#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1upx s ASN 2 N 0.00 7.33 0.38 6.43 0.02 -1.26 -4.94 114.94 122.90 1upx s ASN 2 Ca 0.00 2.04 0.14 0.00 -1.02 0.00 0.00 52.86 54.02 1upx s ASN 2 Cb 0.00 -2.60 0.76 0.00 0.02 0.00 0.00 41.25 39.42 1upx s ASN 2 CO 0.00 -0.17 1.83 0.00 0.02 0.00 0.00 177.10 178.78 1upx h ALA 3 N 5.09 1.35 -2.86 0.60 0.00 -1.79 -3.46 119.26 118.20 1upx h ALA 3 Ca -0.44 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.11 1upx h ALA 3 Cb 1.21 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.85 1upx h ALA 3 CO 0.72 0.45 -0.04 0.00 0.00 0.00 0.00 179.25 180.38 1upx s MET 4 N -4.15 1.52 -0.19 0.00 0.00 -0.76 -4.84 119.30 110.88 1upx s MET 4 Ca -0.03 -1.10 -0.04 0.00 0.00 0.00 0.00 55.69 54.52 1upx s MET 4 Cb 0.14 0.50 0.09 0.00 0.00 0.00 0.00 34.83 35.56 1upx s MET 4 CO 0.72 -0.64 0.29 0.12 0.00 0.00 0.00 175.02 175.50 1upx s PHE 5 N -3.96 -0.51 -0.03 3.16 5.36 -1.24 -4.16 117.98 116.60 1upx s PHE 5 Ca 0.17 0.73 -0.01 0.00 -0.96 0.00 0.00 56.93 56.86 1upx s PHE 5 Cb -0.01 -0.10 0.02 0.00 -0.34 0.00 0.00 43.02 42.59 1upx s PHE 5 CO 0.05 -0.54 0.06 0.00 -1.46 0.00 0.00 175.22 173.33 1upx n TYR 7 N 3.85 0.00 0.71 0.00 -0.00 -1.26 -0.60 117.16 119.87 1upx n TYR 7 Ca -0.23 -0.38 0.13 0.00 -0.00 0.00 0.00 57.90 57.42 1upx n TYR 7 Cb 0.53 -0.12 0.40 0.00 -0.00 0.00 0.00 39.34 40.15 1upx n TYR 7 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1upx n GLN 8 N 0.38 0.20 -4.39 -3.48 10.64 -1.26 -4.42 117.38 115.05 1upx n GLN 8 Ca 0.04 0.14 -0.26 0.00 -1.83 0.00 0.00 57.00 55.09 1upx n GLN 8 Cb 1.04 -1.71 -0.09 0.00 -0.86 0.00 0.00 30.24 28.62 1upx n GLN 8 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1upx h GLN 10 N 1.69 0.00 -0.35 0.00 -0.00 -1.31 -2.84 115.11 112.31 1upx h GLN 10 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.22 1upx h GLN 10 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.73 1upx h GLN 10 CO 0.73 0.17 0.00 0.39 0.00 0.00 0.00 178.83 180.12 1upx n GLU 11 N -4.13 1.84 -1.62 1.69 1.02 -1.26 -4.87 120.64 113.30 1upx n GLU 11 Ca -0.02 -1.30 -0.41 0.00 -0.02 0.00 0.00 57.16 55.41 1upx n GLU 11 Cb 0.24 -1.30 0.01 0.00 -0.02 0.00 0.00 31.44 30.38 1upx n GLU 11 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 1upx n THR 12 N 0.55 2.54 -1.67 2.62 5.66 -1.07 -4.75 114.28 118.16 1upx n THR 12 Ca 0.13 -0.50 -0.46 0.00 -3.05 0.00 0.00 64.05 60.16 1upx n THR 12 Cb 0.31 -1.21 -0.04 0.00 -1.55 0.00 0.00 70.33 67.84 1upx n THR 12 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1upx n VAL 13 N -0.54 0.13 -1.26 1.08 0.31 -1.26 -1.33 118.33 115.47 1upx n VAL 13 Ca 0.09 -0.02 -0.09 0.00 -0.01 0.00 0.00 64.34 64.31 1upx n VAL 13 Cb 0.40 -1.62 -0.04 0.00 -0.91 0.00 0.00 33.84 31.67 1upx n VAL 13 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1upx n GLY 14 N 3.63 0.91 3.83 2.92 0.00 -1.26 -0.78 105.19 114.44 1upx n GLY 14 Ca 0.18 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 1upx n GLY 14 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1upx n ASN 15 N -0.85 -3.93 0.00 1.61 5.15 -0.44 -4.84 115.26 111.95 1upx n ASN 15 Ca -0.09 -0.73 0.00 0.00 -0.60 0.00 0.00 54.58 53.17 1upx n ASN 15 Cb 0.50 -3.20 0.00 0.00 -0.53 0.00 0.00 39.78 36.56 1upx n ASN 15 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1upx n LYS 16 N -4.24 0.00 0.00 1.20 5.02 0.04 -4.55 118.16 115.63 1upx n LYS 16 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1upx n LYS 16 Cb 0.52 -0.43 0.00 0.00 -0.02 0.00 0.00 35.03 35.09 1upx n LYS 16 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1upx n GLY 17 N 2.47 3.84 3.62 0.72 0.00 -0.70 -4.87 105.19 110.28 1upx n GLY 17 Ca 0.00 -0.40 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 1upx n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1upx n THR 19 N 5.53 0.00 0.05 0.00 -2.24 -1.26 -1.84 114.28 114.53 1upx n THR 19 Ca 0.05 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1upx n THR 19 Cb 0.48 0.68 0.00 0.00 -2.10 0.00 0.00 70.33 69.39 1upx n THR 19 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1upx n GLN 20 N -1.45 0.00 -4.02 -0.78 -0.06 -1.26 -1.82 117.38 107.98 1upx n GLN 20 Ca 0.00 0.00 -0.12 0.00 -2.00 0.00 0.00 57.00 54.88 1upx n GLN 20 Cb 0.15 -0.38 -0.12 0.00 -4.06 0.00 0.00 30.24 25.82 1upx n GLN 20 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 1upx s VAL 21 N -2.00 0.31 0.39 1.69 1.01 -1.26 -3.94 120.40 116.60 1upx s VAL 21 Ca 0.00 -0.82 -0.24 0.00 0.00 0.00 0.00 61.98 60.92 1upx s VAL 21 Cb 0.00 -0.39 -0.09 0.00 0.00 0.00 0.00 36.38 35.90 1upx s VAL 21 CO 0.00 -0.34 1.03 -0.83 0.00 0.00 0.00 175.10 174.96 1upx s GLY 22 N -1.23 2.72 0.53 4.51 0.00 0.12 -4.86 107.32 109.10 1upx s GLY 22 Ca -0.10 0.65 0.21 0.00 0.00 0.00 0.00 44.72 45.48 1upx s GLY 22 CO -0.00 1.07 2.07 -2.08 0.00 0.00 0.00 173.10 174.16 1upx h VAL 23 N 2.24 0.85 0.00 1.40 2.07 -1.89 -0.67 116.25 120.24 1upx h VAL 23 Ca -0.48 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.04 1upx h VAL 23 Cb 1.21 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1upx h VAL 23 CO 0.63 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.22 1upx n GLY 25 N 0.95 0.46 3.66 0.00 0.00 -0.26 -4.55 105.19 105.45 1upx n GLY 25 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1upx n GLY 25 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1upx s LYS 26 N -0.81 4.20 0.54 1.61 2.20 -1.26 -4.75 119.74 121.47 1upx s LYS 26 Ca 0.00 2.12 -0.13 0.00 -0.36 0.00 0.00 55.97 57.60 1upx s LYS 26 Cb 0.00 -3.90 -0.06 0.00 -1.51 0.00 0.00 37.83 32.36 1upx s LYS 26 CO 0.00 -0.80 0.96 0.15 -0.36 0.00 0.00 175.35 175.30 1upx s LYS 27 N 3.74 3.75 0.42 4.03 1.02 -1.26 -0.70 119.74 130.74 1upx s LYS 27 Ca 0.70 0.76 0.09 0.00 0.02 0.00 0.00 55.97 57.54 1upx s LYS 27 Cb -0.32 -2.16 0.92 0.00 -0.52 0.00 0.00 37.83 35.75 1upx s LYS 27 CO 0.28 -0.36 2.06 -1.00 -0.92 0.00 0.00 175.35 175.40 1upx h PRO 28 N 0.39 0.47 -0.22 -1.68 0.13 -1.90 -0.20 132.00 129.00 1upx h PRO 28 Ca -0.46 -0.03 -0.14 0.00 -0.87 0.00 0.00 66.00 64.50 1upx h PRO 28 Cb 1.19 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1upx h PRO 28 CO 0.62 0.31 -0.45 0.93 -0.23 0.00 0.00 178.00 179.18 1upx h GLU 29 N 0.48 0.56 -0.43 0.86 5.08 -1.93 -0.59 114.58 118.61 1upx h GLU 29 Ca 0.15 -0.30 -0.03 0.00 -1.00 0.00 0.00 59.36 58.18 1upx h GLU 29 Cb 0.02 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1upx h GLU 29 CO -0.04 0.90 0.16 1.15 -1.00 0.00 0.00 179.01 180.18 1upx h THR 30 N 0.45 1.21 -0.95 1.13 2.02 -1.64 -1.33 112.91 113.79 1upx h THR 30 Ca 0.03 -0.65 0.01 0.00 0.77 0.00 0.00 66.41 66.57 1upx h THR 30 Cb 0.96 0.84 -0.05 0.00 -1.74 0.00 0.00 68.15 68.16 1upx h THR 30 CO 0.09 0.24 0.63 0.00 0.37 0.00 0.00 175.52 176.84 1upx h ALA 31 N 1.01 1.32 -0.42 6.16 0.00 -0.84 -1.24 119.26 125.24 1upx h ALA 31 Ca 0.14 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1upx h ALA 31 Cb 0.21 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1upx h ALA 31 CO -0.01 0.63 0.10 0.00 0.00 0.00 0.00 179.25 179.97 1upx h ALA 32 N 1.41 0.56 -0.70 0.00 0.00 -0.78 -0.97 119.26 118.77 1upx h ALA 32 Ca 0.35 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1upx h ALA 32 Cb -0.15 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 1upx h ALA 32 CO -0.08 0.25 0.23 -0.07 0.00 0.00 0.00 179.25 179.58 1upx h LEU 33 N 0.55 1.00 -0.75 0.00 3.38 -0.87 -0.17 115.31 118.45 1upx h LEU 33 Ca 0.13 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 1upx h LEU 33 Cb 0.33 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1upx h LEU 33 CO 0.00 0.93 0.17 1.56 0.09 0.00 0.00 178.44 181.19 1upx h GLN 34 N 1.04 1.11 -0.72 1.13 4.20 -1.03 -0.10 115.11 120.74 1upx h GLN 34 Ca 0.23 -0.26 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 1upx h GLN 34 Cb 0.28 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.88 1upx h GLN 34 CO -0.01 0.98 0.37 -0.44 -0.67 0.00 0.00 178.83 179.06 1upx h ASP 35 N 1.06 0.92 -0.67 1.46 3.32 -0.63 -0.35 116.42 121.52 1upx h ASP 35 Ca 0.22 -0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.09 1upx h ASP 35 Cb 0.37 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 1upx h ASP 35 CO 0.00 0.77 0.16 0.00 -1.72 0.00 0.00 179.24 178.46 1upx h ALA 36 N 1.18 0.99 -0.48 3.45 0.00 -0.73 -1.47 119.26 122.20 1upx h ALA 36 Ca 0.25 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 1upx h ALA 36 Cb 0.08 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1upx h ALA 36 CO -0.04 0.65 -0.12 1.25 0.00 0.00 0.00 179.25 181.00 1upx h LEU 37 N 1.04 0.93 -0.69 0.00 5.85 -0.56 -1.72 115.31 120.16 1upx h LEU 37 Ca 0.22 -0.36 -0.06 0.00 0.84 0.00 0.00 57.88 58.52 1upx h LEU 37 Cb 0.37 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 1upx h LEU 37 CO 0.00 1.08 0.21 0.40 -0.34 0.00 0.00 178.44 179.79 1upx h ILE 38 N 0.78 1.26 0.03 4.05 1.08 -0.92 -0.60 117.51 123.19 1upx h ILE 38 Ca 0.12 -0.89 0.01 0.00 -0.39 0.00 0.00 64.86 63.72 1upx h ILE 38 Cb 0.67 0.52 -0.02 0.00 -3.07 0.00 0.00 36.82 34.92 1upx h ILE 38 CO 0.05 0.34 -0.11 0.22 -0.69 0.00 0.00 178.15 177.96 1upx h TYR 39 N 1.01 -0.28 0.00 1.37 3.20 -0.92 -0.66 116.97 120.68 1upx h TYR 39 Ca 0.22 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.03 1upx h TYR 39 Cb 0.31 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1upx h TYR 39 CO 0.02 -0.17 -0.31 -0.39 -1.64 0.00 0.00 178.16 175.67 1upx h VAL 40 N -0.21 0.70 -0.54 1.81 -1.51 -1.22 -1.64 116.25 113.65 1upx h VAL 40 Ca 0.03 -1.43 -0.12 0.00 -1.23 0.00 0.00 66.70 63.96 1upx h VAL 40 Cb 0.24 1.93 -0.02 0.00 -2.13 0.00 0.00 31.29 31.31 1upx h VAL 40 CO -0.09 0.31 -0.13 0.74 -1.23 0.00 0.00 177.57 177.17 1upx h THR 41 N 0.00 1.27 -0.52 7.19 2.02 -0.71 0.11 112.91 122.27 1upx h THR 41 Ca -0.00 -1.29 -0.09 0.00 0.77 0.00 0.00 66.41 65.80 1upx h THR 41 Cb 0.91 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 68.28 1upx h THR 41 CO 0.04 0.46 -0.03 0.11 0.37 0.00 0.00 175.52 176.47 1upx h LYS 42 N 0.91 0.90 -0.63 6.66 1.57 -0.82 0.05 116.57 125.22 1upx h LYS 42 Ca 0.14 -0.27 -0.05 0.00 -1.87 0.00 0.00 60.65 58.60 1upx h LYS 42 Cb 0.70 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.90 1upx h LYS 42 CO 0.05 0.91 0.20 0.78 -0.57 0.00 0.00 179.45 180.82 1upx h GLY 43 N 0.99 1.04 1.02 3.86 0.00 -1.10 -0.24 103.07 108.63 1upx h GLY 43 Ca 0.15 -0.61 -0.02 0.00 0.00 0.00 0.00 47.33 46.85 1upx h GLY 43 CO 0.03 0.57 0.43 -2.00 0.00 0.00 0.00 176.54 175.57 1upx h LEU 44 N 0.89 1.00 -0.98 3.11 5.85 -0.74 -1.98 115.31 122.47 1upx h LEU 44 Ca 0.20 -0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.85 1upx h LEU 44 Cb 0.28 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.00 1upx h LEU 44 CO -0.01 0.82 0.64 1.23 -0.34 0.00 0.00 178.44 180.78 1upx h GLY 45 N 1.11 1.43 0.92 3.75 0.00 -0.47 0.19 103.07 110.00 1upx h GLY 45 Ca 0.28 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 1upx h GLY 45 CO -0.04 0.42 0.12 1.46 0.00 0.00 0.00 176.54 178.50 1upx h GLN 46 N 1.24 0.49 -0.23 4.80 4.20 -0.50 -0.63 115.11 124.48 1upx h GLN 46 Ca 0.39 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.97 1upx h GLN 46 Cb -0.00 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 1upx h GLN 46 CO -0.12 0.50 0.02 0.82 -0.67 0.00 0.00 178.83 179.38 1upx h ILE 47 N 0.38 1.24 -0.74 2.54 2.04 -0.98 -1.48 117.51 120.50 1upx h ILE 47 Ca 0.11 -0.82 -0.04 0.00 1.00 0.00 0.00 64.86 65.11 1upx h ILE 47 Cb 0.20 1.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 1upx h ILE 47 CO -0.01 0.26 0.30 0.00 0.00 0.00 0.00 178.15 178.70 1upx h ALA 48 N 0.83 0.97 -0.64 1.87 0.00 -0.92 -0.63 119.26 120.73 1upx h ALA 48 Ca 0.07 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1upx h ALA 48 Cb 0.36 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1upx h ALA 48 CO 0.01 0.59 0.40 1.15 0.00 0.00 0.00 179.25 181.39 1upx h THR 49 N 1.07 1.18 -0.36 0.00 2.02 -1.01 -0.95 112.91 114.86 1upx h THR 49 Ca 0.25 -0.38 -0.08 0.00 0.77 0.00 0.00 66.41 66.97 1upx h THR 49 Cb 0.21 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 66.89 1upx h THR 49 CO -0.02 0.18 -0.11 0.03 0.37 0.00 0.00 175.52 175.97 1upx h ARG 50 N 0.86 0.63 -0.22 6.66 3.08 -0.72 -1.15 114.38 123.52 1upx h ARG 50 Ca 0.23 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 1upx h ARG 50 Cb -0.05 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 1upx h ARG 50 CO -0.05 0.73 0.04 -0.07 -1.07 0.00 0.00 179.97 179.56 1upx h LEU 51 N 0.57 0.35 -1.55 3.04 3.38 -0.72 -2.50 115.31 117.89 1upx h LEU 51 Ca 0.10 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 1upx h LEU 51 Cb 0.53 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1upx h LEU 51 CO 0.03 0.50 0.25 0.03 0.09 0.00 0.00 178.44 179.34 1upx h ARG 52 N 0.18 0.55 0.00 1.13 3.08 -0.94 -1.16 114.38 117.22 1upx h ARG 52 Ca 0.07 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1upx h ARG 52 Cb 0.30 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1upx h ARG 52 CO 0.00 0.39 0.00 0.00 -1.07 0.00 0.00 179.97 179.29 1upx n ALA 53 N -2.47 2.12 -0.26 0.04 0.00 -0.45 -1.38 120.51 118.10 1upx n ALA 53 Ca 0.03 -0.09 0.09 0.00 0.00 0.00 0.00 53.44 53.48 1upx n ALA 53 Cb 0.08 -1.39 0.25 0.00 0.00 0.00 0.00 19.45 18.40 1upx n ALA 53 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1upx n GLU 54 N -1.46 2.75 -0.90 0.00 0.28 -0.69 -4.96 120.64 115.66 1upx n GLU 54 Ca 0.07 -2.41 0.00 0.00 -0.16 0.00 0.00 57.16 54.66 1upx n GLU 54 Cb 0.26 -1.45 0.00 0.00 1.43 0.00 0.00 31.44 31.68 1upx n GLU 54 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1upx n GLY 55 N 1.22 0.54 3.88 -1.84 0.00 -0.48 -5.05 105.19 103.47 1upx n GLY 55 Ca 0.19 -0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1upx n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1upx s LYS 56 N -0.29 3.73 0.34 1.61 1.02 -0.52 -4.99 119.74 120.63 1upx s LYS 56 Ca 0.00 0.13 -0.26 0.00 0.02 0.00 0.00 55.97 55.86 1upx s LYS 56 Cb 0.00 -2.71 -0.09 0.00 -0.52 0.00 0.00 37.83 34.50 1upx s LYS 56 CO 0.00 0.36 1.00 0.00 -0.92 0.00 0.00 175.35 175.79 1upx s ALA 57 N -1.79 3.20 -0.18 5.17 0.00 -1.26 -3.74 121.76 123.16 1upx s ALA 57 Ca 0.45 0.64 0.00 0.00 0.00 0.00 0.00 51.96 53.06 1upx s ALA 57 Cb -0.11 -3.24 0.01 0.00 0.00 0.00 0.00 23.12 19.78 1upx s ALA 57 CO 0.23 -0.01 -0.17 0.08 0.00 0.00 0.00 175.76 175.89 1upx s VAL 58 N -1.55 2.36 0.42 0.00 1.01 -1.26 -4.93 120.40 116.44 1upx s VAL 58 Ca 0.52 -0.85 -0.26 0.00 0.00 0.00 0.00 61.98 61.38 1upx s VAL 58 Cb -0.22 -2.00 -0.10 0.00 0.00 0.00 0.00 36.38 34.07 1upx s VAL 58 CO 0.28 0.52 1.43 -0.67 0.00 0.00 0.00 175.10 176.66 1upx n ASP 59 N 4.46 3.37 0.29 3.32 2.03 -1.26 -4.89 116.55 123.87 1upx n ASP 59 Ca -0.20 1.16 0.17 0.00 0.52 0.00 0.00 54.79 56.43 1upx n ASP 59 Cb 0.51 -1.59 0.89 0.00 -0.72 0.00 0.00 41.12 40.21 1upx n ASP 59 CO 0.00 0.00 0.00 -0.74 -1.92 0.00 0.00 177.20 174.54 1upx h HIS 60 N 2.50 0.00 -0.28 -0.67 -0.00 -2.00 -1.19 115.15 113.50 1upx h HIS 60 Ca -0.50 0.00 0.04 0.00 -0.00 0.00 0.00 60.37 59.90 1upx h HIS 60 Cb 1.26 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.66 1upx h HIS 60 CO 0.51 0.05 0.19 0.07 -0.00 0.00 0.00 177.93 178.75 1upx h ARG 61 N 0.00 0.23 -0.37 5.26 0.11 -1.99 -1.17 114.38 116.44 1upx h ARG 61 Ca -0.00 -0.01 -0.04 0.00 0.10 0.00 0.00 59.98 60.03 1upx h ARG 61 Cb 0.21 -0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.23 1upx h ARG 61 CO 0.01 0.15 0.08 0.82 0.10 0.00 0.00 179.97 181.12 1upx h ILE 62 N 0.24 1.23 -0.91 0.08 1.08 -1.57 -1.53 117.51 116.13 1upx h ILE 62 Ca 0.12 -0.80 0.07 0.00 -0.39 0.00 0.00 64.86 63.86 1upx h ILE 62 Cb 0.19 1.05 -0.07 0.00 -3.07 0.00 0.00 36.82 34.92 1upx h ILE 62 CO -0.02 0.27 0.57 0.44 -0.69 0.00 0.00 178.15 178.72 1upx h ASP 63 N 0.45 0.89 -0.13 1.72 3.32 -1.32 -1.39 116.42 119.97 1upx h ASP 63 Ca 0.11 0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.06 1upx h ASP 63 Cb 0.33 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1upx h ASP 63 CO 0.00 0.56 -0.32 0.03 -1.72 0.00 0.00 179.24 177.79 1upx h ARG 64 N 1.02 0.62 -0.41 3.56 3.08 -1.07 -1.01 114.38 120.18 1upx h ARG 64 Ca 0.40 -0.28 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 1upx h ARG 64 Cb 0.21 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 1upx h ARG 64 CO -0.19 0.87 0.17 1.25 -1.07 0.00 0.00 179.97 181.00 1upx h LEU 65 N 0.53 0.56 -0.21 3.04 5.85 -0.76 -1.15 115.31 123.17 1upx h LEU 65 Ca 0.06 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.61 1upx h LEU 65 Cb 0.81 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 1upx h LEU 65 CO 0.07 0.56 0.07 0.58 -0.34 0.00 0.00 178.44 179.39 1upx h VAL 66 N 0.52 1.18 -0.46 1.05 2.07 -0.98 -0.33 116.25 119.30 1upx h VAL 66 Ca 0.14 -0.56 -0.12 0.00 0.82 0.00 0.00 66.70 66.98 1upx h VAL 66 Cb 0.17 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1upx h VAL 66 CO -0.01 0.18 -0.18 0.71 0.02 0.00 0.00 177.57 178.29 1upx h THR 67 N 0.18 1.27 -0.72 2.57 1.35 -1.15 -1.48 112.91 114.93 1upx h THR 67 Ca 0.07 -1.31 -0.06 0.00 -0.55 0.00 0.00 66.41 64.56 1upx h THR 67 Cb 0.21 1.10 -0.03 0.00 -1.73 0.00 0.00 68.15 67.70 1upx h THR 67 CO -0.00 0.45 0.22 1.23 -0.25 0.00 0.00 175.52 177.16 1upx h GLY 68 N 0.94 1.19 0.90 5.82 0.00 -1.10 -1.36 103.07 109.46 1upx h GLY 68 Ca 0.11 -0.70 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 1upx h GLY 68 CO 0.06 0.66 0.08 3.43 0.00 0.00 0.00 176.54 180.77 1upx h ASN 69 N 1.07 0.26 -0.32 0.19 2.35 -0.69 -0.44 115.58 118.01 1upx h ASN 69 Ca 0.23 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 1upx h ASN 69 Cb 0.31 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.59 1upx h ASN 69 CO -0.01 0.34 0.16 -0.07 -1.65 0.00 0.00 177.43 176.20 1upx h LEU 70 N 0.17 0.41 -0.96 1.61 3.38 -1.18 -2.88 115.31 115.86 1upx h LEU 70 Ca 0.07 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1upx h LEU 70 Cb 0.15 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1upx h LEU 70 CO -0.01 0.41 0.07 0.15 0.09 0.00 0.00 178.44 179.15 1upx h PHE 71 N 0.38 0.87 0.00 1.13 -0.00 -1.14 -1.80 116.94 116.38 1upx h PHE 71 Ca 0.11 -0.10 -0.00 0.00 -0.00 0.00 0.00 57.97 57.98 1upx h PHE 71 Cb 0.10 -0.25 -0.00 0.00 -0.00 0.00 0.00 35.95 35.81 1upx h PHE 71 CO -0.02 0.76 -0.01 0.00 -0.00 0.00 0.00 178.31 179.04 1upx h ALA 72 N 1.29 1.30 -0.37 2.41 0.00 -0.86 -1.64 119.26 121.39 1upx h ALA 72 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1upx h ALA 72 Cb 0.37 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1upx h ALA 72 CO 0.01 0.02 0.00 0.25 0.00 0.00 0.00 179.25 179.53 1upx n THR 73 N -3.54 0.47 -2.22 0.00 -2.24 -0.69 -3.56 114.28 102.50 1upx n THR 73 Ca -0.03 -0.74 -0.35 0.00 -2.27 0.00 0.00 64.05 60.66 1upx n THR 73 Cb 0.10 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 1upx n THR 73 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1upx s ILE 74 N -1.53 3.08 0.15 2.28 1.01 -0.62 -4.93 121.20 120.64 1upx s ILE 74 Ca 0.38 0.69 -0.34 0.00 0.00 0.00 0.00 60.65 61.38 1upx s ILE 74 Cb 0.23 -3.29 -0.15 0.00 0.01 0.00 0.00 42.46 39.26 1upx s ILE 74 CO 0.32 -0.12 1.41 0.41 0.00 0.00 0.00 174.94 176.96 1upx n THR 75 N -1.21 0.28 -2.08 2.92 -1.04 -1.26 -1.96 114.28 109.93 1upx n THR 75 Ca 0.11 -0.07 -0.16 0.00 -2.04 0.00 0.00 64.05 61.90 1upx n THR 75 Cb 0.50 -1.19 -0.02 0.00 -1.82 0.00 0.00 70.33 67.80 1upx n THR 75 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1upx n ASN 76 N 2.72 -4.75 -0.12 8.00 3.02 -1.26 -4.80 115.26 118.07 1upx n ASN 76 Ca 0.16 0.09 -0.22 0.00 -0.03 0.00 0.00 54.58 54.59 1upx n ASN 76 Cb 0.25 -3.81 -0.08 0.00 -0.61 0.00 0.00 39.78 35.53 1upx n ASN 76 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1upx n ALA 77 N -0.96 1.01 -3.60 5.41 0.00 -0.83 -0.73 120.51 120.82 1upx n ALA 77 Ca -0.18 -0.91 -0.14 0.00 0.00 0.00 0.00 53.44 52.21 1upx n ALA 77 Cb 0.61 0.01 -0.13 0.00 0.00 0.00 0.00 19.45 19.95 1upx n ALA 77 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1upx s ASN 78 N -6.88 0.55 0.00 0.00 3.04 -1.23 -1.81 114.94 108.61 1upx s ASN 78 Ca -0.33 0.39 0.12 0.00 0.04 0.00 0.00 52.86 53.07 1upx s ASN 78 Cb 0.10 0.68 0.31 0.00 -1.54 0.00 0.00 41.25 40.81 1upx s ASN 78 CO 0.47 -0.26 1.24 0.49 -3.04 0.00 0.00 177.10 176.00 1upx n PHE 79 N 5.35 0.46 -3.10 0.43 3.01 -0.26 -4.92 117.46 118.43 1upx n PHE 79 Ca -0.06 -0.46 -0.44 0.00 1.01 0.00 0.00 57.45 57.50 1upx n PHE 79 Cb 0.50 -0.02 -0.05 0.00 -0.01 0.00 0.00 39.48 39.89 1upx n PHE 79 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1upx s ASP 80 N -1.00 6.21 0.31 4.37 -1.08 -1.25 -4.53 116.67 119.70 1upx s ASP 80 Ca 0.24 -1.08 -0.00 0.00 -0.52 0.00 0.00 52.55 51.18 1upx s ASP 80 Cb 0.13 -2.31 0.49 0.00 -1.46 0.00 0.00 42.92 39.77 1upx s ASP 80 CO 0.17 -1.03 1.94 0.44 0.52 0.00 0.00 175.17 177.20 1upx h ASP 81 N 9.12 0.82 -0.66 -0.34 3.32 -1.96 -1.29 116.42 125.44 1upx h ASP 81 Ca -0.28 -0.06 -0.08 0.00 0.02 0.00 0.00 57.03 56.63 1upx h ASP 81 Cb 1.09 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.40 1upx h ASP 81 CO 1.04 0.66 0.12 0.44 -1.72 0.00 0.00 179.24 179.77 1upx h ASP 82 N 0.94 1.04 -0.41 6.45 3.32 -1.99 -0.24 116.42 125.53 1upx h ASP 82 Ca 0.24 -0.26 -0.08 0.00 0.02 0.00 0.00 57.03 56.96 1upx h ASP 82 Cb 0.01 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 1upx h ASP 82 CO -0.04 1.03 -0.05 0.40 -1.72 0.00 0.00 179.24 178.85 1upx h ILE 83 N 1.00 1.27 -0.52 0.35 1.08 -1.85 -1.60 117.51 117.25 1upx h ILE 83 Ca 0.20 -1.12 -0.04 0.00 -0.39 0.00 0.00 64.86 63.51 1upx h ILE 83 Cb 0.43 1.17 -0.02 0.00 -3.07 0.00 0.00 36.82 35.32 1upx h ILE 83 CO 0.01 0.38 0.16 -0.07 -0.69 0.00 0.00 178.15 177.93 1upx h LEU 84 N 0.58 0.76 -1.00 1.44 3.38 -1.09 -1.13 115.31 118.25 1upx h LEU 84 Ca 0.11 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 1upx h LEU 84 Cb 0.56 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1upx h LEU 84 CO 0.03 0.77 0.29 0.00 0.09 0.00 0.00 178.44 179.63 1upx h ALA 85 N 1.02 1.21 -0.36 1.53 0.00 -0.99 -1.56 119.26 120.11 1upx h ALA 85 Ca 0.17 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1upx h ALA 85 Cb 0.29 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1upx h ALA 85 CO -0.00 0.58 -0.16 1.49 0.00 0.00 0.00 179.25 181.15 1upx h GLU 86 N 0.99 0.65 -0.40 0.00 4.57 -0.84 -1.85 114.58 117.71 1upx h GLU 86 Ca 0.24 -0.23 -0.08 0.00 -1.18 0.00 0.00 59.36 58.11 1upx h GLU 86 Cb 0.16 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.68 1upx h GLU 86 CO -0.02 0.79 -0.10 0.00 -1.18 0.00 0.00 179.01 178.49 1upx h ARG 87 N 0.59 0.70 -0.41 1.92 3.08 -0.65 -0.53 114.38 119.08 1upx h ARG 87 Ca 0.10 -0.22 0.02 0.00 0.07 0.00 0.00 59.98 59.94 1upx h ARG 87 Cb 0.61 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 1upx h ARG 87 CO 0.04 0.78 0.24 0.28 -1.07 0.00 0.00 179.97 180.25 1upx h VAL 88 N 0.64 1.05 -0.35 2.04 2.07 -0.86 -1.19 116.25 119.65 1upx h VAL 88 Ca 0.11 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 1upx h VAL 88 Cb 0.54 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 1upx h VAL 88 CO 0.03 0.09 0.21 0.03 0.02 0.00 0.00 177.57 177.96 1upx h ARG 89 N 0.49 0.48 -0.99 1.57 3.08 -0.83 -0.57 114.38 117.61 1upx h ARG 89 Ca 0.16 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.19 1upx h ARG 89 Cb -0.00 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 29.89 1upx h ARG 89 CO -0.07 0.37 0.65 0.52 -1.07 0.00 0.00 179.97 180.37 1upx h MET 90 N 0.46 1.26 -0.31 0.04 2.86 -0.94 -1.29 114.93 117.01 1upx h MET 90 Ca 0.13 -0.08 -0.18 0.00 -2.06 0.00 0.00 59.70 57.51 1upx h MET 90 Cb 0.01 -0.28 -0.00 0.00 0.06 0.00 0.00 31.60 31.38 1upx h MET 90 CO -0.02 0.83 -0.51 1.15 1.06 0.00 0.00 176.91 179.42 1upx h THR 91 N 1.30 1.27 -0.70 2.22 2.02 -0.82 -1.04 112.91 117.17 1upx h THR 91 Ca 0.38 -1.69 -0.04 0.00 0.77 0.00 0.00 66.41 65.83 1upx h THR 91 Cb -0.08 1.57 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 1upx h THR 91 CO -0.10 0.55 0.27 0.00 0.37 0.00 0.00 175.52 176.61 1upx h ALA 93 N 1.12 0.69 -0.48 0.00 0.00 -1.10 -2.12 119.26 117.37 1upx h ALA 93 Ca 0.23 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1upx h ALA 93 Cb 0.23 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1upx h ALA 93 CO -0.02 0.35 0.03 0.00 0.00 0.00 0.00 179.25 179.61 1upx h ALA 94 N 1.03 0.64 0.00 0.00 0.00 -0.89 -2.38 119.26 117.66 1upx h ALA 94 Ca 0.17 -0.26 -0.16 0.00 0.00 0.00 0.00 54.91 54.66 1upx h ALA 94 Cb 0.27 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1upx h ALA 94 CO -0.01 0.42 -0.76 1.57 0.00 0.00 0.00 179.25 180.47 1upx h LYS 95 N 0.69 0.00 -0.39 0.00 2.10 -1.10 -1.54 116.57 116.33 1upx h LYS 95 Ca 0.14 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.79 1upx h LYS 95 Cb 0.46 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.77 1upx h LYS 95 CO 0.02 0.76 0.22 -0.22 -2.00 0.00 0.00 179.45 178.23 1upx h LYS 96 N 0.00 0.53 -0.50 0.07 3.64 -1.28 -1.21 116.57 117.82 1upx h LYS 96 Ca -0.01 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.29 1upx h LYS 96 Cb 1.36 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 33.05 1upx h LYS 96 CO 0.10 0.42 0.22 1.49 -2.27 0.00 0.00 179.45 179.41 1upx h GLU 97 N 0.50 0.73 -0.59 1.90 4.81 -1.23 -2.98 114.58 117.72 1upx h GLU 97 Ca 0.14 -0.12 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 1upx h GLU 97 Cb 0.03 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 1upx h GLU 97 CO -0.02 0.64 0.08 -0.07 -0.73 0.00 0.00 179.01 178.90 1upx h LEU 98 N 0.66 0.95 -1.83 1.64 3.38 -1.14 -2.94 115.31 116.03 1upx h LEU 98 Ca 0.17 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1upx h LEU 98 Cb 0.16 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 1upx h LEU 98 CO -0.02 0.98 -0.12 0.00 0.09 0.00 0.00 178.44 179.37 1upx h ALA 99 N 1.01 1.66 0.00 1.53 0.00 -1.12 -1.15 119.26 121.18 1upx h ALA 99 Ca 0.18 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1upx h ALA 99 Cb 0.44 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1upx h ALA 99 CO 0.01 0.16 -0.09 0.00 0.00 0.00 0.00 179.25 179.33 1upx h ALA 100 N 1.88 1.54 -0.00 0.00 0.00 -1.37 -2.15 119.26 119.15 1upx h ALA 100 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1upx h ALA 100 Cb 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1upx h ALA 100 CO 0.02 0.11 -0.06 0.43 0.00 0.00 0.00 179.25 179.75 1upx n SER 101 N -3.97 0.12 -4.74 0.00 7.64 -0.43 -4.87 113.62 107.37 1upx n SER 101 Ca -0.02 0.03 -0.41 0.00 1.01 0.00 0.00 58.87 59.48 1upx n SER 101 Cb 0.18 -0.29 -0.03 0.00 -1.01 0.00 0.00 64.21 63.05 1upx n SER 101 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1upx s LEU 102 N -2.76 4.43 0.02 -3.43 1.43 -0.81 -4.95 118.68 112.61 1upx s LEU 102 Ca 0.21 2.30 -0.19 0.00 -1.03 0.00 0.00 54.13 55.42 1upx s LEU 102 Cb 0.19 -3.61 -0.23 0.00 0.03 0.00 0.00 46.19 42.58 1upx s LEU 102 CO 0.51 -0.45 1.12 0.71 0.23 0.00 0.00 176.35 178.47 1upx h THR 103 N 3.80 1.40 -3.61 5.49 1.35 -1.89 -3.41 112.91 116.04 1upx h THR 103 Ca -0.44 -2.11 -0.70 0.00 -0.55 0.00 0.00 66.41 62.61 1upx h THR 103 Cb 1.21 2.56 -0.27 0.00 -1.73 0.00 0.00 68.15 69.92 1upx h THR 103 CO 0.76 0.62 -0.56 -0.62 -0.25 0.00 0.00 175.52 175.48 1upx s ASP 104 N -6.85 5.49 0.00 5.36 -1.08 -1.26 -4.95 116.67 113.39 1upx s ASP 104 Ca -0.13 -1.16 0.24 0.00 -0.52 0.00 0.00 52.55 50.98 1upx s ASP 104 Cb 0.04 -1.93 0.39 0.00 -1.46 0.00 0.00 42.92 39.96 1upx s ASP 104 CO 0.84 -0.38 1.38 0.29 0.52 0.00 0.00 175.17 177.82 1upx n LYS 105 N 4.88 2.47 -2.12 4.34 5.02 -1.26 -5.01 118.16 126.49 1upx n LYS 105 Ca -0.12 -2.21 -0.37 0.00 -2.02 0.00 0.00 58.31 53.59 1upx n LYS 105 Cb 0.45 -1.51 0.01 0.00 -0.02 0.00 0.00 35.03 33.96 1upx n LYS 105 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1upx s SER 106 N -1.59 5.88 -1.50 4.39 1.04 -1.26 -3.66 113.70 116.99 1upx s SER 106 Ca 0.37 2.43 0.00 0.00 0.48 0.00 0.00 55.95 59.23 1upx s SER 106 Cb 0.22 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.73 1upx s SER 106 CO 0.31 -1.13 0.00 0.61 0.98 0.00 0.00 173.24 174.02 1upx n GLY 107 N 0.51 -0.25 3.74 7.32 0.00 -1.26 -4.97 105.19 110.28 1upx n GLY 107 Ca 0.08 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 1upx n GLY 107 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1upx s LEU 108 N -4.94 4.41 1.01 0.99 1.43 -1.24 -5.01 118.68 115.33 1upx s LEU 108 Ca 0.00 2.44 -0.13 0.00 -1.03 0.00 0.00 54.13 55.42 1upx s LEU 108 Cb 0.00 -3.61 0.19 0.00 0.03 0.00 0.00 46.19 42.80 1upx s LEU 108 CO 0.00 -0.58 1.10 -0.94 0.23 0.00 0.00 176.35 176.16 1upx s SER 109 N 0.43 2.54 0.33 2.29 1.04 -1.26 -4.82 113.70 114.24 1upx s SER 109 Ca 0.58 1.13 0.05 0.00 0.48 0.00 0.00 55.95 58.19 1upx s SER 109 Cb -0.38 -1.79 0.58 0.00 0.10 0.00 0.00 66.02 64.53 1upx s SER 109 CO 0.38 -3.18 1.84 -0.78 0.98 0.00 0.00 173.24 172.48 1upx h ASP 110 N -1.93 0.44 -0.72 7.02 1.82 -1.98 -1.89 116.42 119.19 1upx h ASP 110 Ca -0.55 -0.10 -0.02 0.00 -0.39 0.00 0.00 57.03 55.97 1upx h ASP 110 Cb 1.33 -0.12 -0.04 0.00 0.68 0.00 0.00 39.33 41.19 1upx h ASP 110 CO 0.58 0.58 0.40 0.00 -1.61 0.00 0.00 179.24 179.18 1upx h ALA 111 N 1.47 1.32 -0.17 -0.78 0.00 -1.92 0.37 119.26 119.55 1upx h ALA 111 Ca 0.08 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1upx h ALA 111 Cb 0.44 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1upx h ALA 111 CO 0.02 0.56 -0.47 0.00 0.00 0.00 0.00 179.25 179.36 1upx h ALA 112 N 1.41 0.87 0.00 0.00 0.00 -1.66 -3.34 119.26 116.54 1upx h ALA 112 Ca 0.26 -0.47 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 1upx h ALA 112 Cb 0.03 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1upx h ALA 112 CO -0.04 0.66 -1.97 1.28 0.00 0.00 0.00 179.25 179.17 1upx n LEU 113 N -3.99 0.20 -4.76 0.00 4.77 -0.76 -4.80 117.00 107.66 1upx n LEU 113 Ca -0.02 0.08 -0.40 0.00 -0.03 0.00 0.00 56.01 55.64 1upx n LEU 113 Cb 0.55 0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.78 1upx n LEU 113 CO 0.45 0.18 0.87 0.86 -1.33 0.00 0.00 177.39 178.42 1upx s TRP 114 N -3.07 3.28 0.06 -1.77 -0.00 0.13 -5.03 118.94 112.54 1upx s TRP 114 Ca -0.07 1.56 -0.11 0.00 -0.00 0.00 0.00 56.10 57.48 1upx s TRP 114 Cb 0.10 -3.45 0.01 0.00 -0.00 0.00 0.00 33.47 30.13 1upx s TRP 114 CO 0.86 -1.19 0.23 -1.83 -0.00 0.00 0.00 176.95 175.03 1upx s GLU 115 N -1.74 0.78 -0.08 5.86 -1.05 -1.26 -4.93 118.70 116.27 1upx s GLU 115 Ca 0.48 -0.67 -0.23 0.00 -0.15 0.00 0.00 54.97 54.40 1upx s GLU 115 Cb -0.35 0.33 0.05 0.00 -0.44 0.00 0.00 34.13 33.72 1upx s GLU 115 CO 0.45 -0.24 0.54 0.00 0.95 0.00 0.00 175.26 176.96 1upx s ALA 116 N -2.92 -1.37 -0.03 -0.84 0.00 -1.26 -5.05 121.76 110.29 1upx s ALA 116 Ca -0.02 1.09 0.07 0.00 0.00 0.00 0.00 51.96 53.10 1upx s ALA 116 Cb 0.01 -0.22 -0.11 0.00 0.00 0.00 0.00 23.12 22.80 1upx s ALA 116 CO -0.06 -0.31 0.12 0.45 0.00 0.00 0.00 175.76 175.96 1upx n SER 117 N 1.50 3.24 -4.71 0.00 2.88 -1.26 -4.61 113.62 110.66 1upx n SER 117 Ca -0.18 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 56.95 1upx n SER 117 Cb 0.56 1.11 -0.04 0.00 -0.75 0.00 0.00 64.21 65.10 1upx n SER 117 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1upx s GLU 118 N -2.41 4.50 0.26 -1.46 2.02 -1.26 -4.95 118.70 115.41 1upx s GLU 118 Ca -0.03 1.19 -0.01 0.00 0.02 0.00 0.00 54.97 56.14 1upx s GLU 118 Cb 0.04 -3.46 0.49 0.00 0.10 0.00 0.00 34.13 31.30 1upx s GLU 118 CO 0.31 -0.02 1.81 -0.22 0.02 0.00 0.00 175.26 177.16 1upx h LYS 119 N 6.81 0.83 -0.90 1.61 3.64 -1.96 -1.43 116.57 125.17 1upx h LYS 119 Ca -0.40 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 58.99 1upx h LYS 119 Cb 1.21 -0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 32.78 1upx h LYS 119 CO 0.76 0.55 0.59 0.66 -2.27 0.00 0.00 179.45 179.74 1upx h SER 120 N 0.86 0.92 -0.07 4.20 4.64 -1.99 -0.57 113.55 121.53 1upx h SER 120 Ca 0.45 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.65 1upx h SER 120 Cb 0.47 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 1upx h SER 120 CO -0.27 0.60 -0.36 0.00 -0.87 0.00 0.00 176.83 175.93 1upx h ALA 121 N 1.50 0.90 -0.41 5.18 0.00 -1.68 -1.49 119.26 123.26 1upx h ALA 121 Ca 0.38 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1upx h ALA 121 Cb 0.17 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1upx h ALA 121 CO -0.14 0.63 0.15 0.52 0.00 0.00 0.00 179.25 180.41 1upx h MET 122 N 0.48 0.63 -0.79 0.00 2.07 -0.76 -1.65 114.93 114.91 1upx h MET 122 Ca 0.05 -0.12 -0.02 0.00 -2.07 0.00 0.00 59.70 57.53 1upx h MET 122 Cb 0.84 -0.10 -0.04 0.00 -1.87 0.00 0.00 31.60 30.44 1upx h MET 122 CO 0.07 0.60 0.40 -0.07 1.07 0.00 0.00 176.91 178.99 1upx h LEU 123 N 0.53 1.01 -0.80 1.22 3.38 -0.96 -1.73 115.31 117.95 1upx h LEU 123 Ca 0.14 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 1upx h LEU 123 Cb 0.22 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1upx h LEU 123 CO -0.01 0.84 -0.28 0.00 0.09 0.00 0.00 178.44 179.08 1upx h ALA 124 N 1.21 0.97 -0.27 1.53 0.00 -1.12 -2.86 119.26 118.73 1upx h ALA 124 Ca 0.27 -0.38 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 1upx h ALA 124 Cb 0.08 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1upx h ALA 124 CO -0.04 0.60 -0.36 -0.22 0.00 0.00 0.00 179.25 179.23 1upx h LYS 125 N 0.50 0.60 -0.78 0.00 1.63 -1.02 -3.30 116.57 114.20 1upx h LYS 125 Ca 0.07 -0.29 0.11 0.00 -0.85 0.00 0.00 60.65 59.69 1upx h LYS 125 Cb 0.75 -0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 32.32 1upx h LYS 125 CO 0.06 0.87 0.51 0.00 -3.45 0.00 0.00 179.45 177.44 1upx h ALA 126 N 1.10 1.84 -0.04 5.00 0.00 -1.07 -2.00 119.26 124.07 1upx h ALA 126 Ca 0.05 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1upx h ALA 126 Cb 0.86 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1upx h ALA 126 CO 0.07 -0.01 0.06 0.78 0.00 0.00 0.00 179.25 180.15 1upx h GLY 127 N 0.66 0.00 -1.57 0.00 0.00 -1.67 -2.09 103.07 98.39 1upx h GLY 127 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 1upx h GLY 127 CO -0.14 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.10 1upx n THR 128 N -3.75 0.35 -0.76 4.70 -2.24 -0.75 -4.56 114.28 107.26 1upx n THR 128 Ca -0.02 -0.67 0.02 0.00 -2.27 0.00 0.00 64.05 61.10 1upx n THR 128 Cb 0.15 1.06 0.02 0.00 -2.10 0.00 0.00 70.33 69.46 1upx n THR 128 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1upx n VAL 129 N 0.99 0.70 -1.08 2.28 0.24 -0.80 -4.72 118.33 115.94 1upx n VAL 129 Ca 0.13 -0.76 0.00 0.00 -2.04 0.00 0.00 64.34 61.66 1upx n VAL 129 Cb 0.46 0.53 0.00 0.00 -1.47 0.00 0.00 33.84 33.36 1upx n VAL 129 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1upx n GLY 130 N -0.43 0.27 0.23 7.63 0.00 -1.13 -4.81 105.19 106.94 1upx n GLY 130 Ca 0.03 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.24 1upx n GLY 130 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1upx h VAL 131 N -0.16 0.68 0.00 1.61 2.07 -1.93 -1.98 116.25 116.55 1upx h VAL 131 Ca 0.00 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1upx h VAL 131 Cb 0.00 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 1upx h VAL 131 CO 0.00 0.05 0.00 0.23 0.02 0.00 0.00 177.57 177.87 1upx n MET 132 N -5.09 0.84 0.26 1.57 2.81 -1.26 -3.09 117.12 113.16 1upx n MET 132 Ca 0.09 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.11 1upx n MET 132 Cb 0.30 -1.50 0.70 0.00 -0.71 0.00 0.00 33.22 32.02 1upx n MET 132 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1upx h ALA 133 N 3.71 1.18 -2.29 3.04 0.00 -1.64 -3.40 119.26 119.86 1upx h ALA 133 Ca 0.00 -0.11 -0.61 0.00 0.00 0.00 0.00 54.91 54.19 1upx h ALA 133 Cb 0.02 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 17.68 1upx h ALA 133 CO 0.00 0.15 0.33 0.99 0.00 0.00 0.00 179.25 180.73 1upx s THR 134 N -4.03 4.83 0.08 0.00 2.01 -1.18 -4.96 115.64 112.40 1upx s THR 134 Ca -0.02 1.10 -0.14 0.00 0.31 0.00 0.00 61.69 62.94 1upx s THR 134 Cb 0.12 -4.11 -0.18 0.00 0.01 0.00 0.00 72.50 68.35 1upx s THR 134 CO 0.58 -0.22 1.27 0.71 -0.69 0.00 0.00 174.62 176.27 1upx h THR 135 N 5.58 1.30 -3.24 -0.82 1.35 -1.91 -3.44 112.91 111.73 1upx h THR 135 Ca -0.25 -1.99 -0.53 0.00 -0.55 0.00 0.00 66.41 63.09 1upx h THR 135 Cb 1.10 2.10 0.00 0.00 -1.73 0.00 0.00 68.15 69.62 1upx h THR 135 CO 0.86 0.62 0.53 -0.62 -0.25 0.00 0.00 175.52 176.66 1upx s ASP 136 N -7.04 7.12 0.19 5.36 -1.08 -1.26 -4.94 116.67 115.02 1upx s ASP 136 Ca -0.11 1.98 -0.09 0.00 -0.52 0.00 0.00 52.55 53.81 1upx s ASP 136 Cb 0.08 -2.58 0.11 0.00 -1.46 0.00 0.00 42.92 39.06 1upx s ASP 136 CO 0.89 -0.43 1.71 0.44 0.52 0.00 0.00 175.17 178.30 1upx h ASP 137 N 6.71 1.04 -0.01 -0.34 3.32 -1.99 0.16 116.42 125.32 1upx h ASP 137 Ca -0.42 -0.23 -0.22 0.00 0.02 0.00 0.00 57.03 56.18 1upx h ASP 137 Cb 1.21 -0.27 0.02 0.00 0.22 0.00 0.00 39.33 40.51 1upx h ASP 137 CO 0.80 1.00 -0.86 0.44 -1.72 0.00 0.00 179.24 178.90 1upx h ASP 138 N 1.04 0.77 -0.74 6.45 3.32 -1.98 -1.53 116.42 123.75 1upx h ASP 138 Ca 0.22 -0.74 -0.02 0.00 0.02 0.00 0.00 57.03 56.51 1upx h ASP 138 Cb 0.36 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 1upx h ASP 138 CO 0.00 1.41 0.39 0.58 -1.72 0.00 0.00 179.24 179.90 1upx h VAL 139 N 0.22 1.23 -0.06 -1.35 2.07 -1.96 -1.35 116.25 115.05 1upx h VAL 139 Ca -0.10 -0.60 0.01 0.00 0.82 0.00 0.00 66.70 66.83 1upx h VAL 139 Cb 1.53 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1upx h VAL 139 CO 0.17 0.26 -0.00 -0.09 0.02 0.00 0.00 177.57 177.92 1upx h ARG 140 N 1.02 0.01 -0.33 1.57 2.43 -0.91 -0.00 114.38 118.17 1upx h ARG 140 Ca 0.26 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.45 1upx h ARG 140 Cb 0.06 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 1upx h ARG 140 CO -0.04 0.01 0.15 1.03 -1.51 0.00 0.00 179.97 179.61 1upx h SER 141 N 0.01 0.21 -0.33 -3.80 0.87 -1.07 -2.07 113.55 107.38 1upx h SER 141 Ca 0.03 0.02 -0.15 0.00 -1.23 0.00 0.00 61.79 60.46 1upx h SER 141 Cb 0.03 -0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 61.97 1upx h SER 141 CO -0.05 0.16 -0.38 -0.07 -0.53 0.00 0.00 176.83 175.96 1upx h LEU 142 N 0.32 0.90 -0.76 2.23 3.38 -1.11 -0.11 115.31 120.15 1upx h LEU 142 Ca 0.14 -0.48 0.06 0.00 0.09 0.00 0.00 57.88 57.69 1upx h LEU 142 Cb 0.07 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.51 1upx h LEU 142 CO -0.11 1.20 0.45 0.03 0.09 0.00 0.00 178.44 180.09 1upx h ARG 143 N 0.61 0.79 0.10 1.13 3.08 -0.83 -0.35 114.38 118.91 1upx h ARG 143 Ca 0.05 -0.05 -0.28 0.00 0.07 0.00 0.00 59.98 59.77 1upx h ARG 143 Cb 0.97 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 1upx h ARG 143 CO 0.09 0.52 -1.34 -1.49 -1.07 0.00 0.00 179.97 176.68 1upx h TRP 144 N 0.81 0.37 -0.44 3.04 4.06 -1.24 -0.37 115.95 122.18 1upx h TRP 144 Ca 0.34 -0.27 0.07 0.00 2.06 0.00 0.00 58.89 61.08 1upx h TRP 144 Cb 0.20 -0.01 -0.06 0.00 -1.00 0.00 0.00 29.16 28.29 1upx h TRP 144 CO -0.06 1.26 0.11 1.25 -3.56 0.00 0.00 178.44 177.44 1upx h LEU 145 N 0.06 0.06 -0.32 -4.49 5.85 -0.85 0.99 115.31 116.60 1upx h LEU 145 Ca -0.16 0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 1upx h LEU 145 Cb 1.96 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 43.06 1upx h LEU 145 CO 0.17 0.07 0.06 0.40 -0.34 0.00 0.00 178.44 178.80 1upx h ILE 146 N 0.25 1.23 -0.61 4.05 2.04 -1.02 -1.10 117.51 122.37 1upx h ILE 146 Ca 0.21 -0.79 0.04 0.00 1.00 0.00 0.00 64.86 65.32 1upx h ILE 146 Cb 0.25 1.13 -0.05 0.00 -0.74 0.00 0.00 36.82 37.41 1upx h ILE 146 CO -0.26 0.26 0.34 0.74 0.00 0.00 0.00 178.15 179.24 1upx h THR 147 N 0.37 1.00 -0.56 -0.27 2.02 -0.65 0.91 112.91 115.73 1upx h THR 147 Ca 0.10 -0.23 -0.11 0.00 0.77 0.00 0.00 66.41 66.94 1upx h THR 147 Cb 0.33 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 1upx h THR 147 CO 0.00 0.12 -0.07 -0.26 0.37 0.00 0.00 175.52 175.68 1upx h PHE 148 N 0.66 1.15 -0.87 3.16 0.05 -0.64 -0.95 116.94 119.50 1upx h PHE 148 Ca 0.26 -0.23 0.04 0.00 3.82 0.00 0.00 57.97 61.86 1upx h PHE 148 Cb 0.11 -0.29 -0.05 0.00 2.00 0.00 0.00 35.95 37.72 1upx h PHE 148 CO -0.08 1.05 0.56 0.78 -0.18 0.00 0.00 178.31 180.44 1upx h GLY 149 N 0.95 1.26 1.67 -1.45 0.00 -0.67 -2.25 103.07 102.59 1upx h GLY 149 Ca 0.15 -0.42 -0.07 0.00 0.00 0.00 0.00 47.33 46.99 1upx h GLY 149 CO 0.04 0.36 -0.17 1.41 0.00 0.00 0.00 176.54 178.18 1upx h LEU 150 N 1.08 0.38 -0.45 3.11 3.38 -0.27 -0.52 115.31 122.02 1upx h LEU 150 Ca 0.35 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 1upx h LEU 150 Cb 0.02 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1upx h LEU 150 CO -0.12 0.57 0.22 0.11 0.09 0.00 0.00 178.44 179.31 1upx h LYS 151 N 0.36 0.65 -0.48 1.13 1.57 -0.63 0.54 116.57 119.70 1upx h LYS 151 Ca 0.07 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 1upx h LYS 151 Cb 0.51 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 1upx h LYS 151 CO 0.03 0.55 0.18 0.78 -0.57 0.00 0.00 179.45 180.42 1upx h GLY 152 N 0.58 0.78 0.96 3.86 0.00 -0.97 -1.40 103.07 106.89 1upx h GLY 152 Ca 0.15 -0.44 0.01 0.00 0.00 0.00 0.00 47.33 47.06 1upx h GLY 152 CO -0.02 0.41 0.44 1.98 0.00 0.00 0.00 176.54 179.35 1upx h MET 153 N 0.64 0.86 -0.80 4.80 1.85 -0.94 -2.42 114.93 118.93 1upx h MET 153 Ca 0.16 -0.05 -0.03 0.00 -0.61 0.00 0.00 59.70 59.17 1upx h MET 153 Cb 0.22 -0.20 -0.04 0.00 0.43 0.00 0.00 31.60 32.01 1upx h MET 153 CO -0.01 0.57 0.38 0.00 -0.40 0.00 0.00 176.91 177.45 1upx h ALA 154 N 1.26 1.16 -0.18 0.39 0.00 -0.58 -0.02 119.26 121.30 1upx h ALA 154 Ca 0.26 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1upx h ALA 154 Cb -0.07 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 1upx h ALA 154 CO -0.07 0.63 0.10 0.00 0.00 0.00 0.00 179.25 179.91 1upx h ALA 155 N 1.28 0.23 -0.53 0.00 0.00 -0.82 0.13 119.26 119.54 1upx h ALA 155 Ca 0.28 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 1upx h ALA 155 Cb 0.12 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1upx h ALA 155 CO -0.03 -0.23 -0.14 1.88 0.00 0.00 0.00 179.25 180.72 1upx h TYR 156 N 0.18 1.16 -0.93 0.00 0.99 -1.17 -1.98 116.97 115.21 1upx h TYR 156 Ca 0.06 -0.25 0.01 0.00 2.00 0.00 0.00 58.73 60.55 1upx h TYR 156 Cb 0.08 -0.28 -0.05 0.00 1.00 0.00 0.00 36.73 37.48 1upx h TYR 156 CO -0.04 1.08 0.61 0.00 -0.00 0.00 0.00 178.16 179.81 1upx h ALA 157 N 0.91 1.32 -0.46 3.88 0.00 -0.84 -2.04 119.26 122.03 1upx h ALA 157 Ca 0.13 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 1upx h ALA 157 Cb 0.71 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1upx h ALA 157 CO 0.05 0.62 -0.13 -0.22 0.00 0.00 0.00 179.25 179.58 1upx h LYS 158 N 1.27 0.89 -0.79 0.00 3.64 -0.33 -0.80 116.57 120.44 1upx h LYS 158 Ca 0.34 -0.35 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1upx h LYS 158 Cb -0.13 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.61 1upx h LYS 158 CO -0.07 1.00 0.39 0.45 -2.27 0.00 0.00 179.45 178.95 1upx h HIS 159 N 0.73 1.12 -0.72 1.91 3.86 -1.08 -0.11 115.15 120.86 1upx h HIS 159 Ca 0.11 -0.04 -0.04 0.00 -1.16 0.00 0.00 60.37 59.24 1upx h HIS 159 Cb 0.68 -0.35 -0.03 0.00 1.06 0.00 0.00 27.41 28.77 1upx h HIS 159 CO 0.05 0.80 0.30 0.00 0.86 0.00 0.00 177.93 179.94 1upx h ALA 160 N 1.31 0.94 -0.69 2.45 0.00 -1.10 -2.91 119.26 119.25 1upx h ALA 160 Ca 0.27 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1upx h ALA 160 Cb 0.09 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 1upx h ALA 160 CO -0.04 0.55 0.20 0.22 0.00 0.00 0.00 179.25 180.19 1upx h ASP 161 N 1.03 1.02 -0.78 0.00 3.58 -0.51 -0.71 116.42 120.05 1upx h ASP 161 Ca 0.24 -0.22 0.15 0.00 0.42 0.00 0.00 57.03 57.63 1upx h ASP 161 Cb 0.20 -0.27 -0.05 0.00 1.72 0.00 0.00 39.33 40.93 1upx h ASP 161 CO -0.02 0.97 0.52 0.58 -2.88 0.00 0.00 179.24 178.40 1upx h VAL 162 N 1.02 0.79 -0.53 2.25 2.07 -0.85 -0.13 116.25 120.87 1upx h VAL 162 Ca 0.22 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.59 1upx h VAL 162 Cb 0.32 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1upx h VAL 162 CO -0.00 0.08 0.00 0.18 0.02 0.00 0.00 177.57 177.85 1upx n LEU 163 N -4.49 3.02 0.00 2.57 4.77 -0.63 -4.29 117.00 117.95 1upx n LEU 163 Ca 0.15 -1.51 0.00 0.00 -0.03 0.00 0.00 56.01 54.62 1upx n LEU 163 Cb 0.53 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1upx n LEU 163 CO 0.32 0.71 0.00 0.61 -1.33 0.00 0.00 177.39 177.70 1upx n GLY 164 N 1.29 0.83 3.25 -0.72 0.00 -0.06 -5.03 105.19 104.75 1upx n GLY 164 Ca 0.18 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1upx n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1upx s LYS 165 N -0.66 3.22 0.00 1.61 1.02 -0.37 -4.96 119.74 119.60 1upx s LYS 165 Ca 0.00 -0.72 -0.16 0.00 0.02 0.00 0.00 55.97 55.11 1upx s LYS 165 Cb 0.00 -2.75 0.03 0.00 -0.52 0.00 0.00 37.83 34.59 1upx s LYS 165 CO 0.00 -0.11 0.35 -3.38 -0.92 0.00 0.00 175.35 171.28 1upx s HIS 166 N 1.16 -0.20 -0.11 3.18 -3.43 -1.26 -2.13 115.29 112.49 1upx s HIS 166 Ca 0.01 0.25 0.02 0.00 -0.80 0.00 0.00 55.06 54.54 1upx s HIS 166 Cb -0.14 0.13 0.01 0.00 -1.43 0.00 0.00 32.58 31.15 1upx s HIS 166 CO -0.05 -0.45 -0.16 -1.21 -2.00 0.00 0.00 174.74 170.87 1upx s GLU 167 N -1.76 2.24 0.30 -0.38 0.41 -1.26 -5.03 118.70 113.22 1upx s GLU 167 Ca -0.10 -0.57 0.01 0.00 -0.41 0.00 0.00 54.97 53.89 1upx s GLU 167 Cb -0.03 -1.89 0.54 0.00 -1.78 0.00 0.00 34.13 30.96 1upx s GLU 167 CO 0.02 -0.05 1.89 -0.91 -0.49 0.00 0.00 175.26 175.72 1upx h ASN 168 N 7.36 0.91 -0.45 -0.19 2.35 -2.01 -1.71 115.58 121.85 1upx h ASN 168 Ca -0.31 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.44 1upx h ASN 168 Cb 1.18 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 39.35 1upx h ASN 168 CO 0.49 0.56 0.22 0.77 -1.65 0.00 0.00 177.43 177.82 1upx h SER 169 N 1.02 0.62 -0.04 5.81 4.64 -1.98 0.13 113.55 123.74 1upx h SER 169 Ca 0.42 -0.06 -0.03 0.00 -0.47 0.00 0.00 61.79 61.65 1upx h SER 169 Cb 0.30 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1upx h SER 169 CO -0.18 0.54 -0.09 0.25 -0.87 0.00 0.00 176.83 176.48 1upx h LEU 170 N 0.69 0.16 -0.79 5.97 5.85 -1.75 -1.18 115.31 124.25 1upx h LEU 170 Ca 0.17 -0.58 -0.08 0.00 0.84 0.00 0.00 57.88 58.23 1upx h LEU 170 Cb 0.10 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 1upx h LEU 170 CO -0.02 0.70 -0.01 0.44 -0.34 0.00 0.00 178.44 179.21 1upx h ASP 171 N -0.38 0.88 -0.42 1.25 3.32 -1.26 -1.45 116.42 118.36 1upx h ASP 171 Ca 0.00 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 56.81 1upx h ASP 171 Cb 0.68 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1upx h ASP 171 CO 0.02 0.94 0.22 0.00 -1.72 0.00 0.00 179.24 178.71 1upx h ALA 172 N 1.15 0.54 -0.24 3.45 0.00 -0.78 -2.16 119.26 121.22 1upx h ALA 172 Ca 0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1upx h ALA 172 Cb 0.51 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1upx h ALA 172 CO 0.03 0.07 0.13 0.35 0.00 0.00 0.00 179.25 179.83 1upx h PHE 173 N 0.54 0.33 -0.77 0.00 3.57 -0.98 -1.00 116.94 118.63 1upx h PHE 173 Ca 0.15 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.72 1upx h PHE 173 Cb 0.07 -0.11 -0.07 0.00 2.79 0.00 0.00 35.95 38.64 1upx h PHE 173 CO -0.02 0.30 0.44 0.52 -2.23 0.00 0.00 178.31 177.31 1upx h MET 174 N 0.27 0.74 -0.07 1.11 2.86 -1.08 0.12 114.93 118.88 1upx h MET 174 Ca 0.08 -0.04 -0.18 0.00 -2.06 0.00 0.00 59.70 57.50 1upx h MET 174 Cb 0.08 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 1upx h MET 174 CO -0.01 0.49 -0.73 1.96 1.06 0.00 0.00 176.91 179.67 1upx h GLN 175 N 0.76 0.37 -0.35 1.72 4.20 -1.16 -1.64 115.11 119.01 1upx h GLN 175 Ca 0.36 -0.31 -0.09 0.00 0.06 0.00 0.00 58.65 58.68 1upx h GLN 175 Cb 0.29 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 1upx h GLN 175 CO -0.22 0.95 -0.14 1.49 -0.67 0.00 0.00 178.83 180.23 1upx h GLU 176 N 0.25 0.71 -0.53 1.46 4.81 -0.61 -1.96 114.58 118.71 1upx h GLU 176 Ca -0.03 -0.30 -0.06 0.00 -0.13 0.00 0.00 59.36 58.84 1upx h GLU 176 Cb 1.30 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.64 1upx h GLU 176 CO 0.12 0.90 0.10 0.00 -0.73 0.00 0.00 179.01 179.40 1upx h ALA 177 N 0.79 0.70 -0.49 2.92 0.00 -0.74 -0.24 119.26 122.21 1upx h ALA 177 Ca 0.08 -0.23 0.06 0.00 0.00 0.00 0.00 54.91 54.81 1upx h ALA 177 Cb 0.67 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 1upx h ALA 177 CO 0.05 0.43 0.20 -0.07 0.00 0.00 0.00 179.25 179.86 1upx h LEU 178 N 0.76 0.25 -0.91 0.00 3.38 -1.27 -2.03 115.31 115.48 1upx h LEU 178 Ca 0.16 0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.20 1upx h LEU 178 Cb 0.38 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 1upx h LEU 178 CO 0.01 0.18 0.60 0.00 0.09 0.00 0.00 178.44 179.32 1upx h ALA 179 N 1.30 1.18 0.00 1.53 0.00 -0.87 -2.45 119.26 119.94 1upx h ALA 179 Ca 0.23 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1upx h ALA 179 Cb 0.20 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1upx h ALA 179 CO -0.20 0.52 -0.24 0.87 0.00 0.00 0.00 179.25 180.19 1upx h LYS 180 N 1.20 0.00 0.00 0.00 1.57 -0.40 -1.69 116.57 117.25 1upx h LYS 180 Ca 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 1upx h LYS 180 Cb -0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1upx h LYS 180 CO -0.09 0.24 0.00 0.25 -0.57 0.00 0.00 179.45 179.28 1upx n THR 181 N -3.82 0.63 0.72 -0.16 -2.24 -0.83 -1.78 114.28 106.81 1upx n THR 181 Ca -0.02 0.16 0.08 0.00 -2.27 0.00 0.00 64.05 62.01 1upx n THR 181 Cb 0.34 -0.89 0.05 0.00 -2.10 0.00 0.00 70.33 67.72 1upx n THR 181 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1upx n LEU 182 N -1.34 2.18 -4.54 3.22 4.77 -0.64 -4.95 117.00 115.71 1upx n LEU 182 Ca 0.07 -0.92 -0.43 0.00 -0.03 0.00 0.00 56.01 54.69 1upx n LEU 182 Cb 0.14 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.18 1upx n LEU 182 CO 0.13 0.39 0.64 -0.62 -1.33 0.00 0.00 177.39 176.60 1upx s ASP 183 N -1.59 6.40 0.14 -1.43 -1.08 -0.73 -4.91 116.67 113.46 1upx s ASP 183 Ca 0.18 -0.17 0.20 0.00 -0.52 0.00 0.00 52.55 52.25 1upx s ASP 183 Cb 0.14 -2.41 0.84 0.00 -1.46 0.00 0.00 42.92 40.03 1upx s ASP 183 CO 0.28 -1.03 1.63 0.47 0.52 0.00 0.00 175.17 177.04 1upx n ASP 184 N 6.99 0.37 0.07 -0.34 8.00 -1.26 -2.95 116.55 127.43 1upx n ASP 184 Ca 0.03 0.58 0.13 0.00 0.71 0.00 0.00 54.79 56.24 1upx n ASP 184 Cb 0.48 -0.67 0.39 0.00 -0.02 0.00 0.00 41.12 41.31 1upx n ASP 184 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1upx n SER 185 N -1.90 0.62 -4.73 -2.24 3.41 -1.26 -4.87 113.62 102.65 1upx n SER 185 Ca 0.03 0.43 -0.41 0.00 -0.26 0.00 0.00 58.87 58.66 1upx n SER 185 Cb 0.23 -0.51 -0.03 0.00 -0.26 0.00 0.00 64.21 63.64 1upx n SER 185 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1upx s LEU 186 N -4.10 4.42 0.79 1.04 1.43 -1.15 -5.02 118.68 116.09 1upx s LEU 186 Ca 0.10 2.26 -0.12 0.00 -1.03 0.00 0.00 54.13 55.34 1upx s LEU 186 Cb 0.14 -3.60 0.07 0.00 0.03 0.00 0.00 46.19 42.82 1upx s LEU 186 CO 0.61 -0.45 1.12 -0.94 0.23 0.00 0.00 176.35 176.92 1upx s SER 187 N 0.41 4.65 0.25 2.29 1.04 -1.26 -4.90 113.70 116.17 1upx s SER 187 Ca 0.56 1.06 -0.05 0.00 0.48 0.00 0.00 55.95 57.99 1upx s SER 187 Cb -0.34 -1.72 0.33 0.00 0.10 0.00 0.00 66.02 64.39 1upx s SER 187 CO 0.35 -1.84 1.88 0.58 0.98 0.00 0.00 173.24 175.19 1upx h VAL 188 N -1.01 1.11 -0.83 5.02 2.07 -1.97 -1.38 116.25 119.26 1upx h VAL 188 Ca -0.47 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 66.64 1upx h VAL 188 Cb 1.29 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 1upx h VAL 188 CO 0.63 0.20 0.38 0.00 0.02 0.00 0.00 177.57 178.80 1upx h ALA 189 N 1.40 1.10 -0.70 1.67 0.00 -1.99 0.47 119.26 121.22 1upx h ALA 189 Ca 0.38 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.15 1upx h ALA 189 Cb 0.09 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 1upx h ALA 189 CO -0.15 0.66 0.44 -0.44 0.00 0.00 0.00 179.25 179.76 1upx h ASP 190 N 1.19 0.72 0.39 0.00 3.32 -1.75 -1.73 116.42 118.57 1upx h ASP 190 Ca 0.28 -0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.17 1upx h ASP 190 Cb 0.14 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1upx h ASP 190 CO -0.03 0.50 -0.69 -0.07 -1.72 0.00 0.00 179.24 177.23 1upx h LEU 191 N 0.86 0.31 -0.52 1.55 3.38 -0.49 -0.56 115.31 119.83 1upx h LEU 191 Ca 0.28 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1upx h LEU 191 Cb 0.01 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1upx h LEU 191 CO -0.10 0.90 0.18 0.58 0.09 0.00 0.00 178.44 180.08 1upx h VAL 192 N 0.18 1.23 -0.89 1.22 2.07 -0.74 -0.79 116.25 118.53 1upx h VAL 192 Ca -0.02 -0.74 -0.02 0.00 0.82 0.00 0.00 66.70 66.74 1upx h VAL 192 Cb 1.23 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.70 1upx h VAL 192 CO 0.11 0.28 0.47 0.00 0.02 0.00 0.00 177.57 178.45 1upx h ALA 193 N 1.03 1.16 -0.07 1.67 0.00 -1.08 -2.19 119.26 119.79 1upx h ALA 193 Ca 0.17 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1upx h ALA 193 Cb 0.25 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1upx h ALA 193 CO -0.01 0.66 -0.34 1.25 0.00 0.00 0.00 179.25 180.82 1upx h LEU 194 N 1.25 0.13 -0.54 0.00 5.85 -0.81 -0.86 115.31 120.32 1upx h LEU 194 Ca 0.31 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 1upx h LEU 194 Cb 0.05 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 1upx h LEU 194 CO -0.05 0.47 0.24 0.74 -0.34 0.00 0.00 178.44 179.51 1upx h THR 195 N 0.12 1.21 -0.10 1.05 2.02 -0.54 0.27 112.91 116.93 1upx h THR 195 Ca 0.01 -0.62 -0.17 0.00 0.77 0.00 0.00 66.41 66.40 1upx h THR 195 Cb 0.66 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 1upx h THR 195 CO 0.05 0.24 -0.67 -0.07 0.37 0.00 0.00 175.52 175.44 1upx h LEU 196 N 0.73 0.49 -0.98 2.58 3.38 -1.03 -1.98 115.31 118.50 1upx h LEU 196 Ca 0.18 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1upx h LEU 196 Cb 0.15 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 1upx h LEU 196 CO -0.02 1.02 0.27 -0.08 0.09 0.00 0.00 178.44 179.72 1upx h GLU 197 N 0.30 1.01 -0.73 1.13 4.81 -0.98 -1.58 114.58 118.54 1upx h GLU 197 Ca -0.02 -0.17 0.01 0.00 -0.13 0.00 0.00 59.36 59.05 1upx h GLU 197 Cb 1.23 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 30.40 1upx h GLU 197 CO 0.12 0.82 0.48 1.15 -0.73 0.00 0.00 179.01 180.85 1upx h THR 198 N 0.99 1.18 -0.65 0.32 2.02 -0.69 -1.37 112.91 114.70 1upx h THR 198 Ca 0.23 -0.33 0.05 0.00 0.77 0.00 0.00 66.41 67.13 1upx h THR 198 Cb 0.19 0.11 -0.05 0.00 -1.74 0.00 0.00 68.15 66.67 1upx h THR 198 CO -0.02 0.18 0.37 1.23 0.37 0.00 0.00 175.52 177.65 1upx h GLY 199 N 0.98 0.94 0.96 2.16 0.00 -0.76 0.12 103.07 107.47 1upx h GLY 199 Ca 0.27 -0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.32 1upx h GLY 199 CO -0.06 0.18 0.20 1.70 0.00 0.00 0.00 176.54 178.55 1upx h LYS 200 N 0.69 0.62 0.00 4.80 3.64 -0.66 -1.34 116.57 124.33 1upx h LYS 200 Ca 0.28 -0.09 -0.04 0.00 -1.27 0.00 0.00 60.65 59.53 1upx h LYS 200 Cb 0.14 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1upx h LYS 200 CO -0.16 0.54 -0.18 0.74 -2.27 0.00 0.00 179.45 178.12 1upx h PHE 201 N 0.55 0.00 -0.37 1.91 -1.00 -1.02 -2.17 116.94 114.84 1upx h PHE 201 Ca 0.15 0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.93 1upx h PHE 201 Cb 0.13 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.67 1upx h PHE 201 CO -0.01 0.18 0.24 0.78 -1.61 0.00 0.00 178.31 177.89 1upx h GLY 202 N 2.20 0.52 0.69 -1.45 0.00 0.21 0.47 103.07 105.72 1upx h GLY 202 Ca -0.00 -0.19 0.05 0.00 0.00 0.00 0.00 47.33 47.18 1upx h GLY 202 CO 0.02 0.18 0.22 -2.08 0.00 0.00 0.00 176.54 174.88 1upx h VAL 203 N 0.49 0.93 -0.67 4.60 2.07 -0.78 -0.69 116.25 122.19 1upx h VAL 203 Ca 0.14 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.53 1upx h VAL 203 Cb -0.05 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.14 1upx h VAL 203 CO -0.03 0.08 0.43 0.28 0.02 0.00 0.00 177.57 178.35 1upx h SER 204 N 0.43 0.74 -0.54 0.57 0.02 -0.99 0.65 113.55 114.43 1upx h SER 204 Ca 0.21 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.08 1upx h SER 204 Cb 0.15 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 1upx h SER 204 CO -0.17 0.53 0.06 0.00 -1.14 0.00 0.00 176.83 176.11 1upx h ALA 205 N 1.26 0.72 -0.48 3.77 0.00 -0.56 -0.56 119.26 123.41 1upx h ALA 205 Ca 0.26 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1upx h ALA 205 Cb -0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1upx h ALA 205 CO -0.07 0.48 -0.04 0.52 0.00 0.00 0.00 179.25 180.14 1upx h MET 206 N 0.79 0.81 -0.49 0.00 2.86 -0.74 -1.24 114.93 116.93 1upx h MET 206 Ca 0.16 -0.24 -0.08 0.00 -2.06 0.00 0.00 59.70 57.48 1upx h MET 206 Cb 0.44 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 1upx h MET 206 CO 0.02 0.84 -0.02 0.00 1.06 0.00 0.00 176.91 178.81 1upx h ALA 207 N 1.21 0.66 -0.51 6.32 0.00 -0.64 -0.36 119.26 125.95 1upx h ALA 207 Ca 0.14 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 1upx h ALA 207 Cb 0.51 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1upx h ALA 207 CO 0.03 0.49 0.12 1.25 0.00 0.00 0.00 179.25 181.14 1upx h LEU 208 N 0.74 0.77 -0.58 0.00 5.85 -0.87 -1.42 115.31 119.79 1upx h LEU 208 Ca 0.14 -0.23 -0.10 0.00 0.84 0.00 0.00 57.88 58.53 1upx h LEU 208 Cb 0.54 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 1upx h LEU 208 CO 0.03 0.80 -0.02 0.25 -0.34 0.00 0.00 178.44 179.16 1upx h LEU 209 N 0.70 1.03 -0.61 2.25 5.85 -1.09 -0.57 115.31 122.87 1upx h LEU 209 Ca 0.16 -0.31 0.01 0.00 0.84 0.00 0.00 57.88 58.57 1upx h LEU 209 Cb 0.33 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 1upx h LEU 209 CO 0.00 1.09 0.40 -0.78 -0.34 0.00 0.00 178.44 178.82 1upx h ASP 210 N 0.94 0.70 -0.62 1.25 3.58 -0.88 0.11 116.42 121.49 1upx h ASP 210 Ca 0.16 -0.02 -0.08 0.00 0.42 0.00 0.00 57.03 57.51 1upx h ASP 210 Cb 0.58 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 41.43 1upx h ASP 210 CO 0.03 0.51 0.07 0.00 -2.88 0.00 0.00 179.24 176.96 1upx h ALA 211 N 1.22 0.92 -0.12 -0.78 0.00 -1.05 -1.24 119.26 118.20 1upx h ALA 211 Ca 0.22 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1upx h ALA 211 Cb -0.10 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 1upx h ALA 211 CO -0.05 0.66 -0.01 0.00 0.00 0.00 0.00 179.25 179.85 1upx h ALA 212 N 1.07 0.16 0.09 0.00 0.00 -0.55 0.29 119.26 120.32 1upx h ALA 212 Ca 0.19 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1upx h ALA 212 Cb 0.48 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1upx h ALA 212 CO 0.02 -0.13 -0.04 -0.91 0.00 0.00 0.00 179.25 178.19 1upx h ASN 213 N -0.08 -0.10 0.32 0.00 2.35 -0.73 -1.91 115.58 115.43 1upx h ASN 213 Ca 0.03 -0.12 -0.17 0.00 -0.55 0.00 0.00 56.30 55.49 1upx h ASN 213 Cb 0.39 0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 1upx h ASN 213 CO 0.01 0.06 -0.69 0.71 -1.65 0.00 0.00 177.43 175.86 1upx h THR 214 N -0.25 1.39 -0.16 2.81 1.35 -1.28 -0.27 112.91 116.50 1upx h THR 214 Ca -0.01 -2.12 -0.07 0.00 -0.55 0.00 0.00 66.41 63.65 1upx h THR 214 Cb 0.21 2.09 -0.01 0.00 -1.73 0.00 0.00 68.15 68.72 1upx h THR 214 CO 0.02 0.63 -0.22 1.23 -0.25 0.00 0.00 175.52 176.93 1upx h GLY 215 N 1.41 0.30 0.59 5.82 0.00 -0.93 0.50 103.07 110.75 1upx h GLY 215 Ca -0.02 -0.22 -0.30 0.00 0.00 0.00 0.00 47.33 46.79 1upx h GLY 215 CO 0.11 0.20 -1.54 -0.84 0.00 0.00 0.00 176.54 174.47 1upx h THR 216 N 0.25 0.95 -0.04 4.70 2.02 -1.21 -3.41 112.91 116.16 1upx h THR 216 Ca 0.04 -2.40 0.00 0.00 0.77 0.00 0.00 66.41 64.83 1upx h THR 216 Cb 0.54 2.66 0.00 0.00 -1.74 0.00 0.00 68.15 69.62 1upx h THR 216 CO 0.04 0.74 0.00 -1.22 0.37 0.00 0.00 175.52 175.44 1upx n TYR 217 N -3.83 0.06 0.00 3.16 4.02 -0.12 -4.96 117.16 115.48 1upx n TYR 217 Ca -0.26 -0.19 0.00 0.00 -0.01 0.00 0.00 57.90 57.44 1upx n TYR 217 Cb 0.94 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 40.24 1upx n TYR 217 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1upx n GLY 218 N 0.06 -0.02 3.71 2.72 0.00 0.17 -1.58 105.19 110.25 1upx n GLY 218 Ca 0.03 -1.76 -0.42 0.00 0.00 0.00 0.00 46.02 43.87 1upx n GLY 218 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1upx s HIS 219 N -2.32 3.52 0.51 1.61 3.76 -1.26 -4.23 115.29 116.89 1upx s HIS 219 Ca 0.00 1.45 -0.20 0.00 -0.15 0.00 0.00 55.06 56.16 1upx s HIS 219 Cb 0.00 -3.31 -0.09 0.00 1.11 0.00 0.00 32.58 30.29 1upx s HIS 219 CO 0.00 -0.80 0.71 -2.30 -0.85 0.00 0.00 174.74 171.50 1upx n PRO 220 N 3.90 0.78 -4.12 8.40 -0.02 -1.26 -4.34 135.00 138.33 1upx n PRO 220 Ca 0.08 0.29 -0.08 0.00 -2.02 0.00 0.00 63.50 61.77 1upx n PRO 220 Cb 0.48 -1.82 -0.10 0.00 -0.02 0.00 0.00 33.50 32.04 1upx n PRO 220 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1upx s GLU 221 N -2.08 0.73 0.21 -0.52 -1.05 -0.24 -4.24 118.70 111.51 1upx s GLU 221 Ca 0.68 -1.30 -0.32 0.00 -0.15 0.00 0.00 54.97 53.88 1upx s GLU 221 Cb -0.50 0.18 -0.13 0.00 -0.44 0.00 0.00 34.13 33.25 1upx s GLU 221 CO 0.54 -0.15 1.63 -0.89 0.95 0.00 0.00 175.26 177.34 1upx n ILE 222 N 0.03 0.26 -3.76 1.83 5.41 -1.25 -4.29 119.36 117.59 1upx n ILE 222 Ca -0.11 -0.06 -0.13 0.00 1.00 0.00 0.00 62.75 63.45 1upx n ILE 222 Cb 0.62 -1.80 -0.12 0.00 -0.71 0.00 0.00 39.64 37.63 1upx n ILE 222 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 1upx s THR 223 N 0.78 -0.01 -0.22 1.39 2.01 0.20 -4.99 115.64 114.80 1upx s THR 223 Ca 0.74 0.05 -0.13 0.00 0.31 0.00 0.00 61.69 62.66 1upx s THR 223 Cb -0.57 -0.37 -0.05 0.00 0.01 0.00 0.00 72.50 71.52 1upx s THR 223 CO 0.38 0.02 0.27 -0.54 -0.69 0.00 0.00 174.62 174.06 1upx s LYS 224 N 0.53 4.13 -0.18 4.92 1.02 -1.26 -1.51 119.74 127.38 1upx s LYS 224 Ca -0.03 -0.05 -0.03 0.00 0.02 0.00 0.00 55.97 55.87 1upx s LYS 224 Cb -0.05 -3.53 -0.02 0.00 -0.52 0.00 0.00 37.83 33.72 1upx s LYS 224 CO -0.03 0.03 -0.06 0.08 -0.92 0.00 0.00 175.35 174.46 1upx s VAL 225 N 1.12 3.46 0.21 3.17 1.01 0.74 -4.94 120.40 125.17 1upx s VAL 225 Ca 0.13 -0.49 -0.30 0.00 0.00 0.00 0.00 61.98 61.32 1upx s VAL 225 Cb -0.14 -2.53 -0.09 0.00 0.00 0.00 0.00 36.38 33.62 1upx s VAL 225 CO 0.06 0.46 1.32 0.21 0.00 0.00 0.00 175.10 177.14 1upx s ASN 226 N 0.95 6.87 0.00 3.32 2.47 -1.26 -0.95 114.94 126.35 1upx s ASN 226 Ca -0.00 2.44 0.14 0.00 0.42 0.00 0.00 52.86 55.85 1upx s ASN 226 Cb -0.15 -2.61 0.09 0.00 -1.45 0.00 0.00 41.25 37.13 1upx s ASN 226 CO 0.01 -0.54 0.91 2.30 -3.72 0.00 0.00 177.10 176.06 1upx n ILE 227 N 2.48 0.00 -1.67 -5.21 -5.35 -0.67 -1.41 119.36 107.53 1upx n ILE 227 Ca 0.06 -0.48 -0.14 0.00 -0.27 0.00 0.00 62.75 61.92 1upx n ILE 227 Cb 0.42 1.27 0.09 0.00 -1.74 0.00 0.00 39.64 39.69 1upx n ILE 227 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1upx n GLY 228 N 0.82 -0.88 3.35 3.28 0.00 -1.23 -4.48 105.19 106.04 1upx n GLY 228 Ca 0.08 -1.76 -0.18 0.00 0.00 0.00 0.00 46.02 44.16 1upx n GLY 228 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1upx s VAL 229 N -2.25 1.52 0.00 1.61 -7.23 -1.26 -4.63 120.40 108.15 1upx s VAL 229 Ca 0.37 -2.14 0.00 0.00 -1.81 0.00 0.00 61.98 58.40 1upx s VAL 229 Cb -0.01 -2.15 0.00 0.00 0.56 0.00 0.00 36.38 34.78 1upx s VAL 229 CO 0.26 -0.52 0.00 0.61 -0.31 0.00 0.00 175.10 175.14 1upx n GLY 230 N -0.40 1.48 0.51 2.32 0.00 -1.26 -5.05 105.19 102.79 1upx n GLY 230 Ca -0.07 -2.03 0.06 0.00 0.00 0.00 0.00 46.02 43.98 1upx n GLY 230 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1upx n SER 231 N -1.79 2.15 -4.91 1.61 3.41 -1.26 -4.56 113.62 108.27 1upx n SER 231 Ca 0.00 -1.58 -0.29 0.00 -0.26 0.00 0.00 58.87 56.75 1upx n SER 231 Cb 0.00 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 63.87 1upx n SER 231 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1upx s ASN 232 N -0.98 6.43 0.60 4.04 0.02 -1.26 -4.67 114.94 119.11 1upx s ASN 232 Ca 0.16 0.53 -0.19 0.00 -1.02 0.00 0.00 52.86 52.33 1upx s ASN 232 Cb 0.10 -2.06 -0.03 0.00 0.02 0.00 0.00 41.25 39.28 1upx s ASN 232 CO 0.15 -0.06 1.23 -2.65 0.02 0.00 0.00 177.10 175.79 1upx n PRO 233 N -0.58 1.23 -4.25 -0.60 -0.02 -1.26 -4.34 135.00 125.18 1upx n PRO 233 Ca -0.03 0.47 -0.14 0.00 -2.02 0.00 0.00 63.50 61.78 1upx n PRO 233 Cb 0.53 -2.45 -0.10 0.00 -0.02 0.00 0.00 33.50 31.46 1upx n PRO 233 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1upx s GLY 234 N -1.20 1.34 -0.10 -1.23 0.00 -1.26 -1.46 107.32 103.41 1upx s GLY 234 Ca 0.78 -1.66 0.02 0.00 0.00 0.00 0.00 44.72 43.86 1upx s GLY 234 CO 0.45 -1.53 -0.16 -0.42 0.00 0.00 0.00 173.10 171.44 1upx s ILE 235 N -3.71 2.87 -0.30 0.90 1.01 -0.14 -3.59 121.20 118.24 1upx s ILE 235 Ca 0.28 -0.75 -0.11 0.00 0.00 0.00 0.00 60.65 60.07 1upx s ILE 235 Cb 0.07 -2.16 -0.03 0.00 0.01 0.00 0.00 42.46 40.34 1upx s ILE 235 CO 0.06 0.55 0.20 -0.22 0.00 0.00 0.00 174.94 175.53 1upx s LEU 236 N 0.02 4.17 -0.17 2.97 2.96 -0.30 -1.13 118.68 127.20 1upx s LEU 236 Ca -0.05 -0.22 -0.08 0.00 -0.22 0.00 0.00 54.13 53.57 1upx s LEU 236 Cb -0.15 -2.10 -0.04 0.00 0.50 0.00 0.00 46.19 44.40 1upx s LEU 236 CO 0.04 -0.13 0.08 -0.51 -1.32 0.00 0.00 176.35 174.52 1upx s ILE 237 N 1.72 5.00 0.31 6.68 2.07 0.03 -0.32 121.20 136.70 1upx s ILE 237 Ca 0.06 0.04 0.04 0.00 -1.41 0.00 0.00 60.65 59.38 1upx s ILE 237 Cb -0.17 -3.24 -0.06 0.00 0.13 0.00 0.00 42.46 39.12 1upx s ILE 237 CO 0.10 0.49 0.04 -0.55 -1.91 0.00 0.00 174.94 173.10 1upx s SER 238 N 0.07 2.43 0.00 4.50 0.15 0.28 -1.05 113.70 120.09 1upx s SER 238 Ca 0.07 -1.34 0.00 0.00 0.70 0.00 0.00 55.95 55.38 1upx s SER 238 Cb -0.12 -0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.09 1upx s SER 238 CO 0.00 -0.56 0.00 0.61 1.20 0.00 0.00 173.24 174.49 1upx n GLY 239 N -0.66 0.62 0.00 9.45 0.00 -1.26 -1.65 105.19 111.69 1upx n GLY 239 Ca -0.03 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.55 1upx n GLY 239 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1upx n HIS 240 N 3.15 0.00 -2.62 1.61 8.25 -1.26 -2.01 115.22 122.34 1upx n HIS 240 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.03 1upx n HIS 240 Cb 0.00 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.09 1upx n HIS 240 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1upx s ASP 241 N -0.59 6.63 0.33 0.41 -1.08 -1.26 -4.88 116.67 116.22 1upx s ASP 241 Ca 0.00 0.45 0.16 0.00 -0.52 0.00 0.00 52.55 52.64 1upx s ASP 241 Cb 0.00 -2.54 0.51 0.00 -1.46 0.00 0.00 42.92 39.43 1upx s ASP 241 CO 0.00 -1.22 1.66 -0.07 0.52 0.00 0.00 175.17 176.06 1upx h LEU 242 N 11.13 0.00 -0.61 -1.34 3.38 -1.97 -3.02 115.31 122.88 1upx h LEU 242 Ca -0.23 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.61 1upx h LEU 242 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1upx h LEU 242 CO 1.12 0.48 -0.34 -0.09 0.09 0.00 0.00 178.44 179.69 1upx h ARG 243 N 0.00 0.73 -0.72 1.13 9.65 -1.96 -1.00 114.38 122.21 1upx h ARG 243 Ca -0.00 -0.35 0.02 0.00 -1.10 0.00 0.00 59.98 58.54 1upx h ARG 243 Cb 1.02 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 29.55 1upx h ARG 243 CO 0.06 0.96 0.47 -0.44 2.80 0.00 0.00 179.97 183.83 1upx h ASP 244 N 0.62 0.80 -0.57 -3.80 3.32 -1.94 -2.04 116.42 112.81 1upx h ASP 244 Ca 0.06 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1upx h ASP 244 Cb 0.87 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.20 1upx h ASP 244 CO 0.08 0.57 0.31 0.25 -1.72 0.00 0.00 179.24 178.73 1upx h LEU 245 N 0.95 0.72 -0.26 1.55 5.85 -1.35 -0.99 115.31 121.78 1upx h LEU 245 Ca 0.27 -0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.93 1upx h LEU 245 Cb -0.07 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.74 1upx h LEU 245 CO -0.08 0.61 0.04 -0.08 -0.34 0.00 0.00 178.44 178.59 1upx h GLU 246 N 0.77 0.13 -0.64 1.25 4.81 -0.79 0.13 114.58 120.24 1upx h GLU 246 Ca 0.20 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.35 1upx h GLU 246 Cb 0.05 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.38 1upx h GLU 246 CO -0.03 0.08 0.10 0.52 -0.73 0.00 0.00 179.01 178.95 1upx h MET 247 N 0.13 1.04 -0.46 1.92 2.86 -1.22 -1.72 114.93 117.48 1upx h MET 247 Ca 0.12 -0.27 -0.07 0.00 -2.06 0.00 0.00 59.70 57.42 1upx h MET 247 Cb 0.13 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 1upx h MET 247 CO -0.17 0.96 0.03 1.25 1.06 0.00 0.00 176.91 180.04 1upx h LEU 248 N 0.98 0.78 -0.61 1.22 5.85 -0.60 -1.35 115.31 121.58 1upx h LEU 248 Ca 0.19 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.59 1upx h LEU 248 Cb 0.43 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 1upx h LEU 248 CO 0.01 0.88 0.25 -0.07 -0.34 0.00 0.00 178.44 179.17 1upx h LEU 249 N 0.66 0.83 -0.74 2.25 3.38 -0.58 -0.67 115.31 120.43 1upx h LEU 249 Ca 0.13 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 1upx h LEU 249 Cb 0.46 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1upx h LEU 249 CO 0.02 0.76 0.25 0.11 0.09 0.00 0.00 178.44 179.67 1upx h LYS 250 N 0.84 1.14 0.00 1.13 1.57 -1.17 -2.52 116.57 117.55 1upx h LYS 250 Ca 0.20 -0.24 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 1upx h LYS 250 Cb 0.19 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1upx h LYS 250 CO -0.02 0.96 -0.24 1.96 -0.57 0.00 0.00 179.45 181.54 1upx h GLN 251 N 1.09 0.00 -0.00 3.15 4.20 -1.05 -3.04 115.11 119.46 1upx h GLN 251 Ca 0.24 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.95 1upx h GLN 251 Cb 0.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1upx h GLN 251 CO -0.01 0.24 -0.28 0.25 -0.67 0.00 0.00 178.83 178.35 1upx n THR 252 N -3.19 0.00 -1.68 -0.54 -2.24 -0.28 -4.83 114.28 101.53 1upx n THR 252 Ca 0.02 -0.02 -0.47 0.00 -2.27 0.00 0.00 64.05 61.32 1upx n THR 252 Cb 0.59 -0.01 -0.04 0.00 -2.10 0.00 0.00 70.33 68.77 1upx n THR 252 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1upx n GLU 253 N -1.37 2.21 -0.99 -0.78 4.07 -0.97 -1.79 120.64 121.03 1upx n GLU 253 Ca 0.08 0.80 0.00 0.00 -0.06 0.00 0.00 57.16 57.98 1upx n GLU 253 Cb 0.33 -2.62 0.00 0.00 -0.06 0.00 0.00 31.44 29.09 1upx n GLU 253 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1upx n GLY 254 N 3.94 0.69 0.03 8.31 0.00 -1.26 -4.92 105.19 111.98 1upx n GLY 254 Ca 0.20 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.33 1upx n GLY 254 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1upx n THR 255 N -2.55 0.14 -0.98 2.61 -2.24 -0.74 -4.96 114.28 105.57 1upx n THR 255 Ca 0.00 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 1upx n THR 255 Cb 0.01 0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 1upx n THR 255 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1upx n GLY 256 N 1.35 0.70 3.59 3.38 0.00 -1.26 -5.02 105.19 107.93 1upx n GLY 256 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 1upx n GLY 256 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1upx s VAL 257 N -2.79 4.87 0.49 1.61 1.01 -1.26 -4.40 120.40 119.93 1upx s VAL 257 Ca 0.00 0.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.93 1upx s VAL 257 Cb 0.00 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 1upx s VAL 257 CO 0.00 0.37 0.80 -1.81 0.00 0.00 0.00 175.10 174.47 1upx s ASP 258 N 1.04 6.28 -0.09 3.32 1.01 -0.53 -4.85 116.67 122.84 1upx s ASP 258 Ca 0.05 0.98 0.04 0.00 0.71 0.00 0.00 52.55 54.33 1upx s ASP 258 Cb -0.14 -2.27 0.00 0.00 1.01 0.00 0.00 42.92 41.52 1upx s ASP 258 CO 0.04 -0.59 -0.22 -0.69 0.21 0.00 0.00 175.17 173.91 1upx s VAL 259 N -2.75 1.92 0.18 -1.27 1.01 -0.30 -0.97 120.40 118.23 1upx s VAL 259 Ca 0.48 -0.94 0.11 0.00 0.00 0.00 0.00 61.98 61.63 1upx s VAL 259 Cb -0.10 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 1upx s VAL 259 CO 0.45 0.53 -0.23 -0.31 0.00 0.00 0.00 175.10 175.54 1upx s TYR 260 N 0.35 2.33 0.26 5.22 1.51 -0.28 -0.38 117.35 126.37 1upx s TYR 260 Ca -0.17 -0.35 0.06 0.00 -1.01 0.00 0.00 57.07 55.60 1upx s TYR 260 Cb -0.17 -1.17 -0.03 0.00 -0.11 0.00 0.00 41.96 40.48 1upx s TYR 260 CO 0.08 0.48 0.30 0.95 -1.11 0.00 0.00 175.55 176.24 1upx s THR 261 N -1.59 4.75 -0.02 -0.71 -4.23 -0.58 -0.79 115.64 112.47 1upx s THR 261 Ca 0.20 -1.18 -0.02 0.00 -1.18 0.00 0.00 61.69 59.51 1upx s THR 261 Cb -0.08 -3.61 0.01 0.00 1.34 0.00 0.00 72.50 70.16 1upx s THR 261 CO 0.10 -0.32 0.06 -2.28 -0.54 0.00 0.00 174.62 171.64 1upx s HIS 262 N -2.07 -0.06 0.00 3.99 2.46 -0.21 -0.67 115.29 118.72 1upx s HIS 262 Ca 0.35 0.17 0.00 0.00 0.47 0.00 0.00 55.06 56.05 1upx s HIS 262 Cb -0.08 -0.01 0.00 0.00 -0.13 0.00 0.00 32.58 32.36 1upx s HIS 262 CO 0.27 -0.04 0.00 0.45 -2.47 0.00 0.00 174.74 172.95 1upx n SER 263 N 3.21 0.00 -0.18 9.88 2.88 -1.23 -1.37 113.62 126.82 1upx n SER 263 Ca -0.14 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.50 1upx n SER 263 Cb 0.58 0.00 0.52 0.00 -0.75 0.00 0.00 64.21 64.57 1upx n SER 263 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1upx n GLU 264 N 0.00 1.24 0.00 -1.46 -0.58 -1.24 -2.89 120.64 115.70 1upx n GLU 264 Ca 0.00 -0.36 0.12 0.00 -0.42 0.00 0.00 57.16 56.50 1upx n GLU 264 Cb 0.00 -1.34 0.27 0.00 -0.57 0.00 0.00 31.44 29.80 1upx n GLU 264 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1upx n MET 265 N -0.44 0.16 -0.27 3.49 2.81 -0.47 -4.35 117.12 118.06 1upx n MET 265 Ca 0.15 -0.10 0.07 0.00 -1.81 0.00 0.00 57.70 56.02 1upx n MET 265 Cb 0.16 -1.50 0.18 0.00 -0.71 0.00 0.00 33.22 31.35 1upx n MET 265 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1upx h LEU 266 N 0.23 -0.31 -1.20 4.03 5.85 -1.70 -0.97 115.31 121.24 1upx h LEU 266 Ca 0.00 0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.92 1upx h LEU 266 Cb 0.50 0.34 0.00 0.00 0.37 0.00 0.00 40.66 41.87 1upx h LEU 266 CO 0.00 -0.18 0.00 -0.65 -0.34 0.00 0.00 178.44 177.27 1upx h PRO 267 N 0.12 0.00 -0.76 5.25 0.11 -1.85 -2.12 132.00 132.74 1upx h PRO 267 Ca 0.44 0.00 0.19 0.00 0.11 0.00 0.00 66.00 66.74 1upx h PRO 267 Cb 0.80 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.87 1upx h PRO 267 CO -0.68 0.00 0.52 0.00 -0.21 0.00 0.00 178.00 177.63 1upx h ALA 268 N 2.10 2.38 0.00 -0.75 0.00 -1.47 -0.35 119.26 121.17 1upx h ALA 268 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1upx h ALA 268 Cb 0.16 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1upx h ALA 268 CO 0.00 -0.60 -0.02 0.45 0.00 0.00 0.00 179.25 179.08 1upx h HIS 269 N 0.23 0.00 0.00 0.00 3.86 -1.57 -2.59 115.15 115.07 1upx h HIS 269 Ca 0.38 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.59 1upx h HIS 269 Cb 1.14 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.61 1upx h HIS 269 CO -0.00 0.02 -0.15 0.66 0.86 0.00 0.00 177.93 179.31 1upx n TYR 270 N -3.32 0.74 -3.15 2.45 0.53 -0.14 -4.84 117.16 109.43 1upx n TYR 270 Ca -0.02 0.22 -0.39 0.00 -1.02 0.00 0.00 57.90 56.68 1upx n TYR 270 Cb 0.12 -0.82 -0.05 0.00 -1.03 0.00 0.00 39.34 37.56 1upx n TYR 270 CO 0.00 0.00 0.00 0.71 -1.02 0.00 0.00 176.86 176.55 1upx s TYR 271 N -3.10 3.60 0.31 -0.72 1.51 -0.98 -1.08 117.35 116.89 1upx s TYR 271 Ca 0.10 1.16 0.07 0.00 -1.01 0.00 0.00 57.07 57.39 1upx s TYR 271 Cb 0.13 -2.69 0.81 0.00 -0.11 0.00 0.00 41.96 40.10 1upx s TYR 271 CO 0.62 0.19 1.75 -1.35 -1.11 0.00 0.00 175.55 175.65 1upx h PRO 272 N 6.37 0.63 -0.11 -1.71 0.11 -1.74 -2.43 132.00 133.12 1upx h PRO 272 Ca -0.42 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1upx h PRO 272 Cb 1.19 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1upx h PRO 272 CO 0.73 0.41 0.01 0.00 -0.21 0.00 0.00 178.00 178.95 1upx h ALA 273 N 1.69 1.81 -0.00 -0.75 0.00 -1.65 -2.49 119.26 117.86 1upx h ALA 273 Ca 0.61 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.45 1upx h ALA 273 Cb 1.07 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1upx h ALA 273 CO -0.44 0.15 -0.45 1.19 0.00 0.00 0.00 179.25 179.70 1upx n PHE 274 N -4.45 0.00 0.31 0.00 0.99 -0.92 -4.00 117.46 109.39 1upx n PHE 274 Ca -0.01 0.00 0.15 0.00 -0.00 0.00 0.00 57.45 57.59 1upx n PHE 274 Cb 0.14 -0.19 0.50 0.00 -1.00 0.00 0.00 39.48 38.93 1upx n PHE 274 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.76 177.63 1upx h LYS 275 N 0.44 0.00 0.00 -1.08 1.57 -1.48 -3.10 116.57 112.93 1upx h LYS 275 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1upx h LYS 275 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1upx h LYS 275 CO 0.00 0.00 0.00 0.36 -0.57 0.00 0.00 179.45 179.24 1upx n LYS 276 N -2.91 0.10 -3.18 3.15 2.85 -1.26 -4.70 118.16 112.22 1upx n LYS 276 Ca 0.02 0.21 -0.43 0.00 -1.05 0.00 0.00 58.31 57.06 1upx n LYS 276 Cb 0.37 -1.64 -0.07 0.00 -0.65 0.00 0.00 35.03 33.03 1upx n LYS 276 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1upx s TYR 277 N -3.09 3.12 0.33 5.58 1.51 -1.17 -4.94 117.35 118.68 1upx s TYR 277 Ca 0.09 -0.03 0.24 0.00 -1.01 0.00 0.00 57.07 56.37 1upx s TYR 277 Cb 0.13 -3.15 1.18 0.00 -0.11 0.00 0.00 41.96 40.01 1upx s TYR 277 CO 0.44 -0.75 1.96 0.00 -1.11 0.00 0.00 175.55 176.10 1upx h ALA 278 N 8.72 1.21 -0.14 3.71 0.00 -1.90 -2.40 119.26 128.47 1upx h ALA 278 Ca -0.26 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1upx h ALA 278 Cb 1.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1upx h ALA 278 CO 0.84 0.24 0.00 -2.39 0.00 0.00 0.00 179.25 177.94 1upx n HIS 279 N -3.63 0.17 -2.76 0.00 1.44 -1.26 -4.69 115.22 104.49 1upx n HIS 279 Ca -0.01 -0.08 -0.43 0.00 -2.01 0.00 0.00 57.72 55.19 1upx n HIS 279 Cb 0.32 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.40 1upx n HIS 279 CO 0.00 0.00 0.00 0.12 -2.81 0.00 0.00 176.34 173.65 1upx s PHE 280 N -1.83 2.72 0.00 -1.40 5.36 -0.90 -1.15 117.98 120.78 1upx s PHE 280 Ca 0.33 0.08 0.00 0.00 -0.96 0.00 0.00 56.93 56.38 1upx s PHE 280 Cb 0.18 -4.23 0.00 0.00 -0.34 0.00 0.00 43.02 38.63 1upx s PHE 280 CO 0.27 -1.46 0.00 1.63 -1.46 0.00 0.00 175.22 174.21 1upx n LYS 281 N 7.81 1.86 -0.18 10.12 4.76 0.49 -4.96 118.16 138.06 1upx n LYS 281 Ca 0.03 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.47 1upx n LYS 281 Cb 0.48 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.67 1upx n LYS 281 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1upx n GLY 282 N 5.00 1.67 3.50 0.72 0.00 -1.26 -4.83 105.19 110.00 1upx n GLY 282 Ca 0.00 -2.02 -0.34 0.00 0.00 0.00 0.00 46.02 43.66 1upx n GLY 282 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1upx s ASN 283 N -1.00 4.97 -0.23 1.61 2.47 -0.50 -1.53 114.94 120.73 1upx s ASN 283 Ca 0.00 -0.12 -0.06 0.00 0.42 0.00 0.00 52.86 53.10 1upx s ASN 283 Cb 0.00 -1.83 -0.02 0.00 -1.45 0.00 0.00 41.25 37.94 1upx s ASN 283 CO 0.00 0.13 0.03 -0.47 -3.72 0.00 0.00 177.10 173.07 1upx s TYR 284 N 0.61 3.05 0.00 0.43 5.04 0.15 -4.31 117.35 122.33 1upx s TYR 284 Ca -0.01 -0.51 0.00 0.00 -2.44 0.00 0.00 57.07 54.11 1upx s TYR 284 Cb -0.14 -2.16 0.00 0.00 0.35 0.00 0.00 41.96 40.01 1upx s TYR 284 CO 0.02 -0.34 0.00 0.41 -1.34 0.00 0.00 175.55 174.30 1upx n GLY 285 N 4.66 -0.26 0.00 8.97 0.00 -1.26 -4.56 105.19 112.73 1upx n GLY 285 Ca -0.17 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.52 1upx n GLY 285 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1upx n ASN 286 N 0.76 0.00 -4.79 1.61 3.02 -1.26 -4.90 115.26 109.70 1upx n ASN 286 Ca 0.00 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.26 1upx n ASN 286 Cb 0.00 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.28 1upx n ASN 286 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1upx s ALA 287 N -2.00 2.03 0.35 5.41 0.00 -1.26 -3.48 121.76 122.81 1upx s ALA 287 Ca 0.00 -0.32 0.16 0.00 0.00 0.00 0.00 51.96 51.79 1upx s ALA 287 Cb 0.00 -3.08 1.09 0.00 0.00 0.00 0.00 23.12 21.13 1upx s ALA 287 CO 0.00 -1.97 1.68 0.11 0.00 0.00 0.00 175.76 175.58 1upx h TRP 288 N -1.27 0.88 0.00 0.00 5.08 -1.93 -2.47 115.95 116.24 1upx h TRP 288 Ca -0.48 0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.52 1upx h TRP 288 Cb 1.29 -0.24 0.00 0.00 -3.00 0.00 0.00 29.16 27.22 1upx h TRP 288 CO 0.40 -0.12 0.00 -2.67 -1.28 0.00 0.00 178.44 174.77 1upx n TRP 289 N -4.95 0.68 1.01 0.12 4.27 -1.26 -1.67 117.44 115.63 1upx n TRP 289 Ca 0.31 0.24 0.05 0.00 -3.89 0.00 0.00 57.50 54.21 1upx n TRP 289 Cb 0.98 -0.89 0.14 0.00 -1.36 0.00 0.00 31.31 30.18 1upx n TRP 289 CO 0.00 0.00 0.00 1.63 -2.29 0.00 0.00 177.69 177.03 1upx n LYS 290 N -2.09 1.73 0.22 -2.67 5.02 -0.93 -4.54 118.16 114.90 1upx n LYS 290 Ca 0.04 -1.10 0.10 0.00 -2.02 0.00 0.00 58.31 55.33 1upx n LYS 290 Cb 0.29 -1.25 0.41 0.00 -0.02 0.00 0.00 35.03 34.45 1upx n LYS 290 CO 0.00 0.00 0.00 -0.56 -0.52 0.00 0.00 177.40 176.32 1upx h GLN 291 N 1.77 0.00 -0.18 1.97 3.07 -1.51 -1.61 115.11 118.62 1upx h GLN 291 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.72 1upx h GLN 291 Cb 0.43 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.98 1upx h GLN 291 CO 0.01 0.21 0.02 0.87 0.09 0.00 0.00 178.83 180.02 1upx h LYS 292 N 0.00 0.25 0.07 0.06 1.57 -1.84 0.10 116.57 116.78 1upx h LYS 292 Ca -0.00 -0.03 -0.20 0.00 -1.87 0.00 0.00 60.65 58.54 1upx h LYS 292 Cb 0.82 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 1upx h LYS 292 CO 0.03 0.26 -1.03 0.93 -0.57 0.00 0.00 179.45 179.07 1upx h GLU 293 N 0.25 0.15 0.08 3.15 3.07 -1.81 -3.34 114.58 116.13 1upx h GLU 293 Ca 0.06 -0.26 -0.26 0.00 -0.50 0.00 0.00 59.36 58.40 1upx h GLU 293 Cb 0.15 0.10 0.01 0.00 -0.84 0.00 0.00 28.75 28.16 1upx h GLU 293 CO 0.00 1.13 -1.13 0.93 -1.40 0.00 0.00 179.01 178.54 1upx h GLU 294 N -0.59 0.38 -0.50 2.33 5.08 -1.13 -2.05 114.58 118.10 1upx h GLU 294 Ca -0.23 -0.51 -0.04 0.00 -1.00 0.00 0.00 59.36 57.58 1upx h GLU 294 Cb 1.51 0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.90 1upx h GLU 294 CO 0.01 1.20 0.16 0.74 -1.00 0.00 0.00 179.01 180.11 1upx h PHE 295 N 0.16 0.74 0.18 4.33 0.04 -1.03 -1.70 116.94 119.66 1upx h PHE 295 Ca -0.12 -0.05 -0.01 0.00 2.80 0.00 0.00 57.97 60.59 1upx h PHE 295 Cb 1.81 -0.22 0.00 0.00 2.20 0.00 0.00 35.95 39.74 1upx h PHE 295 CO 0.07 0.60 -0.09 1.49 -0.60 0.00 0.00 178.31 179.79 1upx h GLU 296 N 0.72 -0.23 0.00 1.51 4.57 -1.62 -3.14 114.58 116.38 1upx h GLU 296 Ca 0.17 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.36 1upx h GLU 296 Cb 0.21 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 1upx h GLU 296 CO -0.01 -0.06 0.00 0.66 -1.18 0.00 0.00 179.01 178.42 1upx h SER 297 N -0.36 0.00 0.32 1.04 4.64 -1.22 -2.70 113.55 115.27 1upx h SER 297 Ca -0.02 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.24 1upx h SER 297 Cb 0.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1upx h SER 297 CO 0.04 0.00 -0.26 0.15 -0.87 0.00 0.00 176.83 175.89 1upx h PHE 298 N 0.00 0.00 0.00 4.77 3.57 -1.26 -1.69 116.94 122.33 1upx h PHE 298 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1upx h PHE 298 Cb 0.55 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.29 1upx h PHE 298 CO 0.00 0.26 0.00 0.09 -2.23 0.00 0.00 178.31 176.43 1upx n ASN 299 N -4.09 0.00 -4.78 0.41 3.02 -1.02 -3.52 115.26 105.28 1upx n ASN 299 Ca -0.02 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.31 1upx n ASN 299 Cb 0.32 0.00 0.10 0.00 -0.61 0.00 0.00 39.78 39.59 1upx n ASN 299 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1upx s GLY 300 N 0.00 1.74 0.68 7.41 0.00 -1.26 -4.52 107.32 111.37 1upx s GLY 300 Ca 0.00 -1.94 -0.17 0.00 0.00 0.00 0.00 44.72 42.61 1upx s GLY 300 CO 0.00 -1.38 1.24 -4.14 0.00 0.00 0.00 173.10 168.82 1upx s PRO 301 N -5.00 2.42 -0.08 2.90 0.02 -1.24 -4.81 135.00 129.21 1upx s PRO 301 Ca 0.66 1.89 0.04 0.00 0.02 0.00 0.00 61.00 63.60 1upx s PRO 301 Cb -0.05 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.62 1upx s PRO 301 CO 0.43 -1.66 -0.19 0.14 -0.33 0.00 0.00 177.00 175.39 1upx s VAL 302 N -1.69 1.69 -0.24 3.83 -7.23 -0.08 -1.15 120.40 115.52 1upx s VAL 302 Ca 0.78 -0.81 -0.04 0.00 -1.81 0.00 0.00 61.98 60.10 1upx s VAL 302 Cb -0.33 -1.47 0.01 0.00 0.56 0.00 0.00 36.38 35.15 1upx s VAL 302 CO 0.41 0.48 -0.03 -0.22 -0.31 0.00 0.00 175.10 175.43 1upx s LEU 303 N 0.36 3.16 -0.37 1.32 2.96 0.56 -0.40 118.68 126.27 1upx s LEU 303 Ca -0.14 -0.62 -0.16 0.00 -0.22 0.00 0.00 54.13 52.99 1upx s LEU 303 Cb -0.16 -1.74 0.00 0.00 0.50 0.00 0.00 46.19 44.79 1upx s LEU 303 CO 0.06 -0.09 0.38 -0.76 -1.32 0.00 0.00 176.35 174.63 1upx s LEU 304 N 1.43 4.61 0.14 -0.68 2.01 -0.01 -0.56 118.68 125.62 1upx s LEU 304 Ca 0.03 -0.41 0.18 0.00 0.01 0.00 0.00 54.13 53.94 1upx s LEU 304 Cb -0.16 -2.35 -0.06 0.00 0.01 0.00 0.00 46.19 43.64 1upx s LEU 304 CO -0.03 -0.43 0.99 0.71 1.01 0.00 0.00 176.35 178.61 1upx h THR 305 N 5.61 0.41 -2.46 5.49 1.35 -1.60 -2.50 112.91 119.21 1upx h THR 305 Ca -0.28 -1.75 -0.06 0.00 -0.55 0.00 0.00 66.41 63.77 1upx h THR 305 Cb 1.13 1.96 -0.01 0.00 -1.73 0.00 0.00 68.15 69.49 1upx h THR 305 CO 0.73 0.23 -0.01 0.35 -0.25 0.00 0.00 175.52 176.57 1upx n THR 306 N -2.89 0.00 -0.86 6.82 -2.24 -1.26 -4.59 114.28 109.26 1upx n THR 306 Ca -0.05 -0.41 -0.32 0.00 -2.27 0.00 0.00 64.05 61.00 1upx n THR 306 Cb 0.75 0.28 0.15 0.00 -2.10 0.00 0.00 70.33 69.41 1upx n THR 306 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1upx s ASN 307 N -1.56 3.16 -0.25 3.42 4.22 -1.26 -4.42 114.94 118.25 1upx s ASN 307 Ca 0.07 2.28 -0.09 0.00 -2.14 0.00 0.00 52.86 52.97 1upx s ASN 307 Cb -0.01 -2.58 -0.04 0.00 1.28 0.00 0.00 41.25 39.90 1upx s ASN 307 CO 0.05 -2.95 0.14 0.00 -2.04 0.00 0.00 177.10 172.29 1upx s LEU 309 N 1.33 3.77 0.08 0.00 2.96 0.09 -4.93 118.68 121.99 1upx s LEU 309 Ca 0.06 0.07 0.02 0.00 -0.22 0.00 0.00 54.13 54.06 1upx s LEU 309 Cb -0.15 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.56 1upx s LEU 309 CO 0.06 0.18 0.18 0.68 -1.32 0.00 0.00 176.35 176.13 1upx s VAL 310 N 0.34 5.08 -0.18 1.68 -7.23 -1.26 -4.60 120.40 114.22 1upx s VAL 310 Ca 0.03 -0.58 -0.37 0.00 -1.81 0.00 0.00 61.98 59.24 1upx s VAL 310 Cb -0.12 -3.50 -0.14 0.00 0.56 0.00 0.00 36.38 33.18 1upx s VAL 310 CO 0.00 0.09 1.79 -2.65 -0.31 0.00 0.00 175.10 174.02 1upx n PRO 311 N 0.18 1.60 -2.43 4.82 -0.02 -1.26 -4.86 135.00 133.03 1upx n PRO 311 Ca -0.06 0.59 -0.35 0.00 -2.02 0.00 0.00 63.50 61.66 1upx n PRO 311 Cb 0.52 -2.34 -0.02 0.00 -0.02 0.00 0.00 33.50 31.64 1upx n PRO 311 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1upx s PRO 312 N 3.61 3.65 0.54 0.52 0.04 -1.26 -5.01 135.00 137.08 1upx s PRO 312 Ca 0.95 1.47 -0.19 0.00 0.04 0.00 0.00 61.00 63.28 1upx s PRO 312 Cb -0.90 -2.09 -0.06 0.00 0.04 0.00 0.00 34.50 31.50 1upx s PRO 312 CO 0.59 -0.58 1.08 0.15 0.04 0.00 0.00 177.00 178.28 1upx s LYS 313 N -3.21 3.45 0.45 4.56 -0.14 -1.26 -4.86 119.74 118.74 1upx s LYS 313 Ca 0.69 1.43 0.18 0.00 -1.36 0.00 0.00 55.97 56.91 1upx s LYS 313 Cb -0.20 -2.04 1.14 0.00 -1.68 0.00 0.00 37.83 35.06 1upx s LYS 313 CO 0.23 -0.74 1.94 -0.44 -0.76 0.00 0.00 175.35 175.59 1upx h ASP 314 N 1.07 0.29 -0.35 2.83 3.32 -2.00 -1.49 116.42 120.10 1upx h ASP 314 Ca -0.49 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 56.58 1upx h ASP 314 Cb 1.24 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.73 1upx h ASP 314 CO 0.57 0.15 0.22 0.77 -1.72 0.00 0.00 179.24 179.24 1upx h SER 315 N 0.31 0.41 0.00 6.45 4.64 -2.00 -3.19 113.55 120.17 1upx h SER 315 Ca 0.33 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1upx h SER 315 Cb 0.87 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 1upx h SER 315 CO -0.08 0.31 0.00 0.00 -0.87 0.00 0.00 176.83 176.19 1upx n TYR 316 N -4.47 0.00 -0.17 4.77 0.18 -1.01 -4.79 117.16 111.67 1upx n TYR 316 Ca 0.02 -0.10 0.10 0.00 1.88 0.00 0.00 57.90 59.80 1upx n TYR 316 Cb 0.07 -0.01 0.42 0.00 -0.38 0.00 0.00 39.34 39.44 1upx n TYR 316 CO 0.00 0.00 0.00 -0.22 -2.08 0.00 0.00 176.86 174.56 1upx h LYS 317 N 0.00 0.59 0.00 -3.48 3.64 -1.27 -0.89 116.57 115.17 1upx h LYS 317 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1upx h LYS 317 Cb 0.22 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1upx h LYS 317 CO 0.00 0.39 0.00 -3.47 -2.27 0.00 0.00 179.45 174.10 1upx n ASP 318 N -4.49 0.38 -0.48 4.20 -0.08 -1.26 -2.35 116.55 112.46 1upx n ASP 318 Ca 0.12 0.58 0.08 0.00 -1.51 0.00 0.00 54.79 54.07 1upx n ASP 318 Cb 0.34 -0.67 0.19 0.00 2.34 0.00 0.00 41.12 43.33 1upx n ASP 318 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1upx n ARG 319 N -1.91 2.25 -3.22 -0.67 1.85 -0.35 -4.95 116.66 109.67 1upx n ARG 319 Ca 0.03 -2.60 -0.39 0.00 -1.00 0.00 0.00 57.85 53.89 1upx n ARG 319 Cb 0.23 -1.61 -0.06 0.00 -1.05 0.00 0.00 32.46 29.97 1upx n ARG 319 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1upx s VAL 320 N -2.62 5.10 -0.11 8.89 1.01 -0.99 -0.90 120.40 130.77 1upx s VAL 320 Ca 0.34 1.04 0.03 0.00 0.00 0.00 0.00 61.98 63.39 1upx s VAL 320 Cb 0.28 -3.87 -0.01 0.00 0.00 0.00 0.00 36.38 32.78 1upx s VAL 320 CO 0.06 0.19 -0.20 -0.31 0.00 0.00 0.00 175.10 174.85 1upx s TYR 321 N 1.45 2.65 0.25 5.22 1.51 0.46 -3.48 117.35 125.41 1upx s TYR 321 Ca 0.26 -0.84 0.07 0.00 -1.01 0.00 0.00 57.07 55.56 1upx s TYR 321 Cb -0.16 -1.75 -0.04 0.00 -0.11 0.00 0.00 41.96 39.91 1upx s TYR 321 CO 0.10 -0.30 0.21 0.95 -1.11 0.00 0.00 175.55 175.40 1upx s THR 322 N 0.26 4.53 0.31 -0.71 -4.23 0.11 -0.83 115.64 115.07 1upx s THR 322 Ca -0.14 -1.36 -0.10 0.00 -1.18 0.00 0.00 61.69 58.91 1upx s THR 322 Cb -0.17 -3.45 0.01 0.00 1.34 0.00 0.00 72.50 70.24 1upx s THR 322 CO 0.07 -0.35 0.55 0.28 -0.54 0.00 0.00 174.62 174.63 1upx s THR 323 N -2.12 0.00 0.00 3.99 -1.32 -0.94 -0.33 115.64 114.92 1upx s THR 323 Ca 0.33 -1.38 0.00 0.00 -1.21 0.00 0.00 61.69 59.43 1upx s THR 323 Cb -0.08 -2.48 0.00 0.00 -1.51 0.00 0.00 72.50 68.43 1upx s THR 323 CO 0.25 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.27 1upx n GLY 324 N -0.48 3.05 1.29 6.08 0.00 -1.10 -1.87 105.19 112.15 1upx n GLY 324 Ca -0.02 -0.22 0.10 0.00 0.00 0.00 0.00 46.02 45.88 1upx n GLY 324 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1upx n ILE 325 N 0.00 1.08 -2.76 -0.61 -6.64 -1.26 -4.72 119.36 104.45 1upx n ILE 325 Ca 0.00 -0.93 -0.37 0.00 -1.77 0.00 0.00 62.75 59.68 1upx n ILE 325 Cb 0.00 0.35 -0.06 0.00 -1.44 0.00 0.00 39.64 38.49 1upx n ILE 325 CO 0.00 0.00 0.00 -0.69 -1.77 0.00 0.00 176.55 174.09 1upx s VAL 326 N -1.29 4.16 -0.14 7.28 1.01 -0.78 -4.51 120.40 126.13 1upx s VAL 326 Ca 0.45 1.78 -0.29 0.00 0.00 0.00 0.00 61.98 63.92 1upx s VAL 326 Cb 0.25 -3.98 0.08 0.00 0.00 0.00 0.00 36.38 32.73 1upx s VAL 326 CO 0.28 0.13 0.74 -0.83 0.00 0.00 0.00 175.10 175.42 1upx s GLY 327 N -1.61 -0.52 -0.14 4.51 0.00 -0.75 -4.30 107.32 104.51 1upx s GLY 327 Ca 0.51 1.67 -0.08 0.00 0.00 0.00 0.00 44.72 46.81 1upx s GLY 327 CO 0.24 1.26 0.35 -0.12 0.00 0.00 0.00 173.10 174.83 1upx s PHE 328 N -0.62 -0.49 0.13 1.90 5.36 -1.26 -1.10 117.98 121.89 1upx s PHE 328 Ca -0.06 1.08 -0.31 0.00 -0.96 0.00 0.00 56.93 56.68 1upx s PHE 328 Cb -0.02 0.18 -0.11 0.00 -0.34 0.00 0.00 43.02 42.73 1upx s PHE 328 CO 0.06 -0.29 1.84 2.41 -1.46 0.00 0.00 175.22 177.78 1upx n THR 329 N 4.12 0.36 -0.45 0.12 -1.04 -1.26 -1.23 114.28 114.90 1upx n THR 329 Ca -0.23 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 61.71 1upx n THR 329 Cb 0.55 -2.14 0.00 0.00 -1.82 0.00 0.00 70.33 66.92 1upx n THR 329 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1upx n GLY 330 N 4.24 0.73 3.63 3.41 0.00 -1.26 -5.05 105.19 110.89 1upx n GLY 330 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1upx n GLY 330 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1upx n LYS 332 N 3.39 1.98 -4.86 0.00 5.02 -1.23 -4.71 118.16 117.75 1upx n LYS 332 Ca -0.17 0.70 -0.27 0.00 -2.02 0.00 0.00 58.31 56.55 1upx n LYS 332 Cb 0.52 -2.42 -0.16 0.00 -0.02 0.00 0.00 35.03 32.95 1upx n LYS 332 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1upx s HIS 333 N -1.19 1.84 -0.41 2.13 5.65 -1.26 -0.71 115.29 121.33 1upx s HIS 333 Ca 0.61 -0.62 -0.15 0.00 0.25 0.00 0.00 55.06 55.15 1upx s HIS 333 Cb -0.50 -1.26 0.02 0.00 -1.18 0.00 0.00 32.58 29.66 1upx s HIS 333 CO 0.58 -0.25 0.30 0.42 -0.65 0.00 0.00 174.74 175.14 1upx s ILE 334 N 0.27 5.24 0.36 0.89 1.01 0.55 -4.94 121.20 124.57 1upx s ILE 334 Ca -0.10 -0.66 -0.28 0.00 0.00 0.00 0.00 60.65 59.61 1upx s ILE 334 Cb -0.14 -3.92 -0.10 0.00 0.01 0.00 0.00 42.46 38.31 1upx s ILE 334 CO 0.04 -0.30 1.38 -2.16 0.00 0.00 0.00 174.94 173.90 1upx s PRO 335 N 1.68 4.19 0.00 2.79 0.04 -1.26 -4.06 135.00 138.38 1upx s PRO 335 Ca 0.05 2.36 0.00 0.00 0.04 0.00 0.00 61.00 63.45 1upx s PRO 335 Cb -0.19 -2.98 0.00 0.00 0.04 0.00 0.00 34.50 31.37 1upx s PRO 335 CO 0.10 -0.38 0.00 0.41 0.04 0.00 0.00 177.00 177.17 1upx n GLY 336 N 0.64 3.73 0.07 0.56 0.00 -1.26 -4.86 105.19 104.07 1upx n GLY 336 Ca 0.01 -0.76 0.02 0.00 0.00 0.00 0.00 46.02 45.29 1upx n GLY 336 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1upx n GLU 337 N 0.00 1.69 -0.08 1.61 0.28 -1.26 -2.72 120.64 120.16 1upx n GLU 337 Ca 0.00 -1.50 0.02 0.00 -0.16 0.00 0.00 57.16 55.52 1upx n GLU 337 Cb 0.00 -0.96 0.03 0.00 1.43 0.00 0.00 31.44 31.93 1upx n GLU 337 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 177.13 177.41 1upx n ILE 338 N -0.57 0.77 -0.77 3.84 -5.35 -1.26 -4.80 119.36 111.23 1upx n ILE 338 Ca 0.04 -0.85 0.00 0.00 -0.27 0.00 0.00 62.75 61.67 1upx n ILE 338 Cb 0.44 0.49 0.00 0.00 -1.74 0.00 0.00 39.64 38.83 1upx n ILE 338 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1upx n GLY 339 N -0.48 0.79 3.65 3.28 0.00 -1.26 -4.44 105.19 106.72 1upx n GLY 339 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1upx n GLY 339 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1upx s GLU 340 N -0.23 -0.14 0.06 1.61 0.41 -1.26 -4.88 118.70 114.27 1upx s GLU 340 Ca 0.00 0.32 -0.35 0.00 -0.41 0.00 0.00 54.97 54.53 1upx s GLU 340 Cb 0.00 -1.69 -0.15 0.00 -1.78 0.00 0.00 34.13 30.52 1upx s GLU 340 CO 0.00 -3.07 1.56 1.58 -0.49 0.00 0.00 175.26 174.84 1upx n HIS 341 N -4.38 2.02 -4.76 1.61 -0.00 -1.26 -4.97 115.22 103.49 1upx n HIS 341 Ca 0.07 0.37 -0.33 0.00 0.46 0.00 0.00 57.72 58.29 1upx n HIS 341 Cb 0.58 -2.49 -0.13 0.00 -0.12 0.00 0.00 29.99 27.84 1upx n HIS 341 CO 0.00 0.00 0.00 0.15 0.46 0.00 0.00 176.34 176.95 1upx s LYS 342 N 1.46 2.77 -0.49 1.57 1.02 -1.26 -5.02 119.74 119.79 1upx s LYS 342 Ca 0.84 -0.63 -0.19 0.00 0.02 0.00 0.00 55.97 56.01 1upx s LYS 342 Cb -0.80 -2.52 0.05 0.00 -0.52 0.00 0.00 37.83 34.04 1upx s LYS 342 CO 0.45 0.56 0.61 0.34 -0.92 0.00 0.00 175.35 176.40 1upx s ASP 343 N -0.56 6.24 -0.09 2.83 2.15 -1.26 -4.92 116.67 121.06 1upx s ASP 343 Ca 0.08 -0.81 0.14 0.00 0.43 0.00 0.00 52.55 52.39 1upx s ASP 343 Cb -0.12 -2.29 0.56 0.00 -0.30 0.00 0.00 42.92 40.78 1upx s ASP 343 CO 0.02 -0.85 1.43 0.49 -0.17 0.00 0.00 175.17 176.08 1upx n PHE 344 N 6.14 1.17 -0.34 -5.34 0.99 -1.26 -4.55 117.46 114.28 1upx n PHE 344 Ca -0.06 -0.46 0.01 0.00 -0.00 0.00 0.00 57.45 56.93 1upx n PHE 344 Cb 0.46 -0.21 0.14 0.00 -1.00 0.00 0.00 39.48 38.87 1upx n PHE 344 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.76 177.53 1upx h SER 345 N 3.16 0.97 -0.32 4.37 0.02 -1.97 -1.77 113.55 118.01 1upx h SER 345 Ca 0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.87 1upx h SER 345 Cb 1.20 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.52 1upx h SER 345 CO 0.19 0.64 -0.14 0.00 -1.14 0.00 0.00 176.83 176.38 1upx h ALA 346 N 1.41 0.45 -0.28 3.77 0.00 -2.00 -1.04 119.26 121.57 1upx h ALA 346 Ca 0.39 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1upx h ALA 346 Cb 0.09 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1upx h ALA 346 CO -0.15 0.35 -0.26 0.97 0.00 0.00 0.00 179.25 180.16 1upx h ILE 347 N 0.44 1.27 -0.35 0.00 2.10 -1.83 -1.48 117.51 117.65 1upx h ILE 347 Ca 0.07 -1.30 -0.04 0.00 1.08 0.00 0.00 64.86 64.67 1upx h ILE 347 Cb 0.66 1.34 -0.01 0.00 -1.09 0.00 0.00 36.82 37.72 1upx h ILE 347 CO 0.04 0.42 0.07 0.40 -1.08 0.00 0.00 178.15 178.00 1upx h ILE 348 N 0.47 1.23 -0.77 2.19 2.04 -1.17 -0.33 117.51 121.19 1upx h ILE 348 Ca 0.07 -0.82 0.01 0.00 1.00 0.00 0.00 64.86 65.12 1upx h ILE 348 Cb 0.70 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.82 1upx h ILE 348 CO 0.05 0.27 0.50 0.00 0.00 0.00 0.00 178.15 178.98 1upx h ALA 349 N 0.91 0.97 -0.45 1.87 0.00 -0.99 -2.08 119.26 119.50 1upx h ALA 349 Ca 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1upx h ALA 349 Cb 0.34 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1upx h ALA 349 CO 0.01 0.40 0.29 1.25 0.00 0.00 0.00 179.25 181.20 1upx h HIS 350 N 1.04 0.56 -0.72 0.00 -0.00 -1.09 -2.88 115.15 112.07 1upx h HIS 350 Ca 0.28 0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.68 1upx h HIS 350 Cb -0.11 -0.19 -0.04 0.00 -0.00 0.00 0.00 27.41 27.07 1upx h HIS 350 CO -0.02 0.36 0.47 0.00 -0.00 0.00 0.00 177.93 178.74 1upx h ALA 351 N 1.16 1.54 0.00 5.26 0.00 -0.40 -1.31 119.26 125.50 1upx h ALA 351 Ca 0.16 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1upx h ALA 351 Cb -0.06 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 1upx h ALA 351 CO -0.03 0.41 -0.02 0.87 0.00 0.00 0.00 179.25 180.48 1upx h LYS 352 N 0.92 0.00 -0.01 0.00 1.57 -1.18 -1.48 116.57 116.39 1upx h LYS 352 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1upx h LYS 352 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1upx h LYS 352 CO -0.07 0.02 -0.14 0.25 -0.57 0.00 0.00 179.45 178.95 1upx n THR 353 N -3.77 0.00 -3.85 -0.16 -2.24 -0.50 -4.94 114.28 98.82 1upx n THR 353 Ca -0.03 -0.18 -0.24 0.00 -2.27 0.00 0.00 64.05 61.33 1upx n THR 353 Cb 0.11 0.43 -0.02 0.00 -2.10 0.00 0.00 70.33 68.74 1upx n THR 353 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1upx s PRO 355 N -3.68 2.19 0.88 0.00 0.02 -1.26 -4.57 135.00 128.57 1upx s PRO 355 Ca 0.36 1.23 -0.11 0.00 0.02 0.00 0.00 61.00 62.49 1upx s PRO 355 Cb -0.10 -1.89 0.12 0.00 0.02 0.00 0.00 34.50 32.66 1upx s PRO 355 CO 0.30 -1.70 1.16 0.00 -0.33 0.00 0.00 177.00 176.42 1upx s ALA 356 N -2.82 1.62 0.52 -1.55 0.00 -1.26 -4.16 121.76 114.10 1upx s ALA 356 Ca 0.62 0.63 -0.22 0.00 0.00 0.00 0.00 51.96 52.99 1upx s ALA 356 Cb -0.18 -3.45 -0.06 0.00 0.00 0.00 0.00 23.12 19.44 1upx s ALA 356 CO 0.55 -2.57 1.32 -2.14 0.00 0.00 0.00 175.76 172.92 1upx s PRO 357 N -4.54 3.31 -0.11 0.00 0.02 -1.23 -4.76 135.00 127.68 1upx s PRO 357 Ca 0.68 2.16 -0.30 0.00 0.02 0.00 0.00 61.00 63.56 1upx s PRO 357 Cb -0.24 -2.32 -0.02 0.00 0.02 0.00 0.00 34.50 31.95 1upx s PRO 357 CO 0.56 -1.03 1.09 0.99 -0.33 0.00 0.00 177.00 178.28 1upx s THR 358 N -1.34 4.56 0.09 0.99 2.01 -0.64 -4.93 115.64 116.38 1upx s THR 358 Ca 0.69 1.85 -0.31 0.00 0.31 0.00 0.00 61.69 64.23 1upx s THR 358 Cb -0.38 -4.19 -0.07 0.00 0.01 0.00 0.00 72.50 67.86 1upx s THR 358 CO 0.46 -0.03 1.35 -0.70 -0.69 0.00 0.00 174.62 175.01 1upx s GLU 359 N 2.34 4.34 -0.01 4.92 2.12 -1.26 -4.74 118.70 126.41 1upx s GLU 359 Ca 0.51 2.00 0.05 0.00 0.36 0.00 0.00 54.97 57.89 1upx s GLU 359 Cb -0.20 -3.30 -0.07 0.00 0.26 0.00 0.00 34.13 30.81 1upx s GLU 359 CO 0.17 -0.41 0.14 0.44 -0.54 0.00 0.00 175.26 175.07 1upx n ILE 360 N 4.02 0.00 -3.90 -3.70 -5.35 -1.26 -5.06 119.36 104.11 1upx n ILE 360 Ca 0.11 -0.20 -0.09 0.00 -0.27 0.00 0.00 62.75 62.31 1upx n ILE 360 Cb 0.43 0.56 -0.04 0.00 -1.74 0.00 0.00 39.64 38.85 1upx n ILE 360 CO 0.00 0.00 0.00 -1.83 -1.76 0.00 0.00 176.55 172.96 1upx s GLU 361 N -2.10 1.55 0.12 6.28 -1.05 -1.26 -5.12 118.70 117.11 1upx s GLU 361 Ca -0.01 -1.09 -0.03 0.00 -0.15 0.00 0.00 54.97 53.70 1upx s GLU 361 Cb 0.03 0.51 -0.03 0.00 -0.44 0.00 0.00 34.13 34.21 1upx s GLU 361 CO 0.21 -0.66 0.09 -1.54 0.95 0.00 0.00 175.26 174.31 1upx s SER 362 N -2.96 0.29 0.00 0.83 1.04 -1.26 -3.57 113.70 108.07 1upx s SER 362 Ca 0.16 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.51 1upx s SER 362 Cb -0.02 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.41 1upx s SER 362 CO 0.05 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.15 1upx n GLY 363 N -0.07 0.22 3.17 7.32 0.00 -1.26 -4.81 105.19 109.75 1upx n GLY 363 Ca -0.08 -2.02 -0.08 0.00 0.00 0.00 0.00 46.02 43.84 1upx n GLY 363 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1upx s GLU 364 N 0.00 0.76 -0.09 1.61 -1.05 -1.26 -1.67 118.70 117.01 1upx s GLU 364 Ca 0.00 -0.99 0.03 0.00 -0.15 0.00 0.00 54.97 53.86 1upx s GLU 364 Cb 0.00 0.30 -0.01 0.00 -0.44 0.00 0.00 34.13 33.98 1upx s GLU 364 CO 0.00 -0.22 -0.20 0.42 0.95 0.00 0.00 175.26 176.22 1upx s ILE 365 N -3.73 2.51 -0.11 1.83 1.01 -0.12 -4.92 121.20 117.68 1upx s ILE 365 Ca 0.04 -0.88 -0.06 0.00 0.00 0.00 0.00 60.65 59.75 1upx s ILE 365 Cb 0.05 -1.98 -0.04 0.00 0.01 0.00 0.00 42.46 40.50 1upx s ILE 365 CO -0.10 0.56 0.12 -0.51 0.00 0.00 0.00 174.94 175.01 1upx s ILE 366 N 0.03 5.34 0.00 2.92 2.07 -1.26 -0.18 121.20 130.11 1upx s ILE 366 Ca -0.07 0.11 0.00 0.00 -1.41 0.00 0.00 60.65 59.28 1upx s ILE 366 Cb -0.15 -3.33 0.00 0.00 0.13 0.00 0.00 42.46 39.11 1upx s ILE 366 CO 0.05 0.59 0.00 0.61 -1.91 0.00 0.00 174.94 174.28 1upx n GLY 367 N 1.91 1.69 0.00 1.50 0.00 -0.57 -4.62 105.19 105.10 1upx n GLY 367 Ca -0.19 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 44.91 1upx n GLY 367 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1upx n GLY 368 N 0.00 1.31 2.49 -0.02 0.00 -0.52 -0.63 105.19 107.82 1upx n GLY 368 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1upx n GLY 368 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1upx n PHE 369 N -1.45 2.45 -1.60 1.61 3.01 -0.46 -3.43 117.46 117.59 1upx n PHE 369 Ca 0.00 -2.68 -0.14 0.00 1.01 0.00 0.00 57.45 55.65 1upx n PHE 369 Cb 0.00 -1.74 0.09 0.00 -0.01 0.00 0.00 39.48 37.82 1upx n PHE 369 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1upx n ALA 370 N 1.52 -0.59 -0.19 4.37 0.00 -1.26 -3.96 120.51 120.40 1upx n ALA 370 Ca 0.60 -0.85 -0.09 0.00 0.00 0.00 0.00 53.44 53.11 1upx n ALA 370 Cb 0.29 -0.01 0.01 0.00 0.00 0.00 0.00 19.45 19.75 1upx n ALA 370 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1upx h HIS 371 N -1.22 0.93 -0.60 0.00 2.07 -1.91 -1.24 115.15 113.18 1upx h HIS 371 Ca -0.20 -0.12 -0.02 0.00 -2.85 0.00 0.00 60.37 57.18 1upx h HIS 371 Cb 0.57 -0.26 -0.03 0.00 2.57 0.00 0.00 27.41 30.26 1upx h HIS 371 CO 0.00 0.83 0.29 -0.97 -3.07 0.00 0.00 177.93 175.01 1upx h ASN 372 N 0.77 0.78 -0.46 3.10 -0.73 -1.94 -0.91 115.58 116.19 1upx h ASN 372 Ca 0.16 -0.13 -0.14 0.00 1.87 0.00 0.00 56.30 58.07 1upx h ASN 372 Cb 0.39 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 38.76 1upx h ASN 372 CO 0.01 0.69 -0.26 -0.61 -0.37 0.00 0.00 177.43 176.89 1upx h GLN 373 N 0.82 0.98 -0.33 6.67 5.75 -1.64 -0.94 115.11 126.42 1upx h GLN 373 Ca 0.21 -0.44 -0.16 0.00 -0.15 0.00 0.00 58.65 58.11 1upx h GLN 373 Cb 0.11 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.63 1upx h GLN 373 CO -0.03 1.11 -0.42 0.28 -2.65 0.00 0.00 178.83 177.13 1upx h VAL 374 N 0.84 1.28 -0.06 2.39 2.07 -1.10 -2.45 116.25 119.22 1upx h VAL 374 Ca 0.10 -1.60 -0.07 0.00 0.82 0.00 0.00 66.70 65.95 1upx h VAL 374 Cb 0.84 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 1upx h VAL 374 CO 0.07 0.52 -0.31 -0.07 0.02 0.00 0.00 177.57 177.81 1upx h LEU 375 N 0.67 0.10 -1.57 2.57 4.07 -1.01 -1.44 115.31 118.70 1upx h LEU 375 Ca 0.05 -0.03 -0.02 0.00 0.08 0.00 0.00 57.88 57.95 1upx h LEU 375 Cb 0.99 -0.03 -0.00 0.00 1.08 0.00 0.00 40.66 42.70 1upx h LEU 375 CO 0.10 0.41 -0.10 0.00 -1.08 0.00 0.00 178.44 177.76 1upx h ALA 376 N 1.60 1.07 -0.60 1.53 0.00 -0.86 -2.25 119.26 119.75 1upx h ALA 376 Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1upx h ALA 376 Cb 0.59 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1upx h ALA 376 CO 0.04 0.13 0.00 1.28 0.00 0.00 0.00 179.25 180.70 1upx n LEU 377 N -3.31 4.82 -0.26 0.00 4.77 -0.59 -4.73 117.00 117.69 1upx n LEU 377 Ca -0.00 -2.55 0.04 0.00 -0.03 0.00 0.00 56.01 53.46 1upx n LEU 377 Cb 0.31 -0.58 0.27 0.00 -2.33 0.00 0.00 43.42 41.09 1upx n LEU 377 CO 0.29 0.77 1.24 0.00 -1.33 0.00 0.00 177.39 178.37 1upx h ALA 378 N 3.84 1.55 -0.79 -1.18 0.00 -0.85 -1.18 119.26 120.65 1upx h ALA 378 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1upx h ALA 378 Cb 1.52 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 19.01 1upx h ALA 378 CO 0.27 0.34 0.45 0.38 0.00 0.00 0.00 179.25 180.69 1upx h ASP 379 N 0.96 0.97 -0.33 0.00 2.03 -1.84 0.19 116.42 118.40 1upx h ASP 379 Ca 0.35 -0.08 -0.08 0.00 -0.73 0.00 0.00 57.03 56.49 1upx h ASP 379 Cb 0.15 -0.25 -0.01 0.00 -0.83 0.00 0.00 39.33 38.40 1upx h ASP 379 CO -0.12 0.77 -0.10 0.11 -1.03 0.00 0.00 179.24 178.88 1upx h LYS 380 N 1.09 0.65 -0.11 4.15 1.79 -1.63 -1.15 116.57 121.37 1upx h LYS 380 Ca 0.28 -0.26 -0.02 0.00 -2.18 0.00 0.00 60.65 58.47 1upx h LYS 380 Cb -0.00 -0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 30.61 1upx h LYS 380 CO -0.05 0.84 -0.03 0.28 -1.08 0.00 0.00 179.45 179.41 1upx h VAL 381 N 0.43 1.29 -0.55 0.50 2.07 -1.02 -2.06 116.25 116.91 1upx h VAL 381 Ca 0.08 -0.96 -0.04 0.00 0.82 0.00 0.00 66.70 66.61 1upx h VAL 381 Cb 0.61 1.71 -0.02 0.00 -1.52 0.00 0.00 31.29 32.07 1upx h VAL 381 CO 0.04 0.27 0.20 0.40 0.02 0.00 0.00 177.57 178.49 1upx h ILE 382 N -0.11 1.23 -0.84 4.57 2.04 -0.66 -1.45 117.51 122.28 1upx h ILE 382 Ca 0.03 -0.74 0.08 0.00 1.00 0.00 0.00 64.86 65.23 1upx h ILE 382 Cb 0.44 0.68 -0.07 0.00 -0.74 0.00 0.00 36.82 37.14 1upx h ILE 382 CO 0.01 0.28 0.50 0.44 0.00 0.00 0.00 178.15 179.38 1upx h ASP 383 N 0.75 0.74 -0.14 1.72 3.32 -1.18 0.02 116.42 121.65 1upx h ASP 383 Ca 0.18 0.03 -0.13 0.00 0.02 0.00 0.00 57.03 57.14 1upx h ASP 383 Cb 0.24 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1upx h ASP 383 CO -0.01 0.45 -0.34 0.00 -1.72 0.00 0.00 179.24 177.62 1upx h ALA 384 N 1.43 0.85 -0.29 3.45 0.00 -0.80 -1.04 119.26 122.86 1upx h ALA 384 Ca 0.39 -0.41 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1upx h ALA 384 Cb 0.28 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1upx h ALA 384 CO -0.21 0.64 -0.29 0.28 0.00 0.00 0.00 179.25 179.66 1upx h VAL 385 N 0.55 1.30 -0.26 0.00 2.07 -0.87 -0.82 116.25 118.22 1upx h VAL 385 Ca 0.06 -1.46 -0.09 0.00 0.82 0.00 0.00 66.70 66.03 1upx h VAL 385 Cb 0.85 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 1upx h VAL 385 CO 0.07 0.47 -0.23 0.11 0.02 0.00 0.00 177.57 178.01 1upx h LYS 386 N 0.46 0.48 0.00 1.57 1.57 -0.82 -2.79 116.57 117.03 1upx h LYS 386 Ca 0.05 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1upx h LYS 386 Cb 0.86 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.14 1upx h LYS 386 CO 0.07 0.68 -0.22 -1.13 -0.57 0.00 0.00 179.45 178.28 1upx n SER 387 N -4.14 0.78 0.00 0.86 3.41 -0.41 -4.93 113.62 109.20 1upx n SER 387 Ca -0.00 0.41 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 1upx n SER 387 Cb 0.39 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 63.88 1upx n SER 387 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1upx n GLY 388 N 1.32 0.81 0.36 5.00 0.00 -0.96 -4.94 105.19 106.78 1upx n GLY 388 Ca 0.05 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.13 1upx n GLY 388 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1upx h ALA 389 N 0.00 1.63 -3.23 4.61 0.00 -1.46 -3.33 119.26 117.49 1upx h ALA 389 Ca 0.00 -0.02 -0.67 0.00 0.00 0.00 0.00 54.91 54.22 1upx h ALA 389 Cb 0.00 -0.22 -0.30 0.00 0.00 0.00 0.00 17.79 17.27 1upx h ALA 389 CO 0.00 0.23 -0.71 0.42 0.00 0.00 0.00 179.25 179.19 1upx s ILE 390 N -5.77 3.17 -0.11 0.00 1.01 -0.65 -4.58 121.20 114.27 1upx s ILE 390 Ca -0.10 -0.97 0.16 0.00 0.00 0.00 0.00 60.65 59.73 1upx s ILE 390 Cb 0.20 -2.64 -0.22 0.00 0.01 0.00 0.00 42.46 39.82 1upx s ILE 390 CO 0.79 0.14 0.54 0.29 0.00 0.00 0.00 174.94 176.69 1upx n LYS 391 N 4.72 0.65 -3.73 2.79 4.76 0.97 -4.31 118.16 124.00 1upx n LYS 391 Ca -0.16 0.17 -0.14 0.00 -2.87 0.00 0.00 58.31 55.32 1upx n LYS 391 Cb 0.47 -1.71 -0.09 0.00 -1.84 0.00 0.00 35.03 31.86 1upx n LYS 391 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1upx s LYS 392 N -2.71 0.64 -0.05 1.97 1.02 -1.23 -4.85 119.74 114.52 1upx s LYS 392 Ca -0.06 0.08 -0.03 0.00 0.02 0.00 0.00 55.97 55.98 1upx s LYS 392 Cb 0.08 0.29 -0.04 0.00 -0.52 0.00 0.00 37.83 37.64 1upx s LYS 392 CO 0.83 -0.16 0.10 -0.06 -0.92 0.00 0.00 175.35 175.14 1upx s PHE 393 N -0.84 3.40 -0.23 3.18 0.40 -0.18 -1.60 117.98 122.11 1upx s PHE 393 Ca -0.09 0.32 0.01 0.00 -0.60 0.00 0.00 56.93 56.57 1upx s PHE 393 Cb -0.04 -1.82 0.06 0.00 0.51 0.00 0.00 43.02 41.73 1upx s PHE 393 CO 0.04 0.61 -0.06 0.08 0.70 0.00 0.00 175.22 176.58 1upx s VAL 394 N -1.12 1.61 -0.36 -0.44 1.01 0.25 -1.12 120.40 120.24 1upx s VAL 394 Ca 0.20 -1.25 -0.29 0.00 0.00 0.00 0.00 61.98 60.64 1upx s VAL 394 Cb -0.12 -1.84 0.01 0.00 0.00 0.00 0.00 36.38 34.43 1upx s VAL 394 CO 0.10 -0.07 1.25 -0.69 0.00 0.00 0.00 175.10 175.70 1upx s VAL 395 N 1.36 4.16 -0.19 2.92 1.01 0.26 -0.64 120.40 129.28 1upx s VAL 395 Ca -0.06 1.27 0.14 0.00 0.00 0.00 0.00 61.98 63.33 1upx s VAL 395 Cb -0.19 -4.30 0.40 0.00 0.00 0.00 0.00 36.38 32.29 1upx s VAL 395 CO -0.06 -0.64 1.25 0.23 0.00 0.00 0.00 175.10 175.87 1upx n MET 396 N 7.51 1.61 -0.46 2.72 2.81 -0.15 -0.58 117.12 130.57 1upx n MET 396 Ca 0.14 -3.04 -0.19 0.00 -1.81 0.00 0.00 57.70 52.81 1upx n MET 396 Cb 0.47 -1.63 0.17 0.00 -0.71 0.00 0.00 33.22 31.52 1upx n MET 396 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1upx n ALA 397 N -1.18 -2.54 0.00 3.04 0.00 -1.24 -4.53 120.51 114.06 1upx n ALA 397 Ca 0.20 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.65 1upx n ALA 397 Cb 0.74 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 20.11 1upx n ALA 397 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1upx n GLY 398 N -2.59 -0.34 3.17 0.00 0.00 -0.67 -2.35 105.19 102.41 1upx n GLY 398 Ca 0.09 -2.02 -0.25 0.00 0.00 0.00 0.00 46.02 43.84 1upx n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1upx s ASP 400 N -0.49 3.70 0.16 0.00 2.15 -1.26 -3.40 116.67 117.53 1upx s ASP 400 Ca 0.07 0.21 -0.15 0.00 0.43 0.00 0.00 52.55 53.11 1upx s ASP 400 Cb -0.07 -0.44 0.05 0.00 -0.30 0.00 0.00 42.92 42.17 1upx s ASP 400 CO -0.00 -2.35 0.72 0.61 -0.17 0.00 0.00 175.17 173.98 1upx n GLY 401 N -3.44 0.88 0.17 2.66 0.00 -1.26 -4.66 105.19 99.54 1upx n GLY 401 Ca 0.14 -1.11 -0.04 0.00 0.00 0.00 0.00 46.02 45.01 1upx n GLY 401 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1upx h ARG 402 N 0.00 0.21 -6.42 1.61 3.08 -1.99 -3.47 114.38 107.39 1upx h ARG 402 Ca -0.21 -0.13 -0.61 0.00 0.07 0.00 0.00 59.98 59.10 1upx h ARG 402 Cb 0.88 0.01 0.05 0.00 0.08 0.00 0.00 29.97 30.99 1upx h ARG 402 CO 0.27 0.71 0.78 0.00 -1.07 0.00 0.00 179.97 180.66 1upx n ALA 403 N -2.47 0.80 0.29 0.04 0.00 -1.26 -4.83 120.51 113.08 1upx n ALA 403 Ca -0.02 0.44 0.16 0.00 0.00 0.00 0.00 53.44 54.02 1upx n ALA 403 Cb 0.58 -2.31 0.85 0.00 0.00 0.00 0.00 19.45 18.57 1upx n ALA 403 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1upx h LYS 404 N 6.15 0.00 -0.01 0.00 2.10 -2.05 -0.92 116.57 121.84 1upx h LYS 404 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 1upx h LYS 404 Cb 1.27 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.60 1upx h LYS 404 CO 0.88 0.06 0.10 0.66 -2.00 0.00 0.00 179.45 179.15 1upx h SER 405 N 0.00 0.00 0.39 7.07 4.64 -1.99 -2.30 113.55 121.36 1upx h SER 405 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1upx h SER 405 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1upx h SER 405 CO 0.01 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.51 1upx n ARG 406 N -3.13 0.19 0.04 4.77 1.74 -0.35 -1.59 116.66 118.34 1upx n ARG 406 Ca -0.02 0.14 0.22 0.00 -0.77 0.00 0.00 57.85 57.41 1upx n ARG 406 Cb 0.17 -1.50 0.73 0.00 -1.02 0.00 0.00 32.46 30.84 1upx n ARG 406 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1upx h SER 407 N 0.00 0.00 -0.88 0.55 4.64 -1.63 -0.85 113.55 115.39 1upx h SER 407 Ca 0.00 0.00 0.23 0.00 -0.47 0.00 0.00 61.79 61.55 1upx h SER 407 Cb 0.20 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.14 1upx h SER 407 CO 0.00 0.00 0.12 0.22 -0.87 0.00 0.00 176.83 176.30 1upx h TYR 408 N 0.00 0.14 -0.30 4.77 3.20 -1.55 -0.96 116.97 122.27 1upx h TYR 408 Ca 0.24 0.06 -0.13 0.00 3.14 0.00 0.00 58.73 62.03 1upx h TYR 408 Cb 1.23 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.56 1upx h TYR 408 CO 0.00 -0.28 -0.36 1.88 -1.64 0.00 0.00 178.16 177.76 1upx h TYR 409 N 0.12 0.80 -0.17 -3.82 -1.99 -1.40 0.23 116.97 110.74 1upx h TYR 409 Ca 0.53 -0.22 -0.01 0.00 2.00 0.00 0.00 58.73 61.03 1upx h TYR 409 Cb 1.06 -0.18 -0.01 0.00 2.00 0.00 0.00 36.73 39.60 1upx h TYR 409 CO -0.36 0.94 0.05 1.15 -0.00 0.00 0.00 178.16 179.94 1upx h THR 410 N 0.57 1.19 -0.41 -2.88 2.02 -1.50 -1.52 112.91 110.37 1upx h THR 410 Ca 0.06 -0.59 -0.12 0.00 0.77 0.00 0.00 66.41 66.53 1upx h THR 410 Cb 0.87 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.52 1upx h THR 410 CO 0.08 0.18 -0.22 0.44 0.37 0.00 0.00 175.52 176.36 1upx h ASP 411 N 0.10 0.85 -0.14 4.18 3.32 -0.96 -1.20 116.42 122.56 1upx h ASP 411 Ca 0.06 -0.31 -0.00 0.00 0.02 0.00 0.00 57.03 56.79 1upx h ASP 411 Cb 0.23 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1upx h ASP 411 CO -0.00 1.04 0.09 0.15 -1.72 0.00 0.00 179.24 178.80 1upx h PHE 412 N 0.72 0.19 -0.59 4.55 3.57 -0.54 -0.72 116.94 124.13 1upx h PHE 412 Ca 0.10 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.63 1upx h PHE 412 Cb 0.75 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.39 1upx h PHE 412 CO 0.04 0.16 0.35 0.00 -2.23 0.00 0.00 178.31 176.64 1upx h ALA 413 N 1.01 0.76 0.00 2.41 0.00 -0.99 -1.95 119.26 120.50 1upx h ALA 413 Ca 0.05 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1upx h ALA 413 Cb 0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1upx h ALA 413 CO -0.01 0.08 -0.28 0.93 0.00 0.00 0.00 179.25 179.96 1upx h GLU 414 N 0.69 0.00 -0.00 0.00 5.08 -1.06 -2.92 114.58 116.37 1upx h GLU 414 Ca 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 1upx h GLU 414 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1upx h GLU 414 CO -0.11 0.28 -0.38 0.41 -1.00 0.00 0.00 179.01 178.21 1upx n GLY 415 N 0.07 -1.09 3.76 -3.84 0.00 -0.29 -4.94 105.19 98.86 1upx n GLY 415 Ca -0.00 -0.34 -0.38 0.00 0.00 0.00 0.00 46.02 45.29 1upx n GLY 415 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1upx s LEU 416 N -2.84 3.95 0.65 0.99 1.43 -0.78 -4.96 118.68 117.11 1upx s LEU 416 Ca 0.16 2.67 -0.17 0.00 -1.03 0.00 0.00 54.13 55.75 1upx s LEU 416 Cb 0.18 -4.20 -0.02 0.00 0.03 0.00 0.00 46.19 42.18 1upx s LEU 416 CO 0.63 -1.32 1.05 -2.65 0.23 0.00 0.00 176.35 174.29 1upx n PRO 417 N -0.72 0.82 0.22 1.29 -0.02 -1.26 -4.87 135.00 130.46 1upx n PRO 417 Ca 0.09 0.33 0.16 0.00 -2.02 0.00 0.00 63.50 62.05 1upx n PRO 417 Cb 0.45 -2.28 0.74 0.00 -0.02 0.00 0.00 33.50 32.39 1upx n PRO 417 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1upx h LYS 418 N 0.26 0.00 -1.00 -0.52 1.57 -1.98 -2.59 116.57 112.30 1upx h LYS 418 Ca -0.49 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 57.79 1upx h LYS 418 Cb 1.35 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 33.37 1upx h LYS 418 CO 0.50 0.00 0.63 -0.40 -0.57 0.00 0.00 179.45 179.61 1upx n ASP 419 N -2.65 3.87 -4.38 0.86 5.68 -1.26 -4.92 116.55 113.76 1upx n ASP 419 Ca -0.00 -3.53 -0.25 0.00 -0.50 0.00 0.00 54.79 50.50 1upx n ASP 419 Cb 0.16 -0.83 -0.12 0.00 -1.14 0.00 0.00 41.12 39.19 1upx n ASP 419 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1upx s THR 420 N -3.18 2.12 -0.06 2.12 -4.23 -0.98 -0.02 115.64 111.41 1upx s THR 420 Ca 0.54 -1.91 0.04 0.00 -1.18 0.00 0.00 61.69 59.18 1upx s THR 420 Cb 0.45 -1.97 -0.00 0.00 1.34 0.00 0.00 72.50 72.33 1upx s THR 420 CO 0.10 -0.14 -0.19 -0.69 -0.54 0.00 0.00 174.62 173.16 1upx s VAL 421 N -1.64 1.63 -0.08 2.29 1.01 -0.62 -4.87 120.40 118.10 1upx s VAL 421 Ca 0.17 -0.80 -0.22 0.00 0.00 0.00 0.00 61.98 61.14 1upx s VAL 421 Cb -0.08 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 1upx s VAL 421 CO 0.08 0.46 0.62 -0.63 0.00 0.00 0.00 175.10 175.63 1upx s ILE 422 N 0.22 5.10 -0.20 2.22 1.01 0.63 -0.58 121.20 129.59 1upx s ILE 422 Ca -0.10 1.27 -0.07 0.00 0.00 0.00 0.00 60.65 61.74 1upx s ILE 422 Cb -0.14 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 1upx s ILE 422 CO 0.04 0.28 0.06 -0.76 0.00 0.00 0.00 174.94 174.57 1upx s LEU 423 N 0.72 3.71 0.16 2.97 1.43 0.19 -0.41 118.68 127.44 1upx s LEU 423 Ca 0.33 0.01 -0.00 0.00 -1.03 0.00 0.00 54.13 53.44 1upx s LEU 423 Cb -0.17 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 1upx s LEU 423 CO 0.15 0.12 0.05 0.28 0.23 0.00 0.00 176.35 177.19 1upx s THR 424 N 0.66 0.30 -0.24 5.49 -1.32 -0.26 -0.98 115.64 119.29 1upx s THR 424 Ca 0.03 -1.94 -0.28 0.00 -1.21 0.00 0.00 61.69 58.29 1upx s THR 424 Cb -0.13 -2.14 0.15 0.00 -1.51 0.00 0.00 72.50 68.87 1upx s THR 424 CO 0.02 -0.40 1.15 0.00 -2.21 0.00 0.00 174.62 173.18 1upx s ALA 425 N -3.92 -2.03 0.00 11.08 0.00 -1.26 -0.81 121.76 124.82 1upx s ALA 425 Ca 0.26 1.74 0.00 0.00 0.00 0.00 0.00 51.96 53.96 1upx s ALA 425 Cb 0.07 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.93 1upx s ALA 425 CO 0.04 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 175.97 1upx n GLY 426 N 1.27 -1.36 0.00 0.00 0.00 -0.46 -1.66 105.19 102.98 1upx n GLY 426 Ca -0.09 -1.59 0.10 0.00 0.00 0.00 0.00 46.02 44.45 1upx n GLY 426 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1upx h ALA 428 N 2.92 2.94 -0.73 0.00 0.00 -1.70 -1.97 119.26 120.72 1upx h ALA 428 Ca 0.00 -0.03 0.21 0.00 0.00 0.00 0.00 54.91 55.09 1upx h ALA 428 Cb 0.26 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1upx h ALA 428 CO 0.00 -1.25 0.60 1.57 0.00 0.00 0.00 179.25 180.17 1upx h LYS 429 N 0.00 0.00 0.00 0.00 2.10 -1.67 -2.45 116.57 114.55 1upx h LYS 429 Ca 0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.12 1upx h LYS 429 Cb 1.93 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.26 1upx h LYS 429 CO -0.00 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.11 1upx n TYR 430 N -4.05 0.35 0.52 0.07 4.02 -0.74 -1.06 117.16 116.28 1upx n TYR 430 Ca 0.15 0.13 0.12 0.00 -0.01 0.00 0.00 57.90 58.29 1upx n TYR 430 Cb 0.86 -0.71 0.46 0.00 -0.02 0.00 0.00 39.34 39.93 1upx n TYR 430 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1upx n ARG 431 N -1.81 0.18 -0.11 -0.72 5.12 -0.92 -4.27 116.66 114.12 1upx n ARG 431 Ca 0.04 0.31 0.00 0.00 -1.93 0.00 0.00 57.85 56.27 1upx n ARG 431 Cb 0.24 -1.79 0.00 0.00 -1.16 0.00 0.00 32.46 29.75 1upx n ARG 431 CO 0.00 0.00 0.00 2.48 -1.93 0.00 0.00 177.63 178.18 1upx n TYR 432 N -2.12 0.00 0.95 -1.55 0.18 -0.63 -3.98 117.16 110.00 1upx n TYR 432 Ca 0.04 0.00 0.11 0.00 1.88 0.00 0.00 57.90 59.92 1upx n TYR 432 Cb 0.29 0.09 0.31 0.00 -0.38 0.00 0.00 39.34 39.66 1upx n TYR 432 CO 0.00 0.00 0.00 0.27 -2.08 0.00 0.00 176.86 175.05 1upx n ASN 433 N 0.00 2.20 -1.36 9.48 6.94 -0.22 -3.88 115.26 128.42 1upx n ASN 433 Ca 0.00 -1.81 -0.01 0.00 -0.02 0.00 0.00 54.58 52.74 1upx n ASN 433 Cb 0.52 -0.15 0.11 0.00 -2.36 0.00 0.00 39.78 37.90 1upx n ASN 433 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1upx n LYS 434 N 0.68 1.61 -2.16 -3.83 5.02 -1.26 -4.86 118.16 113.36 1upx n LYS 434 Ca 0.17 -3.18 -0.12 0.00 -2.02 0.00 0.00 58.31 53.16 1upx n LYS 434 Cb 0.41 -1.34 0.04 0.00 -0.02 0.00 0.00 35.03 34.12 1upx n LYS 434 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1upx n LEU 435 N -0.57 0.00 -3.40 -0.35 4.77 -1.25 -5.07 117.00 111.13 1upx n LEU 435 Ca 0.19 -1.49 -0.27 0.00 -0.03 0.00 0.00 56.01 54.42 1upx n LEU 435 Cb 0.87 -0.26 -0.08 0.00 -2.33 0.00 0.00 43.42 41.62 1upx n LEU 435 CO 0.06 -0.64 0.04 -3.20 -1.33 0.00 0.00 177.39 172.32 1upx n ASN 436 N -2.62 3.37 0.05 -1.43 4.05 -1.26 -4.84 115.26 112.57 1upx n ASN 436 Ca 0.10 -3.36 0.11 0.00 0.45 0.00 0.00 54.58 51.88 1upx n ASN 436 Cb 0.36 -0.67 0.04 0.00 1.23 0.00 0.00 39.78 40.74 1upx n ASN 436 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1upx n LEU 437 N 0.91 0.64 0.00 1.20 4.77 -1.26 -5.06 117.00 118.21 1upx n LEU 437 Ca 0.29 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 1upx n LEU 437 Cb 0.42 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 1upx n LEU 437 CO 0.38 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1upx n GLY 438 N 1.32 -0.37 3.20 -0.72 0.00 -1.26 -4.78 105.19 102.58 1upx n GLY 438 Ca 0.01 -1.09 -0.09 0.00 0.00 0.00 0.00 46.02 44.85 1upx n GLY 438 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1upx s ASP 439 N -4.00 0.24 -0.32 1.61 -4.77 -1.26 -1.49 116.67 106.68 1upx s ASP 439 Ca 0.00 -1.06 0.03 0.00 -3.30 0.00 0.00 52.55 48.22 1upx s ASP 439 Cb 0.00 0.33 0.09 0.00 -1.09 0.00 0.00 42.92 42.25 1upx s ASP 439 CO 0.00 -0.76 0.01 -0.63 0.70 0.00 0.00 175.17 174.48 1upx s ILE 440 N -4.00 2.34 -1.46 2.11 1.01 0.67 -4.72 121.20 117.15 1upx s ILE 440 Ca 0.19 -2.05 -0.11 0.00 0.00 0.00 0.00 60.65 58.68 1upx s ILE 440 Cb 0.06 -2.59 0.07 0.00 0.01 0.00 0.00 42.46 40.00 1upx s ILE 440 CO -0.01 -0.40 0.78 0.61 0.00 0.00 0.00 174.94 175.93 1upx n GLY 441 N 4.35 -0.50 0.99 6.18 0.00 -1.26 -1.54 105.19 113.41 1upx n GLY 441 Ca -0.03 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1upx n GLY 441 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1upx n GLY 442 N -1.52 2.30 3.61 -0.02 0.00 -1.26 -5.03 105.19 103.26 1upx n GLY 442 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1upx n GLY 442 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1upx s ILE 443 N -2.38 4.62 0.54 -0.61 1.01 -0.59 -5.02 121.20 118.78 1upx s ILE 443 Ca 0.00 1.24 -0.21 0.00 0.00 0.00 0.00 60.65 61.67 1upx s ILE 443 Cb 0.00 -4.30 -0.06 0.00 0.01 0.00 0.00 42.46 38.11 1upx s ILE 443 CO 0.00 -0.47 1.24 -2.65 0.00 0.00 0.00 174.94 173.06 1upx n PRO 444 N 6.66 1.50 0.00 2.79 -0.02 -1.26 -0.24 135.00 144.42 1upx n PRO 444 Ca 0.07 0.55 0.14 0.00 -2.02 0.00 0.00 63.50 62.24 1upx n PRO 444 Cb 0.48 -2.43 0.67 0.00 -0.02 0.00 0.00 33.50 32.21 1upx n PRO 444 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1upx n ARG 445 N -0.85 0.20 -4.05 -0.52 1.74 -0.56 -4.38 116.66 108.25 1upx n ARG 445 Ca 0.11 0.01 -0.31 0.00 -0.77 0.00 0.00 57.85 56.89 1upx n ARG 445 Cb 0.44 -1.50 -0.16 0.00 -1.02 0.00 0.00 32.46 30.22 1upx n ARG 445 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1upx s VAL 446 N -2.79 1.74 -0.35 1.55 1.01 -1.26 -0.27 120.40 120.03 1upx s VAL 446 Ca 0.21 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 1upx s VAL 446 Cb 0.19 -1.62 0.06 0.00 0.00 0.00 0.00 36.38 35.02 1upx s VAL 446 CO 0.49 0.46 0.11 -0.76 0.00 0.00 0.00 175.10 175.40 1upx s LEU 447 N 1.42 4.47 -0.44 3.92 1.43 0.45 -4.94 118.68 124.98 1upx s LEU 447 Ca 0.05 -1.41 -0.20 0.00 -1.03 0.00 0.00 54.13 51.54 1upx s LEU 447 Cb -0.13 -1.82 0.03 0.00 0.03 0.00 0.00 46.19 44.29 1upx s LEU 447 CO -0.11 -0.37 0.59 -0.62 0.23 0.00 0.00 176.35 176.06 1upx s ASP 448 N 1.53 6.28 0.31 2.29 2.15 -1.26 -1.10 116.67 126.86 1upx s ASP 448 Ca -0.00 -0.50 0.24 0.00 0.43 0.00 0.00 52.55 52.73 1upx s ASP 448 Cb -0.21 -2.29 0.54 0.00 -0.30 0.00 0.00 42.92 40.66 1upx s ASP 448 CO -0.00 -0.74 1.65 0.00 -0.17 0.00 0.00 175.17 175.91 1upx h ALA 449 N 8.85 0.96 0.00 3.66 0.00 -1.10 -0.89 119.26 130.74 1upx h ALA 449 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1upx h ALA 449 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1upx h ALA 449 CO 0.87 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.53 1upx n GLY 450 N 1.21 0.45 3.88 0.00 0.00 -1.26 -4.14 105.19 105.34 1upx n GLY 450 Ca 0.05 -1.22 -0.29 0.00 0.00 0.00 0.00 46.02 44.55 1upx n GLY 450 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1upx s GLN 451 N -0.72 1.34 0.38 1.61 -0.21 -1.26 -1.35 119.66 119.45 1upx s GLN 451 Ca 0.00 -0.03 0.10 0.00 0.02 0.00 0.00 55.36 55.44 1upx s GLN 451 Cb 0.00 -1.89 0.86 0.00 1.00 0.00 0.00 33.01 32.97 1upx s GLN 451 CO 0.00 -2.00 1.92 0.00 -2.12 0.00 0.00 175.29 173.09 1upx h ASN 453 N 0.63 0.00 0.00 0.00 -1.07 -1.94 -1.01 115.58 112.19 1upx h ASN 453 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.74 1upx h ASN 453 Cb 0.57 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.82 1upx h ASN 453 CO -0.14 0.05 0.00 0.47 0.07 0.00 0.00 177.43 177.88 1upx n ASP 454 N -3.90 0.00 -0.17 6.14 8.00 0.10 -1.76 116.55 124.96 1upx n ASP 454 Ca -0.03 -1.20 0.28 0.00 0.71 0.00 0.00 54.79 54.55 1upx n ASP 454 Cb 0.14 0.00 0.72 0.00 -0.02 0.00 0.00 41.12 41.96 1upx n ASP 454 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 1upx h SER 455 N 0.00 0.00 -0.37 -2.24 4.64 -1.22 -0.89 113.55 113.46 1upx h SER 455 Ca 0.00 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.39 1upx h SER 455 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.02 1upx h SER 455 CO 0.00 0.00 -0.07 0.22 -0.87 0.00 0.00 176.83 176.11 1upx h TYR 456 N 0.00 -0.15 -0.98 4.77 3.20 -1.58 -1.14 116.97 121.10 1upx h TYR 456 Ca 0.42 0.03 0.10 0.00 3.14 0.00 0.00 58.73 62.42 1upx h TYR 456 Cb 1.69 0.12 -0.08 0.00 1.54 0.00 0.00 36.73 40.00 1upx h TYR 456 CO 0.00 -0.14 0.63 0.77 -1.64 0.00 0.00 178.16 177.78 1upx h SER 457 N 0.03 0.93 -0.68 -2.11 0.02 -1.40 -0.00 113.55 110.33 1upx h SER 457 Ca 0.18 0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 61.10 1upx h SER 457 Cb 0.27 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 1upx h SER 457 CO -0.36 0.54 0.17 -0.07 -1.14 0.00 0.00 176.83 175.96 1upx h LEU 458 N 1.02 1.04 -0.49 5.07 3.38 -1.17 0.58 115.31 124.73 1upx h LEU 458 Ca 0.46 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 1upx h LEU 458 Cb 0.39 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1upx h LEU 458 CO -0.22 1.00 0.18 0.00 0.09 0.00 0.00 178.44 179.49 1upx h ALA 459 N 1.07 0.64 -0.64 1.53 0.00 -0.57 -0.96 119.26 120.34 1upx h ALA 459 Ca 0.21 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1upx h ALA 459 Cb 0.37 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1upx h ALA 459 CO 0.00 0.27 0.35 0.28 0.00 0.00 0.00 179.25 180.16 1upx h VAL 460 N 0.66 1.20 -0.36 0.00 2.07 -0.65 -0.08 116.25 119.09 1upx h VAL 460 Ca 0.16 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 1upx h VAL 460 Cb 0.23 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 1upx h VAL 460 CO -0.01 0.22 0.14 0.40 0.02 0.00 0.00 177.57 178.34 1upx h ILE 461 N 0.87 1.20 -0.55 4.57 2.04 -0.74 0.00 117.51 124.91 1upx h ILE 461 Ca 0.23 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1upx h ILE 461 Cb 0.04 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 1upx h ILE 461 CO -0.04 0.22 0.31 0.00 0.00 0.00 0.00 178.15 178.64 1upx h ALA 462 N 0.98 0.70 -0.12 1.87 0.00 -0.89 0.09 119.26 121.89 1upx h ALA 462 Ca 0.12 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1upx h ALA 462 Cb 0.21 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1upx h ALA 462 CO -0.01 0.20 -0.31 -0.07 0.00 0.00 0.00 179.25 179.07 1upx h LEU 463 N 0.73 0.23 -0.31 0.00 3.38 -0.82 -0.35 115.31 118.18 1upx h LEU 463 Ca 0.19 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 1upx h LEU 463 Cb 0.02 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1upx h LEU 463 CO -0.03 0.54 -0.19 0.50 0.09 0.00 0.00 178.44 179.35 1upx h LYS 464 N 0.20 0.68 -0.52 1.13 1.63 -0.56 -2.56 116.57 116.58 1upx h LYS 464 Ca 0.03 -0.31 -0.06 0.00 -0.85 0.00 0.00 60.65 59.45 1upx h LYS 464 Cb 0.65 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 32.24 1upx h LYS 464 CO 0.05 0.91 0.07 -0.07 -3.45 0.00 0.00 179.45 176.96 1upx h LEU 465 N 0.44 0.77 -0.67 5.20 3.38 -0.59 -0.11 115.31 123.74 1upx h LEU 465 Ca 0.07 -0.16 0.07 0.00 0.09 0.00 0.00 57.88 57.95 1upx h LEU 465 Cb 0.73 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.21 1upx h LEU 465 CO 0.05 0.79 0.35 0.50 0.09 0.00 0.00 178.44 180.23 1upx h LYS 466 N 0.78 0.61 -0.19 1.13 3.64 -0.94 -1.22 116.57 120.37 1upx h LYS 466 Ca 0.16 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.46 1upx h LYS 466 Cb 0.37 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1upx h LYS 466 CO 0.01 0.40 -0.07 1.49 -2.27 0.00 0.00 179.45 179.01 1upx h GLU 467 N 0.63 0.38 -0.77 1.90 4.81 -0.98 -0.79 114.58 119.75 1upx h GLU 467 Ca 0.31 -0.16 0.05 0.00 -0.13 0.00 0.00 59.36 59.43 1upx h GLU 467 Cb 0.26 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.56 1upx h GLU 467 CO -0.22 0.66 0.47 0.28 -0.73 0.00 0.00 179.01 179.47 1upx h VAL 468 N 0.09 1.05 -0.17 0.32 2.07 -0.67 -2.18 116.25 116.75 1upx h VAL 468 Ca 0.05 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.26 1upx h VAL 468 Cb 0.53 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1upx h VAL 468 CO 0.02 0.16 0.00 0.49 0.02 0.00 0.00 177.57 178.26 1upx n PHE 469 N -4.66 0.22 -3.45 1.57 3.01 -0.49 -4.95 117.46 108.70 1upx n PHE 469 Ca 0.10 -0.11 -0.21 0.00 1.01 0.00 0.00 57.45 58.25 1upx n PHE 469 Cb 0.14 0.00 0.07 0.00 -0.01 0.00 0.00 39.48 39.69 1upx n PHE 469 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1upx n GLY 470 N 1.22 -0.35 3.89 1.37 0.00 -0.80 -4.99 105.19 105.53 1upx n GLY 470 Ca 0.17 0.13 -0.32 0.00 0.00 0.00 0.00 46.02 46.01 1upx n GLY 470 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1upx s LEU 471 N -6.48 4.25 0.11 0.99 1.43 -0.37 -5.01 118.68 113.60 1upx s LEU 471 Ca 0.48 0.65 0.24 0.00 -1.03 0.00 0.00 54.13 54.47 1upx s LEU 471 Cb -0.21 -3.36 0.28 0.00 0.03 0.00 0.00 46.19 42.93 1upx s LEU 471 CO 0.64 0.04 1.26 -1.84 0.23 0.00 0.00 176.35 176.67 1upx n GLU 472 N 0.08 0.30 -3.91 1.70 0.28 -1.26 -4.73 120.64 113.09 1upx n GLU 472 Ca -0.02 0.07 -0.18 0.00 -0.16 0.00 0.00 57.16 56.86 1upx n GLU 472 Cb 0.52 -1.67 -0.17 0.00 1.43 0.00 0.00 31.44 31.55 1upx n GLU 472 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1upx s ASP 473 N -4.18 0.70 0.54 -1.84 -1.08 -1.26 -5.03 116.67 104.52 1upx s ASP 473 Ca 0.06 -0.04 0.21 0.00 -0.52 0.00 0.00 52.55 52.26 1upx s ASP 473 Cb 0.14 -0.27 1.39 0.00 -1.46 0.00 0.00 42.92 42.72 1upx s ASP 473 CO 0.74 -0.12 2.10 1.62 0.52 0.00 0.00 175.17 180.03 1upx h VAL 474 N 6.26 0.82 0.00 1.11 3.04 -1.93 -1.55 116.25 123.99 1upx h VAL 474 Ca -0.36 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.33 1upx h VAL 474 Cb 1.13 0.89 0.00 0.00 -2.01 0.00 0.00 31.29 31.31 1upx h VAL 474 CO 0.42 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 177.57 1upx n ASN 475 N -4.35 0.44 -0.00 3.17 3.02 -1.26 -2.33 115.26 113.94 1upx n ASN 475 Ca 0.02 0.62 0.14 0.00 -0.03 0.00 0.00 54.58 55.33 1upx n ASN 475 Cb 0.28 -0.71 0.66 0.00 -0.61 0.00 0.00 39.78 39.40 1upx n ASN 475 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1upx n ASP 476 N -2.00 0.04 -4.78 6.41 8.00 -0.58 -4.84 116.55 118.79 1upx n ASP 476 Ca 0.02 0.19 -0.33 0.00 0.71 0.00 0.00 54.79 55.38 1upx n ASP 476 Cb 0.18 -0.37 0.03 0.00 -0.02 0.00 0.00 41.12 40.94 1upx n ASP 476 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1upx s LEU 477 N -2.82 3.47 -1.49 0.64 1.43 -0.99 -4.93 118.68 114.00 1upx s LEU 477 Ca 0.20 1.94 -0.13 0.00 -1.03 0.00 0.00 54.13 55.11 1upx s LEU 477 Cb 0.19 -4.55 0.02 0.00 0.03 0.00 0.00 46.19 41.89 1upx s LEU 477 CO 0.51 -1.40 2.36 -0.81 0.23 0.00 0.00 176.35 177.23 1upx n PRO 478 N -2.15 3.01 -4.52 1.29 -0.04 -1.26 -4.86 135.00 126.47 1upx n PRO 478 Ca 0.10 -2.54 -0.22 0.00 -0.04 0.00 0.00 63.50 60.80 1upx n PRO 478 Cb 0.52 -3.20 -0.16 0.00 -0.04 0.00 0.00 33.50 30.62 1upx n PRO 478 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1upx s ILE 479 N 2.99 0.98 -0.00 0.52 1.01 -1.26 -1.02 121.20 124.43 1upx s ILE 479 Ca 0.51 -0.46 0.06 0.00 0.00 0.00 0.00 60.65 60.76 1upx s ILE 479 Cb 0.15 -0.87 -0.03 0.00 0.01 0.00 0.00 42.46 41.72 1upx s ILE 479 CO -0.08 0.30 -0.18 -0.69 0.00 0.00 0.00 174.94 174.28 1upx s VAL 480 N 0.20 2.75 -0.30 2.92 1.01 -0.27 -4.98 120.40 121.73 1upx s VAL 480 Ca -0.04 -1.02 -0.02 0.00 0.00 0.00 0.00 61.98 60.89 1upx s VAL 480 Cb -0.10 -2.10 0.05 0.00 0.00 0.00 0.00 36.38 34.23 1upx s VAL 480 CO 0.01 0.47 0.01 -0.31 0.00 0.00 0.00 175.10 175.28 1upx s TYR 481 N -0.80 3.25 -0.60 5.22 1.51 -1.26 -0.58 117.35 124.09 1upx s TYR 481 Ca 0.13 -1.78 0.05 0.00 -1.01 0.00 0.00 57.07 54.45 1upx s TYR 481 Cb -0.10 -2.13 0.18 0.00 -0.11 0.00 0.00 41.96 39.80 1upx s TYR 481 CO 0.03 -0.79 0.46 -1.71 -1.11 0.00 0.00 175.55 172.43 1upx n ASN 482 N 4.65 1.81 -4.86 2.29 5.15 0.25 -1.07 115.26 123.48 1upx n ASN 482 Ca -0.13 -2.93 -0.37 0.00 -0.60 0.00 0.00 54.58 50.55 1upx n ASN 482 Cb 0.44 -0.68 -0.06 0.00 -0.53 0.00 0.00 39.78 38.94 1upx n ASN 482 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1upx s ILE 483 N -1.01 5.49 -0.06 -1.44 -4.36 -0.04 -4.18 121.20 115.59 1upx s ILE 483 Ca 0.29 0.22 -0.04 0.00 -0.26 0.00 0.00 60.65 60.86 1upx s ILE 483 Cb 0.00 -3.42 -0.04 0.00 1.25 0.00 0.00 42.46 40.26 1upx s ILE 483 CO -0.17 0.60 0.13 0.00 0.24 0.00 0.00 174.94 175.74 1upx s ALA 484 N -0.85 3.80 0.14 2.27 0.00 -0.99 -1.71 121.76 124.42 1upx s ALA 484 Ca 0.14 -0.73 0.05 0.00 0.00 0.00 0.00 51.96 51.42 1upx s ALA 484 Cb -0.12 -1.83 -0.04 0.00 0.00 0.00 0.00 23.12 21.12 1upx s ALA 484 CO 0.03 0.67 -0.12 1.67 0.00 0.00 0.00 175.76 178.02 1upx s TRP 485 N -1.14 1.33 0.25 0.00 1.48 -0.40 -0.83 118.94 119.63 1upx s TRP 485 Ca 0.20 -0.67 0.00 0.00 -1.06 0.00 0.00 56.10 54.57 1upx s TRP 485 Cb -0.12 -0.68 0.00 0.00 -1.16 0.00 0.00 33.47 31.51 1upx s TRP 485 CO 0.10 0.12 0.00 0.98 -4.06 0.00 0.00 176.95 174.09 1upx n TYR 486 N 0.07 -2.13 -2.04 1.66 9.36 -1.25 -4.61 117.16 118.22 1upx n TYR 486 Ca -0.12 0.38 0.00 0.00 3.32 0.00 0.00 57.90 61.48 1upx n TYR 486 Cb 0.59 0.55 0.00 0.00 -0.63 0.00 0.00 39.34 39.85 1upx n TYR 486 CO 0.00 0.00 0.00 -0.85 0.22 0.00 0.00 176.86 176.23 1upx n GLU 487 N -3.37 3.70 0.11 2.98 -0.00 -1.26 -0.91 120.64 121.89 1upx n GLU 487 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 57.16 57.26 1upx n GLU 487 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 31.44 31.45 1upx n GLU 487 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.13 179.09 1upx h GLN 488 N 0.00 0.00 -0.65 3.44 7.50 -1.87 -2.98 115.11 120.55 1upx h GLN 488 Ca 0.00 0.00 -0.04 0.00 0.50 0.00 0.00 58.65 59.11 1upx h GLN 488 Cb 0.00 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 27.50 1upx h GLN 488 CO 0.00 0.05 0.25 0.87 -1.50 0.00 0.00 178.83 178.50 1upx h LYS 489 N 0.00 0.95 -0.28 1.46 1.57 -1.86 -2.09 116.57 116.31 1upx h LYS 489 Ca -0.02 -0.16 -0.05 0.00 -1.87 0.00 0.00 60.65 58.54 1upx h LYS 489 Cb 1.10 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.23 1upx h LYS 489 CO 0.01 0.78 -0.06 0.00 -0.57 0.00 0.00 179.45 179.62 1upx h ALA 490 N 1.34 1.38 -0.35 3.86 0.00 -1.93 -1.73 119.26 121.82 1upx h ALA 490 Ca 0.22 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1upx h ALA 490 Cb 0.20 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1upx h ALA 490 CO -0.02 0.43 0.15 0.28 0.00 0.00 0.00 179.25 180.09 1upx h VAL 491 N 0.43 1.18 -0.17 0.00 2.07 -1.27 -0.99 116.25 117.49 1upx h VAL 491 Ca 0.09 -0.53 -0.09 0.00 0.82 0.00 0.00 66.70 66.98 1upx h VAL 491 Cb 0.37 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1upx h VAL 491 CO 0.02 0.19 -0.29 -0.29 0.02 0.00 0.00 177.57 177.22 1upx h ILE 492 N 0.42 1.27 -0.48 4.57 6.09 -1.06 -0.97 117.51 127.35 1upx h ILE 492 Ca 0.12 -1.28 -0.03 0.00 -1.37 0.00 0.00 64.86 62.31 1upx h ILE 492 Cb 0.16 1.46 -0.02 0.00 0.47 0.00 0.00 36.82 38.89 1upx h ILE 492 CO -0.01 0.39 0.20 0.58 -3.07 0.00 0.00 178.15 176.24 1upx h VAL 493 N 0.29 1.21 -0.09 2.19 2.07 -1.09 0.12 116.25 120.95 1upx h VAL 493 Ca 0.04 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.93 1upx h VAL 493 Cb 0.67 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1upx h VAL 493 CO 0.05 0.24 0.06 0.25 0.02 0.00 0.00 177.57 178.18 1upx h LEU 494 N 0.63 0.10 -1.07 2.57 5.85 -0.81 -0.73 115.31 121.85 1upx h LEU 494 Ca 0.16 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 1upx h LEU 494 Cb 0.18 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 1upx h LEU 494 CO -0.01 0.09 0.19 -0.07 -0.34 0.00 0.00 178.44 178.30 1upx h LEU 495 N 0.11 0.79 -0.22 2.25 3.38 -0.93 -0.80 115.31 119.88 1upx h LEU 495 Ca 0.03 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.89 1upx h LEU 495 Cb 0.00 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1upx h LEU 495 CO -0.01 0.74 0.13 0.00 0.09 0.00 0.00 178.44 179.40 1upx h ALA 496 N 1.37 0.28 -0.83 1.53 0.00 -0.44 0.10 119.26 121.27 1upx h ALA 496 Ca 0.19 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1upx h ALA 496 Cb 0.22 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1upx h ALA 496 CO -0.01 -0.26 0.39 -0.07 0.00 0.00 0.00 179.25 179.30 1upx h LEU 497 N 0.28 1.08 -0.84 0.00 3.38 -0.61 -1.58 115.31 117.02 1upx h LEU 497 Ca 0.09 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1upx h LEU 497 Cb -0.01 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1upx h LEU 497 CO -0.04 0.91 0.05 -0.07 0.09 0.00 0.00 178.44 179.38 1upx h LEU 498 N 1.18 0.88 -1.42 1.67 3.38 -0.82 -1.77 115.31 118.40 1upx h LEU 498 Ca 0.28 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1upx h LEU 498 Cb 0.12 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1upx h LEU 498 CO -0.04 0.91 -0.26 0.77 0.09 0.00 0.00 178.44 179.91 1upx h SER 499 N 0.86 0.00 0.19 -0.43 4.64 -0.49 -1.71 113.55 116.59 1upx h SER 499 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1upx h SER 499 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1upx h SER 499 CO 0.02 0.26 -0.03 0.18 -0.87 0.00 0.00 176.83 176.39 1upx n LEU 500 N -3.75 0.36 0.00 5.97 4.77 -0.64 -4.92 117.00 118.79 1upx n LEU 500 Ca -0.01 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1upx n LEU 500 Cb 0.36 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1upx n LEU 500 CO 0.35 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 1upx n GLY 501 N 1.15 0.78 3.68 -0.72 0.00 -0.64 -4.97 105.19 104.46 1upx n GLY 501 Ca 0.19 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1upx n GLY 501 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1upx s VAL 502 N -2.00 4.13 0.36 1.61 1.01 -0.71 -4.83 120.40 119.97 1upx s VAL 502 Ca 0.00 1.43 0.08 0.00 0.00 0.00 0.00 61.98 63.48 1upx s VAL 502 Cb 0.00 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 1upx s VAL 502 CO 0.00 -0.05 0.30 -0.54 0.00 0.00 0.00 175.10 174.80 1upx s LYS 503 N 2.81 2.61 -1.61 2.72 -0.14 -1.26 -4.54 119.74 120.33 1upx s LYS 503 Ca 0.58 -1.41 0.00 0.00 -1.36 0.00 0.00 55.97 53.78 1upx s LYS 503 Cb -0.25 -2.40 0.00 0.00 -1.68 0.00 0.00 37.83 33.50 1upx s LYS 503 CO 0.21 0.01 0.00 0.09 -0.76 0.00 0.00 175.35 174.89 1upx n ASN 504 N -1.39 -5.14 -4.73 2.83 3.02 -0.51 -4.94 115.26 104.40 1upx n ASN 504 Ca -0.00 0.11 -0.42 0.00 -0.03 0.00 0.00 54.58 54.24 1upx n ASN 504 Cb 0.61 -4.21 -0.03 0.00 -0.61 0.00 0.00 39.78 35.54 1upx n ASN 504 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1upx s ILE 505 N -2.81 3.05 -0.25 2.41 1.01 -1.26 -4.65 121.20 118.70 1upx s ILE 505 Ca 0.00 0.81 -0.09 0.00 0.00 0.00 0.00 60.65 61.37 1upx s ILE 505 Cb 0.00 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 38.91 1upx s ILE 505 CO 0.00 0.09 0.12 -1.00 0.00 0.00 0.00 174.94 174.15 1upx s HIS 506 N 0.59 3.17 -0.09 3.97 3.76 -0.23 -1.38 115.29 125.08 1upx s HIS 506 Ca 0.62 -0.12 0.04 0.00 -0.15 0.00 0.00 55.06 55.46 1upx s HIS 506 Cb -0.39 -2.27 -0.00 0.00 1.11 0.00 0.00 32.58 31.03 1upx s HIS 506 CO 0.35 -0.18 -0.24 -1.17 -0.85 0.00 0.00 174.74 172.65 1upx s LEU 507 N 1.44 2.13 0.00 0.89 2.96 0.05 -0.87 118.68 125.28 1upx s LEU 507 Ca 0.06 -0.53 -0.07 0.00 -0.22 0.00 0.00 54.13 53.38 1upx s LEU 507 Cb -0.15 -1.41 0.03 0.00 0.50 0.00 0.00 46.19 45.16 1upx s LEU 507 CO 0.06 0.19 0.46 0.61 -1.32 0.00 0.00 176.35 176.35 1upx n GLY 508 N 3.31 1.70 0.00 7.98 0.00 -0.69 -3.86 105.19 113.63 1upx n GLY 508 Ca -0.18 -1.30 0.13 0.00 0.00 0.00 0.00 46.02 44.67 1upx n GLY 508 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1upx n PRO 509 N -0.37 0.15 -4.29 1.61 -0.04 -1.26 -1.27 135.00 129.53 1upx n PRO 509 Ca -0.04 0.03 -0.15 0.00 -0.04 0.00 0.00 63.50 63.30 1upx n PRO 509 Cb 0.40 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.25 1upx n PRO 509 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1upx s THR 510 N -2.83 0.68 0.15 0.52 -4.23 -1.26 -4.73 115.64 103.94 1upx s THR 510 Ca 0.18 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.59 1upx s THR 510 Cb 0.18 -2.40 -0.07 0.00 1.34 0.00 0.00 72.50 71.56 1upx s THR 510 CO 0.47 -0.23 0.49 -0.76 -0.54 0.00 0.00 174.62 174.05 1upx s LEU 511 N -3.26 4.28 0.30 4.79 1.43 -1.26 -4.94 118.68 120.01 1upx s LEU 511 Ca 0.31 0.90 -0.29 0.00 -1.03 0.00 0.00 54.13 54.02 1upx s LEU 511 Cb 0.07 -3.32 -0.13 0.00 0.03 0.00 0.00 46.19 42.84 1upx s LEU 511 CO 0.09 0.06 1.25 -2.65 0.23 0.00 0.00 176.35 175.34 1upx n PRO 512 N 0.47 1.91 0.26 1.29 -0.02 -1.26 -4.88 135.00 132.77 1upx n PRO 512 Ca -0.04 0.67 0.13 0.00 -2.02 0.00 0.00 63.50 62.24 1upx n PRO 512 Cb 0.52 -2.22 0.73 0.00 -0.02 0.00 0.00 33.50 32.51 1upx n PRO 512 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1upx h ALA 513 N 2.86 1.31 -0.04 3.55 0.00 -1.80 -3.06 119.26 122.08 1upx h ALA 513 Ca -0.44 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1upx h ALA 513 Cb 1.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1upx h ALA 513 CO 0.66 0.14 0.00 1.97 0.00 0.00 0.00 179.25 182.01 1upx n PHE 514 N -3.67 0.04 -3.09 0.00 1.16 -1.26 -4.68 117.46 105.96 1upx n PHE 514 Ca -0.02 -0.02 -0.42 0.00 -1.87 0.00 0.00 57.45 55.12 1upx n PHE 514 Cb 0.23 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.03 1upx n PHE 514 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1upx s LEU 515 N -1.72 4.25 0.85 5.98 1.43 -1.16 -4.52 118.68 123.80 1upx s LEU 515 Ca 0.35 0.14 -0.11 0.00 -1.03 0.00 0.00 54.13 53.47 1upx s LEU 515 Cb 0.17 -2.82 0.10 0.00 0.03 0.00 0.00 46.19 43.67 1upx s LEU 515 CO 0.27 -0.63 1.09 -0.94 0.23 0.00 0.00 176.35 176.37 1upx s SER 516 N 1.82 3.80 0.23 2.29 1.04 -1.26 -4.69 113.70 116.93 1upx s SER 516 Ca 0.25 1.66 -0.07 0.00 0.48 0.00 0.00 55.95 58.28 1upx s SER 516 Cb -0.14 -2.33 0.39 0.00 0.10 0.00 0.00 66.02 64.04 1upx s SER 516 CO 0.16 -2.46 1.71 -0.65 0.98 0.00 0.00 173.24 172.97 1upx h PRO 517 N -1.42 0.31 -0.18 4.02 0.11 -1.97 0.96 132.00 133.82 1upx h PRO 517 Ca -0.47 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.47 1upx h PRO 517 Cb 1.26 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1upx h PRO 517 CO 0.52 0.20 -0.52 -0.91 -0.21 0.00 0.00 178.00 177.09 1upx h ASN 518 N 0.32 0.55 -0.17 -2.05 2.35 -1.98 -1.74 115.58 112.86 1upx h ASN 518 Ca 0.38 -0.28 -0.14 0.00 -0.55 0.00 0.00 56.30 55.70 1upx h ASN 518 Cb 0.59 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.80 1upx h ASN 518 CO -0.44 0.97 -0.44 0.58 -1.65 0.00 0.00 177.43 176.45 1upx h VAL 519 N 0.39 1.34 -0.91 2.81 2.07 -1.76 -1.79 116.25 118.40 1upx h VAL 519 Ca 0.01 -1.70 0.05 0.00 0.82 0.00 0.00 66.70 65.89 1upx h VAL 519 Cb 1.04 1.97 -0.06 0.00 -1.52 0.00 0.00 31.29 32.71 1upx h VAL 519 CO 0.09 0.52 0.58 0.00 0.02 0.00 0.00 177.57 178.79 1upx h ALA 520 N 0.56 1.23 -0.61 1.67 0.00 -0.82 -1.66 119.26 119.64 1upx h ALA 520 Ca -0.01 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1upx h ALA 520 Cb 1.06 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1upx h ALA 520 CO 0.10 0.38 0.37 -0.22 0.00 0.00 0.00 179.25 179.88 1upx h LYS 521 N 1.08 0.82 -0.55 0.00 3.64 -1.12 -0.94 116.57 119.51 1upx h LYS 521 Ca 0.38 -0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.70 1upx h LYS 521 Cb 0.10 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 1upx h LYS 521 CO -0.15 0.58 0.36 0.28 -2.27 0.00 0.00 179.45 178.25 1upx h VAL 522 N 0.82 1.14 -0.26 2.00 2.07 -0.76 -0.39 116.25 120.88 1upx h VAL 522 Ca 0.22 -0.26 -0.09 0.00 0.82 0.00 0.00 66.70 67.39 1upx h VAL 522 Cb -0.03 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1upx h VAL 522 CO -0.04 0.14 -0.23 -0.07 0.02 0.00 0.00 177.57 177.39 1upx h LEU 523 N 0.74 0.48 -0.23 2.57 3.38 -0.85 -0.58 115.31 120.83 1upx h LEU 523 Ca 0.20 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1upx h LEU 523 Cb -0.09 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1upx h LEU 523 CO -0.04 0.71 -0.10 0.58 0.09 0.00 0.00 178.44 179.67 1upx h VAL 524 N 0.43 1.30 -0.73 1.22 2.07 -0.91 -0.54 116.25 119.09 1upx h VAL 524 Ca 0.07 -1.17 -0.01 0.00 0.82 0.00 0.00 66.70 66.41 1upx h VAL 524 Cb 0.64 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.95 1upx h VAL 524 CO 0.05 0.36 0.42 -0.33 0.02 0.00 0.00 177.57 178.08 1upx h GLU 525 N 0.20 1.01 0.00 1.57 5.08 -0.71 0.84 114.58 122.57 1upx h GLU 525 Ca 0.05 -0.11 -0.27 0.00 -1.00 0.00 0.00 59.36 58.03 1upx h GLU 525 Cb 0.60 -0.20 -0.05 0.00 0.50 0.00 0.00 28.75 29.60 1upx h GLU 525 CO 0.03 0.73 -1.55 1.96 -1.00 0.00 0.00 179.01 179.19 1upx h GLN 526 N 1.00 0.00 0.00 2.33 4.20 -1.14 -3.41 115.11 118.09 1upx h GLN 526 Ca 0.26 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.96 1upx h GLN 526 Cb 0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.79 1upx h GLN 526 CO -0.04 0.62 0.00 1.19 -0.67 0.00 0.00 178.83 179.92 1upx n PHE 527 N -3.12 0.00 -4.11 2.96 3.01 -0.22 -5.03 117.46 110.94 1upx n PHE 527 Ca -0.13 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.00 1upx n PHE 527 Cb 1.03 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 40.48 1upx n PHE 527 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1upx n ASN 528 N -0.31 -3.16 -4.76 4.37 5.15 0.29 -1.42 115.26 115.41 1upx n ASN 528 Ca 0.00 -0.96 -0.36 0.00 -0.60 0.00 0.00 54.58 52.66 1upx n ASN 528 Cb 0.05 -3.06 0.03 0.00 -0.53 0.00 0.00 39.78 36.27 1upx n ASN 528 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1upx s ILE 529 N -3.40 2.63 0.30 -1.44 -4.36 -1.25 -3.59 121.20 110.09 1upx s ILE 529 Ca 0.61 0.41 -0.08 0.00 -0.26 0.00 0.00 60.65 61.33 1upx s ILE 529 Cb -0.33 -3.18 0.00 0.00 1.25 0.00 0.00 42.46 40.21 1upx s ILE 529 CO 0.90 -0.06 0.49 -0.83 0.24 0.00 0.00 174.94 175.68 1upx s GLY 530 N -1.47 0.99 0.24 6.27 0.00 -0.48 -4.67 107.32 108.20 1upx s GLY 530 Ca 0.75 -1.19 0.04 0.00 0.00 0.00 0.00 44.72 44.31 1upx s GLY 530 CO 0.35 -0.80 0.31 0.61 0.00 0.00 0.00 173.10 173.57 1upx n GLY 531 N -0.47 2.05 3.93 0.20 0.00 -1.26 -0.77 105.19 108.87 1upx n GLY 531 Ca -0.01 -2.18 -0.21 0.00 0.00 0.00 0.00 46.02 43.63 1upx n GLY 531 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1upx s ILE 532 N -0.56 4.61 0.00 -0.61 -4.36 -1.25 -4.67 121.20 114.36 1upx s ILE 532 Ca 0.24 -1.12 0.00 0.00 -0.26 0.00 0.00 60.65 59.50 1upx s ILE 532 Cb -0.02 -3.58 0.00 0.00 1.25 0.00 0.00 42.46 40.11 1upx s ILE 532 CO 0.15 -0.28 0.00 0.35 0.24 0.00 0.00 174.94 175.40 1upx n THR 533 N -1.41 0.00 -3.95 8.37 -2.24 -1.26 -5.04 114.28 108.75 1upx n THR 533 Ca -0.06 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.48 1upx n THR 533 Cb 0.58 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.78 1upx n THR 533 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1upx s SER 534 N 1.00 6.33 0.22 3.42 1.04 -1.26 -4.98 113.70 119.46 1upx s SER 534 Ca 0.00 0.13 -0.08 0.00 0.48 0.00 0.00 55.95 56.49 1upx s SER 534 Cb 0.00 -1.89 0.29 0.00 0.10 0.00 0.00 66.02 64.52 1upx s SER 534 CO 0.00 0.01 1.81 -0.65 0.98 0.00 0.00 173.24 175.39 1upx h PRO 535 N 1.80 0.70 -0.45 4.02 0.11 -1.95 -1.24 132.00 134.99 1upx h PRO 535 Ca -0.50 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.48 1upx h PRO 535 Cb 1.21 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1upx h PRO 535 CO 0.66 0.46 -0.08 1.96 -0.21 0.00 0.00 178.00 180.79 1upx h GLN 536 N 0.72 0.84 -0.44 1.05 1.08 -1.95 0.11 115.11 116.52 1upx h GLN 536 Ca 0.33 -0.31 -0.14 0.00 -1.45 0.00 0.00 58.65 57.08 1upx h GLN 536 Cb 0.24 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 1upx h GLN 536 CO -0.20 0.94 -0.28 -0.44 -0.95 0.00 0.00 178.83 177.90 1upx h ASP 537 N 0.68 0.99 0.57 1.46 3.32 -1.92 -2.80 116.42 118.73 1upx h ASP 537 Ca 0.12 -0.40 -0.17 0.00 0.02 0.00 0.00 57.03 56.59 1upx h ASP 537 Cb 0.61 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 1upx h ASP 537 CO 0.04 1.20 -0.76 0.44 -1.72 0.00 0.00 179.24 178.44 1upx h ASP 538 N 0.81 0.18 0.11 6.45 3.32 -1.13 0.11 116.42 126.27 1upx h ASP 538 Ca 0.09 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 1upx h ASP 538 Cb 0.86 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.35 1upx h ASP 538 CO 0.08 0.87 -0.10 -0.07 -1.72 0.00 0.00 179.24 178.30 1upx h LEU 539 N 0.09 0.00 0.00 1.55 3.38 -0.84 -0.50 115.31 118.99 1upx h LEU 539 Ca -0.02 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1upx h LEU 539 Cb 1.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.08 1upx h LEU 539 CO 0.11 0.10 -0.12 0.50 0.09 0.00 0.00 178.44 179.12 1upx h LYS 540 N 0.00 0.00 -0.31 1.13 3.64 -1.22 -3.38 116.57 116.43 1upx h LYS 540 Ca -0.00 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.22 1upx h LYS 540 Cb 0.18 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 1upx h LYS 540 CO 0.01 0.79 -0.45 0.00 -2.27 0.00 0.00 179.45 177.53 1upx h ALA 541 N -0.25 0.61 0.00 5.00 0.00 -0.57 -3.03 119.26 121.02 1upx h ALA 541 Ca -0.03 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1upx h ALA 541 Cb 0.83 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1upx h ALA 541 CO -0.02 0.68 0.00 0.74 0.00 0.00 0.00 179.25 180.65 1upx h PHE 542 N 0.65 0.00 -0.61 0.00 0.05 -1.33 -3.13 116.94 112.57 1upx h PHE 542 Ca 0.04 0.00 -0.34 0.00 3.82 0.00 0.00 57.97 61.49 1upx h PHE 542 Cb 1.03 0.00 -0.20 0.00 2.00 0.00 0.00 35.95 38.78 1upx h PHE 542 CO 0.06 0.00 0.15 1.19 -0.18 0.00 0.00 178.31 179.53 1upx n PHE 543 N -2.68 1.91 0.00 -0.55 3.72 -1.15 -4.96 117.46 113.75 1upx n PHE 543 Ca 0.03 -1.84 0.00 0.00 -0.05 0.00 0.00 57.45 55.59 1upx n PHE 543 Cb 0.36 -0.69 0.00 0.00 -0.94 0.00 0.00 39.48 38.21 1upx n PHE 543 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12