#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iax s LEU 12 N 0.00 1.53 1.03 1.39 1.43 -1.26 -5.04 118.68 117.76 1iax s LEU 12 Ca 0.00 1.22 -0.15 0.00 -1.03 0.00 0.00 54.13 54.17 1iax s LEU 12 Cb 0.00 -3.38 0.21 0.00 0.03 0.00 0.00 46.19 43.05 1iax s LEU 12 CO 0.00 -3.24 1.16 -0.94 0.23 0.00 0.00 176.35 173.56 1iax s SER 13 N -3.37 2.44 0.20 2.29 1.04 -1.26 -4.76 113.70 110.28 1iax s SER 13 Ca 0.66 0.72 -0.09 0.00 0.48 0.00 0.00 55.95 57.72 1iax s SER 13 Cb -0.19 -1.08 0.13 0.00 0.10 0.00 0.00 66.02 64.98 1iax s SER 13 CO 0.58 -3.19 1.75 0.11 0.98 0.00 0.00 173.24 173.48 1iax h LYS 14 N -1.94 1.13 0.18 4.02 1.57 -1.97 -0.18 116.57 119.37 1iax h LYS 14 Ca -0.48 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.07 1iax h LYS 14 Cb 1.30 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1iax h LYS 14 CO 0.47 0.94 -0.08 -0.07 -0.57 0.00 0.00 179.45 180.14 1iax h LEU 15 N 1.09 -0.20 -1.96 2.94 3.38 -1.96 0.16 115.31 118.75 1iax h LEU 15 Ca 0.24 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1iax h LEU 15 Cb 0.25 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1iax h LEU 15 CO -0.02 0.04 -0.06 0.00 0.09 0.00 0.00 178.44 178.50 1iax h ALA 16 N 0.34 1.80 0.00 1.53 0.00 -1.90 -2.71 119.26 118.33 1iax h ALA 16 Ca -0.02 -0.05 -0.24 0.00 0.00 0.00 0.00 54.91 54.59 1iax h ALA 16 Cb 0.34 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1iax h ALA 16 CO 0.04 0.07 -1.57 0.00 0.00 0.00 0.00 179.25 177.80 1iax h THR 17 N 0.00 0.73 0.00 0.00 1.03 -0.86 -3.36 112.91 110.45 1iax h THR 17 Ca -0.00 -2.45 0.00 0.00 -0.01 0.00 0.00 66.41 63.95 1iax h THR 17 Cb 0.11 2.28 0.00 0.00 -1.07 0.00 0.00 68.15 69.47 1iax h THR 17 CO 0.01 0.42 0.00 0.59 -0.01 0.00 0.00 175.52 176.53 1iax n ASN 18 N -3.00 1.27 -3.72 0.00 4.13 0.56 -5.07 115.26 109.43 1iax n ASN 18 Ca -0.14 -0.95 -0.14 0.00 1.68 0.00 0.00 54.58 55.04 1iax n ASN 18 Cb 0.97 -0.24 -0.09 0.00 -1.54 0.00 0.00 39.78 38.88 1iax n ASN 18 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1iax s GLU 19 N 0.29 0.62 -0.38 3.52 2.02 -1.26 -5.05 118.70 118.47 1iax s GLU 19 Ca 0.00 0.21 -0.03 0.00 0.02 0.00 0.00 54.97 55.17 1iax s GLU 19 Cb 0.00 0.29 0.22 0.00 0.10 0.00 0.00 34.13 34.74 1iax s GLU 19 CO 0.00 -0.14 1.04 -1.13 0.02 0.00 0.00 175.26 175.05 1iax n SER 25 N 1.97 -1.90 -0.10 -0.19 3.41 -1.26 -5.07 113.62 110.48 1iax n SER 25 Ca -0.17 -1.62 -0.19 0.00 -0.26 0.00 0.00 58.87 56.63 1iax n SER 25 Cb 0.57 0.99 -0.11 0.00 -0.26 0.00 0.00 64.21 65.40 1iax n SER 25 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1iax h PRO 26 N 4.15 0.00 -0.60 4.33 0.13 -2.09 -3.39 132.00 134.53 1iax h PRO 26 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1iax h PRO 26 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1iax h PRO 26 CO -0.07 0.91 0.00 0.66 -0.23 0.00 0.00 178.00 179.27 1iax n TYR 27 N -4.48 0.58 0.76 1.56 4.01 -1.26 -3.97 117.16 114.36 1iax n TYR 27 Ca -0.26 -0.22 0.10 0.00 -0.16 0.00 0.00 57.90 57.36 1iax n TYR 27 Cb 0.61 -0.14 0.10 0.00 -0.31 0.00 0.00 39.34 39.59 1iax n TYR 27 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1iax n PHE 28 N 0.25 0.07 -0.11 -0.72 3.72 -1.26 -4.31 117.46 115.09 1iax n PHE 28 Ca 0.09 -0.04 0.12 0.00 -0.05 0.00 0.00 57.45 57.57 1iax n PHE 28 Cb 0.43 -0.00 0.48 0.00 -0.94 0.00 0.00 39.48 39.45 1iax n PHE 28 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1iax h ASP 29 N 4.03 0.42 0.42 4.37 3.32 -1.83 0.87 116.42 128.02 1iax h ASP 29 Ca 0.00 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1iax h ASP 29 Cb 0.87 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1iax h ASP 29 CO 0.00 0.25 -0.20 1.23 -1.72 0.00 0.00 179.24 178.80 1iax h GLY 30 N 0.47 -0.59 1.70 2.75 0.00 -1.91 0.80 103.07 106.29 1iax h GLY 30 Ca 0.30 0.22 0.02 0.00 0.00 0.00 0.00 47.33 47.87 1iax h GLY 30 CO -0.09 -0.21 0.16 -0.25 0.00 0.00 0.00 176.54 176.15 1iax h TRP 31 N -1.03 0.23 0.23 5.60 2.91 -1.68 -1.38 115.95 120.83 1iax h TRP 31 Ca -0.06 0.01 -0.01 0.00 1.13 0.00 0.00 58.89 59.96 1iax h TRP 31 Cb 0.54 -0.08 0.00 0.00 -0.51 0.00 0.00 29.16 29.12 1iax h TRP 31 CO 0.02 0.14 -0.11 -0.22 -1.03 0.00 0.00 178.44 177.24 1iax h LYS 32 N 0.24 -0.29 -0.32 2.65 3.64 0.84 -2.71 116.57 120.61 1iax h LYS 32 Ca 0.10 0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.56 1iax h LYS 32 Cb 0.09 0.07 -0.08 0.00 -0.41 0.00 0.00 32.23 31.90 1iax h LYS 32 CO -0.02 0.08 -0.36 0.00 -2.27 0.00 0.00 179.45 176.88 1iax h ALA 33 N -0.38 -0.31 -0.57 5.00 0.00 0.10 -1.00 119.26 122.10 1iax h ALA 33 Ca -0.03 0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.06 1iax h ALA 33 Cb 0.51 0.74 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 1iax h ALA 33 CO 0.05 -0.79 -0.02 -0.92 0.00 0.00 0.00 179.25 177.57 1iax h TYR 34 N -0.32 -0.08 -0.84 0.00 3.20 -1.35 0.15 116.97 117.74 1iax h TYR 34 Ca 0.14 0.04 0.09 0.00 3.14 0.00 0.00 58.73 62.14 1iax h TYR 34 Cb 0.56 0.12 -0.06 0.00 1.54 0.00 0.00 36.73 38.89 1iax h TYR 34 CO -0.53 -0.16 0.55 -0.44 -1.64 0.00 0.00 178.16 175.94 1iax h ASP 35 N 0.10 0.75 0.17 -2.11 3.32 -0.86 0.71 116.42 118.50 1iax h ASP 35 Ca 0.29 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.35 1iax h ASP 35 Cb 0.46 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1iax h ASP 35 CO -0.50 0.46 -0.08 0.28 -1.72 0.00 0.00 179.24 177.68 1iax h SER 36 N 0.84 -0.20 -2.28 6.45 0.02 -0.36 -3.38 113.55 114.65 1iax h SER 36 Ca 0.38 -0.30 -0.71 0.00 -0.84 0.00 0.00 61.79 60.32 1iax h SER 36 Cb 0.36 0.05 -0.34 0.00 0.14 0.00 0.00 62.40 62.61 1iax h SER 36 CO -0.15 0.36 0.26 -0.67 -1.14 0.00 0.00 176.83 175.49 1iax n ASP 37 N -4.92 6.01 -4.68 3.07 2.03 -0.13 -5.06 116.55 112.88 1iax n ASP 37 Ca -0.07 -3.68 -0.42 0.00 0.52 0.00 0.00 54.79 51.14 1iax n ASP 37 Cb 0.24 -0.89 -0.03 0.00 -0.72 0.00 0.00 41.12 39.72 1iax n ASP 37 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1iax s PRO 38 N -3.89 4.18 0.83 -0.67 0.04 0.23 -0.27 135.00 135.45 1iax s PRO 38 Ca 0.43 2.34 -0.13 0.00 0.04 0.00 0.00 61.00 63.68 1iax s PRO 38 Cb 0.23 -3.78 0.05 0.00 0.04 0.00 0.00 34.50 31.04 1iax s PRO 38 CO -0.13 -0.80 0.89 0.34 0.04 0.00 0.00 177.00 177.35 1iax n PHE 39 N 6.26 0.24 -3.52 0.56 7.35 -0.80 -4.62 117.46 122.93 1iax n PHE 39 Ca 0.17 0.36 0.02 0.00 -0.76 0.00 0.00 57.45 57.24 1iax n PHE 39 Cb 0.41 -1.99 -0.06 0.00 0.35 0.00 0.00 39.48 38.19 1iax n PHE 39 CO 0.00 0.00 0.00 -1.58 -0.76 0.00 0.00 176.76 174.42 1iax s HIS 40 N -2.18 -0.19 0.28 -5.13 5.65 -0.50 -4.91 115.29 108.32 1iax s HIS 40 Ca 0.68 0.36 -0.01 0.00 0.25 0.00 0.00 55.06 56.34 1iax s HIS 40 Cb -0.28 0.11 0.65 0.00 -1.18 0.00 0.00 32.58 31.89 1iax s HIS 40 CO 0.56 -0.09 1.61 -1.00 -0.65 0.00 0.00 174.74 175.17 1iax h PRO 41 N 5.88 0.09 0.00 2.88 0.13 -1.92 -0.74 132.00 138.32 1iax h PRO 41 Ca -0.23 -0.01 -0.30 0.00 -0.87 0.00 0.00 66.00 64.59 1iax h PRO 41 Cb 1.15 -0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.22 1iax h PRO 41 CO 0.18 0.06 -1.92 -0.11 -0.23 0.00 0.00 178.00 175.97 1iax n LEU 42 N -5.37 1.94 -0.24 1.56 7.94 -1.26 -4.13 117.00 117.43 1iax n LEU 42 Ca 0.20 0.36 0.09 0.00 -1.11 0.00 0.00 56.01 55.55 1iax n LEU 42 Cb 0.66 -0.82 0.43 0.00 0.53 0.00 0.00 43.42 44.22 1iax n LEU 42 CO 0.00 0.28 0.79 2.29 -1.11 0.00 0.00 177.39 179.64 1iax n LYS 43 N -4.34 1.31 0.00 1.96 2.85 -1.25 -4.48 118.16 114.21 1iax n LYS 43 Ca -0.40 -0.47 0.00 0.00 -1.05 0.00 0.00 58.31 56.39 1iax n LYS 43 Cb 0.74 -1.31 0.00 0.00 -0.65 0.00 0.00 35.03 33.82 1iax n LYS 43 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1iax n ASN 44 N -0.29 0.00 0.00 -5.58 5.15 -0.87 -4.96 115.26 108.71 1iax n ASN 44 Ca 0.14 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.12 1iax n ASN 44 Cb 0.17 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.42 1iax n ASN 44 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1iax n PRO 45 N 0.00 0.00 -1.44 1.20 -0.04 -0.34 -1.41 135.00 132.98 1iax n PRO 45 Ca 0.00 0.47 -0.06 0.00 -0.04 0.00 0.00 63.50 63.88 1iax n PRO 45 Cb 0.00 -1.52 0.10 0.00 -0.04 0.00 0.00 33.50 32.04 1iax n PRO 45 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1iax n ASN 46 N -1.47 2.80 -4.88 3.54 2.85 -1.26 -4.83 115.26 112.00 1iax n ASN 46 Ca 0.00 -3.46 -0.29 0.00 -0.11 0.00 0.00 54.58 50.72 1iax n ASN 46 Cb 0.02 -0.43 -0.02 0.00 1.24 0.00 0.00 39.78 40.59 1iax n ASN 46 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 1iax s GLY 47 N -3.29 1.81 0.26 8.20 0.00 -0.93 -4.94 107.32 108.43 1iax s GLY 47 Ca 0.41 -0.29 -0.30 0.00 0.00 0.00 0.00 44.72 44.54 1iax s GLY 47 CO -0.04 -0.11 1.27 -0.62 0.00 0.00 0.00 173.10 173.60 1iax n VAL 48 N -1.58 1.38 -3.36 1.40 0.31 0.63 -3.90 118.33 113.22 1iax n VAL 48 Ca 0.02 -0.35 -0.38 0.00 -0.01 0.00 0.00 64.34 63.62 1iax n VAL 48 Cb 0.54 -1.32 -0.06 0.00 -0.91 0.00 0.00 33.84 32.09 1iax n VAL 48 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1iax s ILE 49 N -0.50 4.88 -0.86 2.52 1.01 0.31 -1.91 121.20 126.65 1iax s ILE 49 Ca 0.64 1.06 -0.24 0.00 0.00 0.00 0.00 60.65 62.11 1iax s ILE 49 Cb -0.67 -3.82 0.05 0.00 0.01 0.00 0.00 42.46 38.03 1iax s ILE 49 CO 0.55 0.55 1.29 -1.58 0.00 0.00 0.00 174.94 175.75 1iax s GLN 50 N -0.96 3.38 -0.17 2.79 2.00 -1.26 -0.58 119.66 124.87 1iax s GLN 50 Ca 0.27 -0.83 0.14 0.00 -2.00 0.00 0.00 55.36 52.94 1iax s GLN 50 Cb -0.18 -4.73 0.38 0.00 0.80 0.00 0.00 33.01 29.28 1iax s GLN 50 CO 0.16 -2.09 1.20 -1.33 -0.50 0.00 0.00 175.29 172.73 1iax n MET 51 N 8.67 1.37 -0.00 1.67 2.81 -0.55 -4.64 117.12 126.46 1iax n MET 51 Ca 0.16 -3.00 0.01 0.00 -1.81 0.00 0.00 57.70 53.06 1iax n MET 51 Cb 0.49 -1.46 0.01 0.00 -0.71 0.00 0.00 33.22 31.55 1iax n MET 51 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1iax n GLY 52 N -1.06 -0.86 3.41 3.03 0.00 -0.35 -0.54 105.19 108.82 1iax n GLY 52 Ca 0.17 -0.04 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1iax n GLY 52 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iax s LEU 53 N -0.21 3.00 -0.71 0.99 1.43 -1.26 -4.90 118.68 117.01 1iax s LEU 53 Ca 0.02 -0.26 -0.07 0.00 -1.03 0.00 0.00 54.13 52.79 1iax s LEU 53 Cb 0.01 -1.72 -0.17 0.00 0.03 0.00 0.00 46.19 44.34 1iax s LEU 53 CO 0.02 0.12 3.12 0.00 0.23 0.00 0.00 176.35 179.83 1iax n ALA 54 N 3.88 6.50 -2.42 4.21 0.00 -1.26 -4.80 120.51 126.63 1iax n ALA 54 Ca -0.18 -2.44 -0.35 0.00 0.00 0.00 0.00 53.44 50.47 1iax n ALA 54 Cb 0.52 -2.79 -0.06 0.00 0.00 0.00 0.00 19.45 17.13 1iax n ALA 54 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1iax s GLU 55 N 1.74 3.93 -0.39 0.00 2.02 -1.26 -4.87 118.70 119.86 1iax s GLU 55 Ca 0.63 0.41 -0.04 0.00 0.02 0.00 0.00 54.97 56.00 1iax s GLU 55 Cb 0.23 -2.96 0.10 0.00 0.10 0.00 0.00 34.13 31.60 1iax s GLU 55 CO -0.03 0.51 0.18 1.21 0.02 0.00 0.00 175.26 177.15 1iax s ASN 56 N -1.70 5.26 0.00 -0.19 3.84 -1.26 -3.61 114.94 117.28 1iax s ASN 56 Ca 0.36 -1.82 0.09 0.00 0.21 0.00 0.00 52.86 51.71 1iax s ASN 56 Cb -0.15 -1.84 -0.02 0.00 -0.55 0.00 0.00 41.25 38.69 1iax s ASN 56 CO 0.19 -0.50 0.56 0.00 -2.79 0.00 0.00 177.10 174.56 1iax n GLN 57 N 4.65 2.52 0.05 0.43 6.02 0.27 -4.23 117.38 127.09 1iax n GLN 57 Ca -0.05 -0.46 0.20 0.00 -0.01 0.00 0.00 57.00 56.68 1iax n GLN 57 Cb 0.42 -1.04 0.73 0.00 1.02 0.00 0.00 30.24 31.38 1iax n GLN 57 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1iax h LEU 58 N 0.83 0.00 -3.03 1.08 3.38 -1.90 -2.86 115.31 112.81 1iax h LEU 58 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1iax h LEU 58 Cb 0.30 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 1iax h LEU 58 CO 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 178.44 178.45 1iax h LEU 60 N 0.35 0.14 -1.25 0.00 3.38 -1.81 -1.56 115.31 114.56 1iax h LEU 60 Ca 0.01 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 57.96 1iax h LEU 60 Cb 1.06 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.73 1iax h LEU 60 CO 0.03 0.43 0.52 -2.24 0.09 0.00 0.00 178.44 177.27 1iax h ASP 61 N 0.13 0.85 -0.56 -0.43 2.03 -1.83 -0.76 116.42 115.84 1iax h ASP 61 Ca 0.02 -0.01 -0.00 0.00 -0.73 0.00 0.00 57.03 56.31 1iax h ASP 61 Cb 0.58 -0.20 -0.03 0.00 -0.83 0.00 0.00 39.33 38.85 1iax h ASP 61 CO 0.04 0.59 0.35 -0.07 -1.03 0.00 0.00 179.24 179.13 1iax h LEU 62 N 0.99 0.67 -0.51 0.15 3.38 -1.62 -1.40 115.31 116.97 1iax h LEU 62 Ca 0.31 -0.05 -0.11 0.00 0.09 0.00 0.00 57.88 58.12 1iax h LEU 62 Cb 0.00 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1iax h LEU 62 CO -0.08 0.52 -0.11 0.40 0.09 0.00 0.00 178.44 179.26 1iax h ILE 63 N 0.76 1.27 -0.39 1.22 2.04 -1.05 -2.33 117.51 119.03 1iax h ILE 63 Ca 0.20 -1.25 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 1iax h ILE 63 Cb -0.04 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1iax h ILE 63 CO -0.04 0.44 0.21 -0.33 0.00 0.00 0.00 178.15 178.43 1iax h GLU 64 N 0.83 0.55 -0.09 2.37 5.08 -0.99 0.79 114.58 123.12 1iax h GLU 64 Ca 0.13 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.47 1iax h GLU 64 Cb 0.67 -0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.75 1iax h GLU 64 CO 0.05 0.45 -0.39 -0.44 -1.00 0.00 0.00 179.01 177.68 1iax h ASP 65 N 0.50 -1.20 -0.73 1.42 3.32 -1.16 -1.56 116.42 117.02 1iax h ASP 65 Ca 0.14 0.16 0.10 0.00 0.02 0.00 0.00 57.03 57.45 1iax h ASP 65 Cb 0.06 0.49 -0.07 0.00 0.22 0.00 0.00 39.33 40.02 1iax h ASP 65 CO -0.02 -0.41 0.36 -0.25 -1.72 0.00 0.00 179.24 177.20 1iax h TRP 66 N -0.48 0.65 0.00 4.55 7.01 -1.06 -0.26 115.95 126.35 1iax h TRP 66 Ca 0.07 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.10 1iax h TRP 66 Cb 0.61 -0.18 0.00 0.00 -2.10 0.00 0.00 29.16 27.49 1iax h TRP 66 CO -0.44 0.22 0.08 -0.89 -2.79 0.00 0.00 178.44 174.62 1iax n ILE 67 N -4.86 1.15 -1.40 2.65 5.41 0.24 -1.60 119.36 120.95 1iax n ILE 67 Ca 0.12 0.37 -0.30 0.00 1.00 0.00 0.00 62.75 63.94 1iax n ILE 67 Cb 0.29 -1.37 0.10 0.00 -0.71 0.00 0.00 39.64 37.95 1iax n ILE 67 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1iax n LYS 68 N -1.26 2.67 0.00 0.38 5.02 -0.11 -4.95 118.16 119.92 1iax n LYS 68 Ca 0.00 -3.34 0.00 0.00 -2.02 0.00 0.00 58.31 52.95 1iax n LYS 68 Cb 0.08 -2.24 0.00 0.00 -0.02 0.00 0.00 35.03 32.85 1iax n LYS 68 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1iax n ARG 69 N -0.95 0.00 -4.23 1.97 1.74 -0.62 -5.11 116.66 109.46 1iax n ARG 69 Ca 0.59 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 57.35 1iax n ARG 69 Cb 0.90 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 32.25 1iax n ARG 69 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1iax s ASN 70 N 1.76 5.01 0.00 0.55 4.22 -1.26 -4.78 114.94 120.43 1iax s ASN 70 Ca 0.00 -0.11 0.00 0.00 -2.14 0.00 0.00 52.86 50.61 1iax s ASN 70 Cb 0.00 -1.24 0.00 0.00 1.28 0.00 0.00 41.25 41.29 1iax s ASN 70 CO 0.00 0.23 0.00 -0.81 -2.04 0.00 0.00 177.10 174.48 1iax n PRO 71 N 1.03 0.00 -2.83 3.55 -0.04 -1.26 -4.91 135.00 130.54 1iax n PRO 71 Ca -0.13 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.90 1iax n PRO 71 Cb 0.52 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.95 1iax n PRO 71 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1iax s LYS 72 N 1.88 3.13 0.25 0.54 2.47 -1.26 -4.88 119.74 121.86 1iax s LYS 72 Ca 0.00 -0.79 -0.05 0.00 -1.56 0.00 0.00 55.97 53.56 1iax s LYS 72 Cb 0.00 -4.24 0.31 0.00 -1.46 0.00 0.00 37.83 32.44 1iax s LYS 72 CO 0.00 -1.85 1.89 0.78 0.16 0.00 0.00 175.35 176.33 1iax h GLY 73 N 11.50 1.37 -5.84 5.54 0.00 -1.91 -3.45 103.07 110.28 1iax h GLY 73 Ca -0.28 -0.45 0.18 0.00 0.00 0.00 0.00 47.33 46.78 1iax h GLY 73 CO 1.19 0.37 0.38 -1.35 0.00 0.00 0.00 176.54 177.13 1iax s SER 74 N -5.92 -0.41 0.00 0.19 1.04 -1.26 -3.89 113.70 103.45 1iax s SER 74 Ca -0.13 0.60 0.00 0.00 0.48 0.00 0.00 55.95 56.90 1iax s SER 74 Cb 0.18 1.37 0.00 0.00 0.10 0.00 0.00 66.02 67.68 1iax s SER 74 CO 0.80 -0.09 0.00 -0.38 0.98 0.00 0.00 173.24 174.56 1iax n ILE 75 N 4.37 0.00 0.00 -1.02 5.41 -1.26 -5.13 119.36 121.73 1iax n ILE 75 Ca -0.12 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.63 1iax n ILE 75 Cb 0.55 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.48 1iax n ILE 75 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1iax n SER 82 N 0.00 0.00 -0.15 4.38 3.41 -1.26 -5.18 113.62 114.83 1iax n SER 82 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.58 1iax n SER 82 Cb 0.00 -0.45 0.06 0.00 -0.26 0.00 0.00 64.21 63.56 1iax n SER 82 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1iax h PHE 83 N 0.00 0.13 -0.95 7.33 3.57 -2.04 -1.19 116.94 123.78 1iax h PHE 83 Ca 0.00 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.58 1iax h PHE 83 Cb 0.00 0.01 -0.06 0.00 2.79 0.00 0.00 35.95 38.70 1iax h PHE 83 CO 0.00 -0.01 0.62 0.87 -2.23 0.00 0.00 178.31 177.55 1iax h LYS 84 N 0.21 1.11 -0.29 1.11 1.57 -2.02 0.60 116.57 118.86 1iax h LYS 84 Ca 0.24 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.93 1iax h LYS 84 Cb 0.31 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1iax h LYS 84 CO -0.32 0.73 0.10 0.00 -0.57 0.00 0.00 179.45 179.39 1iax h ALA 85 N 1.47 0.38 0.14 3.86 0.00 -1.67 -1.85 119.26 121.58 1iax h ALA 85 Ca 0.39 -0.14 -0.28 0.00 0.00 0.00 0.00 54.91 54.88 1iax h ALA 85 Cb 0.11 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.79 1iax h ALA 85 CO -0.14 -0.00 -1.28 -0.84 0.00 0.00 0.00 179.25 176.99 1iax h ILE 86 N 0.31 1.47 0.00 0.00 3.07 -0.93 0.32 117.51 121.74 1iax h ILE 86 Ca 0.09 -3.02 -0.01 0.00 1.55 0.00 0.00 64.86 63.48 1iax h ILE 86 Cb 0.22 2.96 -0.00 0.00 -0.27 0.00 0.00 36.82 39.73 1iax h ILE 86 CO -0.00 0.88 -0.03 0.00 -1.05 0.00 0.00 178.15 177.95 1iax h ALA 87 N 0.53 1.19 0.00 0.16 0.00 0.23 -2.66 119.26 118.70 1iax h ALA 87 Ca -0.15 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1iax h ALA 87 Cb 2.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.78 1iax h ALA 87 CO 0.21 0.04 -1.04 -1.71 0.00 0.00 0.00 179.25 176.76 1iax n ASN 88 N -3.40 2.03 -4.69 0.00 4.05 -0.70 -4.98 115.26 107.58 1iax n ASN 88 Ca -0.02 -0.26 -0.44 0.00 0.45 0.00 0.00 54.58 54.31 1iax n ASN 88 Cb 0.15 1.26 -0.04 0.00 1.23 0.00 0.00 39.78 42.38 1iax n ASN 88 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 177.26 174.54 1iax n PHE 89 N -1.59 2.54 -2.75 1.20 -0.00 0.11 -4.86 117.46 112.11 1iax n PHE 89 Ca -0.00 0.03 -0.03 0.00 -0.00 0.00 0.00 57.45 57.44 1iax n PHE 89 Cb 0.19 -2.66 0.07 0.00 -0.00 0.00 0.00 39.48 37.09 1iax n PHE 89 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1iax n GLN 90 N 4.70 1.47 -3.33 -4.13 10.64 -1.26 -4.89 117.38 120.58 1iax n GLN 90 Ca 0.18 -2.74 -0.39 0.00 -1.83 0.00 0.00 57.00 52.22 1iax n GLN 90 Cb 0.34 -0.89 -0.07 0.00 -0.86 0.00 0.00 30.24 28.75 1iax n GLN 90 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1iax s ASP 91 N -2.77 6.46 0.00 2.61 -1.08 -1.26 -4.93 116.67 115.70 1iax s ASP 91 Ca 0.22 0.55 0.00 0.00 -0.52 0.00 0.00 52.55 52.80 1iax s ASP 91 Cb 0.39 -2.25 0.00 0.00 -1.46 0.00 0.00 42.92 39.59 1iax s ASP 91 CO -0.05 -0.14 0.77 -1.22 0.52 0.00 0.00 175.17 175.05 1iax n TYR 92 N 4.73 0.00 0.02 -5.34 0.53 -1.26 0.12 117.16 115.97 1iax n TYR 92 Ca -0.07 0.00 -0.10 0.00 -1.02 0.00 0.00 57.90 56.71 1iax n TYR 92 Cb 0.51 -0.28 -0.13 0.00 -1.03 0.00 0.00 39.34 38.40 1iax n TYR 92 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 1iax h HIS 93 N 0.00 0.10 0.00 -0.72 3.86 -1.95 -3.44 115.15 113.01 1iax h HIS 93 Ca 0.00 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.14 1iax h HIS 93 Cb 0.35 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.81 1iax h HIS 93 CO 0.00 1.10 0.00 0.41 0.86 0.00 0.00 177.93 180.30 1iax n GLY 94 N 1.53 0.09 3.70 2.45 0.00 0.34 -4.77 105.19 108.53 1iax n GLY 94 Ca -0.12 -1.87 -0.43 0.00 0.00 0.00 0.00 46.02 43.59 1iax n GLY 94 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1iax n LEU 95 N -0.63 3.66 -0.25 0.99 4.77 -1.26 -4.88 117.00 119.40 1iax n LEU 95 Ca 0.00 1.14 -0.04 0.00 -0.03 0.00 0.00 56.01 57.08 1iax n LEU 95 Cb 0.00 -1.50 -0.02 0.00 -2.33 0.00 0.00 43.42 39.57 1iax n LEU 95 CO 0.00 -0.20 0.33 -2.65 -1.33 0.00 0.00 177.39 173.54 1iax n PRO 96 N 2.13 -0.22 0.07 3.23 -0.02 -1.26 -0.69 135.00 138.24 1iax n PRO 96 Ca 0.10 0.95 0.13 0.00 -2.02 0.00 0.00 63.50 62.66 1iax n PRO 96 Cb 0.34 -1.40 0.47 0.00 -0.02 0.00 0.00 33.50 32.89 1iax n PRO 96 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1iax n GLU 97 N -4.84 0.17 0.30 -0.52 4.07 -1.26 -4.13 120.64 114.43 1iax n GLU 97 Ca 0.04 0.19 -0.15 0.00 -0.06 0.00 0.00 57.16 57.18 1iax n GLU 97 Cb 0.20 -1.72 -0.08 0.00 -0.06 0.00 0.00 31.44 29.79 1iax n GLU 97 CO 0.00 0.00 0.00 0.35 -0.06 0.00 0.00 177.13 177.42 1iax h PHE 98 N 0.00 -0.71 -0.80 4.31 3.57 -1.22 -1.71 116.94 120.38 1iax h PHE 98 Ca 0.00 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.59 1iax h PHE 98 Cb 0.60 0.24 -0.08 0.00 2.79 0.00 0.00 35.95 39.50 1iax h PHE 98 CO 0.00 -0.38 0.43 0.00 -2.23 0.00 0.00 178.31 176.13 1iax h ARG 99 N -1.03 0.68 -0.70 1.11 3.08 -1.72 -0.64 114.38 115.17 1iax h ARG 99 Ca -0.08 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 59.85 1iax h ARG 99 Cb 0.65 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.52 1iax h ARG 99 CO 0.13 0.45 0.14 0.87 -1.07 0.00 0.00 179.97 180.49 1iax h LYS 100 N 0.70 1.13 -0.34 0.04 1.57 -1.74 -1.59 116.57 116.35 1iax h LYS 100 Ca 0.40 -0.29 -0.03 0.00 -1.87 0.00 0.00 60.65 58.85 1iax h LYS 100 Cb 0.42 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1iax h LYS 100 CO -0.28 1.02 0.08 0.00 -0.57 0.00 0.00 179.45 179.70 1iax h ALA 101 N 1.07 0.45 0.00 3.86 0.00 -0.47 0.21 119.26 124.38 1iax h ALA 101 Ca 0.21 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1iax h ALA 101 Cb 0.41 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1iax h ALA 101 CO 0.01 0.12 -0.07 0.82 0.00 0.00 0.00 179.25 180.13 1iax h ILE 102 N 0.40 0.83 -0.54 0.00 1.08 -0.96 0.84 117.51 119.15 1iax h ILE 102 Ca 0.11 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.61 1iax h ILE 102 Cb 0.30 0.83 -0.04 0.00 -3.07 0.00 0.00 36.82 34.84 1iax h ILE 102 CO 0.00 0.00 0.31 0.00 -0.69 0.00 0.00 178.15 177.77 1iax h ALA 103 N 0.87 0.70 -0.52 1.87 0.00 -1.13 0.85 119.26 121.91 1iax h ALA 103 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1iax h ALA 103 Cb 0.15 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1iax h ALA 103 CO -0.07 0.00 0.19 0.87 0.00 0.00 0.00 179.25 180.24 1iax h LYS 104 N 0.60 0.75 -0.33 0.00 1.57 -0.68 -0.24 116.57 118.25 1iax h LYS 104 Ca 0.23 -0.12 -0.17 0.00 -1.87 0.00 0.00 60.65 58.73 1iax h LYS 104 Cb 0.07 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.25 1iax h LYS 104 CO -0.12 0.63 -0.45 0.35 -0.57 0.00 0.00 179.45 179.29 1iax h PHE 105 N 0.74 1.04 0.00 -1.35 3.57 0.84 -1.32 116.94 120.47 1iax h PHE 105 Ca 0.18 -0.33 -0.04 0.00 3.53 0.00 0.00 57.97 61.30 1iax h PHE 105 Cb 0.17 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1iax h PHE 105 CO 0.01 1.14 -0.20 0.52 -2.23 0.00 0.00 178.31 177.56 1iax h MET 106 N 0.69 0.00 0.10 1.11 2.86 0.13 -2.04 114.93 117.78 1iax h MET 106 Ca 0.04 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1iax h MET 106 Cb 1.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.69 1iax h MET 106 CO 0.10 0.20 -0.05 0.93 1.06 0.00 0.00 176.91 179.15 1iax h GLU 107 N 0.00 -0.13 -1.09 1.72 5.08 -0.72 -2.46 114.58 116.97 1iax h GLU 107 Ca -0.00 0.01 0.30 0.00 -1.00 0.00 0.00 59.36 58.67 1iax h GLU 107 Cb 0.43 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.61 1iax h GLU 107 CO 0.03 0.22 0.70 0.87 -1.00 0.00 0.00 179.01 179.82 1iax h LYS 108 N -0.98 0.32 0.97 2.33 1.79 -1.19 0.54 116.57 120.35 1iax h LYS 108 Ca -0.01 -0.02 -0.05 0.00 -2.18 0.00 0.00 60.65 58.39 1iax h LYS 108 Cb 0.41 -0.07 0.01 0.00 -1.58 0.00 0.00 32.23 31.00 1iax h LYS 108 CO 0.02 0.21 -0.47 1.15 -1.08 0.00 0.00 179.45 179.29 1iax h THR 109 N 0.33 0.00 -0.02 -0.16 2.02 -1.38 -3.02 112.91 110.68 1iax h THR 109 Ca 0.65 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 67.77 1iax h THR 109 Cb 1.73 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 1iax h THR 109 CO -0.34 0.00 0.02 0.54 0.37 0.00 0.00 175.52 176.10 1iax n ARG 110 N -5.63 1.03 0.00 6.66 1.74 -0.42 -4.76 116.66 115.27 1iax n ARG 110 Ca -0.16 -0.06 0.00 0.00 -0.77 0.00 0.00 57.85 56.86 1iax n ARG 110 Cb 0.51 -1.02 0.00 0.00 -1.02 0.00 0.00 32.46 30.93 1iax n ARG 110 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1iax n GLY 111 N 1.08 2.76 1.13 -0.13 0.00 -1.04 -3.72 105.19 105.27 1iax n GLY 111 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1iax n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iax n GLY 112 N -0.34 0.74 0.16 -0.02 0.00 0.17 -4.82 105.19 101.10 1iax n GLY 112 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1iax n GLY 112 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1iax h ARG 113 N 3.55 0.56 -6.09 1.61 3.08 -1.80 -3.46 114.38 111.84 1iax h ARG 113 Ca 0.00 -0.72 -0.61 0.00 0.07 0.00 0.00 59.98 58.72 1iax h ARG 113 Cb 0.00 0.23 -0.06 0.00 0.08 0.00 0.00 29.97 30.22 1iax h ARG 113 CO 0.00 1.31 -0.55 0.54 -1.07 0.00 0.00 179.97 180.21 1iax s VAL 114 N -3.02 4.88 0.04 2.04 0.11 -1.26 -5.12 120.40 118.08 1iax s VAL 114 Ca -0.08 -0.71 0.01 0.00 -2.93 0.00 0.00 61.98 58.27 1iax s VAL 114 Cb 0.06 -3.41 -0.04 0.00 -1.53 0.00 0.00 36.38 31.46 1iax s VAL 114 CO 0.92 0.05 0.12 -0.13 -3.33 0.00 0.00 175.10 172.73 1iax s ARG 115 N -2.68 3.11 -0.03 1.54 1.81 -1.26 -4.78 118.95 116.66 1iax s ARG 115 Ca 0.32 -0.54 0.06 0.00 -1.72 0.00 0.00 55.73 53.85 1iax s ARG 115 Cb -0.12 -2.87 -0.01 0.00 -0.45 0.00 0.00 34.95 31.50 1iax s ARG 115 CO 0.25 0.61 -0.21 -0.06 -0.68 0.00 0.00 175.30 175.20 1iax s PHE 116 N -1.35 1.97 -0.54 -0.53 0.40 -1.26 -5.09 117.98 111.57 1iax s PHE 116 Ca 0.29 -0.44 -0.18 0.00 -0.60 0.00 0.00 56.93 55.99 1iax s PHE 116 Cb -0.12 -1.28 0.09 0.00 0.51 0.00 0.00 43.02 42.21 1iax s PHE 116 CO 0.21 -0.09 0.61 0.34 0.70 0.00 0.00 175.22 176.99 1iax s ASP 117 N -0.36 6.19 0.64 1.36 -1.08 -1.26 -4.86 116.67 117.31 1iax s ASP 117 Ca 0.04 -1.30 0.20 0.00 -0.52 0.00 0.00 52.55 50.98 1iax s ASP 117 Cb -0.10 -2.27 1.01 0.00 -1.46 0.00 0.00 42.92 40.10 1iax s ASP 117 CO 0.00 -0.95 1.55 1.55 0.52 0.00 0.00 175.17 177.84 1iax h PRO 118 N 9.03 0.00 0.00 4.34 0.13 -1.92 0.54 132.00 144.12 1iax h PRO 118 Ca -0.29 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.79 1iax h PRO 118 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1iax h PRO 118 CO 1.02 0.00 -0.26 0.93 -0.23 0.00 0.00 178.00 179.47 1iax h GLU 119 N 0.00 0.00 -0.10 0.86 4.39 -1.92 -2.76 114.58 115.06 1iax h GLU 119 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 1iax h GLU 119 Cb 1.48 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.13 1iax h GLU 119 CO -0.00 0.26 0.00 0.54 -1.16 0.00 0.00 179.01 178.64 1iax n ARG 120 N -3.39 1.86 -2.75 2.33 1.74 0.19 -4.89 116.66 111.74 1iax n ARG 120 Ca 0.00 -1.26 -0.42 0.00 -0.77 0.00 0.00 57.85 55.40 1iax n ARG 120 Cb 0.46 -1.45 -0.03 0.00 -1.02 0.00 0.00 32.46 30.42 1iax n ARG 120 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1iax s VAL 121 N -1.89 4.78 -0.03 1.55 1.01 -1.04 -4.42 120.40 120.36 1iax s VAL 121 Ca 0.35 1.89 0.06 0.00 0.00 0.00 0.00 61.98 64.29 1iax s VAL 121 Cb 0.20 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.31 1iax s VAL 121 CO 0.31 -0.05 -0.22 -0.69 0.00 0.00 0.00 175.10 174.44 1iax s VAL 122 N 2.48 1.77 0.62 2.92 1.01 -0.82 -4.99 120.40 123.38 1iax s VAL 122 Ca 0.43 -0.94 -0.05 0.00 0.00 0.00 0.00 61.98 61.41 1iax s VAL 122 Cb -0.17 -1.48 0.03 0.00 0.00 0.00 0.00 36.38 34.76 1iax s VAL 122 CO 0.12 0.50 0.92 -0.04 0.00 0.00 0.00 175.10 176.60 1iax s MET 123 N -0.41 2.68 -0.11 2.72 -1.94 -1.26 0.22 119.30 121.21 1iax s MET 123 Ca 0.05 -0.14 -0.32 0.00 -1.71 0.00 0.00 55.69 53.57 1iax s MET 123 Cb -0.10 -2.26 0.12 0.00 2.01 0.00 0.00 34.83 34.60 1iax s MET 123 CO 0.00 -0.85 1.12 0.00 -0.01 0.00 0.00 175.02 175.28 1iax s ALA 124 N -3.04 -2.00 -1.11 3.03 0.00 -0.80 -4.57 121.76 113.27 1iax s ALA 124 Ca 0.56 1.28 -0.23 0.00 0.00 0.00 0.00 51.96 53.57 1iax s ALA 124 Cb -0.11 0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 1iax s ALA 124 CO 0.44 -0.69 1.87 0.20 0.00 0.00 0.00 175.76 177.59 1iax s GLY 125 N -2.38 0.46 0.00 0.00 0.00 -0.52 -0.11 107.32 104.78 1iax s GLY 125 Ca 0.09 -2.10 0.00 0.00 0.00 0.00 0.00 44.72 42.71 1iax s GLY 125 CO -0.05 3.35 0.00 0.61 0.00 0.00 0.00 173.10 177.01 1iax n GLY 126 N 6.12 -1.32 0.16 0.20 0.00 -1.16 -0.72 105.19 108.47 1iax n GLY 126 Ca 0.43 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 45.32 1iax n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iax h ALA 127 N -0.68 1.12 -0.08 4.61 0.00 -1.82 -2.15 119.26 120.26 1iax h ALA 127 Ca 0.00 -0.47 0.04 0.00 0.00 0.00 0.00 54.91 54.48 1iax h ALA 127 Cb 0.02 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 1iax h ALA 127 CO 0.00 0.65 -0.32 1.15 0.00 0.00 0.00 179.25 180.73 1iax h THR 128 N 0.00 0.30 -0.46 0.00 2.02 -1.96 0.35 112.91 113.15 1iax h THR 128 Ca -0.01 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.06 1iax h THR 128 Cb 0.93 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 1iax h THR 128 CO 0.07 0.00 -0.18 1.23 0.37 0.00 0.00 175.52 177.00 1iax h GLY 129 N -0.42 0.98 0.80 2.16 0.00 -0.82 -2.36 103.07 103.41 1iax h GLY 129 Ca 0.08 -0.83 0.03 0.00 0.00 0.00 0.00 47.33 46.62 1iax h GLY 129 CO -0.32 0.76 0.23 0.00 0.00 0.00 0.00 176.54 177.21 1iax h ALA 130 N 0.99 0.56 0.09 3.60 0.00 -0.71 -0.87 119.26 122.91 1iax h ALA 130 Ca 0.11 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1iax h ALA 130 Cb 0.73 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1iax h ALA 130 CO 0.06 -0.12 -0.04 -0.91 0.00 0.00 0.00 179.25 178.24 1iax h ASN 131 N 0.46 -0.10 -0.98 0.00 2.35 -0.23 -0.32 115.58 116.76 1iax h ASN 131 Ca 0.19 -0.14 0.02 0.00 -0.55 0.00 0.00 56.30 55.82 1iax h ASN 131 Cb 0.08 0.03 -0.05 0.00 0.05 0.00 0.00 38.32 38.43 1iax h ASN 131 CO -0.12 0.08 0.65 -0.08 -1.65 0.00 0.00 177.43 176.30 1iax h GLU 132 N -0.27 1.26 -0.20 0.81 4.81 -1.26 -2.52 114.58 117.21 1iax h GLU 132 Ca -0.01 -0.08 -0.06 0.00 -0.13 0.00 0.00 59.36 59.09 1iax h GLU 132 Cb 0.23 -0.29 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 1iax h GLU 132 CO 0.02 0.84 -0.09 1.15 -0.73 0.00 0.00 179.01 180.20 1iax h THR 133 N 1.30 1.30 0.00 0.32 2.02 -1.05 -0.99 112.91 115.82 1iax h THR 133 Ca 0.37 -1.14 -0.01 0.00 0.77 0.00 0.00 66.41 66.40 1iax h THR 133 Cb -0.12 1.62 -0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1iax h THR 133 CO -0.09 0.34 -0.04 -0.29 0.37 0.00 0.00 175.52 175.82 1iax h ILE 134 N 0.12 0.42 0.22 3.11 6.09 -0.82 -0.00 117.51 126.65 1iax h ILE 134 Ca 0.05 -0.19 -0.33 0.00 -1.37 0.00 0.00 64.86 63.01 1iax h ILE 134 Cb 0.57 1.13 0.03 0.00 0.47 0.00 0.00 36.82 39.02 1iax h ILE 134 CO 0.03 0.04 -1.55 0.40 -3.07 0.00 0.00 178.15 174.00 1iax h ILE 135 N 0.00 1.16 -0.72 2.19 1.08 -1.28 -2.61 117.51 117.33 1iax h ILE 135 Ca -0.00 -2.62 0.13 0.00 -0.39 0.00 0.00 64.86 61.98 1iax h ILE 135 Cb 0.13 2.95 -0.05 0.00 -3.07 0.00 0.00 36.82 36.78 1iax h ILE 135 CO 0.01 0.82 0.48 -0.26 -0.69 0.00 0.00 178.15 178.51 1iax h PHE 136 N 0.09 0.53 0.08 1.37 0.04 0.14 0.13 116.94 119.33 1iax h PHE 136 Ca -0.29 0.01 -0.25 0.00 2.80 0.00 0.00 57.97 60.25 1iax h PHE 136 Cb 2.11 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 40.09 1iax h PHE 136 CO 0.12 0.22 -1.13 0.00 -0.60 0.00 0.00 178.31 176.93 1iax n LEU 138 N -3.50 0.89 -4.25 0.00 4.77 -0.76 -5.00 117.00 109.15 1iax n LEU 138 Ca -0.06 0.10 -0.19 0.00 -0.03 0.00 0.00 56.01 55.83 1iax n LEU 138 Cb 0.97 0.07 -0.11 0.00 -2.33 0.00 0.00 43.42 42.02 1iax n LEU 138 CO 0.51 0.57 -0.46 0.00 -1.33 0.00 0.00 177.39 176.68 1iax s ALA 139 N -2.53 1.56 0.34 -1.18 0.00 0.39 -4.95 121.76 115.39 1iax s ALA 139 Ca -0.14 -1.29 0.02 0.00 0.00 0.00 0.00 51.96 50.55 1iax s ALA 139 Cb 0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 1iax s ALA 139 CO 0.79 0.14 0.53 -0.51 0.00 0.00 0.00 175.76 176.71 1iax s ASP 140 N -2.38 6.18 0.35 0.00 1.01 -1.26 -4.57 116.67 116.00 1iax s ASP 140 Ca 0.09 0.28 -0.28 0.00 0.71 0.00 0.00 52.55 53.35 1iax s ASP 140 Cb -0.06 -1.83 -0.12 0.00 1.01 0.00 0.00 42.92 41.92 1iax s ASP 140 CO 0.03 -0.34 1.36 -2.65 0.21 0.00 0.00 175.17 173.79 1iax n PRO 141 N -1.75 2.31 0.00 8.23 -0.02 -1.24 -1.35 135.00 141.17 1iax n PRO 141 Ca -0.04 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 1iax n PRO 141 Cb 0.57 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 1iax n PRO 141 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1iax n GLY 142 N 0.76 3.11 3.72 -1.23 0.00 0.63 -4.94 105.19 107.25 1iax n GLY 142 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1iax n GLY 142 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1iax s ASP 143 N 0.44 2.79 0.17 1.61 1.01 -0.46 -4.69 116.67 117.55 1iax s ASP 143 Ca 0.00 1.01 0.03 0.00 0.71 0.00 0.00 52.55 54.30 1iax s ASP 143 Cb 0.00 -1.59 -0.05 0.00 1.01 0.00 0.00 42.92 42.30 1iax s ASP 143 CO 0.00 -3.00 -0.06 0.00 0.21 0.00 0.00 175.17 172.32 1iax s ALA 144 N -3.12 1.47 0.04 5.23 0.00 -0.46 -1.18 121.76 123.74 1iax s ALA 144 Ca 0.65 -1.56 0.05 0.00 0.00 0.00 0.00 51.96 51.10 1iax s ALA 144 Cb -0.16 0.26 -0.02 0.00 0.00 0.00 0.00 23.12 23.20 1iax s ALA 144 CO 0.56 -0.19 -0.14 -0.06 0.00 0.00 0.00 175.76 175.92 1iax s PHE 145 N -3.44 1.26 0.00 0.00 0.40 -0.16 -0.99 117.98 115.04 1iax s PHE 145 Ca 0.20 -0.37 -0.19 0.00 -0.60 0.00 0.00 56.93 55.98 1iax s PHE 145 Cb 0.04 -0.74 -0.06 0.00 0.51 0.00 0.00 43.02 42.77 1iax s PHE 145 CO 0.03 0.04 0.54 -0.51 0.70 0.00 0.00 175.22 176.02 1iax s LEU 146 N -1.21 4.44 -0.09 -0.37 1.43 0.76 -0.38 118.68 123.26 1iax s LEU 146 Ca 0.01 1.11 -0.01 0.00 -1.03 0.00 0.00 54.13 54.21 1iax s LEU 146 Cb -0.08 -2.83 0.03 0.00 0.03 0.00 0.00 46.19 43.34 1iax s LEU 146 CO 0.01 0.17 -0.03 -0.69 0.23 0.00 0.00 176.35 176.05 1iax s VAL 147 N -0.47 0.63 0.71 -1.59 1.01 0.02 -0.82 120.40 119.89 1iax s VAL 147 Ca 0.29 -0.04 -0.14 0.00 0.00 0.00 0.00 61.98 62.08 1iax s VAL 147 Cb -0.18 -0.73 0.03 0.00 0.00 0.00 0.00 36.38 35.50 1iax s VAL 147 CO 0.16 0.30 1.13 -2.84 0.00 0.00 0.00 175.10 173.85 1iax s PRO 148 N 1.81 2.44 0.11 2.72 0.02 -1.26 -1.39 135.00 139.46 1iax s PRO 148 Ca 0.04 1.42 0.03 0.00 0.02 0.00 0.00 61.00 62.51 1iax s PRO 148 Cb -0.12 -1.90 -0.04 0.00 0.02 0.00 0.00 34.50 32.45 1iax s PRO 148 CO -0.06 -1.53 -0.08 -1.54 -0.33 0.00 0.00 177.00 173.46 1iax s SER 149 N -2.65 1.30 0.46 2.53 1.04 -1.05 -4.16 113.70 111.16 1iax s SER 149 Ca 0.67 -0.97 -0.25 0.00 0.48 0.00 0.00 55.95 55.88 1iax s SER 149 Cb -0.21 0.06 -0.08 0.00 0.10 0.00 0.00 66.02 65.89 1iax s SER 149 CO 0.46 -0.41 1.42 -2.16 0.98 0.00 0.00 173.24 173.54 1iax s PRO 150 N -3.64 3.65 0.24 4.02 0.04 -1.26 -4.05 135.00 133.99 1iax s PRO 150 Ca 0.12 2.41 0.03 0.00 0.04 0.00 0.00 61.00 63.59 1iax s PRO 150 Cb 0.03 -2.63 -0.05 0.00 0.04 0.00 0.00 34.50 31.89 1iax s PRO 150 CO -0.03 -0.84 0.03 1.52 0.04 0.00 0.00 177.00 177.72 1iax s TYR 151 N -1.21 1.53 -0.33 0.56 -0.85 0.56 -4.42 117.35 113.19 1iax s TYR 151 Ca 0.62 -1.02 -0.29 0.00 -0.52 0.00 0.00 57.07 55.85 1iax s TYR 151 Cb -0.44 -0.90 -0.07 0.00 0.38 0.00 0.00 41.96 40.93 1iax s TYR 151 CO 0.56 -0.15 2.27 0.98 -1.52 0.00 0.00 175.55 177.69 1iax n TYR 152 N -0.42 1.73 -0.22 -3.49 9.36 -1.25 -4.45 117.16 118.41 1iax n TYR 152 Ca -0.04 0.03 0.28 0.00 3.32 0.00 0.00 57.90 61.49 1iax n TYR 152 Cb 0.65 -2.66 0.68 0.00 -0.63 0.00 0.00 39.34 37.38 1iax n TYR 152 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1iax h PRO 153 N 15.35 0.08 0.00 2.98 0.13 -1.92 0.10 132.00 148.73 1iax h PRO 153 Ca -0.33 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.78 1iax h PRO 153 Cb 1.27 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 1iax h PRO 153 CO 1.03 0.05 -0.05 0.00 -0.23 0.00 0.00 178.00 178.80 1iax h ALA 154 N 1.54 1.41 -0.86 -0.56 0.00 -1.93 -2.30 119.26 116.57 1iax h ALA 154 Ca 0.47 -0.04 0.18 0.00 0.00 0.00 0.00 54.91 55.51 1iax h ALA 154 Cb 1.72 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 19.39 1iax h ALA 154 CO -0.05 0.06 0.39 0.74 0.00 0.00 0.00 179.25 180.39 1iax h PHE 155 N 0.00 0.67 0.00 0.00 0.04 -1.35 0.77 116.94 117.07 1iax h PHE 155 Ca -0.00 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.81 1iax h PHE 155 Cb 0.14 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.12 1iax h PHE 155 CO 0.00 0.06 0.23 -0.91 -0.60 0.00 0.00 178.31 177.09 1iax h ASN 156 N 0.49 0.00 0.00 2.17 2.35 -1.60 0.30 115.58 119.29 1iax h ASN 156 Ca 0.50 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.19 1iax h ASN 156 Cb 0.83 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.19 1iax h ASN 156 CO -0.45 0.00 -0.93 -1.14 -1.65 0.00 0.00 177.43 173.26 1iax n ARG 157 N -2.71 0.37 -0.25 0.81 0.63 0.05 -4.18 116.66 111.38 1iax n ARG 157 Ca -0.02 0.15 0.05 0.00 -0.92 0.00 0.00 57.85 57.11 1iax n ARG 157 Cb 0.28 -1.15 0.15 0.00 0.45 0.00 0.00 32.46 32.19 1iax n ARG 157 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1iax h ASP 158 N -0.69 -0.36 1.18 6.15 5.19 -0.71 0.23 116.42 127.41 1iax h ASP 158 Ca -0.09 0.19 -0.05 0.00 -0.62 0.00 0.00 57.03 56.47 1iax h ASP 158 Cb 0.82 0.35 -0.01 0.00 0.18 0.00 0.00 39.33 40.66 1iax h ASP 158 CO -0.05 -0.18 -0.84 -0.07 -3.12 0.00 0.00 179.24 174.98 1iax h LEU 159 N 0.10 0.00 0.00 1.55 3.38 -0.62 -3.32 115.31 116.40 1iax h LEU 159 Ca 0.40 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.30 1iax h LEU 159 Cb 0.70 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1iax h LEU 159 CO -0.66 0.18 -1.28 0.54 0.09 0.00 0.00 178.44 177.31 1iax n ARG 160 N -2.87 2.04 0.00 1.13 1.74 -0.84 -4.34 116.66 113.52 1iax n ARG 160 Ca -0.01 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1iax n ARG 160 Cb 0.63 -1.10 0.00 0.00 -1.02 0.00 0.00 32.46 30.97 1iax n ARG 160 CO 0.00 0.00 0.00 1.87 -1.52 0.00 0.00 177.63 177.98 1iax n TRP 161 N -2.35 0.00 1.55 -1.55 -0.00 0.75 -2.07 117.44 113.76 1iax n TRP 161 Ca -0.08 0.00 0.03 0.00 -0.00 0.00 0.00 57.50 57.46 1iax n TRP 161 Cb 0.62 0.00 0.20 0.00 -0.00 0.00 0.00 31.31 32.13 1iax n TRP 161 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 1iax n ARG 162 N -0.28 0.77 -0.00 5.87 1.74 -1.26 -3.52 116.66 119.99 1iax n ARG 162 Ca 0.00 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.15 1iax n ARG 162 Cb 0.00 -1.14 -0.10 0.00 -1.02 0.00 0.00 32.46 30.20 1iax n ARG 162 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1iax n THR 163 N -0.64 0.00 -1.28 0.55 -2.24 -1.13 -4.97 114.28 104.57 1iax n THR 163 Ca 0.05 -0.28 -0.10 0.00 -2.27 0.00 0.00 64.05 61.45 1iax n THR 163 Cb 0.02 0.38 -0.04 0.00 -2.10 0.00 0.00 70.33 68.60 1iax n THR 163 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iax n GLY 164 N 1.63 1.10 3.91 3.38 0.00 -0.88 -3.70 105.19 110.62 1iax n GLY 164 Ca -0.01 -0.34 -0.31 0.00 0.00 0.00 0.00 46.02 45.35 1iax n GLY 164 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iax s VAL 165 N -2.23 5.30 0.16 1.61 1.01 -1.25 0.23 120.40 125.23 1iax s VAL 165 Ca 0.00 -0.19 0.09 0.00 0.00 0.00 0.00 61.98 61.88 1iax s VAL 165 Cb 0.00 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 1iax s VAL 165 CO 0.00 0.11 -0.12 0.00 0.00 0.00 0.00 175.10 175.10 1iax s GLN 166 N -2.52 1.99 -0.10 2.72 -2.07 -0.33 -4.24 119.66 115.12 1iax s GLN 166 Ca 0.37 -1.24 -0.02 0.00 -1.82 0.00 0.00 55.36 52.65 1iax s GLN 166 Cb -0.13 -2.15 -0.03 0.00 -1.09 0.00 0.00 33.01 29.61 1iax s GLN 166 CO 0.26 0.45 -0.01 -0.51 -1.32 0.00 0.00 175.29 174.16 1iax s LEU 167 N -2.62 3.52 -0.24 2.60 1.43 -1.26 -0.99 118.68 121.11 1iax s LEU 167 Ca 0.23 0.09 0.02 0.00 -1.03 0.00 0.00 54.13 53.44 1iax s LEU 167 Cb -0.09 -1.81 0.05 0.00 0.03 0.00 0.00 46.19 44.36 1iax s LEU 167 CO 0.14 0.34 -0.13 -0.63 0.23 0.00 0.00 176.35 176.29 1iax s ILE 168 N -0.63 2.18 0.49 -0.59 1.01 0.49 -4.91 121.20 119.24 1iax s ILE 168 Ca 0.10 -1.43 -0.23 0.00 0.00 0.00 0.00 60.65 59.09 1iax s ILE 168 Cb -0.12 -2.19 -0.06 0.00 0.01 0.00 0.00 42.46 40.10 1iax s ILE 168 CO 0.02 0.12 1.27 -2.16 0.00 0.00 0.00 174.94 174.20 1iax s PRO 169 N 1.16 3.50 -0.14 2.79 0.04 -1.26 -0.80 135.00 140.28 1iax s PRO 169 Ca -0.05 2.03 0.01 0.00 0.04 0.00 0.00 61.00 63.04 1iax s PRO 169 Cb -0.18 -2.38 0.00 0.00 0.04 0.00 0.00 34.50 31.98 1iax s PRO 169 CO -0.07 -0.84 -0.18 0.42 0.04 0.00 0.00 177.00 176.37 1iax s ILE 170 N -1.40 2.47 0.28 0.56 1.01 -0.48 -4.83 121.20 118.81 1iax s ILE 170 Ca 0.66 -0.84 -0.30 0.00 0.00 0.00 0.00 60.65 60.17 1iax s ILE 170 Cb -0.35 -2.02 -0.12 0.00 0.01 0.00 0.00 42.46 39.98 1iax s ILE 170 CO 0.42 0.53 1.57 1.57 0.00 0.00 0.00 174.94 179.04 1iax n HIS 171 N 3.98 2.76 -3.74 3.97 -0.00 -1.26 -2.53 115.22 118.39 1iax n HIS 171 Ca -0.19 0.27 -0.12 0.00 -0.00 0.00 0.00 57.72 57.68 1iax n HIS 171 Cb 0.52 -2.58 -0.12 0.00 -0.00 0.00 0.00 29.99 27.81 1iax n HIS 171 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1iax s GLU 173 N 0.85 1.90 0.02 0.00 2.02 -1.26 -4.66 118.70 117.57 1iax s GLU 173 Ca -0.06 -2.14 0.26 0.00 0.02 0.00 0.00 54.97 53.05 1iax s GLU 173 Cb -0.07 -0.93 0.68 0.00 0.10 0.00 0.00 34.13 33.91 1iax s GLU 173 CO -0.06 -0.34 1.54 -1.13 0.02 0.00 0.00 175.26 175.29 1iax n SER 174 N -1.09 0.41 0.27 -0.19 3.41 -1.26 -0.10 113.62 115.06 1iax n SER 174 Ca -0.07 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.65 1iax n SER 174 Cb 0.66 0.02 0.73 0.00 -0.26 0.00 0.00 64.21 65.36 1iax n SER 174 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1iax h SER 175 N 0.00 0.00 -0.18 4.04 4.64 -2.02 -2.29 113.55 117.74 1iax h SER 175 Ca 0.00 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 1iax h SER 175 Cb 0.54 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.48 1iax h SER 175 CO 0.00 0.00 -0.64 -0.46 -0.87 0.00 0.00 176.83 174.86 1iax n ASN 176 N -4.31 2.36 -3.21 4.97 6.94 -1.24 -4.97 115.26 115.80 1iax n ASN 176 Ca -0.03 -3.63 -0.23 0.00 -0.02 0.00 0.00 54.58 50.68 1iax n ASN 176 Cb 0.10 -0.46 0.03 0.00 -2.36 0.00 0.00 39.78 37.08 1iax n ASN 176 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1iax n ASN 177 N -0.85 -5.46 -3.81 0.53 3.02 -0.86 -2.91 115.26 104.91 1iax n ASN 177 Ca 0.23 -0.36 -0.26 0.00 -0.03 0.00 0.00 54.58 54.16 1iax n ASN 177 Cb 0.80 -4.41 0.03 0.00 -0.61 0.00 0.00 39.78 35.59 1iax n ASN 177 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1iax n PHE 178 N -4.42 -2.14 -3.34 3.10 3.72 0.86 -4.99 117.46 110.25 1iax n PHE 178 Ca -0.07 0.88 -0.31 0.00 -0.05 0.00 0.00 57.45 57.90 1iax n PHE 178 Cb 0.59 -4.19 -0.05 0.00 -0.94 0.00 0.00 39.48 34.89 1iax n PHE 178 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1iax s LYS 179 N -6.33 3.77 -0.40 -1.08 1.02 -1.15 -4.90 119.74 110.67 1iax s LYS 179 Ca 0.36 0.25 -0.21 0.00 0.02 0.00 0.00 55.97 56.39 1iax s LYS 179 Cb -0.18 -2.62 0.01 0.00 -0.52 0.00 0.00 37.83 34.53 1iax s LYS 179 CO 0.82 0.26 0.65 0.42 -0.92 0.00 0.00 175.35 176.58 1iax s ILE 180 N -1.92 4.84 -0.06 2.17 1.01 -1.26 -4.78 121.20 121.19 1iax s ILE 180 Ca 0.47 0.32 -0.12 0.00 0.00 0.00 0.00 60.65 61.32 1iax s ILE 180 Cb -0.11 -4.16 -0.05 0.00 0.01 0.00 0.00 42.46 38.15 1iax s ILE 180 CO 0.24 -0.49 0.31 0.42 0.00 0.00 0.00 174.94 175.42 1iax s THR 181 N 2.80 5.22 0.59 2.92 -4.23 -1.26 -4.97 115.64 116.71 1iax s THR 181 Ca 0.24 0.60 0.29 0.00 -1.18 0.00 0.00 61.69 61.64 1iax s THR 181 Cb -0.14 -3.60 0.37 0.00 1.34 0.00 0.00 72.50 70.46 1iax s THR 181 CO 0.18 0.56 2.00 0.28 -0.54 0.00 0.00 174.62 177.10 1iax h SER 182 N 5.08 0.00 -0.10 3.99 0.02 -1.96 0.14 113.55 120.71 1iax h SER 182 Ca -0.51 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.39 1iax h SER 182 Cb 1.22 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.75 1iax h SER 182 CO 0.62 0.00 -0.14 0.50 -1.14 0.00 0.00 176.83 176.67 1iax h LYS 183 N 0.00 0.28 -0.27 3.45 3.64 -2.00 -2.05 116.57 119.62 1iax h LYS 183 Ca 0.14 -0.16 0.04 0.00 -1.27 0.00 0.00 60.65 59.39 1iax h LYS 183 Cb 0.80 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.62 1iax h LYS 183 CO -0.00 0.72 0.19 0.00 -2.27 0.00 0.00 179.45 178.09 1iax h ALA 184 N 0.55 1.99 -0.03 5.00 0.00 -1.12 -1.32 119.26 124.32 1iax h ALA 184 Ca 0.01 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1iax h ALA 184 Cb 0.69 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.43 1iax h ALA 184 CO 0.03 -0.03 -0.40 0.28 0.00 0.00 0.00 179.25 179.13 1iax h VAL 185 N 0.22 1.45 -0.70 0.00 2.07 -1.19 -3.07 116.25 115.02 1iax h VAL 185 Ca 0.12 -1.90 0.01 0.00 0.82 0.00 0.00 66.70 65.75 1iax h VAL 185 Cb 0.19 2.52 -0.04 0.00 -1.52 0.00 0.00 31.29 32.45 1iax h VAL 185 CO -0.02 0.54 0.46 0.11 0.02 0.00 0.00 177.57 178.68 1iax h LYS 186 N -0.21 0.90 -0.29 1.57 1.57 -0.81 -2.11 116.57 117.18 1iax h LYS 186 Ca -0.04 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.73 1iax h LYS 186 Cb 1.10 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 33.17 1iax h LYS 186 CO 0.08 0.59 0.06 0.93 -0.57 0.00 0.00 179.45 180.54 1iax h GLU 187 N 0.92 0.16 -0.73 3.15 5.08 -1.32 -0.49 114.58 121.34 1iax h GLU 187 Ca 0.26 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.58 1iax h GLU 187 Cb -0.07 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 1iax h GLU 187 CO -0.07 0.10 0.32 0.00 -1.00 0.00 0.00 179.01 178.37 1iax h ALA 188 N 1.21 0.95 0.47 3.43 0.00 -1.41 0.18 119.26 124.09 1iax h ALA 188 Ca 0.13 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1iax h ALA 188 Cb 0.14 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1iax h ALA 188 CO -0.18 0.54 -0.27 -0.92 0.00 0.00 0.00 179.25 178.43 1iax h TYR 189 N 1.04 -0.71 -0.32 0.00 3.20 -0.85 -1.32 116.97 118.02 1iax h TYR 189 Ca 0.25 -0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.97 1iax h TYR 189 Cb 0.16 0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 1iax h TYR 189 CO 0.01 -0.42 -0.35 0.93 -1.64 0.00 0.00 178.16 176.69 1iax h GLU 190 N -0.70 0.72 -1.01 1.82 5.08 -1.01 -2.24 114.58 117.24 1iax h GLU 190 Ca -0.06 -0.35 0.06 0.00 -1.00 0.00 0.00 59.36 58.02 1iax h GLU 190 Cb 0.56 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.74 1iax h GLU 190 CO 0.07 0.96 0.65 -0.91 -1.00 0.00 0.00 179.01 178.78 1iax h ASN 191 N 0.60 1.05 -0.01 1.42 4.21 -0.57 -1.41 115.58 120.86 1iax h ASN 191 Ca 0.06 0.01 -0.13 0.00 1.21 0.00 0.00 56.30 57.45 1iax h ASN 191 Cb 0.88 -0.22 -0.01 0.00 -1.12 0.00 0.00 38.32 37.85 1iax h ASN 191 CO 0.08 0.68 -0.41 0.00 -1.29 0.00 0.00 177.43 176.48 1iax h ALA 192 N 1.45 0.87 -0.26 -0.83 0.00 -0.96 -3.14 119.26 116.39 1iax h ALA 192 Ca 0.43 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1iax h ALA 192 Cb 0.15 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1iax h ALA 192 CO -0.17 0.64 -0.20 1.96 0.00 0.00 0.00 179.25 181.48 1iax h GLN 193 N 0.43 0.60 -0.81 0.00 4.20 -0.72 0.25 115.11 119.07 1iax h GLN 193 Ca 0.04 -0.29 0.10 0.00 0.06 0.00 0.00 58.65 58.55 1iax h GLN 193 Cb 0.90 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.63 1iax h GLN 193 CO 0.08 0.88 0.53 0.87 -0.67 0.00 0.00 178.83 180.52 1iax h LYS 194 N 0.32 0.72 -0.00 1.46 1.79 -1.33 1.03 116.57 120.55 1iax h LYS 194 Ca 0.05 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1iax h LYS 194 Cb 0.75 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.24 1iax h LYS 194 CO 0.05 0.47 0.00 0.43 -1.08 0.00 0.00 179.45 179.33 1iax n SER 195 N -4.51 0.07 -2.21 0.86 7.64 -1.09 -4.90 113.62 109.47 1iax n SER 195 Ca 0.14 -1.05 -0.17 0.00 1.01 0.00 0.00 58.87 58.80 1iax n SER 195 Cb 0.33 -0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.55 1iax n SER 195 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1iax n ASN 196 N -0.93 -4.93 -4.66 6.43 3.02 0.36 -5.00 115.26 109.54 1iax n ASN 196 Ca 0.23 -0.18 -0.39 0.00 -0.03 0.00 0.00 54.58 54.22 1iax n ASN 196 Cb 0.12 -3.84 -0.07 0.00 -0.61 0.00 0.00 39.78 35.38 1iax n ASN 196 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1iax s ILE 197 N -2.97 5.17 -0.69 2.41 1.01 0.83 -4.98 121.20 121.97 1iax s ILE 197 Ca 0.18 0.77 -0.27 0.00 0.00 0.00 0.00 60.65 61.33 1iax s ILE 197 Cb -0.08 -3.76 0.03 0.00 0.01 0.00 0.00 42.46 38.66 1iax s ILE 197 CO 0.23 0.22 1.22 -0.75 0.00 0.00 0.00 174.94 175.86 1iax s LYS 198 N 1.49 3.25 -0.27 2.79 2.20 -1.26 -4.27 119.74 123.67 1iax s LYS 198 Ca 0.20 -0.20 -0.29 0.00 -0.36 0.00 0.00 55.97 55.32 1iax s LYS 198 Cb -0.15 -4.15 0.01 0.00 -1.51 0.00 0.00 37.83 32.03 1iax s LYS 198 CO 0.09 -2.00 1.16 0.08 -0.36 0.00 0.00 175.35 174.32 1iax s VAL 199 N 5.35 4.40 -0.40 4.02 1.01 -1.26 -1.36 120.40 132.16 1iax s VAL 199 Ca 0.35 1.64 0.22 0.00 0.00 0.00 0.00 61.98 64.19 1iax s VAL 199 Cb -0.09 -4.25 -0.20 0.00 0.00 0.00 0.00 36.38 31.84 1iax s VAL 199 CO 0.17 -0.36 0.81 0.29 0.00 0.00 0.00 175.10 176.01 1iax n LYS 200 N 6.83 0.43 -3.94 2.72 4.76 -0.17 -4.89 118.16 123.90 1iax n LYS 200 Ca 0.13 -0.06 0.01 0.00 -2.87 0.00 0.00 58.31 55.52 1iax n LYS 200 Cb 0.46 -1.58 0.02 0.00 -1.84 0.00 0.00 35.03 32.09 1iax n LYS 200 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1iax n GLY 201 N 1.32 0.34 2.87 0.72 0.00 -1.24 -1.14 105.19 108.05 1iax n GLY 201 Ca -0.00 -1.08 -0.18 0.00 0.00 0.00 0.00 46.02 44.75 1iax n GLY 201 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iax s LEU 202 N 0.00 1.30 -0.23 0.99 0.20 0.12 -0.17 118.68 120.90 1iax s LEU 202 Ca 0.28 -0.09 -0.01 0.00 0.69 0.00 0.00 54.13 55.00 1iax s LEU 202 Cb -0.01 -0.35 0.02 0.00 -0.43 0.00 0.00 46.19 45.42 1iax s LEU 202 CO 0.01 -0.07 -0.10 -0.51 -0.29 0.00 0.00 176.35 175.40 1iax s ILE 203 N 0.89 2.65 0.38 6.68 2.07 -0.00 -1.41 121.20 132.47 1iax s ILE 203 Ca -0.11 -1.00 0.04 0.00 -1.41 0.00 0.00 60.65 58.17 1iax s ILE 203 Cb -0.14 -2.29 -0.01 0.00 0.13 0.00 0.00 42.46 40.15 1iax s ILE 203 CO -0.00 0.29 0.56 -0.76 -1.91 0.00 0.00 174.94 173.11 1iax s LEU 204 N 1.31 3.84 -0.16 8.50 1.43 0.01 -4.31 118.68 129.31 1iax s LEU 204 Ca 0.01 0.04 -0.01 0.00 -1.03 0.00 0.00 54.13 53.14 1iax s LEU 204 Cb -0.16 -2.94 0.04 0.00 0.03 0.00 0.00 46.19 43.17 1iax s LEU 204 CO -0.07 -0.54 -0.03 -0.89 0.23 0.00 0.00 176.35 175.06 1iax s THR 205 N -2.34 0.90 -0.20 5.49 2.01 -1.26 -0.95 115.64 119.29 1iax s THR 205 Ca 0.46 -0.51 -0.05 0.00 0.31 0.00 0.00 61.69 61.90 1iax s THR 205 Cb -0.10 -1.13 0.10 0.00 0.01 0.00 0.00 72.50 71.38 1iax s THR 205 CO 0.34 0.09 0.38 0.21 -0.69 0.00 0.00 174.62 174.95 1iax s ASN 206 N 1.72 0.00 0.95 3.53 2.47 -0.68 -3.62 114.94 119.32 1iax s ASN 206 Ca 0.01 0.69 -0.13 0.00 0.42 0.00 0.00 52.86 53.85 1iax s ASN 206 Cb -0.15 1.18 0.05 0.00 -1.45 0.00 0.00 41.25 40.87 1iax s ASN 206 CO -0.07 -0.25 0.46 -2.65 -3.72 0.00 0.00 177.10 170.86 1iax n PRO 207 N 5.38 -0.34 -3.30 0.43 -0.02 -1.26 -3.90 135.00 131.99 1iax n PRO 207 Ca -0.07 -0.05 -0.39 0.00 -2.02 0.00 0.00 63.50 60.97 1iax n PRO 207 Cb 0.50 -1.89 -0.06 0.00 -0.02 0.00 0.00 33.50 32.02 1iax n PRO 207 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1iax s SER 208 N -2.06 7.01 -0.12 2.55 0.15 0.15 -4.68 113.70 116.69 1iax s SER 208 Ca 0.58 1.19 0.03 0.00 0.70 0.00 0.00 55.95 58.45 1iax s SER 208 Cb -0.21 -2.34 0.01 0.00 -1.71 0.00 0.00 66.02 61.77 1iax s SER 208 CO 0.67 0.25 -0.21 0.21 1.20 0.00 0.00 173.24 175.36 1iax s ASN 209 N -0.94 2.97 0.00 5.45 3.84 -1.26 0.11 114.94 125.11 1iax s ASN 209 Ca 0.28 -0.56 0.27 0.00 0.21 0.00 0.00 52.86 53.06 1iax s ASN 209 Cb -0.19 -1.37 0.84 0.00 -0.55 0.00 0.00 41.25 39.99 1iax s ASN 209 CO 0.18 0.09 1.63 -0.81 -2.79 0.00 0.00 177.10 175.39 1iax n PRO 210 N 3.96 0.53 0.32 0.43 -0.04 -1.26 -3.97 135.00 134.97 1iax n PRO 210 Ca -0.20 -0.27 0.20 0.00 -0.04 0.00 0.00 63.50 63.19 1iax n PRO 210 Cb 0.52 -1.49 1.08 0.00 -0.04 0.00 0.00 33.50 33.56 1iax n PRO 210 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1iax h LEU 211 N 0.66 0.00 1.05 1.53 3.38 -1.89 -3.37 115.31 116.67 1iax h LEU 211 Ca 0.00 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.58 1iax h LEU 211 Cb 0.47 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.22 1iax h LEU 211 CO 0.00 0.01 -0.57 0.61 0.09 0.00 0.00 178.44 178.58 1iax n GLY 212 N -1.08 -0.51 3.32 0.83 0.00 0.31 -4.66 105.19 103.40 1iax n GLY 212 Ca -0.03 0.10 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 1iax n GLY 212 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1iax s THR 213 N -3.06 1.98 0.21 2.61 -4.23 -1.23 -1.76 115.64 110.16 1iax s THR 213 Ca 0.30 -1.39 -0.15 0.00 -1.18 0.00 0.00 61.69 59.27 1iax s THR 213 Cb -0.14 -1.72 -0.08 0.00 1.34 0.00 0.00 72.50 71.90 1iax s THR 213 CO 0.37 0.25 0.63 0.42 -0.54 0.00 0.00 174.62 175.76 1iax s THR 214 N -0.86 4.76 0.12 3.99 -4.23 -1.26 0.31 115.64 118.47 1iax s THR 214 Ca 0.10 0.92 -0.28 0.00 -1.18 0.00 0.00 61.69 61.25 1iax s THR 214 Cb -0.10 -3.73 -0.06 0.00 1.34 0.00 0.00 72.50 69.95 1iax s THR 214 CO 0.03 0.11 0.88 -0.76 -0.54 0.00 0.00 174.62 174.34 1iax s LEU 215 N -2.28 4.52 -0.08 4.79 1.43 -1.26 -4.96 118.68 120.84 1iax s LEU 215 Ca 0.44 1.71 -0.35 0.00 -1.03 0.00 0.00 54.13 54.90 1iax s LEU 215 Cb -0.14 -3.46 -0.13 0.00 0.03 0.00 0.00 46.19 42.49 1iax s LEU 215 CO 0.20 0.02 1.82 -0.67 0.23 0.00 0.00 176.35 177.95 1iax n ASP 216 N 2.45 3.23 -0.25 2.29 -0.08 -1.26 -4.65 116.55 118.28 1iax n ASP 216 Ca -0.01 1.00 0.04 0.00 -1.51 0.00 0.00 54.79 54.32 1iax n ASP 216 Cb 0.49 -1.34 0.15 0.00 2.34 0.00 0.00 41.12 42.75 1iax n ASP 216 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 1iax h LYS 217 N 8.47 0.09 -0.23 -0.67 3.64 -1.95 0.55 116.57 126.48 1iax h LYS 217 Ca -0.48 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 58.89 1iax h LYS 217 Cb 1.28 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 1iax h LYS 217 CO 0.94 0.06 0.10 -0.44 -2.27 0.00 0.00 179.45 177.84 1iax h ASP 218 N 0.09 0.27 -0.55 4.20 3.32 -1.99 -1.12 116.42 120.65 1iax h ASP 218 Ca 0.40 -0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.32 1iax h ASP 218 Cb 0.69 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 1iax h ASP 218 CO -0.66 0.25 -0.09 0.74 -1.72 0.00 0.00 179.24 177.76 1iax h THR 219 N 0.32 1.27 -0.12 0.35 2.02 -0.28 -1.77 112.91 114.70 1iax h THR 219 Ca 0.08 -1.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.01 1iax h THR 219 Cb 0.05 0.94 -0.00 0.00 -1.74 0.00 0.00 68.15 67.40 1iax h THR 219 CO -0.01 0.44 0.04 -0.07 0.37 0.00 0.00 175.52 176.29 1iax h LEU 220 N 0.91 0.17 -2.06 2.58 3.38 -0.60 -1.33 115.31 118.36 1iax h LEU 220 Ca 0.15 -0.20 0.11 0.00 0.09 0.00 0.00 57.88 58.03 1iax h LEU 220 Cb 0.66 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1iax h LEU 220 CO 0.05 0.32 0.33 0.11 0.09 0.00 0.00 178.44 179.34 1iax h LYS 221 N 0.01 0.00 0.04 1.13 1.57 -1.00 0.34 116.57 118.66 1iax h LYS 221 Ca 0.04 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1iax h LYS 221 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1iax h LYS 221 CO -0.00 0.00 -0.02 0.77 -0.57 0.00 0.00 179.45 179.63 1iax h SER 222 N 0.00 -0.05 -0.97 0.86 0.02 -0.69 -2.54 113.55 110.17 1iax h SER 222 Ca 0.18 -0.45 0.19 0.00 -0.84 0.00 0.00 61.79 60.87 1iax h SER 222 Cb 0.84 0.01 -0.09 0.00 0.14 0.00 0.00 62.40 63.30 1iax h SER 222 CO -0.00 0.66 0.61 0.58 -1.14 0.00 0.00 176.83 177.54 1iax h VAL 223 N -0.98 0.70 -0.11 2.27 2.07 -0.73 -0.49 116.25 118.99 1iax h VAL 223 Ca -0.01 -0.22 -0.16 0.00 0.82 0.00 0.00 66.70 67.13 1iax h VAL 223 Cb 0.50 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 1iax h VAL 223 CO 0.01 0.12 -0.63 0.25 0.02 0.00 0.00 177.57 177.33 1iax h LEU 224 N 0.64 0.45 0.59 2.57 5.85 -1.03 -0.53 115.31 123.87 1iax h LEU 224 Ca 0.54 -0.27 -0.03 0.00 0.84 0.00 0.00 57.88 58.96 1iax h LEU 224 Cb 1.00 -0.13 0.01 0.00 0.37 0.00 0.00 40.66 41.91 1iax h LEU 224 CO -0.30 0.97 -0.29 0.28 -0.34 0.00 0.00 178.44 178.76 1iax h SER 225 N 0.29 -0.68 -0.84 1.25 0.02 -0.67 0.21 113.55 113.13 1iax h SER 225 Ca -0.01 -0.02 0.10 0.00 -0.84 0.00 0.00 61.79 61.02 1iax h SER 225 Cb 1.17 0.17 -0.08 0.00 0.14 0.00 0.00 62.40 63.81 1iax h SER 225 CO 0.11 -0.30 0.48 0.15 -1.14 0.00 0.00 176.83 176.12 1iax h PHE 226 N -1.11 0.87 0.35 3.45 3.57 -1.41 0.55 116.94 123.20 1iax h PHE 226 Ca -0.08 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.44 1iax h PHE 226 Cb 0.66 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 1iax h PHE 226 CO 0.00 0.34 -0.23 1.15 -2.23 0.00 0.00 178.31 177.34 1iax h THR 227 N 0.79 0.52 -0.03 4.41 2.02 -1.00 -2.66 112.91 116.96 1iax h THR 227 Ca 0.41 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.52 1iax h THR 227 Cb 0.41 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1iax h THR 227 CO -0.26 0.00 -0.33 -1.13 0.37 0.00 0.00 175.52 174.17 1iax h ASN 228 N -0.56 0.05 0.35 4.18 -0.73 0.09 -2.67 115.58 116.29 1iax h ASN 228 Ca -0.03 -0.02 0.00 0.00 1.87 0.00 0.00 56.30 58.12 1iax h ASN 228 Cb 0.47 -0.01 0.00 0.00 0.27 0.00 0.00 38.32 39.05 1iax h ASN 228 CO 0.02 0.38 0.00 1.67 -0.37 0.00 0.00 177.43 179.13 1iax n GLN 229 N -4.14 0.33 -0.07 6.67 7.27 0.19 -2.96 117.38 124.67 1iax n GLN 229 Ca -0.02 0.08 0.01 0.00 0.07 0.00 0.00 57.00 57.15 1iax n GLN 229 Cb 0.38 -1.50 0.02 0.00 2.41 0.00 0.00 30.24 31.55 1iax n GLN 229 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 1iax n HIS 230 N -1.26 0.00 -3.58 3.69 8.25 -1.05 -5.01 115.22 116.27 1iax n HIS 230 Ca 0.10 -0.34 -0.26 0.00 -0.26 0.00 0.00 57.72 56.95 1iax n HIS 230 Cb 0.15 -0.05 0.03 0.00 1.12 0.00 0.00 29.99 31.24 1iax n HIS 230 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1iax n ASN 231 N -0.41 -5.06 -4.58 0.41 2.85 -1.15 -5.00 115.26 102.32 1iax n ASN 231 Ca 0.02 -0.57 -0.28 0.00 -0.11 0.00 0.00 54.58 53.64 1iax n ASN 231 Cb 0.44 -4.06 -0.09 0.00 1.24 0.00 0.00 39.78 37.31 1iax n ASN 231 CO 0.00 0.00 0.00 0.27 -2.11 0.00 0.00 177.26 175.42 1iax s ILE 232 N -3.20 3.35 0.42 -1.44 -4.36 -1.03 -4.98 121.20 109.96 1iax s ILE 232 Ca 0.53 -1.40 -0.23 0.00 -0.26 0.00 0.00 60.65 59.29 1iax s ILE 232 Cb -0.26 -2.61 -0.09 0.00 1.25 0.00 0.00 42.46 40.75 1iax s ILE 232 CO 0.65 0.02 1.03 -1.00 0.24 0.00 0.00 174.94 175.88 1iax s HIS 233 N -1.42 3.24 -0.30 1.37 3.76 -0.30 -4.45 115.29 117.20 1iax s HIS 233 Ca 0.23 1.64 -0.01 0.00 -0.15 0.00 0.00 55.06 56.77 1iax s HIS 233 Cb -0.10 -3.07 0.06 0.00 1.11 0.00 0.00 32.58 30.58 1iax s HIS 233 CO 0.15 -0.55 -0.01 -1.17 -0.85 0.00 0.00 174.74 172.31 1iax s LEU 234 N -2.84 3.92 -0.15 0.89 2.96 0.22 0.13 118.68 123.80 1iax s LEU 234 Ca 0.60 -1.37 -0.08 0.00 -0.22 0.00 0.00 54.13 53.06 1iax s LEU 234 Cb -0.19 -1.68 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 1iax s LEU 234 CO 0.24 -0.27 0.11 -0.69 -1.32 0.00 0.00 176.35 174.42 1iax s VAL 235 N 1.20 5.26 -0.17 1.68 1.01 -0.50 -1.31 120.40 127.58 1iax s VAL 235 Ca -0.05 0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.07 1iax s VAL 235 Cb -0.20 -3.34 0.02 0.00 0.00 0.00 0.00 36.38 32.86 1iax s VAL 235 CO -0.02 0.53 -0.19 0.00 0.00 0.00 0.00 175.10 175.42 1iax s ASP 237 N 1.27 6.40 -0.47 0.00 -1.08 -0.12 0.73 116.67 123.39 1iax s ASP 237 Ca 0.04 -1.81 0.03 0.00 -0.52 0.00 0.00 52.55 50.29 1iax s ASP 237 Cb -0.13 -2.31 0.56 0.00 -1.46 0.00 0.00 42.92 39.58 1iax s ASP 237 CO -0.11 -1.01 1.83 -0.62 0.52 0.00 0.00 175.17 175.78 1iax n GLU 238 N 5.96 2.38 0.21 4.34 1.02 -0.44 -1.69 120.64 132.43 1iax n GLU 238 Ca 0.03 -3.20 0.13 0.00 -0.02 0.00 0.00 57.16 54.10 1iax n GLU 238 Cb 0.45 -2.15 0.69 0.00 -0.02 0.00 0.00 31.44 30.41 1iax n GLU 238 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 1iax h ILE 239 N 1.07 0.00 -0.47 -3.67 2.10 -1.81 -0.79 117.51 113.94 1iax h ILE 239 Ca 0.54 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.48 1iax h ILE 239 Cb 1.99 0.56 0.00 0.00 -1.09 0.00 0.00 36.82 38.28 1iax h ILE 239 CO 1.10 0.00 0.00 -1.22 -1.08 0.00 0.00 178.15 176.95 1iax n TYR 240 N -2.43 0.94 -0.29 2.19 4.01 -1.26 -4.01 117.16 116.30 1iax n TYR 240 Ca -0.02 -0.61 0.12 0.00 -0.16 0.00 0.00 57.90 57.23 1iax n TYR 240 Cb 0.12 -0.15 0.27 0.00 -0.31 0.00 0.00 39.34 39.27 1iax n TYR 240 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1iax h ALA 241 N 2.90 1.20 -0.87 -0.72 0.00 -1.41 -2.12 119.26 118.23 1iax h ALA 241 Ca 0.00 0.23 -0.62 0.00 0.00 0.00 0.00 54.91 54.52 1iax h ALA 241 Cb 1.13 0.34 -0.25 0.00 0.00 0.00 0.00 17.79 19.00 1iax h ALA 241 CO 0.12 -0.46 0.79 0.00 0.00 0.00 0.00 179.25 179.70 1iax n ALA 242 N -2.75 6.16 -0.67 0.00 0.00 -1.26 -4.08 120.51 117.90 1iax n ALA 242 Ca 0.20 -3.22 0.01 0.00 0.00 0.00 0.00 53.44 50.42 1iax n ALA 242 Cb 0.65 -1.77 0.01 0.00 0.00 0.00 0.00 19.45 18.34 1iax n ALA 242 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1iax n THR 243 N -0.50 0.51 -2.27 0.00 -2.24 -0.80 -4.85 114.28 104.13 1iax n THR 243 Ca 0.54 -0.53 -0.42 0.00 -2.27 0.00 0.00 64.05 61.38 1iax n THR 243 Cb 0.56 0.70 -0.03 0.00 -2.10 0.00 0.00 70.33 69.46 1iax n THR 243 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1iax s VAL 244 N -0.56 3.52 -0.02 2.28 1.01 -1.26 -3.53 120.40 121.83 1iax s VAL 244 Ca 0.02 1.14 0.03 0.00 0.00 0.00 0.00 61.98 63.17 1iax s VAL 244 Cb 0.02 -3.73 0.05 0.00 0.00 0.00 0.00 36.38 32.72 1iax s VAL 244 CO 0.00 0.12 0.93 2.22 0.00 0.00 0.00 175.10 178.37 1iax n PHE 245 N 3.52 0.00 -3.75 5.22 1.16 0.38 -4.65 117.46 119.34 1iax n PHE 245 Ca 0.09 -0.46 -0.05 0.00 -1.87 0.00 0.00 57.45 55.16 1iax n PHE 245 Cb 0.44 -0.06 -0.02 0.00 -1.61 0.00 0.00 39.48 38.23 1iax n PHE 245 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 1iax s ASP 246 N -1.13 -0.23 0.71 5.98 -1.08 -1.15 -4.68 116.67 115.09 1iax s ASP 246 Ca 0.06 -0.42 -0.11 0.00 -0.52 0.00 0.00 52.55 51.56 1iax s ASP 246 Cb 0.05 0.55 0.01 0.00 -1.46 0.00 0.00 42.92 42.08 1iax s ASP 246 CO 0.01 -1.01 1.07 0.42 0.52 0.00 0.00 175.17 176.17 1iax s THR 247 N -3.47 3.89 0.00 1.71 -4.23 -1.26 -4.62 115.64 107.66 1iax s THR 247 Ca 0.11 0.62 0.00 0.00 -1.18 0.00 0.00 61.69 61.23 1iax s THR 247 Cb -0.03 -3.42 0.00 0.00 1.34 0.00 0.00 72.50 70.40 1iax s THR 247 CO 0.02 -0.80 0.00 -2.65 -0.54 0.00 0.00 174.62 170.65 1iax n PRO 248 N -3.12 -1.19 -3.43 3.99 -0.02 -1.26 -4.75 135.00 125.22 1iax n PRO 248 Ca 0.07 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.31 1iax n PRO 248 Cb 0.54 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 34.01 1iax n PRO 248 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1iax s GLN 249 N -2.63 3.48 -0.07 -0.52 0.74 -1.26 -4.99 119.66 114.41 1iax s GLN 249 Ca 0.00 -0.36 -0.30 0.00 0.05 0.00 0.00 55.36 54.75 1iax s GLN 249 Cb 0.00 -2.68 -0.02 0.00 1.10 0.00 0.00 33.01 31.41 1iax s GLN 249 CO 0.00 0.18 1.04 0.12 -0.55 0.00 0.00 175.29 176.08 1iax s PHE 250 N -2.28 3.48 -0.34 1.67 5.36 -1.26 -4.91 117.98 119.70 1iax s PHE 250 Ca 0.39 1.54 -0.06 0.00 -0.96 0.00 0.00 56.93 57.84 1iax s PHE 250 Cb -0.10 -3.22 0.04 0.00 -0.34 0.00 0.00 43.02 39.40 1iax s PHE 250 CO 0.35 -0.41 0.10 0.08 -1.46 0.00 0.00 175.22 173.88 1iax s VAL 251 N 1.85 3.76 0.44 3.12 1.01 -1.26 -4.86 120.40 124.46 1iax s VAL 251 Ca 0.51 -1.12 -0.22 0.00 0.00 0.00 0.00 61.98 61.15 1iax s VAL 251 Cb -0.20 -3.12 -0.10 0.00 0.00 0.00 0.00 36.38 32.96 1iax s VAL 251 CO 0.21 -0.16 1.00 -0.55 0.00 0.00 0.00 175.10 175.59 1iax s SER 252 N 1.40 6.72 0.46 3.32 0.15 -1.26 -4.92 113.70 119.58 1iax s SER 252 Ca -0.02 1.85 0.12 0.00 0.70 0.00 0.00 55.95 58.61 1iax s SER 252 Cb -0.19 -2.56 1.06 0.00 -1.71 0.00 0.00 66.02 62.62 1iax s SER 252 CO 0.03 -0.51 2.08 -0.29 1.20 0.00 0.00 173.24 175.74 1iax h ILE 253 N 1.89 1.07 -0.59 6.45 6.09 -1.98 -0.28 117.51 130.16 1iax h ILE 253 Ca -0.49 -0.22 0.04 0.00 -1.37 0.00 0.00 64.86 62.82 1iax h ILE 253 Cb 1.20 0.91 -0.03 0.00 0.47 0.00 0.00 36.82 39.37 1iax h ILE 253 CO 0.61 0.08 0.39 0.00 -3.07 0.00 0.00 178.15 176.16 1iax h ALA 254 N 1.86 1.71 -0.35 0.18 0.00 -1.98 -0.56 119.26 120.11 1iax h ALA 254 Ca 0.05 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1iax h ALA 254 Cb 0.06 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1iax h ALA 254 CO -0.00 0.23 -0.32 0.93 0.00 0.00 0.00 179.25 180.09 1iax h GLU 255 N 0.67 0.76 -0.57 0.00 5.08 -1.42 -2.89 114.58 116.21 1iax h GLU 255 Ca 0.24 -0.35 -0.06 0.00 -1.00 0.00 0.00 59.36 58.18 1iax h GLU 255 Cb 0.10 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1iax h GLU 255 CO -0.06 0.98 0.12 0.82 -1.00 0.00 0.00 179.01 179.86 1iax h ILE 256 N 0.65 1.24 0.00 3.13 1.08 -0.96 -1.08 117.51 121.57 1iax h ILE 256 Ca 0.07 -0.89 0.00 0.00 -0.39 0.00 0.00 64.86 63.65 1iax h ILE 256 Cb 0.85 0.67 0.00 0.00 -3.07 0.00 0.00 36.82 35.27 1iax h ILE 256 CO 0.07 0.33 0.00 0.18 -0.69 0.00 0.00 178.15 178.05 1iax n LEU 257 N -4.25 0.09 -0.35 1.44 4.77 -0.50 -2.43 117.00 115.77 1iax n LEU 257 Ca 0.04 0.53 0.11 0.00 -0.03 0.00 0.00 56.01 56.66 1iax n LEU 257 Cb 0.25 -0.52 0.08 0.00 -2.33 0.00 0.00 43.42 40.90 1iax n LEU 257 CO 0.41 -0.39 0.34 0.47 -1.33 0.00 0.00 177.39 176.89 1iax n ASP 258 N -1.60 1.58 -4.82 -1.43 8.00 -0.41 -4.81 116.55 113.06 1iax n ASP 258 Ca 0.02 -1.24 -0.34 0.00 0.71 0.00 0.00 54.79 53.94 1iax n ASP 258 Cb 0.12 0.46 -0.07 0.00 -0.02 0.00 0.00 41.12 41.61 1iax n ASP 258 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1iax s GLU 259 N -2.58 4.20 0.24 -1.24 2.02 -1.02 -4.95 118.70 115.37 1iax s GLU 259 Ca 0.18 0.98 -0.06 0.00 0.02 0.00 0.00 54.97 56.09 1iax s GLU 259 Cb 0.18 -2.38 0.29 0.00 0.10 0.00 0.00 34.13 32.32 1iax s GLU 259 CO 0.61 0.10 1.88 0.37 0.02 0.00 0.00 175.26 178.24 1iax h GLN 260 N 2.28 1.09 0.00 1.61 5.75 -1.93 -1.67 115.11 122.24 1iax h GLN 260 Ca -0.48 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 57.95 1iax h GLN 260 Cb 1.18 -0.25 0.00 0.00 1.07 0.00 0.00 27.48 29.48 1iax h GLN 260 CO 0.63 0.72 0.00 -1.91 -2.65 0.00 0.00 178.83 175.62 1iax n GLU 261 N -4.52 0.00 -1.42 1.69 2.13 -1.26 -2.56 120.64 114.70 1iax n GLU 261 Ca 0.12 0.33 0.04 0.00 0.66 0.00 0.00 57.16 58.31 1iax n GLU 261 Cb 0.10 -1.50 0.03 0.00 0.27 0.00 0.00 31.44 30.34 1iax n GLU 261 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 1iax n MET 262 N -1.33 0.07 -0.07 5.31 2.81 -0.64 -4.88 117.12 118.39 1iax n MET 262 Ca 0.00 -2.02 0.02 0.00 -1.81 0.00 0.00 57.70 53.89 1iax n MET 262 Cb 0.00 -0.09 0.34 0.00 -0.71 0.00 0.00 33.22 32.76 1iax n MET 262 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 1iax h THR 263 N 6.72 1.15 -0.16 2.03 2.02 -1.43 -2.71 112.91 120.53 1iax h THR 263 Ca -0.21 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.61 1iax h THR 263 Cb 1.84 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 68.70 1iax h THR 263 CO 0.09 0.16 0.00 -1.22 0.37 0.00 0.00 175.52 174.92 1iax n TYR 264 N -4.42 0.21 -2.57 3.16 4.02 -1.26 -4.84 117.16 111.46 1iax n TYR 264 Ca 0.04 -0.11 -0.42 0.00 -0.01 0.00 0.00 57.90 57.41 1iax n TYR 264 Cb 0.09 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.37 1iax n TYR 264 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1iax s ASN 266 N 0.77 6.25 0.00 0.00 3.84 -1.26 -4.88 114.94 119.65 1iax s ASN 266 Ca 0.54 1.42 0.19 0.00 0.21 0.00 0.00 52.86 55.22 1iax s ASN 266 Cb -0.26 -2.53 1.09 0.00 -0.55 0.00 0.00 41.25 39.00 1iax s ASN 266 CO 0.30 -1.40 1.53 0.29 -2.79 0.00 0.00 177.10 175.03 1iax n LYS 267 N 7.92 0.52 0.19 0.43 5.02 -1.26 -2.71 118.16 128.26 1iax n LYS 267 Ca 0.20 0.03 0.06 0.00 -2.02 0.00 0.00 58.31 56.57 1iax n LYS 267 Cb 0.46 -1.50 0.31 0.00 -0.02 0.00 0.00 35.03 34.28 1iax n LYS 267 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1iax h ASP 268 N 0.00 0.00 -0.65 4.39 3.32 -1.90 -3.25 116.42 118.33 1iax h ASP 268 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1iax h ASP 268 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1iax h ASP 268 CO 0.00 0.36 0.00 0.18 -1.72 0.00 0.00 179.24 178.06 1iax n LEU 269 N -3.44 4.39 -4.34 1.55 4.77 -1.10 -4.56 117.00 114.27 1iax n LEU 269 Ca 0.00 -2.29 -0.32 0.00 -0.03 0.00 0.00 56.01 53.37 1iax n LEU 269 Cb 0.53 -0.53 -0.15 0.00 -2.33 0.00 0.00 43.42 40.94 1iax n LEU 269 CO 0.37 0.86 -0.51 -0.69 -1.33 0.00 0.00 177.39 176.09 1iax s VAL 270 N -1.55 2.54 0.06 4.08 1.01 -1.23 0.73 120.40 126.04 1iax s VAL 270 Ca 0.49 -0.88 -0.10 0.00 0.00 0.00 0.00 61.98 61.48 1iax s VAL 270 Cb 0.29 -1.98 0.01 0.00 0.00 0.00 0.00 36.38 34.70 1iax s VAL 270 CO 0.27 0.56 0.22 -1.00 0.00 0.00 0.00 175.10 175.15 1iax s HIS 271 N -0.14 0.05 -0.05 5.22 3.76 -0.42 -2.41 115.29 121.30 1iax s HIS 271 Ca -0.03 -0.34 0.04 0.00 -0.15 0.00 0.00 55.06 54.58 1iax s HIS 271 Cb -0.14 -0.01 -0.00 0.00 1.11 0.00 0.00 32.58 33.54 1iax s HIS 271 CO 0.04 -0.49 -0.17 0.42 -0.85 0.00 0.00 174.74 173.69 1iax s ILE 272 N -3.05 1.46 -0.15 0.60 1.01 -0.40 -0.58 121.20 120.09 1iax s ILE 272 Ca -0.01 -0.72 -0.01 0.00 0.00 0.00 0.00 60.65 59.91 1iax s ILE 272 Cb 0.01 -1.27 -0.01 0.00 0.01 0.00 0.00 42.46 41.20 1iax s ILE 272 CO -0.07 0.42 -0.10 -0.69 0.00 0.00 0.00 174.94 174.50 1iax s VAL 273 N 0.17 3.19 0.17 2.92 1.01 0.22 -1.10 120.40 126.99 1iax s VAL 273 Ca -0.07 -0.60 -0.02 0.00 0.00 0.00 0.00 61.98 61.29 1iax s VAL 273 Cb -0.13 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 1iax s VAL 273 CO 0.03 0.50 0.12 -0.47 0.00 0.00 0.00 175.10 175.28 1iax s TYR 274 N 0.60 1.00 0.14 5.22 5.04 -0.28 -1.33 117.35 127.73 1iax s TYR 274 Ca -0.06 -1.28 -0.25 0.00 -2.44 0.00 0.00 57.07 53.03 1iax s TYR 274 Cb -0.15 -0.49 0.07 0.00 0.35 0.00 0.00 41.96 41.73 1iax s TYR 274 CO 0.03 -0.61 0.87 0.45 -1.34 0.00 0.00 175.55 174.95 1iax s SER 275 N -3.11 -0.27 0.00 4.32 0.15 -1.26 -0.56 113.70 112.97 1iax s SER 275 Ca 0.32 -0.30 0.19 0.00 0.70 0.00 0.00 55.95 56.86 1iax s SER 275 Cb 0.07 0.51 0.06 0.00 -1.71 0.00 0.00 66.02 64.95 1iax s SER 275 CO 0.08 -0.91 1.01 0.18 1.20 0.00 0.00 173.24 174.80 1iax n LEU 276 N -0.41 2.13 0.27 3.45 4.77 -1.18 -4.60 117.00 121.43 1iax n LEU 276 Ca -0.07 -0.87 -0.16 0.00 -0.03 0.00 0.00 56.01 54.88 1iax n LEU 276 Cb 0.61 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.62 1iax n LEU 276 CO 0.13 0.39 0.63 0.28 -1.33 0.00 0.00 177.39 177.49 1iax h SER 277 N 2.79 -0.92 0.07 -1.43 0.02 -1.85 -3.07 113.55 109.16 1iax h SER 277 Ca 0.00 0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1iax h SER 277 Cb 0.70 0.29 0.00 0.00 0.14 0.00 0.00 62.40 63.54 1iax h SER 277 CO 0.00 -0.52 -0.03 0.11 -1.14 0.00 0.00 176.83 175.25 1iax h LYS 278 N -0.80 -0.09 -4.00 3.45 1.79 -1.82 -2.73 116.57 112.37 1iax h LYS 278 Ca -0.04 0.01 -0.72 0.00 -2.18 0.00 0.00 60.65 57.71 1iax h LYS 278 Cb 0.68 0.02 -0.32 0.00 -1.58 0.00 0.00 32.23 31.03 1iax h LYS 278 CO -0.00 0.45 -0.33 0.16 -1.08 0.00 0.00 179.45 178.64 1iax s ASP 279 N -5.68 5.62 0.00 0.86 1.47 -1.25 -3.78 116.67 113.91 1iax s ASP 279 Ca -0.15 -2.39 0.00 0.00 1.18 0.00 0.00 52.55 51.19 1iax s ASP 279 Cb 0.00 -1.95 0.00 0.00 -0.34 0.00 0.00 42.92 40.63 1iax s ASP 279 CO 0.59 -0.54 0.00 0.23 0.68 0.00 0.00 175.17 176.14 1iax n MET 280 N 4.20 0.00 -3.82 2.11 2.81 -1.20 -4.73 117.12 116.50 1iax n MET 280 Ca 0.02 0.00 -0.25 0.00 -1.81 0.00 0.00 57.70 55.65 1iax n MET 280 Cb 0.41 0.00 0.02 0.00 -0.71 0.00 0.00 33.22 32.94 1iax n MET 280 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1iax n GLY 281 N 0.00 -0.36 2.58 3.03 0.00 -1.04 -4.95 105.19 104.45 1iax n GLY 281 Ca 0.00 0.15 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 1iax n GLY 281 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1iax n LEU 282 N -4.45 2.93 -0.34 0.99 4.77 -1.13 -4.91 117.00 114.86 1iax n LEU 282 Ca -0.16 -5.11 -0.03 0.00 -0.03 0.00 0.00 56.01 50.68 1iax n LEU 282 Cb 0.62 0.01 0.09 0.00 -2.33 0.00 0.00 43.42 41.81 1iax n LEU 282 CO 0.72 2.20 1.24 1.55 -1.33 0.00 0.00 177.39 181.77 1iax h PRO 283 N 2.92 1.24 0.00 3.23 0.13 -1.82 -1.98 132.00 135.72 1iax h PRO 283 Ca 0.12 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1iax h PRO 283 Cb 0.82 -0.27 0.00 0.00 0.13 0.00 0.00 31.00 31.68 1iax h PRO 283 CO 0.68 0.85 0.00 0.41 -0.23 0.00 0.00 178.00 179.70 1iax n GLY 284 N -1.28 -0.18 0.04 1.56 0.00 -1.26 -1.31 105.19 102.75 1iax n GLY 284 Ca 0.10 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.22 1iax n GLY 284 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1iax n PHE 285 N -1.12 0.31 -3.77 1.61 3.01 -0.74 -4.99 117.46 111.78 1iax n PHE 285 Ca 0.01 0.09 -0.23 0.00 1.01 0.00 0.00 57.45 58.33 1iax n PHE 285 Cb 0.01 -0.47 0.02 0.00 -0.01 0.00 0.00 39.48 39.03 1iax n PHE 285 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1iax n ARG 286 N -1.98 -4.72 -3.16 -1.08 5.12 -0.43 -4.76 116.66 105.66 1iax n ARG 286 Ca 0.02 0.58 -0.45 0.00 -1.93 0.00 0.00 57.85 56.07 1iax n ARG 286 Cb 0.43 -5.11 -0.01 0.00 -1.16 0.00 0.00 32.46 26.61 1iax n ARG 286 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1iax s VAL 287 N -3.67 5.43 0.20 1.55 1.01 -1.26 -2.97 120.40 120.69 1iax s VAL 287 Ca 0.09 -2.70 -0.13 0.00 0.00 0.00 0.00 61.98 59.24 1iax s VAL 287 Cb -0.04 -4.70 -0.07 0.00 0.00 0.00 0.00 36.38 31.57 1iax s VAL 287 CO 0.83 -1.33 0.57 -0.83 0.00 0.00 0.00 175.10 174.33 1iax s GLY 288 N 2.31 2.38 -0.03 4.51 0.00 0.85 -3.09 107.32 114.25 1iax s GLY 288 Ca 0.32 -0.16 0.00 0.00 0.00 0.00 0.00 44.72 44.88 1iax s GLY 288 CO -0.06 0.05 0.01 -0.42 0.00 0.00 0.00 173.10 172.68 1iax s ILE 289 N -1.66 0.10 -0.15 0.90 -1.09 0.27 -1.90 121.20 117.67 1iax s ILE 289 Ca 0.43 0.13 -0.00 0.00 -2.23 0.00 0.00 60.65 58.98 1iax s ILE 289 Cb -0.13 -0.21 -0.01 0.00 -1.58 0.00 0.00 42.46 40.54 1iax s ILE 289 CO 0.20 0.12 -0.14 -0.63 -1.23 0.00 0.00 174.94 173.27 1iax s ILE 290 N 1.02 2.86 -0.39 2.92 1.01 0.13 -1.12 121.20 127.63 1iax s ILE 290 Ca -0.10 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 59.86 1iax s ILE 290 Cb -0.13 -2.21 0.12 0.00 0.01 0.00 0.00 42.46 40.24 1iax s ILE 290 CO -0.02 0.51 0.16 -0.47 0.00 0.00 0.00 174.94 175.12 1iax s TYR 291 N 0.70 2.29 -0.06 3.97 5.04 -0.26 -1.95 117.35 127.08 1iax s TYR 291 Ca -0.06 -2.36 -0.05 0.00 -2.44 0.00 0.00 57.07 52.16 1iax s TYR 291 Cb -0.15 -2.09 -0.04 0.00 0.35 0.00 0.00 41.96 40.03 1iax s TYR 291 CO 0.02 -0.84 0.15 0.45 -1.34 0.00 0.00 175.55 173.99 1iax s SER 292 N 0.81 6.29 0.00 4.32 0.15 -1.26 -1.28 113.70 122.73 1iax s SER 292 Ca 0.14 0.38 0.26 0.00 0.70 0.00 0.00 55.95 57.43 1iax s SER 292 Cb -0.21 -1.99 1.18 0.00 -1.71 0.00 0.00 66.02 63.29 1iax s SER 292 CO -0.10 0.34 1.80 0.49 1.20 0.00 0.00 173.24 176.98 1iax n PHE 293 N 1.50 0.05 -3.69 3.44 3.01 -1.01 -4.73 117.46 116.03 1iax n PHE 293 Ca -0.16 -0.02 -0.37 0.00 1.01 0.00 0.00 57.45 57.91 1iax n PHE 293 Cb 0.54 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.90 1iax n PHE 293 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 1iax s ASN 294 N -1.85 5.71 0.34 4.37 3.84 -1.23 -4.54 114.94 121.58 1iax s ASN 294 Ca 0.38 -0.05 0.06 0.00 0.21 0.00 0.00 52.86 53.46 1iax s ASN 294 Cb 0.19 -2.04 0.61 0.00 -0.55 0.00 0.00 41.25 39.46 1iax s ASN 294 CO 0.31 -0.01 1.83 0.44 -2.79 0.00 0.00 177.10 176.88 1iax h ASP 295 N 8.06 0.35 -0.11 -4.21 5.19 -1.92 -1.28 116.42 122.50 1iax h ASP 295 Ca -0.37 -0.09 -0.05 0.00 -0.62 0.00 0.00 57.03 55.90 1iax h ASP 295 Cb 1.18 -0.09 -0.00 0.00 0.18 0.00 0.00 39.33 40.59 1iax h ASP 295 CO 0.59 0.54 -0.13 0.44 -3.12 0.00 0.00 179.24 177.56 1iax h ASP 296 N 0.34 0.31 -0.78 6.45 3.32 -1.97 -1.72 116.42 122.36 1iax h ASP 296 Ca 0.06 -0.49 0.07 0.00 0.02 0.00 0.00 57.03 56.69 1iax h ASP 296 Cb 0.49 -0.09 -0.06 0.00 0.22 0.00 0.00 39.33 39.89 1iax h ASP 296 CO 0.03 0.74 0.45 0.58 -1.72 0.00 0.00 179.24 179.32 1iax h VAL 297 N -0.12 0.96 -0.37 -1.35 2.07 -1.92 0.52 116.25 116.04 1iax h VAL 297 Ca 0.02 -0.27 0.04 0.00 0.82 0.00 0.00 66.70 67.31 1iax h VAL 297 Cb 0.66 0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 1iax h VAL 297 CO 0.03 0.15 0.12 0.58 0.02 0.00 0.00 177.57 178.47 1iax h VAL 298 N 0.80 0.89 -0.14 2.57 2.07 -1.10 0.24 116.25 121.57 1iax h VAL 298 Ca 0.36 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.78 1iax h VAL 298 Cb 0.25 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1iax h VAL 298 CO -0.21 0.05 0.07 0.78 0.02 0.00 0.00 177.57 178.28 1iax h ASN 299 N 0.27 0.18 -0.32 0.57 2.35 -0.19 -1.61 115.58 116.84 1iax h ASN 299 Ca 0.17 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1iax h ASN 299 Cb 0.15 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 1iax h ASN 299 CO -0.17 0.24 0.18 0.00 -1.65 0.00 0.00 177.43 176.02 1iax h ALA 301 N 1.04 1.67 -0.22 0.00 0.00 -0.45 -0.72 119.26 120.59 1iax h ALA 301 Ca 0.11 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1iax h ALA 301 Cb 0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1iax h ALA 301 CO -0.02 0.25 -0.05 0.00 0.00 0.00 0.00 179.25 179.44 1iax h ARG 302 N 0.73 0.42 -0.92 0.00 3.08 -0.71 -1.20 114.38 115.79 1iax h ARG 302 Ca 0.26 -0.16 0.07 0.00 0.07 0.00 0.00 59.98 60.21 1iax h ARG 302 Cb 0.10 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.06 1iax h ARG 302 CO -0.07 0.66 0.58 0.87 -1.07 0.00 0.00 179.97 180.93 1iax h LYS 303 N 0.15 1.01 0.00 0.04 1.57 -0.53 -0.89 116.57 117.92 1iax h LYS 303 Ca 0.06 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1iax h LYS 303 Cb 0.50 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 1iax h LYS 303 CO 0.02 0.67 -0.05 0.52 -0.57 0.00 0.00 179.45 180.04 1iax h MET 304 N 1.04 0.00 0.00 3.15 2.86 -0.82 -3.08 114.93 118.09 1iax h MET 304 Ca 0.40 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.04 1iax h MET 304 Cb 0.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.85 1iax h MET 304 CO -0.18 0.05 0.00 -1.13 1.06 0.00 0.00 176.91 176.71 1iax n SER 305 N -3.18 0.45 0.25 1.22 3.41 -0.34 -1.94 113.62 113.49 1iax n SER 305 Ca 0.00 0.65 0.08 0.00 -0.26 0.00 0.00 58.87 59.34 1iax n SER 305 Cb 0.31 -0.73 0.61 0.00 -0.26 0.00 0.00 64.21 64.14 1iax n SER 305 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1iax h SER 306 N 0.00 0.00 1.33 4.04 4.64 -1.65 -1.73 113.55 120.18 1iax h SER 306 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1iax h SER 306 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 1iax h SER 306 CO 0.00 0.07 -0.23 -0.26 -0.87 0.00 0.00 176.83 175.54 1iax h PHE 307 N 0.00 0.00 -1.46 4.77 0.04 -1.66 -3.38 116.94 115.26 1iax h PHE 307 Ca -0.00 0.00 -0.41 0.00 2.80 0.00 0.00 57.97 60.36 1iax h PHE 307 Cb 0.12 0.00 -0.34 0.00 2.20 0.00 0.00 35.95 37.93 1iax h PHE 307 CO 0.00 0.23 -1.02 0.41 -0.60 0.00 0.00 178.31 177.33 1iax n GLY 308 N 0.65 2.76 3.78 -1.45 0.00 -0.69 -4.95 105.19 105.29 1iax n GLY 308 Ca 0.02 -1.26 -0.39 0.00 0.00 0.00 0.00 46.02 44.38 1iax n GLY 308 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iax s LEU 309 N -2.46 4.58 0.52 0.99 1.43 -0.96 -1.44 118.68 121.34 1iax s LEU 309 Ca 0.35 1.56 -0.22 0.00 -1.03 0.00 0.00 54.13 54.79 1iax s LEU 309 Cb 0.35 -3.21 -0.06 0.00 0.03 0.00 0.00 46.19 43.30 1iax s LEU 309 CO -0.07 0.22 1.27 -0.69 0.23 0.00 0.00 176.35 177.32 1iax s VAL 310 N -1.15 2.49 0.04 -1.59 1.01 -1.26 -4.91 120.40 115.04 1iax s VAL 310 Ca 0.34 0.36 -0.31 0.00 0.00 0.00 0.00 61.98 62.38 1iax s VAL 310 Cb -0.22 -3.18 -0.07 0.00 0.00 0.00 0.00 36.38 32.91 1iax s VAL 310 CO 0.25 -0.01 1.42 -0.55 0.00 0.00 0.00 175.10 176.20 1iax s SER 311 N -1.17 6.82 0.54 3.32 0.15 -1.26 -4.86 113.70 117.24 1iax s SER 311 Ca 0.69 2.21 0.44 0.00 0.70 0.00 0.00 55.95 60.00 1iax s SER 311 Cb -0.35 -2.57 1.65 0.00 -1.71 0.00 0.00 66.02 63.04 1iax s SER 311 CO 0.42 -0.71 1.64 0.71 1.20 0.00 0.00 173.24 176.50 1iax h THR 312 N 4.69 0.13 -0.13 6.45 1.35 -1.90 0.56 112.91 124.06 1iax h THR 312 Ca -0.40 -0.01 -0.05 0.00 -0.55 0.00 0.00 66.41 65.40 1iax h THR 312 Cb 1.19 0.12 -0.00 0.00 -1.73 0.00 0.00 68.15 67.73 1iax h THR 312 CO 0.89 0.00 -0.13 -0.61 -0.25 0.00 0.00 175.52 175.42 1iax h GLN 313 N 0.02 0.32 -0.12 4.72 4.15 -1.89 -1.16 115.11 121.15 1iax h GLN 313 Ca 0.82 -0.17 -0.08 0.00 0.77 0.00 0.00 58.65 59.99 1iax h GLN 313 Cb 3.20 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 30.89 1iax h GLN 313 CO -0.07 0.72 -0.29 1.15 -1.93 0.00 0.00 178.83 178.41 1iax h THR 314 N -0.07 1.26 0.18 2.39 2.02 -0.35 -2.08 112.91 116.25 1iax h THR 314 Ca 0.02 -1.22 -0.01 0.00 0.77 0.00 0.00 66.41 65.98 1iax h THR 314 Cb 0.66 1.49 0.00 0.00 -1.74 0.00 0.00 68.15 68.56 1iax h THR 314 CO 0.03 0.37 -0.09 1.56 0.37 0.00 0.00 175.52 177.76 1iax h GLN 315 N 0.20 -0.23 0.25 6.66 4.20 -0.92 -0.96 115.11 124.31 1iax h GLN 315 Ca 0.03 0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.76 1iax h GLN 315 Cb 0.63 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.43 1iax h GLN 315 CO 0.05 0.01 -0.41 -0.92 -0.67 0.00 0.00 178.83 176.89 1iax h TYR 316 N -0.46 -1.12 -0.23 2.96 3.20 -1.05 0.13 116.97 120.39 1iax h TYR 316 Ca -0.02 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.91 1iax h TYR 316 Cb 0.36 0.46 -0.07 0.00 1.54 0.00 0.00 36.73 39.01 1iax h TYR 316 CO -0.00 -0.53 -0.45 0.35 -1.64 0.00 0.00 178.16 175.89 1iax h PHE 317 N -0.72 -1.31 -0.90 -3.82 3.57 -1.39 -1.86 116.94 110.51 1iax h PHE 317 Ca -0.00 0.06 0.02 0.00 3.53 0.00 0.00 57.97 61.58 1iax h PHE 317 Cb 0.70 0.60 -0.05 0.00 2.79 0.00 0.00 35.95 39.99 1iax h PHE 317 CO -0.30 -0.48 0.59 -0.07 -2.23 0.00 0.00 178.31 175.83 1iax h LEU 318 N -0.45 1.00 -0.88 0.59 3.38 -0.91 -1.34 115.31 116.69 1iax h LEU 318 Ca 0.09 -0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.14 1iax h LEU 318 Cb 0.62 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 41.06 1iax h LEU 318 CO -0.47 0.70 0.52 0.00 0.09 0.00 0.00 178.44 179.29 1iax h ALA 319 N 1.35 1.27 -0.36 1.53 0.00 -0.20 0.29 119.26 123.15 1iax h ALA 319 Ca 0.35 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.16 1iax h ALA 319 Cb -0.06 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1iax h ALA 319 CO -0.10 0.16 -0.27 0.00 0.00 0.00 0.00 179.25 179.04 1iax h ALA 320 N 1.47 0.85 0.02 0.00 0.00 -0.53 -2.29 119.26 118.79 1iax h ALA 320 Ca 0.42 -0.39 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1iax h ALA 320 Cb 0.38 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.03 1iax h ALA 320 CO -0.25 0.64 -0.38 1.98 0.00 0.00 0.00 179.25 181.24 1iax h MET 321 N 0.65 0.22 0.00 0.00 -1.53 -0.18 -3.30 114.93 110.79 1iax h MET 321 Ca 0.08 -0.27 0.00 0.00 -3.44 0.00 0.00 59.70 56.08 1iax h MET 321 Cb 0.78 0.08 0.00 0.00 -0.55 0.00 0.00 31.60 31.91 1iax h MET 321 CO 0.06 1.02 0.00 1.28 0.14 0.00 0.00 176.91 179.41 1iax n LEU 322 N -4.40 0.00 -0.96 3.39 4.77 0.92 -2.36 117.00 118.35 1iax n LEU 322 Ca -0.11 0.45 0.08 0.00 -0.03 0.00 0.00 56.01 56.40 1iax n LEU 322 Cb 0.59 -0.45 0.22 0.00 -2.33 0.00 0.00 43.42 41.45 1iax n LEU 322 CO 0.42 -0.11 0.68 -1.20 -1.33 0.00 0.00 177.39 175.84 1iax n SER 323 N -1.45 2.79 -4.14 -1.43 7.64 -0.86 -4.65 113.62 111.52 1iax n SER 323 Ca 0.06 -2.06 -0.38 0.00 1.01 0.00 0.00 58.87 57.50 1iax n SER 323 Cb 0.24 -0.36 -0.07 0.00 -1.01 0.00 0.00 64.21 63.00 1iax n SER 323 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1iax s ASP 324 N -0.95 5.69 0.30 6.43 -1.08 -1.00 -4.95 116.67 121.11 1iax s ASP 324 Ca 0.33 -3.08 0.04 0.00 -0.52 0.00 0.00 52.55 49.33 1iax s ASP 324 Cb 0.18 -1.93 0.78 0.00 -1.46 0.00 0.00 42.92 40.49 1iax s ASP 324 CO 0.21 -0.35 1.64 -0.33 0.52 0.00 0.00 175.17 176.86 1iax h GLU 325 N 6.86 0.19 -0.25 4.34 5.08 -1.86 0.17 114.58 129.11 1iax h GLU 325 Ca 0.05 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1iax h GLU 325 Cb 0.93 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 1iax h GLU 325 CO 0.76 0.13 0.06 -0.22 -1.00 0.00 0.00 179.01 178.73 1iax h LYS 326 N 0.20 0.40 0.25 2.33 3.64 -1.96 0.20 116.57 121.63 1iax h LYS 326 Ca 0.59 -0.10 -0.01 0.00 -1.27 0.00 0.00 60.65 59.86 1iax h LYS 326 Cb 1.23 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1iax h LYS 326 CO -0.68 0.51 -0.14 0.35 -2.27 0.00 0.00 179.45 177.22 1iax h PHE 327 N 0.23 -0.37 -0.72 1.91 3.57 -1.42 -0.76 116.94 119.37 1iax h PHE 327 Ca 0.08 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.65 1iax h PHE 327 Cb 0.29 0.13 -0.06 0.00 2.79 0.00 0.00 35.95 39.10 1iax h PHE 327 CO 0.01 -0.23 0.40 0.28 -2.23 0.00 0.00 178.31 176.55 1iax h VAL 328 N -0.37 0.94 0.19 1.41 2.07 -0.61 0.39 116.25 120.26 1iax h VAL 328 Ca -0.03 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1iax h VAL 328 Cb 0.31 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1iax h VAL 328 CO 0.03 0.13 -0.09 0.44 0.02 0.00 0.00 177.57 178.10 1iax h ASP 329 N 0.71 -0.22 -0.80 0.57 3.32 -0.38 -1.93 116.42 117.70 1iax h ASP 329 Ca 0.34 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1iax h ASP 329 Cb 0.26 0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.83 1iax h ASP 329 CO -0.21 0.07 0.47 -1.13 -1.72 0.00 0.00 179.24 176.71 1iax h ASN 330 N -0.50 0.97 0.72 6.45 -1.24 -0.85 -0.75 115.58 120.37 1iax h ASN 330 Ca -0.03 -0.06 -0.03 0.00 0.71 0.00 0.00 56.30 56.89 1iax h ASN 330 Cb 0.38 -0.25 0.01 0.00 0.73 0.00 0.00 38.32 39.19 1iax h ASN 330 CO 0.04 0.76 -0.35 0.15 -1.29 0.00 0.00 177.43 176.74 1iax h PHE 331 N 1.11 -0.91 -0.84 0.67 3.57 -0.12 0.31 116.94 120.73 1iax h PHE 331 Ca 0.29 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.80 1iax h PHE 331 Cb -0.02 0.30 -0.05 0.00 2.79 0.00 0.00 35.95 38.97 1iax h PHE 331 CO 0.01 -0.56 0.54 -0.07 -2.23 0.00 0.00 178.31 175.99 1iax h LEU 332 N -0.97 0.91 -0.24 0.59 3.38 -1.21 0.17 115.31 117.93 1iax h LEU 332 Ca -0.10 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1iax h LEU 332 Cb 0.75 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1iax h LEU 332 CO 0.16 0.63 0.01 -0.09 0.09 0.00 0.00 178.44 179.23 1iax h ARG 333 N 1.06 0.42 -0.63 1.13 2.43 -0.98 -2.61 114.38 115.21 1iax h ARG 333 Ca 0.33 -0.13 -0.07 0.00 -0.81 0.00 0.00 59.98 59.30 1iax h ARG 333 Cb -0.01 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.47 1iax h ARG 333 CO -0.11 0.59 0.11 0.93 -1.51 0.00 0.00 179.97 179.98 1iax h GLU 334 N 0.20 1.04 -0.40 0.20 4.39 0.01 -2.89 114.58 117.14 1iax h GLU 334 Ca 0.07 -0.27 0.03 0.00 0.34 0.00 0.00 59.36 59.52 1iax h GLU 334 Cb 0.40 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.89 1iax h GLU 334 CO 0.01 0.96 0.21 1.03 -1.16 0.00 0.00 179.01 180.06 1iax h SER 335 N 0.95 0.31 -0.69 1.42 0.87 -0.63 -0.86 113.55 114.92 1iax h SER 335 Ca 0.19 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.78 1iax h SER 335 Cb 0.42 -0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.30 1iax h SER 335 CO 0.01 0.22 0.46 0.00 -0.53 0.00 0.00 176.83 176.99 1iax h ALA 336 N 1.20 1.53 0.00 6.23 0.00 -1.33 0.23 119.26 127.12 1iax h ALA 336 Ca 0.17 -0.05 -0.25 0.00 0.00 0.00 0.00 54.91 54.78 1iax h ALA 336 Cb 0.06 -0.27 0.02 0.00 0.00 0.00 0.00 17.79 17.60 1iax h ALA 336 CO -0.11 0.43 -0.98 0.52 0.00 0.00 0.00 179.25 179.11 1iax h MET 337 N 0.91 0.66 -0.28 0.00 2.07 -1.21 -1.57 114.93 115.53 1iax h MET 337 Ca 0.26 -0.71 -0.09 0.00 -2.07 0.00 0.00 59.70 57.08 1iax h MET 337 Cb -0.08 0.20 -0.01 0.00 -1.87 0.00 0.00 31.60 29.85 1iax h MET 337 CO -0.06 1.30 -0.19 0.00 1.07 0.00 0.00 176.91 179.03 1iax h ARG 338 N 0.32 0.62 -0.05 1.72 3.08 -0.97 0.29 114.38 119.37 1iax h ARG 338 Ca -0.12 -0.30 -0.05 0.00 0.07 0.00 0.00 59.98 59.58 1iax h ARG 338 Cb 1.64 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.68 1iax h ARG 338 CO 0.19 0.89 -0.20 -0.07 -1.07 0.00 0.00 179.97 179.71 1iax h LEU 339 N 0.35 0.08 -0.18 3.04 3.38 -1.04 -1.15 115.31 119.79 1iax h LEU 339 Ca 0.05 -0.02 -0.18 0.00 0.09 0.00 0.00 57.88 57.82 1iax h LEU 339 Cb 0.73 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.47 1iax h LEU 339 CO 0.05 0.29 -0.61 1.23 0.09 0.00 0.00 178.44 179.50 1iax h GLY 340 N 0.72 0.81 0.90 0.83 0.00 -0.79 -0.86 103.07 104.68 1iax h GLY 340 Ca 0.01 -1.06 -0.05 0.00 0.00 0.00 0.00 47.33 46.23 1iax h GLY 340 CO 0.03 0.95 -0.01 1.70 0.00 0.00 0.00 176.54 179.21 1iax h LYS 341 N 0.45 0.57 0.20 4.80 3.64 -0.14 -2.65 116.57 123.44 1iax h LYS 341 Ca -0.02 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.16 1iax h LYS 341 Cb 1.23 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1iax h LYS 341 CO 0.13 0.71 -0.10 -0.09 -2.27 0.00 0.00 179.45 177.83 1iax h ARG 342 N 0.37 -0.26 -0.40 1.90 9.65 -1.26 -1.68 114.38 122.70 1iax h ARG 342 Ca 0.09 0.02 0.08 0.00 -1.10 0.00 0.00 59.98 59.07 1iax h ARG 342 Cb 0.45 0.06 -0.07 0.00 -1.39 0.00 0.00 29.97 29.02 1iax h ARG 342 CO 0.02 0.04 -0.05 1.25 2.80 0.00 0.00 179.97 184.02 1iax h HIS 343 N -0.57 -0.12 0.25 2.20 2.76 -1.21 0.25 115.15 118.72 1iax h HIS 343 Ca -0.03 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.16 1iax h HIS 343 Cb 0.42 0.11 0.00 0.00 1.55 0.00 0.00 27.41 29.50 1iax h HIS 343 CO 0.02 -0.13 -0.12 0.87 -1.30 0.00 0.00 177.93 177.27 1iax h LYS 344 N 0.05 -0.33 -0.66 5.26 6.56 -1.51 0.33 116.57 126.28 1iax h LYS 344 Ca 0.20 0.02 0.12 0.00 -1.06 0.00 0.00 60.65 59.93 1iax h LYS 344 Cb 0.29 0.07 -0.09 0.00 -0.57 0.00 0.00 32.23 31.94 1iax h LYS 344 CO -0.37 -0.15 0.20 1.25 -2.06 0.00 0.00 179.45 178.31 1iax h HIS 345 N -0.43 0.33 -0.56 -1.35 2.76 -0.90 0.73 115.15 115.73 1iax h HIS 345 Ca -0.03 0.04 -0.08 0.00 -2.20 0.00 0.00 60.37 58.09 1iax h HIS 345 Cb 0.33 -0.05 -0.02 0.00 1.55 0.00 0.00 27.41 29.22 1iax h HIS 345 CO -0.03 0.02 0.06 0.35 -1.30 0.00 0.00 177.93 177.02 1iax h PHE 346 N 0.34 1.03 -0.24 5.26 3.57 -0.20 -1.90 116.94 124.80 1iax h PHE 346 Ca 0.35 -0.16 -0.20 0.00 3.53 0.00 0.00 57.97 61.49 1iax h PHE 346 Cb 0.51 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.98 1iax h PHE 346 CO -0.21 0.91 -0.63 1.15 -2.23 0.00 0.00 178.31 177.30 1iax h THR 347 N 0.84 1.28 0.00 4.41 2.02 0.14 -2.51 112.91 119.10 1iax h THR 347 Ca 0.17 -1.82 -0.02 0.00 0.77 0.00 0.00 66.41 65.51 1iax h THR 347 Cb 0.47 1.75 -0.00 0.00 -1.74 0.00 0.00 68.15 68.63 1iax h THR 347 CO 0.02 0.59 -0.08 0.78 0.37 0.00 0.00 175.52 177.20 1iax h ASN 348 N 0.62 0.00 -0.05 4.18 2.35 0.60 -0.84 115.58 122.43 1iax h ASN 348 Ca -0.01 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.63 1iax h ASN 348 Cb 1.24 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.62 1iax h ASN 348 CO 0.13 0.08 -0.40 1.23 -1.65 0.00 0.00 177.43 176.82 1iax h GLY 349 N 0.36 0.40 2.00 2.83 0.00 -1.15 -2.43 103.07 105.07 1iax h GLY 349 Ca -0.00 -0.60 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 1iax h GLY 349 CO 0.01 0.53 -0.07 1.41 0.00 0.00 0.00 176.54 178.42 1iax h LEU 350 N -0.15 0.00 0.00 3.11 3.38 -0.92 -1.64 115.31 119.09 1iax h LEU 350 Ca -0.04 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.72 1iax h LEU 350 Cb 1.08 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.80 1iax h LEU 350 CO 0.08 0.07 -1.16 -0.08 0.09 0.00 0.00 178.44 177.44 1iax h GLU 351 N 0.00 0.00 -0.74 1.13 4.81 -0.95 0.45 114.58 119.28 1iax h GLU 351 Ca -0.00 0.00 0.16 0.00 -0.13 0.00 0.00 59.36 59.39 1iax h GLU 351 Cb 0.30 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.64 1iax h GLU 351 CO 0.01 0.71 0.50 0.28 -0.73 0.00 0.00 179.01 179.78 1iax h VAL 352 N 0.00 0.77 -0.54 0.32 2.07 -0.78 0.12 116.25 118.21 1iax h VAL 352 Ca -0.10 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.30 1iax h VAL 352 Cb 1.76 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.92 1iax h VAL 352 CO 0.10 0.06 0.00 1.33 0.02 0.00 0.00 177.57 179.08 1iax n VAL 353 N -4.46 1.44 0.00 2.57 0.24 -1.20 -4.96 118.33 111.95 1iax n VAL 353 Ca 0.14 -1.17 0.00 0.00 -2.04 0.00 0.00 64.34 61.27 1iax n VAL 353 Cb 0.57 0.29 0.00 0.00 -1.47 0.00 0.00 33.84 33.22 1iax n VAL 353 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1iax n GLY 354 N 0.89 3.07 3.69 7.63 0.00 0.40 -5.02 105.19 115.86 1iax n GLY 354 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1iax n GLY 354 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iax s ILE 355 N -1.90 2.99 0.25 -0.61 1.01 0.16 -4.84 121.20 118.26 1iax s ILE 355 Ca 0.00 0.46 0.12 0.00 0.00 0.00 0.00 60.65 61.23 1iax s ILE 355 Cb 0.00 -3.30 -0.05 0.00 0.01 0.00 0.00 42.46 39.12 1iax s ILE 355 CO 0.00 0.00 -0.20 -0.54 0.00 0.00 0.00 174.94 174.20 1iax s LYS 356 N 2.56 1.67 0.41 2.79 1.02 -1.26 -2.67 119.74 124.27 1iax s LYS 356 Ca 0.74 -1.67 0.04 0.00 0.02 0.00 0.00 55.97 55.10 1iax s LYS 356 Cb -0.40 -1.82 -0.05 0.00 -0.52 0.00 0.00 37.83 35.04 1iax s LYS 356 CO 0.32 0.35 0.04 0.00 -0.92 0.00 0.00 175.35 175.15 1iax s LEU 358 N -3.67 3.99 -0.17 0.00 2.96 -0.58 -4.92 118.68 116.28 1iax s LEU 358 Ca 0.26 2.33 -0.29 0.00 -0.22 0.00 0.00 54.13 56.21 1iax s LEU 358 Cb 0.06 -4.26 -0.00 0.00 0.50 0.00 0.00 46.19 42.48 1iax s LEU 358 CO 0.13 -0.98 1.09 -0.75 -1.32 0.00 0.00 176.35 174.52 1iax s LYS 359 N -2.74 4.30 0.11 1.98 2.20 -1.26 -4.66 119.74 119.66 1iax s LYS 359 Ca 0.65 1.46 0.02 0.00 -0.36 0.00 0.00 55.97 57.74 1iax s LYS 359 Cb -0.29 -3.63 -0.04 0.00 -1.51 0.00 0.00 37.83 32.35 1iax s LYS 359 CO 0.35 -0.56 -0.07 0.54 -0.36 0.00 0.00 175.35 175.25 1iax s ASN 360 N 1.36 1.23 0.00 1.43 4.22 -1.26 -4.91 114.94 117.00 1iax s ASN 360 Ca 0.48 -1.01 0.00 0.00 -2.14 0.00 0.00 52.86 50.19 1iax s ASN 360 Cb -0.18 0.08 0.00 0.00 1.28 0.00 0.00 41.25 42.43 1iax s ASN 360 CO 0.12 -0.45 0.74 -0.46 -2.04 0.00 0.00 177.10 175.01 1iax n ASN 361 N -0.07 1.15 -1.88 3.54 6.94 -1.19 -4.93 115.26 118.82 1iax n ASN 361 Ca -0.12 -1.53 -0.07 0.00 -0.02 0.00 0.00 54.58 52.84 1iax n ASN 361 Cb 0.61 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 38.01 1iax n ASN 361 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1iax n ALA 362 N -0.26 0.01 0.00 -2.53 0.00 -0.72 0.14 120.51 117.15 1iax n ALA 362 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.71 1iax n ALA 362 Cb 0.31 0.59 0.00 0.00 0.00 0.00 0.00 19.45 20.35 1iax n ALA 362 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iax n GLY 363 N -0.25 -2.24 1.90 0.00 0.00 -1.23 -4.59 105.19 98.78 1iax n GLY 363 Ca 0.01 -1.52 -0.07 0.00 0.00 0.00 0.00 46.02 44.45 1iax n GLY 363 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1iax n LEU 364 N 0.00 2.90 -3.78 0.99 4.77 -1.26 -4.91 117.00 115.71 1iax n LEU 364 Ca 0.00 -3.65 0.01 0.00 -0.03 0.00 0.00 56.01 52.34 1iax n LEU 364 Cb 0.00 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1iax n LEU 364 CO 0.00 1.40 1.00 0.72 -1.33 0.00 0.00 177.39 179.18 1iax s PHE 365 N -3.02 -0.02 0.06 -1.77 -0.12 -1.26 -2.62 117.98 109.23 1iax s PHE 365 Ca 0.39 -0.16 0.02 0.00 -0.05 0.00 0.00 56.93 57.13 1iax s PHE 365 Cb 0.37 0.58 -0.03 0.00 -0.63 0.00 0.00 43.02 43.32 1iax s PHE 365 CO -0.04 -0.43 -0.08 0.00 -0.05 0.00 0.00 175.22 174.63 1iax s TRP 367 N -1.88 3.21 0.06 0.00 -0.00 -1.26 -2.11 118.94 116.96 1iax s TRP 367 Ca -0.05 -1.71 -0.31 0.00 -0.00 0.00 0.00 56.10 54.03 1iax s TRP 367 Cb -0.07 -4.38 -0.07 0.00 -0.00 0.00 0.00 33.47 28.96 1iax s TRP 367 CO -0.01 -1.51 1.38 1.41 -0.00 0.00 0.00 176.95 178.21 1iax s MET 368 N 2.51 4.32 -0.54 5.86 -2.45 0.47 -1.53 119.30 127.94 1iax s MET 368 Ca 0.40 1.99 -0.18 0.00 -1.25 0.00 0.00 55.69 56.66 1iax s MET 368 Cb -0.03 -3.41 0.09 0.00 1.25 0.00 0.00 34.83 32.73 1iax s MET 368 CO -0.03 -0.48 0.60 0.34 1.05 0.00 0.00 175.02 176.49 1iax s ASP 369 N 1.46 6.19 -0.36 1.11 2.15 -0.73 -0.81 116.67 125.68 1iax s ASP 369 Ca 0.64 -1.31 0.07 0.00 0.43 0.00 0.00 52.55 52.37 1iax s ASP 369 Cb -0.34 -2.26 0.54 0.00 -0.30 0.00 0.00 42.92 40.56 1iax s ASP 369 CO 0.29 -0.93 1.61 0.18 -0.17 0.00 0.00 175.17 176.14 1iax n LEU 370 N 5.93 5.11 -0.20 -1.34 4.77 0.94 -4.51 117.00 127.70 1iax n LEU 370 Ca -0.10 -3.85 -0.03 0.00 -0.03 0.00 0.00 56.01 52.00 1iax n LEU 370 Cb 0.43 -0.70 0.17 0.00 -2.33 0.00 0.00 43.42 40.99 1iax n LEU 370 CO 0.55 1.29 1.07 0.03 -1.33 0.00 0.00 177.39 179.00 1iax h ARG 371 N 1.15 0.98 0.00 3.23 3.08 -1.85 -2.63 114.38 118.34 1iax h ARG 371 Ca 0.37 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1iax h ARG 371 Cb 1.90 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.77 1iax h ARG 371 CO 0.69 0.79 0.00 -0.35 -1.07 0.00 0.00 179.97 180.02 1iax n PRO 372 N -4.31 0.37 0.00 0.04 -0.04 -1.26 -2.23 135.00 127.56 1iax n PRO 372 Ca 0.06 0.08 0.11 0.00 -0.04 0.00 0.00 63.50 63.71 1iax n PRO 372 Cb 0.16 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.17 1iax n PRO 372 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1iax n LEU 373 N -1.22 1.92 -4.90 1.53 4.77 -0.99 -4.97 117.00 113.15 1iax n LEU 373 Ca 0.11 -0.70 -0.29 0.00 -0.03 0.00 0.00 56.01 55.10 1iax n LEU 373 Cb 0.13 -0.02 0.10 0.00 -2.33 0.00 0.00 43.42 41.31 1iax n LEU 373 CO 0.14 0.36 0.79 -0.76 -1.33 0.00 0.00 177.39 176.59 1iax s LEU 374 N -2.47 2.49 -0.08 2.23 1.43 -0.95 -5.02 118.68 116.31 1iax s LEU 374 Ca 0.19 0.74 0.10 0.00 -1.03 0.00 0.00 54.13 54.14 1iax s LEU 374 Cb 0.18 -3.19 -0.14 0.00 0.03 0.00 0.00 46.19 43.07 1iax s LEU 374 CO 0.56 -2.01 0.09 0.54 0.23 0.00 0.00 176.35 175.76 1iax n ARG 375 N -3.38 1.78 -3.67 1.70 5.12 -1.26 -5.02 116.66 111.92 1iax n ARG 375 Ca 0.09 -0.03 -0.15 0.00 -1.93 0.00 0.00 57.85 55.83 1iax n ARG 375 Cb 0.61 -1.27 -0.08 0.00 -1.16 0.00 0.00 32.46 30.56 1iax n ARG 375 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1iax s GLU 376 N -2.39 0.74 -0.98 5.56 2.02 -1.26 -5.04 118.70 117.35 1iax s GLU 376 Ca -0.05 0.32 -0.06 0.00 0.02 0.00 0.00 54.97 55.20 1iax s GLU 376 Cb 0.04 0.35 -0.07 0.00 0.10 0.00 0.00 34.13 34.55 1iax s GLU 376 CO 0.44 -0.17 2.36 0.43 0.02 0.00 0.00 175.26 178.34 1iax n SER 377 N 1.85 5.65 -4.05 -0.19 7.64 -1.26 -4.56 113.62 118.70 1iax n SER 377 Ca -0.17 -2.36 -0.20 0.00 1.01 0.00 0.00 58.87 57.15 1iax n SER 377 Cb 0.56 -1.19 -0.15 0.00 -1.01 0.00 0.00 64.21 62.43 1iax n SER 377 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1iax s THR 378 N 2.94 0.85 -0.98 0.44 -4.23 -1.26 -4.82 115.64 108.57 1iax s THR 378 Ca 0.47 -0.46 0.00 0.00 -1.18 0.00 0.00 61.69 60.52 1iax s THR 378 Cb 0.13 -0.71 0.00 0.00 1.34 0.00 0.00 72.50 73.26 1iax s THR 378 CO -0.04 0.24 0.98 0.49 -0.54 0.00 0.00 174.62 175.75 1iax n PHE 379 N 2.85 0.00 0.22 3.99 3.72 -1.26 0.23 117.46 127.20 1iax n PHE 379 Ca -0.14 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.38 1iax n PHE 379 Cb 0.56 -0.48 0.21 0.00 -0.94 0.00 0.00 39.48 38.83 1iax n PHE 379 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1iax h ASP 380 N 0.00 0.00 0.27 4.37 3.32 -1.95 -2.04 116.42 120.39 1iax h ASP 380 Ca 0.00 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.71 1iax h ASP 380 Cb 0.03 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1iax h ASP 380 CO 0.00 0.04 -1.84 0.28 -1.72 0.00 0.00 179.24 175.99 1iax h SER 381 N 0.00 0.31 -0.54 6.45 0.02 -0.47 -3.06 113.55 116.26 1iax h SER 381 Ca -0.00 -0.64 -0.00 0.00 -0.84 0.00 0.00 61.79 60.31 1iax h SER 381 Cb 0.98 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 63.39 1iax h SER 381 CO 0.00 1.57 0.32 -0.08 -1.14 0.00 0.00 176.83 177.50 1iax h GLU 382 N 0.05 0.74 -0.03 3.45 4.81 -1.45 -0.22 114.58 121.94 1iax h GLU 382 Ca -0.36 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 58.71 1iax h GLU 382 Cb 2.03 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 31.24 1iax h GLU 382 CO 0.10 0.54 -0.41 0.52 -0.73 0.00 0.00 179.01 179.04 1iax h MET 383 N 0.73 0.06 -0.06 1.92 2.86 -1.50 0.53 114.93 119.47 1iax h MET 383 Ca 0.19 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.80 1iax h MET 383 Cb -0.01 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.65 1iax h MET 383 CO -0.04 0.46 -0.01 1.03 1.06 0.00 0.00 176.91 179.42 1iax h SER 384 N 0.05 0.12 -0.44 1.22 0.87 -1.31 -2.08 113.55 111.97 1iax h SER 384 Ca 0.00 -0.34 -0.04 0.00 -1.23 0.00 0.00 61.79 60.18 1iax h SER 384 Cb 0.75 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.66 1iax h SER 384 CO 0.06 0.43 0.12 0.25 -0.53 0.00 0.00 176.83 177.16 1iax h LEU 385 N -0.20 0.66 -0.58 2.23 5.85 -0.77 -2.83 115.31 119.68 1iax h LEU 385 Ca 0.02 -0.22 0.11 0.00 0.84 0.00 0.00 57.88 58.63 1iax h LEU 385 Cb 0.38 -0.17 -0.09 0.00 0.37 0.00 0.00 40.66 41.14 1iax h LEU 385 CO 0.00 0.71 0.06 -0.25 -0.34 0.00 0.00 178.44 178.63 1iax h TRP 386 N 0.58 0.08 -0.26 1.25 7.01 0.24 -0.42 115.95 124.43 1iax h TRP 386 Ca 0.14 0.04 0.02 0.00 2.11 0.00 0.00 58.89 61.20 1iax h TRP 386 Cb 0.30 0.05 -0.03 0.00 -2.10 0.00 0.00 29.16 27.38 1iax h TRP 386 CO 0.02 -0.09 0.10 0.00 -2.79 0.00 0.00 178.44 175.68 1iax h ARG 387 N 0.19 0.22 -0.55 2.65 2.47 -1.20 -0.59 114.38 117.56 1iax h ARG 387 Ca 0.30 -0.01 0.10 0.00 -1.26 0.00 0.00 59.98 59.10 1iax h ARG 387 Cb 0.46 -0.05 -0.08 0.00 -1.65 0.00 0.00 29.97 28.66 1iax h ARG 387 CO -0.44 0.15 0.13 0.28 0.56 0.00 0.00 179.97 180.65 1iax h VAL 388 N 0.23 0.70 -0.58 2.04 2.07 -0.98 0.00 116.25 119.73 1iax h VAL 388 Ca 0.11 -0.09 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 1iax h VAL 388 Cb 0.07 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 1iax h VAL 388 CO -0.11 0.05 0.22 0.40 0.02 0.00 0.00 177.57 178.16 1iax h ILE 389 N 0.27 1.21 -0.03 4.57 2.04 -0.51 -1.99 117.51 123.07 1iax h ILE 389 Ca 0.28 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1iax h ILE 389 Cb 0.39 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1iax h ILE 389 CO -0.35 0.26 0.00 2.30 0.00 0.00 0.00 178.15 180.36 1iax n ILE 390 N -4.32 0.02 0.03 -0.67 -5.35 -0.29 -1.38 119.36 107.40 1iax n ILE 390 Ca 0.05 -0.36 0.00 0.00 -0.27 0.00 0.00 62.75 62.17 1iax n ILE 390 Cb 0.17 0.89 0.00 0.00 -1.74 0.00 0.00 39.64 38.95 1iax n ILE 390 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1iax n ASN 391 N 0.65 0.58 0.02 7.28 3.02 -0.14 -4.48 115.26 122.19 1iax n ASN 391 Ca 0.17 0.08 -0.10 0.00 -0.03 0.00 0.00 54.58 54.70 1iax n ASN 391 Cb 0.45 -0.17 -0.13 0.00 -0.61 0.00 0.00 39.78 39.31 1iax n ASN 391 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1iax h ASP 392 N 0.00 0.07 0.71 6.41 3.32 -1.57 -3.31 116.42 122.06 1iax h ASP 392 Ca 0.00 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1iax h ASP 392 Cb 0.46 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1iax h ASP 392 CO 0.00 1.09 -1.11 0.52 -1.72 0.00 0.00 179.24 178.02 1iax n VAL 393 N -3.22 0.40 -3.24 -1.35 0.31 -0.91 -4.98 118.33 105.34 1iax n VAL 393 Ca -0.11 -0.44 -0.21 0.00 -0.01 0.00 0.00 64.34 63.56 1iax n VAL 393 Cb 1.01 -0.14 0.05 0.00 -0.91 0.00 0.00 33.84 33.85 1iax n VAL 393 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1iax n LYS 394 N -2.39 -6.00 -4.63 5.55 4.76 -1.00 -4.93 118.16 109.52 1iax n LYS 394 Ca 0.00 0.80 -0.33 0.00 -2.87 0.00 0.00 58.31 55.92 1iax n LYS 394 Cb 0.51 -5.59 -0.16 0.00 -1.84 0.00 0.00 35.03 27.95 1iax n LYS 394 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1iax s LEU 395 N -6.52 2.16 -0.49 -0.35 1.43 -0.48 -0.53 118.68 113.91 1iax s LEU 395 Ca 0.41 -0.59 -0.20 0.00 -1.03 0.00 0.00 54.13 52.73 1iax s LEU 395 Cb -0.18 -1.46 0.05 0.00 0.03 0.00 0.00 46.19 44.62 1iax s LEU 395 CO 0.51 0.08 0.64 0.21 0.23 0.00 0.00 176.35 178.03 1iax s ASN 396 N 0.84 6.25 0.00 2.29 2.47 0.26 -3.70 114.94 123.35 1iax s ASN 396 Ca -0.06 -0.73 0.00 0.00 0.42 0.00 0.00 52.86 52.49 1iax s ASN 396 Cb -0.15 -2.30 0.00 0.00 -1.45 0.00 0.00 41.25 37.34 1iax s ASN 396 CO -0.02 -0.88 0.00 1.33 -3.72 0.00 0.00 177.10 173.81 1iax n VAL 397 N 5.71 0.00 -5.01 -5.21 0.24 -1.26 -1.21 118.33 111.58 1iax n VAL 397 Ca -0.05 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 61.96 1iax n VAL 397 Cb 0.46 -0.11 -0.17 0.00 -1.47 0.00 0.00 33.84 32.55 1iax n VAL 397 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1iax s SER 398 N -0.71 2.62 -0.02 -1.34 0.01 -0.96 -4.79 113.70 108.52 1iax s SER 398 Ca 0.00 -0.46 -0.30 0.00 1.31 0.00 0.00 55.95 56.50 1iax s SER 398 Cb 0.00 -1.04 -0.03 0.00 0.21 0.00 0.00 66.02 65.16 1iax s SER 398 CO 0.00 0.14 1.06 -2.16 0.41 0.00 0.00 173.24 172.70 1iax s PRO 399 N 0.28 4.47 0.36 12.44 0.04 -1.26 -1.73 135.00 149.60 1iax s PRO 399 Ca -0.13 1.52 0.18 0.00 0.04 0.00 0.00 61.00 62.62 1iax s PRO 399 Cb -0.16 -3.47 1.26 0.00 0.04 0.00 0.00 34.50 32.17 1iax s PRO 399 CO 0.06 -0.21 1.59 0.78 0.04 0.00 0.00 177.00 179.26 1iax h GLY 400 N 7.29 2.16 1.93 0.56 0.00 -0.20 0.43 103.07 115.23 1iax h GLY 400 Ca -0.38 -0.13 0.01 0.00 0.00 0.00 0.00 47.33 46.82 1iax h GLY 400 CO 0.81 -0.74 0.03 1.48 0.00 0.00 0.00 176.54 178.11 1iax h SER 401 N 0.05 0.00 0.72 0.19 4.64 -1.81 0.72 113.55 118.05 1iax h SER 401 Ca 0.81 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.13 1iax h SER 401 Cb 2.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.17 1iax h SER 401 CO -0.76 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 173.66 1iax n SER 402 N -3.75 0.13 -1.16 4.97 3.41 0.15 -1.74 113.62 115.63 1iax n SER 402 Ca -0.02 0.52 0.08 0.00 -0.26 0.00 0.00 58.87 59.19 1iax n SER 402 Cb 0.11 -0.56 0.29 0.00 -0.26 0.00 0.00 64.21 63.80 1iax n SER 402 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1iax n PHE 403 N -1.64 1.19 -1.47 7.33 3.01 0.22 -4.39 117.46 121.71 1iax n PHE 403 Ca 0.04 -0.76 -0.16 0.00 1.01 0.00 0.00 57.45 57.58 1iax n PHE 403 Cb 0.24 -0.31 -0.07 0.00 -0.01 0.00 0.00 39.48 39.33 1iax n PHE 403 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1iax n GLU 404 N 0.07 -1.45 -1.85 -1.08 -0.58 -0.71 -0.33 120.64 114.71 1iax n GLU 404 Ca 0.22 1.06 -0.42 0.00 -0.42 0.00 0.00 57.16 57.60 1iax n GLU 404 Cb 0.90 -5.40 -0.03 0.00 -0.57 0.00 0.00 31.44 26.33 1iax n GLU 404 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1iax n GLN 406 N 6.23 0.04 -4.97 0.00 6.02 -1.26 -4.49 117.38 118.95 1iax n GLN 406 Ca 0.17 0.22 -0.28 0.00 -0.01 0.00 0.00 57.00 57.10 1iax n GLN 406 Cb 0.40 -1.50 -0.16 0.00 1.02 0.00 0.00 30.24 30.00 1iax n GLN 406 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 1iax s GLU 407 N -2.92 1.93 0.81 -1.09 -1.05 -1.26 -5.10 118.70 110.02 1iax s GLU 407 Ca 0.09 -0.71 -0.11 0.00 -0.15 0.00 0.00 54.97 54.09 1iax s GLU 407 Cb 0.10 -1.70 0.07 0.00 -0.44 0.00 0.00 34.13 32.16 1iax s GLU 407 CO 0.27 0.32 1.09 -2.14 0.95 0.00 0.00 175.26 175.75 1iax s PRO 408 N -0.13 2.01 0.00 -4.83 0.02 -1.26 -4.44 135.00 126.38 1iax s PRO 408 Ca -0.01 0.75 0.00 0.00 0.02 0.00 0.00 61.00 61.76 1iax s PRO 408 Cb -0.11 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.51 1iax s PRO 408 CO 0.02 -1.70 0.00 0.41 -0.33 0.00 0.00 177.00 175.40 1iax n GLY 409 N -1.82 0.62 3.88 0.52 0.00 -1.26 -4.79 105.19 102.34 1iax n GLY 409 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 1iax n GLY 409 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1iax s TRP 410 N -2.17 3.60 -0.01 1.61 0.52 -1.26 -0.04 118.94 121.19 1iax s TRP 410 Ca 0.00 0.64 0.01 0.00 0.02 0.00 0.00 56.10 56.77 1iax s TRP 410 Cb 0.00 -2.03 0.00 0.00 -1.15 0.00 0.00 33.47 30.29 1iax s TRP 410 CO 0.00 0.63 -0.02 -0.06 0.02 0.00 0.00 176.95 177.52 1iax s PHE 411 N -1.24 0.26 -0.15 -1.98 0.40 0.01 0.62 117.98 115.91 1iax s PHE 411 Ca 0.25 -0.04 -0.20 0.00 -0.60 0.00 0.00 56.93 56.34 1iax s PHE 411 Cb -0.14 -0.21 -0.03 0.00 0.51 0.00 0.00 43.02 43.15 1iax s PHE 411 CO 0.14 -0.03 0.59 0.50 0.70 0.00 0.00 175.22 177.12 1iax s ARG 412 N 0.13 4.30 -0.25 0.44 3.52 -0.71 -0.39 118.95 125.99 1iax s ARG 412 Ca -0.01 0.61 0.01 0.00 -0.13 0.00 0.00 55.73 56.21 1iax s ARG 412 Cb -0.03 -3.51 0.07 0.00 -1.56 0.00 0.00 34.95 29.92 1iax s ARG 412 CO -0.00 -0.05 -0.05 0.08 -0.81 0.00 0.00 175.30 174.47 1iax s VAL 413 N 1.26 1.71 -0.21 7.11 1.01 -0.90 -2.25 120.40 128.14 1iax s VAL 413 Ca 0.29 -1.42 -0.29 0.00 0.00 0.00 0.00 61.98 60.56 1iax s VAL 413 Cb -0.16 -1.98 0.00 0.00 0.00 0.00 0.00 36.38 34.24 1iax s VAL 413 CO 0.12 -0.15 1.07 0.00 0.00 0.00 0.00 175.10 176.14 1iax n PHE 415 N 6.23 0.28 -0.15 0.00 1.16 -1.08 -4.52 117.46 119.39 1iax n PHE 415 Ca 0.12 -1.13 0.04 0.00 -1.87 0.00 0.00 57.45 54.61 1iax n PHE 415 Cb 0.46 -0.23 0.10 0.00 -1.61 0.00 0.00 39.48 38.20 1iax n PHE 415 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1iax n ALA 416 N -1.18 2.14 0.19 1.98 0.00 -1.25 -4.65 120.51 117.74 1iax n ALA 416 Ca 0.19 -1.15 0.04 0.00 0.00 0.00 0.00 53.44 52.52 1iax n ALA 416 Cb 0.74 -0.28 -0.05 0.00 0.00 0.00 0.00 19.45 19.85 1iax n ALA 416 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1iax n ASN 417 N 0.08 1.67 -3.66 0.00 6.94 -1.24 -0.57 115.26 118.48 1iax n ASN 417 Ca 0.08 -0.37 -0.12 0.00 -0.02 0.00 0.00 54.58 54.14 1iax n ASN 417 Cb 0.38 1.16 0.03 0.00 -2.36 0.00 0.00 39.78 38.98 1iax n ASN 417 CO 0.00 0.00 0.00 1.15 -1.03 0.00 0.00 177.26 177.38 1iax n MET 418 N -1.44 0.86 -2.31 -3.83 0.00 -1.26 -4.76 117.12 104.38 1iax n MET 418 Ca 0.00 -1.85 -0.26 0.00 0.00 0.00 0.00 57.70 55.59 1iax n MET 418 Cb 0.15 -0.01 0.04 0.00 0.00 0.00 0.00 33.22 33.40 1iax n MET 418 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1iax s ASP 419 N -2.98 5.36 0.39 3.17 -0.00 -1.26 -4.92 116.67 116.42 1iax s ASP 419 Ca 0.29 0.65 0.12 0.00 -0.00 0.00 0.00 52.55 53.61 1iax s ASP 419 Cb -0.02 -1.53 0.79 0.00 -0.00 0.00 0.00 42.92 42.15 1iax s ASP 419 CO 0.18 -1.23 1.88 0.44 -0.00 0.00 0.00 175.17 176.44 1iax h ASP 420 N -0.32 0.07 -0.29 0.27 3.32 -2.00 -2.02 116.42 115.45 1iax h ASP 420 Ca -0.45 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.54 1iax h ASP 420 Cb 1.27 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.79 1iax h ASP 420 CO 0.61 0.34 0.02 1.23 -1.72 0.00 0.00 179.24 179.72 1iax h GLY 421 N 0.89 0.53 1.02 2.75 0.00 -2.00 -2.83 103.07 103.43 1iax h GLY 421 Ca 0.01 -0.38 -0.04 0.00 0.00 0.00 0.00 47.33 46.92 1iax h GLY 421 CO 0.04 0.35 0.26 -0.84 0.00 0.00 0.00 176.54 176.35 1iax h THR 422 N 0.29 1.25 -0.96 4.70 2.02 -1.82 -2.10 112.91 116.29 1iax h THR 422 Ca 0.08 -0.79 0.01 0.00 0.77 0.00 0.00 66.41 66.48 1iax h THR 422 Cb 0.39 0.48 -0.05 0.00 -1.74 0.00 0.00 68.15 67.23 1iax h THR 422 CO 0.01 0.31 0.62 0.58 0.37 0.00 0.00 175.52 177.41 1iax h VAL 423 N 0.98 1.25 -0.17 3.16 2.07 -1.31 0.12 116.25 122.36 1iax h VAL 423 Ca 0.23 -0.48 -0.15 0.00 0.82 0.00 0.00 66.70 67.11 1iax h VAL 423 Cb 0.23 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 29.85 1iax h VAL 423 CO -0.02 0.25 -0.53 0.44 0.02 0.00 0.00 177.57 177.73 1iax h ASP 424 N 1.30 0.53 -0.01 0.57 3.32 -1.30 0.15 116.42 120.98 1iax h ASP 424 Ca 0.35 -0.28 -0.00 0.00 0.02 0.00 0.00 57.03 57.12 1iax h ASP 424 Cb -0.12 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.27 1iax h ASP 424 CO -0.07 0.96 0.01 0.40 -1.72 0.00 0.00 179.24 178.82 1iax h ILE 425 N 0.37 1.03 -0.80 0.35 2.04 -0.63 0.37 117.51 120.24 1iax h ILE 425 Ca 0.01 -0.08 0.03 0.00 1.00 0.00 0.00 64.86 65.82 1iax h ILE 425 Cb 1.05 1.06 -0.05 0.00 -0.74 0.00 0.00 36.82 38.15 1iax h ILE 425 CO 0.10 0.02 0.51 0.00 0.00 0.00 0.00 178.15 178.78 1iax h ALA 426 N 0.97 1.04 -0.66 1.87 0.00 -0.53 -0.79 119.26 121.17 1iax h ALA 426 Ca 0.00 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1iax h ALA 426 Cb 0.03 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1iax h ALA 426 CO -0.00 0.35 0.09 -0.07 0.00 0.00 0.00 179.25 179.62 1iax h LEU 427 N 1.01 1.04 0.16 0.00 3.38 -0.23 -2.27 115.31 118.40 1iax h LEU 427 Ca 0.31 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1iax h LEU 427 Cb -0.01 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 1iax h LEU 427 CO -0.10 1.04 -0.14 0.00 0.09 0.00 0.00 178.44 179.33 1iax h ALA 428 N 1.07 -0.29 -0.87 1.53 0.00 0.59 0.52 119.26 121.82 1iax h ALA 428 Ca 0.20 -0.04 0.14 0.00 0.00 0.00 0.00 54.91 55.20 1iax h ALA 428 Cb 0.45 0.20 -0.07 0.00 0.00 0.00 0.00 17.79 18.37 1iax h ALA 428 CO 0.01 -0.68 0.56 0.00 0.00 0.00 0.00 179.25 179.15 1iax h ARG 429 N -0.32 0.67 -0.13 0.00 3.08 -1.00 -1.21 114.38 115.47 1iax h ARG 429 Ca 0.00 -0.04 -0.17 0.00 0.07 0.00 0.00 59.98 59.84 1iax h ARG 429 Cb 0.30 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 30.21 1iax h ARG 429 CO -0.03 0.44 -0.59 0.82 -1.07 0.00 0.00 179.97 179.55 1iax h ILE 430 N 0.69 1.33 -0.16 2.04 2.04 -0.72 -1.80 117.51 120.94 1iax h ILE 430 Ca 0.43 -1.86 0.05 0.00 1.00 0.00 0.00 64.86 64.48 1iax h ILE 430 Cb 0.68 2.09 -0.01 0.00 -0.74 0.00 0.00 36.82 38.85 1iax h ILE 430 CO -0.19 0.57 0.12 -0.09 0.00 0.00 0.00 178.15 178.56 1iax h ARG 431 N 0.28 0.00 0.05 2.37 2.43 0.10 -1.16 114.38 118.45 1iax h ARG 431 Ca -0.04 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1iax h ARG 431 Cb 1.22 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 1iax h ARG 431 CO 0.12 0.00 -0.02 0.00 -1.51 0.00 0.00 179.97 178.56 1iax h ARG 432 N 0.00 -0.06 -0.98 0.20 3.08 -1.10 -2.66 114.38 112.86 1iax h ARG 432 Ca 0.08 0.00 0.28 0.00 0.07 0.00 0.00 59.98 60.41 1iax h ARG 432 Cb 0.32 0.01 -0.18 0.00 0.08 0.00 0.00 29.97 30.21 1iax h ARG 432 CO -0.00 -0.04 0.06 0.35 -1.07 0.00 0.00 179.97 179.27 1iax h PHE 433 N -0.31 0.01 -0.56 3.04 3.57 -1.20 1.77 116.94 123.26 1iax h PHE 433 Ca -0.01 0.07 -0.09 0.00 3.53 0.00 0.00 57.97 61.47 1iax h PHE 433 Cb 0.05 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.93 1iax h PHE 433 CO 0.03 -0.43 -0.02 0.28 -2.23 0.00 0.00 178.31 175.95 1iax h VAL 434 N 0.02 1.26 0.49 1.41 2.07 -1.35 -3.14 116.25 117.00 1iax h VAL 434 Ca 0.61 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 1iax h VAL 434 Cb 1.27 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 1iax h VAL 434 CO -0.90 0.41 -0.46 1.23 0.02 0.00 0.00 177.57 177.86 1iax h GLY 435 N 0.99 -1.14 -5.78 2.17 0.00 0.30 -3.05 103.07 96.55 1iax h GLY 435 Ca 0.16 0.53 -0.72 0.00 0.00 0.00 0.00 47.33 47.30 1iax h GLY 435 CO 0.03 -0.36 2.78 -0.62 0.00 0.00 0.00 176.54 178.37 1iax n VAL 436 N -5.54 4.44 -1.51 4.60 0.31 -0.17 -3.19 118.33 117.26 1iax n VAL 436 Ca -0.12 -3.69 0.00 0.00 -0.01 0.00 0.00 64.34 60.52 1iax n VAL 436 Cb 0.44 -2.38 0.00 0.00 -0.91 0.00 0.00 33.84 30.99 1iax n VAL 436 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1iax n GLU 437 N 3.58 0.00 0.00 5.55 -0.58 -1.15 -4.90 120.64 123.14 1iax n GLU 437 Ca 0.58 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.32 1iax n GLU 437 Cb 0.30 -0.16 0.00 0.00 -0.57 0.00 0.00 31.44 31.01 1iax n GLU 437 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82