.02 0.00 0.03 0.00 0.00 46.19 42.66 1xle s LEU 205 CO 0.56 -0.01 1.77 -0.08 0.23 0.00 0.00 176.35 178.82 1xle h GLU 206 N 3.31 0.59 -0.89 1.70 4.81 -1.93 -3.26 114.58 118.92 1xle h GLU 206 Ca -0.47 -0.06 -0.62 0.00 -0.13 0.00 0.00 59.36 58.07 1xle h GLU 206 Cb 1.19 -0.12 -0.35 0.00 0.63 0.00 0.00 28.75 30.11 1xle h GLU 206 CO 0.65 0.46 0.15 0.72 -0.73 0.00 0.00 179.01 180.26 1xle n HIS 207 N -4.73 3.01 0.29 0.92 8.25 -1.26 -4.85 115.22 116.85 1xle n HIS 207 Ca 0.01 -2.67 0.03 0.00 -0.26 0.00 0.00 57.72 54.83 1xle n HIS 207 Cb 0.07 -0.97 0.16 0.00 1.12 0.00 0.00 29.99 30.37 1xle n HIS 207 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xle n GLY 208 N -0.84 -0.63 0.27 -1.41 0.00 -1.23 -2.93 105.19 98.42 1xle n GLY 208 Ca 0.55 -0.03 -0.02 0.00 0.00 0.00 0.00 46.02 46.51 1xle n GLY 208 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1xle h ASP 209 N 0.00 0.61 -0.41 1.61 2.03 -1.90 -2.74 116.42 115.61 1xle h ASP 209 Ca 0.00 -0.14 0.00 0.00 -0.73 0.00 0.00 57.03 56.16 1xle h ASP 209 Cb 0.09 -0.16 0.00 0.00 -0.83 0.00 0.00 39.33 38.43 1xle h ASP 209 CO 0.00 0.70 0.00 2.30 -1.03 0.00 0.00 179.24 181.21 1xle n ILE 210 N -4.23 2.38 -4.53 4.15 -5.35 -1.15 -4.91 119.36 105.72 1xle n ILE 210 Ca 0.02 -1.62 -0.31 0.00 -0.27 0.00 0.00 62.75 60.57 1xle n ILE 210 Cb 0.29 -0.20 -0.17 0.00 -1.74 0.00 0.00 39.64 37.82 1xle n ILE 210 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1xle s VAL 211 N -2.65 1.81 0.00 7.28 1.01 -1.04 -0.86 120.40 125.95 1xle s VAL 211 Ca 0.47 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.62 1xle s VAL 211 Cb 0.36 -1.62 0.00 0.00 0.00 0.00 0.00 36.38 35.12 1xle s VAL 211 CO 0.13 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.34 1xle n GLY 212 N 4.19 5.31 3.74 4.51 0.00 0.12 -4.89 105.19 118.16 1xle n GLY 212 Ca -0.19 -1.43 -0.22 0.00 0.00 0.00 0.00 46.02 44.17 1xle n GLY 212 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xle s LEU 213 N 0.00 3.49 -0.43 0.99 2.01 0.17 0.08 118.68 124.98 1xle s LEU 213 Ca 0.00 -0.47 0.07 0.00 0.01 0.00 0.00 54.13 53.73 1xle s LEU 213 Cb 0.00 -2.01 0.23 0.00 0.01 0.00 0.00 46.19 44.42 1xle s LEU 213 CO 0.00 -0.05 0.50 -3.20 1.01 0.00 0.00 176.35 174.62 1xle n ASN 214 N -1.05 0.52 -4.77 2.29 5.15 0.12 -2.52 115.26 115.00 1xle n ASN 214 Ca -0.07 -2.72 -0.39 0.00 -0.60 0.00 0.00 54.58 50.80 1xle n ASN 214 Cb 0.59 -0.63 -0.03 0.00 -0.53 0.00 0.00 39.78 39.18 1xle n ASN 214 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1xle s PRO 215 N -1.06 4.29 -0.10 1.20 0.04 -1.25 -4.42 135.00 133.69 1xle s PRO 215 Ca 0.35 1.89 0.02 0.00 0.04 0.00 0.00 61.00 63.30 1xle s PRO 215 Cb 0.13 -2.90 -0.01 0.00 0.04 0.00 0.00 34.50 31.76 1xle s PRO 215 CO -0.12 -0.13 -0.18 -2.00 0.04 0.00 0.00 177.00 174.61 1xle s GLU 216 N -1.96 3.08 0.16 4.56 2.12 -1.26 -1.00 118.70 124.40 1xle s GLU 216 Ca 0.52 -0.78 -0.28 0.00 0.36 0.00 0.00 54.97 54.79 1xle s GLU 216 Cb -0.32 -2.44 -0.00 0.00 0.26 0.00 0.00 34.13 31.63 1xle s GLU 216 CO 0.42 0.27 1.56 1.15 -0.54 0.00 0.00 175.26 178.11 1xle h THR 217 N 5.35 0.05 -0.24 -1.70 2.02 -1.55 -2.57 112.91 114.27 1xle h THR 217 Ca -0.26 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 66.83 1xle h THR 217 Cb 1.21 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 1xle h THR 217 CO 0.51 0.00 -0.22 1.23 0.37 0.00 0.00 175.52 177.41 1xle h GLY 218 N -0.23 0.47 0.96 2.16 0.00 -1.85 -2.89 103.07 101.69 1xle h GLY 218 Ca 0.16 -0.36 -0.06 0.00 0.00 0.00 0.00 47.33 47.07 1xle h GLY 218 CO -0.72 0.33 0.04 0.45 0.00 0.00 0.00 176.54 176.64 1xle h HIS 219 N 0.39 0.79 -0.62 5.60 3.86 -1.81 -2.25 115.15 121.11 1xle h HIS 219 Ca 0.06 -0.12 -0.06 0.00 -1.16 0.00 0.00 60.37 59.09 1xle h HIS 219 Cb 0.60 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.83 1xle h HIS 219 CO 0.02 0.77 0.16 0.93 0.86 0.00 0.00 177.93 180.67 1xle h GLU 220 N 0.59 0.98 0.00 2.45 4.39 -1.48 -2.71 114.58 118.79 1xle h GLU 220 Ca 0.13 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1xle h GLU 220 Cb 0.42 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 1xle h GLU 220 CO 0.01 0.89 0.00 1.04 -1.16 0.00 0.00 179.01 179.79 1xle n GLN 221 N -4.35 0.15 0.21 2.33 6.02 -1.09 -2.10 117.38 118.54 1xle n GLN 221 Ca 0.04 0.48 0.14 0.00 -0.01 0.00 0.00 57.00 57.65 1xle n GLN 221 Cb 0.24 -1.85 0.47 0.00 1.02 0.00 0.00 30.24 30.12 1xle n GLN 221 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 1xle h MET 222 N 0.00 0.00 -0.29 -1.09 2.86 -1.07 -2.76 114.93 112.58 1xle h MET 222 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1xle h MET 222 Cb 0.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.88 1xle h MET 222 CO 0.00 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.97 1xle n ALA 223 N -1.98 2.37 -2.63 6.32 0.00 -1.08 -4.65 120.51 118.86 1xle n ALA 223 Ca 0.03 -1.46 -0.21 0.00 0.00 0.00 0.00 53.44 51.79 1xle n ALA 223 Cb 0.36 -0.47 0.01 0.00 0.00 0.00 0.00 19.45 19.35 1xle n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xle n GLY 224 N 0.13 -0.50 3.93 0.00 0.00 -1.04 -5.01 105.19 102.70 1xle n GLY 224 Ca 0.13 0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 1xle n GLY 224 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xle s LEU 225 N -6.22 3.28 -0.35 0.99 1.43 -0.89 -4.96 118.68 111.96 1xle s LEU 225 Ca 0.11 0.57 -0.20 0.00 -1.03 0.00 0.00 54.13 53.58 1xle s LEU 225 Cb -0.05 -3.39 0.00 0.00 0.03 0.00 0.00 46.19 42.78 1xle s LEU 225 CO 0.14 -1.04 0.62 0.21 0.23 0.00 0.00 176.35 176.51 1xle s ASN 226 N -4.31 6.41 0.17 2.29 3.84 -1.26 -4.14 114.94 117.94 1xle s ASN 226 Ca 0.53 0.13 -0.21 0.00 0.21 0.00 0.00 52.86 53.53 1xle s ASN 226 Cb -0.10 -2.32 0.08 0.00 -0.55 0.00 0.00 41.25 38.36 1xle s ASN 226 CO 0.43 -0.57 1.62 0.15 -2.79 0.00 0.00 177.10 175.94 1xle h PHE 227 N 8.45 -0.66 -0.56 0.43 3.57 -1.91 -1.70 116.94 124.55 1xle h PHE 227 Ca -0.27 0.05 0.11 0.00 3.53 0.00 0.00 57.97 61.39 1xle h PHE 227 Cb 1.11 0.35 -0.09 0.00 2.79 0.00 0.00 35.95 40.11 1xle h PHE 227 CO 0.75 -0.33 0.07 1.15 -2.23 0.00 0.00 178.31 177.72 1xle h THR 228 N -0.19 0.61 -0.54 4.41 2.02 -1.93 0.11 112.91 117.41 1xle h THR 228 Ca 0.18 -0.07 -0.06 0.00 0.77 0.00 0.00 66.41 67.24 1xle h THR 228 Cb 0.48 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 1xle h THR 228 CO -0.49 0.03 0.11 0.45 0.37 0.00 0.00 175.52 175.99 1xle h HIS 229 N 0.19 0.92 -0.11 3.16 3.86 -1.77 -2.08 115.15 119.33 1xle h HIS 229 Ca 0.29 -0.12 -0.00 0.00 -1.16 0.00 0.00 60.37 59.38 1xle h HIS 229 Cb 0.44 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.65 1xle h HIS 229 CO -0.28 0.82 0.06 0.78 0.86 0.00 0.00 177.93 180.16 1xle h GLY 230 N 0.77 0.16 2.00 2.45 0.00 -0.48 -1.19 103.07 106.77 1xle h GLY 230 Ca 0.17 -0.07 -0.06 0.00 0.00 0.00 0.00 47.33 47.36 1xle h GLY 230 CO 0.01 0.07 -0.31 0.16 0.00 0.00 0.00 176.54 176.46 1xle h ILE 231 N 0.09 0.72 -0.44 2.60 3.07 -0.81 -2.48 117.51 120.25 1xle h ILE 231 Ca 0.04 -1.37 -0.07 0.00 1.55 0.00 0.00 64.86 65.01 1xle h ILE 231 Cb 0.06 1.89 -0.02 0.00 -0.27 0.00 0.00 36.82 38.47 1xle h ILE 231 CO -0.01 0.30 0.00 0.00 -1.05 0.00 0.00 178.15 177.40 1xle h ALA 232 N 1.69 1.17 -0.01 0.16 0.00 -0.91 0.14 119.26 121.52 1xle h ALA 232 Ca -0.00 -0.25 -0.23 0.00 0.00 0.00 0.00 54.91 54.43 1xle h ALA 232 Cb 0.86 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1xle h ALA 232 CO 0.04 0.54 -0.94 0.37 0.00 0.00 0.00 179.25 179.26 1xle h GLN 233 N 0.68 0.45 -0.22 0.00 4.15 -0.92 -2.11 115.11 117.14 1xle h GLN 233 Ca 0.14 -0.47 -0.02 0.00 0.77 0.00 0.00 58.65 59.07 1xle h GLN 233 Cb 0.42 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.23 1xle h GLN 233 CO 0.02 1.12 0.07 0.00 -1.93 0.00 0.00 178.83 178.11 1xle h ALA 234 N 0.71 0.28 -0.49 3.38 0.00 -0.97 -2.54 119.26 119.63 1xle h ALA 234 Ca -0.08 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1xle h ALA 234 Cb 1.57 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.25 1xle h ALA 234 CO 0.16 -0.10 0.32 -0.07 0.00 0.00 0.00 179.25 179.57 1xle h LEU 235 N 0.18 0.57 -1.12 0.00 3.38 -0.76 0.27 115.31 117.83 1xle h LEU 235 Ca 0.07 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1xle h LEU 235 Cb 0.22 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 1xle h LEU 235 CO -0.00 0.42 0.55 -0.25 0.09 0.00 0.00 178.44 179.25 1xle h TRP 236 N 0.67 1.09 -0.00 1.13 7.01 -1.26 -1.74 115.95 122.85 1xle h TRP 236 Ca 0.18 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.20 1xle h TRP 236 Cb -0.07 -0.37 0.00 0.00 -2.10 0.00 0.00 29.16 26.63 1xle h TRP 236 CO -0.04 0.70 -0.05 0.00 -2.79 0.00 0.00 178.44 176.26 1xle n ALA 237 N -2.41 2.57 -3.36 2.65 0.00 -0.97 -4.92 120.51 114.07 1xle n ALA 237 Ca 0.10 -0.17 -0.16 0.00 0.00 0.00 0.00 53.44 53.20 1xle n ALA 237 Cb 0.04 -1.43 0.09 0.00 0.00 0.00 0.00 19.45 18.14 1xle n ALA 237 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1xle n GLU 238 N -1.28 -6.28 -0.09 0.00 1.02 -0.66 -4.95 120.64 108.40 1xle n GLU 238 Ca 0.12 0.81 0.03 0.00 -0.02 0.00 0.00 57.16 58.10 1xle n GLU 238 Cb 0.28 -5.71 0.04 0.00 -0.02 0.00 0.00 31.44 26.03 1xle n GLU 238 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1xle n LYS 239 N -3.97 1.54 -2.92 3.49 4.76 0.92 -4.92 118.16 117.06 1xle n LYS 239 Ca -0.27 -1.61 -0.44 0.00 -2.87 0.00 0.00 58.31 53.11 1xle n LYS 239 Cb 0.66 -1.01 -0.02 0.00 -1.84 0.00 0.00 35.03 32.83 1xle n LYS 239 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1xle s LEU 240 N -1.30 5.00 0.01 -0.35 2.96 -1.21 0.43 118.68 124.23 1xle s LEU 240 Ca 0.10 -2.35 0.05 0.00 -0.22 0.00 0.00 54.13 51.71 1xle s LEU 240 Cb 0.09 -2.41 -0.24 0.00 0.50 0.00 0.00 46.19 44.13 1xle s LEU 240 CO 0.01 -0.97 0.89 -0.26 -1.32 0.00 0.00 176.35 174.70 1xle h PHE 241 N 8.28 0.18 -3.31 5.38 -1.00 -1.87 -3.46 116.94 121.14 1xle h PHE 241 Ca 0.21 -0.13 -0.00 0.00 2.81 0.00 0.00 57.97 60.86 1xle h PHE 241 Cb 0.97 -0.01 -0.06 0.00 3.61 0.00 0.00 35.95 40.46 1xle h PHE 241 CO 1.15 1.16 0.08 -1.58 -1.61 0.00 0.00 178.31 177.51 1xle s HIS 242 N -2.63 0.12 -0.04 -0.55 2.46 -1.05 -4.80 115.29 108.80 1xle s HIS 242 Ca -0.05 -0.55 -0.15 0.00 0.47 0.00 0.00 55.06 54.78 1xle s HIS 242 Cb 0.08 0.48 0.03 0.00 -0.13 0.00 0.00 32.58 33.04 1xle s HIS 242 CO 0.83 -1.17 0.33 -1.50 -2.47 0.00 0.00 174.74 170.76 1xle s ILE 243 N -3.77 0.05 -0.23 0.89 2.07 -1.26 -3.96 121.20 114.98 1xle s ILE 243 Ca 0.17 -0.38 0.02 0.00 -1.41 0.00 0.00 60.65 59.05 1xle s ILE 243 Cb -0.04 -0.60 0.04 0.00 0.13 0.00 0.00 42.46 42.00 1xle s ILE 243 CO 0.09 -0.21 -0.13 -1.81 -1.91 0.00 0.00 174.94 170.97 1xle s ASP 244 N -1.06 4.02 -0.13 4.50 1.11 -0.17 -3.87 116.67 121.06 1xle s ASP 244 Ca -0.11 -1.11 -0.06 0.00 0.18 0.00 0.00 52.55 51.44 1xle s ASP 244 Cb -0.05 -1.54 -0.04 0.00 1.07 0.00 0.00 42.92 42.37 1xle s ASP 244 CO 0.04 -0.13 0.08 -0.76 1.18 0.00 0.00 175.17 175.58 1xle s LEU 245 N 1.18 4.01 0.00 1.23 1.43 -0.00 -1.39 118.68 125.14 1xle s LEU 245 Ca -0.04 0.26 0.00 0.00 -1.03 0.00 0.00 54.13 53.33 1xle s LEU 245 Cb -0.17 -1.98 0.00 0.00 0.03 0.00 0.00 46.19 44.07 1xle s LEU 245 CO -0.07 0.32 0.00 -0.46 0.23 0.00 0.00 176.35 176.37 1xle n ASN 246 N 2.56 0.00 -4.01 2.29 0.23 -1.26 -2.36 115.26 112.71 1xle n ASN 246 Ca -0.18 -0.55 -0.12 0.00 -0.53 0.00 0.00 54.58 53.20 1xle n ASN 246 Cb 0.54 0.00 -0.12 0.00 -2.08 0.00 0.00 39.78 38.12 1xle n ASN 246 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1xle s GLY 247 N -1.33 0.36 -0.01 4.83 0.00 0.29 -4.29 107.32 107.16 1xle s GLY 247 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 44.72 44.11 1xle s GLY 247 CO 0.00 -0.66 0.01 1.62 0.00 0.00 0.00 173.10 174.07 1xle s GLN 248 N -1.33 0.00 -0.78 2.90 2.00 -1.26 -0.69 119.66 120.50 1xle s GLN 248 Ca -0.11 0.10 0.03 0.00 -2.00 0.00 0.00 55.36 53.38 1xle s GLN 248 Cb -0.09 -0.16 0.25 0.00 0.80 0.00 0.00 33.01 33.81 1xle s GLN 248 CO -0.00 -0.09 0.90 0.54 -0.50 0.00 0.00 175.29 176.13 1xle n ARG 249 N 3.70 2.93 0.00 1.67 1.74 -1.26 -3.41 116.66 122.03 1xle n ARG 249 Ca -0.21 -4.61 0.00 0.00 -0.77 0.00 0.00 57.85 52.26 1xle n ARG 249 Cb 0.54 -2.34 0.00 0.00 -1.02 0.00 0.00 32.46 29.64 1xle n ARG 249 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xle n GLY 250 N 1.25 1.15 3.55 -0.13 0.00 -1.26 -4.89 105.19 104.86 1xle n GLY 250 Ca 0.27 -2.09 -0.40 0.00 0.00 0.00 0.00 46.02 43.79 1xle n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xle s ILE 251 N -1.56 3.65 0.00 -0.61 1.01 -1.26 -4.59 121.20 117.84 1xle s ILE 251 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.90 1xle s ILE 251 Cb 0.00 -4.70 0.00 0.00 0.01 0.00 0.00 42.46 37.77 1xle s ILE 251 CO 0.00 -1.64 0.00 2.29 0.00 0.00 0.00 174.94 175.59 1xle n LYS 252 N 9.28 0.00 -0.76 2.79 2.85 -1.26 -5.09 118.16 125.97 1xle n LYS 252 Ca 0.10 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 57.04 1xle n LYS 252 Cb 0.50 0.00 0.14 0.00 -0.65 0.00 0.00 35.03 35.02 1xle n LYS 252 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 177.40 179.83 1xle n TYR 253 N 0.00 -0.51 -2.27 5.58 4.11 -1.26 -4.85 117.16 117.96 1xle n TYR 253 Ca 0.00 0.30 -0.41 0.00 -0.00 0.00 0.00 57.90 57.79 1xle n TYR 253 Cb 0.00 -1.87 -0.03 0.00 -0.00 0.00 0.00 39.34 37.44 1xle n TYR 253 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 1xle s ASP 254 N -2.25 5.85 0.04 9.48 2.15 -1.26 -4.87 116.67 125.81 1xle s ASP 254 Ca 0.61 0.31 -0.18 0.00 0.43 0.00 0.00 52.55 53.73 1xle s ASP 254 Cb -0.22 -2.54 -0.20 0.00 -0.30 0.00 0.00 42.92 39.65 1xle s ASP 254 CO 0.63 -1.92 1.19 1.56 -0.17 0.00 0.00 175.17 176.46 1xle h GLN 255 N 12.27 0.53 -5.76 4.34 4.20 -1.89 -3.48 115.11 125.32 1xle h GLN 255 Ca -0.27 -0.49 -0.36 0.00 0.06 0.00 0.00 58.65 57.59 1xle h GLN 255 Cb 1.12 0.12 0.15 0.00 0.30 0.00 0.00 27.48 29.16 1xle h GLN 255 CO 1.19 1.12 -0.76 -0.25 -0.67 0.00 0.00 178.83 179.46 1xle n ASP 256 N -4.16 -2.95 -4.57 1.46 8.00 -1.18 -4.70 116.55 108.44 1xle n ASP 256 Ca -0.09 -0.63 -0.29 0.00 0.71 0.00 0.00 54.79 54.49 1xle n ASP 256 Cb 0.67 -4.97 0.13 0.00 -0.02 0.00 0.00 41.12 36.93 1xle n ASP 256 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xle s LEU 257 N -6.62 2.60 0.36 0.64 1.43 0.13 0.25 118.68 117.47 1xle s LEU 257 Ca 0.14 0.55 -0.28 0.00 -1.03 0.00 0.00 54.13 53.51 1xle s LEU 257 Cb -0.06 -2.85 -0.10 0.00 0.03 0.00 0.00 46.19 43.21 1xle s LEU 257 CO 0.74 -2.25 1.36 -0.69 0.23 0.00 0.00 176.35 175.73 1xle s VAL 258 N -3.70 2.51 0.08 -1.59 1.01 -1.26 -0.55 120.40 116.89 1xle s VAL 258 Ca 0.67 0.50 -0.34 0.00 0.00 0.00 0.00 61.98 62.81 1xle s VAL 258 Cb -0.08 -3.31 -0.13 0.00 0.00 0.00 0.00 36.38 32.86 1xle s VAL 258 CO 0.51 0.11 1.66 0.33 0.00 0.00 0.00 175.10 177.70 1xle n PHE 259 N 0.54 2.26 -0.08 5.22 7.35 -1.26 -0.84 117.46 130.65 1xle n PHE 259 Ca 0.01 0.20 0.00 0.00 -0.76 0.00 0.00 57.45 56.90 1xle n PHE 259 Cb 0.41 -2.57 0.00 0.00 0.35 0.00 0.00 39.48 37.67 1xle n PHE 259 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1xle n GLY 260 N 3.68 0.82 0.45 7.13 0.00 -1.26 -4.74 105.19 111.27 1xle n GLY 260 Ca 0.19 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.30 1xle n GLY 260 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xle n HIS 261 N -2.00 0.21 0.00 1.61 8.25 -0.02 -4.51 115.22 118.76 1xle n HIS 261 Ca 0.00 -0.11 0.00 0.00 -0.26 0.00 0.00 57.72 57.35 1xle n HIS 261 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1xle n HIS 261 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xle n GLY 262 N 1.03 1.40 3.56 -1.41 0.00 -1.26 -4.83 105.19 103.68 1xle n GLY 262 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 1xle n GLY 262 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xle s ASP 263 N 0.38 6.44 0.00 1.61 -1.08 -1.22 -4.92 116.67 117.89 1xle s ASP 263 Ca 0.00 -0.02 -0.25 0.00 -0.52 0.00 0.00 52.55 51.76 1xle s ASP 263 Cb 0.00 -2.48 -0.16 0.00 -1.46 0.00 0.00 42.92 38.82 1xle s ASP 263 CO 0.00 -1.23 1.18 0.25 0.52 0.00 0.00 175.17 175.89 1xle h LEU 264 N 11.07 -0.38 -0.95 -1.34 5.85 -1.96 -1.74 115.31 125.86 1xle h LEU 264 Ca -0.25 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.32 1xle h LEU 264 Cb 1.07 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 42.15 1xle h LEU 264 CO 1.09 0.00 0.63 0.74 -0.34 0.00 0.00 178.44 180.56 1xle h THR 265 N -0.82 1.23 -0.74 1.05 2.02 -1.95 0.47 112.91 114.17 1xle h THR 265 Ca -0.05 -0.44 -0.02 0.00 0.77 0.00 0.00 66.41 66.68 1xle h THR 265 Cb 0.52 -0.16 -0.03 0.00 -1.74 0.00 0.00 68.15 66.74 1xle h THR 265 CO 0.08 0.23 0.39 -1.28 0.37 0.00 0.00 175.52 175.31 1xle h SER 266 N 1.27 0.93 -0.14 4.18 0.87 -1.97 -2.06 113.55 116.64 1xle h SER 266 Ca 0.36 -0.10 0.03 0.00 -1.23 0.00 0.00 61.79 60.84 1xle h SER 266 Cb -0.12 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 61.58 1xle h SER 266 CO -0.09 0.77 -0.04 0.00 -0.53 0.00 0.00 176.83 176.95 1xle h ALA 267 N 1.20 0.09 -0.04 6.23 0.00 -0.22 -0.14 119.26 126.38 1xle h ALA 267 Ca 0.26 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.26 1xle h ALA 267 Cb 0.05 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 1xle h ALA 267 CO -0.04 -0.48 -0.23 0.35 0.00 0.00 0.00 179.25 178.84 1xle h PHE 268 N -0.00 -0.62 0.00 0.00 3.57 -0.70 0.27 116.94 119.46 1xle h PHE 268 Ca 0.07 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.53 1xle h PHE 268 Cb 0.11 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 1xle h PHE 268 CO -0.18 -0.32 -0.27 0.74 -2.23 0.00 0.00 178.31 176.05 1xle h PHE 269 N -0.34 0.00 -0.15 0.41 0.04 -1.18 0.55 116.94 116.26 1xle h PHE 269 Ca 0.07 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.81 1xle h PHE 269 Cb 0.45 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.59 1xle h PHE 269 CO -0.29 0.27 -0.05 1.15 -0.60 0.00 0.00 178.31 178.79 1xle h THR 270 N 0.00 1.30 -0.19 -1.55 2.02 -0.13 -2.47 112.91 111.89 1xle h THR 270 Ca -0.00 -1.04 0.02 0.00 0.77 0.00 0.00 66.41 66.16 1xle h THR 270 Cb 0.50 1.66 -0.02 0.00 -1.74 0.00 0.00 68.15 68.55 1xle h THR 270 CO 0.04 0.30 0.07 0.58 0.37 0.00 0.00 175.52 176.88 1xle h VAL 271 N -0.00 0.96 -0.84 3.16 2.07 0.10 -0.74 116.25 120.96 1xle h VAL 271 Ca 0.04 -0.06 0.17 0.00 0.82 0.00 0.00 66.70 67.66 1xle h VAL 271 Cb 0.49 0.78 -0.10 0.00 -1.52 0.00 0.00 31.29 30.94 1xle h VAL 271 CO 0.02 0.03 0.40 -0.78 0.02 0.00 0.00 177.57 177.26 1xle h ASP 272 N 0.17 0.43 -0.22 0.57 3.58 -0.79 0.15 116.42 120.32 1xle h ASP 272 Ca 0.08 0.11 -0.18 0.00 0.42 0.00 0.00 57.03 57.47 1xle h ASP 272 Cb 0.04 0.06 -0.00 0.00 1.72 0.00 0.00 39.33 41.15 1xle h ASP 272 CO -0.08 0.14 -0.53 0.25 -2.88 0.00 0.00 179.24 176.14 1xle h LEU 273 N 0.53 0.89 -0.09 2.28 7.12 -1.10 0.27 115.31 125.22 1xle h LEU 273 Ca 0.48 -0.47 -0.12 0.00 0.13 0.00 0.00 57.88 57.90 1xle h LEU 273 Cb 0.76 -0.25 0.01 0.00 -0.53 0.00 0.00 40.66 40.64 1xle h LEU 273 CO -0.41 1.25 -0.42 -0.07 -0.13 0.00 0.00 178.44 178.65 1xle h LEU 274 N 0.62 0.53 0.03 2.25 3.38 0.40 -2.70 115.31 119.83 1xle h LEU 274 Ca 0.02 -0.64 -0.00 0.00 0.09 0.00 0.00 57.88 57.34 1xle h LEU 274 Cb 1.12 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1xle h LEU 274 CO 0.11 1.08 -0.02 -0.33 0.09 0.00 0.00 178.44 179.38 1xle h GLU 275 N 0.00 -0.04 -0.00 1.13 4.39 -0.86 -3.40 114.58 115.80 1xle h GLU 275 Ca -0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1xle h GLU 275 Cb 1.07 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 1xle h GLU 275 CO 0.09 0.17 -0.30 0.09 -1.16 0.00 0.00 179.01 177.89 1xle n ASN 276 N -4.78 0.42 -0.02 1.42 3.02 0.95 -5.05 115.26 111.22 1xle n ASN 276 Ca -0.03 -0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.36 1xle n ASN 276 Cb 0.11 0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 1xle n ASN 276 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xle n GLY 277 N 1.46 0.48 3.74 7.41 0.00 -1.02 -4.75 105.19 112.51 1xle n GLY 277 Ca 0.08 -0.92 -0.41 0.00 0.00 0.00 0.00 46.02 44.77 1xle n GLY 277 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xle s PHE 278 N 0.00 3.82 0.32 1.61 0.08 -1.26 -4.58 117.98 117.97 1xle s PHE 278 Ca 0.00 1.72 0.09 0.00 0.12 0.00 0.00 56.93 58.86 1xle s PHE 278 Cb 0.00 -2.97 0.91 0.00 -0.57 0.00 0.00 43.02 40.40 1xle s PHE 278 CO 0.00 0.28 1.66 -1.35 -0.10 0.00 0.00 175.22 175.71 1xle h PRO 279 N 5.32 0.28 -0.65 0.24 0.11 -1.98 0.76 132.00 136.08 1xle h PRO 279 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1xle h PRO 279 Cb 1.21 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1xle h PRO 279 CO 0.71 0.19 0.00 0.09 -0.21 0.00 0.00 178.00 178.77 1xle n ASN 280 N -5.12 4.35 0.00 -2.05 3.02 -1.26 -5.05 115.26 109.16 1xle n ASN 280 Ca 0.27 -2.37 0.00 0.00 -0.03 0.00 0.00 54.58 52.45 1xle n ASN 280 Cb 0.84 -0.55 0.00 0.00 -0.61 0.00 0.00 39.78 39.46 1xle n ASN 280 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xle n GLY 281 N 1.14 -1.35 0.00 7.41 0.00 0.26 -5.09 105.19 107.55 1xle n GLY 281 Ca 0.24 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.67 1xle n GLY 281 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xle n GLY 282 N -1.50 0.13 3.52 -0.02 0.00 -1.26 -4.68 105.19 101.37 1xle n GLY 282 Ca 0.00 -1.77 -0.30 0.00 0.00 0.00 0.00 46.02 43.96 1xle n GLY 282 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1xle n PRO 283 N -1.09 -1.68 -4.23 1.61 -0.04 -1.26 -4.82 135.00 123.49 1xle n PRO 283 Ca 0.00 -0.45 -0.17 0.00 -0.04 0.00 0.00 63.50 62.85 1xle n PRO 283 Cb 0.00 -2.19 -0.14 0.00 -0.04 0.00 0.00 33.50 31.12 1xle n PRO 283 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1xle s LYS 284 N -4.38 0.53 -0.02 0.54 -0.14 -1.26 -4.61 119.74 110.40 1xle s LYS 284 Ca 0.67 -0.26 -0.30 0.00 -1.36 0.00 0.00 55.97 54.72 1xle s LYS 284 Cb -0.24 -0.51 -0.03 0.00 -1.68 0.00 0.00 37.83 35.37 1xle s LYS 284 CO 0.63 0.14 1.05 -0.47 -0.76 0.00 0.00 175.35 175.94 1xle s TYR 285 N -0.21 3.54 -0.25 3.18 5.04 -1.26 -4.96 117.35 122.43 1xle s TYR 285 Ca 0.02 1.55 0.08 0.00 -2.44 0.00 0.00 57.07 56.29 1xle s TYR 285 Cb -0.03 -3.22 -0.10 0.00 0.35 0.00 0.00 41.96 38.96 1xle s TYR 285 CO -0.00 -0.42 0.29 0.25 -1.34 0.00 0.00 175.55 174.33 1xle n THR 286 N 4.13 0.00 -0.05 4.34 -2.24 -1.26 -4.96 114.28 114.23 1xle n THR 286 Ca 0.08 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1xle n THR 286 Cb 0.49 0.75 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 1xle n THR 286 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xle n GLY 287 N 1.49 -3.49 3.79 3.38 0.00 -1.26 -4.99 105.19 104.11 1xle n GLY 287 Ca 0.00 -1.25 -0.35 0.00 0.00 0.00 0.00 46.02 44.43 1xle n GLY 287 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xle s PRO 288 N -2.30 3.64 -0.83 1.61 0.04 -1.26 -4.96 135.00 130.94 1xle s PRO 288 Ca 0.00 1.47 -0.15 0.00 0.04 0.00 0.00 61.00 62.36 1xle s PRO 288 Cb 0.00 -2.07 0.20 0.00 0.04 0.00 0.00 34.50 32.67 1xle s PRO 288 CO 0.00 -0.59 0.81 1.03 0.04 0.00 0.00 177.00 178.29 1xle s ARG 289 N -3.23 3.58 -0.14 4.56 3.00 0.03 -4.35 118.95 122.40 1xle s ARG 289 Ca 0.69 -2.33 -0.11 0.00 0.00 0.00 0.00 55.73 53.98 1xle s ARG 289 Cb -0.20 -4.49 -0.05 0.00 0.00 0.00 0.00 34.95 30.22 1xle s ARG 289 CO 0.23 -1.36 0.21 -1.58 0.00 0.00 0.00 175.30 172.80 1xle s HIS 290 N 0.57 3.52 -0.22 -0.53 2.46 -1.25 -1.89 115.29 117.95 1xle s HIS 290 Ca 0.19 0.54 -0.05 0.00 0.47 0.00 0.00 55.06 56.21 1xle s HIS 290 Cb -0.10 -2.16 -0.02 0.00 -0.13 0.00 0.00 32.58 30.17 1xle s HIS 290 CO -0.08 0.45 -0.00 -0.06 -2.47 0.00 0.00 174.74 172.57 1xle s PHE 291 N -0.18 3.01 -0.61 3.88 0.08 -0.45 -0.82 117.98 122.89 1xle s PHE 291 Ca 0.14 -0.63 0.00 0.00 0.12 0.00 0.00 56.93 56.56 1xle s PHE 291 Cb -0.12 -2.12 0.16 0.00 -0.57 0.00 0.00 43.02 40.36 1xle s PHE 291 CO 0.03 -0.38 0.41 0.34 -0.10 0.00 0.00 175.22 175.51 1xle s ASP 292 N 1.32 4.94 0.37 1.36 2.15 -0.99 -3.87 116.67 121.94 1xle s ASP 292 Ca 0.04 -3.04 0.04 0.00 0.43 0.00 0.00 52.55 50.03 1xle s ASP 292 Cb -0.15 -1.77 -0.03 0.00 -0.30 0.00 0.00 42.92 40.67 1xle s ASP 292 CO 0.00 -0.29 0.17 -0.72 -0.17 0.00 0.00 175.17 174.16 1xle s TYR 293 N -0.33 1.75 -0.06 -5.34 1.13 -1.26 -4.59 117.35 108.64 1xle s TYR 293 Ca 0.18 -1.39 -0.01 0.00 -1.41 0.00 0.00 57.07 54.44 1xle s TYR 293 Cb -0.21 -1.00 0.03 0.00 -1.10 0.00 0.00 41.96 39.68 1xle s TYR 293 CO -0.03 -0.47 0.02 0.15 -2.51 0.00 0.00 175.55 172.70 1xle s LYS 294 N -3.67 0.45 0.13 -3.49 1.02 0.14 -4.42 119.74 109.89 1xle s LYS 294 Ca 0.30 0.17 -0.32 0.00 0.02 0.00 0.00 55.97 56.14 1xle s LYS 294 Cb 0.03 -0.86 -0.11 0.00 -0.52 0.00 0.00 37.83 36.37 1xle s LYS 294 CO 0.18 -0.31 1.82 -2.30 -0.92 0.00 0.00 175.35 173.82 1xle n PRO 295 N 5.18 2.74 -1.53 -1.68 -0.02 -1.26 -4.64 135.00 133.79 1xle n PRO 295 Ca -0.06 1.00 -0.41 0.00 -2.02 0.00 0.00 63.50 62.00 1xle n PRO 295 Cb 0.50 -2.88 0.01 0.00 -0.02 0.00 0.00 33.50 31.11 1xle n PRO 295 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1xle n SER 296 N 5.38 0.08 0.00 2.55 7.64 -1.26 -4.86 113.62 123.15 1xle n SER 296 Ca 0.18 0.95 0.06 0.00 1.01 0.00 0.00 58.87 61.08 1xle n SER 296 Cb 0.36 -1.23 0.30 0.00 -1.01 0.00 0.00 64.21 62.64 1xle n SER 296 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1xle n ARG 297 N 0.31 0.12 0.19 1.43 1.85 -1.26 -3.07 116.66 116.22 1xle n ARG 297 Ca 0.11 0.21 0.07 0.00 -1.00 0.00 0.00 57.85 57.24 1xle n ARG 297 Cb 0.40 -1.50 0.20 0.00 -1.05 0.00 0.00 32.46 30.51 1xle n ARG 297 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 1xle h THR 298 N 0.00 0.55 -3.10 8.89 1.35 -1.99 -3.45 112.91 115.16 1xle h THR 298 Ca 0.00 -1.58 -0.59 0.00 -0.55 0.00 0.00 66.41 63.69 1xle h THR 298 Cb 0.15 2.11 -0.05 0.00 -1.73 0.00 0.00 68.15 68.64 1xle h THR 298 CO 0.00 0.29 -0.23 -1.81 -0.25 0.00 0.00 175.52 173.51 1xle s ASP 299 N -6.30 6.67 0.52 5.36 1.11 -1.17 -5.12 116.67 117.74 1xle s ASP 299 Ca 0.04 0.83 -0.00 0.00 0.18 0.00 0.00 52.55 53.59 1xle s ASP 299 Cb 0.08 -2.19 0.03 0.00 1.07 0.00 0.00 42.92 41.91 1xle s ASP 299 CO 0.69 0.19 0.22 0.61 1.18 0.00 0.00 175.17 178.07 1xle n GLY 300 N 1.05 0.53 0.33 0.21 0.00 -1.26 -4.84 105.19 101.21 1xle n GLY 300 Ca -0.09 -1.94 0.13 0.00 0.00 0.00 0.00 46.02 44.12 1xle n GLY 300 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1xle h TYR 301 N -0.51 0.10 -0.45 1.61 -1.99 -1.99 -1.22 116.97 112.52 1xle h TYR 301 Ca -0.07 0.00 0.02 0.00 2.00 0.00 0.00 58.73 60.68 1xle h TYR 301 Cb 0.26 -0.03 -0.03 0.00 2.00 0.00 0.00 36.73 38.93 1xle h TYR 301 CO 0.00 0.05 0.27 -0.44 -0.00 0.00 0.00 178.16 178.04 1xle h ASP 302 N 0.10 0.44 -0.89 3.88 3.32 -2.01 -1.82 116.42 119.43 1xle h ASP 302 Ca 0.15 0.00 0.13 0.00 0.02 0.00 0.00 57.03 57.33 1xle h ASP 302 Cb 0.49 -0.09 -0.07 0.00 0.22 0.00 0.00 39.33 39.87 1xle h ASP 302 CO -0.02 0.32 0.58 1.23 -1.72 0.00 0.00 179.24 179.63 1xle h GLY 303 N 0.55 1.25 0.98 2.75 0.00 -1.57 -2.35 103.07 104.68 1xle h GLY 303 Ca 0.18 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1xle h GLY 303 CO -0.08 0.12 0.13 -2.08 0.00 0.00 0.00 176.54 174.63 1xle h VAL 304 N 0.76 1.07 0.00 4.60 2.07 -1.14 -1.37 116.25 122.24 1xle h VAL 304 Ca 0.44 -0.16 -0.19 0.00 0.82 0.00 0.00 66.70 67.60 1xle h VAL 304 Cb 0.62 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1xle h VAL 304 CO -0.20 0.07 -0.86 -0.50 0.02 0.00 0.00 177.57 176.09 1xle h TRP 305 N 0.26 0.26 0.85 1.57 4.06 -1.41 -2.23 115.95 119.30 1xle h TRP 305 Ca 0.07 -0.14 -0.04 0.00 2.06 0.00 0.00 58.89 60.84 1xle h TRP 305 Cb 0.00 -0.03 -0.00 0.00 -1.00 0.00 0.00 29.16 28.13 1xle h TRP 305 CO -0.05 0.95 -0.49 -0.44 -3.56 0.00 0.00 178.44 174.84 1xle h ASP 306 N 0.10 -1.23 -0.94 -3.49 5.19 -1.37 0.05 116.42 114.73 1xle h ASP 306 Ca -0.04 0.06 0.09 0.00 -0.62 0.00 0.00 57.03 56.53 1xle h ASP 306 Cb 1.49 0.35 -0.07 0.00 0.18 0.00 0.00 39.33 41.27 1xle h ASP 306 CO 0.13 -0.77 0.58 0.77 -3.12 0.00 0.00 179.24 176.83 1xle h SER 307 N -1.25 0.88 -0.31 6.45 4.64 -1.26 0.52 113.55 123.22 1xle h SER 307 Ca -0.11 0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1xle h SER 307 Cb 0.99 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.92 1xle h SER 307 CO 0.13 0.51 0.18 0.00 -0.87 0.00 0.00 176.83 176.79 1xle h ALA 308 N 1.48 0.39 -0.03 5.18 0.00 -1.29 -2.16 119.26 122.82 1xle h ALA 308 Ca 0.44 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.31 1xle h ALA 308 Cb 0.34 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1xle h ALA 308 CO -0.23 -0.11 -0.02 -0.22 0.00 0.00 0.00 179.25 178.67 1xle h LYS 309 N 0.39 -0.02 -0.88 0.00 3.64 0.22 -2.87 116.57 117.04 1xle h LYS 309 Ca 0.11 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.60 1xle h LYS 309 Cb 0.01 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.77 1xle h LYS 309 CO -0.02 -0.02 0.57 0.00 -2.27 0.00 0.00 179.45 177.71 1xle h ALA 310 N 1.01 1.69 0.08 5.00 0.00 0.25 -1.73 119.26 125.56 1xle h ALA 310 Ca 0.02 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1xle h ALA 310 Cb 0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1xle h ALA 310 CO -0.05 0.11 -0.15 -0.91 0.00 0.00 0.00 179.25 178.26 1xle h ASN 311 N 0.83 -0.40 -0.16 0.00 2.35 -1.16 -0.09 115.58 116.94 1xle h ASN 311 Ca 0.42 0.05 -0.13 0.00 -0.55 0.00 0.00 56.30 56.09 1xle h ASN 311 Cb 0.48 0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.00 1xle h ASN 311 CO -0.18 -0.21 -0.33 0.24 -1.65 0.00 0.00 177.43 175.30 1xle h MET 312 N -0.28 0.66 -0.05 0.81 2.86 -1.53 -2.53 114.93 114.86 1xle h MET 312 Ca 0.02 -0.30 -0.00 0.00 -2.06 0.00 0.00 59.70 57.36 1xle h MET 312 Cb 0.30 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.95 1xle h MET 312 CO -0.09 0.90 0.03 1.03 1.06 0.00 0.00 176.91 179.84 1xle h SER 313 N 0.56 0.07 0.01 1.22 0.87 -1.23 -1.52 113.55 113.53 1xle h SER 313 Ca 0.06 -0.09 -0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1xle h SER 313 Cb 0.83 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.77 1xle h SER 313 CO 0.07 0.14 -0.01 0.24 -0.53 0.00 0.00 176.83 176.75 1xle h MET 314 N -0.01 -0.02 -0.29 2.24 2.07 -0.96 -1.93 114.93 116.02 1xle h MET 314 Ca 0.02 0.00 0.04 0.00 -2.07 0.00 0.00 59.70 57.69 1xle h MET 314 Cb 0.09 0.00 -0.04 0.00 -1.87 0.00 0.00 31.60 29.79 1xle h MET 314 CO -0.00 0.08 0.08 -0.92 1.07 0.00 0.00 176.91 177.22 1xle h TYR 315 N -0.12 0.13 -0.46 -0.22 5.03 -1.44 -1.67 116.97 118.23 1xle h TYR 315 Ca -0.00 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.29 1xle h TYR 315 Cb 0.11 -0.02 -0.02 0.00 1.55 0.00 0.00 36.73 38.35 1xle h TYR 315 CO -0.04 0.05 0.14 -0.07 -1.32 0.00 0.00 178.16 176.92 1xle h LEU 316 N 0.19 0.66 -0.58 2.82 3.38 -1.20 -0.77 115.31 119.82 1xle h LEU 316 Ca 0.13 -0.20 0.03 0.00 0.09 0.00 0.00 57.88 57.93 1xle h LEU 316 Cb 0.12 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 1xle h LEU 316 CO -0.16 0.69 0.34 -0.07 0.09 0.00 0.00 178.44 179.33 1xle h LEU 317 N 0.60 0.54 0.07 1.67 3.38 -1.23 -1.51 115.31 118.82 1xle h LEU 317 Ca 0.15 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 1xle h LEU 317 Cb 0.26 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1xle h LEU 317 CO -0.01 0.37 -0.03 -0.07 0.09 0.00 0.00 178.44 178.79 1xle h LEU 318 N 0.66 -0.08 -0.60 1.67 3.38 -1.20 -2.88 115.31 116.26 1xle h LEU 318 Ca 0.24 -0.28 0.12 0.00 0.09 0.00 0.00 57.88 58.05 1xle h LEU 318 Cb 0.06 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 40.74 1xle h LEU 318 CO -0.12 0.24 0.08 0.50 0.09 0.00 0.00 178.44 179.24 1xle h LYS 319 N -0.40 0.20 0.12 1.13 3.64 -0.88 0.15 116.57 120.52 1xle h LYS 319 Ca -0.01 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1xle h LYS 319 Cb 0.35 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1xle h LYS 319 CO 0.01 0.13 -0.18 1.49 -2.27 0.00 0.00 179.45 178.64 1xle h GLU 320 N 0.20 -0.34 -0.64 1.90 4.81 -1.26 -1.22 114.58 118.03 1xle h GLU 320 Ca 0.32 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.57 1xle h GLU 320 Cb 0.49 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 1xle h GLU 320 CO -0.44 -0.23 0.40 0.00 -0.73 0.00 0.00 179.01 178.01 1xle h ARG 321 N -0.36 0.86 -0.07 1.92 3.08 -1.22 -1.93 114.38 116.65 1xle h ARG 321 Ca 0.02 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 1xle h ARG 321 Cb 0.37 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 1xle h ARG 321 CO -0.09 0.60 -0.23 0.00 -1.07 0.00 0.00 179.97 179.17 1xle h ALA 322 N 1.21 1.49 0.06 0.04 0.00 -0.79 -2.02 119.26 119.25 1xle h ALA 322 Ca 0.23 -0.25 -0.27 0.00 0.00 0.00 0.00 54.91 54.62 1xle h ALA 322 Cb -0.05 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1xle h ALA 322 CO -0.05 0.37 -1.39 -0.07 0.00 0.00 0.00 179.25 178.12 1xle h LEU 323 N 0.11 0.21 -1.12 0.00 3.38 -1.16 -3.23 115.31 113.49 1xle h LEU 323 Ca 0.02 -0.28 -0.09 0.00 0.09 0.00 0.00 57.88 57.62 1xle h LEU 323 Cb 0.48 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1xle h LEU 323 CO 0.03 1.23 -0.33 0.00 0.09 0.00 0.00 178.44 179.47 1xle h ALA 324 N 0.74 1.26 -0.16 1.53 0.00 -1.05 -2.84 119.26 118.74 1xle h ALA 324 Ca -0.18 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.33 1xle h ALA 324 Cb 1.94 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.64 1xle h ALA 324 CO 0.14 0.51 -0.12 0.35 0.00 0.00 0.00 179.25 180.12 1xle h PHE 325 N 0.17 0.43 0.00 0.00 3.57 -1.48 -2.55 116.94 117.08 1xle h PHE 325 Ca 0.02 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.40 1xle h PHE 325 Cb 0.67 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.32 1xle h PHE 325 CO 0.01 0.72 -0.37 0.00 -2.23 0.00 0.00 178.31 176.44 1xle h ARG 326 N 0.02 0.00 0.01 1.11 2.47 -1.57 -3.19 114.38 113.22 1xle h ARG 326 Ca 0.03 0.00 -0.20 0.00 -1.26 0.00 0.00 59.98 58.55 1xle h ARG 326 Cb 0.63 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.93 1xle h ARG 326 CO 0.03 0.00 -0.96 0.00 0.56 0.00 0.00 179.97 179.60 1xle h ALA 327 N 2.23 0.42 -2.25 0.04 0.00 -1.55 -3.45 119.26 114.71 1xle h ALA 327 Ca 0.00 -0.85 -0.55 0.00 0.00 0.00 0.00 54.91 53.51 1xle h ALA 327 Cb 0.88 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1xle h ALA 327 CO 0.00 1.15 1.14 0.34 0.00 0.00 0.00 179.25 181.89 1xle s ASP 328 N -6.77 6.53 0.28 0.00 -1.08 -0.96 -4.92 116.67 109.75 1xle s ASP 328 Ca 0.00 2.26 0.02 0.00 -0.52 0.00 0.00 52.55 54.31 1xle s ASP 328 Cb 0.10 -2.53 0.58 0.00 -1.46 0.00 0.00 42.92 39.61 1xle s ASP 328 CO 0.82 -1.04 1.80 -0.65 0.52 0.00 0.00 175.17 176.62 1xle h PRO 329 N 10.16 0.83 -0.58 4.34 0.11 -1.89 -0.90 132.00 144.07 1xle h PRO 329 Ca -0.41 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 1xle h PRO 329 Cb 1.19 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.09 1xle h PRO 329 CO 0.96 0.55 0.25 1.49 -0.21 0.00 0.00 178.00 181.03 1xle h GLU 330 N 0.85 0.85 -0.30 1.05 4.57 -1.95 -0.17 114.58 119.49 1xle h GLU 330 Ca 0.50 -0.14 -0.08 0.00 -1.18 0.00 0.00 59.36 58.46 1xle h GLU 330 Cb 0.62 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 1xle h GLU 330 CO -0.31 0.72 -0.15 0.28 -1.18 0.00 0.00 179.01 178.37 1xle h VAL 331 N 0.79 1.29 -0.58 0.32 2.07 -1.64 -2.04 116.25 116.47 1xle h VAL 331 Ca 0.20 -1.25 -0.05 0.00 0.82 0.00 0.00 66.70 66.42 1xle h VAL 331 Cb 0.17 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 1xle h VAL 331 CO -0.02 0.40 0.17 1.56 0.02 0.00 0.00 177.57 179.70 1xle h GLN 332 N 0.37 0.87 0.15 1.57 1.08 -0.90 -2.32 115.11 115.93 1xle h GLN 332 Ca 0.07 -0.17 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 1xle h GLN 332 Cb 0.67 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 1xle h GLN 332 CO 0.04 0.76 -0.07 1.49 -0.95 0.00 0.00 178.83 180.10 1xle h GLU 333 N 0.84 -0.19 -0.82 1.46 4.81 -0.86 -2.65 114.58 117.17 1xle h GLU 333 Ca 0.19 0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.54 1xle h GLU 333 Cb 0.26 0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.60 1xle h GLU 333 CO -0.01 -0.08 0.46 0.00 -0.73 0.00 0.00 179.01 178.65 1xle h ALA 334 N 0.59 1.19 -0.78 2.92 0.00 -1.21 -1.05 119.26 120.93 1xle h ALA 334 Ca -0.02 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1xle h ALA 334 Cb 0.20 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1xle h ALA 334 CO 0.03 0.06 0.52 0.52 0.00 0.00 0.00 179.25 180.38 1xle h MET 335 N 0.76 1.03 -0.06 0.00 2.86 -1.30 -1.07 114.93 117.15 1xle h MET 335 Ca 0.41 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.94 1xle h MET 335 Cb 0.41 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.84 1xle h MET 335 CO -0.27 0.68 -0.14 -0.22 1.06 0.00 0.00 176.91 178.02 1xle h LYS 336 N 1.06 0.19 -0.77 1.72 3.11 -0.95 0.36 116.57 121.30 1xle h LYS 336 Ca 0.29 -0.13 0.09 0.00 -2.81 0.00 0.00 60.65 58.09 1xle h LYS 336 Cb -0.12 0.02 -0.07 0.00 -1.00 0.00 0.00 32.23 31.06 1xle h LYS 336 CO -0.06 0.74 0.42 1.15 -2.81 0.00 0.00 179.45 178.88 1xle h THR 337 N -0.32 0.89 0.00 1.00 2.02 -0.97 -2.10 112.91 113.42 1xle h THR 337 Ca -0.00 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.94 1xle h THR 337 Cb 0.74 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1xle h THR 337 CO 0.03 0.13 0.00 -1.20 0.37 0.00 0.00 175.52 174.85 1xle n SER 338 N -4.79 0.02 0.00 4.18 7.64 -0.43 -4.88 113.62 115.36 1xle n SER 338 Ca 0.12 0.50 0.00 0.00 1.01 0.00 0.00 58.87 60.50 1xle n SER 338 Cb 0.26 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 1xle n SER 338 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xle n GLY 339 N 1.06 0.71 0.10 0.23 0.00 -0.79 -4.95 105.19 101.55 1xle n GLY 339 Ca 0.06 -0.12 -0.09 0.00 0.00 0.00 0.00 46.02 45.87 1xle n GLY 339 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1xle h VAL 340 N 0.00 0.86 -0.09 1.61 2.07 -1.14 -1.20 116.25 118.36 1xle h VAL 340 Ca 0.00 -0.02 -0.15 0.00 0.82 0.00 0.00 66.70 67.35 1xle h VAL 340 Cb 0.00 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 1xle h VAL 340 CO 0.00 0.01 -0.59 -0.26 0.02 0.00 0.00 177.57 176.75 1xle h PHE 341 N 0.05 0.39 -0.50 1.57 0.04 -1.86 -3.18 116.94 113.45 1xle h PHE 341 Ca 0.09 -0.15 0.08 0.00 2.80 0.00 0.00 57.97 60.79 1xle h PHE 341 Cb 0.11 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 1xle h PHE 341 CO -0.18 0.82 0.34 0.93 -0.60 0.00 0.00 178.31 179.63 1xle h GLU 342 N 0.23 0.33 -0.85 1.51 5.08 -1.77 -2.16 114.58 116.96 1xle h GLU 342 Ca -0.00 -0.02 0.11 0.00 -1.00 0.00 0.00 59.36 58.45 1xle h GLU 342 Cb 1.10 -0.07 -0.08 0.00 0.50 0.00 0.00 28.75 30.20 1xle h GLU 342 CO 0.10 0.22 0.48 1.25 -1.00 0.00 0.00 179.01 180.05 1xle h LEU 343 N 0.34 0.66 0.00 1.33 5.85 -1.21 -2.92 115.31 119.35 1xle h LEU 343 Ca 0.23 0.06 0.00 0.00 0.84 0.00 0.00 57.88 59.01 1xle h LEU 343 Cb 0.45 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1xle h LEU 343 CO -0.05 0.35 0.00 0.61 -0.34 0.00 0.00 178.44 179.01 1xle n GLY 344 N -1.32 -0.72 3.65 3.75 0.00 -0.81 -4.70 105.19 105.03 1xle n GLY 344 Ca 0.15 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1xle n GLY 344 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xle s GLU 345 N -2.76 4.19 0.61 1.61 2.02 -1.11 -5.04 118.70 118.22 1xle s GLU 345 Ca 0.08 1.04 -0.18 0.00 0.02 0.00 0.00 54.97 55.93 1xle s GLU 345 Cb 0.07 -3.65 -0.06 0.00 0.10 0.00 0.00 34.13 30.59 1xle s GLU 345 CO 0.17 -0.57 0.76 0.25 0.02 0.00 0.00 175.26 175.88 1xle n THR 346 N 5.32 3.02 0.06 3.63 -2.24 -1.26 -4.92 114.28 117.89 1xle n THR 346 Ca 0.07 -0.49 -0.21 0.00 -2.27 0.00 0.00 64.05 61.16 1xle n THR 346 Cb 0.47 -0.93 -0.13 0.00 -2.10 0.00 0.00 70.33 67.64 1xle n THR 346 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1xle h THR 347 N 0.26 1.38 -3.72 4.28 2.02 -1.96 -3.44 112.91 111.73 1xle h THR 347 Ca -0.47 -2.41 -0.47 0.00 0.77 0.00 0.00 66.41 63.83 1xle h THR 347 Cb 1.38 2.84 0.06 0.00 -1.74 0.00 0.00 68.15 70.69 1xle h THR 347 CO 0.48 0.71 0.20 -0.76 0.37 0.00 0.00 175.52 176.52 1xle s LEU 348 N -7.97 3.13 0.25 2.58 1.43 -1.26 -5.08 118.68 111.76 1xle s LEU 348 Ca -0.11 0.69 -0.01 0.00 -1.03 0.00 0.00 54.13 53.66 1xle s LEU 348 Cb 0.04 -3.48 -0.04 0.00 0.03 0.00 0.00 46.19 42.74 1xle s LEU 348 CO 0.88 -1.19 0.46 0.20 0.23 0.00 0.00 176.35 176.93 1xle s ASN 349 N -4.35 6.37 -0.14 2.29 0.01 -1.26 -5.00 114.94 112.87 1xle s ASN 349 Ca 0.55 0.46 -0.37 0.00 -0.71 0.00 0.00 52.86 52.79 1xle s ASN 349 Cb -0.11 -2.03 -0.14 0.00 0.41 0.00 0.00 41.25 39.38 1xle s ASN 349 CO 0.45 -0.13 1.73 0.00 -1.51 0.00 0.00 177.10 177.65 1xle n ALA 350 N -1.01 0.22 -3.56 0.60 0.00 -1.26 -1.90 120.51 113.61 1xle n ALA 350 Ca -0.04 0.37 -0.26 0.00 0.00 0.00 0.00 53.44 53.50 1xle n ALA 350 Cb 0.54 -2.31 0.05 0.00 0.00 0.00 0.00 19.45 17.73 1xle n ALA 350 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xle n GLY 351 N 4.02 -1.06 3.27 0.00 0.00 -1.26 -5.00 105.19 105.16 1xle n GLY 351 Ca 0.23 0.49 -0.32 0.00 0.00 0.00 0.00 46.02 46.43 1xle n GLY 351 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xle s GLU 352 N -5.44 2.77 0.38 1.61 2.12 -0.80 -5.14 118.70 114.20 1xle s GLU 352 Ca 0.43 -0.87 0.06 0.00 0.36 0.00 0.00 54.97 54.95 1xle s GLU 352 Cb -0.13 -2.25 0.06 0.00 0.26 0.00 0.00 34.13 32.07 1xle s GLU 352 CO 0.83 0.32 0.53 -1.13 -0.54 0.00 0.00 175.26 175.27 1xle n SER 353 N 3.14 1.36 0.36 -1.70 3.41 -1.26 -4.81 113.62 114.12 1xle n SER 353 Ca -0.18 -1.99 -0.19 0.00 -0.26 0.00 0.00 58.87 56.25 1xle n SER 353 Cb 0.52 -0.29 -0.10 0.00 -0.26 0.00 0.00 64.21 64.09 1xle n SER 353 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xle h ALA 354 N 0.21 -1.19 -0.64 7.33 0.00 -2.00 -2.66 119.26 120.30 1xle h ALA 354 Ca -0.18 -0.22 0.13 0.00 0.00 0.00 0.00 54.91 54.64 1xle h ALA 354 Cb 0.82 0.67 -0.12 0.00 0.00 0.00 0.00 17.79 19.15 1xle h ALA 354 CO 0.25 -1.20 -0.16 0.00 0.00 0.00 0.00 179.25 178.14 1xle h ALA 355 N -0.99 0.42 -0.92 0.00 0.00 -1.99 0.11 119.26 115.89 1xle h ALA 355 Ca -0.08 0.25 0.13 0.00 0.00 0.00 0.00 54.91 55.21 1xle h ALA 355 Cb 0.92 0.49 -0.07 0.00 0.00 0.00 0.00 17.79 19.12 1xle h ALA 355 CO 0.02 -0.42 0.59 -0.44 0.00 0.00 0.00 179.25 178.99 1xle h ASP 356 N -0.00 0.75 -0.01 0.00 3.32 -1.92 -2.48 116.42 116.08 1xle h ASP 356 Ca 0.31 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.39 1xle h ASP 356 Cb 0.47 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1xle h ASP 356 CO -0.66 0.39 -0.04 0.25 -1.72 0.00 0.00 179.24 177.47 1xle h LEU 357 N 0.80 0.05 -1.34 1.55 5.85 -0.47 0.68 115.31 122.43 1xle h LEU 357 Ca 0.46 -0.67 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 1xle h LEU 357 Cb 0.61 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 1xle h LEU 357 CO -0.22 0.70 0.33 0.24 -0.34 0.00 0.00 178.44 179.16 1xle h MET 358 N -0.61 0.78 0.02 1.25 0.00 -1.21 -1.64 114.93 113.52 1xle h MET 358 Ca -0.00 -0.07 -0.25 0.00 0.00 0.00 0.00 59.70 59.37 1xle h MET 358 Cb 0.70 -0.16 0.01 0.00 0.00 0.00 0.00 31.60 32.15 1xle h MET 358 CO 0.01 0.56 -1.03 -0.97 0.00 0.00 0.00 176.91 175.47 1xle h ASN 359 N 0.79 0.75 -2.21 1.22 -0.00 -1.56 -3.45 115.58 111.13 1xle h ASN 359 Ca 0.21 -0.61 -0.56 0.00 -0.00 0.00 0.00 56.30 55.33 1xle h ASN 359 Cb -0.01 -0.23 0.01 0.00 -0.00 0.00 0.00 38.32 38.09 1xle h ASN 359 CO -0.04 1.42 1.35 -0.62 -0.00 0.00 0.00 177.43 179.54 1xle s ASP 360 N -7.22 5.96 0.30 1.15 2.15 0.23 -4.86 116.67 114.38 1xle s ASP 360 Ca -0.08 2.23 0.00 0.00 0.43 0.00 0.00 52.55 55.13 1xle s ASP 360 Cb 0.08 -2.52 0.47 0.00 -0.30 0.00 0.00 42.92 40.65 1xle s ASP 360 CO 0.90 -1.51 1.88 -1.28 -0.17 0.00 0.00 175.17 174.99 1xle h SER 361 N 12.79 0.74 0.71 -0.34 0.87 -1.85 -2.68 113.55 123.80 1xle h SER 361 Ca -0.45 -0.10 -0.09 0.00 -1.23 0.00 0.00 61.79 59.93 1xle h SER 361 Cb 1.23 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.99 1xle h SER 361 CO 0.95 0.69 -0.41 0.00 -0.53 0.00 0.00 176.83 177.53 1xle h ALA 362 N 1.42 1.05 0.00 6.23 0.00 -1.89 1.16 119.26 127.24 1xle h ALA 362 Ca 0.19 -0.37 -0.18 0.00 0.00 0.00 0.00 54.91 54.55 1xle h ALA 362 Cb 0.19 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1xle h ALA 362 CO -0.01 0.51 -0.88 0.77 0.00 0.00 0.00 179.25 179.63 1xle h SER 363 N 0.00 0.00 0.00 0.00 0.02 -1.79 -3.33 113.55 108.45 1xle h SER 363 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1xle h SER 363 Cb 0.87 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1xle h SER 363 CO 0.05 0.83 0.00 0.33 -1.14 0.00 0.00 176.83 176.90 1xle n PHE 364 N -3.28 0.00 -0.31 3.45 7.35 -1.14 -4.75 117.46 118.77 1xle n PHE 364 Ca -0.00 0.00 0.13 0.00 -0.76 0.00 0.00 57.45 56.82 1xle n PHE 364 Cb 0.88 0.04 0.28 0.00 0.35 0.00 0.00 39.48 41.03 1xle n PHE 364 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1xle h ALA 365 N 0.00 1.19 -0.35 3.13 0.00 -1.76 -0.26 119.26 121.22 1xle h ALA 365 Ca 0.00 0.28 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 1xle h ALA 365 Cb 0.00 0.45 -0.07 0.00 0.00 0.00 0.00 17.79 18.16 1xle h ALA 365 CO 0.00 -0.53 -0.01 0.41 0.00 0.00 0.00 179.25 179.13 1xle n GLY 366 N -1.43 4.54 3.75 0.00 0.00 0.40 -5.01 105.19 107.44 1xle n GLY 366 Ca 0.22 -1.15 -0.40 0.00 0.00 0.00 0.00 46.02 44.69 1xle n GLY 366 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1xle s PHE 367 N -3.08 3.77 -0.97 1.61 5.36 -0.11 -4.78 117.98 119.77 1xle s PHE 367 Ca 0.44 1.79 -0.13 0.00 -0.96 0.00 0.00 56.93 58.06 1xle s PHE 367 Cb 0.38 -3.14 0.21 0.00 -0.34 0.00 0.00 43.02 40.14 1xle s PHE 367 CO 0.04 -0.08 1.01 0.34 -1.46 0.00 0.00 175.22 175.07 1xle s ASP 368 N -0.84 6.94 0.15 6.13 2.15 -1.26 -4.87 116.67 125.06 1xle s ASP 368 Ca 0.44 -2.87 -0.17 0.00 0.43 0.00 0.00 52.55 50.38 1xle s ASP 368 Cb -0.29 -2.27 0.03 0.00 -0.30 0.00 0.00 42.92 40.09 1xle s ASP 368 CO 0.36 -0.60 1.76 0.00 -0.17 0.00 0.00 175.17 176.52 1xle h ALA 369 N 7.58 0.39 -0.48 3.66 0.00 -1.96 0.18 119.26 128.62 1xle h ALA 369 Ca 0.16 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1xle h ALA 369 Cb 0.97 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1xle h ALA 369 CO 0.94 -0.24 0.23 0.93 0.00 0.00 0.00 179.25 181.11 1xle h GLU 370 N 0.30 0.70 -0.31 0.00 4.39 -1.99 -1.87 114.58 115.79 1xle h GLU 370 Ca 0.14 -0.10 -0.07 0.00 0.34 0.00 0.00 59.36 59.67 1xle h GLU 370 Cb 0.08 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 1xle h GLU 370 CO -0.12 0.59 -0.11 0.00 -1.16 0.00 0.00 179.01 178.21 1xle h ALA 371 N 1.07 1.23 -0.05 3.43 0.00 -1.80 -2.73 119.26 120.41 1xle h ALA 371 Ca 0.17 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 1xle h ALA 371 Cb 0.12 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1xle h ALA 371 CO -0.02 0.50 -0.46 0.00 0.00 0.00 0.00 179.25 179.27 1xle h ALA 372 N 1.40 1.14 0.00 0.00 0.00 -0.60 -2.96 119.26 118.24 1xle h ALA 372 Ca 0.09 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1xle h ALA 372 Cb 0.49 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1xle h ALA 372 CO 0.03 0.60 0.00 0.00 0.00 0.00 0.00 179.25 179.88 1xle n ALA 373 N -2.46 1.58 0.12 0.00 0.00 -0.74 -2.59 120.51 116.42 1xle n ALA 373 Ca -0.02 -0.03 -0.00 0.00 0.00 0.00 0.00 53.44 53.39 1xle n ALA 373 Cb 0.50 -1.23 0.06 0.00 0.00 0.00 0.00 19.45 18.78 1xle n ALA 373 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1xle h GLU 374 N 0.00 0.00 -6.14 0.00 5.08 -1.54 -3.46 114.58 108.52 1xle h GLU 374 Ca 0.00 0.00 -0.74 0.00 -1.00 0.00 0.00 59.36 57.62 1xle h GLU 374 Cb 0.23 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.53 1xle h GLU 374 CO 0.00 0.65 0.36 -2.13 -1.00 0.00 0.00 179.01 176.88 1xle n ARG 375 N -3.40 0.63 -2.95 2.33 0.63 -1.07 -4.90 116.66 107.92 1xle n ARG 375 Ca 0.00 0.23 -0.43 0.00 -0.92 0.00 0.00 57.85 56.73 1xle n ARG 375 Cb 0.74 -1.81 -0.05 0.00 0.45 0.00 0.00 32.46 31.79 1xle n ARG 375 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1xle s ASN 376 N 0.74 6.23 0.32 6.15 2.47 -1.26 -4.94 114.94 124.65 1xle s ASN 376 Ca 0.90 -0.85 0.06 0.00 0.42 0.00 0.00 52.86 53.38 1xle s ASN 376 Cb -1.12 -2.38 0.54 0.00 -1.45 0.00 0.00 41.25 36.83 1xle s ASN 376 CO 0.55 -1.21 1.78 -0.26 -3.72 0.00 0.00 177.10 174.23 1xle h PHE 377 N 9.31 0.38 -5.42 0.43 0.04 -1.90 -3.46 116.94 116.32 1xle h PHE 377 Ca -0.28 -0.07 -0.29 0.00 2.80 0.00 0.00 57.97 60.13 1xle h PHE 377 Cb 1.08 -0.10 0.17 0.00 2.20 0.00 0.00 35.95 39.30 1xle h PHE 377 CO 0.88 0.57 -0.76 0.00 -0.60 0.00 0.00 178.31 178.41 1xle n ALA 378 N -2.48 -2.05 0.04 2.45 0.00 -1.26 -3.90 120.51 113.31 1xle n ALA 378 Ca -0.01 -0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.32 1xle n ALA 378 Cb 0.38 -3.26 -0.13 0.00 0.00 0.00 0.00 19.45 16.43 1xle n ALA 378 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1xle h PHE 379 N -1.58 0.19 0.01 0.00 0.04 -1.96 -3.07 116.94 110.58 1xle h PHE 379 Ca -0.57 -0.14 0.02 0.00 2.80 0.00 0.00 57.97 60.08 1xle h PHE 379 Cb 1.31 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 39.43 1xle h PHE 379 CO 0.38 1.16 -0.11 0.82 -0.60 0.00 0.00 178.31 179.95 1xle h ILE 380 N 0.03 0.72 -0.76 -0.55 2.04 -1.99 -1.27 117.51 115.72 1xle h ILE 380 Ca -0.17 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 1xle h ILE 380 Cb 1.93 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 38.69 1xle h ILE 380 CO 0.13 0.00 0.36 -0.09 0.00 0.00 0.00 178.15 178.55 1xle h ARG 381 N -0.20 1.10 -0.71 2.37 2.43 -1.97 0.33 114.38 117.72 1xle h ARG 381 Ca 0.04 -0.16 -0.05 0.00 -0.81 0.00 0.00 59.98 59.00 1xle h ARG 381 Cb 0.24 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 1xle h ARG 381 CO -0.10 0.85 0.23 1.25 -1.51 0.00 0.00 179.97 180.69 1xle h LEU 382 N 1.09 1.02 -0.61 3.80 5.85 -1.36 -0.40 115.31 124.71 1xle h LEU 382 Ca 0.26 -0.20 -0.13 0.00 0.84 0.00 0.00 57.88 58.65 1xle h LEU 382 Cb 0.12 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1xle h LEU 382 CO -0.03 0.95 -0.33 -1.13 -0.34 0.00 0.00 178.44 177.56 1xle h ASN 383 N 1.04 0.77 -0.13 1.25 -1.24 -0.65 -1.23 115.58 115.40 1xle h ASN 383 Ca 0.23 -0.32 -0.01 0.00 0.71 0.00 0.00 56.30 56.91 1xle h ASN 383 Cb 0.29 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.12 1xle h ASN 383 CO -0.01 1.04 0.03 -0.61 -1.29 0.00 0.00 177.43 176.59 1xle h GLN 384 N 0.62 0.21 -0.19 6.67 5.75 -0.69 -0.94 115.11 126.53 1xle h GLN 384 Ca 0.07 -0.05 0.04 0.00 -0.15 0.00 0.00 58.65 58.55 1xle h GLN 384 Cb 0.86 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 29.35 1xle h GLN 384 CO 0.07 0.36 -0.03 -0.07 -2.65 0.00 0.00 178.83 176.52 1xle h LEU 385 N 0.02 -0.13 -0.22 -2.39 3.38 -0.90 -0.99 115.31 114.08 1xle h LEU 385 Ca 0.04 0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.12 1xle h LEU 385 Cb 0.24 0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.03 1xle h LEU 385 CO -0.00 -0.04 -0.20 0.00 0.09 0.00 0.00 178.44 178.29 1xle h ALA 386 N 1.18 -0.07 -0.70 1.53 0.00 -0.85 -2.37 119.26 117.97 1xle h ALA 386 Ca 0.09 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1xle h ALA 386 Cb 0.13 0.42 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 1xle h ALA 386 CO -0.18 -0.63 0.41 0.82 0.00 0.00 0.00 179.25 179.68 1xle h ILE 387 N -0.21 1.02 -0.69 0.00 1.08 -0.81 -0.65 117.51 117.25 1xle h ILE 387 Ca 0.13 -0.27 -0.00 0.00 -0.39 0.00 0.00 64.86 64.33 1xle h ILE 387 Cb 0.40 0.17 -0.03 0.00 -3.07 0.00 0.00 36.82 34.30 1xle h ILE 387 CO -0.34 0.14 0.41 -0.33 -0.69 0.00 0.00 178.15 177.34 1xle h GLU 388 N 0.78 0.93 -0.24 2.37 5.08 -0.96 -1.20 114.58 121.35 1xle h GLU 388 Ca 0.30 -0.08 -0.15 0.00 -1.00 0.00 0.00 59.36 58.44 1xle h GLU 388 Cb 0.12 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1xle h GLU 388 CO -0.15 0.65 -0.43 0.45 -1.00 0.00 0.00 179.01 178.53 1xle h HIS 389 N 0.95 0.88 -0.72 4.33 3.86 -0.85 -2.54 115.15 121.05 1xle h HIS 389 Ca 0.25 -0.31 0.03 0.00 -1.16 0.00 0.00 60.37 59.18 1xle h HIS 389 Cb -0.04 -0.17 -0.04 0.00 1.06 0.00 0.00 27.41 28.22 1xle h HIS 389 CO 0.00 1.09 0.48 1.25 0.86 0.00 0.00 177.93 181.61 1xle h LEU 390 N 0.42 0.77 0.00 2.43 5.85 -0.51 -2.50 115.31 121.77 1xle h LEU 390 Ca 0.01 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1xle h LEU 390 Cb 1.03 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.88 1xle h LEU 390 CO 0.10 0.53 -0.16 0.18 -0.34 0.00 0.00 178.44 178.75 1xle n LEU 391 N -4.45 0.33 -3.27 2.25 4.77 -0.51 -4.95 117.00 111.16 1xle n LEU 391 Ca 0.09 0.39 -0.19 0.00 -0.03 0.00 0.00 56.01 56.27 1xle n LEU 391 Cb 0.11 -0.38 0.08 0.00 -2.33 0.00 0.00 43.42 40.89 1xle n LEU 391 CO 0.35 -0.01 0.16 0.61 -1.33 0.00 0.00 177.39 177.17 1xle n GLY 392 N 1.45 -0.35 0.00 -0.72 0.00 -0.94 -4.90 105.19 99.73 1xle n GLY 392 Ca 0.06 0.11 0.10 0.00 0.00 0.00 0.00 46.02 46.29 1xle n GLY 392 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xle n SER 393 N -2.78 0.78 -0.26 1.61 3.41 -0.97 -5.06 113.62 110.36 1xle n SER 393 Ca -0.13 -0.73 0.03 0.00 -0.26 0.00 0.00 58.87 57.78 1xle n SER 393 Cb 0.61 1.23 0.03 0.00 -0.26 0.00 0.00 64.21 65.81 1xle n SER 393 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42