#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aax h MET 3 N 0.00 0.07 -0.27 5.31 -0.00 -1.91 -0.84 114.93 117.30 1aax h MET 3 Ca 0.00 -0.00 -0.06 0.00 -0.00 0.00 0.00 59.70 59.64 1aax h MET 3 Cb 0.00 -0.02 -0.01 0.00 -0.00 0.00 0.00 31.60 31.58 1aax h MET 3 CO 0.00 0.05 -0.06 1.49 -0.00 0.00 0.00 176.91 178.39 1aax h GLU 4 N 0.07 0.51 0.08 -0.10 4.81 -1.98 0.45 114.58 118.42 1aax h GLU 4 Ca 0.59 -0.19 -0.00 0.00 -0.13 0.00 0.00 59.36 59.62 1aax h GLU 4 Cb 1.23 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.58 1aax h GLU 4 CO -0.81 0.72 -0.04 -0.22 -0.73 0.00 0.00 179.01 177.94 1aax h LYS 5 N 0.26 -0.10 -0.91 1.92 3.64 -1.87 -1.52 116.57 117.99 1aax h LYS 5 Ca 0.07 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1aax h LYS 5 Cb 0.53 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.33 1aax h LYS 5 CO 0.03 -0.01 0.58 1.49 -2.27 0.00 0.00 179.45 179.27 1aax h GLU 6 N -0.16 1.22 -0.90 1.90 4.81 -1.14 -1.15 114.58 119.15 1aax h GLU 6 Ca -0.01 -0.09 0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1aax h GLU 6 Cb 0.14 -0.27 -0.06 0.00 0.63 0.00 0.00 28.75 29.19 1aax h GLU 6 CO 0.02 0.83 0.58 0.35 -0.73 0.00 0.00 179.01 180.06 1aax h PHE 7 N 1.25 1.09 0.16 0.92 3.57 0.50 -1.05 116.94 123.37 1aax h PHE 7 Ca 0.33 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.85 1aax h PHE 7 Cb -0.10 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 38.28 1aax h PHE 7 CO 0.00 0.61 -0.08 1.49 -2.23 0.00 0.00 178.31 178.10 1aax h GLU 8 N 1.11 -0.21 -0.28 1.11 4.57 -0.24 -1.39 114.58 119.25 1aax h GLU 8 Ca 0.37 0.01 0.05 0.00 -1.18 0.00 0.00 59.36 58.61 1aax h GLU 8 Cb 0.05 0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 28.64 1aax h GLU 8 CO -0.13 -0.05 0.01 0.37 -1.18 0.00 0.00 179.01 178.02 1aax h GLN 9 N -0.33 0.09 -0.65 1.92 -0.00 -0.92 -0.26 115.11 114.97 1aax h GLN 9 Ca -0.02 -0.01 -0.01 0.00 -0.00 0.00 0.00 58.65 58.61 1aax h GLN 9 Cb 0.26 -0.02 -0.03 0.00 0.00 0.00 0.00 27.48 27.69 1aax h GLN 9 CO 0.04 0.06 0.36 0.82 0.00 0.00 0.00 178.83 180.11 1aax h ILE 10 N 0.09 1.20 0.00 2.39 2.04 -1.13 -1.05 117.51 121.06 1aax h ILE 10 Ca 0.13 -0.51 -0.00 0.00 1.00 0.00 0.00 64.86 65.48 1aax h ILE 10 Cb 0.17 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.61 1aax h ILE 10 CO -0.22 0.22 -0.00 -0.78 0.00 0.00 0.00 178.15 177.37 1aax h ASP 11 N 0.89 -0.00 0.17 1.72 3.58 -0.96 0.54 116.42 122.36 1aax h ASP 11 Ca 0.23 -0.17 -0.03 0.00 0.42 0.00 0.00 57.03 57.48 1aax h ASP 11 Cb 0.04 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.08 1aax h ASP 11 CO -0.04 0.17 -0.15 0.11 -2.88 0.00 0.00 179.24 176.45 1aax h LYS 12 N -0.17 0.00 0.00 0.28 6.56 -0.84 -1.97 116.57 120.43 1aax h LYS 12 Ca -0.00 0.00 -0.06 0.00 -1.06 0.00 0.00 60.65 59.53 1aax h LYS 12 Cb 0.17 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.82 1aax h LYS 12 CO 0.00 0.15 -0.76 0.77 -2.06 0.00 0.00 179.45 177.56 1aax h SER 13 N 0.00 0.00 -1.42 0.86 0.02 -0.99 -3.48 113.55 108.53 1aax h SER 13 Ca -0.00 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.81 1aax h SER 13 Cb 0.28 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.83 1aax h SER 13 CO 0.02 0.22 -0.19 0.61 -1.14 0.00 0.00 176.83 176.36 1aax n GLY 14 N 1.22 0.20 2.07 -3.77 0.00 0.09 -4.97 105.19 100.02 1aax n GLY 14 Ca -0.01 -0.54 -0.21 0.00 0.00 0.00 0.00 46.02 45.27 1aax n GLY 14 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1aax n SER 15 N 0.51 3.59 0.03 1.61 3.41 -0.65 -4.56 113.62 117.56 1aax n SER 15 Ca -0.06 -3.63 -0.04 0.00 -0.26 0.00 0.00 58.87 54.88 1aax n SER 15 Cb 0.55 -0.81 0.18 0.00 -0.26 0.00 0.00 64.21 63.87 1aax n SER 15 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1aax h TRP 16 N 1.05 0.52 -0.19 7.33 4.06 -1.94 -0.86 115.95 125.91 1aax h TRP 16 Ca 0.57 -0.13 -0.02 0.00 2.06 0.00 0.00 58.89 61.37 1aax h TRP 16 Cb 2.69 -0.12 -0.01 0.00 -1.00 0.00 0.00 29.16 30.72 1aax h TRP 16 CO 1.51 0.74 0.05 0.00 -3.56 0.00 0.00 178.44 177.18 1aax h ALA 17 N 1.26 0.26 -0.21 1.49 0.00 -1.92 -0.40 119.26 119.73 1aax h ALA 17 Ca 0.05 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1aax h ALA 17 Cb 0.78 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1aax h ALA 17 CO 0.06 -0.10 -0.05 0.00 0.00 0.00 0.00 179.25 179.16 1aax h ALA 18 N 0.85 0.29 -0.41 0.00 0.00 -1.86 -0.85 119.26 117.29 1aax h ALA 18 Ca 0.06 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.73 1aax h ALA 18 Cb 0.27 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1aax h ALA 18 CO 0.00 0.08 0.24 0.82 0.00 0.00 0.00 179.25 180.39 1aax h ILE 19 N 0.13 1.04 -0.74 0.00 1.08 -1.14 0.34 117.51 118.23 1aax h ILE 19 Ca 0.05 -0.17 -0.05 0.00 -0.39 0.00 0.00 64.86 64.31 1aax h ILE 19 Cb 0.51 0.52 -0.03 0.00 -3.07 0.00 0.00 36.82 34.74 1aax h ILE 19 CO 0.02 0.09 0.26 0.22 -0.69 0.00 0.00 178.15 178.05 1aax h TYR 20 N 0.48 1.15 -0.27 1.37 3.20 -1.03 -2.55 116.97 119.33 1aax h TYR 20 Ca 0.16 -0.10 -0.08 0.00 3.14 0.00 0.00 58.73 61.85 1aax h TYR 20 Cb 0.01 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 37.92 1aax h TYR 20 CO -0.07 0.90 -0.19 1.96 -1.64 0.00 0.00 178.16 179.11 1aax h GLN 21 N 1.09 0.49 -0.52 1.82 1.08 -0.65 -2.19 115.11 116.23 1aax h GLN 21 Ca 0.24 -0.16 -0.07 0.00 -1.45 0.00 0.00 58.65 57.21 1aax h GLN 21 Cb 0.26 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.63 1aax h GLN 21 CO -0.01 0.66 0.04 -0.44 -0.95 0.00 0.00 178.83 178.13 1aax h ASP 22 N 0.44 0.81 -0.42 1.46 3.32 -0.58 -1.06 116.42 120.40 1aax h ASP 22 Ca 0.07 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 1aax h ASP 22 Cb 0.59 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 1aax h ASP 22 CO 0.04 0.85 0.15 0.40 -1.72 0.00 0.00 179.24 178.96 1aax h ILE 23 N 0.80 1.21 -0.67 0.35 2.04 -1.10 -1.91 117.51 118.23 1aax h ILE 23 Ca 0.16 -0.66 -0.00 0.00 1.00 0.00 0.00 64.86 65.35 1aax h ILE 23 Cb 0.42 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 1aax h ILE 23 CO 0.01 0.24 0.42 0.03 0.00 0.00 0.00 178.15 178.85 1aax h ARG 24 N 0.53 0.90 -0.27 2.37 3.08 -1.03 -1.72 114.38 118.24 1aax h ARG 24 Ca 0.14 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 60.03 1aax h ARG 24 Cb 0.22 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1aax h ARG 24 CO -0.01 0.62 -0.22 1.25 -1.07 0.00 0.00 179.97 180.55 1aax h HIS 25 N 0.92 0.56 0.00 3.04 2.76 -0.56 -3.11 115.15 118.76 1aax h HIS 25 Ca 0.24 -0.11 0.00 0.00 -2.20 0.00 0.00 60.37 58.30 1aax h HIS 25 Cb -0.06 -0.14 0.00 0.00 1.55 0.00 0.00 27.41 28.76 1aax h HIS 25 CO 0.00 0.69 -0.67 0.39 -1.30 0.00 0.00 177.93 177.04 1aax n GLU 26 N -4.14 0.08 -1.64 5.26 1.02 -0.78 -4.99 120.64 115.45 1aax n GLU 26 Ca -0.00 0.01 -0.39 0.00 -0.02 0.00 0.00 57.16 56.76 1aax n GLU 26 Cb 0.39 -1.54 0.04 0.00 -0.02 0.00 0.00 31.44 30.31 1aax n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1aax n ALA 27 N -1.59 0.50 -1.37 0.62 0.00 -0.68 -4.96 120.51 113.02 1aax n ALA 27 Ca 0.04 0.09 -0.34 0.00 0.00 0.00 0.00 53.44 53.23 1aax n ALA 27 Cb 0.36 -2.16 0.09 0.00 0.00 0.00 0.00 19.45 17.74 1aax n ALA 27 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1aax s SER 28 N -1.04 4.31 -0.22 0.00 0.01 -1.26 -5.04 113.70 110.47 1aax s SER 28 Ca 0.71 2.31 -0.03 0.00 1.31 0.00 0.00 55.95 60.25 1aax s SER 28 Cb -0.45 -2.58 0.07 0.00 0.21 0.00 0.00 66.02 63.27 1aax s SER 28 CO 0.50 -2.18 0.08 -0.62 0.41 0.00 0.00 173.24 171.42 1aax s ASP 29 N -2.10 3.01 0.25 2.44 -1.08 -1.26 -4.95 116.67 112.98 1aax s ASP 29 Ca 0.73 -0.95 0.11 0.00 -0.52 0.00 0.00 52.55 51.92 1aax s ASP 29 Cb -0.28 -0.49 -0.05 0.00 -1.46 0.00 0.00 42.92 40.64 1aax s ASP 29 CO 0.45 -0.36 -0.18 -0.36 0.52 0.00 0.00 175.17 175.24 1aax s PHE 30 N 1.95 2.10 0.59 -5.34 0.08 -1.26 -5.13 117.98 110.96 1aax s PHE 30 Ca 0.03 -0.41 -0.17 0.00 0.12 0.00 0.00 56.93 56.50 1aax s PHE 30 Cb -0.17 -0.93 -0.04 0.00 -0.57 0.00 0.00 43.02 41.31 1aax s PHE 30 CO -0.16 0.59 1.09 -1.25 -0.10 0.00 0.00 175.22 175.39 1aax s PRO 31 N -3.48 3.22 -0.37 0.24 0.04 -1.26 -4.86 135.00 128.52 1aax s PRO 31 Ca 0.27 1.39 0.13 0.00 0.04 0.00 0.00 61.00 62.82 1aax s PRO 31 Cb -0.04 -2.01 0.44 0.00 0.04 0.00 0.00 34.50 32.94 1aax s PRO 31 CO 0.12 -0.92 1.02 0.00 0.04 0.00 0.00 177.00 177.26 1aax h ARG 33 N 2.81 0.22 -0.83 0.00 3.08 -1.94 -2.43 114.38 115.30 1aax h ARG 33 Ca 0.07 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1aax h ARG 33 Cb 1.08 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 31.04 1aax h ARG 33 CO 0.64 0.14 0.39 0.28 -1.07 0.00 0.00 179.97 180.36 1aax h VAL 34 N 0.22 1.26 -0.91 2.04 2.07 -1.92 -2.60 116.25 116.41 1aax h VAL 34 Ca 0.14 -0.74 0.03 0.00 0.82 0.00 0.00 66.70 66.95 1aax h VAL 34 Cb 0.13 0.21 -0.05 0.00 -1.52 0.00 0.00 31.29 30.06 1aax h VAL 34 CO -0.16 0.31 0.60 0.00 0.02 0.00 0.00 177.57 178.34 1aax h ALA 35 N 1.21 1.40 -0.03 1.67 0.00 -1.78 -2.22 119.26 119.51 1aax h ALA 35 Ca 0.28 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1aax h ALA 35 Cb 0.13 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1aax h ALA 35 CO -0.03 0.53 0.00 1.63 0.00 0.00 0.00 179.25 181.37 1aax n LYS 36 N -4.43 1.30 -1.89 0.00 4.76 -0.94 -4.64 118.16 112.32 1aax n LYS 36 Ca 0.12 -0.43 -0.41 0.00 -2.87 0.00 0.00 58.31 54.72 1aax n LYS 36 Cb 0.08 -1.45 -0.00 0.00 -1.84 0.00 0.00 35.03 31.82 1aax n LYS 36 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1aax s LEU 37 N -1.88 4.30 0.28 -0.35 1.43 -0.84 -4.89 118.68 116.73 1aax s LEU 37 Ca 0.40 2.91 0.02 0.00 -1.03 0.00 0.00 54.13 56.43 1aax s LEU 37 Cb 0.20 -3.73 0.62 0.00 0.03 0.00 0.00 46.19 43.30 1aax s LEU 37 CO 0.32 -0.85 1.77 -0.65 0.23 0.00 0.00 176.35 177.16 1aax h PRO 38 N 2.93 0.66 0.00 1.29 0.11 -1.91 -0.63 132.00 134.45 1aax h PRO 38 Ca -0.50 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1aax h PRO 38 Cb 1.24 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1aax h PRO 38 CO 0.64 0.43 0.00 1.57 -0.21 0.00 0.00 178.00 180.43 1aax h LYS 39 N 0.68 0.00 -0.10 1.05 2.10 -1.95 -2.24 116.57 116.11 1aax h LYS 39 Ca 0.51 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.16 1aax h LYS 39 Cb 0.76 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.09 1aax h LYS 39 CO -0.38 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.16 1aax n ASN 40 N -2.56 3.05 -0.24 7.07 3.02 -0.25 -4.54 115.26 120.82 1aax n ASN 40 Ca -0.01 -1.98 0.01 0.00 -0.03 0.00 0.00 54.58 52.57 1aax n ASN 40 Cb 0.10 -0.05 0.08 0.00 -0.61 0.00 0.00 39.78 39.30 1aax n ASN 40 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1aax h LYS 41 N 4.56 0.01 0.00 3.52 3.11 -1.38 0.21 116.57 126.59 1aax h LYS 41 Ca 0.00 -0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1aax h LYS 41 Cb 0.98 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.20 1aax h LYS 41 CO 0.00 0.00 0.00 0.27 -2.81 0.00 0.00 179.45 176.91 1aax n ASN 42 N -5.46 0.00 -0.80 4.20 2.04 -1.26 -2.56 115.26 111.41 1aax n ASN 42 Ca 0.09 -1.05 0.10 0.00 -0.44 0.00 0.00 54.58 53.28 1aax n ASN 42 Cb 0.36 0.00 0.08 0.00 -2.53 0.00 0.00 39.78 37.69 1aax n ASN 42 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1aax n ARG 43 N -0.82 1.87 -4.49 -3.83 1.74 0.73 -4.91 116.66 106.95 1aax n ARG 43 Ca 0.12 -1.68 -0.34 0.00 -0.77 0.00 0.00 57.85 55.19 1aax n ARG 43 Cb 0.05 -1.40 -0.13 0.00 -1.02 0.00 0.00 32.46 29.96 1aax n ARG 43 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1aax s ASN 44 N -1.79 4.38 0.07 0.55 0.01 -1.06 -4.45 114.94 112.63 1aax s ASN 44 Ca 0.24 -0.26 -0.15 0.00 -0.71 0.00 0.00 52.86 51.98 1aax s ASN 44 Cb 0.17 -1.70 -0.20 0.00 0.41 0.00 0.00 41.25 39.93 1aax s ASN 44 CO 0.28 0.14 1.22 -0.09 -1.51 0.00 0.00 177.10 177.14 1aax h ARG 45 N 6.92 0.65 -5.06 -0.60 2.43 -1.89 -3.44 114.38 113.40 1aax h ARG 45 Ca -0.30 -0.62 -0.62 0.00 -0.81 0.00 0.00 59.98 57.63 1aax h ARG 45 Cb 1.20 0.15 -0.33 0.00 -0.42 0.00 0.00 29.97 30.57 1aax h ARG 45 CO 0.59 1.22 -0.86 0.71 -1.51 0.00 0.00 179.97 180.13 1aax s TYR 46 N -3.50 2.19 0.37 2.20 2.02 -1.26 -5.02 117.35 114.35 1aax s TYR 46 Ca -0.11 -0.89 0.08 0.00 -0.37 0.00 0.00 57.07 55.79 1aax s TYR 46 Cb 0.07 -1.50 0.82 0.00 -0.40 0.00 0.00 41.96 40.95 1aax s TYR 46 CO 0.88 -0.38 1.92 -0.09 -1.57 0.00 0.00 175.55 176.32 1aax h ARG 47 N 6.83 0.66 -0.55 -0.62 2.43 -1.98 -2.64 114.38 118.50 1aax h ARG 47 Ca -0.23 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 1aax h ARG 47 Cb 1.22 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1aax h ARG 47 CO 0.47 0.44 0.00 -0.25 -1.51 0.00 0.00 179.97 179.12 1aax n ASP 48 N -4.51 2.96 -3.86 -3.80 8.00 -1.26 -4.76 116.55 109.33 1aax n ASP 48 Ca 0.13 -2.00 -0.29 0.00 0.71 0.00 0.00 54.79 53.34 1aax n ASP 48 Cb 0.35 -0.37 -0.16 0.00 -0.02 0.00 0.00 41.12 40.93 1aax n ASP 48 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1aax s VAL 49 N -1.26 1.17 0.07 2.53 1.01 -0.99 -5.07 120.40 117.86 1aax s VAL 49 Ca 0.37 -1.08 0.01 0.00 0.00 0.00 0.00 61.98 61.29 1aax s VAL 49 Cb 0.19 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 1aax s VAL 49 CO 0.25 -0.22 -0.06 -0.44 0.00 0.00 0.00 175.10 174.63 1aax s SER 50 N 1.55 0.95 0.10 3.32 0.01 -1.26 -4.64 113.70 113.72 1aax s SER 50 Ca -0.02 -0.87 -0.23 0.00 1.31 0.00 0.00 55.95 56.14 1aax s SER 50 Cb -0.18 0.09 -0.07 0.00 0.21 0.00 0.00 66.02 66.07 1aax s SER 50 CO -0.09 -0.41 0.70 -2.16 0.41 0.00 0.00 173.24 171.69 1aax s PRO 51 N -3.18 4.43 0.54 12.44 0.04 -1.26 -4.54 135.00 143.47 1aax s PRO 51 Ca 0.05 0.98 -0.21 0.00 0.04 0.00 0.00 61.00 61.86 1aax s PRO 51 Cb 0.01 -3.28 -0.05 0.00 0.04 0.00 0.00 34.50 31.22 1aax s PRO 51 CO -0.04 0.51 1.27 -0.06 0.04 0.00 0.00 177.00 178.73 1aax s PHE 52 N -0.83 2.43 0.26 0.56 0.08 -1.26 -4.56 117.98 114.66 1aax s PHE 52 Ca 0.34 1.45 -0.04 0.00 0.12 0.00 0.00 56.93 58.81 1aax s PHE 52 Cb -0.21 -3.62 0.33 0.00 -0.57 0.00 0.00 43.02 38.95 1aax s PHE 52 CO 0.23 -2.41 1.86 -0.44 -0.10 0.00 0.00 175.22 174.35 1aax h ASP 53 N 1.39 0.95 -0.18 1.36 3.32 -1.11 -2.27 116.42 119.88 1aax h ASP 53 Ca -0.50 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 56.41 1aax h ASP 53 Cb 1.29 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.58 1aax h ASP 53 CO 0.57 0.82 0.05 1.12 -1.72 0.00 0.00 179.24 180.08 1aax h HIS 54 N 1.04 0.37 -0.23 4.55 2.07 -1.92 -3.20 115.15 117.84 1aax h HIS 54 Ca 0.25 -0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.75 1aax h HIS 54 Cb 0.13 -0.12 0.00 0.00 2.57 0.00 0.00 27.41 29.99 1aax h HIS 54 CO 0.01 0.34 0.00 -1.13 -3.07 0.00 0.00 177.93 174.08 1aax n SER 55 N -4.38 2.55 -4.77 3.10 3.41 -1.14 -5.04 113.62 107.36 1aax n SER 55 Ca 0.01 -1.91 -0.35 0.00 -0.26 0.00 0.00 58.87 56.36 1aax n SER 55 Cb 0.17 -0.15 0.02 0.00 -0.26 0.00 0.00 64.21 63.99 1aax n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1aax s ARG 56 N -0.96 3.09 -0.13 4.33 1.70 -0.87 -0.85 118.95 125.27 1aax s ARG 56 Ca 0.16 1.59 -0.23 0.00 -0.47 0.00 0.00 55.73 56.78 1aax s ARG 56 Cb 0.09 -1.97 -0.03 0.00 -0.57 0.00 0.00 34.95 32.47 1aax s ARG 56 CO 0.12 -1.06 0.70 0.42 -1.08 0.00 0.00 175.30 174.40 1aax s ILE 57 N -1.91 5.01 -0.17 4.99 -1.09 -0.69 -4.79 121.20 122.55 1aax s ILE 57 Ca 0.72 1.40 -0.12 0.00 -2.23 0.00 0.00 60.65 60.42 1aax s ILE 57 Cb -0.24 -4.03 -0.05 0.00 -1.58 0.00 0.00 42.46 36.56 1aax s ILE 57 CO 0.33 0.16 0.23 -0.54 -1.23 0.00 0.00 174.94 173.89 1aax s LYS 58 N 1.41 4.16 0.38 2.79 1.02 -1.26 -4.24 119.74 124.00 1aax s LYS 58 Ca 0.35 -0.02 -0.25 0.00 0.02 0.00 0.00 55.97 56.07 1aax s LYS 58 Cb -0.17 -3.40 -0.09 0.00 -0.52 0.00 0.00 37.83 33.65 1aax s LYS 58 CO 0.14 0.31 1.03 -0.51 -0.92 0.00 0.00 175.35 175.41 1aax s LEU 59 N 0.27 4.20 -1.16 3.17 1.43 0.96 -4.95 118.68 122.60 1aax s LEU 59 Ca 0.14 2.02 -0.18 0.00 -1.03 0.00 0.00 54.13 55.08 1aax s LEU 59 Cb -0.12 -4.12 0.11 0.00 0.03 0.00 0.00 46.19 42.09 1aax s LEU 59 CO 0.02 -0.39 1.49 -1.00 0.23 0.00 0.00 176.35 176.70 1aax s HIS 60 N -1.62 3.03 -0.04 0.29 3.76 -1.26 -4.56 115.29 114.89 1aax s HIS 60 Ca 0.55 -1.61 -0.30 0.00 -0.15 0.00 0.00 55.06 53.55 1aax s HIS 60 Cb -0.22 -4.52 0.08 0.00 1.11 0.00 0.00 32.58 29.03 1aax s HIS 60 CO 0.28 -1.65 0.74 1.14 -0.85 0.00 0.00 174.74 174.40 1aax s GLN 61 N 3.25 0.99 0.01 1.40 -2.07 -1.26 -5.05 119.66 116.93 1aax s GLN 61 Ca 0.45 0.11 0.25 0.00 -1.82 0.00 0.00 55.36 54.36 1aax s GLN 61 Cb -0.00 0.46 0.58 0.00 -1.09 0.00 0.00 33.01 32.96 1aax s GLN 61 CO -0.01 -0.33 1.47 -0.85 -1.32 0.00 0.00 175.29 174.25 1aax n GLU 62 N 0.65 0.04 0.02 9.60 0.00 -1.26 -4.31 120.64 125.37 1aax n GLU 62 Ca -0.17 0.01 -0.02 0.00 0.00 0.00 0.00 57.16 56.99 1aax n GLU 62 Cb 0.58 -1.52 -0.01 0.00 0.00 0.00 0.00 31.44 30.49 1aax n GLU 62 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1aax h ASP 63 N 0.00 -0.09 -1.46 -1.84 5.19 -1.97 -3.46 116.42 112.78 1aax h ASP 63 Ca 0.00 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.36 1aax h ASP 63 Cb 0.53 0.02 -0.26 0.00 0.18 0.00 0.00 39.33 39.81 1aax h ASP 63 CO 0.00 0.10 -0.40 0.21 -3.12 0.00 0.00 179.24 176.03 1aax s ASN 64 N -3.82 -0.51 0.00 6.45 3.84 -1.26 -5.04 114.94 114.60 1aax s ASN 64 Ca -0.02 0.39 0.16 0.00 0.21 0.00 0.00 52.86 53.60 1aax s ASN 64 Cb 0.00 1.59 0.62 0.00 -0.55 0.00 0.00 41.25 42.91 1aax s ASN 64 CO 0.05 -0.29 1.45 -0.90 -2.79 0.00 0.00 177.10 174.61 1aax n ASP 65 N 5.39 1.25 -4.73 -4.21 5.68 -1.26 -4.88 116.55 113.79 1aax n ASP 65 Ca -0.01 -1.76 -0.41 0.00 -0.50 0.00 0.00 54.79 52.11 1aax n ASP 65 Cb 0.51 -0.11 -0.05 0.00 -1.14 0.00 0.00 41.12 40.33 1aax n ASP 65 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 1aax s TYR 66 N -1.78 3.80 -0.11 2.11 5.04 -1.26 -0.03 117.35 125.12 1aax s TYR 66 Ca 0.26 1.74 -0.09 0.00 -2.44 0.00 0.00 57.07 56.54 1aax s TYR 66 Cb 0.13 -3.01 0.03 0.00 0.35 0.00 0.00 41.96 39.47 1aax s TYR 66 CO 0.20 0.22 0.28 -1.50 -1.34 0.00 0.00 175.55 173.41 1aax s ILE 67 N -0.02 -0.01 -1.14 3.14 2.07 -1.26 -4.92 121.20 119.05 1aax s ILE 67 Ca 0.45 0.02 -0.21 0.00 -1.41 0.00 0.00 60.65 59.50 1aax s ILE 67 Cb -0.23 -0.40 0.00 0.00 0.13 0.00 0.00 42.46 41.97 1aax s ILE 67 CO 0.28 0.01 1.77 0.21 -1.91 0.00 0.00 174.94 175.30 1aax s ASN 68 N 0.34 5.98 -0.14 4.50 3.84 -1.26 -4.62 114.94 123.59 1aax s ASN 68 Ca -0.02 -1.73 -0.18 0.00 0.21 0.00 0.00 52.86 51.14 1aax s ASN 68 Cb -0.03 -2.58 0.05 0.00 -0.55 0.00 0.00 41.25 38.13 1aax s ASN 68 CO -0.01 -2.04 0.47 0.00 -2.79 0.00 0.00 177.10 172.73 1aax s ALA 69 N 7.27 -1.19 0.05 1.71 0.00 -1.26 -3.00 121.76 125.34 1aax s ALA 69 Ca 0.59 1.17 0.06 0.00 0.00 0.00 0.00 51.96 53.78 1aax s ALA 69 Cb 0.00 -0.54 -0.02 0.00 0.00 0.00 0.00 23.12 22.55 1aax s ALA 69 CO 0.04 -0.25 -0.18 -1.12 0.00 0.00 0.00 175.76 174.26 1aax s SER 70 N -0.20 2.11 -0.39 0.00 0.01 0.11 -1.71 113.70 113.63 1aax s SER 70 Ca -0.04 -0.51 -0.16 0.00 1.31 0.00 0.00 55.95 56.55 1aax s SER 70 Cb -0.03 -0.15 0.01 0.00 0.21 0.00 0.00 66.02 66.05 1aax s SER 70 CO 0.02 0.09 0.41 -0.22 0.41 0.00 0.00 173.24 173.95 1aax s LEU 71 N -1.22 4.69 -0.67 2.44 2.96 -0.03 -1.01 118.68 125.84 1aax s LEU 71 Ca 0.05 -0.48 -0.19 0.00 -0.22 0.00 0.00 54.13 53.28 1aax s LEU 71 Cb -0.08 -2.37 0.11 0.00 0.50 0.00 0.00 46.19 44.35 1aax s LEU 71 CO 0.02 -0.48 0.80 -0.63 -1.32 0.00 0.00 176.35 174.74 1aax s ILE 72 N 2.08 4.82 -0.56 6.68 1.09 0.32 -4.87 121.20 130.77 1aax s ILE 72 Ca 0.12 -1.14 -0.17 0.00 -1.10 0.00 0.00 60.65 58.36 1aax s ILE 72 Cb -0.17 -4.56 0.11 0.00 -1.06 0.00 0.00 42.46 36.78 1aax s ILE 72 CO 0.13 -1.22 0.59 -0.75 -0.10 0.00 0.00 174.94 173.59 1aax s LYS 73 N 2.63 3.02 -0.81 2.79 2.20 -1.26 -1.80 119.74 126.51 1aax s LYS 73 Ca 0.16 -1.45 -0.22 0.00 -0.36 0.00 0.00 55.97 54.10 1aax s LYS 73 Cb -0.19 -4.26 0.08 0.00 -1.51 0.00 0.00 37.83 31.95 1aax s LYS 73 CO 0.03 -1.39 1.13 -1.64 -0.36 0.00 0.00 175.35 173.12 1aax s MET 74 N 2.16 3.34 0.11 4.03 -1.94 -0.38 -4.91 119.30 121.71 1aax s MET 74 Ca 0.08 -1.06 -0.26 0.00 -1.71 0.00 0.00 55.69 52.74 1aax s MET 74 Cb -0.26 -4.60 -0.09 0.00 2.01 0.00 0.00 34.83 31.89 1aax s MET 74 CO 0.05 -1.91 1.66 1.49 -0.01 0.00 0.00 175.02 176.30 1aax h GLU 75 N 9.46 -0.36 -0.20 2.03 4.81 -1.95 0.23 114.58 128.60 1aax h GLU 75 Ca -0.08 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1aax h GLU 75 Cb 1.04 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 1aax h GLU 75 CO 1.21 -0.24 0.09 1.49 -0.73 0.00 0.00 179.01 180.83 1aax h GLU 76 N -0.38 0.29 0.00 1.92 4.81 -1.96 -2.83 114.58 116.43 1aax h GLU 76 Ca 0.03 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1aax h GLU 76 Cb 0.40 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.73 1aax h GLU 76 CO -0.11 0.32 0.00 0.00 -0.73 0.00 0.00 179.01 178.49 1aax h ALA 77 N 0.95 1.00 -3.35 2.92 0.00 -1.93 -3.47 119.26 115.38 1aax h ALA 77 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.71 1aax h ALA 77 Cb 0.14 0.00 0.05 0.00 0.00 0.00 0.00 17.79 17.98 1aax h ALA 77 CO -0.01 0.00 -0.41 1.04 0.00 0.00 0.00 179.25 179.88 1aax n GLN 78 N -3.07 -3.71 -4.00 0.00 1.13 0.05 -4.89 117.38 102.89 1aax n GLN 78 Ca 0.01 0.58 -0.12 0.00 -1.94 0.00 0.00 57.00 55.53 1aax n GLN 78 Cb 0.33 -4.76 -0.13 0.00 0.11 0.00 0.00 30.24 25.79 1aax n GLN 78 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1aax s ARG 79 N -5.43 0.27 0.14 -1.09 3.52 -1.08 -4.92 118.95 110.35 1aax s ARG 79 Ca 0.25 -0.33 0.08 0.00 -0.13 0.00 0.00 55.73 55.59 1aax s ARG 79 Cb -0.11 -0.11 -0.04 0.00 -1.56 0.00 0.00 34.95 33.13 1aax s ARG 79 CO 0.30 0.02 -0.19 -1.12 -0.81 0.00 0.00 175.30 173.51 1aax s SER 80 N -0.68 2.54 0.03 -2.12 0.01 -1.26 -1.25 113.70 110.97 1aax s SER 80 Ca -0.05 -0.79 -0.00 0.00 1.31 0.00 0.00 55.95 56.41 1aax s SER 80 Cb -0.05 -0.14 -0.03 0.00 0.21 0.00 0.00 66.02 66.02 1aax s SER 80 CO -0.00 -0.02 -0.03 -0.31 0.41 0.00 0.00 173.24 173.29 1aax s TYR 81 N -1.76 0.34 -0.25 2.43 1.51 -0.74 -4.02 117.35 114.86 1aax s TYR 81 Ca 0.12 -0.69 -0.03 0.00 -1.01 0.00 0.00 57.07 55.45 1aax s TYR 81 Cb -0.07 -0.25 0.01 0.00 -0.11 0.00 0.00 41.96 41.54 1aax s TYR 81 CO 0.05 -0.25 -0.03 0.42 -1.11 0.00 0.00 175.55 174.63 1aax s ILE 82 N -2.25 3.18 -0.19 2.71 1.01 -0.20 -0.52 121.20 124.94 1aax s ILE 82 Ca -0.09 -0.82 -0.09 0.00 0.00 0.00 0.00 60.65 59.65 1aax s ILE 82 Cb -0.04 -2.57 -0.05 0.00 0.01 0.00 0.00 42.46 39.81 1aax s ILE 82 CO -0.04 0.25 0.11 -0.76 0.00 0.00 0.00 174.94 174.50 1aax s LEU 83 N 1.40 4.08 0.11 2.97 1.02 -0.18 -0.02 118.68 128.06 1aax s LEU 83 Ca 0.02 0.18 -0.04 0.00 0.02 0.00 0.00 54.13 54.31 1aax s LEU 83 Cb -0.16 -2.05 -0.03 0.00 0.02 0.00 0.00 46.19 43.98 1aax s LEU 83 CO -0.03 0.18 0.11 0.28 0.02 0.00 0.00 176.35 176.91 1aax s THR 84 N 0.35 0.13 0.68 5.49 -1.32 -0.70 -0.71 115.64 119.57 1aax s THR 84 Ca 0.06 -1.64 -0.11 0.00 -1.21 0.00 0.00 61.69 58.79 1aax s THR 84 Cb -0.11 -1.77 0.00 0.00 -1.51 0.00 0.00 72.50 69.11 1aax s THR 84 CO -0.01 -0.57 1.08 0.00 -2.21 0.00 0.00 174.62 172.90 1aax s GLN 85 N -3.97 3.00 0.07 7.08 -2.07 -1.16 -3.56 119.66 119.04 1aax s GLN 85 Ca 0.16 0.49 -0.31 0.00 -1.82 0.00 0.00 55.36 53.88 1aax s GLN 85 Cb 0.06 -2.04 -0.08 0.00 -1.09 0.00 0.00 33.01 29.86 1aax s GLN 85 CO -0.03 -0.93 1.57 0.20 -1.32 0.00 0.00 175.29 174.77 1aax s GLY 86 N -4.32 1.65 0.49 2.60 0.00 0.60 -4.83 107.32 103.50 1aax s GLY 86 Ca 0.57 1.15 -0.22 0.00 0.00 0.00 0.00 44.72 46.22 1aax s GLY 86 CO 0.52 2.74 1.09 -1.55 0.00 0.00 0.00 173.10 175.90 1aax n PRO 87 N 5.25 1.38 -2.59 2.90 -0.04 -1.26 -4.69 135.00 135.95 1aax n PRO 87 Ca 0.15 0.50 -0.24 0.00 -0.04 0.00 0.00 63.50 63.87 1aax n PRO 87 Cb 0.41 -2.21 0.03 0.00 -0.04 0.00 0.00 33.50 31.69 1aax n PRO 87 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1aax s LEU 88 N -1.51 3.30 0.48 1.53 1.43 -1.26 -0.87 118.68 121.78 1aax s LEU 88 Ca 0.67 0.39 0.23 0.00 -1.03 0.00 0.00 54.13 54.40 1aax s LEU 88 Cb -0.49 -3.22 1.27 0.00 0.03 0.00 0.00 46.19 43.79 1aax s LEU 88 CO 0.53 -1.05 1.92 -0.65 0.23 0.00 0.00 176.35 177.32 1aax h PRO 89 N -0.02 0.18 -0.01 1.29 0.11 -1.96 -0.18 132.00 131.41 1aax h PRO 89 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1aax h PRO 89 Cb 1.27 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1aax h PRO 89 CO 0.58 0.12 -0.30 0.27 -0.21 0.00 0.00 178.00 178.45 1aax n ASN 90 N -4.40 1.57 -0.40 -2.05 6.94 -1.26 -4.24 115.26 111.42 1aax n ASN 90 Ca 0.16 -1.25 0.04 0.00 -0.02 0.00 0.00 54.58 53.51 1aax n ASN 90 Cb 0.72 0.25 0.10 0.00 -2.36 0.00 0.00 39.78 38.49 1aax n ASN 90 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1aax n THR 91 N -0.22 1.13 -0.19 5.53 -2.24 -0.10 -4.66 114.28 113.53 1aax n THR 91 Ca 0.12 -1.12 -0.08 0.00 -2.27 0.00 0.00 64.05 60.70 1aax n THR 91 Cb 0.41 0.41 0.02 0.00 -2.10 0.00 0.00 70.33 69.07 1aax n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1aax h GLY 93 N 0.74 1.25 1.09 0.00 0.00 -1.90 -1.84 103.07 102.41 1aax h GLY 93 Ca 0.18 -0.65 -0.07 0.00 0.00 0.00 0.00 47.33 46.79 1aax h GLY 93 CO -0.01 0.61 0.16 0.45 0.00 0.00 0.00 176.54 177.75 1aax h HIS 94 N 1.15 1.18 -0.04 5.60 3.86 -1.76 -0.37 115.15 124.77 1aax h HIS 94 Ca 0.27 -0.14 0.01 0.00 -1.16 0.00 0.00 60.37 59.35 1aax h HIS 94 Cb 0.16 -0.33 -0.02 0.00 1.06 0.00 0.00 27.41 28.28 1aax h HIS 94 CO 0.02 0.96 -0.04 0.35 0.86 0.00 0.00 177.93 180.08 1aax h PHE 95 N 1.07 -0.10 0.00 2.45 3.57 -0.51 -0.45 116.94 122.97 1aax h PHE 95 Ca 0.22 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.65 1aax h PHE 95 Cb 0.38 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 1aax h PHE 95 CO 0.03 -0.07 -0.37 -1.49 -2.23 0.00 0.00 178.31 174.18 1aax h TRP 96 N -0.06 0.00 -0.48 0.41 4.06 -1.20 -1.65 115.95 117.03 1aax h TRP 96 Ca 0.03 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 60.91 1aax h TRP 96 Cb 0.10 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.25 1aax h TRP 96 CO -0.14 0.37 0.00 1.49 -3.56 0.00 0.00 178.44 176.61 1aax h GLU 97 N 0.00 0.85 -0.23 0.49 4.81 -0.68 -0.39 114.58 119.43 1aax h GLU 97 Ca -0.00 -0.27 -0.01 0.00 -0.13 0.00 0.00 59.36 58.95 1aax h GLU 97 Cb 0.84 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1aax h GLU 97 CO 0.05 0.89 0.12 1.98 -0.73 0.00 0.00 179.01 181.31 1aax h MET 98 N 0.70 0.32 -0.72 1.92 4.05 -0.68 0.12 114.93 120.65 1aax h MET 98 Ca 0.14 -0.04 0.07 0.00 -0.28 0.00 0.00 59.70 59.58 1aax h MET 98 Cb 0.50 -0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 31.18 1aax h MET 98 CO 0.02 0.31 0.40 0.28 0.23 0.00 0.00 176.91 178.16 1aax h VAL 99 N 0.25 0.96 0.50 -5.77 2.07 -1.07 0.42 116.25 113.61 1aax h VAL 99 Ca 0.08 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 1aax h VAL 99 Cb 0.09 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.03 1aax h VAL 99 CO -0.01 0.13 -0.24 -0.25 0.02 0.00 0.00 177.57 177.22 1aax h TRP 100 N 0.73 -0.62 -0.62 1.57 2.91 -0.57 -2.50 115.95 116.85 1aax h TRP 100 Ca 0.33 -0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.34 1aax h TRP 100 Cb 0.22 0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 29.05 1aax h TRP 100 CO -0.07 -0.30 0.41 0.93 -1.03 0.00 0.00 178.44 178.39 1aax h GLU 101 N -0.93 0.82 -0.01 2.65 5.08 -0.52 -1.90 114.58 119.77 1aax h GLU 101 Ca -0.07 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1aax h GLU 101 Cb 0.60 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1aax h GLU 101 CO 0.11 0.54 -0.04 1.04 -1.00 0.00 0.00 179.01 179.66 1aax n GLN 102 N -4.44 1.18 -2.90 2.33 1.13 0.12 -4.94 117.38 109.86 1aax n GLN 102 Ca 0.06 -0.47 -0.22 0.00 -1.94 0.00 0.00 57.00 54.43 1aax n GLN 102 Cb 0.04 -1.49 0.03 0.00 0.11 0.00 0.00 30.24 28.93 1aax n GLN 102 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1aax n LYS 103 N -0.50 -4.33 -2.21 -1.09 5.02 -0.72 -4.04 118.16 110.31 1aax n LYS 103 Ca 0.19 0.93 -0.38 0.00 -2.02 0.00 0.00 58.31 57.03 1aax n LYS 103 Cb 0.26 -5.75 -0.01 0.00 -0.02 0.00 0.00 35.03 29.51 1aax n LYS 103 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1aax s SER 104 N -2.59 6.39 -0.09 4.39 0.01 -0.97 -0.71 113.70 120.12 1aax s SER 104 Ca 0.25 2.44 0.16 0.00 1.31 0.00 0.00 55.95 60.10 1aax s SER 104 Cb -0.11 -2.62 -0.24 0.00 0.21 0.00 0.00 66.02 63.27 1aax s SER 104 CO 0.31 -0.78 0.23 -1.14 0.41 0.00 0.00 173.24 172.27 1aax n ARG 105 N -0.00 0.93 -4.12 12.44 3.00 -1.26 -4.87 116.66 122.77 1aax n ARG 105 Ca 0.05 -0.09 -0.12 0.00 -0.00 0.00 0.00 57.85 57.69 1aax n ARG 105 Cb 0.46 -1.41 -0.11 0.00 0.00 0.00 0.00 32.46 31.40 1aax n ARG 105 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1aax s GLY 106 N -4.45 0.64 -0.11 5.14 0.00 -1.26 -1.62 107.32 105.66 1aax s GLY 106 Ca -0.07 -1.06 -0.00 0.00 0.00 0.00 0.00 44.72 43.58 1aax s GLY 106 CO 0.69 -1.14 -0.08 0.14 0.00 0.00 0.00 173.10 172.71 1aax s VAL 107 N -2.51 1.03 -0.30 1.40 1.01 -0.21 -1.70 120.40 119.13 1aax s VAL 107 Ca 0.01 -0.29 -0.10 0.00 0.00 0.00 0.00 61.98 61.60 1aax s VAL 107 Cb -0.02 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.30 1aax s VAL 107 CO -0.02 0.37 0.15 -0.69 0.00 0.00 0.00 175.10 174.90 1aax s VAL 108 N 1.68 4.68 -0.23 2.92 1.01 0.13 -1.05 120.40 129.54 1aax s VAL 108 Ca 0.05 -0.29 -0.06 0.00 0.00 0.00 0.00 61.98 61.68 1aax s VAL 108 Cb -0.13 -3.33 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 1aax s VAL 108 CO -0.08 0.14 0.02 -0.32 0.00 0.00 0.00 175.10 174.85 1aax s MET 109 N 1.64 3.54 0.00 2.72 0.00 0.15 -0.69 119.30 126.66 1aax s MET 109 Ca 0.05 -0.54 0.18 0.00 0.00 0.00 0.00 55.69 55.39 1aax s MET 109 Cb -0.17 -3.17 0.31 0.00 0.00 0.00 0.00 34.83 31.80 1aax s MET 109 CO 0.07 -0.17 1.24 1.28 0.00 0.00 0.00 175.02 177.44 1aax n LEU 110 N 4.80 2.99 0.00 4.11 4.77 -0.38 -0.94 117.00 132.35 1aax n LEU 110 Ca -0.17 -1.44 -0.28 0.00 -0.03 0.00 0.00 56.01 54.09 1aax n LEU 110 Cb 0.51 -0.17 -0.07 0.00 -2.33 0.00 0.00 43.42 41.36 1aax n LEU 110 CO 0.30 0.64 -0.19 -0.46 -1.33 0.00 0.00 177.39 176.36 1aax n ASN 111 N 1.11 1.85 -4.57 -1.43 6.94 -1.25 -4.48 115.26 113.43 1aax n ASN 111 Ca 0.15 -3.21 -0.24 0.00 -0.02 0.00 0.00 54.58 51.26 1aax n ASN 111 Cb 0.50 0.85 -0.09 0.00 -2.36 0.00 0.00 39.78 38.68 1aax n ASN 111 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1aax s ARG 112 N -3.65 2.03 0.28 -3.83 0.52 -1.26 -4.76 118.95 108.27 1aax s ARG 112 Ca 0.15 -1.49 -0.02 0.00 -0.52 0.00 0.00 55.73 53.84 1aax s ARG 112 Cb 0.01 -2.03 0.42 0.00 0.52 0.00 0.00 34.95 33.86 1aax s ARG 112 CO 0.11 0.37 1.92 0.28 0.02 0.00 0.00 175.30 178.00 1aax h VAL 113 N 2.25 1.16 -3.31 3.52 2.07 -1.93 -3.41 116.25 116.61 1aax h VAL 113 Ca -0.44 -0.40 -0.63 0.00 0.82 0.00 0.00 66.70 66.05 1aax h VAL 113 Cb 1.24 -0.12 -0.34 0.00 -1.52 0.00 0.00 31.29 30.56 1aax h VAL 113 CO 0.58 0.21 -0.86 -0.32 0.02 0.00 0.00 177.57 177.21 1aax s MET 114 N -5.99 2.66 -0.01 1.57 -2.45 -1.26 -0.88 119.30 112.94 1aax s MET 114 Ca -0.12 -0.73 -0.00 0.00 -1.25 0.00 0.00 55.69 53.59 1aax s MET 114 Cb 0.19 -2.10 0.01 0.00 1.25 0.00 0.00 34.83 34.18 1aax s MET 114 CO 0.81 0.06 0.01 -1.21 1.05 0.00 0.00 175.02 175.74 1aax s GLU 115 N 0.63 -0.01 -1.54 4.11 2.02 -0.36 -4.86 118.70 118.69 1aax s GLU 115 Ca -0.13 0.06 -0.14 0.00 0.02 0.00 0.00 54.97 54.78 1aax s GLU 115 Cb -0.16 -0.08 0.09 0.00 0.10 0.00 0.00 34.13 34.08 1aax s GLU 115 CO 0.03 -0.05 0.94 1.63 0.02 0.00 0.00 175.26 177.83 1aax n LYS 116 N 3.42 -5.23 -0.97 1.61 5.02 -1.26 -0.73 118.16 120.02 1aax n LYS 116 Ca -0.17 0.58 0.00 0.00 -2.02 0.00 0.00 58.31 56.70 1aax n LYS 116 Cb 0.57 -5.46 0.00 0.00 -0.02 0.00 0.00 35.03 30.12 1aax n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1aax n GLY 117 N -1.64 0.28 3.31 0.72 0.00 -1.26 -4.99 105.19 101.60 1aax n GLY 117 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 1aax n GLY 117 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1aax s SER 118 N -2.06 2.76 -0.57 1.61 0.15 0.09 -5.09 113.70 110.58 1aax s SER 118 Ca 0.00 -0.66 -0.26 0.00 0.70 0.00 0.00 55.95 55.73 1aax s SER 118 Cb 0.00 -0.18 0.04 0.00 -1.71 0.00 0.00 66.02 64.16 1aax s SER 118 CO 0.00 0.13 1.07 -0.76 1.20 0.00 0.00 173.24 174.88 1aax s LEU 119 N -1.73 3.77 0.00 3.45 1.43 -1.26 -1.23 118.68 123.11 1aax s LEU 119 Ca 0.09 -0.13 0.26 0.00 -1.03 0.00 0.00 54.13 53.32 1aax s LEU 119 Cb -0.10 -2.99 0.64 0.00 0.03 0.00 0.00 46.19 43.77 1aax s LEU 119 CO 0.04 -1.36 1.49 0.29 0.23 0.00 0.00 176.35 177.04 1aax n LYS 120 N 7.98 0.96 -3.62 1.70 4.76 -0.06 -4.95 118.16 124.93 1aax n LYS 120 Ca 0.05 -0.62 -0.07 0.00 -2.87 0.00 0.00 58.31 54.80 1aax n LYS 120 Cb 0.48 -1.49 -0.06 0.00 -1.84 0.00 0.00 35.03 32.13 1aax n LYS 120 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1aax s ALA 122 N -0.51 2.74 -1.14 0.00 0.00 -0.05 -4.68 121.76 118.12 1aax s ALA 122 Ca 0.03 -0.00 -0.19 0.00 0.00 0.00 0.00 51.96 51.80 1aax s ALA 122 Cb -0.03 -3.14 0.09 0.00 0.00 0.00 0.00 23.12 20.04 1aax s ALA 122 CO -0.05 -1.15 1.51 -1.14 0.00 0.00 0.00 175.76 174.93 1aax s GLN 123 N -5.10 3.82 0.00 0.00 2.00 -1.26 -4.81 119.66 114.31 1aax s GLN 123 Ca 0.58 -1.78 0.28 0.00 -2.00 0.00 0.00 55.36 52.44 1aax s GLN 123 Cb -0.13 -5.32 1.17 0.00 0.80 0.00 0.00 33.01 29.53 1aax s GLN 123 CO 0.55 -2.10 1.82 2.48 -0.50 0.00 0.00 175.29 177.54 1aax n TYR 124 N 7.85 0.00 -4.21 1.67 0.18 -1.26 -4.88 117.16 116.51 1aax n TYR 124 Ca 0.38 0.00 -0.16 0.00 1.88 0.00 0.00 57.90 60.00 1aax n TYR 124 Cb 0.48 -0.08 -0.11 0.00 -0.38 0.00 0.00 39.34 39.24 1aax n TYR 124 CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 1aax s TRP 125 N -2.25 1.25 0.24 -3.48 -2.14 -1.26 -5.05 118.94 106.25 1aax s TRP 125 Ca 0.34 -0.59 -0.30 0.00 2.66 0.00 0.00 56.10 58.21 1aax s TRP 125 Cb 0.20 -0.67 -0.09 0.00 -3.10 0.00 0.00 33.47 29.82 1aax s TRP 125 CO 0.42 0.08 1.27 -2.14 -2.66 0.00 0.00 176.95 173.92 1aax s PRO 126 N -2.70 4.42 0.06 3.25 0.02 -1.26 -4.94 135.00 133.85 1aax s PRO 126 Ca 0.07 2.05 0.23 0.00 0.02 0.00 0.00 61.00 63.37 1aax s PRO 126 Cb -0.04 -3.16 0.18 0.00 0.02 0.00 0.00 34.50 31.49 1aax s PRO 126 CO 0.02 -0.16 1.15 1.04 -0.33 0.00 0.00 177.00 178.72 1aax n GLN 127 N 1.94 0.24 -3.98 5.54 6.02 -1.26 -4.68 117.38 121.20 1aax n GLN 127 Ca 0.03 0.02 -0.15 0.00 -0.01 0.00 0.00 57.00 56.90 1aax n GLN 127 Cb 0.43 -1.60 -0.15 0.00 1.02 0.00 0.00 30.24 29.94 1aax n GLN 127 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1aax s LYS 128 N -3.16 0.21 0.20 -1.09 1.02 -1.26 -5.06 119.74 110.61 1aax s LYS 128 Ca 0.05 -0.04 -0.12 0.00 0.02 0.00 0.00 55.97 55.88 1aax s LYS 128 Cb 0.15 -0.26 0.25 0.00 -0.52 0.00 0.00 37.83 37.45 1aax s LYS 128 CO 0.77 0.01 1.67 0.93 -0.92 0.00 0.00 175.35 177.80 1aax h GLU 129 N 6.38 0.10 0.00 1.68 3.07 -1.91 -1.57 114.58 122.34 1aax h GLU 129 Ca -0.30 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.55 1aax h GLU 129 Cb 1.18 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.07 1aax h GLU 129 CO 0.50 0.07 0.00 -0.85 -1.40 0.00 0.00 179.01 177.33 1aax n GLU 130 N -5.28 0.39 -3.50 2.33 0.00 -1.26 -4.09 120.64 109.23 1aax n GLU 130 Ca 0.08 0.06 -0.29 0.00 0.00 0.00 0.00 57.16 57.01 1aax n GLU 130 Cb 0.32 -1.50 -0.08 0.00 0.00 0.00 0.00 31.44 30.18 1aax n GLU 130 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1aax n LYS 131 N -1.24 2.55 -1.35 3.44 4.76 -0.59 -5.09 118.16 120.64 1aax n LYS 131 Ca 0.12 -4.62 -0.31 0.00 -2.87 0.00 0.00 58.31 50.63 1aax n LYS 131 Cb 0.17 -2.29 0.08 0.00 -1.84 0.00 0.00 35.03 31.14 1aax n LYS 131 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 1aax s GLU 132 N -2.24 2.40 -0.08 1.97 1.03 -1.26 -4.61 118.70 115.91 1aax s GLU 132 Ca 0.35 1.08 0.01 0.00 0.03 0.00 0.00 54.97 56.44 1aax s GLU 132 Cb 0.09 -1.92 -0.03 0.00 -0.80 0.00 0.00 34.13 31.47 1aax s GLU 132 CO -0.04 -1.51 -0.10 -1.64 -1.33 0.00 0.00 175.26 170.64 1aax s MET 133 N -4.95 2.87 -0.13 -4.83 -1.94 0.09 -4.97 119.30 105.45 1aax s MET 133 Ca 0.60 -0.61 0.01 0.00 -1.71 0.00 0.00 55.69 53.99 1aax s MET 133 Cb -0.16 -2.57 -0.01 0.00 2.01 0.00 0.00 34.83 34.10 1aax s MET 133 CO 0.56 0.54 -0.18 0.42 -0.01 0.00 0.00 175.02 176.35 1aax s ILE 134 N -0.48 2.58 -0.63 2.53 -1.09 -1.26 -0.60 121.20 122.24 1aax s ILE 134 Ca 0.07 -0.82 -0.10 0.00 -2.23 0.00 0.00 60.65 57.56 1aax s ILE 134 Cb -0.12 -2.05 0.16 0.00 -1.58 0.00 0.00 42.46 38.87 1aax s ILE 134 CO 0.02 0.53 0.53 -0.36 -1.23 0.00 0.00 174.94 174.43 1aax s PHE 135 N 0.49 3.51 0.23 3.97 0.08 0.07 -4.94 117.98 121.39 1aax s PHE 135 Ca -0.12 -2.03 -0.05 0.00 0.12 0.00 0.00 56.93 54.84 1aax s PHE 135 Cb -0.16 -3.58 0.38 0.00 -0.57 0.00 0.00 43.02 39.09 1aax s PHE 135 CO 0.05 -0.96 1.78 0.93 -0.10 0.00 0.00 175.22 176.92 1aax h GLU 136 N 7.96 0.62 -0.64 0.44 3.07 -1.97 0.38 114.58 124.43 1aax h GLU 136 Ca -0.07 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.75 1aax h GLU 136 Cb 1.04 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 28.78 1aax h GLU 136 CO 0.82 0.41 0.41 0.38 -1.40 0.00 0.00 179.01 179.63 1aax h ASP 137 N 0.64 0.75 -0.13 1.42 2.03 -1.97 -3.12 116.42 116.05 1aax h ASP 137 Ca 0.38 -0.04 0.00 0.00 -0.73 0.00 0.00 57.03 56.64 1aax h ASP 137 Cb 0.41 -0.19 0.00 0.00 -0.83 0.00 0.00 39.33 38.72 1aax h ASP 137 CO -0.28 0.57 0.00 0.35 -1.03 0.00 0.00 179.24 178.84 1aax n THR 138 N -4.62 0.14 -3.49 1.15 -2.24 -1.10 -5.00 114.28 99.13 1aax n THR 138 Ca 0.05 -0.57 -0.20 0.00 -2.27 0.00 0.00 64.05 61.06 1aax n THR 138 Cb 0.03 1.34 0.06 0.00 -2.10 0.00 0.00 70.33 69.67 1aax n THR 138 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1aax n ASN 139 N 1.34 -3.62 -4.20 3.42 5.15 0.11 -4.93 115.26 112.52 1aax n ASN 139 Ca 0.15 -0.76 -0.20 0.00 -0.60 0.00 0.00 54.58 53.17 1aax n ASN 139 Cb 0.58 -4.61 -0.12 0.00 -0.53 0.00 0.00 39.78 35.10 1aax n ASN 139 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1aax s LEU 140 N -6.17 2.27 -0.02 1.20 1.43 -1.11 -1.67 118.68 114.62 1aax s LEU 140 Ca 0.20 -0.62 0.06 0.00 -1.03 0.00 0.00 54.13 52.74 1aax s LEU 140 Cb -0.04 -0.62 -0.01 0.00 0.03 0.00 0.00 46.19 45.55 1aax s LEU 140 CO 0.77 -0.03 -0.20 -0.75 0.23 0.00 0.00 176.35 176.37 1aax s LYS 141 N -1.73 1.67 -0.06 1.70 2.20 -0.11 -0.75 119.74 122.65 1aax s LYS 141 Ca 0.00 -0.71 0.01 0.00 -0.36 0.00 0.00 55.97 54.92 1aax s LYS 141 Cb -0.10 -1.58 0.02 0.00 -1.51 0.00 0.00 37.83 34.66 1aax s LYS 141 CO 0.03 0.40 -0.08 -1.17 -0.36 0.00 0.00 175.35 174.17 1aax s LEU 142 N -0.39 1.40 -0.02 5.43 2.96 0.23 -0.01 118.68 128.28 1aax s LEU 142 Ca 0.06 -0.21 0.05 0.00 -0.22 0.00 0.00 54.13 53.81 1aax s LEU 142 Cb -0.08 -0.63 -0.01 0.00 0.50 0.00 0.00 46.19 45.97 1aax s LEU 142 CO -0.00 -0.03 -0.16 -0.89 -1.32 0.00 0.00 176.35 173.94 1aax s THR 143 N 0.94 1.31 -0.15 3.68 2.01 -0.53 -0.73 115.64 122.17 1aax s THR 143 Ca -0.10 -0.69 -0.29 0.00 0.31 0.00 0.00 61.69 60.91 1aax s THR 143 Cb -0.15 -1.10 -0.00 0.00 0.01 0.00 0.00 72.50 71.26 1aax s THR 143 CO 0.00 0.37 1.02 -0.22 -0.69 0.00 0.00 174.62 175.11 1aax s LEU 144 N -0.24 4.19 -0.20 4.42 2.96 -1.26 -1.02 118.68 127.53 1aax s LEU 144 Ca 0.03 1.48 -0.05 0.00 -0.22 0.00 0.00 54.13 55.37 1aax s LEU 144 Cb -0.08 -3.55 -0.21 0.00 0.50 0.00 0.00 46.19 42.86 1aax s LEU 144 CO 0.00 -0.53 0.04 -0.38 -1.32 0.00 0.00 176.35 174.17 1aax n ILE 145 N 4.82 1.62 -3.68 6.68 2.08 0.51 -4.33 119.36 127.06 1aax n ILE 145 Ca 0.10 -0.55 -0.04 0.00 0.56 0.00 0.00 62.75 62.82 1aax n ILE 145 Cb 0.48 -1.64 -0.01 0.00 -0.75 0.00 0.00 39.64 37.72 1aax n ILE 145 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 1aax s SER 146 N -6.85 -0.19 -0.14 4.38 1.04 -1.14 -5.00 113.70 105.80 1aax s SER 146 Ca -0.30 -0.27 -0.16 0.00 0.48 0.00 0.00 55.95 55.70 1aax s SER 146 Cb 0.08 0.40 0.04 0.00 0.10 0.00 0.00 66.02 66.65 1aax s SER 146 CO 0.66 -0.72 0.45 -1.83 0.98 0.00 0.00 173.24 172.77 1aax s GLU 147 N -3.08 0.57 -0.33 4.02 -1.05 -1.26 -0.96 118.70 116.61 1aax s GLU 147 Ca 0.11 0.51 0.02 0.00 -0.15 0.00 0.00 54.97 55.46 1aax s GLU 147 Cb -0.00 0.27 0.09 0.00 -0.44 0.00 0.00 34.13 34.05 1aax s GLU 147 CO -0.01 -0.09 0.03 0.34 0.95 0.00 0.00 175.26 176.48 1aax s ASP 148 N -0.03 4.78 -0.12 0.83 2.15 0.42 -4.98 116.67 119.73 1aax s ASP 148 Ca -0.02 -1.89 -0.19 0.00 0.43 0.00 0.00 52.55 50.88 1aax s ASP 148 Cb -0.03 -1.65 -0.04 0.00 -0.30 0.00 0.00 42.92 40.90 1aax s ASP 148 CO 0.02 -0.35 0.51 -0.63 -0.17 0.00 0.00 175.17 174.54 1aax s ILE 149 N 1.01 5.16 0.51 4.11 1.01 -1.26 -1.11 121.20 130.63 1aax s ILE 149 Ca 0.05 1.02 0.01 0.00 0.00 0.00 0.00 60.65 61.73 1aax s ILE 149 Cb -0.20 -3.85 -0.01 0.00 0.01 0.00 0.00 42.46 38.41 1aax s ILE 149 CO -0.06 0.30 0.01 -0.54 0.00 0.00 0.00 174.94 174.65 1aax s LYS 150 N 0.73 2.18 0.21 2.79 -0.14 0.05 -5.00 119.74 120.55 1aax s LYS 150 Ca 0.27 -2.39 -0.10 0.00 -1.36 0.00 0.00 55.97 52.39 1aax s LYS 150 Cb -0.15 -1.46 0.19 0.00 -1.68 0.00 0.00 37.83 34.73 1aax s LYS 150 CO 0.11 -0.38 1.84 0.66 -0.76 0.00 0.00 175.35 176.82 1aax h SER 151 N 1.37 0.66 0.00 2.83 4.64 -0.63 -3.28 113.55 119.15 1aax h SER 151 Ca -0.43 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1aax h SER 151 Cb 1.31 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1aax h SER 151 CO 0.73 0.45 0.00 0.00 -0.87 0.00 0.00 176.83 177.14 1aax n TYR 152 N -4.70 0.00 -3.45 4.77 4.11 -1.26 -4.99 117.16 111.63 1aax n TYR 152 Ca 0.07 -0.40 -0.12 0.00 -0.00 0.00 0.00 57.90 57.45 1aax n TYR 152 Cb 0.11 -0.04 -0.03 0.00 -0.00 0.00 0.00 39.34 39.38 1aax n TYR 152 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.86 178.38 1aax s TYR 153 N -0.80 -0.53 -0.01 -3.48 -0.85 -1.24 -1.29 117.35 109.15 1aax s TYR 153 Ca 0.00 0.45 0.01 0.00 -0.52 0.00 0.00 57.07 57.01 1aax s TYR 153 Cb 0.00 0.53 0.01 0.00 0.38 0.00 0.00 41.96 42.88 1aax s TYR 153 CO 0.00 -0.76 -0.03 0.99 -1.52 0.00 0.00 175.55 174.23 1aax s THR 154 N -3.20 0.31 -0.16 -3.49 2.01 0.01 -0.77 115.64 110.36 1aax s THR 154 Ca -0.00 -0.11 -0.03 0.00 0.31 0.00 0.00 61.69 61.86 1aax s THR 154 Cb -0.01 -0.31 -0.02 0.00 0.01 0.00 0.00 72.50 72.17 1aax s THR 154 CO -0.09 0.12 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.21 1aax s VAL 155 N 0.28 3.58 0.08 3.82 1.01 -0.27 -0.48 120.40 128.41 1aax s VAL 155 Ca -0.03 -0.46 0.09 0.00 0.00 0.00 0.00 61.98 61.58 1aax s VAL 155 Cb -0.06 -2.56 -0.03 0.00 0.00 0.00 0.00 36.38 33.72 1aax s VAL 155 CO -0.00 0.49 -0.21 -0.13 0.00 0.00 0.00 175.10 175.24 1aax s ARG 156 N 0.52 1.83 -0.24 2.72 0.52 0.89 -0.43 118.95 124.77 1aax s ARG 156 Ca -0.05 -1.12 -0.06 0.00 -0.52 0.00 0.00 55.73 53.98 1aax s ARG 156 Cb -0.15 -2.08 -0.02 0.00 0.52 0.00 0.00 34.95 33.22 1aax s ARG 156 CO 0.03 0.50 0.04 -1.14 0.02 0.00 0.00 175.30 174.75 1aax s GLN 157 N -1.67 3.59 0.24 3.54 0.74 -0.14 -0.72 119.66 125.24 1aax s GLN 157 Ca 0.15 -0.52 0.12 0.00 0.05 0.00 0.00 55.36 55.16 1aax s GLN 157 Cb -0.10 -3.22 -0.05 0.00 1.10 0.00 0.00 33.01 30.74 1aax s GLN 157 CO 0.06 -0.17 -0.22 -0.51 -0.55 0.00 0.00 175.29 173.90 1aax s LEU 158 N 1.51 2.52 -0.20 3.68 1.43 0.36 -0.36 118.68 127.62 1aax s LEU 158 Ca 0.06 -0.96 0.01 0.00 -1.03 0.00 0.00 54.13 52.21 1aax s LEU 158 Cb -0.15 -1.13 0.04 0.00 0.03 0.00 0.00 46.19 44.98 1aax s LEU 158 CO 0.02 0.07 -0.13 -0.70 0.23 0.00 0.00 176.35 175.84 1aax s GLU 159 N -3.14 2.29 -0.20 1.70 2.12 -0.19 -1.01 118.70 120.27 1aax s GLU 159 Ca 0.26 -0.87 -0.09 0.00 0.36 0.00 0.00 54.97 54.64 1aax s GLU 159 Cb -0.06 -2.46 -0.04 0.00 0.26 0.00 0.00 34.13 31.82 1aax s GLU 159 CO 0.13 -0.37 0.10 -1.17 -0.54 0.00 0.00 175.26 173.40 1aax s LEU 160 N 1.35 3.94 -0.10 2.70 2.96 0.03 -1.46 118.68 128.11 1aax s LEU 160 Ca -0.00 0.10 0.03 0.00 -0.22 0.00 0.00 54.13 54.04 1aax s LEU 160 Cb -0.16 -2.02 0.01 0.00 0.50 0.00 0.00 46.19 44.52 1aax s LEU 160 CO -0.09 0.14 -0.19 -0.70 -1.32 0.00 0.00 176.35 174.19 1aax s GLU 161 N 0.59 2.51 -0.72 1.98 2.12 0.99 -0.95 118.70 125.21 1aax s GLU 161 Ca 0.05 -0.68 -0.25 0.00 0.36 0.00 0.00 54.97 54.45 1aax s GLU 161 Cb -0.12 -1.99 0.05 0.00 0.26 0.00 0.00 34.13 32.32 1aax s GLU 161 CO 0.01 0.07 1.17 1.21 -0.54 0.00 0.00 175.26 177.17 1aax s ASN 162 N 0.62 6.18 0.58 -1.70 3.84 -0.61 -0.94 114.94 122.91 1aax s ASN 162 Ca -0.14 -0.69 0.28 0.00 0.21 0.00 0.00 52.86 52.52 1aax s ASN 162 Cb -0.16 -2.51 1.63 0.00 -0.55 0.00 0.00 41.25 39.66 1aax s ASN 162 CO 0.04 -1.68 2.11 -0.07 -2.79 0.00 0.00 177.10 174.71 1aax h LEU 163 N 12.38 0.00 -0.77 3.21 3.38 -1.62 0.58 115.31 132.47 1aax h LEU 163 Ca -0.27 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.58 1aax h LEU 163 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1aax h LEU 163 CO 1.25 0.00 -0.39 0.74 0.09 0.00 0.00 178.44 180.13 1aax h THR 164 N 0.00 1.30 -0.00 0.22 2.02 -1.89 -3.29 112.91 111.26 1aax h THR 164 Ca 0.09 -1.52 0.00 0.00 0.77 0.00 0.00 66.41 65.74 1aax h THR 164 Cb 0.46 1.56 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 1aax h THR 164 CO -0.00 0.47 -0.36 0.35 0.37 0.00 0.00 175.52 176.35 1aax n THR 165 N -4.04 0.00 -1.33 3.16 -2.24 -0.74 -4.99 114.28 104.10 1aax n THR 165 Ca -0.01 -0.32 -0.11 0.00 -2.27 0.00 0.00 64.05 61.33 1aax n THR 165 Cb 0.49 1.01 -0.05 0.00 -2.10 0.00 0.00 70.33 69.69 1aax n THR 165 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1aax n GLN 166 N -1.07 -1.28 -2.96 -0.78 6.02 0.20 -4.98 117.38 112.52 1aax n GLN 166 Ca 0.02 0.87 -0.37 0.00 -0.01 0.00 0.00 57.00 57.50 1aax n GLN 166 Cb 0.14 -5.06 -0.06 0.00 1.02 0.00 0.00 30.24 26.27 1aax n GLN 166 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1aax s GLU 167 N -2.83 4.46 0.11 -1.09 2.12 -1.22 -4.88 118.70 115.35 1aax s GLU 167 Ca 0.00 1.10 0.07 0.00 0.36 0.00 0.00 54.97 56.51 1aax s GLU 167 Cb 0.00 -2.96 -0.04 0.00 0.26 0.00 0.00 34.13 31.39 1aax s GLU 167 CO 0.00 0.41 -0.18 0.95 -0.54 0.00 0.00 175.26 175.90 1aax s THR 168 N -1.45 1.55 0.01 -1.70 -4.23 -1.26 -1.57 115.64 107.00 1aax s THR 168 Ca 0.43 -1.60 -0.00 0.00 -1.18 0.00 0.00 61.69 59.34 1aax s THR 168 Cb -0.19 -1.51 -0.01 0.00 1.34 0.00 0.00 72.50 72.12 1aax s THR 168 CO 0.24 -0.20 -0.02 -0.13 -0.54 0.00 0.00 174.62 173.97 1aax s ARG 169 N -2.17 0.24 -0.18 3.99 0.52 -0.12 -4.99 118.95 116.24 1aax s ARG 169 Ca 0.07 -0.46 -0.19 0.00 -0.52 0.00 0.00 55.73 54.63 1aax s ARG 169 Cb -0.08 0.09 -0.03 0.00 0.52 0.00 0.00 34.95 35.44 1aax s ARG 169 CO 0.04 -0.04 0.53 -2.00 0.02 0.00 0.00 175.30 173.85 1aax s GLU 170 N -1.11 4.23 -0.10 3.54 2.12 -1.26 -0.79 118.70 125.32 1aax s GLU 170 Ca -0.12 0.46 0.01 0.00 0.36 0.00 0.00 54.97 55.68 1aax s GLU 170 Cb -0.08 -3.54 -0.02 0.00 0.26 0.00 0.00 34.13 30.76 1aax s GLU 170 CO -0.01 -0.10 -0.13 0.42 -0.54 0.00 0.00 175.26 174.91 1aax s ILE 171 N 1.47 3.13 -0.18 -3.70 -1.09 -0.18 -4.89 121.20 115.76 1aax s ILE 171 Ca 0.25 -0.65 -0.09 0.00 -2.23 0.00 0.00 60.65 57.93 1aax s ILE 171 Cb -0.15 -2.29 -0.05 0.00 -1.58 0.00 0.00 42.46 38.39 1aax s ILE 171 CO 0.10 0.55 0.11 -0.76 -1.23 0.00 0.00 174.94 173.70 1aax s LEU 172 N -0.03 4.08 -0.23 2.97 1.43 -0.64 -0.49 118.68 125.77 1aax s LEU 172 Ca -0.03 0.20 -0.03 0.00 -1.03 0.00 0.00 54.13 53.24 1aax s LEU 172 Cb -0.14 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.04 1aax s LEU 172 CO 0.04 0.20 -0.04 -2.28 0.23 0.00 0.00 176.35 174.50 1aax s HIS 173 N 0.21 3.00 -0.34 0.29 2.46 0.10 -1.04 115.29 119.97 1aax s HIS 173 Ca 0.07 -1.14 -0.08 0.00 0.47 0.00 0.00 55.06 54.39 1aax s HIS 173 Cb -0.12 -2.10 0.03 0.00 -0.13 0.00 0.00 32.58 30.27 1aax s HIS 173 CO -0.01 -0.61 0.13 -0.06 -2.47 0.00 0.00 174.74 171.72 1aax s PHE 174 N 1.43 3.24 -0.36 3.88 0.08 -0.21 -0.07 117.98 125.97 1aax s PHE 174 Ca 0.04 -1.27 -0.05 0.00 0.12 0.00 0.00 56.93 55.78 1aax s PHE 174 Cb -0.15 -2.32 0.07 0.00 -0.57 0.00 0.00 43.02 40.05 1aax s PHE 174 CO -0.03 -0.69 0.13 -1.58 -0.10 0.00 0.00 175.22 172.94 1aax s HIS 175 N 1.45 3.35 -0.40 0.36 2.46 0.36 -0.68 115.29 122.19 1aax s HIS 175 Ca -0.00 -1.80 -0.24 0.00 0.47 0.00 0.00 55.06 53.49 1aax s HIS 175 Cb -0.19 -2.57 0.02 0.00 -0.13 0.00 0.00 32.58 29.71 1aax s HIS 175 CO 0.04 -0.83 0.81 -0.47 -2.47 0.00 0.00 174.74 171.82 1aax s TYR 176 N 1.30 3.05 -2.77 3.88 6.14 -0.11 -0.81 117.35 128.04 1aax s TYR 176 Ca 0.00 0.43 0.24 0.00 0.64 0.00 0.00 57.07 58.38 1aax s TYR 176 Cb -0.21 -3.56 0.29 0.00 0.42 0.00 0.00 41.96 38.90 1aax s TYR 176 CO -0.00 -0.86 1.32 0.25 0.64 0.00 0.00 175.55 176.90 1aax n THR 177 N 5.98 0.22 -1.65 4.34 -2.24 -0.41 -3.80 114.28 116.73 1aax n THR 177 Ca 0.03 -0.61 0.06 0.00 -2.27 0.00 0.00 64.05 61.26 1aax n THR 177 Cb 0.48 1.27 0.16 0.00 -2.10 0.00 0.00 70.33 70.15 1aax n THR 177 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1aax n THR 178 N 1.42 1.77 -3.59 4.28 -2.24 -1.24 -4.85 114.28 109.83 1aax n THR 178 Ca 0.16 -2.65 -0.40 0.00 -2.27 0.00 0.00 64.05 58.89 1aax n THR 178 Cb 0.61 -0.04 -0.09 0.00 -2.10 0.00 0.00 70.33 68.70 1aax n THR 178 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1aax s TRP 179 N -2.61 3.37 0.46 4.78 -0.11 -1.26 -4.75 118.94 118.81 1aax s TRP 179 Ca 0.35 -1.64 -0.24 0.00 1.22 0.00 0.00 56.10 55.79 1aax s TRP 179 Cb 0.34 -3.13 -0.07 0.00 -1.50 0.00 0.00 33.47 29.11 1aax s TRP 179 CO -0.06 -0.89 1.33 -2.14 -4.62 0.00 0.00 176.95 170.57 1aax s PRO 180 N 1.41 3.67 0.38 5.86 0.02 -1.26 -4.76 135.00 140.32 1aax s PRO 180 Ca 0.04 2.20 -0.27 0.00 0.02 0.00 0.00 61.00 62.98 1aax s PRO 180 Cb -0.24 -2.57 -0.10 0.00 0.02 0.00 0.00 34.50 31.61 1aax s PRO 180 CO 0.01 -0.75 1.37 0.16 -0.33 0.00 0.00 177.00 177.46 1aax s ASP 181 N -0.80 6.43 -1.42 2.53 -4.77 -1.26 -0.71 116.67 116.66 1aax s ASP 181 Ca 0.62 2.82 0.00 0.00 -3.30 0.00 0.00 52.55 52.69 1aax s ASP 181 Cb -0.39 -2.65 0.00 0.00 -1.09 0.00 0.00 42.92 38.79 1aax s ASP 181 CO 0.49 -0.79 0.00 0.49 0.70 0.00 0.00 175.17 176.06 1aax n PHE 182 N 0.42 0.00 -4.38 2.11 3.72 -1.26 -4.95 117.46 113.12 1aax n PHE 182 Ca 0.02 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.24 1aax n PHE 182 Cb 0.41 -2.75 -0.03 0.00 -0.94 0.00 0.00 39.48 36.17 1aax n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1aax n GLY 183 N -0.39 3.82 3.34 1.37 0.00 0.11 -4.93 105.19 108.50 1aax n GLY 183 Ca -0.13 -2.30 -0.19 0.00 0.00 0.00 0.00 46.02 43.40 1aax n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1aax s VAL 184 N -1.97 1.70 1.04 1.61 -7.23 -1.26 -4.79 120.40 109.49 1aax s VAL 184 Ca 0.01 -2.16 -0.12 0.00 -1.81 0.00 0.00 61.98 57.90 1aax s VAL 184 Cb -0.00 -1.99 0.21 0.00 0.56 0.00 0.00 36.38 35.16 1aax s VAL 184 CO 0.00 -0.57 1.08 -2.84 -0.31 0.00 0.00 175.10 172.46 1aax s PRO 185 N -3.53 0.05 0.32 4.82 0.02 -1.26 -4.64 135.00 130.78 1aax s PRO 185 Ca 0.21 1.08 0.02 0.00 0.02 0.00 0.00 61.00 62.33 1aax s PRO 185 Cb -0.01 -1.65 0.60 0.00 0.02 0.00 0.00 34.50 33.46 1aax s PRO 185 CO 0.06 -3.14 1.93 0.93 -0.33 0.00 0.00 177.00 176.45 1aax h GLU 186 N -2.22 0.91 -2.44 5.54 5.08 -1.98 -3.45 114.58 116.02 1aax h GLU 186 Ca -0.54 -0.05 0.07 0.00 -1.00 0.00 0.00 59.36 57.84 1aax h GLU 186 Cb 1.30 -0.21 -0.15 0.00 0.50 0.00 0.00 28.75 30.20 1aax h GLU 186 CO 0.48 0.60 0.42 -1.54 -1.00 0.00 0.00 179.01 177.97 1aax s SER 187 N -6.10 -0.42 0.35 1.42 1.04 -1.26 -5.00 113.70 103.72 1aax s SER 187 Ca -0.11 0.02 0.07 0.00 0.48 0.00 0.00 55.95 56.42 1aax s SER 187 Cb 0.19 0.44 0.77 0.00 0.10 0.00 0.00 66.02 67.53 1aax s SER 187 CO 0.79 -0.70 1.89 -0.65 0.98 0.00 0.00 173.24 175.54 1aax h PRO 188 N 2.03 0.72 -0.52 4.02 0.11 -1.94 -1.91 132.00 134.51 1aax h PRO 188 Ca -0.25 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 65.83 1aax h PRO 188 Cb 1.26 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 1aax h PRO 188 CO 0.33 0.48 0.32 0.00 -0.21 0.00 0.00 178.00 178.92 1aax h ALA 189 N 1.59 0.67 -0.48 -0.75 0.00 -1.95 0.13 119.26 118.47 1aax h ALA 189 Ca 0.42 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.27 1aax h ALA 189 Cb 0.58 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1aax h ALA 189 CO -0.18 0.05 0.16 0.77 0.00 0.00 0.00 179.25 180.05 1aax h SER 190 N 0.65 0.69 0.08 0.00 0.02 -1.62 -0.35 113.55 113.01 1aax h SER 190 Ca 0.21 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1aax h SER 190 Cb -0.01 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.35 1aax h SER 190 CO -0.08 0.70 -0.04 0.15 -1.14 0.00 0.00 176.83 176.43 1aax h PHE 191 N 0.64 -0.10 -0.37 3.45 3.57 -0.89 -2.33 116.94 120.92 1aax h PHE 191 Ca 0.16 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.61 1aax h PHE 191 Cb 0.25 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 1aax h PHE 191 CO 0.01 0.11 0.05 -0.07 -2.23 0.00 0.00 178.31 176.18 1aax h LEU 192 N -0.29 0.51 -0.60 0.59 3.38 -0.72 0.16 115.31 118.34 1aax h LEU 192 Ca -0.01 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1aax h LEU 192 Cb 0.25 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1aax h LEU 192 CO 0.02 0.54 0.25 -1.13 0.09 0.00 0.00 178.44 178.21 1aax h ASN 193 N 0.54 0.82 -0.18 -0.43 -1.24 -0.97 0.12 115.58 114.24 1aax h ASN 193 Ca 0.12 -0.16 -0.05 0.00 0.71 0.00 0.00 56.30 56.92 1aax h ASN 193 Cb 0.26 -0.21 -0.00 0.00 0.73 0.00 0.00 38.32 39.10 1aax h ASN 193 CO 0.00 0.76 -0.08 0.15 -1.29 0.00 0.00 177.43 176.97 1aax h PHE 194 N 0.83 0.44 -0.66 0.67 3.57 -0.77 -2.50 116.94 118.52 1aax h PHE 194 Ca 0.20 -0.11 0.02 0.00 3.53 0.00 0.00 57.97 61.61 1aax h PHE 194 Cb 0.19 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.79 1aax h PHE 194 CO 0.01 0.68 0.42 1.25 -2.23 0.00 0.00 178.31 178.44 1aax h LEU 195 N 0.07 0.72 -1.80 0.59 5.85 -0.53 -1.68 115.31 118.53 1aax h LEU 195 Ca 0.04 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 1aax h LEU 195 Cb 0.56 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.42 1aax h LEU 195 CO 0.03 0.51 -0.10 -0.26 -0.34 0.00 0.00 178.44 178.28 1aax h PHE 196 N 0.85 0.00 -0.24 1.25 -1.00 -0.93 -0.44 116.94 116.43 1aax h PHE 196 Ca 0.25 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.85 1aax h PHE 196 Cb -0.05 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.51 1aax h PHE 196 CO -0.04 0.10 -0.56 0.87 -1.61 0.00 0.00 178.31 177.08 1aax h LYS 197 N 0.00 0.80 -0.16 1.51 1.79 -0.85 0.66 116.57 120.32 1aax h LYS 197 Ca -0.00 -0.54 -0.02 0.00 -2.18 0.00 0.00 60.65 57.91 1aax h LYS 197 Cb 0.41 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.13 1aax h LYS 197 CO 0.01 1.17 0.02 0.28 -1.08 0.00 0.00 179.45 179.85 1aax h VAL 198 N 0.55 1.23 -0.22 0.50 2.07 -0.94 -2.63 116.25 116.82 1aax h VAL 198 Ca -0.00 -0.75 0.03 0.00 0.82 0.00 0.00 66.70 66.79 1aax h VAL 198 Cb 1.17 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 32.33 1aax h VAL 198 CO 0.12 0.23 0.05 0.03 0.02 0.00 0.00 177.57 178.02 1aax h ARG 199 N 0.04 0.14 -0.71 1.57 3.08 -1.06 -2.46 114.38 114.97 1aax h ARG 199 Ca 0.05 -0.01 0.16 0.00 0.07 0.00 0.00 59.98 60.25 1aax h ARG 199 Cb 0.33 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.30 1aax h ARG 199 CO 0.00 0.09 0.49 1.49 -1.07 0.00 0.00 179.97 180.97 1aax h GLU 200 N 0.14 0.27 0.00 0.04 4.81 -0.78 -2.12 114.58 116.94 1aax h GLU 200 Ca 0.10 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1aax h GLU 200 Cb 0.09 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.41 1aax h GLU 200 CO -0.13 0.18 0.00 -1.13 -0.73 0.00 0.00 179.01 177.20 1aax n SER 201 N -4.44 0.61 0.00 1.04 3.41 -0.93 -4.89 113.62 108.42 1aax n SER 201 Ca 0.14 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.37 1aax n SER 201 Cb 0.59 -0.76 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 1aax n SER 201 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1aax n GLY 202 N 0.39 1.36 0.30 5.00 0.00 -0.80 -4.92 105.19 106.52 1aax n GLY 202 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.17 1aax n GLY 202 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1aax h SER 203 N 0.00 0.03 -0.43 1.61 0.02 -1.79 -1.58 113.55 111.40 1aax h SER 203 Ca 0.00 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1aax h SER 203 Cb 0.00 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.53 1aax h SER 203 CO 0.00 0.02 0.00 0.18 -1.14 0.00 0.00 176.83 175.89 1aax n LEU 204 N -4.49 2.39 -4.79 5.07 4.77 -1.26 -4.33 117.00 114.36 1aax n LEU 204 Ca 0.01 -1.18 -0.36 0.00 -0.03 0.00 0.00 56.01 54.45 1aax n LEU 204 Cb 0.24 -0.29 -0.06 0.00 -2.33 0.00 0.00 43.42 40.98 1aax n LEU 204 CO 0.35 0.59 0.62 -0.44 -1.33 0.00 0.00 177.39 177.18 1aax s SER 205 N -1.05 7.26 0.53 -1.43 0.01 -0.60 -4.98 113.70 113.44 1aax s SER 205 Ca 0.31 1.77 0.35 0.00 1.31 0.00 0.00 55.95 59.69 1aax s SER 205 Cb 0.16 -2.55 1.87 0.00 0.21 0.00 0.00 66.02 65.71 1aax s SER 205 CO 0.21 -0.08 2.08 1.55 0.41 0.00 0.00 173.24 177.41 1aax h PRO 206 N 3.08 0.00 0.00 12.44 0.13 -1.91 -2.07 132.00 143.66 1aax h PRO 206 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1aax h PRO 206 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1aax h PRO 206 CO 0.65 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.81 1aax n GLU 207 N -2.78 0.01 -4.09 0.86 4.71 -1.26 -4.75 120.64 113.33 1aax n GLU 207 Ca -0.02 0.15 -0.23 0.00 -0.01 0.00 0.00 57.16 57.05 1aax n GLU 207 Cb 0.09 -1.52 -0.06 0.00 -1.01 0.00 0.00 31.44 28.94 1aax n GLU 207 CO 0.00 0.00 0.00 -1.01 0.09 0.00 0.00 177.13 176.21 1aax s HIS 208 N -3.01 2.69 1.25 -0.32 3.76 -0.78 -5.13 115.29 113.74 1aax s HIS 208 Ca 0.10 -0.42 -0.21 0.00 -0.15 0.00 0.00 55.06 54.39 1aax s HIS 208 Cb 0.14 -1.69 0.31 0.00 1.11 0.00 0.00 32.58 32.44 1aax s HIS 208 CO 0.39 0.31 1.10 0.20 -0.85 0.00 0.00 174.74 175.89 1aax s GLY 209 N -3.86 1.58 0.26 -2.22 0.00 0.11 -4.91 107.32 98.28 1aax s GLY 209 Ca 0.38 -1.03 -0.30 0.00 0.00 0.00 0.00 44.72 43.77 1aax s GLY 209 CO 0.23 -0.10 1.52 -4.14 0.00 0.00 0.00 173.10 170.61 1aax s PRO 210 N -5.46 4.20 0.47 2.90 0.02 -1.26 -4.48 135.00 131.40 1aax s PRO 210 Ca 0.72 2.43 -0.24 0.00 0.02 0.00 0.00 61.00 63.93 1aax s PRO 210 Cb -0.08 -3.07 -0.07 0.00 0.02 0.00 0.00 34.50 31.29 1aax s PRO 210 CO 0.56 -0.53 1.31 0.54 -0.33 0.00 0.00 177.00 178.55 1aax s VAL 211 N 0.08 2.44 -0.22 3.83 0.11 -1.26 -4.45 120.40 120.93 1aax s VAL 211 Ca 0.62 0.35 -0.16 0.00 -2.93 0.00 0.00 61.98 59.86 1aax s VAL 211 Cb -0.45 -3.19 -0.04 0.00 -1.53 0.00 0.00 36.38 31.17 1aax s VAL 211 CO 0.44 0.02 0.41 -0.69 -3.33 0.00 0.00 175.10 171.95 1aax s VAL 212 N -1.33 5.18 -0.11 2.04 1.01 -0.69 -1.03 120.40 125.47 1aax s VAL 212 Ca 0.64 0.71 0.02 0.00 0.00 0.00 0.00 61.98 63.35 1aax s VAL 212 Cb -0.38 -3.74 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 1aax s VAL 212 CO 0.47 0.21 -0.19 -0.69 0.00 0.00 0.00 175.10 174.90 1aax s VAL 213 N 1.58 2.49 0.08 2.92 1.01 0.98 0.18 120.40 129.65 1aax s VAL 213 Ca 0.19 -0.87 -0.09 0.00 0.00 0.00 0.00 61.98 61.21 1aax s VAL 213 Cb -0.15 -1.99 0.00 0.00 0.00 0.00 0.00 36.38 34.24 1aax s VAL 213 CO 0.08 0.55 0.20 -1.38 0.00 0.00 0.00 175.10 174.55 1aax s HIS 214 N 0.31 0.12 0.00 5.22 -3.43 0.14 -1.71 115.29 115.93 1aax s HIS 214 Ca -0.15 -0.51 0.00 0.00 -0.80 0.00 0.00 55.06 53.60 1aax s HIS 214 Cb -0.17 -0.04 0.00 0.00 -1.43 0.00 0.00 32.58 30.94 1aax s HIS 214 CO 0.07 -0.54 0.00 -1.13 -2.00 0.00 0.00 174.74 171.15 1aax n SER 215 N 0.03 0.00 -0.07 7.38 3.41 -1.25 -1.25 113.62 121.88 1aax n SER 215 Ca -0.16 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.34 1aax n SER 215 Cb 0.62 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.47 1aax n SER 215 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1aax h SER 216 N 0.00 0.00 0.88 4.04 0.87 -1.89 -1.82 113.55 115.64 1aax h SER 216 Ca 0.00 -0.74 -0.07 0.00 -1.23 0.00 0.00 61.79 59.75 1aax h SER 216 Cb 0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 1aax h SER 216 CO 0.00 0.90 -1.17 0.00 -0.53 0.00 0.00 176.83 176.03 1aax h ALA 217 N -0.26 0.57 -0.13 6.23 0.00 -1.88 0.17 119.26 123.96 1aax h ALA 217 Ca -0.01 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 1aax h ALA 217 Cb 0.77 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 1aax h ALA 217 CO -0.01 0.41 -0.00 0.41 0.00 0.00 0.00 179.25 180.06 1aax n GLY 218 N 1.27 0.44 0.22 0.00 0.00 -1.23 -3.94 105.19 101.95 1aax n GLY 218 Ca -0.04 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1aax n GLY 218 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1aax n ILE 219 N -3.82 0.00 0.00 -0.61 -5.35 -1.26 -4.43 119.36 103.89 1aax n ILE 219 Ca -0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1aax n ILE 219 Cb 0.50 -0.10 0.00 0.00 -1.74 0.00 0.00 39.64 38.31 1aax n ILE 219 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1aax n GLY 220 N 1.63 -0.12 0.32 3.28 0.00 -1.26 -0.80 105.19 108.24 1aax n GLY 220 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1aax n GLY 220 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1aax h ARG 221 N 0.00 0.97 -0.41 1.61 3.08 -1.95 -1.96 114.38 115.72 1aax h ARG 221 Ca 0.00 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 59.89 1aax h ARG 221 Cb 0.00 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 1aax h ARG 221 CO 0.00 0.79 0.26 0.77 -1.07 0.00 0.00 179.97 180.72 1aax h SER 222 N 0.95 0.48 -0.86 7.04 0.02 -1.88 0.05 113.55 119.36 1aax h SER 222 Ca 0.22 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.11 1aax h SER 222 Cb 0.19 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.57 1aax h SER 222 CO -0.02 0.38 0.46 1.23 -1.14 0.00 0.00 176.83 177.74 1aax h GLY 223 N 0.55 1.29 0.90 -3.77 0.00 -1.09 -1.37 103.07 99.58 1aax h GLY 223 Ca 0.15 -0.60 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 1aax h GLY 223 CO -0.03 0.57 0.09 -0.84 0.00 0.00 0.00 176.54 176.33 1aax h THR 224 N 1.21 1.17 0.30 4.70 2.02 -0.87 0.16 112.91 121.59 1aax h THR 224 Ca 0.30 -0.51 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1aax h THR 224 Cb 0.05 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.52 1aax h THR 224 CO -0.05 0.17 -0.31 0.15 0.37 0.00 0.00 175.52 175.85 1aax h PHE 225 N 0.21 -0.84 -0.75 3.16 3.57 -0.81 -2.41 116.94 119.07 1aax h PHE 225 Ca 0.07 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 1aax h PHE 225 Cb 0.18 0.33 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 1aax h PHE 225 CO -0.01 -0.44 0.34 0.00 -2.23 0.00 0.00 178.31 175.97 1aax h LEU 227 N 1.07 0.27 -0.45 0.00 5.85 -0.84 -0.69 115.31 120.52 1aax h LEU 227 Ca 0.26 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.88 1aax h LEU 227 Cb 0.14 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1aax h LEU 227 CO -0.03 0.28 0.26 0.00 -0.34 0.00 0.00 178.44 178.61 1aax h ALA 228 N 1.00 0.58 -0.05 1.25 0.00 -1.29 -1.37 119.26 119.37 1aax h ALA 228 Ca 0.07 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1aax h ALA 228 Cb 0.07 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1aax h ALA 228 CO -0.01 0.09 0.03 0.22 0.00 0.00 0.00 179.25 179.57 1aax h ASP 229 N 0.60 0.06 -0.45 0.00 3.58 -1.23 -1.72 116.42 117.26 1aax h ASP 229 Ca 0.16 -0.09 -0.00 0.00 0.42 0.00 0.00 57.03 57.52 1aax h ASP 229 Cb 0.03 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.04 1aax h ASP 229 CO -0.03 0.14 0.28 0.74 -2.88 0.00 0.00 179.24 177.49 1aax h THR 230 N -0.02 1.13 -0.95 2.25 2.02 -1.04 -0.26 112.91 116.04 1aax h THR 230 Ca 0.02 -0.29 0.01 0.00 0.77 0.00 0.00 66.41 66.92 1aax h THR 230 Cb 0.09 0.51 -0.05 0.00 -1.74 0.00 0.00 68.15 66.97 1aax h THR 230 CO -0.00 0.13 0.62 0.00 0.37 0.00 0.00 175.52 176.64 1aax h LEU 232 N 1.30 0.40 -0.74 0.00 3.38 -0.96 -2.21 115.31 116.48 1aax h LEU 232 Ca 0.35 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 58.02 1aax h LEU 232 Cb -0.14 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 1aax h LEU 232 CO -0.07 0.61 0.49 0.25 0.09 0.00 0.00 178.44 179.80 1aax h LEU 233 N 0.17 0.84 0.17 1.67 5.85 -0.57 -1.16 115.31 122.28 1aax h LEU 233 Ca 0.07 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1aax h LEU 233 Cb 0.40 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1aax h LEU 233 CO 0.01 0.61 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.49 1aax h LEU 234 N 1.00 -0.44 -1.91 2.25 3.38 -0.74 -0.64 115.31 118.20 1aax h LEU 234 Ca 0.27 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.28 1aax h LEU 234 Cb -0.11 0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1aax h LEU 234 CO -0.06 -0.25 -0.01 0.00 0.09 0.00 0.00 178.44 178.21 1aax h MET 235 N -0.36 0.00 -0.12 1.13 -0.00 -1.14 -2.52 114.93 111.92 1aax h MET 235 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 59.70 59.61 1aax h MET 235 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.94 1aax h MET 235 CO -0.04 0.01 -0.29 0.22 -0.00 0.00 0.00 176.91 176.81 1aax h ASP 236 N 0.00 0.47 -0.72 -0.10 3.58 -0.26 0.88 116.42 120.27 1aax h ASP 236 Ca -0.00 -0.57 0.09 0.00 0.42 0.00 0.00 57.03 56.96 1aax h ASP 236 Cb 0.36 -0.13 -0.07 0.00 1.72 0.00 0.00 39.33 41.21 1aax h ASP 236 CO 0.00 0.95 0.38 0.11 -2.88 0.00 0.00 179.24 177.80 1aax h LYS 237 N -0.00 0.63 0.00 0.28 1.57 -0.71 -2.84 116.57 115.50 1aax h LYS 237 Ca -0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1aax h LYS 237 Cb 0.89 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.06 1aax h LYS 237 CO 0.06 0.42 -1.26 0.54 -0.57 0.00 0.00 179.45 178.64 1aax n ARG 238 N -4.83 0.47 -3.86 3.15 5.12 -1.14 -4.96 116.66 110.61 1aax n ARG 238 Ca 0.11 -0.02 -0.29 0.00 -1.93 0.00 0.00 57.85 55.73 1aax n ARG 238 Cb 0.25 -1.64 0.03 0.00 -1.16 0.00 0.00 32.46 29.94 1aax n ARG 238 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1aax n LYS 239 N -2.24 -5.63 -3.40 5.56 4.76 0.30 -4.94 118.16 112.57 1aax n LYS 239 Ca -0.00 0.62 -0.24 0.00 -2.87 0.00 0.00 58.31 55.82 1aax n LYS 239 Cb 0.50 -5.48 -0.10 0.00 -1.84 0.00 0.00 35.03 28.12 1aax n LYS 239 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1aax s ASP 240 N -3.46 2.03 0.54 4.39 2.15 -0.93 -5.01 116.67 116.38 1aax s ASP 240 Ca 0.57 -2.02 0.24 0.00 0.43 0.00 0.00 52.55 51.76 1aax s ASP 240 Cb -0.28 0.03 1.41 0.00 -0.30 0.00 0.00 42.92 43.77 1aax s ASP 240 CO 0.82 -0.27 2.05 1.55 -0.17 0.00 0.00 175.17 179.15 1aax h PRO 241 N 6.86 0.00 0.00 4.34 0.13 -1.92 -1.88 132.00 139.53 1aax h PRO 241 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1aax h PRO 241 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1aax h PRO 241 CO 0.24 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 176.88 1aax n SER 242 N -4.31 0.10 -0.02 1.44 3.41 -1.26 -2.61 113.62 110.37 1aax n SER 242 Ca 0.05 0.52 0.14 0.00 -0.26 0.00 0.00 58.87 59.32 1aax n SER 242 Cb 0.43 -0.54 0.65 0.00 -0.26 0.00 0.00 64.21 64.49 1aax n SER 242 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1aax n SER 243 N -1.61 0.10 -4.63 4.04 3.41 -0.71 -4.80 113.62 109.43 1aax n SER 243 Ca 0.04 0.04 -0.39 0.00 -0.26 0.00 0.00 58.87 58.29 1aax n SER 243 Cb 0.22 -0.30 -0.08 0.00 -0.26 0.00 0.00 64.21 63.80 1aax n SER 243 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1aax s VAL 244 N -2.75 5.12 -0.59 -3.33 1.01 -1.07 -5.03 120.40 113.76 1aax s VAL 244 Ca 0.22 0.80 -0.09 0.00 0.00 0.00 0.00 61.98 62.91 1aax s VAL 244 Cb 0.20 -3.79 0.15 0.00 0.00 0.00 0.00 36.38 32.94 1aax s VAL 244 CO 0.51 0.14 0.46 -0.62 0.00 0.00 0.00 175.10 175.59 1aax s ASP 245 N 1.43 5.83 0.21 3.32 -1.08 -1.26 -4.60 116.67 120.52 1aax s ASP 245 Ca 0.20 -2.30 -0.10 0.00 -0.52 0.00 0.00 52.55 49.82 1aax s ASP 245 Cb -0.15 -2.02 0.29 0.00 -1.46 0.00 0.00 42.92 39.58 1aax s ASP 245 CO 0.09 -0.60 1.68 0.40 0.52 0.00 0.00 175.17 177.26 1aax h ILE 246 N 5.64 0.54 -0.36 4.11 2.04 -1.99 -1.22 117.51 126.27 1aax h ILE 246 Ca -0.10 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 1aax h ILE 246 Cb 1.04 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 1aax h ILE 246 CO 0.81 0.03 0.18 0.11 0.00 0.00 0.00 178.15 179.28 1aax h LYS 247 N 0.16 0.52 -0.76 2.37 1.57 -1.99 -1.46 116.57 116.97 1aax h LYS 247 Ca 0.32 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 59.07 1aax h LYS 247 Cb 0.51 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.67 1aax h LYS 247 CO -0.48 0.46 0.47 0.87 -0.57 0.00 0.00 179.45 180.20 1aax h LYS 248 N 0.45 0.86 -0.31 3.15 6.56 -1.82 -0.99 116.57 124.46 1aax h LYS 248 Ca 0.12 -0.05 -0.00 0.00 -1.06 0.00 0.00 60.65 59.66 1aax h LYS 248 Cb 0.11 -0.19 -0.01 0.00 -0.57 0.00 0.00 32.23 31.56 1aax h LYS 248 CO -0.02 0.57 0.18 0.28 -2.06 0.00 0.00 179.45 178.40 1aax h VAL 249 N 0.88 1.12 -0.87 0.50 2.07 -0.74 -0.88 116.25 118.34 1aax h VAL 249 Ca 0.32 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.54 1aax h VAL 249 Cb 0.10 0.75 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 1aax h VAL 249 CO -0.15 0.12 0.52 0.25 0.02 0.00 0.00 177.57 178.33 1aax h LEU 250 N 0.39 1.05 -0.98 2.57 5.85 -0.66 -1.15 115.31 122.37 1aax h LEU 250 Ca 0.11 -0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 1aax h LEU 250 Cb 0.03 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1aax h LEU 250 CO -0.02 0.81 0.07 -0.07 -0.34 0.00 0.00 178.44 178.89 1aax h LEU 251 N 1.20 0.76 -0.34 2.25 3.38 -0.87 -0.54 115.31 121.16 1aax h LEU 251 Ca 0.31 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1aax h LEU 251 Cb -0.04 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1aax h LEU 251 CO -0.06 0.79 0.16 -0.08 0.09 0.00 0.00 178.44 179.34 1aax h GLU 252 N 0.77 0.49 -0.88 1.13 4.57 -0.29 -2.53 114.58 117.83 1aax h GLU 252 Ca 0.16 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.26 1aax h GLU 252 Cb 0.36 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.82 1aax h GLU 252 CO 0.01 0.45 0.50 0.52 -1.18 0.00 0.00 179.01 179.31 1aax h MET 253 N 0.41 1.22 0.00 1.92 2.86 -0.80 -1.80 114.93 118.74 1aax h MET 253 Ca 0.12 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1aax h MET 253 Cb 0.12 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 31.53 1aax h MET 253 CO -0.01 0.87 0.00 0.54 1.06 0.00 0.00 176.91 179.37 1aax n ARG 254 N -4.34 0.04 0.21 1.72 1.74 -0.25 -0.71 116.66 115.07 1aax n ARG 254 Ca 0.10 0.32 0.10 0.00 -0.77 0.00 0.00 57.85 57.59 1aax n ARG 254 Cb 0.08 -1.50 0.36 0.00 -1.02 0.00 0.00 32.46 30.38 1aax n ARG 254 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1aax h LYS 255 N 0.00 0.00 0.00 5.56 1.57 -1.13 -3.33 116.57 119.24 1aax h LYS 255 Ca 0.00 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.54 1aax h LYS 255 Cb 0.12 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.38 1aax h LYS 255 CO 0.00 0.21 -2.00 1.19 -0.57 0.00 0.00 179.45 178.28 1aax n PHE 256 N -3.27 0.35 -3.69 -1.35 3.72 0.11 -4.96 117.46 108.38 1aax n PHE 256 Ca 0.01 0.12 -0.12 0.00 -0.05 0.00 0.00 57.45 57.41 1aax n PHE 256 Cb 0.49 -0.94 -0.09 0.00 -0.94 0.00 0.00 39.48 38.00 1aax n PHE 256 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 1aax s ARG 257 N -2.81 0.61 0.62 -1.08 3.52 -1.18 -4.57 118.95 114.06 1aax s ARG 257 Ca -0.07 0.80 -0.17 0.00 -0.13 0.00 0.00 55.73 56.16 1aax s ARG 257 Cb 0.08 0.25 -0.02 0.00 -1.56 0.00 0.00 34.95 33.70 1aax s ARG 257 CO 0.84 -0.09 1.14 0.00 -0.81 0.00 0.00 175.30 176.38 1aax s MET 258 N 0.57 2.93 -2.15 5.12 0.23 -1.26 -4.21 119.30 120.53 1aax s MET 258 Ca -0.02 1.56 0.00 0.00 -1.03 0.00 0.00 55.69 56.20 1aax s MET 258 Cb -0.05 -1.95 0.00 0.00 -1.53 0.00 0.00 34.83 31.30 1aax s MET 258 CO -0.03 -1.18 0.00 0.41 -2.03 0.00 0.00 175.02 172.19 1aax n GLY 259 N -0.06 1.60 3.65 3.16 0.00 -1.26 -4.88 105.19 107.40 1aax n GLY 259 Ca 0.12 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1aax n GLY 259 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aax s LEU 260 N -4.94 4.29 0.00 0.99 1.43 -1.26 -3.94 118.68 115.25 1aax s LEU 260 Ca 0.00 2.48 0.00 0.00 -1.03 0.00 0.00 54.13 55.58 1aax s LEU 260 Cb 0.00 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.69 1aax s LEU 260 CO 0.00 -1.15 0.00 -0.38 0.23 0.00 0.00 176.35 175.05 1aax n ILE 261 N 5.82 -1.90 0.95 -0.59 5.41 0.01 -4.93 119.36 124.15 1aax n ILE 261 Ca 0.21 0.00 0.11 0.00 1.00 0.00 0.00 62.75 64.07 1aax n ILE 261 Cb 0.42 -2.69 0.08 0.00 -0.71 0.00 0.00 39.64 36.73 1aax n ILE 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1aax n GLN 262 N 0.16 0.03 -4.04 0.38 1.13 -1.25 -4.90 117.38 108.89 1aax n GLN 262 Ca 0.00 -0.00 -0.08 0.00 -1.94 0.00 0.00 57.00 54.98 1aax n GLN 262 Cb 0.00 -1.51 -0.10 0.00 0.11 0.00 0.00 30.24 28.74 1aax n GLN 262 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1aax s THR 263 N -3.02 0.19 0.44 5.09 -4.23 -1.26 -5.03 115.64 107.81 1aax s THR 263 Ca 0.09 -1.55 0.12 0.00 -1.18 0.00 0.00 61.69 59.17 1aax s THR 263 Cb 0.17 -1.27 0.20 0.00 1.34 0.00 0.00 72.50 72.94 1aax s THR 263 CO 0.78 -0.86 2.00 0.00 -0.54 0.00 0.00 174.62 176.00 1aax h ALA 264 N 3.37 1.69 -0.14 3.99 0.00 -1.94 -2.34 119.26 123.90 1aax h ALA 264 Ca -0.34 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.30 1aax h ALA 264 Cb 1.16 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1aax h ALA 264 CO 0.60 0.23 -0.51 0.22 0.00 0.00 0.00 179.25 179.79 1aax h ASP 265 N 0.14 0.41 -0.47 0.00 3.58 -1.96 -1.28 116.42 116.83 1aax h ASP 265 Ca 0.03 -0.21 -0.07 0.00 0.42 0.00 0.00 57.03 57.21 1aax h ASP 265 Cb 0.24 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.15 1aax h ASP 265 CO 0.01 0.85 0.06 1.56 -2.88 0.00 0.00 179.24 178.84 1aax h GLN 266 N 0.29 0.86 -0.03 0.28 4.20 -1.76 0.36 115.11 119.32 1aax h GLN 266 Ca 0.01 -0.22 -0.00 0.00 0.06 0.00 0.00 58.65 58.50 1aax h GLN 266 Cb 1.00 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.67 1aax h GLN 266 CO 0.09 0.83 0.01 1.25 -0.67 0.00 0.00 178.83 180.34 1aax h LEU 267 N 0.81 0.04 -1.02 1.46 5.85 -1.16 0.22 115.31 121.52 1aax h LEU 267 Ca 0.16 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.78 1aax h LEU 267 Cb 0.41 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.37 1aax h LEU 267 CO 0.01 0.16 0.66 -0.09 -0.34 0.00 0.00 178.44 178.84 1aax h ARG 268 N -0.09 1.25 -0.58 1.25 2.43 -0.81 -0.53 114.38 117.30 1aax h ARG 268 Ca 0.01 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 59.04 1aax h ARG 268 Cb 0.13 -0.28 -0.03 0.00 -0.42 0.00 0.00 29.97 29.38 1aax h ARG 268 CO -0.00 0.83 0.11 0.35 -1.51 0.00 0.00 179.97 179.74 1aax h PHE 269 N 1.29 0.97 -0.54 2.20 3.57 0.06 -1.93 116.94 122.54 1aax h PHE 269 Ca 0.39 -0.11 0.05 0.00 3.53 0.00 0.00 57.97 61.83 1aax h PHE 269 Cb -0.04 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 38.38 1aax h PHE 269 CO -0.00 0.82 0.28 0.77 -2.23 0.00 0.00 178.31 177.95 1aax h SER 270 N 0.88 0.40 -0.29 0.41 0.02 0.67 0.36 113.55 116.00 1aax h SER 270 Ca 0.18 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.19 1aax h SER 270 Cb 0.37 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.83 1aax h SER 270 CO 0.01 0.27 0.12 1.88 -1.14 0.00 0.00 176.83 177.97 1aax h TYR 271 N 0.54 0.23 -0.23 3.45 -1.99 -1.00 -0.64 116.97 117.33 1aax h TYR 271 Ca 0.24 0.01 0.03 0.00 2.00 0.00 0.00 58.73 61.01 1aax h TYR 271 Cb 0.15 -0.06 -0.03 0.00 2.00 0.00 0.00 36.73 38.79 1aax h TYR 271 CO -0.10 0.12 0.06 -0.07 -0.00 0.00 0.00 178.16 178.17 1aax h LEU 272 N 0.27 0.05 -0.56 3.88 3.38 -0.65 -0.80 115.31 120.88 1aax h LEU 272 Ca 0.12 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.13 1aax h LEU 272 Cb 0.07 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1aax h LEU 272 CO -0.11 0.06 0.37 0.00 0.09 0.00 0.00 178.44 178.85 1aax h ALA 273 N 1.15 0.71 -0.28 1.53 0.00 -0.58 -0.84 119.26 120.94 1aax h ALA 273 Ca 0.10 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1aax h ALA 273 Cb 0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1aax h ALA 273 CO -0.12 0.14 0.02 0.28 0.00 0.00 0.00 179.25 179.58 1aax h VAL 274 N 0.75 1.25 -0.75 0.00 2.07 -0.91 0.20 116.25 118.86 1aax h VAL 274 Ca 0.21 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.85 1aax h VAL 274 Cb -0.08 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.91 1aax h VAL 274 CO -0.05 0.28 0.44 0.40 0.02 0.00 0.00 177.57 178.66 1aax h ILE 275 N 0.29 1.22 -0.23 4.57 2.04 -0.96 0.67 117.51 125.11 1aax h ILE 275 Ca 0.08 -0.50 -0.10 0.00 1.00 0.00 0.00 64.86 65.34 1aax h ILE 275 Cb 0.39 0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 1aax h ILE 275 CO 0.01 0.23 -0.24 -0.08 0.00 0.00 0.00 178.15 178.07 1aax h GLU 276 N 1.03 0.56 0.00 2.37 4.57 -1.03 -3.02 114.58 119.07 1aax h GLU 276 Ca 0.27 -0.30 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 1aax h GLU 276 Cb -0.01 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1aax h GLU 276 CO -0.05 0.90 -0.10 0.78 -1.18 0.00 0.00 179.01 179.36 1aax h GLY 277 N 0.26 0.00 1.17 1.92 0.00 -0.20 -2.17 103.07 104.04 1aax h GLY 277 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.48 1aax h GLY 277 CO 0.06 0.00 0.31 0.00 0.00 0.00 0.00 176.54 176.91 1aax h ALA 278 N 1.90 2.27 -0.85 3.60 0.00 -0.73 -1.04 119.26 124.40 1aax h ALA 278 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1aax h ALA 278 Cb 0.19 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1aax h ALA 278 CO 0.01 -0.51 0.50 0.87 0.00 0.00 0.00 179.25 180.13 1aax h LYS 279 N 0.00 1.16 0.10 0.00 1.57 -1.51 0.53 116.57 118.41 1aax h LYS 279 Ca 0.18 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1aax h LYS 279 Cb 0.80 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1aax h LYS 279 CO -0.00 0.82 -0.05 0.35 -0.57 0.00 0.00 179.45 180.00 1aax h PHE 280 N 1.17 -0.12 -0.84 -1.35 3.04 -1.35 -1.44 116.94 116.05 1aax h PHE 280 Ca 0.30 -0.00 0.16 0.00 3.98 0.00 0.00 57.97 62.41 1aax h PHE 280 Cb -0.03 0.04 -0.10 0.00 2.56 0.00 0.00 35.95 38.42 1aax h PHE 280 CO -0.00 0.35 0.41 0.82 -2.02 0.00 0.00 178.31 177.87 1aax h ILE 281 N -0.66 0.68 -0.02 1.41 1.08 -1.30 -1.75 117.51 116.95 1aax h ILE 281 Ca -0.01 -0.19 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 1aax h ILE 281 Cb 0.52 0.07 0.00 0.00 -3.07 0.00 0.00 36.82 34.34 1aax h ILE 281 CO 0.02 0.10 0.00 0.23 -0.69 0.00 0.00 178.15 177.81 1aax n MET 282 N -4.92 1.05 0.00 2.37 2.81 0.16 -4.86 117.12 113.74 1aax n MET 282 Ca 0.17 -0.07 0.00 0.00 -1.81 0.00 0.00 57.70 55.99 1aax n MET 282 Cb 0.46 -1.09 0.00 0.00 -0.71 0.00 0.00 33.22 31.88 1aax n MET 282 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1aax n GLY 283 N 0.45 1.41 3.21 3.03 0.00 -0.66 -5.04 105.19 107.59 1aax n GLY 283 Ca 0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.59 1aax n GLY 283 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1aax n ASP 284 N 0.00 5.62 0.27 1.61 2.03 -0.54 -4.82 116.55 120.71 1aax n ASP 284 Ca 0.00 -3.13 0.11 0.00 0.52 0.00 0.00 54.79 52.29 1aax n ASP 284 Cb 0.00 -1.41 0.75 0.00 -0.72 0.00 0.00 41.12 39.74 1aax n ASP 284 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1aax h SER 285 N 6.31 0.00 0.34 1.67 0.02 -1.82 -2.57 113.55 117.50 1aax h SER 285 Ca 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 1aax h SER 285 Cb 0.77 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.31 1aax h SER 285 CO 1.25 0.04 0.00 0.77 -1.14 0.00 0.00 176.83 177.75 1aax h SER 286 N 0.00 0.00 0.12 3.07 4.64 -1.96 -2.39 113.55 117.03 1aax h SER 286 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 1aax h SER 286 Cb 0.09 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1aax h SER 286 CO 0.01 0.00 -0.07 1.62 -0.87 0.00 0.00 176.83 177.52 1aax h VAL 287 N 0.00 0.79 -0.52 0.95 3.04 -1.84 -2.62 116.25 116.05 1aax h VAL 287 Ca 0.00 -0.27 0.00 0.00 -1.01 0.00 0.00 66.70 65.43 1aax h VAL 287 Cb 0.17 1.15 -0.03 0.00 -2.01 0.00 0.00 31.29 30.58 1aax h VAL 287 CO 0.00 0.07 0.33 -0.61 -1.01 0.00 0.00 177.57 176.35 1aax h GLN 288 N 0.00 0.70 0.00 4.17 4.15 -1.65 -1.30 115.11 121.18 1aax h GLN 288 Ca -0.00 -0.05 -0.07 0.00 0.77 0.00 0.00 58.65 59.30 1aax h GLN 288 Cb 0.15 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 1aax h GLN 288 CO 0.01 0.48 -0.34 0.22 -1.93 0.00 0.00 178.83 177.27 1aax h ASP 289 N 0.70 0.00 -0.39 -0.69 3.58 -1.67 -2.52 116.42 115.43 1aax h ASP 289 Ca 0.19 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.52 1aax h ASP 289 Cb -0.05 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 40.99 1aax h ASP 289 CO -0.04 0.34 -0.18 1.56 -2.88 0.00 0.00 179.24 178.03 1aax h GLN 290 N 0.00 0.88 -0.62 0.28 4.20 -1.17 -1.70 115.11 116.98 1aax h GLN 290 Ca -0.00 -0.35 -0.08 0.00 0.06 0.00 0.00 58.65 58.28 1aax h GLN 290 Cb 0.61 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 1aax h GLN 290 CO 0.04 0.99 0.07 -1.49 -0.67 0.00 0.00 178.83 177.78 1aax h TRP 291 N 0.77 1.10 -0.49 2.96 6.55 -0.99 -0.45 115.95 125.40 1aax h TRP 291 Ca 0.11 -0.16 0.01 0.00 0.95 0.00 0.00 58.89 59.80 1aax h TRP 291 Cb 0.72 -0.30 -0.03 0.00 -0.86 0.00 0.00 29.16 28.69 1aax h TRP 291 CO 0.04 0.94 0.32 -0.22 -1.05 0.00 0.00 178.44 178.47 1aax h LYS 292 N 0.96 0.62 0.12 0.49 3.64 -1.11 0.76 116.57 122.06 1aax h LYS 292 Ca 0.19 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1aax h LYS 292 Cb 0.46 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 1aax h LYS 292 CO 0.02 0.41 -0.06 1.49 -2.27 0.00 0.00 179.45 179.04 1aax h GLU 293 N 0.64 -0.15 0.00 1.90 4.57 -1.07 -3.03 114.58 117.44 1aax h GLU 293 Ca 0.18 0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.36 1aax h GLU 293 Cb -0.05 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.57 1aax h GLU 293 CO -0.05 0.11 -0.06 -0.07 -1.18 0.00 0.00 179.01 177.75 1aax h LEU 294 N -0.41 0.00 -0.28 1.64 3.38 -0.95 -2.21 115.31 116.48 1aax h LEU 294 Ca -0.02 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1aax h LEU 294 Cb 0.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1aax h LEU 294 CO 0.03 0.06 -0.12 0.77 0.09 0.00 0.00 178.44 179.26 1aax h SER 295 N 0.00 0.00 -5.90 -0.43 4.64 -0.72 -3.46 113.55 107.68 1aax h SER 295 Ca -0.00 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.94 1aax h SER 295 Cb 0.17 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 62.37 1aax h SER 295 CO 0.01 0.12 -0.82 1.41 -0.87 0.00 0.00 176.83 176.69 1aax n HIS 296 N -3.15 -2.04 0.48 4.77 8.25 -0.83 -4.90 115.22 117.80 1aax n HIS 296 Ca 0.03 0.86 0.10 0.00 -0.26 0.00 0.00 57.72 58.45 1aax n HIS 296 Cb 0.54 -4.57 0.42 0.00 1.12 0.00 0.00 29.99 27.49 1aax n HIS 296 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 1aax n GLU 297 N -4.14 0.11 0.00 -0.41 0.28 -1.26 -4.64 120.64 110.58 1aax n GLU 297 Ca -0.27 0.32 0.14 0.00 -0.16 0.00 0.00 57.16 57.19 1aax n GLU 297 Cb 0.67 -1.70 0.86 0.00 1.43 0.00 0.00 31.44 32.70 1aax n GLU 297 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72