#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sxj n GLN 8 N 0.00 1.09 -1.35 3.23 6.02 -1.26 -5.11 117.38 119.99 1sxj n GLN 8 Ca 0.00 -2.30 -0.53 0.00 -0.01 0.00 0.00 57.00 54.17 1sxj n GLN 8 Cb 0.00 -0.85 -0.12 0.00 1.02 0.00 0.00 30.24 30.29 1sxj n GLN 8 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1sxj n LEU 9 N -0.02 0.72 -4.77 1.08 4.77 -1.26 -4.87 117.00 112.66 1sxj n LEU 9 Ca 0.06 0.48 -0.41 0.00 -0.03 0.00 0.00 56.01 56.11 1sxj n LEU 9 Cb 0.76 -0.94 -0.01 0.00 -2.33 0.00 0.00 43.42 40.89 1sxj n LEU 9 CO 0.06 -0.77 1.10 -2.84 -1.33 0.00 0.00 177.39 173.61 1sxj s PRO 10 N 7.03 4.21 0.55 3.23 0.02 -1.26 -4.81 135.00 143.98 1sxj s PRO 10 Ca 1.24 2.42 0.35 0.00 0.02 0.00 0.00 61.00 65.03 1sxj s PRO 10 Cb -1.35 -3.03 1.51 0.00 0.02 0.00 0.00 34.50 31.64 1sxj s PRO 10 CO 0.59 -0.43 2.03 -1.49 -0.33 0.00 0.00 177.00 177.37 1sxj h TRP 11 N 3.75 0.00 0.00 6.54 6.55 -1.94 0.66 115.95 131.51 1sxj h TRP 11 Ca -0.49 0.00 -0.05 0.00 0.95 0.00 0.00 58.89 59.30 1sxj h TRP 11 Cb 1.23 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.52 1sxj h TRP 11 CO 0.56 0.00 -0.23 -0.39 -1.05 0.00 0.00 178.44 177.33 1sxj h VAL 12 N 0.00 0.58 0.02 1.49 -1.51 -1.92 -1.06 116.25 113.85 1sxj h VAL 12 Ca 0.00 -1.11 -0.37 0.00 -1.23 0.00 0.00 66.70 63.98 1sxj h VAL 12 Cb 0.42 1.75 -0.05 0.00 -2.13 0.00 0.00 31.29 31.28 1sxj h VAL 12 CO 0.00 0.23 -2.11 1.21 -1.23 0.00 0.00 177.57 175.67 1sxj n GLU 13 N -3.42 0.62 -0.27 5.19 2.13 -0.70 -3.75 120.64 120.45 1sxj n GLU 13 Ca -0.00 0.32 -0.00 0.00 0.66 0.00 0.00 57.16 58.14 1sxj n GLU 13 Cb 0.42 -1.60 0.20 0.00 0.27 0.00 0.00 31.44 30.73 1sxj n GLU 13 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1sxj h LYS 14 N -0.63 1.11 -0.67 5.31 3.64 -0.90 -2.65 116.57 121.77 1sxj h LYS 14 Ca -0.54 -0.07 -0.35 0.00 -1.27 0.00 0.00 60.65 58.42 1sxj h LYS 14 Cb 1.66 -0.25 -0.21 0.00 -0.41 0.00 0.00 32.23 33.02 1sxj h LYS 14 CO -0.22 0.73 0.27 0.66 -2.27 0.00 0.00 179.45 178.62 1sxj n TYR 15 N -4.41 2.07 -2.36 1.91 4.02 -0.41 -4.98 117.16 113.01 1sxj n TYR 15 Ca 0.09 -1.76 -0.42 0.00 -0.01 0.00 0.00 57.90 55.80 1sxj n TYR 15 Cb 0.03 -0.73 -0.03 0.00 -0.02 0.00 0.00 39.34 38.59 1sxj n TYR 15 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 1sxj s ARG 16 N -3.29 4.33 -0.12 -0.72 3.52 -1.00 -4.92 118.95 116.73 1sxj s ARG 16 Ca 0.51 1.80 -0.38 0.00 -0.13 0.00 0.00 55.73 57.53 1sxj s ARG 16 Cb 0.44 -3.55 -0.15 0.00 -1.56 0.00 0.00 34.95 30.13 1sxj s ARG 16 CO 0.05 -0.49 1.64 -2.30 -0.81 0.00 0.00 175.30 173.39 1sxj n PRO 17 N 5.21 1.37 0.00 5.12 -0.02 -1.26 -4.84 135.00 140.58 1sxj n PRO 17 Ca 0.12 0.50 0.13 0.00 -2.02 0.00 0.00 63.50 62.22 1sxj n PRO 17 Cb 0.45 -2.20 0.22 0.00 -0.02 0.00 0.00 33.50 31.96 1sxj n PRO 17 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1sxj n GLN 18 N 4.64 1.95 -3.75 -0.52 6.02 -1.26 -4.91 117.38 119.55 1sxj n GLN 18 Ca 0.23 -1.48 -0.13 0.00 -0.01 0.00 0.00 57.00 55.60 1sxj n GLN 18 Cb 0.18 -1.47 -0.09 0.00 1.02 0.00 0.00 30.24 29.88 1sxj n GLN 18 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1sxj s VAL 19 N -2.08 0.05 0.50 5.09 -7.23 -1.26 -4.89 120.40 110.58 1sxj s VAL 19 Ca 0.30 -0.39 0.35 0.00 -1.81 0.00 0.00 61.98 60.42 1sxj s VAL 19 Cb 0.20 -0.61 0.55 0.00 0.56 0.00 0.00 36.38 37.09 1sxj s VAL 19 CO 0.35 -0.22 1.71 -0.07 -0.31 0.00 0.00 175.10 176.57 1sxj h LEU 20 N 4.09 0.13 -0.15 1.32 4.07 -1.91 -1.51 115.31 121.34 1sxj h LEU 20 Ca -0.29 0.04 0.02 0.00 0.08 0.00 0.00 57.88 57.74 1sxj h LEU 20 Cb 1.18 0.03 -0.02 0.00 1.08 0.00 0.00 40.66 42.92 1sxj h LEU 20 CO 0.38 -0.02 0.00 -1.28 -1.08 0.00 0.00 178.44 176.44 1sxj h SER 21 N 0.09 -0.06 0.26 -0.43 0.87 -1.98 -3.07 113.55 109.23 1sxj h SER 21 Ca 0.70 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 61.29 1sxj h SER 21 Cb 2.51 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 64.53 1sxj h SER 21 CO -0.14 -0.01 0.00 0.44 -0.53 0.00 0.00 176.83 176.59 1sxj h ASP 22 N 0.05 0.00 -2.95 6.23 3.32 -1.67 -3.44 116.42 117.96 1sxj h ASP 22 Ca 0.07 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.58 1sxj h ASP 22 Cb 0.08 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.64 1sxj h ASP 22 CO -0.12 0.00 0.78 -0.63 -1.72 0.00 0.00 179.24 177.55 1sxj s ILE 23 N -3.93 3.58 -0.40 0.35 1.09 -1.16 -4.86 121.20 115.87 1sxj s ILE 23 Ca -0.03 1.05 0.05 0.00 -1.10 0.00 0.00 60.65 60.62 1sxj s ILE 23 Cb 0.11 -3.67 0.44 0.00 -1.06 0.00 0.00 42.46 38.28 1sxj s ILE 23 CO 0.41 0.03 1.40 1.33 -0.10 0.00 0.00 174.94 178.02 1sxj n VAL 24 N 4.37 2.00 0.00 2.92 0.24 -1.26 -4.90 118.33 121.70 1sxj n VAL 24 Ca 0.12 -1.00 0.00 0.00 -2.04 0.00 0.00 64.34 61.43 1sxj n VAL 24 Cb 0.43 -0.54 0.00 0.00 -1.47 0.00 0.00 33.84 32.27 1sxj n VAL 24 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1sxj n GLY 25 N -0.07 -2.32 2.58 7.63 0.00 -1.26 -4.74 105.19 107.00 1sxj n GLY 25 Ca 0.27 -0.52 -0.32 0.00 0.00 0.00 0.00 46.02 45.45 1sxj n GLY 25 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1sxj n ASN 26 N 0.00 6.99 0.00 1.61 5.03 -1.26 -4.95 115.26 122.67 1sxj n ASN 26 Ca 0.00 -3.48 0.00 0.00 0.87 0.00 0.00 54.58 51.97 1sxj n ASN 26 Cb 0.00 -1.13 0.00 0.00 -1.02 0.00 0.00 39.78 37.63 1sxj n ASN 26 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 1sxj n LYS 27 N 0.13 0.00 -0.16 3.52 4.81 -1.26 -0.93 118.16 124.27 1sxj n LYS 27 Ca 0.50 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.90 1sxj n LYS 27 Cb 0.45 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.46 1sxj n LYS 27 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1sxj n GLU 28 N 0.00 -0.17 -0.19 1.64 -0.58 -1.26 -0.64 120.64 119.44 1sxj n GLU 28 Ca 0.00 0.85 -0.07 0.00 -0.42 0.00 0.00 57.16 57.51 1sxj n GLU 28 Cb 0.00 -1.26 0.02 0.00 -0.57 0.00 0.00 31.44 29.64 1sxj n GLU 28 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 1sxj h THR 29 N 0.00 1.20 -0.76 2.62 2.02 -1.43 -2.72 112.91 113.83 1sxj h THR 29 Ca 0.06 -0.54 0.04 0.00 0.77 0.00 0.00 66.41 66.73 1sxj h THR 29 Cb 0.16 0.55 -0.05 0.00 -1.74 0.00 0.00 68.15 67.07 1sxj h THR 29 CO -0.37 0.22 0.48 0.40 0.37 0.00 0.00 175.52 176.62 1sxj h ILE 30 N 0.74 1.10 -0.96 3.11 1.08 -1.11 -1.08 117.51 120.38 1sxj h ILE 30 Ca 0.19 -0.32 0.01 0.00 -0.39 0.00 0.00 64.86 64.35 1sxj h ILE 30 Cb 0.10 0.09 -0.05 0.00 -3.07 0.00 0.00 36.82 33.90 1sxj h ILE 30 CO -0.03 0.17 0.62 0.44 -0.69 0.00 0.00 178.15 178.66 1sxj h ASP 31 N 0.92 1.11 -0.93 1.72 3.32 -0.71 0.22 116.42 122.08 1sxj h ASP 31 Ca 0.31 -0.04 0.14 0.00 0.02 0.00 0.00 57.03 57.46 1sxj h ASP 31 Cb 0.04 -0.28 -0.09 0.00 0.22 0.00 0.00 39.33 39.22 1sxj h ASP 31 CO -0.12 0.82 0.54 -0.09 -1.72 0.00 0.00 179.24 178.67 1sxj h ARG 32 N 1.31 0.78 -0.20 3.56 9.65 -0.92 0.12 114.38 128.69 1sxj h ARG 32 Ca 0.35 -0.05 -0.12 0.00 -1.10 0.00 0.00 59.98 59.06 1sxj h ARG 32 Cb -0.13 -0.18 0.00 0.00 -1.39 0.00 0.00 29.97 28.28 1sxj h ARG 32 CO -0.07 0.52 -0.35 -0.07 2.80 0.00 0.00 179.97 182.79 1sxj h LEU 33 N 0.80 0.65 -1.01 3.80 3.38 -0.10 -2.73 115.31 120.11 1sxj h LEU 33 Ca 0.49 -0.54 0.19 0.00 0.09 0.00 0.00 57.88 58.11 1sxj h LEU 33 Cb 0.60 -0.19 -0.11 0.00 0.09 0.00 0.00 40.66 41.06 1sxj h LEU 33 CO -0.31 1.06 0.61 1.56 0.09 0.00 0.00 178.44 181.45 1sxj h GLN 34 N 0.26 0.75 -0.37 1.13 1.08 0.17 0.91 115.11 119.03 1sxj h GLN 34 Ca 0.01 -0.04 -0.16 0.00 -1.45 0.00 0.00 58.65 57.00 1sxj h GLN 34 Cb 0.94 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 28.20 1sxj h GLN 34 CO 0.08 0.49 -0.41 1.96 -0.95 0.00 0.00 178.83 180.00 1sxj h GLN 35 N 0.77 0.92 0.00 1.46 1.08 -0.85 -2.52 115.11 115.97 1sxj h GLN 35 Ca 0.58 -0.50 -0.04 0.00 -1.45 0.00 0.00 58.65 57.24 1sxj h GLN 35 Cb 0.90 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.35 1sxj h GLN 35 CO -0.38 1.15 -0.19 0.82 -0.95 0.00 0.00 178.83 179.28 1sxj h ILE 36 N 0.74 0.75 -0.11 2.54 1.08 -0.76 -1.06 117.51 120.69 1sxj h ILE 36 Ca 0.05 -0.79 -0.12 0.00 -0.39 0.00 0.00 64.86 63.61 1sxj h ILE 36 Cb 1.01 1.48 -0.01 0.00 -3.07 0.00 0.00 36.82 36.23 1sxj h ILE 36 CO 0.10 0.19 -0.48 0.00 -0.69 0.00 0.00 178.15 177.27 1sxj h ALA 37 N 1.81 0.98 0.20 1.87 0.00 -0.49 -2.45 119.26 121.17 1sxj h ALA 37 Ca -0.00 -0.46 -0.33 0.00 0.00 0.00 0.00 54.91 54.12 1sxj h ALA 37 Cb 0.47 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.19 1sxj h ALA 37 CO 0.03 0.65 -1.51 0.87 0.00 0.00 0.00 179.25 179.28 1sxj h LYS 38 N 0.22 0.42 0.00 0.00 1.57 -0.97 -3.40 116.57 114.40 1sxj h LYS 38 Ca 0.01 -0.71 0.00 0.00 -1.87 0.00 0.00 60.65 58.08 1sxj h LYS 38 Cb 0.94 0.26 0.00 0.00 0.08 0.00 0.00 32.23 33.51 1sxj h LYS 38 CO 0.08 1.32 0.00 -0.25 -0.57 0.00 0.00 179.45 180.03 1sxj n ASP 39 N -3.61 0.00 0.00 0.86 10.43 -0.49 -5.07 116.55 118.67 1sxj n ASP 39 Ca -0.17 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.19 1sxj n ASP 39 Cb 1.08 0.00 0.00 0.00 1.84 0.00 0.00 41.12 44.04 1sxj n ASP 39 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1sxj n GLY 40 N 3.16 -0.64 2.42 0.44 0.00 -0.93 -4.74 105.19 104.90 1sxj n GLY 40 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1sxj n GLY 40 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1sxj n ASN 41 N 0.00 7.91 -4.63 1.61 5.03 -1.25 -4.37 115.26 119.56 1sxj n ASN 41 Ca 0.00 -3.00 -0.43 0.00 0.87 0.00 0.00 54.58 52.03 1sxj n ASN 41 Cb 0.00 -1.39 -0.03 0.00 -1.02 0.00 0.00 39.78 37.34 1sxj n ASN 41 CO 0.00 0.00 0.00 -0.32 -1.83 0.00 0.00 177.26 175.11 1sxj s MET 42 N -0.41 3.82 0.71 3.52 1.75 -1.26 -4.99 119.30 122.44 1sxj s MET 42 Ca 0.59 1.76 -0.11 0.00 -1.25 0.00 0.00 55.69 56.67 1sxj s MET 42 Cb 0.21 -4.05 0.02 0.00 2.84 0.00 0.00 34.83 33.85 1sxj s MET 42 CO -0.10 -1.27 1.08 -1.25 -0.65 0.00 0.00 175.02 172.83 1sxj s PRO 43 N 4.67 2.82 0.63 4.11 0.04 -1.26 -4.90 135.00 141.11 1sxj s PRO 43 Ca 0.73 0.60 -0.18 0.00 0.04 0.00 0.00 61.00 62.19 1sxj s PRO 43 Cb -0.27 -2.00 -0.02 0.00 0.04 0.00 0.00 34.50 32.25 1sxj s PRO 43 CO 0.30 -1.10 1.26 -1.01 0.04 0.00 0.00 177.00 176.49 1sxj s HIS 44 N -3.25 2.19 -0.01 0.56 3.76 -1.26 -4.76 115.29 112.52 1sxj s HIS 44 Ca 0.58 1.50 -0.19 0.00 -0.15 0.00 0.00 55.06 56.80 1sxj s HIS 44 Cb -0.12 -3.61 0.04 0.00 1.11 0.00 0.00 32.58 30.00 1sxj s HIS 44 CO 0.53 -2.65 0.42 0.00 -0.85 0.00 0.00 174.74 172.19 1sxj s MET 45 N -3.38 0.82 -0.27 1.40 0.23 -0.19 -0.66 119.30 117.25 1sxj s MET 45 Ca 0.80 -0.12 0.01 0.00 -1.03 0.00 0.00 55.69 55.35 1sxj s MET 45 Cb -0.35 0.37 0.06 0.00 -1.53 0.00 0.00 34.83 33.38 1sxj s MET 45 CO 0.37 -0.25 -0.07 0.42 -2.03 0.00 0.00 175.02 173.46 1sxj s ILE 46 N -1.55 2.47 -0.38 3.16 1.01 0.82 -0.04 121.20 126.68 1sxj s ILE 46 Ca -0.11 -1.53 -0.16 0.00 0.00 0.00 0.00 60.65 58.85 1sxj s ILE 46 Cb -0.03 -2.43 0.01 0.00 0.01 0.00 0.00 42.46 40.02 1sxj s ILE 46 CO 0.04 -0.04 0.38 -0.63 0.00 0.00 0.00 174.94 174.69 1sxj s ILE 47 N 1.16 5.15 0.19 2.92 1.09 0.15 -0.98 121.20 130.87 1sxj s ILE 47 Ca -0.07 -0.22 0.11 0.00 -1.10 0.00 0.00 60.65 59.37 1sxj s ILE 47 Cb -0.20 -3.93 -0.04 0.00 -1.06 0.00 0.00 42.46 37.23 1sxj s ILE 47 CO -0.04 -0.26 -0.23 -0.94 -0.10 0.00 0.00 174.94 173.37 1sxj s SER 48 N 1.76 3.29 0.00 3.58 1.04 -0.81 -2.10 113.70 120.45 1sxj s SER 48 Ca 0.11 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 55.67 1sxj s SER 48 Cb -0.17 -0.24 0.00 0.00 0.10 0.00 0.00 66.02 65.71 1sxj s SER 48 CO 0.12 0.09 0.00 0.61 0.98 0.00 0.00 173.24 175.04 1sxj n GLY 49 N 0.27 0.92 3.55 7.32 0.00 -0.93 -0.86 105.19 115.45 1sxj n GLY 49 Ca -0.13 -1.05 -0.29 0.00 0.00 0.00 0.00 46.02 44.56 1sxj n GLY 49 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1sxj s MET 50 N -2.00 -0.40 0.35 1.61 -1.94 -1.26 -4.15 119.30 111.51 1sxj s MET 50 Ca 0.00 0.93 -0.29 0.00 -1.71 0.00 0.00 55.69 54.63 1sxj s MET 50 Cb 0.00 -1.61 -0.11 0.00 2.01 0.00 0.00 34.83 35.12 1sxj s MET 50 CO 0.00 -3.41 1.51 -2.14 -0.01 0.00 0.00 175.02 170.98 1sxj s PRO 51 N -4.56 4.12 -1.44 2.03 0.02 -1.26 -4.01 135.00 129.91 1sxj s PRO 51 Ca 0.68 2.56 -0.10 0.00 0.02 0.00 0.00 61.00 64.16 1sxj s PRO 51 Cb -0.24 -2.99 0.04 0.00 0.02 0.00 0.00 34.50 31.33 1sxj s PRO 51 CO 0.63 -0.55 1.01 0.41 -0.33 0.00 0.00 177.00 178.17 1sxj n GLY 52 N 0.98 -0.53 0.64 0.52 0.00 -1.26 -4.64 105.19 100.90 1sxj n GLY 52 Ca 0.03 0.21 0.08 0.00 0.00 0.00 0.00 46.02 46.35 1sxj n GLY 52 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1sxj n ILE 53 N -4.80 0.00 0.00 -0.61 -6.64 -1.26 -1.68 119.36 104.38 1sxj n ILE 53 Ca 0.00 -0.49 0.00 0.00 -1.77 0.00 0.00 62.75 60.50 1sxj n ILE 53 Cb 0.56 1.33 0.00 0.00 -1.44 0.00 0.00 39.64 40.09 1sxj n ILE 53 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1sxj n GLY 54 N 0.96 1.55 0.05 3.28 0.00 -1.26 -4.67 105.19 105.09 1sxj n GLY 54 Ca 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.11 1sxj n GLY 54 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sxj h LYS 55 N 0.00 0.00 -0.81 1.61 1.57 -1.93 -2.26 116.57 114.75 1sxj h LYS 55 Ca 0.00 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.88 1sxj h LYS 55 Cb 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.25 1sxj h LYS 55 CO 0.00 0.00 0.53 1.15 -0.57 0.00 0.00 179.45 180.56 1sxj h THR 56 N -0.87 0.94 0.67 -0.16 2.02 -1.97 -0.56 112.91 112.97 1sxj h THR 56 Ca 0.00 -0.26 -0.03 0.00 0.77 0.00 0.00 66.41 66.89 1sxj h THR 56 Cb 0.09 0.13 0.01 0.00 -1.74 0.00 0.00 68.15 66.64 1sxj h THR 56 CO 0.00 0.14 -0.32 0.74 0.37 0.00 0.00 175.52 176.44 1sxj h THR 57 N 0.75 0.29 -0.68 3.16 2.02 -1.95 -2.93 112.91 113.56 1sxj h THR 57 Ca 0.38 -0.13 0.06 0.00 0.77 0.00 0.00 66.41 67.49 1sxj h THR 57 Cb 0.47 0.33 -0.09 0.00 -1.74 0.00 0.00 68.15 67.13 1sxj h THR 57 CO -0.15 0.02 -0.44 -1.28 0.37 0.00 0.00 175.52 174.03 1sxj h SER 58 N -1.00 -1.61 -0.57 4.18 0.87 -0.51 -0.77 113.55 114.14 1sxj h SER 58 Ca -0.09 0.24 0.06 0.00 -1.23 0.00 0.00 61.79 60.76 1sxj h SER 58 Cb 0.72 0.70 -0.05 0.00 -0.44 0.00 0.00 62.40 63.33 1sxj h SER 58 CO 0.15 -0.20 0.28 1.62 -0.53 0.00 0.00 176.83 178.16 1sxj h VAL 59 N -0.05 0.93 -0.22 2.23 3.04 -1.31 -0.35 116.25 120.52 1sxj h VAL 59 Ca 0.11 -0.18 -0.04 0.00 -1.01 0.00 0.00 66.70 65.58 1sxj h VAL 59 Cb 0.33 0.35 -0.01 0.00 -2.01 0.00 0.00 31.29 29.95 1sxj h VAL 59 CO -0.67 0.10 -0.02 0.45 -1.01 0.00 0.00 177.57 176.41 1sxj h HIS 60 N 0.54 0.33 -0.16 3.17 3.86 -1.18 0.11 115.15 121.82 1sxj h HIS 60 Ca 0.26 -0.02 -0.19 0.00 -1.16 0.00 0.00 60.37 59.26 1sxj h HIS 60 Cb 0.19 -0.10 -0.00 0.00 1.06 0.00 0.00 27.41 28.56 1sxj h HIS 60 CO -0.11 0.36 -0.67 0.00 0.86 0.00 0.00 177.93 178.38 1sxj h LEU 62 N 0.45 0.98 -0.46 0.00 5.85 -0.33 -2.83 115.31 118.98 1sxj h LEU 62 Ca -0.02 -0.26 0.07 0.00 0.84 0.00 0.00 57.88 58.51 1sxj h LEU 62 Cb 1.25 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.96 1sxj h LEU 62 CO 0.13 1.02 0.11 0.00 -0.34 0.00 0.00 178.44 179.37 1sxj h ALA 63 N 1.08 0.52 0.47 1.25 0.00 -0.60 -2.81 119.26 119.18 1sxj h ALA 63 Ca 0.17 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1sxj h ALA 63 Cb 0.51 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1sxj h ALA 63 CO 0.02 -0.29 -0.23 0.45 0.00 0.00 0.00 179.25 179.21 1sxj h HIS 64 N 0.26 -0.58 0.00 0.00 3.86 -1.24 -1.95 115.15 115.50 1sxj h HIS 64 Ca 0.22 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.42 1sxj h HIS 64 Cb 0.27 0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.93 1sxj h HIS 64 CO -0.20 -0.36 0.38 0.39 0.86 0.00 0.00 177.93 179.00 1sxj n GLU 65 N -4.25 0.06 -0.07 2.45 1.02 -1.09 0.10 120.64 118.86 1sxj n GLU 65 Ca -0.08 0.49 -0.22 0.00 -0.02 0.00 0.00 57.16 57.34 1sxj n GLU 65 Cb 0.25 -2.07 -0.12 0.00 -0.02 0.00 0.00 31.44 29.47 1sxj n GLU 65 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1sxj n LEU 66 N -1.85 2.49 -0.03 -4.62 4.77 -1.06 -4.64 117.00 112.06 1sxj n LEU 66 Ca -0.01 0.18 0.07 0.00 -0.03 0.00 0.00 56.01 56.22 1sxj n LEU 66 Cb 0.39 -1.00 -0.07 0.00 -2.33 0.00 0.00 43.42 40.41 1sxj n LEU 66 CO 0.04 0.73 -0.00 0.18 -1.33 0.00 0.00 177.39 177.01 1sxj n LEU 67 N -3.70 0.73 0.00 2.23 4.77 0.45 -4.93 117.00 116.54 1sxj n LEU 67 Ca -0.38 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.07 1sxj n LEU 67 Cb 0.94 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.03 1sxj n LEU 67 CO 0.29 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1sxj n GLY 68 N 1.30 2.67 0.00 -0.72 0.00 0.28 0.16 105.19 108.88 1sxj n GLY 68 Ca 0.03 0.20 0.03 0.00 0.00 0.00 0.00 46.02 46.27 1sxj n GLY 68 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1sxj n ARG 69 N 14.00 0.09 0.03 1.61 1.85 -1.26 -1.98 116.66 130.99 1sxj n ARG 69 Ca 0.00 0.22 0.12 0.00 -1.00 0.00 0.00 57.85 57.19 1sxj n ARG 69 Cb 0.00 -1.50 0.14 0.00 -1.05 0.00 0.00 32.46 30.05 1sxj n ARG 69 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1sxj n SER 70 N -1.27 0.62 -0.32 2.89 7.64 0.43 -4.19 113.62 119.42 1sxj n SER 70 Ca 0.03 -0.14 0.18 0.00 1.01 0.00 0.00 58.87 59.95 1sxj n SER 70 Cb 0.04 0.43 0.38 0.00 -1.01 0.00 0.00 64.21 64.05 1sxj n SER 70 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 1sxj h TYR 71 N 0.00 0.59 -0.64 1.43 3.20 -1.45 0.28 116.97 120.38 1sxj h TYR 71 Ca 0.00 0.05 0.11 0.00 3.14 0.00 0.00 58.73 62.03 1sxj h TYR 71 Cb 0.65 -0.11 -0.08 0.00 1.54 0.00 0.00 36.73 38.73 1sxj h TYR 71 CO 0.00 -0.21 0.22 0.00 -1.64 0.00 0.00 178.16 176.53 1sxj h ALA 72 N 1.83 0.83 0.00 1.82 0.00 -1.82 -2.49 119.26 119.42 1sxj h ALA 72 Ca 0.64 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.66 1sxj h ALA 72 Cb 1.39 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.28 1sxj h ALA 72 CO -0.65 -0.22 -1.23 -0.25 0.00 0.00 0.00 179.25 176.89 1sxj n ASP 73 N -5.03 1.04 -1.02 0.00 9.92 -0.50 -4.55 116.55 116.41 1sxj n ASP 73 Ca 0.10 -0.43 0.11 0.00 -0.53 0.00 0.00 54.79 54.05 1sxj n ASP 73 Cb 0.32 1.37 0.15 0.00 -0.64 0.00 0.00 41.12 42.32 1sxj n ASP 73 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1sxj n GLY 74 N 1.48 1.33 3.12 0.44 0.00 0.86 -4.90 105.19 107.52 1sxj n GLY 74 Ca -0.00 -0.69 -0.27 0.00 0.00 0.00 0.00 46.02 45.06 1sxj n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sxj s VAL 75 N -1.65 1.52 -0.24 1.61 1.01 -0.94 0.74 120.40 122.46 1sxj s VAL 75 Ca 0.32 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.59 1sxj s VAL 75 Cb 0.21 -1.34 0.06 0.00 0.00 0.00 0.00 36.38 35.30 1sxj s VAL 75 CO 0.29 0.44 -0.08 -0.22 0.00 0.00 0.00 175.10 175.53 1sxj s LEU 76 N 0.37 2.82 -0.14 3.92 2.96 -0.26 -4.89 118.68 123.46 1sxj s LEU 76 Ca -0.13 -1.21 -0.09 0.00 -0.22 0.00 0.00 54.13 52.49 1sxj s LEU 76 Cb -0.15 -1.32 -0.04 0.00 0.50 0.00 0.00 46.19 45.18 1sxj s LEU 76 CO 0.05 -0.20 0.17 -0.70 -1.32 0.00 0.00 176.35 174.34 1sxj s GLU 77 N 1.29 3.75 -0.12 1.98 2.12 -1.26 -0.17 118.70 126.29 1sxj s GLU 77 Ca -0.06 -0.10 -0.04 0.00 0.36 0.00 0.00 54.97 55.14 1sxj s GLU 77 Cb -0.19 -3.28 0.05 0.00 0.26 0.00 0.00 34.13 30.97 1sxj s GLU 77 CO -0.06 0.60 0.07 -0.51 -0.54 0.00 0.00 175.26 174.81 1sxj s LEU 78 N -0.53 0.38 0.00 2.70 1.43 0.83 -4.95 118.68 118.54 1sxj s LEU 78 Ca 0.14 -0.37 0.01 0.00 -1.03 0.00 0.00 54.13 52.88 1sxj s LEU 78 Cb -0.12 -0.26 0.01 0.00 0.03 0.00 0.00 46.19 45.85 1sxj s LEU 78 CO 0.03 -0.30 0.06 -0.46 0.23 0.00 0.00 176.35 175.91 1sxj n ASN 79 N 5.25 2.81 0.32 2.29 0.23 -1.26 -2.02 115.26 122.88 1sxj n ASN 79 Ca -0.06 -2.49 0.17 0.00 -0.53 0.00 0.00 54.58 51.68 1sxj n ASN 79 Cb 0.49 0.19 0.91 0.00 -2.08 0.00 0.00 39.78 39.29 1sxj n ASN 79 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1sxj h ALA 80 N 1.08 1.32 -0.04 -2.53 0.00 -1.83 0.42 119.26 117.67 1sxj h ALA 80 Ca -0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1sxj h ALA 80 Cb 0.88 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1sxj h ALA 80 CO 0.46 -0.27 0.00 -1.13 0.00 0.00 0.00 179.25 178.31 1sxj n SER 81 N -3.02 1.14 -4.73 0.00 3.41 -1.26 -4.87 113.62 104.28 1sxj n SER 81 Ca -0.02 -1.43 -0.23 0.00 -0.26 0.00 0.00 58.87 56.93 1sxj n SER 81 Cb 0.32 -0.02 -0.07 0.00 -0.26 0.00 0.00 64.21 64.18 1sxj n SER 81 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1sxj s ASP 82 N -1.90 4.61 -0.13 4.04 1.01 0.14 -5.09 116.67 119.33 1sxj s ASP 82 Ca 0.39 -0.86 -0.29 0.00 0.71 0.00 0.00 52.55 52.50 1sxj s ASP 82 Cb 0.20 -0.65 -0.01 0.00 1.01 0.00 0.00 42.92 43.47 1sxj s ASP 82 CO 0.32 -0.37 0.98 -0.62 0.21 0.00 0.00 175.17 175.69 1sxj s ASP 83 N -3.87 7.17 -0.29 0.27 -1.08 -1.26 -4.86 116.67 112.75 1sxj s ASP 83 Ca 0.39 1.44 0.19 0.00 -0.52 0.00 0.00 52.55 54.05 1sxj s ASP 83 Cb -0.01 -2.53 0.48 0.00 -1.46 0.00 0.00 42.92 39.40 1sxj s ASP 83 CO 0.23 -0.47 1.06 0.54 0.52 0.00 0.00 175.17 177.05 1sxj n ARG 84 N 5.22 1.81 -1.92 4.34 1.74 -1.26 -4.86 116.66 121.73 1sxj n ARG 84 Ca 0.08 -3.55 -0.17 0.00 -0.77 0.00 0.00 57.85 53.45 1sxj n ARG 84 Cb 0.48 -1.59 0.09 0.00 -1.02 0.00 0.00 32.46 30.43 1sxj n ARG 84 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1sxj n GLY 85 N -0.42 0.37 0.29 -0.13 0.00 -1.26 -4.75 105.19 99.29 1sxj n GLY 85 Ca 0.13 -1.96 0.02 0.00 0.00 0.00 0.00 46.02 44.21 1sxj n GLY 85 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1sxj h ILE 86 N -0.69 0.22 0.04 -0.61 1.08 -1.89 -0.59 117.51 115.07 1sxj h ILE 86 Ca -0.25 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.25 1sxj h ILE 86 Cb 0.87 0.22 -0.03 0.00 -3.07 0.00 0.00 36.82 34.80 1sxj h ILE 86 CO 0.25 0.00 -0.21 -2.24 -0.69 0.00 0.00 178.15 175.26 1sxj h ASP 87 N -0.00 -0.61 -0.74 1.72 2.03 -1.97 0.17 116.42 117.01 1sxj h ASP 87 Ca 0.37 0.08 -0.05 0.00 -0.73 0.00 0.00 57.03 56.71 1sxj h ASP 87 Cb 0.57 0.25 -0.03 0.00 -0.83 0.00 0.00 39.33 39.28 1sxj h ASP 87 CO -0.80 -0.29 0.29 0.58 -1.03 0.00 0.00 179.24 177.99 1sxj h VAL 88 N -0.36 1.25 -0.55 4.15 2.07 -1.69 -1.36 116.25 119.76 1sxj h VAL 88 Ca 0.05 -0.82 -0.09 0.00 0.82 0.00 0.00 66.70 66.66 1sxj h VAL 88 Cb 0.42 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1sxj h VAL 88 CO -0.17 0.33 -0.00 0.58 0.02 0.00 0.00 177.57 178.33 1sxj h VAL 89 N 1.10 1.26 -0.00 2.57 2.07 -0.79 -0.46 116.25 121.99 1sxj h VAL 89 Ca 0.25 -1.09 0.00 0.00 0.82 0.00 0.00 66.70 66.68 1sxj h VAL 89 Cb 0.23 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1sxj h VAL 89 CO -0.02 0.39 -0.03 0.54 0.02 0.00 0.00 177.57 178.47 1sxj n ARG 90 N -4.19 0.58 0.00 1.57 1.74 0.56 -3.13 116.66 113.79 1sxj n ARG 90 Ca 0.03 -0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.04 1sxj n ARG 90 Cb 0.33 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 1sxj n ARG 90 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1sxj n ASN 91 N -1.15 0.00 -0.00 0.55 4.13 -0.55 -4.67 115.26 113.57 1sxj n ASN 91 Ca 0.16 0.00 -0.01 0.00 1.68 0.00 0.00 54.58 56.41 1sxj n ASN 91 Cb 0.23 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.47 1sxj n ASN 91 CO 0.00 0.00 0.00 -0.61 0.28 0.00 0.00 177.26 176.93 1sxj h GLN 92 N 0.00 -0.04 -0.56 3.52 4.15 -1.31 0.65 115.11 121.52 1sxj h GLN 92 Ca 0.00 0.00 0.11 0.00 0.77 0.00 0.00 58.65 59.54 1sxj h GLN 92 Cb 0.00 0.01 -0.10 0.00 0.21 0.00 0.00 27.48 27.60 1sxj h GLN 92 CO 0.00 -0.03 -0.05 0.82 -1.93 0.00 0.00 178.83 177.64 1sxj h ILE 93 N -0.04 0.51 -0.22 2.39 2.04 -1.51 -0.47 117.51 120.20 1sxj h ILE 93 Ca 0.00 -0.02 0.01 0.00 1.00 0.00 0.00 64.86 65.85 1sxj h ILE 93 Cb 0.05 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 1sxj h ILE 93 CO -0.03 0.01 0.12 0.50 0.00 0.00 0.00 178.15 178.76 1sxj h LYS 94 N 0.07 0.25 -0.79 2.37 3.64 -1.42 -2.10 116.57 118.59 1sxj h LYS 94 Ca 0.28 -0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.74 1sxj h LYS 94 Cb 0.44 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.13 1sxj h LYS 94 CO -0.51 0.17 0.43 1.25 -2.27 0.00 0.00 179.45 178.52 1sxj h HIS 95 N 0.26 0.78 -0.01 1.91 2.76 0.13 -1.35 115.15 119.63 1sxj h HIS 95 Ca 0.09 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.29 1sxj h HIS 95 Cb 0.00 -0.23 -0.00 0.00 1.55 0.00 0.00 27.41 28.73 1sxj h HIS 95 CO -0.08 0.30 0.01 0.35 -1.30 0.00 0.00 177.93 177.21 1sxj h PHE 96 N 0.72 0.01 0.00 5.26 3.57 -0.52 0.35 116.94 126.34 1sxj h PHE 96 Ca 0.39 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.87 1sxj h PHE 96 Cb 0.38 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.12 1sxj h PHE 96 CO -0.08 0.01 -0.08 0.00 -2.23 0.00 0.00 178.31 175.94 1sxj h ALA 97 N 1.00 1.74 -0.00 2.41 0.00 -0.94 -0.36 119.26 123.11 1sxj h ALA 97 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1sxj h ALA 97 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1sxj h ALA 97 CO -0.00 0.10 -0.24 1.04 0.00 0.00 0.00 179.25 180.15 1sxj n GLN 98 N -4.25 0.52 -1.99 0.00 6.02 -0.55 -4.73 117.38 112.39 1sxj n GLN 98 Ca -0.03 -0.24 -0.38 0.00 -0.01 0.00 0.00 57.00 56.34 1sxj n GLN 98 Cb 0.16 -1.49 0.02 0.00 1.02 0.00 0.00 30.24 29.94 1sxj n GLN 98 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1sxj s LYS 99 N -2.65 3.42 -0.21 -1.09 2.20 0.04 -5.00 119.74 116.45 1sxj s LYS 99 Ca 0.22 2.04 -0.14 0.00 -0.36 0.00 0.00 55.97 57.73 1sxj s LYS 99 Cb 0.19 -2.33 -0.04 0.00 -1.51 0.00 0.00 37.83 34.14 1sxj s LYS 99 CO 0.55 -0.91 0.31 0.21 -0.36 0.00 0.00 175.35 175.15 1sxj s LYS 100 N -2.81 4.15 -0.23 4.03 2.47 -1.26 -5.04 119.74 121.05 1sxj s LYS 100 Ca 0.68 0.04 -0.04 0.00 -1.56 0.00 0.00 55.97 55.09 1sxj s LYS 100 Cb -0.35 -3.53 0.12 0.00 -1.46 0.00 0.00 37.83 32.61 1sxj s LYS 100 CO 0.42 0.02 0.40 -1.17 0.16 0.00 0.00 175.35 175.17 1sxj s LEU 101 N 1.16 -0.66 -0.32 5.43 0.20 -1.26 -5.12 118.68 118.10 1sxj s LEU 101 Ca 0.15 0.45 -0.29 0.00 0.69 0.00 0.00 54.13 55.13 1sxj s LEU 101 Cb -0.14 1.21 0.00 0.00 -0.43 0.00 0.00 46.19 46.83 1sxj s LEU 101 CO 0.06 -0.28 1.36 -1.00 -0.29 0.00 0.00 176.35 176.20 1sxj s HIS 102 N 2.57 2.56 0.19 5.38 3.76 -1.26 -5.00 115.29 123.49 1sxj s HIS 102 Ca 0.09 0.79 0.08 0.00 -0.15 0.00 0.00 55.06 55.87 1sxj s HIS 102 Cb -0.15 -4.03 -0.05 0.00 1.11 0.00 0.00 32.58 29.47 1sxj s HIS 102 CO -0.15 -1.89 -0.15 -0.51 -0.85 0.00 0.00 174.74 171.19 1sxj s LEU 103 N 4.74 2.53 0.93 0.89 1.43 -1.26 -5.13 118.68 122.80 1sxj s LEU 103 Ca 0.59 -0.98 -0.15 0.00 -1.03 0.00 0.00 54.13 52.56 1sxj s LEU 103 Cb -0.16 -0.68 -0.04 0.00 0.03 0.00 0.00 46.19 45.34 1sxj s LEU 103 CO 0.26 -0.15 0.01 -2.65 0.23 0.00 0.00 176.35 174.05 1sxj n PRO 104 N -0.21 -0.13 -0.14 1.29 -0.02 -1.26 -4.80 135.00 129.72 1sxj n PRO 104 Ca -0.09 -0.01 -0.04 0.00 -2.02 0.00 0.00 63.50 61.34 1sxj n PRO 104 Cb 0.60 -1.55 -0.03 0.00 -0.02 0.00 0.00 33.50 32.49 1sxj n PRO 104 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1sxj n PRO 105 N -0.14 -0.15 -0.45 0.52 -0.02 -1.26 -2.01 135.00 131.49 1sxj n PRO 105 Ca 0.04 0.87 0.05 0.00 -2.02 0.00 0.00 63.50 62.44 1sxj n PRO 105 Cb 0.54 -1.29 0.23 0.00 -0.02 0.00 0.00 33.50 32.96 1sxj n PRO 105 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1sxj n GLY 106 N -1.09 2.01 3.90 -1.23 0.00 -1.26 -4.93 105.19 102.58 1sxj n GLY 106 Ca 0.01 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.16 1sxj n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sxj s LYS 107 N -1.87 3.40 0.09 1.61 -0.14 -0.85 -3.89 119.74 118.09 1sxj s LYS 107 Ca 0.32 -0.38 0.03 0.00 -1.36 0.00 0.00 55.97 54.58 1sxj s LYS 107 Cb 0.22 -3.05 -0.04 0.00 -1.68 0.00 0.00 37.83 33.28 1sxj s LYS 107 CO 0.13 0.65 -0.08 -1.01 -0.76 0.00 0.00 175.35 174.28 1sxj s HIS 108 N -1.38 0.92 0.60 3.18 3.76 -1.26 -4.77 115.29 116.33 1sxj s HIS 108 Ca 0.30 -0.72 -0.19 0.00 -0.15 0.00 0.00 55.06 54.30 1sxj s HIS 108 Cb -0.13 -0.52 -0.03 0.00 1.11 0.00 0.00 32.58 33.01 1sxj s HIS 108 CO 0.22 -0.07 1.21 0.15 -0.85 0.00 0.00 174.74 175.39 1sxj s LYS 109 N -2.96 2.95 -0.00 1.40 1.02 0.16 -4.77 119.74 117.54 1sxj s LYS 109 Ca 0.05 1.82 0.08 0.00 0.02 0.00 0.00 55.97 57.93 1sxj s LYS 109 Cb -0.01 -1.93 -0.02 0.00 -0.52 0.00 0.00 37.83 35.35 1sxj s LYS 109 CO -0.02 -1.22 -0.24 0.42 -0.92 0.00 0.00 175.35 173.37 1sxj s ILE 110 N -1.61 2.24 -0.15 2.17 -1.09 0.23 0.05 121.20 123.03 1sxj s ILE 110 Ca 0.77 -1.13 0.02 0.00 -2.23 0.00 0.00 60.65 58.08 1sxj s ILE 110 Cb -0.30 -1.82 0.01 0.00 -1.58 0.00 0.00 42.46 38.77 1sxj s ILE 110 CO 0.33 0.52 -0.21 -0.69 -1.23 0.00 0.00 174.94 173.66 1sxj s VAL 111 N -0.69 2.03 -0.29 2.92 1.01 -0.39 -1.11 120.40 123.88 1sxj s VAL 111 Ca 0.11 -0.94 -0.06 0.00 0.00 0.00 0.00 61.98 61.08 1sxj s VAL 111 Cb -0.10 -1.81 0.01 0.00 0.00 0.00 0.00 36.38 34.48 1sxj s VAL 111 CO 0.00 0.54 0.07 -0.63 0.00 0.00 0.00 175.10 175.08 1sxj s ILE 112 N 1.01 3.91 -0.46 2.22 1.01 0.76 -1.35 121.20 128.31 1sxj s ILE 112 Ca -0.02 -0.66 -0.06 0.00 0.00 0.00 0.00 60.65 59.91 1sxj s ILE 112 Cb -0.14 -2.99 0.12 0.00 0.01 0.00 0.00 42.46 39.46 1sxj s ILE 112 CO -0.06 0.12 0.30 -0.76 0.00 0.00 0.00 174.94 174.54 1sxj s LEU 113 N 1.50 5.49 0.44 2.97 1.43 -0.62 -0.12 118.68 129.76 1sxj s LEU 113 Ca 0.03 -2.05 -0.04 0.00 -1.03 0.00 0.00 54.13 51.03 1sxj s LEU 113 Cb -0.17 -1.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 1sxj s LEU 113 CO 0.02 -0.60 0.72 -0.62 0.23 0.00 0.00 176.35 176.10 1sxj s ASP 114 N 2.14 6.30 -1.48 2.29 -1.08 -0.86 -1.91 116.67 122.08 1sxj s ASP 114 Ca 0.08 0.83 -0.08 0.00 -0.52 0.00 0.00 52.55 52.86 1sxj s ASP 114 Cb -0.24 -2.20 0.06 0.00 -1.46 0.00 0.00 42.92 39.07 1sxj s ASP 114 CO -0.03 -0.48 0.72 -0.62 0.52 0.00 0.00 175.17 175.28 1sxj n GLU 115 N -2.00 -4.32 0.07 4.34 4.71 -0.05 -3.98 120.64 119.41 1sxj n GLU 115 Ca -0.01 0.51 0.09 0.00 -0.01 0.00 0.00 57.16 57.74 1sxj n GLU 115 Cb 0.55 -5.08 0.38 0.00 -1.01 0.00 0.00 31.44 26.29 1sxj n GLU 115 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1sxj n ALA 116 N -4.46 1.51 1.92 0.62 0.00 -0.67 -2.24 120.51 117.19 1sxj n ALA 116 Ca -0.13 0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.46 1sxj n ALA 116 Cb 0.60 -1.28 0.60 0.00 0.00 0.00 0.00 19.45 19.37 1sxj n ALA 116 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1sxj n ASP 117 N -1.89 0.19 -0.00 0.00 5.68 -1.26 -2.55 116.55 116.72 1sxj n ASP 117 Ca 0.02 -1.38 0.09 0.00 -0.50 0.00 0.00 54.79 53.02 1sxj n ASP 117 Cb 0.16 -0.01 -0.11 0.00 -1.14 0.00 0.00 41.12 40.02 1sxj n ASP 117 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1sxj n SER 118 N -0.70 0.82 -4.65 -1.12 7.64 -0.95 -4.93 113.62 109.73 1sxj n SER 118 Ca 0.16 -0.69 -0.43 0.00 1.01 0.00 0.00 58.87 58.93 1sxj n SER 118 Cb 0.10 1.22 -0.02 0.00 -1.01 0.00 0.00 64.21 64.50 1sxj n SER 118 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1sxj s MET 119 N -2.86 4.14 0.54 1.43 -1.94 -1.06 -4.97 119.30 114.59 1sxj s MET 119 Ca 0.03 1.85 -0.21 0.00 -1.71 0.00 0.00 55.69 55.65 1sxj s MET 119 Cb 0.13 -3.89 -0.06 0.00 2.01 0.00 0.00 34.83 33.02 1sxj s MET 119 CO 0.75 -0.86 1.12 0.25 -0.01 0.00 0.00 175.02 176.27 1sxj n THR 120 N 5.59 3.46 -0.13 2.05 -2.24 -1.26 -4.76 114.28 116.99 1sxj n THR 120 Ca 0.16 -0.50 -0.04 0.00 -2.27 0.00 0.00 64.05 61.40 1sxj n THR 120 Cb 0.44 -1.34 0.04 0.00 -2.10 0.00 0.00 70.33 67.37 1sxj n THR 120 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sxj h ALA 121 N 1.06 0.49 -0.99 6.98 0.00 -1.93 -1.79 119.26 123.09 1sxj h ALA 121 Ca -0.48 0.07 0.19 0.00 0.00 0.00 0.00 54.91 54.68 1sxj h ALA 121 Cb 1.34 0.08 -0.11 0.00 0.00 0.00 0.00 17.79 19.10 1sxj h ALA 121 CO 0.54 -0.28 0.59 0.78 0.00 0.00 0.00 179.25 180.88 1sxj h GLY 122 N 0.26 1.75 0.65 0.00 0.00 -1.98 0.48 103.07 104.23 1sxj h GLY 122 Ca 0.21 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 1sxj h GLY 122 CO -0.24 -0.06 -0.03 0.00 0.00 0.00 0.00 176.54 176.20 1sxj h ALA 123 N 1.64 0.09 -0.90 3.60 0.00 -1.69 -1.97 119.26 120.03 1sxj h ALA 123 Ca 0.57 -0.24 0.09 0.00 0.00 0.00 0.00 54.91 55.33 1sxj h ALA 123 Cb 0.87 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.57 1sxj h ALA 123 CO -0.38 -0.16 0.54 1.96 0.00 0.00 0.00 179.25 181.21 1sxj h GLN 124 N -0.25 0.89 -0.97 0.00 4.20 -0.49 0.42 115.11 118.91 1sxj h GLN 124 Ca 0.01 -0.05 0.05 0.00 0.06 0.00 0.00 58.65 58.72 1sxj h GLN 124 Cb 0.47 -0.20 -0.06 0.00 0.30 0.00 0.00 27.48 27.99 1sxj h GLN 124 CO 0.01 0.59 0.62 0.37 -0.67 0.00 0.00 178.83 179.75 1sxj h GLN 125 N 0.92 1.13 -0.00 1.46 5.75 0.05 -0.47 115.11 123.94 1sxj h GLN 125 Ca 0.42 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.86 1sxj h GLN 125 Cb 0.34 -0.26 0.00 0.00 1.07 0.00 0.00 27.48 28.64 1sxj h GLN 125 CO -0.23 0.75 -0.00 0.00 -2.65 0.00 0.00 178.83 176.70 1sxj n ALA 126 N -2.36 2.66 -0.03 3.38 0.00 0.06 -3.43 120.51 120.79 1sxj n ALA 126 Ca 0.14 -0.26 -0.19 0.00 0.00 0.00 0.00 53.44 53.12 1sxj n ALA 126 Cb 0.14 -1.43 -0.14 0.00 0.00 0.00 0.00 19.45 18.03 1sxj n ALA 126 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1sxj n LEU 127 N -0.69 2.50 -0.00 0.00 7.94 -0.22 -4.61 117.00 121.92 1sxj n LEU 127 Ca 0.23 0.15 -0.00 0.00 -1.11 0.00 0.00 56.01 55.28 1sxj n LEU 127 Cb 0.18 -0.93 -0.00 0.00 0.53 0.00 0.00 43.42 43.19 1sxj n LEU 127 CO 0.18 0.83 0.22 0.54 -1.11 0.00 0.00 177.39 178.04 1sxj n ARG 128 N -3.38 -0.00 -0.17 1.96 1.74 -0.98 -0.98 116.66 114.85 1sxj n ARG 128 Ca -0.34 0.43 0.08 0.00 -0.77 0.00 0.00 57.85 57.26 1sxj n ARG 128 Cb 1.04 -0.65 0.39 0.00 -1.02 0.00 0.00 32.46 32.22 1sxj n ARG 128 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1sxj h ARG 129 N 0.00 0.66 0.06 5.56 9.65 -1.82 -2.88 114.38 125.61 1sxj h ARG 129 Ca 0.00 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 58.84 1sxj h ARG 129 Cb 0.00 -0.15 0.00 0.00 -1.39 0.00 0.00 29.97 28.43 1sxj h ARG 129 CO -0.00 0.43 -0.03 1.15 2.80 0.00 0.00 179.97 184.33 1sxj h THR 130 N 0.68 0.98 0.00 0.20 2.02 -1.31 -0.87 112.91 114.60 1sxj h THR 130 Ca 0.32 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.38 1sxj h THR 130 Cb 0.37 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 1sxj h THR 130 CO -0.11 0.03 0.00 1.15 0.37 0.00 0.00 175.52 176.96 1sxj n MET 131 N -5.10 0.45 -0.06 6.66 -0.00 -1.11 -1.80 117.12 116.16 1sxj n MET 131 Ca -0.08 0.05 -0.22 0.00 -0.00 0.00 0.00 57.70 57.45 1sxj n MET 131 Cb 0.08 -1.50 -0.12 0.00 -0.00 0.00 0.00 33.22 31.68 1sxj n MET 131 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 1sxj n GLU 132 N -1.20 0.67 0.08 3.17 2.13 -0.93 -3.67 120.64 120.88 1sxj n GLU 132 Ca 0.13 0.35 -0.06 0.00 0.66 0.00 0.00 57.16 58.24 1sxj n GLU 132 Cb 0.16 -1.67 0.08 0.00 0.27 0.00 0.00 31.44 30.28 1sxj n GLU 132 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1sxj h LEU 133 N -0.39 0.27 -3.32 4.31 4.07 -1.05 -3.32 115.31 115.87 1sxj h LEU 133 Ca -0.45 -0.17 -0.13 0.00 0.08 0.00 0.00 57.88 57.20 1sxj h LEU 133 Cb 1.74 -0.08 -0.08 0.00 1.08 0.00 0.00 40.66 43.32 1sxj h LEU 133 CO -0.09 0.87 -0.05 -1.22 -1.08 0.00 0.00 178.44 176.87 1sxj n TYR 134 N -3.81 1.03 0.29 1.13 4.02 -0.74 -4.65 117.16 114.43 1sxj n TYR 134 Ca -0.03 -1.41 0.13 0.00 -0.01 0.00 0.00 57.90 56.58 1sxj n TYR 134 Cb 0.67 -0.44 0.59 0.00 -0.02 0.00 0.00 39.34 40.14 1sxj n TYR 134 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1sxj h SER 135 N 1.15 0.00 0.64 7.72 4.64 -1.66 -0.53 113.55 125.51 1sxj h SER 135 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1sxj h SER 135 Cb 1.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 1sxj h SER 135 CO 0.34 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.89 1sxj n ASN 136 N -2.38 0.00 0.00 4.97 5.03 -1.26 -3.77 115.26 117.85 1sxj n ASN 136 Ca 0.00 0.18 0.00 0.00 0.87 0.00 0.00 54.58 55.64 1sxj n ASN 136 Cb 0.15 -0.38 0.00 0.00 -1.02 0.00 0.00 39.78 38.53 1sxj n ASN 136 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 1sxj n SER 137 N -1.38 0.66 -3.89 6.41 3.41 -0.97 -4.99 113.62 112.87 1sxj n SER 137 Ca 0.09 -0.03 -0.19 0.00 -0.26 0.00 0.00 58.87 58.48 1sxj n SER 137 Cb 0.24 0.19 -0.16 0.00 -0.26 0.00 0.00 64.21 64.22 1sxj n SER 137 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1sxj s THR 138 N -0.33 0.48 -0.02 6.66 2.01 -0.25 0.39 115.64 124.59 1sxj s THR 138 Ca 0.00 -0.11 0.07 0.00 0.31 0.00 0.00 61.69 61.97 1sxj s THR 138 Cb 0.00 -0.50 -0.02 0.00 0.01 0.00 0.00 72.50 71.99 1sxj s THR 138 CO 0.00 0.20 -0.24 -0.13 -0.69 0.00 0.00 174.62 173.77 1sxj s ARG 139 N 0.81 1.91 -0.05 4.92 1.81 0.11 -3.98 118.95 124.47 1sxj s ARG 139 Ca -0.10 -0.84 -0.02 0.00 -1.72 0.00 0.00 55.73 53.04 1sxj s ARG 139 Cb -0.13 -1.85 -0.04 0.00 -0.45 0.00 0.00 34.95 32.48 1sxj s ARG 139 CO -0.00 0.51 0.08 -0.06 -0.68 0.00 0.00 175.30 175.14 1sxj s PHE 140 N -0.55 3.33 -0.16 -0.53 0.40 -1.26 -1.26 117.98 117.94 1sxj s PHE 140 Ca 0.09 0.28 0.00 0.00 -0.60 0.00 0.00 56.93 56.70 1sxj s PHE 140 Cb -0.09 -1.80 0.03 0.00 0.51 0.00 0.00 43.02 41.67 1sxj s PHE 140 CO -0.01 0.57 -0.12 0.00 0.70 0.00 0.00 175.22 176.36 1sxj s ALA 141 N -1.08 1.87 -0.16 5.36 0.00 -0.45 -1.02 121.76 126.27 1sxj s ALA 141 Ca 0.19 -0.98 -0.06 0.00 0.00 0.00 0.00 51.96 51.11 1sxj s ALA 141 Cb -0.12 -1.12 -0.04 0.00 0.00 0.00 0.00 23.12 21.85 1sxj s ALA 141 CO 0.09 -0.53 0.04 -0.06 0.00 0.00 0.00 175.76 175.30 1sxj s PHE 142 N 1.47 3.22 -0.12 0.00 0.40 0.94 -1.59 117.98 122.30 1sxj s PHE 142 Ca 0.03 0.05 0.03 0.00 -0.60 0.00 0.00 56.93 56.44 1sxj s PHE 142 Cb -0.14 -2.02 0.01 0.00 0.51 0.00 0.00 43.02 41.38 1sxj s PHE 142 CO -0.10 0.19 -0.22 0.00 0.70 0.00 0.00 175.22 175.80 1sxj s ALA 143 N 0.14 2.13 0.34 5.36 0.00 -0.80 0.31 121.76 129.24 1sxj s ALA 143 Ca 0.04 -0.99 -0.15 0.00 0.00 0.00 0.00 51.96 50.86 1sxj s ALA 143 Cb -0.12 -0.89 0.03 0.00 0.00 0.00 0.00 23.12 22.14 1sxj s ALA 143 CO 0.01 0.10 0.70 0.00 0.00 0.00 0.00 175.76 176.57 1sxj n ASN 145 N -1.10 0.68 -3.94 0.00 4.13 -1.26 -2.20 115.26 111.57 1sxj n ASN 145 Ca -0.05 -0.02 -0.31 0.00 1.68 0.00 0.00 54.58 55.88 1sxj n ASN 145 Cb 0.60 0.77 -0.15 0.00 -1.54 0.00 0.00 39.78 39.46 1sxj n ASN 145 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1sxj s GLN 146 N -2.45 1.26 0.54 3.52 -0.21 -1.26 -4.15 119.66 116.91 1sxj s GLN 146 Ca -0.12 -1.64 0.33 0.00 0.02 0.00 0.00 55.36 53.94 1sxj s GLN 146 Cb 0.06 -2.85 1.43 0.00 1.00 0.00 0.00 33.01 32.65 1sxj s GLN 146 CO 0.73 -0.95 2.02 0.66 -2.12 0.00 0.00 175.29 175.62 1sxj h SER 147 N 7.75 0.00 -0.52 5.90 4.64 -1.96 -2.32 113.55 127.03 1sxj h SER 147 Ca -0.07 0.00 0.15 0.00 -0.47 0.00 0.00 61.79 61.40 1sxj h SER 147 Cb 1.02 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.09 1sxj h SER 147 CO 0.51 0.06 0.49 -1.13 -0.87 0.00 0.00 176.83 175.88 1sxj h ASN 148 N 0.00 0.00 -0.06 4.97 -1.24 -2.01 0.17 115.58 117.40 1sxj h ASN 148 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1sxj h ASN 148 Cb 0.47 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.52 1sxj h ASN 148 CO 0.01 0.00 0.00 0.29 -1.29 0.00 0.00 177.43 176.44 1sxj n LYS 149 N -3.88 1.39 -3.48 6.67 4.76 -0.87 -4.78 118.16 117.98 1sxj n LYS 149 Ca 0.10 -0.59 -0.38 0.00 -2.87 0.00 0.00 58.31 54.57 1sxj n LYS 149 Cb 0.70 -1.40 -0.09 0.00 -1.84 0.00 0.00 35.03 32.40 1sxj n LYS 149 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1sxj s ILE 150 N -1.93 5.24 0.35 -0.18 -1.09 0.58 -4.85 121.20 119.32 1sxj s ILE 150 Ca 0.35 0.47 -0.29 0.00 -2.23 0.00 0.00 60.65 58.95 1sxj s ILE 150 Cb 0.18 -3.64 -0.12 0.00 -1.58 0.00 0.00 42.46 37.30 1sxj s ILE 150 CO 0.28 0.24 1.47 2.30 -1.23 0.00 0.00 174.94 177.99 1sxj n ILE 151 N 4.73 1.75 -0.30 2.92 -6.64 -1.26 -4.76 119.36 115.80 1sxj n ILE 151 Ca -0.11 -0.44 0.10 0.00 -1.77 0.00 0.00 62.75 60.54 1sxj n ILE 151 Cb 0.51 -1.87 0.27 0.00 -1.44 0.00 0.00 39.64 37.11 1sxj n ILE 151 CO 0.00 0.00 0.00 -0.33 -1.77 0.00 0.00 176.55 174.45 1sxj h GLU 152 N 3.30 0.47 -0.99 6.28 5.08 -1.95 -1.00 114.58 125.77 1sxj h GLU 152 Ca -0.49 -0.03 0.20 0.00 -1.00 0.00 0.00 59.36 58.04 1sxj h GLU 152 Cb 1.25 -0.11 -0.10 0.00 0.50 0.00 0.00 28.75 30.29 1sxj h GLU 152 CO 0.67 0.31 0.61 -1.35 -1.00 0.00 0.00 179.01 178.26 1sxj h PRO 153 N 0.49 0.68 -0.15 2.33 0.11 -2.00 0.24 132.00 133.70 1sxj h PRO 153 Ca 0.51 -0.04 -0.21 0.00 0.11 0.00 0.00 66.00 66.38 1sxj h PRO 153 Cb 0.88 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.84 1sxj h PRO 153 CO -0.46 0.45 -0.73 -0.07 -0.21 0.00 0.00 178.00 176.98 1sxj h LEU 154 N 0.70 0.80 -0.59 2.35 3.38 -1.55 -3.23 115.31 117.16 1sxj h LEU 154 Ca 0.57 -0.51 0.02 0.00 0.09 0.00 0.00 57.88 58.05 1sxj h LEU 154 Cb 0.97 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 1sxj h LEU 154 CO -0.35 1.28 0.38 1.56 0.09 0.00 0.00 178.44 181.40 1sxj h GLN 155 N 0.47 0.74 0.00 1.13 4.20 -0.14 -1.55 115.11 119.96 1sxj h GLN 155 Ca -0.04 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1sxj h GLN 155 Cb 1.34 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.95 1sxj h GLN 155 CO 0.14 0.49 0.00 -1.13 -0.67 0.00 0.00 178.83 177.66 1sxj n SER 156 N -4.70 0.55 -0.30 1.46 3.41 0.27 -2.05 113.62 112.26 1sxj n SER 156 Ca 0.05 0.66 0.14 0.00 -0.26 0.00 0.00 58.87 59.45 1sxj n SER 156 Cb 0.05 -0.77 0.52 0.00 -0.26 0.00 0.00 64.21 63.75 1sxj n SER 156 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sxj n GLN 157 N -2.13 1.15 -4.05 4.33 6.02 -0.59 -4.95 117.38 117.16 1sxj n GLN 157 Ca 0.02 -0.60 -0.10 0.00 -0.01 0.00 0.00 57.00 56.31 1sxj n GLN 157 Cb 0.18 -1.49 -0.07 0.00 1.02 0.00 0.00 30.24 29.88 1sxj n GLN 157 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1sxj s ALA 159 N -4.04 3.34 -0.34 0.00 0.00 0.17 -4.82 121.76 116.07 1sxj s ALA 159 Ca 0.25 0.54 -0.12 0.00 0.00 0.00 0.00 51.96 52.64 1sxj s ALA 159 Cb 0.03 -3.16 -0.01 0.00 0.00 0.00 0.00 23.12 19.98 1sxj s ALA 159 CO 0.06 0.17 0.22 0.42 0.00 0.00 0.00 175.76 176.64 1sxj s ILE 160 N -0.89 5.07 -0.37 0.00 -1.09 -1.26 -0.12 121.20 122.54 1sxj s ILE 160 Ca 0.41 -0.33 -0.06 0.00 -2.23 0.00 0.00 60.65 58.44 1sxj s ILE 160 Cb -0.25 -3.63 0.07 0.00 -1.58 0.00 0.00 42.46 37.07 1sxj s ILE 160 CO 0.30 -0.02 0.16 -0.76 -1.23 0.00 0.00 174.94 173.39 1sxj s LEU 161 N 1.68 4.72 0.31 2.97 1.02 -0.15 -4.97 118.68 124.25 1sxj s LEU 161 Ca 0.05 -1.45 -0.27 0.00 0.02 0.00 0.00 54.13 52.49 1sxj s LEU 161 Cb -0.18 -1.88 -0.10 0.00 0.02 0.00 0.00 46.19 44.06 1sxj s LEU 161 CO 0.09 -0.43 0.95 -0.13 0.02 0.00 0.00 176.35 176.85 1sxj s ARG 162 N 1.34 4.64 0.07 1.70 1.81 -1.26 -1.93 118.95 125.32 1sxj s ARG 162 Ca 0.01 1.37 0.08 0.00 -1.72 0.00 0.00 55.73 55.47 1sxj s ARG 162 Cb -0.21 -2.90 -0.04 0.00 -0.45 0.00 0.00 34.95 31.35 1sxj s ARG 162 CO 0.01 0.32 -0.17 0.71 -0.68 0.00 0.00 175.30 175.49 1sxj s TYR 163 N -1.52 2.58 0.23 -0.53 1.51 -0.04 -4.93 117.35 114.64 1sxj s TYR 163 Ca 0.48 -0.24 0.08 0.00 -1.01 0.00 0.00 57.07 56.38 1sxj s TYR 163 Cb -0.20 -1.42 -0.04 0.00 -0.11 0.00 0.00 41.96 40.18 1sxj s TYR 163 CO 0.26 0.32 0.06 -1.12 -1.11 0.00 0.00 175.55 173.96 1sxj s SER 164 N -1.76 4.96 0.73 2.29 0.01 -1.26 -4.49 113.70 114.18 1sxj s SER 164 Ca 0.17 -0.42 -0.15 0.00 1.31 0.00 0.00 55.95 56.85 1sxj s SER 164 Cb -0.11 -1.10 0.04 0.00 0.21 0.00 0.00 66.02 65.06 1sxj s SER 164 CO 0.08 0.02 1.23 -0.54 0.41 0.00 0.00 173.24 174.44 1sxj s LYS 165 N -3.45 2.12 -0.03 12.44 1.02 -1.26 -4.88 119.74 125.70 1sxj s LYS 165 Ca 0.31 1.83 -0.30 0.00 0.02 0.00 0.00 55.97 57.82 1sxj s LYS 165 Cb -0.08 -1.82 -0.03 0.00 -0.52 0.00 0.00 37.83 35.38 1sxj s LYS 165 CO 0.21 -1.87 0.98 -0.51 -0.92 0.00 0.00 175.35 173.24 1sxj s LEU 166 N -5.10 4.34 0.85 3.17 2.01 -1.00 -5.00 118.68 117.95 1sxj s LEU 166 Ca 0.76 1.62 -0.12 0.00 0.01 0.00 0.00 54.13 56.39 1sxj s LEU 166 Cb -0.31 -3.55 0.10 0.00 0.01 0.00 0.00 46.19 42.44 1sxj s LEU 166 CO 0.45 -0.30 1.14 -0.24 1.01 0.00 0.00 176.35 178.42 1sxj n SER 167 N 4.14 0.66 0.01 2.29 2.88 -1.26 -4.07 113.62 118.27 1sxj n SER 167 Ca 0.06 0.53 0.06 0.00 -1.33 0.00 0.00 58.87 58.19 1sxj n SER 167 Cb 0.51 -1.48 0.47 0.00 -0.75 0.00 0.00 64.21 62.95 1sxj n SER 167 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1sxj h ASP 168 N -1.23 0.39 0.48 -3.46 3.32 -1.98 -1.51 116.42 112.43 1sxj h ASP 168 Ca -0.45 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.57 1sxj h ASP 168 Cb 1.29 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 1sxj h ASP 168 CO 0.44 0.27 -0.28 -0.33 -1.72 0.00 0.00 179.24 177.62 1sxj h GLU 169 N 0.45 -0.69 -0.47 3.56 3.07 -1.99 0.45 114.58 118.96 1sxj h GLU 169 Ca 0.16 0.05 0.05 0.00 -0.50 0.00 0.00 59.36 59.11 1sxj h GLU 169 Cb 0.09 0.16 -0.04 0.00 -0.84 0.00 0.00 28.75 28.11 1sxj h GLU 169 CO -0.04 -0.46 0.22 -0.44 -1.40 0.00 0.00 179.01 176.89 1sxj h ASP 170 N -0.72 0.29 -0.78 1.42 3.32 -1.78 -0.72 116.42 117.45 1sxj h ASP 170 Ca -0.06 0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.05 1sxj h ASP 170 Cb 0.58 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 40.07 1sxj h ASP 170 CO 0.07 0.21 0.51 0.58 -1.72 0.00 0.00 179.24 178.88 1sxj h VAL 171 N 0.43 1.15 -0.81 -1.35 2.07 -1.16 -2.55 116.25 114.03 1sxj h VAL 171 Ca 0.21 -0.34 0.01 0.00 0.82 0.00 0.00 66.70 67.39 1sxj h VAL 171 Cb 0.15 0.06 -0.04 0.00 -1.52 0.00 0.00 31.29 29.93 1sxj h VAL 171 CO -0.17 0.18 0.53 0.25 0.02 0.00 0.00 177.57 178.38 1sxj h LEU 172 N 1.00 0.94 0.80 2.57 5.85 0.11 -2.01 115.31 124.57 1sxj h LEU 172 Ca 0.30 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.95 1sxj h LEU 172 Cb -0.04 -0.23 0.01 0.00 0.37 0.00 0.00 40.66 40.77 1sxj h LEU 172 CO -0.09 0.69 -0.38 0.11 -0.34 0.00 0.00 178.44 178.42 1sxj h LYS 173 N 1.10 -1.03 0.00 1.25 1.57 -0.75 -1.17 116.57 117.54 1sxj h LYS 173 Ca 0.30 0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 59.15 1sxj h LYS 173 Cb -0.11 0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 1sxj h LYS 173 CO -0.06 -0.69 -0.00 -0.09 -0.57 0.00 0.00 179.45 178.04 1sxj h ARG 174 N -1.10 0.00 -0.14 3.15 9.65 -1.55 -0.30 114.38 124.09 1sxj h ARG 174 Ca -0.11 0.00 -0.10 0.00 -1.10 0.00 0.00 59.98 58.67 1sxj h ARG 174 Cb 0.82 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.40 1sxj h ARG 174 CO 0.18 0.00 -0.30 1.25 2.80 0.00 0.00 179.97 183.90 1sxj h LEU 175 N 0.00 0.52 -0.31 3.80 5.85 -0.92 -2.86 115.31 121.39 1sxj h LEU 175 Ca -0.00 -0.56 -0.10 0.00 0.84 0.00 0.00 57.88 58.06 1sxj h LEU 175 Cb 0.02 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1sxj h LEU 175 CO 0.00 0.98 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.81 1sxj h LEU 176 N 0.07 0.71 -1.05 2.25 3.38 0.13 -2.25 115.31 118.55 1sxj h LEU 176 Ca 0.00 -0.43 0.19 0.00 0.09 0.00 0.00 57.88 57.73 1sxj h LEU 176 Cb 0.90 -0.20 -0.10 0.00 0.09 0.00 0.00 40.66 41.35 1sxj h LEU 176 CO 0.07 0.99 0.61 1.56 0.09 0.00 0.00 178.44 181.76 1sxj h GLN 177 N 0.44 0.73 -0.02 1.13 4.20 -1.18 0.15 115.11 120.57 1sxj h GLN 177 Ca 0.06 -0.04 -0.21 0.00 0.06 0.00 0.00 58.65 58.52 1sxj h GLN 177 Cb 0.75 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 1sxj h GLN 177 CO 0.06 0.48 -0.89 0.82 -0.67 0.00 0.00 178.83 178.63 1sxj h ILE 178 N 0.75 1.41 -0.57 2.54 1.08 -1.40 -3.10 117.51 118.22 1sxj h ILE 178 Ca 0.56 -2.41 0.03 0.00 -0.39 0.00 0.00 64.86 62.66 1sxj h ILE 178 Cb 0.89 2.36 -0.04 0.00 -3.07 0.00 0.00 36.82 36.96 1sxj h ILE 178 CO -0.35 0.72 0.33 0.40 -0.69 0.00 0.00 178.15 178.56 1sxj h ILE 179 N 0.22 1.03 -0.30 -0.67 1.08 -0.14 -1.93 117.51 116.80 1sxj h ILE 179 Ca -0.06 -0.22 -0.04 0.00 -0.39 0.00 0.00 64.86 64.15 1sxj h ILE 179 Cb 1.51 0.32 -0.01 0.00 -3.07 0.00 0.00 36.82 35.57 1sxj h ILE 179 CO 0.15 0.12 0.05 0.50 -0.69 0.00 0.00 178.15 178.28 1sxj h LYS 180 N 0.65 0.50 0.00 2.37 3.64 -1.25 0.29 116.57 122.77 1sxj h LYS 180 Ca 0.24 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1sxj h LYS 180 Cb 0.07 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1sxj h LYS 180 CO -0.12 0.60 0.00 1.28 -2.27 0.00 0.00 179.45 178.94 1sxj n LEU 181 N -4.63 0.00 0.00 5.20 4.77 -1.09 -2.67 117.00 118.58 1sxj n LEU 181 Ca -0.02 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1sxj n LEU 181 Cb 0.21 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1sxj n LEU 181 CO 0.38 -0.08 0.16 1.21 -1.33 0.00 0.00 177.39 177.72 1sxj n GLU 182 N -1.23 -0.14 -3.98 3.23 4.07 -0.74 -5.02 120.64 116.82 1sxj n GLU 182 Ca 0.10 -0.31 -0.26 0.00 -0.06 0.00 0.00 57.16 56.63 1sxj n GLU 182 Cb 0.14 -0.80 -0.02 0.00 -0.06 0.00 0.00 31.44 30.70 1sxj n GLU 182 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1sxj n ASP 183 N -0.07 -0.66 -4.73 4.31 4.64 0.94 -4.91 116.55 116.06 1sxj n ASP 183 Ca 0.00 -1.00 -0.40 0.00 -1.38 0.00 0.00 54.79 52.01 1sxj n ASP 183 Cb 0.07 -3.05 -0.05 0.00 -1.04 0.00 0.00 41.12 37.06 1sxj n ASP 183 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1sxj s VAL 184 N -3.89 4.85 -0.39 5.18 1.01 -0.76 -5.01 120.40 121.39 1sxj s VAL 184 Ca 0.08 1.64 -0.29 0.00 0.00 0.00 0.00 61.98 63.41 1sxj s VAL 184 Cb -0.04 -4.12 0.02 0.00 0.00 0.00 0.00 36.38 32.24 1sxj s VAL 184 CO 0.89 0.30 1.09 -0.54 0.00 0.00 0.00 175.10 176.84 1sxj s LYS 185 N 0.38 3.89 0.36 2.72 -0.14 -1.26 -4.91 119.74 120.78 1sxj s LYS 185 Ca 0.40 0.81 0.05 0.00 -1.36 0.00 0.00 55.97 55.87 1sxj s LYS 185 Cb -0.20 -3.82 -0.07 0.00 -1.68 0.00 0.00 37.83 32.07 1sxj s LYS 185 CO 0.22 -1.12 0.04 1.52 -0.76 0.00 0.00 175.35 175.25 1sxj s TYR 186 N 4.00 2.14 0.08 3.18 -0.85 -1.26 0.34 117.35 124.98 1sxj s TYR 186 Ca 0.46 -0.87 0.05 0.00 -0.52 0.00 0.00 57.07 56.19 1sxj s TYR 186 Cb -0.10 -1.44 -0.03 0.00 0.38 0.00 0.00 41.96 40.77 1sxj s TYR 186 CO 0.23 0.14 -0.14 0.99 -1.52 0.00 0.00 175.55 175.25 1sxj s THR 187 N -3.10 1.16 0.18 -3.49 2.01 -0.40 -4.88 115.64 107.11 1sxj s THR 187 Ca 0.35 -1.42 -0.13 0.00 0.31 0.00 0.00 61.69 60.80 1sxj s THR 187 Cb 0.09 -1.20 0.08 0.00 0.01 0.00 0.00 72.50 71.48 1sxj s THR 187 CO 0.16 -0.28 1.82 0.78 -0.69 0.00 0.00 174.62 176.42 1sxj h ASN 188 N 4.08 0.67 0.16 3.53 4.21 -2.00 -1.17 115.58 125.07 1sxj h ASN 188 Ca -0.41 -0.04 -0.07 0.00 1.21 0.00 0.00 56.30 56.99 1sxj h ASN 188 Cb 1.19 -0.17 -0.01 0.00 -1.12 0.00 0.00 38.32 38.21 1sxj h ASN 188 CO 0.43 0.52 -0.26 0.44 -1.29 0.00 0.00 177.43 177.26 1sxj h ASP 189 N 0.76 0.17 -0.40 5.81 3.32 -1.97 -1.03 116.42 123.09 1sxj h ASP 189 Ca 0.20 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 1sxj h ASP 189 Cb -0.04 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1sxj h ASP 189 CO -0.04 0.44 0.12 1.23 -1.72 0.00 0.00 179.24 179.27 1sxj h GLY 190 N 0.95 0.68 1.09 2.75 0.00 -1.49 -1.44 103.07 105.60 1sxj h GLY 190 Ca 0.03 -0.40 -0.11 0.00 0.00 0.00 0.00 47.33 46.84 1sxj h GLY 190 CO 0.04 0.38 -0.09 1.41 0.00 0.00 0.00 176.54 178.28 1sxj h LEU 191 N 0.51 1.03 -2.24 3.11 3.38 -0.83 -2.04 115.31 118.24 1sxj h LEU 191 Ca 0.13 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1sxj h LEU 191 Cb 0.27 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1sxj h LEU 191 CO -0.00 1.13 -0.03 -0.33 0.09 0.00 0.00 178.44 179.30 1sxj h GLU 192 N 0.92 0.00 -0.23 1.13 5.08 -0.97 -0.95 114.58 119.55 1sxj h GLU 192 Ca 0.15 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.36 1sxj h GLU 192 Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1sxj h GLU 192 CO 0.05 0.03 -0.44 0.00 -1.00 0.00 0.00 179.01 177.65 1sxj h ALA 193 N 1.97 0.37 0.47 3.43 0.00 -0.53 -1.39 119.26 123.57 1sxj h ALA 193 Ca -0.00 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1sxj h ALA 193 Cb 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1sxj h ALA 193 CO 0.00 0.50 -0.23 0.82 0.00 0.00 0.00 179.25 180.34 1sxj h ILE 194 N 0.43 0.40 -0.60 0.00 2.04 -1.01 -1.69 117.51 117.07 1sxj h ILE 194 Ca 0.01 -0.46 0.08 0.00 1.00 0.00 0.00 64.86 65.49 1sxj h ILE 194 Cb 1.04 0.56 -0.10 0.00 -0.74 0.00 0.00 36.82 37.58 1sxj h ILE 194 CO 0.10 0.06 -0.49 0.40 0.00 0.00 0.00 178.15 178.22 1sxj h ILE 195 N -0.96 0.04 -0.96 -0.67 1.08 -1.29 0.19 117.51 114.95 1sxj h ILE 195 Ca -0.06 0.00 0.25 0.00 -0.39 0.00 0.00 64.86 64.65 1sxj h ILE 195 Cb 0.59 0.04 -0.06 0.00 -3.07 0.00 0.00 36.82 34.32 1sxj h ILE 195 CO 0.11 0.00 0.65 0.15 -0.69 0.00 0.00 178.15 178.36 1sxj h PHE 196 N -0.24 0.37 -0.51 1.37 3.57 -1.22 -1.51 116.94 118.77 1sxj h PHE 196 Ca 0.15 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.66 1sxj h PHE 196 Cb 0.55 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.18 1sxj h PHE 196 CO -0.77 0.07 0.00 0.25 -2.23 0.00 0.00 178.31 175.64 1sxj n THR 197 N -4.44 0.71 0.29 4.41 -2.24 0.53 -4.29 114.28 109.26 1sxj n THR 197 Ca 0.21 -0.85 0.05 0.00 -2.27 0.00 0.00 64.05 61.19 1sxj n THR 197 Cb 0.86 0.78 -0.07 0.00 -2.10 0.00 0.00 70.33 69.80 1sxj n THR 197 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sxj n ALA 198 N 1.50 3.00 -4.07 6.98 0.00 -0.37 -4.93 120.51 122.62 1sxj n ALA 198 Ca 0.21 -0.30 -0.32 0.00 0.00 0.00 0.00 53.44 53.03 1sxj n ALA 198 Cb 0.60 -0.40 -0.05 0.00 0.00 0.00 0.00 19.45 19.60 1sxj n ALA 198 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1sxj n GLU 199 N -1.54 -0.71 -0.68 0.00 1.02 -1.14 -0.17 120.64 117.42 1sxj n GLU 199 Ca 0.00 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 1sxj n GLU 199 Cb 0.23 -2.69 0.00 0.00 -0.02 0.00 0.00 31.44 28.96 1sxj n GLU 199 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1sxj n GLY 200 N -2.22 0.79 3.41 0.62 0.00 -1.26 -4.85 105.19 101.67 1sxj n GLY 200 Ca -0.22 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.36 1sxj n GLY 200 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sxj s ASP 201 N -2.74 6.12 0.13 1.61 -1.08 0.76 -2.37 116.67 119.10 1sxj s ASP 201 Ca 0.00 -1.21 -0.16 0.00 -0.52 0.00 0.00 52.55 50.66 1sxj s ASP 201 Cb 0.00 -2.17 -0.01 0.00 -1.46 0.00 0.00 42.92 39.28 1sxj s ASP 201 CO 0.00 -0.59 1.67 -0.03 0.52 0.00 0.00 175.17 176.74 1sxj h MET 202 N 8.71 0.58 0.14 4.34 1.85 -1.61 -1.83 114.93 127.10 1sxj h MET 202 Ca -0.28 -0.11 0.02 0.00 -0.61 0.00 0.00 59.70 58.72 1sxj h MET 202 Cb 1.11 -0.09 -0.04 0.00 0.43 0.00 0.00 31.60 33.01 1sxj h MET 202 CO 0.83 0.56 -0.37 -0.09 -0.40 0.00 0.00 176.91 177.44 1sxj h ARG 203 N 0.47 -0.59 -0.50 0.39 2.43 -1.92 -1.00 114.38 113.66 1sxj h ARG 203 Ca 0.13 0.04 0.10 0.00 -0.81 0.00 0.00 59.98 59.44 1sxj h ARG 203 Cb 0.21 0.13 -0.09 0.00 -0.42 0.00 0.00 29.97 29.80 1sxj h ARG 203 CO -0.01 -0.39 -0.11 0.37 -1.51 0.00 0.00 179.97 178.32 1sxj h GLN 204 N -0.61 0.01 0.29 0.20 4.15 -1.88 0.91 115.11 118.18 1sxj h GLN 204 Ca 0.02 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.44 1sxj h GLN 204 Cb 0.64 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.31 1sxj h GLN 204 CO -0.21 0.01 -0.32 0.00 -1.93 0.00 0.00 178.83 176.39 1sxj h ALA 205 N 1.49 -0.98 -0.24 3.38 0.00 -0.80 -1.51 119.26 120.60 1sxj h ALA 205 Ca 0.24 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.09 1sxj h ALA 205 Cb 0.37 0.57 -0.08 0.00 0.00 0.00 0.00 17.79 18.66 1sxj h ALA 205 CO -0.50 -1.01 -0.42 0.82 0.00 0.00 0.00 179.25 178.14 1sxj h ILE 206 N -0.61 0.14 -0.73 0.00 2.04 -0.85 0.17 117.51 117.67 1sxj h ILE 206 Ca -0.04 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.94 1sxj h ILE 206 Cb 0.54 0.14 -0.13 0.00 -0.74 0.00 0.00 36.82 36.63 1sxj h ILE 206 CO -0.06 0.00 -0.38 -1.13 0.00 0.00 0.00 178.15 176.58 1sxj h ASN 207 N -0.42 -1.36 0.12 1.72 -1.24 -0.73 0.13 115.58 113.80 1sxj h ASN 207 Ca 0.10 0.26 0.01 0.00 0.71 0.00 0.00 56.30 57.38 1sxj h ASN 207 Cb 0.61 0.67 -0.02 0.00 0.73 0.00 0.00 38.32 40.31 1sxj h ASN 207 CO -0.47 -0.30 -0.17 0.78 -1.29 0.00 0.00 177.43 175.98 1sxj h ASN 208 N -0.12 -0.46 -0.79 1.15 2.35 -0.22 -1.05 115.58 116.44 1sxj h ASN 208 Ca 0.25 0.05 0.14 0.00 -0.55 0.00 0.00 56.30 56.19 1sxj h ASN 208 Cb 0.56 0.17 -0.14 0.00 0.05 0.00 0.00 38.32 38.96 1sxj h ASN 208 CO -0.79 -0.25 -0.32 0.25 -1.65 0.00 0.00 177.43 174.68 1sxj h LEU 209 N -0.34 -1.15 -0.26 1.61 5.85 0.12 0.48 115.31 121.61 1sxj h LEU 209 Ca 0.02 0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.98 1sxj h LEU 209 Cb 0.35 0.62 -0.01 0.00 0.37 0.00 0.00 40.66 41.99 1sxj h LEU 209 CO -0.08 -0.29 0.09 -0.61 -0.34 0.00 0.00 178.44 177.21 1sxj h GLN 210 N -0.06 0.41 -0.22 1.25 4.15 -0.86 -1.27 115.11 118.50 1sxj h GLN 210 Ca 0.32 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.66 1sxj h GLN 210 Cb 0.58 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.20 1sxj h GLN 210 CO -0.83 0.47 0.15 0.77 -1.93 0.00 0.00 178.83 177.46 1sxj h SER 211 N 0.26 0.24 -0.26 -0.69 0.02 0.22 0.46 113.55 113.81 1sxj h SER 211 Ca 0.09 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.94 1sxj h SER 211 Cb 0.23 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1sxj h SER 211 CO -0.00 0.17 -0.17 0.74 -1.14 0.00 0.00 176.83 176.43 1sxj h THR 212 N 0.29 1.31 -0.05 -2.27 2.02 0.38 -2.76 112.91 111.82 1sxj h THR 212 Ca 0.08 -1.29 -0.21 0.00 0.77 0.00 0.00 66.41 65.76 1sxj h THR 212 Cb -0.02 1.59 0.00 0.00 -1.74 0.00 0.00 68.15 67.98 1sxj h THR 212 CO -0.02 0.40 -0.85 0.58 0.37 0.00 0.00 175.52 176.01 1sxj h VAL 213 N 0.29 1.37 0.00 3.16 2.07 -0.57 -1.32 116.25 121.26 1sxj h VAL 213 Ca 0.05 -2.26 0.00 0.00 0.82 0.00 0.00 66.70 65.31 1sxj h VAL 213 Cb 0.70 2.25 0.00 0.00 -1.52 0.00 0.00 31.29 32.72 1sxj h VAL 213 CO 0.05 0.68 0.00 0.00 0.02 0.00 0.00 177.57 178.32 1sxj h ALA 214 N 0.77 1.00 0.00 1.67 0.00 -0.08 0.28 119.26 122.90 1sxj h ALA 214 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1sxj h ALA 214 Cb 1.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1sxj h ALA 214 CO 0.15 0.00 -0.20 0.41 0.00 0.00 0.00 179.25 179.61 1sxj n GLY 215 N -0.80 0.80 0.00 0.00 0.00 -1.05 -4.80 105.19 99.34 1sxj n GLY 215 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1sxj n GLY 215 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1sxj n HIS 216 N -1.10 0.00 0.00 1.61 8.25 -0.50 -5.04 115.22 118.44 1sxj n HIS 216 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1sxj n HIS 216 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1sxj n HIS 216 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1sxj n GLY 217 N 0.00 -0.17 3.69 -1.41 0.00 0.97 -4.73 105.19 103.53 1sxj n GLY 217 Ca 0.00 -0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1sxj n GLY 217 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1sxj s LEU 218 N 0.00 4.27 -0.91 0.99 2.96 -1.26 -4.38 118.68 120.35 1sxj s LEU 218 Ca 0.00 1.61 -0.19 0.00 -0.22 0.00 0.00 54.13 55.33 1sxj s LEU 218 Cb 0.00 -3.56 0.13 0.00 0.50 0.00 0.00 46.19 43.26 1sxj s LEU 218 CO 0.00 -0.46 1.10 -0.69 -1.32 0.00 0.00 176.35 174.98 1sxj s VAL 219 N 1.95 4.74 0.19 1.68 1.01 0.15 -4.80 120.40 125.33 1sxj s VAL 219 Ca 0.50 -1.54 0.11 0.00 0.00 0.00 0.00 61.98 61.05 1sxj s VAL 219 Cb -0.20 -4.76 -0.04 0.00 0.00 0.00 0.00 36.38 31.38 1sxj s VAL 219 CO 0.20 -1.48 -0.23 0.21 0.00 0.00 0.00 175.10 173.80 1sxj s ASN 220 N 3.58 3.35 0.24 3.32 2.47 -1.26 -1.28 114.94 125.37 1sxj s ASN 220 Ca 0.31 -0.88 -0.10 0.00 0.42 0.00 0.00 52.86 52.61 1sxj s ASN 220 Cb -0.06 -0.24 0.36 0.00 -1.45 0.00 0.00 41.25 39.85 1sxj s ASN 220 CO -0.08 0.10 1.60 0.00 -3.72 0.00 0.00 177.10 174.99 1sxj h ALA 221 N 3.16 0.57 -0.42 1.71 0.00 -1.81 0.25 119.26 122.71 1sxj h ALA 221 Ca -0.45 0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.82 1sxj h ALA 221 Cb 1.21 0.59 -0.05 0.00 0.00 0.00 0.00 17.79 19.54 1sxj h ALA 221 CO 0.49 -0.41 0.13 -0.44 0.00 0.00 0.00 179.25 179.01 1sxj h ASP 222 N 0.01 0.10 0.05 0.00 3.32 -1.96 -0.54 116.42 117.41 1sxj h ASP 222 Ca 0.39 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.50 1sxj h ASP 222 Cb 0.62 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.22 1sxj h ASP 222 CO -0.81 0.09 -0.03 0.78 -1.72 0.00 0.00 179.24 177.56 1sxj h ASN 223 N 0.28 -0.06 -0.36 6.45 2.35 -1.21 -2.84 115.58 120.18 1sxj h ASN 223 Ca 0.20 -0.25 0.08 0.00 -0.55 0.00 0.00 56.30 55.77 1sxj h ASN 223 Cb 0.21 0.02 -0.08 0.00 0.05 0.00 0.00 38.32 38.52 1sxj h ASN 223 CO -0.23 0.22 -0.21 0.58 -1.65 0.00 0.00 177.43 176.15 1sxj h VAL 224 N -0.35 0.41 0.00 2.81 2.07 -0.32 0.17 116.25 121.04 1sxj h VAL 224 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1sxj h VAL 224 Cb 0.31 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1sxj h VAL 224 CO 0.01 0.00 0.00 0.49 0.02 0.00 0.00 177.57 178.09 1sxj n PHE 225 N -5.37 0.00 -0.01 1.57 0.99 -0.24 -1.95 117.46 112.45 1sxj n PHE 225 Ca 0.01 0.00 -0.17 0.00 -0.00 0.00 0.00 57.45 57.29 1sxj n PHE 225 Cb 0.29 -0.30 -0.14 0.00 -1.00 0.00 0.00 39.48 38.33 1sxj n PHE 225 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.76 177.63 1sxj h LYS 226 N 0.00 0.15 -0.15 -1.08 1.57 -0.41 -2.07 116.57 114.58 1sxj h LYS 226 Ca 0.00 -0.26 -0.19 0.00 -1.87 0.00 0.00 60.65 58.33 1sxj h LYS 226 Cb 0.13 0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 1sxj h LYS 226 CO 0.00 1.12 -0.68 -0.84 -0.57 0.00 0.00 179.45 178.48 1sxj h ILE 227 N -0.68 1.32 -0.74 1.86 -0.00 -1.29 -2.91 117.51 115.07 1sxj h ILE 227 Ca -0.07 -1.96 -0.02 0.00 -0.00 0.00 0.00 64.86 62.80 1sxj h ILE 227 Cb 1.32 1.94 -0.03 0.00 -0.00 0.00 0.00 36.82 40.04 1sxj h ILE 227 CO 0.08 0.61 0.37 0.58 -0.00 0.00 0.00 178.15 179.78 1sxj h VAL 228 N 0.43 1.23 -6.40 0.16 2.07 -1.51 -3.47 116.25 108.77 1sxj h VAL 228 Ca -0.02 -0.64 -0.48 0.00 0.82 0.00 0.00 66.70 66.38 1sxj h VAL 228 Cb 1.27 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1sxj h VAL 228 CO 0.13 0.27 -0.87 -0.67 0.02 0.00 0.00 177.57 176.46 1sxj n ASP 229 N -4.33 -0.84 -4.40 0.57 4.64 -0.78 -5.00 116.55 106.41 1sxj n ASP 229 Ca 0.07 -0.95 -0.21 0.00 -1.38 0.00 0.00 54.79 52.32 1sxj n ASP 229 Cb 0.13 -3.32 -0.10 0.00 -1.04 0.00 0.00 41.12 36.79 1sxj n ASP 229 CO 0.00 0.00 0.00 -0.44 -0.82 0.00 0.00 177.20 175.94 1sxj s SER 230 N -4.27 2.88 -0.18 1.67 0.01 -1.26 -5.07 113.70 107.48 1sxj s SER 230 Ca 0.07 -1.07 -0.41 0.00 1.31 0.00 0.00 55.95 55.85 1sxj s SER 230 Cb -0.04 -0.19 -0.18 0.00 0.21 0.00 0.00 66.02 65.83 1sxj s SER 230 CO 0.87 -0.16 1.44 -2.65 0.41 0.00 0.00 173.24 173.15 1sxj n PRO 231 N -0.49 0.56 -1.86 12.44 -0.02 -1.26 -4.79 135.00 139.58 1sxj n PRO 231 Ca -0.07 0.21 -0.42 0.00 -2.02 0.00 0.00 63.50 61.20 1sxj n PRO 231 Cb 0.61 -1.79 -0.03 0.00 -0.02 0.00 0.00 33.50 32.28 1sxj n PRO 231 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1sxj s HIS 232 N 1.77 2.26 0.30 6.00 2.46 -1.26 -4.87 115.29 121.95 1sxj s HIS 232 Ca 0.95 0.18 0.02 0.00 0.47 0.00 0.00 55.06 56.68 1sxj s HIS 232 Cb -1.20 -4.04 0.75 0.00 -0.13 0.00 0.00 32.58 27.96 1sxj s HIS 232 CO 0.63 -4.24 1.60 -1.35 -2.47 0.00 0.00 174.74 168.91 1sxj h PRO 233 N 8.57 0.07 -0.33 2.88 0.11 -1.98 -0.77 132.00 140.56 1sxj h PRO 233 Ca -0.44 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.73 1sxj h PRO 233 Cb 1.21 -0.02 -0.06 0.00 0.11 0.00 0.00 31.00 32.24 1sxj h PRO 233 CO 0.94 0.05 -0.06 -0.07 -0.21 0.00 0.00 178.00 178.64 1sxj h LEU 234 N 0.07 -0.27 0.17 2.35 4.07 -1.99 0.14 115.31 119.86 1sxj h LEU 234 Ca 0.58 0.09 -0.01 0.00 0.08 0.00 0.00 57.88 58.63 1sxj h LEU 234 Cb 1.21 0.19 0.00 0.00 1.08 0.00 0.00 40.66 43.14 1sxj h LEU 234 CO -0.81 -0.09 -0.08 0.40 -1.08 0.00 0.00 178.44 176.78 1sxj h ILE 235 N 0.02 0.87 -0.97 1.22 1.08 -1.53 -0.67 117.51 117.53 1sxj h ILE 235 Ca 0.16 -0.18 0.15 0.00 -0.39 0.00 0.00 64.86 64.59 1sxj h ILE 235 Cb 0.24 0.99 -0.08 0.00 -3.07 0.00 0.00 36.82 34.89 1sxj h ILE 235 CO -0.32 0.04 0.61 0.58 -0.69 0.00 0.00 178.15 178.37 1sxj h VAL 236 N -0.32 0.84 0.33 1.67 2.07 -1.10 -1.45 116.25 118.30 1sxj h VAL 236 Ca -0.02 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.19 1sxj h VAL 236 Cb 0.25 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.95 1sxj h VAL 236 CO 0.04 0.15 -0.16 0.50 0.02 0.00 0.00 177.57 178.12 1sxj h LYS 237 N 0.84 -0.43 0.00 1.57 3.64 -0.37 -2.38 116.57 119.45 1sxj h LYS 237 Ca 0.50 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.91 1sxj h LYS 237 Cb 0.67 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1sxj h LYS 237 CO -0.27 -0.12 0.14 1.17 -2.27 0.00 0.00 179.45 178.11 1sxj n LYS 238 N -5.15 0.08 -0.02 1.90 4.81 -0.29 -0.56 118.16 118.92 1sxj n LYS 238 Ca -0.10 0.54 -0.14 0.00 -0.87 0.00 0.00 58.31 57.74 1sxj n LYS 238 Cb 0.27 -1.90 -0.14 0.00 0.02 0.00 0.00 35.03 33.28 1sxj n LYS 238 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 1sxj n MET 239 N -1.91 0.69 0.19 1.64 1.56 -0.62 -3.15 117.12 115.51 1sxj n MET 239 Ca -0.01 0.25 0.08 0.00 -0.27 0.00 0.00 57.70 57.75 1sxj n MET 239 Cb 0.16 -1.72 0.11 0.00 2.15 0.00 0.00 33.22 33.92 1sxj n MET 239 CO 0.00 0.00 0.00 -0.07 -0.73 0.00 0.00 175.97 175.17 1sxj h LEU 240 N 0.03 0.00 -0.87 -0.89 3.38 -0.32 -3.31 115.31 113.33 1sxj h LEU 240 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1sxj h LEU 240 Cb 2.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.78 1sxj h LEU 240 CO 0.07 0.20 -0.46 0.18 0.09 0.00 0.00 178.44 178.52 1sxj n LEU 241 N -3.14 1.78 -4.64 1.67 4.77 -0.58 -4.98 117.00 111.89 1sxj n LEU 241 Ca 0.03 -0.74 -0.52 0.00 -0.03 0.00 0.00 56.01 54.75 1sxj n LEU 241 Cb 0.61 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.64 1sxj n LEU 241 CO 0.37 0.34 1.09 0.00 -1.33 0.00 0.00 177.39 177.85 1sxj n ALA 242 N -0.18 -0.35 0.30 -1.18 0.00 -1.19 -4.83 120.51 113.08 1sxj n ALA 242 Ca 0.08 0.46 0.16 0.00 0.00 0.00 0.00 53.44 54.14 1sxj n ALA 242 Cb 0.40 -2.18 0.92 0.00 0.00 0.00 0.00 19.45 18.59 1sxj n ALA 242 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1sxj h SER 243 N 5.73 0.00 -3.99 0.00 4.64 -1.94 -3.42 113.55 114.57 1sxj h SER 243 Ca -0.47 0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 60.16 1sxj h SER 243 Cb 1.32 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 63.09 1sxj h SER 243 CO 0.85 0.03 -0.88 0.20 -0.87 0.00 0.00 176.83 176.15 1sxj s ASN 244 N -5.98 3.07 0.53 4.97 0.01 -1.26 -5.00 114.94 111.27 1sxj s ASN 244 Ca -0.04 -0.51 0.21 0.00 -0.71 0.00 0.00 52.86 51.80 1sxj s ASN 244 Cb 0.14 -0.86 1.34 0.00 0.41 0.00 0.00 41.25 42.28 1sxj s ASN 244 CO 0.53 0.24 2.07 0.25 -1.51 0.00 0.00 177.10 178.68 1sxj h LEU 245 N 6.09 0.00 -0.45 0.60 5.85 -1.96 0.20 115.31 125.63 1sxj h LEU 245 Ca -0.31 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.32 1sxj h LEU 245 Cb 1.18 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 1sxj h LEU 245 CO 0.47 0.00 -0.06 -0.33 -0.34 0.00 0.00 178.44 178.18 1sxj h GLU 246 N 0.00 0.84 0.36 1.25 4.39 -1.95 -2.21 114.58 117.25 1sxj h GLU 246 Ca 0.14 -0.30 -0.02 0.00 0.34 0.00 0.00 59.36 59.52 1sxj h GLU 246 Cb 0.55 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.14 1sxj h GLU 246 CO -0.00 0.92 -0.17 -0.44 -1.16 0.00 0.00 179.01 178.16 1sxj h ASP 247 N 0.68 -0.40 -0.32 1.42 3.32 -1.36 -2.53 116.42 117.23 1sxj h ASP 247 Ca 0.12 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.14 1sxj h ASP 247 Cb 0.58 0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.22 1sxj h ASP 247 CO 0.03 -0.25 0.14 0.77 -1.72 0.00 0.00 179.24 178.22 1sxj h SER 248 N -0.52 0.48 0.56 6.45 4.64 -1.44 -0.52 113.55 123.19 1sxj h SER 248 Ca -0.05 -0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.18 1sxj h SER 248 Cb 0.39 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1sxj h SER 248 CO 0.08 0.44 -0.20 0.40 -0.87 0.00 0.00 176.83 176.68 1sxj h ILE 249 N 0.53 0.68 -0.08 0.95 2.04 -1.27 -1.28 117.51 119.07 1sxj h ILE 249 Ca 0.13 -0.87 -0.24 0.00 1.00 0.00 0.00 64.86 64.88 1sxj h ILE 249 Cb 0.12 1.55 0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1sxj h ILE 249 CO -0.01 0.20 -0.90 -0.61 0.00 0.00 0.00 178.15 176.83 1sxj h GLN 250 N 0.00 0.72 -0.78 2.37 4.15 -0.67 -1.11 115.11 119.79 1sxj h GLN 250 Ca -0.00 -0.67 -0.03 0.00 0.77 0.00 0.00 58.65 58.72 1sxj h GLN 250 Cb 0.54 0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.35 1sxj h GLN 250 CO 0.03 1.26 0.36 0.82 -1.93 0.00 0.00 178.83 179.36 1sxj h ILE 251 N 0.45 1.25 -0.27 2.39 1.08 -0.79 0.43 117.51 122.05 1sxj h ILE 251 Ca -0.08 -0.72 -0.11 0.00 -0.39 0.00 0.00 64.86 63.55 1sxj h ILE 251 Cb 1.53 0.27 -0.01 0.00 -3.07 0.00 0.00 36.82 35.54 1sxj h ILE 251 CO 0.18 0.30 -0.30 0.25 -0.69 0.00 0.00 178.15 177.89 1sxj h LEU 252 N 1.12 0.58 0.02 1.44 5.85 -1.15 -0.90 115.31 122.28 1sxj h LEU 252 Ca 0.27 -0.22 -0.09 0.00 0.84 0.00 0.00 57.88 58.68 1sxj h LEU 252 Cb 0.14 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.02 1sxj h LEU 252 CO -0.03 0.85 -0.36 -0.09 -0.34 0.00 0.00 178.44 178.47 1sxj h ARG 253 N 0.49 0.20 0.00 1.25 9.65 -0.44 0.11 114.38 125.64 1sxj h ARG 253 Ca 0.06 -0.25 -0.12 0.00 -1.10 0.00 0.00 59.98 58.58 1sxj h ARG 253 Cb 0.76 0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 29.40 1sxj h ARG 253 CO 0.06 1.01 -0.66 1.15 2.80 0.00 0.00 179.97 184.33 1sxj h THR 254 N -0.51 1.18 0.00 0.20 2.02 -0.23 -2.21 112.91 113.37 1sxj h THR 254 Ca -0.05 -2.13 0.00 0.00 0.77 0.00 0.00 66.41 65.00 1sxj h THR 254 Cb 1.16 2.47 0.00 0.00 -1.74 0.00 0.00 68.15 70.04 1sxj h THR 254 CO 0.07 0.40 -0.52 0.44 0.37 0.00 0.00 175.52 176.28 1sxj h ASP 255 N -1.00 0.00 0.00 4.18 3.32 -1.32 -3.37 116.42 118.23 1sxj h ASP 255 Ca -0.18 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.72 1sxj h ASP 255 Cb 1.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.63 1sxj h ASP 255 CO -0.11 0.08 -0.08 0.18 -1.72 0.00 0.00 179.24 177.59 1sxj n LEU 256 N -2.23 0.98 -0.03 1.55 4.77 -1.01 -4.61 117.00 116.43 1sxj n LEU 256 Ca 0.03 0.13 -0.12 0.00 -0.03 0.00 0.00 56.01 56.02 1sxj n LEU 256 Cb 0.45 -0.32 -0.07 0.00 -2.33 0.00 0.00 43.42 41.15 1sxj n LEU 256 CO 0.35 -0.67 0.71 -0.25 -1.33 0.00 0.00 177.39 176.20 1sxj h TRP 257 N -0.08 0.20 0.00 -1.77 2.91 -0.94 -2.81 115.95 113.46 1sxj h TRP 257 Ca 0.00 -0.04 0.00 0.00 1.13 0.00 0.00 58.89 59.98 1sxj h TRP 257 Cb 0.08 -0.05 0.00 0.00 -0.51 0.00 0.00 29.16 28.68 1sxj h TRP 257 CO -0.04 0.48 0.00 0.87 -1.03 0.00 0.00 178.44 178.72 1sxj h LYS 258 N -0.14 0.00 -0.39 2.65 6.56 -1.59 -1.61 116.57 122.04 1sxj h LYS 258 Ca 0.02 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.61 1sxj h LYS 258 Cb 0.41 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.07 1sxj h LYS 258 CO 0.01 0.00 0.00 1.63 -2.06 0.00 0.00 179.45 179.03 1sxj n LYS 259 N -3.02 2.03 -2.33 3.15 5.02 -1.12 -4.96 118.16 116.93 1sxj n LYS 259 Ca -0.01 -1.59 -0.08 0.00 -2.02 0.00 0.00 58.31 54.61 1sxj n LYS 259 Cb 0.20 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 1sxj n LYS 259 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1sxj n GLY 260 N 1.24 0.12 3.84 0.72 0.00 -0.61 -5.03 105.19 105.47 1sxj n GLY 260 Ca 0.16 -0.50 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 1sxj n GLY 260 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1sxj s TYR 261 N -2.56 3.59 0.55 1.61 1.51 -1.07 -5.03 117.35 115.94 1sxj s TYR 261 Ca 0.05 1.16 -0.21 0.00 -1.01 0.00 0.00 57.07 57.06 1sxj s TYR 261 Cb -0.02 -2.45 -0.05 0.00 -0.11 0.00 0.00 41.96 39.33 1sxj s TYR 261 CO 0.06 0.37 1.29 0.45 -1.11 0.00 0.00 175.55 176.61 1sxj n SER 262 N 0.64 2.34 0.25 2.29 2.88 -1.26 -4.81 113.62 115.95 1sxj n SER 262 Ca -0.03 0.95 0.11 0.00 -1.33 0.00 0.00 58.87 58.57 1sxj n SER 262 Cb 0.52 -1.54 0.62 0.00 -0.75 0.00 0.00 64.21 63.06 1sxj n SER 262 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1sxj h SER 263 N 1.28 0.00 0.15 -3.46 4.64 -1.96 -0.13 113.55 114.07 1sxj h SER 263 Ca -0.50 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 60.54 1sxj h SER 263 Cb 1.32 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.43 1sxj h SER 263 CO 0.56 0.17 -1.13 0.40 -0.87 0.00 0.00 176.83 175.96 1sxj h ILE 264 N 0.00 1.31 -0.44 0.95 1.08 -1.95 -3.04 117.51 115.42 1sxj h ILE 264 Ca -0.00 -2.42 0.01 0.00 -0.39 0.00 0.00 64.86 62.06 1sxj h ILE 264 Cb 0.48 2.56 -0.03 0.00 -3.07 0.00 0.00 36.82 36.76 1sxj h ILE 264 CO 0.02 0.74 0.27 0.44 -0.69 0.00 0.00 178.15 178.93 1sxj h ASP 265 N 0.30 0.46 0.79 1.72 3.32 -1.59 -1.96 116.42 119.45 1sxj h ASP 265 Ca -0.15 -0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.86 1sxj h ASP 265 Cb 1.80 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 41.24 1sxj h ASP 265 CO 0.21 0.33 -0.43 0.40 -1.72 0.00 0.00 179.24 178.03 1sxj h ILE 266 N 0.55 0.00 -0.13 0.35 1.08 -1.12 -2.77 117.51 115.48 1sxj h ILE 266 Ca 0.17 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.69 1sxj h ILE 266 Cb -0.02 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 33.66 1sxj h ILE 266 CO -0.06 0.00 -0.29 0.58 -0.69 0.00 0.00 178.15 177.69 1sxj h VAL 267 N -1.13 0.33 -0.47 1.67 2.07 -1.52 -0.73 116.25 116.47 1sxj h VAL 267 Ca -0.11 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.51 1sxj h VAL 267 Cb 0.89 0.33 -0.09 0.00 -1.52 0.00 0.00 31.29 30.89 1sxj h VAL 267 CO 0.14 0.00 -0.14 0.74 0.02 0.00 0.00 177.57 178.33 1sxj h THR 268 N -0.37 0.48 -0.59 2.57 2.02 -1.40 0.92 112.91 116.56 1sxj h THR 268 Ca 0.10 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.25 1sxj h THR 268 Cb 0.52 0.48 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 1sxj h THR 268 CO -0.34 0.00 0.26 0.74 0.37 0.00 0.00 175.52 176.55 1sxj h THR 269 N -0.03 1.22 -0.85 3.16 2.02 -1.19 -0.64 112.91 116.59 1sxj h THR 269 Ca 0.23 -0.64 0.14 0.00 0.77 0.00 0.00 66.41 66.90 1sxj h THR 269 Cb 0.38 0.55 -0.09 0.00 -1.74 0.00 0.00 68.15 67.25 1sxj h THR 269 CO -0.50 0.26 0.45 0.28 0.37 0.00 0.00 175.52 176.37 1sxj h SER 270 N 0.80 0.56 0.09 4.18 0.02 0.42 0.61 113.55 120.23 1sxj h SER 270 Ca 0.20 0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 61.23 1sxj h SER 270 Cb 0.16 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.69 1sxj h SER 270 CO -0.02 0.25 -0.04 0.15 -1.14 0.00 0.00 176.83 176.03 1sxj h PHE 271 N 0.66 -0.11 -0.76 3.45 -0.00 -0.43 0.72 116.94 120.46 1sxj h PHE 271 Ca 0.45 -0.00 0.09 0.00 -0.00 0.00 0.00 57.97 58.51 1sxj h PHE 271 Cb 0.61 0.04 -0.07 0.00 -0.00 0.00 0.00 35.95 36.52 1sxj h PHE 271 CO -0.08 0.26 0.42 -0.09 -0.00 0.00 0.00 178.31 178.81 1sxj h ARG 272 N -0.50 0.69 -0.26 1.11 2.43 0.16 -0.82 114.38 117.19 1sxj h ARG 272 Ca -0.01 -0.04 -0.16 0.00 -0.81 0.00 0.00 59.98 58.96 1sxj h ARG 272 Cb 0.42 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1sxj h ARG 272 CO 0.02 0.46 -0.45 0.28 -1.51 0.00 0.00 179.97 178.76 1sxj h VAL 273 N 0.71 1.30 -0.85 0.20 2.07 0.22 -3.04 116.25 116.86 1sxj h VAL 273 Ca 0.37 -1.65 0.04 0.00 0.82 0.00 0.00 66.70 66.27 1sxj h VAL 273 Cb 0.33 1.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.75 1sxj h VAL 273 CO -0.24 0.53 0.56 0.74 0.02 0.00 0.00 177.57 179.17 1sxj h THR 274 N 0.52 1.13 -0.79 2.57 2.02 -0.33 -2.03 112.91 115.99 1sxj h THR 274 Ca 0.02 -0.36 0.01 0.00 0.77 0.00 0.00 66.41 66.85 1sxj h THR 274 Cb 1.06 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.43 1sxj h THR 274 CO 0.10 0.19 0.52 0.50 0.37 0.00 0.00 175.52 177.21 1sxj h LYS 275 N 1.04 1.03 -0.47 6.66 3.64 -1.06 -2.59 116.57 124.82 1sxj h LYS 275 Ca 0.34 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 1sxj h LYS 275 Cb 0.05 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 1sxj h LYS 275 CO -0.10 0.68 0.00 0.09 -2.27 0.00 0.00 179.45 177.85 1sxj n ASN 276 N -4.54 2.65 -3.99 4.20 3.02 -0.87 -4.74 115.26 110.98 1sxj n ASN 276 Ca 0.08 -1.98 -0.40 0.00 -0.03 0.00 0.00 54.58 52.26 1sxj n ASN 276 Cb 0.03 -0.31 -0.03 0.00 -0.61 0.00 0.00 39.78 38.85 1sxj n ASN 276 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1sxj n LEU 277 N 0.95 4.76 -0.18 3.41 7.94 -0.82 -4.71 117.00 128.35 1sxj n LEU 277 Ca 0.17 -3.44 0.17 0.00 -1.11 0.00 0.00 56.01 51.79 1sxj n LEU 277 Cb 0.43 -1.48 0.52 0.00 0.53 0.00 0.00 43.42 43.41 1sxj n LEU 277 CO 0.12 -0.18 1.21 0.00 -1.11 0.00 0.00 177.39 177.43 1sxj h ALA 278 N 7.70 2.17 -0.80 1.96 0.00 -1.87 -1.69 119.26 126.72 1sxj h ALA 278 Ca 0.43 0.00 0.16 0.00 0.00 0.00 0.00 54.91 55.50 1sxj h ALA 278 Cb 0.75 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.39 1sxj h ALA 278 CO 1.72 -0.39 0.34 0.37 0.00 0.00 0.00 179.25 181.28 1sxj h GLN 279 N 0.39 0.44 -7.71 0.00 5.75 -1.99 -3.42 115.11 108.57 1sxj h GLN 279 Ca 0.39 -0.03 -0.45 0.00 -0.15 0.00 0.00 58.65 58.41 1sxj h GLN 279 Cb 0.96 -0.10 0.14 0.00 1.07 0.00 0.00 27.48 29.55 1sxj h GLN 279 CO -0.13 0.29 0.39 0.08 -2.65 0.00 0.00 178.83 176.82 1sxj s VAL 280 N -5.98 2.02 -0.04 2.39 1.01 -0.63 -5.07 120.40 114.09 1sxj s VAL 280 Ca -0.12 -0.05 -0.05 0.00 0.00 0.00 0.00 61.98 61.76 1sxj s VAL 280 Cb 0.22 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 1sxj s VAL 280 CO 0.77 0.00 0.19 -0.54 0.00 0.00 0.00 175.10 175.51 1sxj s LYS 281 N -5.74 3.47 0.17 2.72 1.02 -1.26 -4.92 119.74 115.19 1sxj s LYS 281 Ca 0.70 -0.22 -0.23 0.00 0.02 0.00 0.00 55.97 56.24 1sxj s LYS 281 Cb -0.06 -3.12 0.04 0.00 -0.52 0.00 0.00 37.83 34.17 1sxj s LYS 281 CO 0.51 0.70 1.37 0.39 -0.92 0.00 0.00 175.35 177.40 1sxj n GLU 282 N 1.29 -0.32 -0.29 1.68 -0.58 -1.26 0.86 120.64 122.02 1sxj n GLU 282 Ca -0.14 1.34 0.08 0.00 -0.42 0.00 0.00 57.16 58.03 1sxj n GLU 282 Cb 0.53 -1.98 0.24 0.00 -0.57 0.00 0.00 31.44 29.66 1sxj n GLU 282 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 1sxj h SER 283 N 0.00 0.42 -0.01 1.62 0.02 -1.99 -1.23 113.55 112.38 1sxj h SER 283 Ca 0.20 0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.26 1sxj h SER 283 Cb 0.43 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.03 1sxj h SER 283 CO -0.85 0.14 -0.02 0.58 -1.14 0.00 0.00 176.83 175.54 1sxj h VAL 284 N 0.52 1.45 -0.75 2.27 2.07 0.07 -2.47 116.25 119.40 1sxj h VAL 284 Ca 0.48 -1.35 0.07 0.00 0.82 0.00 0.00 66.70 66.72 1sxj h VAL 284 Cb 0.76 2.33 -0.05 0.00 -1.52 0.00 0.00 31.29 32.81 1sxj h VAL 284 CO -0.42 0.35 0.49 0.03 0.02 0.00 0.00 177.57 178.05 1sxj h ARG 285 N -0.52 0.77 -0.33 1.57 3.08 -0.20 -1.40 114.38 117.34 1sxj h ARG 285 Ca 0.00 -0.05 -0.15 0.00 0.07 0.00 0.00 59.98 59.86 1sxj h ARG 285 Cb 0.59 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.46 1sxj h ARG 285 CO 0.00 0.51 -0.37 -0.07 -1.07 0.00 0.00 179.97 178.97 1sxj h LEU 286 N 0.79 0.90 -1.06 3.04 3.38 -1.25 0.65 115.31 121.77 1sxj h LEU 286 Ca 0.33 -0.48 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 1sxj h LEU 286 Cb 0.26 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1sxj h LEU 286 CO -0.11 1.20 -0.13 -0.33 0.09 0.00 0.00 178.44 179.16 1sxj h GLU 287 N 0.63 0.51 0.43 1.13 5.08 -0.93 -0.55 114.58 120.88 1sxj h GLU 287 Ca 0.05 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 1sxj h GLU 287 Cb 0.96 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1sxj h GLU 287 CO 0.09 0.64 -0.21 0.52 -1.00 0.00 0.00 179.01 179.05 1sxj h MET 288 N 0.47 -0.56 -0.75 2.33 2.86 -1.09 -2.62 114.93 115.58 1sxj h MET 288 Ca 0.09 0.04 0.16 0.00 -2.06 0.00 0.00 59.70 57.93 1sxj h MET 288 Cb 0.51 0.13 -0.14 0.00 0.06 0.00 0.00 31.60 32.16 1sxj h MET 288 CO 0.03 -0.25 -0.09 0.82 1.06 0.00 0.00 176.91 178.48 1sxj h ILE 289 N -0.88 0.29 -1.00 -1.22 2.04 -0.66 1.04 117.51 117.12 1sxj h ILE 289 Ca -0.06 -0.02 0.21 0.00 1.00 0.00 0.00 64.86 65.99 1sxj h ILE 289 Cb 0.56 0.24 -0.11 0.00 -0.74 0.00 0.00 36.82 36.78 1sxj h ILE 289 CO 0.10 0.01 0.61 0.50 0.00 0.00 0.00 178.15 179.37 1sxj h LYS 290 N 0.05 0.65 0.21 2.37 3.64 -0.98 0.34 116.57 122.84 1sxj h LYS 290 Ca 0.39 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.72 1sxj h LYS 290 Cb 0.65 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1sxj h LYS 290 CO -0.72 0.43 -0.10 0.93 -2.27 0.00 0.00 179.45 177.72 1sxj h GLU 291 N 0.67 -0.27 -0.96 1.90 4.39 0.14 -1.96 114.58 118.48 1sxj h GLU 291 Ca 0.58 0.02 0.21 0.00 0.34 0.00 0.00 59.36 60.52 1sxj h GLU 291 Cb 1.03 0.06 -0.12 0.00 -0.10 0.00 0.00 28.75 29.63 1sxj h GLU 291 CO -0.37 0.08 0.54 0.82 -1.16 0.00 0.00 179.01 178.91 1sxj h ILE 292 N -0.94 0.59 -0.14 3.13 2.04 -0.20 -0.07 117.51 121.92 1sxj h ILE 292 Ca -0.03 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.60 1sxj h ILE 292 Cb 0.48 -0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1sxj h ILE 292 CO 0.05 0.11 -0.01 1.23 0.00 0.00 0.00 178.15 179.53 1sxj h GLY 293 N 0.60 0.28 0.34 5.37 0.00 -0.39 0.17 103.07 109.43 1sxj h GLY 293 Ca 0.59 -0.21 0.10 0.00 0.00 0.00 0.00 47.33 47.81 1sxj h GLY 293 CO -0.45 0.19 0.20 -2.00 0.00 0.00 0.00 176.54 174.49 1sxj h LEU 294 N -0.01 0.17 -0.17 3.11 5.85 -0.26 0.14 115.31 124.13 1sxj h LEU 294 Ca 0.04 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1sxj h LEU 294 Cb 0.39 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1sxj h LEU 294 CO 0.01 0.10 0.05 0.74 -0.34 0.00 0.00 178.44 179.00 1sxj h THR 295 N 0.37 1.19 -0.43 1.05 2.02 -1.02 -2.44 112.91 113.65 1sxj h THR 295 Ca 0.31 -0.61 0.09 0.00 0.77 0.00 0.00 66.41 66.97 1sxj h THR 295 Cb 0.41 1.28 -0.09 0.00 -1.74 0.00 0.00 68.15 68.00 1sxj h THR 295 CO -0.33 0.19 -0.23 -0.74 0.37 0.00 0.00 175.52 174.78 1sxj h HIS 296 N 0.09 -0.59 0.00 3.16 -0.00 0.89 0.33 115.15 119.02 1sxj h HIS 296 Ca 0.05 0.05 -0.02 0.00 -0.00 0.00 0.00 60.37 60.46 1sxj h HIS 296 Cb 0.24 0.33 -0.00 0.00 -0.00 0.00 0.00 27.41 27.98 1sxj h HIS 296 CO 0.00 -0.31 -0.07 0.52 -0.00 0.00 0.00 177.93 178.07 1sxj h MET 297 N -0.15 0.00 -0.21 5.26 2.07 -0.70 -0.11 114.93 121.09 1sxj h MET 297 Ca 0.20 0.00 -0.13 0.00 -2.07 0.00 0.00 59.70 57.70 1sxj h MET 297 Cb 0.47 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.20 1sxj h MET 297 CO -0.52 0.07 -0.40 -0.09 1.07 0.00 0.00 176.91 177.05 1sxj h ARG 298 N 0.00 0.64 -0.82 1.72 9.65 0.02 -2.21 114.38 123.38 1sxj h ARG 298 Ca -0.00 -0.41 0.04 0.00 -1.10 0.00 0.00 59.98 58.51 1sxj h ARG 298 Cb 0.18 0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 28.76 1sxj h ARG 298 CO 0.01 1.02 0.54 0.82 2.80 0.00 0.00 179.97 185.16 1sxj h ILE 299 N 0.33 1.11 0.00 1.20 1.08 0.95 -1.41 117.51 120.77 1sxj h ILE 299 Ca 0.01 -0.34 -0.01 0.00 -0.39 0.00 0.00 64.86 64.13 1sxj h ILE 299 Cb 0.99 0.04 -0.00 0.00 -3.07 0.00 0.00 36.82 34.78 1sxj h ILE 299 CO 0.09 0.18 -0.04 -0.07 -0.69 0.00 0.00 178.15 177.62 1sxj h LEU 300 N 0.99 0.00 -1.85 1.44 3.38 -1.01 -2.91 115.31 115.35 1sxj h LEU 300 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1sxj h LEU 300 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1sxj h LEU 300 CO -0.10 0.04 0.00 -0.62 0.09 0.00 0.00 178.44 177.85 1sxj n GLU 301 N -3.13 2.36 0.00 1.13 1.02 -0.54 -4.92 120.64 116.55 1sxj n GLU 301 Ca 0.02 -1.64 0.00 0.00 -0.02 0.00 0.00 57.16 55.52 1sxj n GLU 301 Cb 0.41 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 30.33 1sxj n GLU 301 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1sxj n GLY 302 N 0.96 3.10 2.72 0.62 0.00 -1.10 -4.98 105.19 106.51 1sxj n GLY 302 Ca 0.15 -0.96 -0.33 0.00 0.00 0.00 0.00 46.02 44.88 1sxj n GLY 302 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1sxj n VAL 303 N 0.00 2.64 -2.40 1.61 0.24 -1.13 -4.73 118.33 114.55 1sxj n VAL 303 Ca 0.00 -1.82 -0.41 0.00 -2.04 0.00 0.00 64.34 60.07 1sxj n VAL 303 Cb 0.00 -2.31 0.01 0.00 -1.47 0.00 0.00 33.84 30.07 1sxj n VAL 303 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1sxj n GLY 304 N 3.99 5.62 3.95 7.63 0.00 -1.26 -4.12 105.19 121.00 1sxj n GLY 304 Ca 0.52 -2.36 -0.23 0.00 0.00 0.00 0.00 46.02 43.95 1sxj n GLY 304 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1sxj s THR 305 N -2.69 4.86 0.16 2.61 -4.23 -1.26 -4.86 115.64 110.22 1sxj s THR 305 Ca 0.44 -0.57 -0.16 0.00 -1.18 0.00 0.00 61.69 60.22 1sxj s THR 305 Cb 0.17 -3.76 0.03 0.00 1.34 0.00 0.00 72.50 70.28 1sxj s THR 305 CO -0.09 -0.47 1.74 0.22 -0.54 0.00 0.00 174.62 175.48 1sxj h TYR 306 N 0.75 0.16 -0.88 3.99 3.20 -2.01 -2.35 116.97 119.84 1sxj h TYR 306 Ca -0.49 0.02 0.12 0.00 3.14 0.00 0.00 58.73 61.52 1sxj h TYR 306 Cb 1.23 -0.02 -0.13 0.00 1.54 0.00 0.00 36.73 39.35 1sxj h TYR 306 CO 0.49 0.05 -0.46 1.25 -1.64 0.00 0.00 178.16 177.84 1sxj h LEU 307 N 0.23 -1.68 -0.55 2.82 5.85 -1.98 -0.28 115.31 119.73 1sxj h LEU 307 Ca 0.17 0.30 0.11 0.00 0.84 0.00 0.00 57.88 59.30 1sxj h LEU 307 Cb 0.18 0.80 -0.11 0.00 0.37 0.00 0.00 40.66 41.90 1sxj h LEU 307 CO -0.20 -0.28 -0.21 1.56 -0.34 0.00 0.00 178.44 178.96 1sxj h GLN 308 N -0.07 -0.08 -0.79 1.25 1.08 -1.75 0.84 115.11 115.60 1sxj h GLN 308 Ca 0.24 0.01 0.05 0.00 -1.45 0.00 0.00 58.65 57.50 1sxj h GLN 308 Cb 0.53 0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 27.93 1sxj h GLN 308 CO -0.89 -0.05 0.52 -0.07 -0.95 0.00 0.00 178.83 177.39 1sxj h LEU 309 N -0.08 0.78 -0.22 1.46 3.38 -1.00 -0.99 115.31 118.65 1sxj h LEU 309 Ca 0.25 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 1sxj h LEU 309 Cb 0.48 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1sxj h LEU 309 CO -0.60 0.52 0.05 0.00 0.09 0.00 0.00 178.44 178.49 1sxj h ALA 310 N 1.56 0.29 -0.43 1.53 0.00 0.01 -2.12 119.26 120.10 1sxj h ALA 310 Ca 0.33 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.09 1sxj h ALA 310 Cb 0.16 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1sxj h ALA 310 CO -0.11 -0.06 0.29 1.03 0.00 0.00 0.00 179.25 180.40 1sxj h SER 311 N 0.17 0.45 0.88 0.00 0.87 -0.49 0.78 113.55 116.21 1sxj h SER 311 Ca 0.07 -0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.58 1sxj h SER 311 Cb 0.29 -0.11 0.01 0.00 -0.44 0.00 0.00 62.40 62.15 1sxj h SER 311 CO 0.00 0.32 -0.42 -0.03 -0.53 0.00 0.00 176.83 176.17 1sxj h MET 312 N 0.53 -1.14 -0.94 2.24 -1.53 -0.69 0.16 114.93 113.56 1sxj h MET 312 Ca 0.16 0.08 0.13 0.00 -3.44 0.00 0.00 59.70 56.63 1sxj h MET 312 Cb 0.01 0.26 -0.08 0.00 -0.55 0.00 0.00 31.60 31.24 1sxj h MET 312 CO -0.04 -0.76 0.60 -0.07 0.14 0.00 0.00 176.91 176.78 1sxj h LEU 313 N -1.20 0.79 0.52 3.39 3.38 -1.03 0.64 115.31 121.80 1sxj h LEU 313 Ca -0.12 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1sxj h LEU 313 Cb 0.91 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1sxj h LEU 313 CO 0.20 0.41 -0.28 0.00 0.09 0.00 0.00 178.44 178.86 1sxj h ALA 314 N 1.57 -0.74 -0.53 1.53 0.00 -0.54 -1.41 119.26 119.15 1sxj h ALA 314 Ca 0.47 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.24 1sxj h ALA 314 Cb 0.60 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1sxj h ALA 314 CO -0.24 -0.92 0.35 0.87 0.00 0.00 0.00 179.25 179.31 1sxj h LYS 315 N -0.74 0.66 0.36 0.00 1.57 0.12 -1.54 116.57 117.01 1sxj h LYS 315 Ca -0.07 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 1sxj h LYS 315 Cb 0.58 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1sxj h LYS 315 CO 0.09 0.44 -0.31 0.82 -0.57 0.00 0.00 179.45 179.92 1sxj h ILE 316 N 0.68 0.00 -1.04 1.86 1.08 -0.37 -2.35 117.51 117.37 1sxj h ILE 316 Ca 0.20 0.00 0.29 0.00 -0.39 0.00 0.00 64.86 64.96 1sxj h ILE 316 Cb -0.03 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 33.60 1sxj h ILE 316 CO -0.05 0.00 0.63 0.45 -0.69 0.00 0.00 178.15 178.50 1sxj h HIS 317 N -0.66 0.85 -0.96 1.37 3.86 -0.85 0.37 115.15 119.13 1sxj h HIS 317 Ca -0.05 0.03 0.06 0.00 -1.16 0.00 0.00 60.37 59.25 1sxj h HIS 317 Cb 0.56 -0.24 -0.06 0.00 1.06 0.00 0.00 27.41 28.73 1sxj h HIS 317 CO -0.14 -0.03 0.62 -0.22 0.86 0.00 0.00 177.93 179.02 1sxj h LYS 318 N 0.41 1.11 0.02 2.45 3.64 -0.78 -1.79 116.57 121.63 1sxj h LYS 318 Ca 0.68 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.91 1sxj h LYS 318 Cb 1.56 -0.25 0.01 0.00 -0.41 0.00 0.00 32.23 33.13 1sxj h LYS 318 CO -0.46 0.74 -0.30 -0.07 -2.27 0.00 0.00 179.45 177.09 1sxj h LEU 319 N 1.15 0.24 -0.44 5.20 3.38 0.04 -2.71 115.31 122.16 1sxj h LEU 319 Ca 0.41 -0.83 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1sxj h LEU 319 Cb 0.13 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1sxj h LEU 319 CO -0.16 1.03 0.00 -3.20 0.09 0.00 0.00 178.44 176.20 1sxj n ASN 320 N -4.46 0.26 0.00 -0.43 2.85 -0.07 -1.98 115.26 111.42 1sxj n ASN 320 Ca -0.10 -1.16 0.00 0.00 -0.11 0.00 0.00 54.58 53.21 1sxj n ASN 320 Cb 0.55 -0.13 0.00 0.00 1.24 0.00 0.00 39.78 41.44 1sxj n ASN 320 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1sxj n ASN 321 N -0.18 3.40 -0.07 1.20 2.85 -0.69 -4.99 115.26 116.78 1sxj n ASN 321 Ca 0.00 0.00 0.16 0.00 -0.11 0.00 0.00 54.58 54.63 1sxj n ASN 321 Cb 0.06 0.42 0.89 0.00 1.24 0.00 0.00 39.78 42.39 1sxj n ASN 321 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32