#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xt9 n PRO 3 N 0.00 0.70 -2.71 0.11 -0.04 -1.26 -4.68 135.00 127.12 1xt9 n PRO 3 Ca 0.00 0.29 -0.42 0.00 -0.04 0.00 0.00 63.50 63.33 1xt9 n PRO 3 Cb 0.00 -2.22 -0.03 0.00 -0.04 0.00 0.00 33.50 31.21 1xt9 n PRO 3 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1xt9 s VAL 4 N -1.66 4.81 -0.25 0.52 1.01 -1.26 -0.79 120.40 122.79 1xt9 s VAL 4 Ca 0.75 2.01 -0.05 0.00 0.00 0.00 0.00 61.98 64.70 1xt9 s VAL 4 Cb -0.37 -4.30 -0.17 0.00 0.00 0.00 0.00 36.38 31.54 1xt9 s VAL 4 CO 0.48 0.05 -0.17 0.52 0.00 0.00 0.00 175.10 175.98 1xt9 n VAL 5 N 4.40 1.54 -3.73 2.92 0.31 0.15 -4.86 118.33 119.06 1xt9 n VAL 5 Ca 0.08 -0.50 -0.12 0.00 -0.01 0.00 0.00 64.34 63.79 1xt9 n VAL 5 Cb 0.49 -1.63 -0.12 0.00 -0.91 0.00 0.00 33.84 31.68 1xt9 n VAL 5 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1xt9 s LEU 6 N -6.94 0.43 -0.30 7.52 2.96 -0.73 -4.75 118.68 116.87 1xt9 s LEU 6 Ca -0.34 0.64 -0.05 0.00 -0.22 0.00 0.00 54.13 54.16 1xt9 s LEU 6 Cb 0.10 0.97 0.03 0.00 0.50 0.00 0.00 46.19 47.80 1xt9 s LEU 6 CO 0.59 -0.15 0.04 -0.55 -1.32 0.00 0.00 176.35 174.96 1xt9 s SER 7 N 0.94 4.97 -0.31 3.68 0.15 -1.26 -0.59 113.70 121.27 1xt9 s SER 7 Ca -0.06 -1.00 -0.01 0.00 0.70 0.00 0.00 55.95 55.58 1xt9 s SER 7 Cb -0.07 -1.80 0.10 0.00 -1.71 0.00 0.00 66.02 62.54 1xt9 s SER 7 CO -0.07 -0.24 0.11 -0.47 1.20 0.00 0.00 173.24 173.77 1xt9 s TYR 8 N 1.38 1.64 0.00 3.44 5.04 -0.53 -5.05 117.35 123.27 1xt9 s TYR 8 Ca -0.01 -1.72 0.00 0.00 -2.44 0.00 0.00 57.07 52.90 1xt9 s TYR 8 Cb -0.18 -1.67 0.00 0.00 0.35 0.00 0.00 41.96 40.45 1xt9 s TYR 8 CO 0.00 -0.87 0.00 -1.33 -1.34 0.00 0.00 175.55 172.01 1xt9 n MET 9 N 4.81 0.00 0.00 4.97 2.81 -1.26 -2.05 117.12 126.40 1xt9 n MET 9 Ca -0.02 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.00 1xt9 n MET 9 Cb 0.42 0.00 0.38 0.00 -0.71 0.00 0.00 33.22 33.30 1xt9 n MET 9 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1xt9 n ASP 10 N 8.67 1.15 -4.79 7.83 8.00 -1.26 -4.89 116.55 131.25 1xt9 n ASP 10 Ca 0.00 -1.01 -0.33 0.00 0.71 0.00 0.00 54.79 54.16 1xt9 n ASP 10 Cb 0.00 0.13 -0.07 0.00 -0.02 0.00 0.00 41.12 41.16 1xt9 n ASP 10 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1xt9 s SER 11 N -2.43 5.74 -0.04 -2.24 1.04 -0.87 -5.10 113.70 109.80 1xt9 s SER 11 Ca 0.26 0.15 0.05 0.00 0.48 0.00 0.00 55.95 56.89 1xt9 s SER 11 Cb 0.19 -1.65 -0.01 0.00 0.10 0.00 0.00 66.02 64.65 1xt9 s SER 11 CO 0.50 0.26 -0.19 -0.22 0.98 0.00 0.00 173.24 174.57 1xt9 s LEU 12 N -1.84 1.96 -0.10 2.42 1.98 -1.26 -1.46 118.68 120.38 1xt9 s LEU 12 Ca 0.24 -0.38 0.02 0.00 -2.89 0.00 0.00 54.13 51.13 1xt9 s LEU 12 Cb -0.12 -1.04 0.01 0.00 0.66 0.00 0.00 46.19 45.70 1xt9 s LEU 12 CO 0.16 0.18 -0.17 -0.76 -1.89 0.00 0.00 176.35 173.87 1xt9 s LEU 13 N -0.10 1.81 0.31 -0.68 1.02 0.24 -4.92 118.68 116.37 1xt9 s LEU 13 Ca -0.01 -0.45 0.08 0.00 0.02 0.00 0.00 54.13 53.77 1xt9 s LEU 13 Cb -0.11 -1.14 -0.04 0.00 0.02 0.00 0.00 46.19 44.93 1xt9 s LEU 13 CO 0.02 0.05 0.19 -0.13 0.02 0.00 0.00 176.35 176.50 1xt9 s ARG 14 N 0.80 2.61 0.25 1.70 0.52 -1.26 0.35 118.95 123.92 1xt9 s ARG 14 Ca -0.10 -1.33 -0.04 0.00 -0.52 0.00 0.00 55.73 53.74 1xt9 s ARG 14 Cb -0.16 -2.37 0.48 0.00 0.52 0.00 0.00 34.95 33.42 1xt9 s ARG 14 CO 0.01 0.21 1.71 0.37 0.02 0.00 0.00 175.30 177.62 1xt9 h GLN 15 N 1.48 0.36 -0.87 3.54 4.15 -1.24 0.30 115.11 122.83 1xt9 h GLN 15 Ca -0.45 -0.02 0.11 0.00 0.77 0.00 0.00 58.65 59.05 1xt9 h GLN 15 Cb 1.25 -0.08 -0.06 0.00 0.21 0.00 0.00 27.48 28.79 1xt9 h GLN 15 CO 0.61 0.24 0.56 0.66 -1.93 0.00 0.00 178.83 178.96 1xt9 h SER 16 N 0.37 0.73 0.28 -0.69 4.64 -1.91 0.75 113.55 117.71 1xt9 h SER 16 Ca 0.42 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.76 1xt9 h SER 16 Cb 0.69 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1xt9 h SER 16 CO -0.45 0.42 -0.14 0.44 -0.87 0.00 0.00 176.83 176.23 1xt9 h ASP 17 N 0.80 -0.32 -0.95 4.97 3.32 -0.85 -3.16 116.42 120.23 1xt9 h ASP 17 Ca 0.41 -0.21 0.12 0.00 0.02 0.00 0.00 57.03 57.37 1xt9 h ASP 17 Cb 0.49 0.08 -0.08 0.00 0.22 0.00 0.00 39.33 40.05 1xt9 h ASP 17 CO -0.18 0.09 0.60 0.58 -1.72 0.00 0.00 179.24 178.62 1xt9 h VAL 18 N -0.80 0.90 0.00 -1.35 2.07 -0.51 0.37 116.25 116.92 1xt9 h VAL 18 Ca -0.04 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1xt9 h VAL 18 Cb 0.51 -0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1xt9 h VAL 18 CO 0.06 0.16 -0.02 0.28 0.02 0.00 0.00 177.57 178.07 1xt9 h SER 19 N 0.88 0.00 0.58 0.57 0.02 -0.87 -0.86 113.55 113.87 1xt9 h SER 19 Ca 0.47 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.40 1xt9 h SER 19 Cb 0.55 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.08 1xt9 h SER 19 CO -0.23 0.02 -0.06 -0.07 -1.14 0.00 0.00 176.83 175.36 1xt9 h LEU 20 N 0.00 0.00 -1.77 5.07 3.38 -0.88 -2.14 115.31 118.96 1xt9 h LEU 20 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xt9 h LEU 20 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1xt9 h LEU 20 CO 0.00 0.06 0.00 -0.07 0.09 0.00 0.00 178.44 178.52 1xt9 h LEU 21 N 0.00 0.00 -9.24 1.67 3.38 -1.26 -3.40 115.31 106.46 1xt9 h LEU 21 Ca -0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 1xt9 h LEU 21 Cb 0.36 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1xt9 h LEU 21 CO 0.01 0.00 0.72 -1.81 0.09 0.00 0.00 178.44 177.45 1xt9 s ASP 22 N -5.21 7.08 0.63 -0.43 1.01 -0.81 -4.81 116.67 114.14 1xt9 s ASP 22 Ca -0.00 1.67 -0.16 0.00 0.71 0.00 0.00 52.55 54.77 1xt9 s ASP 22 Cb 0.10 -2.55 -0.02 0.00 1.01 0.00 0.00 42.92 41.46 1xt9 s ASP 22 CO 0.46 -0.60 1.10 -2.16 0.21 0.00 0.00 175.17 174.18 1xt9 s PRO 23 N 2.53 2.99 -0.35 8.23 0.04 -1.26 -1.70 135.00 145.48 1xt9 s PRO 23 Ca 0.52 1.39 -0.00 0.00 0.04 0.00 0.00 61.00 62.95 1xt9 s PRO 23 Cb -0.21 -1.98 0.28 0.00 0.04 0.00 0.00 34.50 32.63 1xt9 s PRO 23 CO 0.18 -1.10 1.91 -0.35 0.04 0.00 0.00 177.00 177.68 1xt9 n PRO 24 N -2.17 1.90 -2.56 0.56 -0.04 -1.26 -5.13 135.00 126.31 1xt9 n PRO 24 Ca 0.10 -1.82 -0.35 0.00 -0.04 0.00 0.00 63.50 61.39 1xt9 n PRO 24 Cb 0.52 -1.72 -0.04 0.00 -0.04 0.00 0.00 33.50 32.23 1xt9 n PRO 24 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1xt9 s SER 25 N -0.20 6.52 0.27 3.54 0.01 -0.69 -4.81 113.70 118.34 1xt9 s SER 25 Ca 0.36 1.96 -0.28 0.00 1.31 0.00 0.00 55.95 59.29 1xt9 s SER 25 Cb 0.28 -2.57 -0.09 0.00 0.21 0.00 0.00 66.02 63.85 1xt9 s SER 25 CO 0.01 -0.66 0.93 0.26 0.41 0.00 0.00 173.24 174.19 1xt9 s TRP 26 N -1.87 3.86 0.33 2.43 0.52 -1.26 -4.83 118.94 118.12 1xt9 s TRP 26 Ca 0.64 1.85 -0.15 0.00 0.02 0.00 0.00 56.10 58.45 1xt9 s TRP 26 Cb -0.18 -2.95 -0.09 0.00 -1.15 0.00 0.00 33.47 29.10 1xt9 s TRP 26 CO 0.22 0.36 0.75 -0.51 0.02 0.00 0.00 176.95 177.79 1xt9 s LEU 27 N -1.56 4.05 0.00 2.99 1.43 -1.26 -4.84 118.68 119.50 1xt9 s LEU 27 Ca 0.45 1.31 0.02 0.00 -1.03 0.00 0.00 54.13 54.88 1xt9 s LEU 27 Cb -0.23 -4.11 0.02 0.00 0.03 0.00 0.00 46.19 41.90 1xt9 s LEU 27 CO 0.28 -0.22 0.20 -0.46 0.23 0.00 0.00 176.35 176.39 1xt9 n ASN 28 N -0.39 2.21 -0.01 2.29 6.94 -1.26 -4.94 115.26 120.10 1xt9 n ASN 28 Ca 0.04 -2.18 -0.01 0.00 -0.02 0.00 0.00 54.58 52.41 1xt9 n ASN 28 Cb 0.53 0.02 0.28 0.00 -2.36 0.00 0.00 39.78 38.26 1xt9 n ASN 28 CO 0.00 0.00 0.00 -2.24 -1.03 0.00 0.00 177.26 173.99 1xt9 h ASP 29 N 0.46 0.51 -0.38 0.53 -0.00 -1.98 -2.75 116.42 112.81 1xt9 h ASP 29 Ca -0.22 -0.10 -0.01 0.00 -0.00 0.00 0.00 57.03 56.70 1xt9 h ASP 29 Cb 0.77 -0.13 -0.02 0.00 -0.00 0.00 0.00 39.33 39.95 1xt9 h ASP 29 CO 0.35 0.58 0.21 0.45 -0.00 0.00 0.00 179.24 180.83 1xt9 h HIS 30 N 0.52 0.53 0.45 4.15 3.86 -1.96 0.13 115.15 122.83 1xt9 h HIS 30 Ca 0.11 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.28 1xt9 h HIS 30 Cb 0.35 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 28.66 1xt9 h HIS 30 CO 0.01 0.41 -0.22 0.82 0.86 0.00 0.00 177.93 179.81 1xt9 h ILE 31 N 0.49 0.55 -0.88 2.45 1.08 -1.86 0.28 117.51 119.62 1xt9 h ILE 31 Ca 0.14 -0.11 0.02 0.00 -0.39 0.00 0.00 64.86 64.52 1xt9 h ILE 31 Cb 0.06 0.61 -0.05 0.00 -3.07 0.00 0.00 36.82 34.36 1xt9 h ILE 31 CO -0.02 0.02 0.58 0.40 -0.69 0.00 0.00 178.15 178.44 1xt9 h ILE 32 N -0.68 1.18 -0.62 -0.67 1.08 -1.48 -2.19 117.51 114.14 1xt9 h ILE 32 Ca -0.06 -0.40 0.01 0.00 -0.39 0.00 0.00 64.86 64.02 1xt9 h ILE 32 Cb 0.50 -0.07 -0.03 0.00 -3.07 0.00 0.00 36.82 34.15 1xt9 h ILE 32 CO 0.10 0.21 0.41 1.23 -0.69 0.00 0.00 178.15 179.41 1xt9 h GLY 33 N 1.15 0.87 0.88 5.37 0.00 -0.56 -1.25 103.07 109.54 1xt9 h GLY 33 Ca 0.34 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1xt9 h GLY 33 CO -0.09 0.31 -0.09 -2.75 0.00 0.00 0.00 176.54 173.92 1xt9 h PHE 34 N 0.83 -0.23 -0.53 5.60 3.57 -0.45 0.21 116.94 125.94 1xt9 h PHE 34 Ca 0.23 0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.84 1xt9 h PHE 34 Cb -0.09 0.09 -0.09 0.00 2.79 0.00 0.00 35.95 38.65 1xt9 h PHE 34 CO -0.03 -0.14 -0.05 0.00 -2.23 0.00 0.00 178.31 175.86 1xt9 h ALA 35 N 0.70 0.45 -0.90 2.41 0.00 -0.92 0.16 119.26 121.16 1xt9 h ALA 35 Ca 0.01 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1xt9 h ALA 35 Cb 0.19 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1xt9 h ALA 35 CO -0.03 -0.41 0.51 0.74 0.00 0.00 0.00 179.25 180.06 1xt9 h PHE 36 N 0.07 1.22 -0.79 0.00 -1.00 -0.94 -0.20 116.94 115.30 1xt9 h PHE 36 Ca 0.27 -0.02 -0.04 0.00 2.81 0.00 0.00 57.97 60.98 1xt9 h PHE 36 Cb 0.41 -0.39 -0.04 0.00 3.61 0.00 0.00 35.95 39.54 1xt9 h PHE 36 CO -0.37 0.83 0.33 0.93 -1.61 0.00 0.00 178.31 178.43 1xt9 h GLU 37 N 1.25 1.17 -0.51 1.51 4.39 0.92 -1.30 114.58 122.02 1xt9 h GLU 37 Ca 0.32 -0.20 -0.07 0.00 0.34 0.00 0.00 59.36 59.75 1xt9 h GLU 37 Cb 0.00 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.44 1xt9 h GLU 37 CO -0.05 0.94 0.06 -0.92 -1.16 0.00 0.00 179.01 177.87 1xt9 h TYR 38 N 1.14 0.93 -0.08 4.33 3.20 -0.23 -0.19 116.97 126.08 1xt9 h TYR 38 Ca 0.27 -0.14 0.01 0.00 3.14 0.00 0.00 58.73 62.00 1xt9 h TYR 38 Cb 0.19 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.20 1xt9 h TYR 38 CO 0.02 0.85 0.03 0.74 -1.64 0.00 0.00 178.16 178.15 1xt9 h PHE 39 N 0.74 0.05 -0.49 -3.82 0.04 -0.82 0.50 116.94 113.15 1xt9 h PHE 39 Ca 0.15 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.85 1xt9 h PHE 39 Cb 0.44 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.56 1xt9 h PHE 39 CO 0.03 0.03 0.00 0.00 -0.60 0.00 0.00 178.31 177.78 1xt9 h ALA 40 N 1.05 0.65 0.00 2.45 0.00 -1.02 0.29 119.26 122.68 1xt9 h ALA 40 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1xt9 h ALA 40 Cb 0.01 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1xt9 h ALA 40 CO -0.03 0.46 -1.05 0.09 0.00 0.00 0.00 179.25 178.72 1xt9 n ASN 41 N -4.34 0.90 0.00 0.00 4.13 -0.10 -3.76 115.26 112.09 1xt9 n ASN 41 Ca 0.01 -0.91 0.00 0.00 1.68 0.00 0.00 54.58 55.36 1xt9 n ASN 41 Cb 0.31 1.08 0.00 0.00 -1.54 0.00 0.00 39.78 39.63 1xt9 n ASN 41 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 1xt9 n SER 42 N -1.54 0.00 -0.28 6.41 2.88 0.04 -4.58 113.62 116.55 1xt9 n SER 42 Ca 0.03 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.67 1xt9 n SER 42 Cb 0.34 0.00 0.23 0.00 -0.75 0.00 0.00 64.21 64.03 1xt9 n SER 42 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 1xt9 h GLN 43 N 0.00 0.18 -0.75 -1.46 4.15 -1.32 -2.41 115.11 113.51 1xt9 h GLN 43 Ca 0.00 -0.01 -0.49 0.00 0.77 0.00 0.00 58.65 58.92 1xt9 h GLN 43 Cb 0.00 -0.04 -0.42 0.00 0.21 0.00 0.00 27.48 27.23 1xt9 h GLN 43 CO 0.00 0.12 -0.88 1.19 -1.93 0.00 0.00 178.83 177.33 1xt9 n PHE 44 N -5.25 2.46 -0.30 3.99 3.01 0.10 -4.83 117.46 116.64 1xt9 n PHE 44 Ca 0.18 -2.28 0.03 0.00 1.01 0.00 0.00 57.45 56.39 1xt9 n PHE 44 Cb 0.59 -0.30 0.22 0.00 -0.01 0.00 0.00 39.48 39.98 1xt9 n PHE 44 CO 0.00 0.00 0.00 1.12 1.01 0.00 0.00 176.76 178.89 1xt9 h HIS 45 N 2.31 1.06 0.00 1.38 2.07 -1.49 -1.62 115.15 118.86 1xt9 h HIS 45 Ca 0.25 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.80 1xt9 h HIS 45 Cb 1.43 -0.35 0.00 0.00 2.57 0.00 0.00 27.41 31.06 1xt9 h HIS 45 CO 0.77 0.59 0.00 -0.40 -3.07 0.00 0.00 177.93 175.82 1xt9 n ASP 46 N -4.46 0.46 -1.44 3.10 5.75 -1.26 -2.22 116.55 116.48 1xt9 n ASP 46 Ca 0.13 0.63 0.09 0.00 -0.01 0.00 0.00 54.79 55.62 1xt9 n ASP 46 Cb 0.14 -0.72 0.32 0.00 -1.03 0.00 0.00 41.12 39.83 1xt9 n ASP 46 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xt9 h SER 48 N 3.69 0.25 0.51 0.00 0.87 -1.55 -0.89 113.55 116.43 1xt9 h SER 48 Ca 0.00 0.12 -0.21 0.00 -1.23 0.00 0.00 61.79 60.47 1xt9 h SER 48 Cb 1.29 0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 63.35 1xt9 h SER 48 CO 0.19 -0.14 -0.93 0.44 -0.53 0.00 0.00 176.83 175.86 1xt9 h ASP 49 N 0.11 0.36 0.29 6.23 3.32 -1.88 -3.33 116.42 121.52 1xt9 h ASP 49 Ca 0.79 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 57.55 1xt9 h ASP 49 Cb 2.51 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 41.94 1xt9 h ASP 49 CO -0.38 1.11 -0.65 1.41 -1.72 0.00 0.00 179.24 179.01 1xt9 n HIS 50 N -3.67 0.00 -3.96 4.55 8.25 -0.39 -4.48 115.22 115.52 1xt9 n HIS 50 Ca -0.05 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.32 1xt9 n HIS 50 Cb 0.84 -0.15 -0.10 0.00 1.12 0.00 0.00 29.99 31.70 1xt9 n HIS 50 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1xt9 s VAL 51 N -2.95 0.13 -0.02 1.59 0.11 -0.91 -1.18 120.40 117.18 1xt9 s VAL 51 Ca 0.11 -1.11 0.00 0.00 -2.93 0.00 0.00 61.98 58.05 1xt9 s VAL 51 Cb 0.17 -0.77 0.03 0.00 -1.53 0.00 0.00 36.38 34.28 1xt9 s VAL 51 CO 0.74 -0.61 0.02 -0.55 -3.33 0.00 0.00 175.10 171.37 1xt9 s SER 52 N -1.99 0.25 -0.28 3.54 0.15 -0.61 -4.70 113.70 110.06 1xt9 s SER 52 Ca -0.07 0.01 -0.07 0.00 0.70 0.00 0.00 55.95 56.53 1xt9 s SER 52 Cb -0.03 -0.13 0.00 0.00 -1.71 0.00 0.00 66.02 64.15 1xt9 s SER 52 CO -0.04 -0.12 0.07 -0.36 1.20 0.00 0.00 173.24 173.99 1xt9 s PHE 53 N 1.09 3.12 -0.26 3.44 0.40 -1.26 -1.16 117.98 123.36 1xt9 s PHE 53 Ca -0.09 -0.88 -0.14 0.00 -0.60 0.00 0.00 56.93 55.23 1xt9 s PHE 53 Cb -0.13 -2.24 -0.04 0.00 0.51 0.00 0.00 43.02 41.11 1xt9 s PHE 53 CO -0.02 -0.54 0.30 0.42 0.70 0.00 0.00 175.22 176.08 1xt9 s ILE 54 N 1.52 5.24 0.83 0.64 1.01 0.15 -4.94 121.20 125.65 1xt9 s ILE 54 Ca 0.03 0.45 -0.13 0.00 0.00 0.00 0.00 60.65 61.00 1xt9 s ILE 54 Cb -0.17 -3.64 0.07 0.00 0.01 0.00 0.00 42.46 38.74 1xt9 s ILE 54 CO 0.02 0.22 1.03 -1.54 0.00 0.00 0.00 174.94 174.67 1xt9 n SER 55 N 4.98 0.32 -0.26 3.58 3.41 -1.26 -3.29 113.62 121.09 1xt9 n SER 55 Ca -0.11 0.53 -0.00 0.00 -0.26 0.00 0.00 58.87 59.03 1xt9 n SER 55 Cb 0.51 -1.44 0.12 0.00 -0.26 0.00 0.00 64.21 63.14 1xt9 n SER 55 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1xt9 h PRO 56 N -1.08 0.78 -0.55 4.33 0.11 -1.87 0.15 132.00 133.87 1xt9 h PRO 56 Ca -0.45 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 1xt9 h PRO 56 Cb 1.30 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1xt9 h PRO 56 CO 0.43 0.52 0.23 0.93 -0.21 0.00 0.00 178.00 179.90 1xt9 h GLU 57 N 0.80 0.83 -0.12 1.05 3.07 -1.91 0.48 114.58 118.78 1xt9 h GLU 57 Ca 0.33 -0.15 -0.20 0.00 -0.50 0.00 0.00 59.36 58.85 1xt9 h GLU 57 Cb 0.19 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 1xt9 h GLU 57 CO -0.18 0.71 -0.73 0.28 -1.40 0.00 0.00 179.01 177.69 1xt9 h VAL 58 N 0.76 1.34 -0.15 3.13 2.07 -1.83 -1.75 116.25 119.81 1xt9 h VAL 58 Ca 0.19 -2.05 -0.01 0.00 0.82 0.00 0.00 66.70 65.65 1xt9 h VAL 58 Cb 0.19 2.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 1xt9 h VAL 58 CO -0.02 0.63 0.07 0.74 0.02 0.00 0.00 177.57 179.01 1xt9 h THR 59 N 0.39 1.13 -0.92 2.57 2.02 -0.49 0.23 112.91 117.84 1xt9 h THR 59 Ca -0.04 -0.39 0.04 0.00 0.77 0.00 0.00 66.41 66.80 1xt9 h THR 59 Cb 1.33 1.12 -0.05 0.00 -1.74 0.00 0.00 68.15 68.80 1xt9 h THR 59 CO 0.14 0.12 0.61 -0.61 0.37 0.00 0.00 175.52 176.15 1xt9 h GLN 60 N 0.10 1.11 -0.75 6.66 5.75 -0.88 0.05 115.11 127.16 1xt9 h GLN 60 Ca 0.05 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 1xt9 h GLN 60 Cb 0.13 -0.25 -0.04 0.00 1.07 0.00 0.00 27.48 28.40 1xt9 h GLN 60 CO -0.01 0.74 0.44 0.35 -2.65 0.00 0.00 178.83 177.70 1xt9 h PHE 61 N 1.15 1.01 0.35 3.99 3.57 -0.65 0.74 116.94 127.09 1xt9 h PHE 61 Ca 0.37 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.85 1xt9 h PHE 61 Cb 0.04 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 38.45 1xt9 h PHE 61 CO -0.00 0.68 -0.17 0.82 -2.23 0.00 0.00 178.31 177.41 1xt9 h ILE 62 N 1.03 0.64 -0.42 1.41 1.08 0.27 -0.40 117.51 121.13 1xt9 h ILE 62 Ca 0.27 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.73 1xt9 h ILE 62 Cb -0.02 0.64 -0.02 0.00 -3.07 0.00 0.00 36.82 34.36 1xt9 h ILE 62 CO -0.05 0.00 0.21 0.50 -0.69 0.00 0.00 178.15 178.12 1xt9 h LYS 63 N -0.48 0.61 0.20 2.37 3.64 -0.69 -3.31 116.57 118.90 1xt9 h LYS 63 Ca -0.05 -0.08 -0.32 0.00 -1.27 0.00 0.00 60.65 58.93 1xt9 h LYS 63 Cb 0.37 -0.11 0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1xt9 h LYS 63 CO 0.08 0.51 -1.45 0.00 -2.27 0.00 0.00 179.45 176.32 1xt9 s THR 65 N -2.62 4.42 -0.37 0.00 2.01 -0.16 -4.65 115.64 114.27 1xt9 s THR 65 Ca -0.08 -1.78 0.02 0.00 0.31 0.00 0.00 61.69 60.16 1xt9 s THR 65 Cb 0.05 -5.02 0.45 0.00 0.01 0.00 0.00 72.50 67.99 1xt9 s THR 65 CO 0.91 -1.81 1.77 -0.24 -0.69 0.00 0.00 174.62 174.56 1xt9 n SER 66 N 7.47 4.51 0.00 3.53 2.88 -1.26 -4.83 113.62 125.92 1xt9 n SER 66 Ca 0.38 -3.24 0.00 0.00 -1.33 0.00 0.00 58.87 54.67 1xt9 n SER 66 Cb 0.47 -0.82 0.00 0.00 -0.75 0.00 0.00 64.21 63.11 1xt9 n SER 66 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1xt9 n ASN 67 N -0.59 0.00 0.00 -3.46 3.02 -1.26 -5.21 115.26 107.77 1xt9 n ASN 67 Ca 0.44 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.99 1xt9 n ASN 67 Cb 1.16 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.33 1xt9 n ASN 67 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1xt9 n GLU 70 N 0.00 0.00 0.33 3.52 4.71 -1.26 -5.08 120.64 122.86 1xt9 n GLU 70 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 57.16 56.98 1xt9 n GLU 70 Cb 0.00 0.00 -0.09 0.00 -1.01 0.00 0.00 31.44 30.34 1xt9 n GLU 70 CO 0.00 0.00 0.00 0.97 0.09 0.00 0.00 177.13 178.19 1xt9 h ILE 71 N 0.00 0.00 -0.74 -3.67 2.10 -1.99 -2.72 117.51 110.50 1xt9 h ILE 71 Ca 0.00 0.00 0.07 0.00 1.08 0.00 0.00 64.86 66.01 1xt9 h ILE 71 Cb 0.00 0.00 -0.09 0.00 -1.09 0.00 0.00 36.82 35.64 1xt9 h ILE 71 CO 0.00 0.00 -0.43 0.00 -1.08 0.00 0.00 178.15 176.64 1xt9 n ALA 72 N -2.72 -0.47 0.13 0.18 0.00 -1.26 0.56 120.51 116.93 1xt9 n ALA 72 Ca -0.12 0.63 0.13 0.00 0.00 0.00 0.00 53.44 54.08 1xt9 n ALA 72 Cb 0.44 0.00 0.65 0.00 0.00 0.00 0.00 19.45 20.54 1xt9 n ALA 72 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1xt9 h MET 73 N 0.00 0.02 0.02 0.00 1.85 -2.01 -0.06 114.93 114.75 1xt9 h MET 73 Ca 0.12 -0.00 -0.00 0.00 -0.61 0.00 0.00 59.70 59.21 1xt9 h MET 73 Cb 0.30 -0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.33 1xt9 h MET 73 CO -0.69 0.01 -0.01 0.35 -0.40 0.00 0.00 176.91 176.17 1xt9 h PHE 74 N 0.02 -0.02 0.00 1.39 3.57 0.45 -3.35 116.94 119.00 1xt9 h PHE 74 Ca 0.12 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 1xt9 h PHE 74 Cb 0.46 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 1xt9 h PHE 74 CO -0.00 0.58 -0.38 -0.07 -2.23 0.00 0.00 178.31 176.21 1xt9 h LEU 75 N -0.65 0.00 -0.88 0.59 3.38 -0.64 -3.39 115.31 113.72 1xt9 h LEU 75 Ca -0.00 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.13 1xt9 h LEU 75 Cb 0.62 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.21 1xt9 h LEU 75 CO 0.00 0.27 -0.25 1.21 0.09 0.00 0.00 178.44 179.77 1xt9 n GLU 76 N -3.12 -0.11 0.20 1.13 4.07 -0.06 -0.02 120.64 122.72 1xt9 n GLU 76 Ca 0.02 1.37 0.18 0.00 -0.06 0.00 0.00 57.16 58.67 1xt9 n GLU 76 Cb 0.65 -2.04 0.82 0.00 -0.06 0.00 0.00 31.44 30.80 1xt9 n GLU 76 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 1xt9 h PRO 77 N 0.00 0.00 0.00 5.31 0.11 -1.81 -2.27 132.00 133.35 1xt9 h PRO 77 Ca 0.40 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.37 1xt9 h PRO 77 Cb 0.62 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.71 1xt9 h PRO 77 CO -0.90 0.00 -0.62 -0.07 -0.21 0.00 0.00 178.00 176.20 1xt9 h LEU 78 N 0.00 0.00 -1.73 2.35 3.38 -0.74 -3.48 115.31 115.09 1xt9 h LEU 78 Ca 0.10 0.00 -0.43 0.00 0.09 0.00 0.00 57.88 57.64 1xt9 h LEU 78 Cb 0.71 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.49 1xt9 h LEU 78 CO -0.00 0.62 -0.83 -0.67 0.09 0.00 0.00 178.44 177.65 1xt9 n ASP 79 N -3.25 -1.34 0.23 -0.43 2.03 -0.85 -4.87 116.55 108.06 1xt9 n ASP 79 Ca 0.01 -0.84 0.06 0.00 0.52 0.00 0.00 54.79 54.55 1xt9 n ASP 79 Cb 0.78 -3.94 0.55 0.00 -0.72 0.00 0.00 41.12 37.79 1xt9 n ASP 79 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1xt9 h LEU 80 N -1.88 0.00 -2.34 -2.67 3.38 -1.86 -2.80 115.31 107.14 1xt9 h LEU 80 Ca -0.61 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.39 1xt9 h LEU 80 Cb 1.36 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.11 1xt9 h LEU 80 CO 0.58 0.14 0.16 -0.65 0.09 0.00 0.00 178.44 178.75 1xt9 h PRO 81 N 0.00 0.00 -0.46 1.13 0.11 -1.90 -0.61 132.00 130.27 1xt9 h PRO 81 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1xt9 h PRO 81 Cb 0.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.36 1xt9 h PRO 81 CO 0.02 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.90 1xt9 n ASN 82 N -3.65 3.37 -4.77 -2.05 3.02 -1.05 -4.89 115.26 105.22 1xt9 n ASN 82 Ca -0.00 -1.97 -0.38 0.00 -0.03 0.00 0.00 54.58 52.20 1xt9 n ASN 82 Cb 0.26 -0.30 -0.06 0.00 -0.61 0.00 0.00 39.78 39.07 1xt9 n ASN 82 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1xt9 s LYS 83 N -1.40 4.14 0.00 3.52 -0.14 -0.24 -4.79 119.74 120.83 1xt9 s LYS 83 Ca 0.40 0.38 0.24 0.00 -1.36 0.00 0.00 55.97 55.63 1xt9 s LYS 83 Cb 0.23 -3.34 0.40 0.00 -1.68 0.00 0.00 37.83 33.44 1xt9 s LYS 83 CO 0.31 0.41 1.38 2.89 -0.76 0.00 0.00 175.35 179.58 1xt9 n ARG 84 N 2.82 2.25 -3.68 1.68 1.85 -0.97 -4.73 116.66 115.88 1xt9 n ARG 84 Ca -0.11 -1.85 -0.11 0.00 -1.00 0.00 0.00 57.85 54.79 1xt9 n ARG 84 Cb 0.52 -1.47 -0.11 0.00 -1.05 0.00 0.00 32.46 30.34 1xt9 n ARG 84 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1xt9 s VAL 85 N -1.85 -0.35 -0.05 8.89 1.01 -0.32 -2.08 120.40 125.65 1xt9 s VAL 85 Ca 0.33 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.50 1xt9 s VAL 85 Cb 0.21 -0.57 0.01 0.00 0.00 0.00 0.00 36.38 36.03 1xt9 s VAL 85 CO 0.31 0.07 -0.10 -0.69 0.00 0.00 0.00 175.10 174.69 1xt9 s VAL 86 N 2.07 0.95 -0.11 2.92 1.01 -0.26 -1.57 120.40 125.40 1xt9 s VAL 86 Ca -0.04 -0.39 -0.01 0.00 0.00 0.00 0.00 61.98 61.53 1xt9 s VAL 86 Cb -0.11 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.37 1xt9 s VAL 86 CO -0.11 0.31 -0.07 -0.36 0.00 0.00 0.00 175.10 174.87 1xt9 s PHE 87 N 0.57 2.95 -0.03 5.22 0.40 -0.31 -0.59 117.98 126.19 1xt9 s PHE 87 Ca -0.11 -0.21 0.02 0.00 -0.60 0.00 0.00 56.93 56.03 1xt9 s PHE 87 Cb -0.14 -1.83 0.01 0.00 0.51 0.00 0.00 43.02 41.57 1xt9 s PHE 87 CO 0.02 0.10 -0.08 -0.51 0.70 0.00 0.00 175.22 175.45 1xt9 s LEU 88 N -0.16 1.67 -0.55 -0.37 1.02 -0.36 0.32 118.68 120.26 1xt9 s LEU 88 Ca 0.02 -0.17 -0.20 0.00 0.02 0.00 0.00 54.13 53.79 1xt9 s LEU 88 Cb -0.13 -0.52 0.06 0.00 0.02 0.00 0.00 46.19 45.62 1xt9 s LEU 88 CO 0.03 0.03 0.74 0.00 0.02 0.00 0.00 176.35 177.17 1xt9 s ALA 89 N 0.39 3.31 -0.03 4.21 0.00 -1.21 -0.46 121.76 127.98 1xt9 s ALA 89 Ca -0.06 -1.74 -0.29 0.00 0.00 0.00 0.00 51.96 49.87 1xt9 s ALA 89 Cb -0.10 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.47 1xt9 s ALA 89 CO 0.01 -2.23 0.94 0.42 0.00 0.00 0.00 175.76 174.90 1xt9 s ILE 90 N 3.07 4.88 0.10 0.00 -1.09 0.33 -4.51 121.20 123.97 1xt9 s ILE 90 Ca 0.18 1.96 0.09 0.00 -2.23 0.00 0.00 60.65 60.66 1xt9 s ILE 90 Cb -0.18 -4.28 -0.04 0.00 -1.58 0.00 0.00 42.46 36.38 1xt9 s ILE 90 CO 0.12 0.14 -0.22 0.21 -1.23 0.00 0.00 174.94 173.96 1xt9 s ASN 91 N 1.00 3.59 0.00 3.58 3.84 -1.26 0.24 114.94 125.94 1xt9 s ASN 91 Ca 0.49 -0.60 0.27 0.00 0.21 0.00 0.00 52.86 53.23 1xt9 s ASN 91 Cb -0.20 -0.42 0.93 0.00 -0.55 0.00 0.00 41.25 41.01 1xt9 s ASN 91 CO 0.24 0.20 1.67 -0.90 -2.79 0.00 0.00 177.10 175.53 1xt9 n ASP 92 N 1.11 0.87 -4.65 -4.21 5.75 -1.07 -4.91 116.55 109.45 1xt9 n ASP 92 Ca -0.17 -0.82 -0.42 0.00 -0.01 0.00 0.00 54.79 53.37 1xt9 n ASP 92 Cb 0.53 0.06 -0.03 0.00 -1.03 0.00 0.00 41.12 40.65 1xt9 n ASP 92 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1xt9 s ASN 93 N -2.46 6.26 -0.01 -1.12 2.47 -1.26 -4.82 114.94 114.00 1xt9 s ASN 93 Ca 0.27 2.49 0.18 0.00 0.42 0.00 0.00 52.86 56.22 1xt9 s ASN 93 Cb 0.20 -2.53 0.54 0.00 -1.45 0.00 0.00 41.25 38.00 1xt9 s ASN 93 CO 0.49 -1.23 1.45 -1.20 -3.72 0.00 0.00 177.10 172.90 1xt9 n SER 94 N 8.34 3.66 -4.79 -4.21 7.64 -1.26 -4.97 113.62 118.02 1xt9 n SER 94 Ca 0.22 -2.04 -0.22 0.00 1.01 0.00 0.00 58.87 57.84 1xt9 n SER 94 Cb 0.42 -0.41 -0.05 0.00 -1.01 0.00 0.00 64.21 63.16 1xt9 n SER 94 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1xt9 s ASN 95 N -1.01 5.30 0.20 6.43 3.84 -1.26 -5.01 114.94 123.43 1xt9 s ASN 95 Ca 0.40 -0.36 0.11 0.00 0.21 0.00 0.00 52.86 53.22 1xt9 s ASN 95 Cb 0.22 -1.24 -0.02 0.00 -0.55 0.00 0.00 41.25 39.66 1xt9 s ASN 95 CO 0.27 -0.07 1.39 -0.61 -2.79 0.00 0.00 177.10 175.29 1xt9 h GLN 96 N 1.54 0.00 -7.20 0.43 -0.00 -2.05 -3.46 115.11 104.37 1xt9 h GLN 96 Ca -0.47 0.00 -0.52 0.00 -0.00 0.00 0.00 58.65 57.65 1xt9 h GLN 96 Cb 1.24 0.00 0.14 0.00 0.00 0.00 0.00 27.48 28.86 1xt9 h GLN 96 CO 0.60 0.75 0.37 0.00 0.00 0.00 0.00 178.83 180.56 1xt9 s ALA 97 N -2.92 2.17 0.56 3.38 0.00 -1.26 -4.95 121.76 118.74 1xt9 s ALA 97 Ca 0.02 0.72 -0.21 0.00 0.00 0.00 0.00 51.96 52.48 1xt9 s ALA 97 Cb 0.09 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.76 1xt9 s ALA 97 CO 0.78 -1.77 1.37 0.00 0.00 0.00 0.00 175.76 176.14 1xt9 s ALA 98 N -2.21 2.79 0.00 0.00 0.00 -1.26 -4.85 121.76 116.23 1xt9 s ALA 98 Ca 0.71 1.36 0.00 0.00 0.00 0.00 0.00 51.96 54.02 1xt9 s ALA 98 Cb -0.25 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.29 1xt9 s ALA 98 CO 0.46 -1.43 0.00 0.41 0.00 0.00 0.00 175.76 175.19 1xt9 n GLY 99 N 0.75 -0.49 0.00 0.00 0.00 -1.26 -5.10 105.19 99.09 1xt9 n GLY 99 Ca 0.11 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1xt9 n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xt9 n GLY 100 N 0.00 3.47 0.00 -0.02 0.00 -1.26 -4.90 105.19 102.48 1xt9 n GLY 100 Ca 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1xt9 n GLY 100 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xt9 n THR 101 N -0.93 0.00 -3.87 2.61 -1.04 -1.26 -4.96 114.28 104.83 1xt9 n THR 101 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 1xt9 n THR 101 Cb 0.00 -0.64 -0.12 0.00 -1.82 0.00 0.00 70.33 67.75 1xt9 n THR 101 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1xt9 s HIS 102 N -1.76 -0.00 -0.02 -1.42 5.65 -1.26 -5.04 115.29 111.44 1xt9 s HIS 102 Ca 0.00 0.02 -0.00 0.00 0.25 0.00 0.00 55.06 55.32 1xt9 s HIS 102 Cb 0.00 -0.02 -0.04 0.00 -1.18 0.00 0.00 32.58 31.34 1xt9 s HIS 102 CO 0.00 -0.10 0.06 -1.58 -0.65 0.00 0.00 174.74 172.47 1xt9 s TRP 103 N -0.41 3.25 0.04 3.88 0.52 -1.26 -2.58 118.94 122.37 1xt9 s TRP 103 Ca -0.05 0.20 -0.08 0.00 0.02 0.00 0.00 56.10 56.19 1xt9 s TRP 103 Cb -0.03 -1.74 -0.00 0.00 -1.15 0.00 0.00 33.47 30.55 1xt9 s TRP 103 CO 0.00 0.53 0.15 0.45 0.02 0.00 0.00 176.95 178.11 1xt9 s SER 104 N -1.58 0.11 -0.23 2.95 0.15 0.14 -4.70 113.70 110.54 1xt9 s SER 104 Ca 0.21 -0.47 -0.05 0.00 0.70 0.00 0.00 55.95 56.33 1xt9 s SER 104 Cb -0.12 0.27 -0.02 0.00 -1.71 0.00 0.00 66.02 64.44 1xt9 s SER 104 CO 0.11 -0.56 -0.00 -0.22 1.20 0.00 0.00 173.24 173.77 1xt9 s LEU 105 N -2.21 3.12 -0.15 3.45 2.96 -0.89 0.12 118.68 125.09 1xt9 s LEU 105 Ca -0.04 -0.31 -0.06 0.00 -0.22 0.00 0.00 54.13 53.51 1xt9 s LEU 105 Cb -0.00 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.84 1xt9 s LEU 105 CO -0.05 -0.01 0.05 -0.22 -1.32 0.00 0.00 176.35 174.80 1xt9 s LEU 106 N 1.46 3.81 -0.14 -0.68 0.20 0.39 -0.98 118.68 122.75 1xt9 s LEU 106 Ca 0.05 0.15 -0.00 0.00 0.69 0.00 0.00 54.13 55.02 1xt9 s LEU 106 Cb -0.15 -1.93 0.03 0.00 -0.43 0.00 0.00 46.19 43.71 1xt9 s LEU 106 CO -0.00 0.26 -0.09 -0.69 -0.29 0.00 0.00 176.35 175.54 1xt9 s VAL 107 N -0.18 1.21 -0.24 1.68 1.01 0.22 -1.22 120.40 122.87 1xt9 s VAL 107 Ca 0.07 -0.49 -0.13 0.00 0.00 0.00 0.00 61.98 61.44 1xt9 s VAL 107 Cb -0.12 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 1xt9 s VAL 107 CO 0.01 0.32 0.27 -0.47 0.00 0.00 0.00 175.10 175.23 1xt9 s TYR 108 N 1.62 3.30 -0.41 5.22 5.04 0.24 0.24 117.35 132.61 1xt9 s TYR 108 Ca 0.04 0.34 0.03 0.00 -2.44 0.00 0.00 57.07 55.03 1xt9 s TYR 108 Cb -0.13 -2.41 0.11 0.00 0.35 0.00 0.00 41.96 39.88 1xt9 s TYR 108 CO -0.09 -0.05 0.14 -0.51 -1.34 0.00 0.00 175.55 173.71 1xt9 s LEU 109 N 1.44 4.76 0.39 6.97 1.02 -0.81 -1.11 118.68 131.33 1xt9 s LEU 109 Ca 0.12 -2.39 0.12 0.00 0.02 0.00 0.00 54.13 52.00 1xt9 s LEU 109 Cb -0.15 -1.67 0.93 0.00 0.02 0.00 0.00 46.19 45.32 1xt9 s LEU 109 CO 0.07 -0.37 1.89 -0.61 0.02 0.00 0.00 176.35 177.36 1xt9 h GLN 110 N 7.37 0.55 -0.19 1.70 4.15 -1.71 0.66 115.11 127.64 1xt9 h GLN 110 Ca -0.06 -0.03 0.03 0.00 0.77 0.00 0.00 58.65 59.35 1xt9 h GLN 110 Cb 0.99 -0.12 -0.05 0.00 0.21 0.00 0.00 27.48 28.50 1xt9 h GLN 110 CO 0.60 0.36 -0.39 0.22 -1.93 0.00 0.00 178.83 177.68 1xt9 h ASP 111 N 0.56 -1.28 -0.04 -0.69 1.82 -1.93 -1.52 116.42 113.34 1xt9 h ASP 111 Ca 0.41 0.16 0.00 0.00 -0.39 0.00 0.00 57.03 57.21 1xt9 h ASP 111 Cb 0.78 0.51 0.00 0.00 0.68 0.00 0.00 39.33 41.30 1xt9 h ASP 111 CO -0.16 -0.32 0.00 0.29 -1.61 0.00 0.00 179.24 177.44 1xt9 n LYS 112 N -4.61 1.49 -3.84 0.28 5.02 -0.45 -4.96 118.16 111.10 1xt9 n LYS 112 Ca -0.03 -0.72 -0.32 0.00 -2.02 0.00 0.00 58.31 55.22 1xt9 n LYS 112 Cb 0.26 -1.46 0.01 0.00 -0.02 0.00 0.00 35.03 33.82 1xt9 n LYS 112 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1xt9 n ASN 113 N -0.11 -4.84 -3.59 4.39 5.15 0.22 -4.93 115.26 111.54 1xt9 n ASN 113 Ca 0.19 -1.04 -0.08 0.00 -0.60 0.00 0.00 54.58 53.05 1xt9 n ASN 113 Cb 0.28 -2.10 -0.04 0.00 -0.53 0.00 0.00 39.78 37.38 1xt9 n ASN 113 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1xt9 s SER 114 N -3.24 -0.28 0.16 1.20 0.15 -1.10 -3.59 113.70 107.01 1xt9 s SER 114 Ca 0.24 0.25 -0.05 0.00 0.70 0.00 0.00 55.95 57.08 1xt9 s SER 114 Cb -0.12 0.24 -0.06 0.00 -1.71 0.00 0.00 66.02 64.37 1xt9 s SER 114 CO 0.91 -0.29 0.41 -0.36 1.20 0.00 0.00 173.24 175.10 1xt9 s PHE 115 N -1.40 3.47 -0.06 3.44 0.40 0.65 -1.93 117.98 122.54 1xt9 s PHE 115 Ca 0.02 0.60 0.00 0.00 -0.60 0.00 0.00 56.93 56.96 1xt9 s PHE 115 Cb -0.01 -2.04 0.02 0.00 0.51 0.00 0.00 43.02 41.50 1xt9 s PHE 115 CO -0.02 0.40 -0.03 -0.06 0.70 0.00 0.00 175.22 176.21 1xt9 s PHE 116 N -1.69 0.81 -0.26 0.36 0.08 0.14 -0.88 117.98 116.53 1xt9 s PHE 116 Ca 0.42 -0.25 -0.06 0.00 0.12 0.00 0.00 56.93 57.16 1xt9 s PHE 116 Cb -0.12 -0.77 -0.01 0.00 -0.57 0.00 0.00 43.02 41.55 1xt9 s PHE 116 CO 0.24 -0.27 0.04 -1.58 -0.10 0.00 0.00 175.22 173.55 1xt9 s HIS 117 N 1.32 3.07 -0.37 0.36 5.65 -0.26 0.70 115.29 125.76 1xt9 s HIS 117 Ca -0.04 -0.78 -0.09 0.00 0.25 0.00 0.00 55.06 54.40 1xt9 s HIS 117 Cb -0.14 -2.20 0.05 0.00 -1.18 0.00 0.00 32.58 29.11 1xt9 s HIS 117 CO -0.02 -0.49 0.19 0.71 -0.65 0.00 0.00 174.74 174.47 1xt9 s TYR 118 N 1.53 3.28 -0.22 3.88 1.51 -0.15 -2.08 117.35 125.09 1xt9 s TYR 118 Ca 0.05 -1.28 -0.00 0.00 -1.01 0.00 0.00 57.07 54.82 1xt9 s TYR 118 Cb -0.16 -2.53 0.02 0.00 -0.11 0.00 0.00 41.96 39.19 1xt9 s TYR 118 CO 0.01 -0.73 -0.12 0.34 -1.11 0.00 0.00 175.55 173.94 1xt9 s ASP 119 N 1.65 3.83 0.00 2.29 -1.08 -1.26 -2.09 116.67 120.01 1xt9 s ASP 119 Ca 0.01 -0.75 0.12 0.00 -0.52 0.00 0.00 52.55 51.41 1xt9 s ASP 119 Cb -0.20 -1.59 0.66 0.00 -1.46 0.00 0.00 42.92 40.33 1xt9 s ASP 119 CO 0.04 -0.06 1.20 -1.54 0.52 0.00 0.00 175.17 175.33 1xt9 n SER 120 N 4.65 0.00 -3.45 -0.34 3.41 -1.25 -4.04 113.62 112.59 1xt9 n SER 120 Ca -0.18 -0.17 -0.27 0.00 -0.26 0.00 0.00 58.87 57.98 1xt9 n SER 120 Cb 0.48 -0.12 -0.12 0.00 -0.26 0.00 0.00 64.21 64.20 1xt9 n SER 120 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1xt9 s HIS 121 N -2.23 0.49 0.00 7.33 5.65 -1.26 -0.61 115.29 124.65 1xt9 s HIS 121 Ca 0.15 -1.39 0.00 0.00 0.25 0.00 0.00 55.06 54.07 1xt9 s HIS 121 Cb 0.08 -0.82 0.00 0.00 -1.18 0.00 0.00 32.58 30.66 1xt9 s HIS 121 CO 0.15 -0.85 0.00 -1.13 -0.65 0.00 0.00 174.74 172.26 1xt9 n SER 122 N 4.23 0.00 -1.33 9.88 3.41 -1.26 -1.52 113.62 127.03 1xt9 n SER 122 Ca 0.10 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.55 1xt9 n SER 122 Cb 0.39 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.27 1xt9 n SER 122 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xt9 n ARG 123 N 0.06 -1.45 -0.30 4.33 1.74 -1.26 -4.86 116.66 114.92 1xt9 n ARG 123 Ca 0.00 0.96 -0.02 0.00 -0.77 0.00 0.00 57.85 58.02 1xt9 n ARG 123 Cb 0.00 -5.26 0.15 0.00 -1.02 0.00 0.00 32.46 26.32 1xt9 n ARG 123 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 1xt9 h SER 124 N 0.00 1.04 -0.59 0.55 0.02 -1.66 -2.71 113.55 110.20 1xt9 h SER 124 Ca -0.32 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1xt9 h SER 124 Cb 1.10 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.38 1xt9 h SER 124 CO 0.46 0.79 0.00 0.59 -1.14 0.00 0.00 176.83 177.54 1xt9 n ASN 125 N -4.37 3.61 -0.30 3.07 4.13 -1.26 -4.66 115.26 115.49 1xt9 n ASN 125 Ca 0.10 -1.99 0.10 0.00 1.68 0.00 0.00 54.58 54.47 1xt9 n ASN 125 Cb 0.06 -0.39 0.23 0.00 -1.54 0.00 0.00 39.78 38.14 1xt9 n ASN 125 CO 0.00 0.00 0.00 -1.28 0.28 0.00 0.00 177.26 176.26 1xt9 h SER 126 N 4.19 -0.32 0.06 6.41 0.87 -1.87 -0.71 113.55 122.18 1xt9 h SER 126 Ca 0.00 0.22 -0.00 0.00 -1.23 0.00 0.00 61.79 60.78 1xt9 h SER 126 Cb 0.95 0.38 0.00 0.00 -0.44 0.00 0.00 62.40 63.28 1xt9 h SER 126 CO 0.00 -0.23 -0.03 0.58 -0.53 0.00 0.00 176.83 176.62 1xt9 h VAL 127 N 0.10 1.12 -0.97 2.23 2.07 -1.83 -1.95 116.25 117.01 1xt9 h VAL 127 Ca 0.50 -0.60 0.04 0.00 0.82 0.00 0.00 66.70 67.47 1xt9 h VAL 127 Cb 0.97 1.51 -0.06 0.00 -1.52 0.00 0.00 31.29 32.19 1xt9 h VAL 127 CO -0.75 0.15 0.63 0.45 0.02 0.00 0.00 177.57 178.07 1xt9 h HIS 128 N -0.35 1.18 -0.43 1.57 -0.00 -1.75 0.13 115.15 115.50 1xt9 h HIS 128 Ca -0.01 0.03 -0.09 0.00 -0.00 0.00 0.00 60.37 60.30 1xt9 h HIS 128 Cb 0.31 -0.39 -0.02 0.00 -0.00 0.00 0.00 27.41 27.31 1xt9 h HIS 128 CO 0.01 0.67 -0.11 0.00 -0.00 0.00 0.00 177.93 178.51 1xt9 h ALA 129 N 1.40 1.00 -0.13 2.45 0.00 -1.09 -1.44 119.26 121.45 1xt9 h ALA 129 Ca 0.39 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1xt9 h ALA 129 Cb 0.02 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1xt9 h ALA 129 CO -0.13 0.60 -0.20 0.87 0.00 0.00 0.00 179.25 180.39 1xt9 h LYS 130 N 0.70 0.36 -0.48 0.00 1.57 -0.59 -2.15 116.57 115.99 1xt9 h LYS 130 Ca 0.12 -0.22 0.10 0.00 -1.87 0.00 0.00 60.65 58.78 1xt9 h LYS 130 Cb 0.58 0.02 -0.10 0.00 0.08 0.00 0.00 32.23 32.81 1xt9 h LYS 130 CO 0.04 0.80 -0.22 0.37 -0.57 0.00 0.00 179.45 179.87 1xt9 h GLN 131 N -0.04 -0.11 -0.66 3.15 4.15 -0.57 0.61 115.11 121.64 1xt9 h GLN 131 Ca 0.01 0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.46 1xt9 h GLN 131 Cb 0.76 0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.44 1xt9 h GLN 131 CO 0.05 -0.07 0.42 0.28 -1.93 0.00 0.00 178.83 177.58 1xt9 h VAL 132 N -0.11 1.12 0.42 2.39 2.07 -1.23 -1.95 116.25 118.97 1xt9 h VAL 132 Ca 0.23 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 1xt9 h VAL 132 Cb 0.46 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1xt9 h VAL 132 CO -0.55 0.15 -0.20 0.00 0.02 0.00 0.00 177.57 176.99 1xt9 h ALA 133 N 1.26 -0.57 -0.96 1.67 0.00 -0.50 -2.44 119.26 117.73 1xt9 h ALA 133 Ca 0.25 -0.15 0.09 0.00 0.00 0.00 0.00 54.91 55.11 1xt9 h ALA 133 Cb -0.04 0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.90 1xt9 h ALA 133 CO -0.08 -0.77 0.60 0.93 0.00 0.00 0.00 179.25 179.93 1xt9 h GLU 134 N -0.66 0.99 0.00 0.00 5.08 -0.91 0.23 114.58 119.32 1xt9 h GLU 134 Ca -0.06 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1xt9 h GLU 134 Cb 0.48 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1xt9 h GLU 134 CO 0.10 0.66 0.00 1.63 -1.00 0.00 0.00 179.01 180.39 1xt9 n LYS 135 N -4.60 0.93 0.00 2.33 5.02 -0.74 -2.70 118.16 118.40 1xt9 n LYS 135 Ca 0.16 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.45 1xt9 n LYS 135 Cb 0.26 -1.30 0.00 0.00 -0.02 0.00 0.00 35.03 33.98 1xt9 n LYS 135 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1xt9 n LEU 136 N -0.80 0.00 -0.37 -0.35 7.94 0.15 -4.60 117.00 118.97 1xt9 n LEU 136 Ca 0.13 -0.33 0.00 0.00 -1.11 0.00 0.00 56.01 54.70 1xt9 n LEU 136 Cb 0.06 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.01 1xt9 n LEU 136 CO 0.10 0.00 0.09 1.21 -1.11 0.00 0.00 177.39 177.68 1xt9 n GLU 137 N -0.86 0.29 0.00 1.96 2.13 0.58 -2.91 120.64 121.83 1xt9 n GLU 137 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1xt9 n GLU 137 Cb 0.00 -1.11 0.00 0.00 0.27 0.00 0.00 31.44 30.60 1xt9 n GLU 137 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1xt9 n ALA 138 N 0.13 1.47 0.20 4.31 0.00 -1.26 -4.70 120.51 120.66 1xt9 n ALA 138 Ca 0.00 -0.06 0.08 0.00 0.00 0.00 0.00 53.44 53.46 1xt9 n ALA 138 Cb 0.05 0.00 0.45 0.00 0.00 0.00 0.00 19.45 19.95 1xt9 n ALA 138 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1xt9 h PHE 139 N 0.00 0.00 -3.18 0.00 -1.00 -1.85 -3.42 116.94 107.49 1xt9 h PHE 139 Ca 0.00 0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.63 1xt9 h PHE 139 Cb 0.00 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.53 1xt9 h PHE 139 CO 0.00 0.00 -0.04 1.47 -1.61 0.00 0.00 178.31 178.13 1xt9 n LEU 140 N -2.22 0.00 -0.01 1.54 -0.00 -1.14 -4.14 117.00 111.02 1xt9 n LEU 140 Ca -0.01 -1.80 0.00 0.00 -0.00 0.00 0.00 56.01 54.20 1xt9 n LEU 140 Cb 0.32 1.79 0.00 0.00 -0.00 0.00 0.00 43.42 45.53 1xt9 n LEU 140 CO 0.07 -0.44 0.00 0.61 -0.00 0.00 0.00 177.39 177.63 1xt9 n GLY 141 N -0.37 1.19 3.19 1.47 0.00 -1.26 -4.44 105.19 104.97 1xt9 n GLY 141 Ca -0.01 -1.29 -0.39 0.00 0.00 0.00 0.00 46.02 44.33 1xt9 n GLY 141 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xt9 n ARG 142 N 2.73 0.00 -3.24 1.61 5.12 -1.26 -4.91 116.66 116.71 1xt9 n ARG 142 Ca 0.00 0.00 -0.39 0.00 -1.93 0.00 0.00 57.85 55.53 1xt9 n ARG 142 Cb 0.00 -0.98 -0.07 0.00 -1.16 0.00 0.00 32.46 30.25 1xt9 n ARG 142 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1xt9 s LYS 143 N -0.98 4.16 -0.50 5.56 1.02 -1.26 -3.95 119.74 123.79 1xt9 s LYS 143 Ca 0.56 0.39 0.00 0.00 0.02 0.00 0.00 55.97 56.95 1xt9 s LYS 143 Cb -0.51 -3.58 0.00 0.00 -0.52 0.00 0.00 37.83 33.22 1xt9 s LYS 143 CO 0.64 -0.20 0.00 0.41 -0.92 0.00 0.00 175.35 175.28 1xt9 n GLY 144 N 4.01 0.72 0.00 -3.33 0.00 -1.26 -5.02 105.19 100.31 1xt9 n GLY 144 Ca -0.05 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.13 1xt9 n GLY 144 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1xt9 n ASP 145 N 1.24 1.74 -4.28 1.61 8.00 -1.25 -5.13 116.55 118.48 1xt9 n ASP 145 Ca -0.05 -0.63 -0.35 0.00 0.71 0.00 0.00 54.79 54.48 1xt9 n ASP 145 Cb 0.17 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.12 1xt9 n ASP 145 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1xt9 s LYS 146 N -0.79 3.30 -0.67 -1.24 2.20 -1.26 -5.01 119.74 116.27 1xt9 s LYS 146 Ca 0.00 -0.67 -0.17 0.00 -0.36 0.00 0.00 55.97 54.77 1xt9 s LYS 146 Cb 0.00 -2.91 0.14 0.00 -1.51 0.00 0.00 37.83 33.55 1xt9 s LYS 146 CO 0.00 -0.18 0.73 -0.51 -0.36 0.00 0.00 175.35 175.03 1xt9 s LEU 147 N 1.39 5.79 0.52 5.43 1.43 -1.26 -4.76 118.68 127.21 1xt9 s LEU 147 Ca 0.05 -1.84 -0.17 0.00 -1.03 0.00 0.00 54.13 51.14 1xt9 s LEU 147 Cb -0.14 -2.28 -0.08 0.00 0.03 0.00 0.00 46.19 43.73 1xt9 s LEU 147 CO -0.05 -0.95 0.99 0.00 0.23 0.00 0.00 176.35 176.58 1xt9 s ALA 148 N 1.95 3.02 -0.11 4.21 0.00 -1.24 -4.90 121.76 124.70 1xt9 s ALA 148 Ca 0.14 0.23 0.01 0.00 0.00 0.00 0.00 51.96 52.34 1xt9 s ALA 148 Cb -0.20 -3.14 0.02 0.00 0.00 0.00 0.00 23.12 19.80 1xt9 s ALA 148 CO 0.01 -0.28 -0.13 0.12 0.00 0.00 0.00 175.76 175.48 1xt9 s PHE 149 N -2.55 1.78 -0.01 0.00 5.36 -1.26 -0.25 117.98 121.04 1xt9 s PHE 149 Ca 0.60 -0.85 0.04 0.00 -0.96 0.00 0.00 56.93 55.76 1xt9 s PHE 149 Cb -0.11 -1.33 -0.01 0.00 -0.34 0.00 0.00 43.02 41.23 1xt9 s PHE 149 CO 0.30 -0.48 -0.14 0.54 -1.46 0.00 0.00 175.22 173.99 1xt9 s VAL 150 N 1.17 1.11 -0.49 3.12 0.11 -0.06 -4.95 120.40 120.42 1xt9 s VAL 150 Ca -0.04 -0.59 -0.22 0.00 -2.93 0.00 0.00 61.98 58.19 1xt9 s VAL 150 Cb -0.14 -0.93 0.04 0.00 -1.53 0.00 0.00 36.38 33.81 1xt9 s VAL 150 CO -0.03 0.32 0.78 -1.61 -3.33 0.00 0.00 175.10 171.23 1xt9 s GLU 151 N -0.28 3.32 0.27 1.54 0.41 -1.26 -1.10 118.70 121.60 1xt9 s GLU 151 Ca 0.04 -0.31 -0.29 0.00 -0.41 0.00 0.00 54.97 54.00 1xt9 s GLU 151 Cb -0.06 -4.00 -0.09 0.00 -1.78 0.00 0.00 34.13 28.20 1xt9 s GLU 151 CO -0.00 -1.22 0.95 -1.21 -0.49 0.00 0.00 175.26 173.28 1xt9 s GLU 152 N 3.30 4.75 -0.08 1.61 0.41 -0.89 -4.94 118.70 122.87 1xt9 s GLU 152 Ca 0.27 1.45 -0.29 0.00 -0.41 0.00 0.00 54.97 55.98 1xt9 s GLU 152 Cb -0.14 -3.11 -0.06 0.00 -1.78 0.00 0.00 34.13 29.05 1xt9 s GLU 152 CO 0.19 0.42 1.84 0.21 -0.49 0.00 0.00 175.26 177.43 1xt9 s LYS 153 N -1.50 3.94 0.18 1.61 2.47 -1.26 -4.66 119.74 120.53 1xt9 s LYS 153 Ca 0.44 2.21 0.09 0.00 -1.56 0.00 0.00 55.97 57.16 1xt9 s LYS 153 Cb -0.24 -4.11 -0.04 0.00 -1.46 0.00 0.00 37.83 31.98 1xt9 s LYS 153 CO 0.30 -1.15 -0.19 0.00 0.16 0.00 0.00 175.35 174.47 1xt9 s ALA 154 N 5.02 2.13 0.06 3.13 0.00 -1.26 -4.93 121.76 125.92 1xt9 s ALA 154 Ca 0.82 -1.56 -0.38 0.00 0.00 0.00 0.00 51.96 50.84 1xt9 s ALA 154 Cb -0.35 -0.20 -0.18 0.00 0.00 0.00 0.00 23.12 22.40 1xt9 s ALA 154 CO 0.35 0.24 1.25 -2.30 0.00 0.00 0.00 175.76 175.29 1xt9 n PRO 155 N 0.13 0.78 -3.59 0.00 -0.02 -1.26 -4.82 135.00 126.21 1xt9 n PRO 155 Ca -0.12 0.28 -0.37 0.00 -2.02 0.00 0.00 63.50 61.28 1xt9 n PRO 155 Cb 0.58 -1.87 -0.08 0.00 -0.02 0.00 0.00 33.50 32.10 1xt9 n PRO 155 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xt9 s ALA 156 N 0.31 3.61 0.40 3.55 0.00 -1.26 -3.87 121.76 124.50 1xt9 s ALA 156 Ca 0.86 -0.67 -0.25 0.00 0.00 0.00 0.00 51.96 51.90 1xt9 s ALA 156 Cb -1.05 -2.37 -0.09 0.00 0.00 0.00 0.00 23.12 19.61 1xt9 s ALA 156 CO 0.50 -0.08 1.14 1.14 0.00 0.00 0.00 175.76 178.46 1xt9 s GLN 157 N 0.84 4.10 0.00 0.00 -2.07 0.22 -4.91 119.66 117.84 1xt9 s GLN 157 Ca 0.12 1.76 0.16 0.00 -1.82 0.00 0.00 55.36 55.57 1xt9 s GLN 157 Cb -0.13 -2.66 0.38 0.00 -1.09 0.00 0.00 33.01 29.51 1xt9 s GLN 157 CO 0.04 -0.26 1.30 1.04 -1.32 0.00 0.00 175.29 176.09 1xt9 n GLN 158 N 0.08 2.51 -4.36 9.60 6.02 -1.26 -4.96 117.38 125.01 1xt9 n GLN 158 Ca 0.04 -2.14 -0.20 0.00 -0.01 0.00 0.00 57.00 54.69 1xt9 n GLN 158 Cb 0.47 -1.37 -0.09 0.00 1.02 0.00 0.00 30.24 30.27 1xt9 n GLN 158 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1xt9 s ASN 159 N -1.07 1.85 0.00 1.08 2.20 -1.26 -5.06 114.94 112.69 1xt9 s ASN 159 Ca 0.31 -1.65 0.25 0.00 -0.94 0.00 0.00 52.86 50.82 1xt9 s ASN 159 Cb 0.17 0.48 0.72 0.00 -2.00 0.00 0.00 41.25 40.62 1xt9 s ASN 159 CO 0.22 -0.96 1.55 -1.54 -2.94 0.00 0.00 177.10 173.44 1xt9 n SER 160 N -1.22 2.08 0.00 3.54 3.41 -1.26 -4.53 113.62 115.64 1xt9 n SER 160 Ca 0.02 -1.71 0.00 0.00 -0.26 0.00 0.00 58.87 56.91 1xt9 n SER 160 Cb 0.64 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.53 1xt9 n SER 160 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xt9 n TYR 161 N 0.61 0.00 1.41 7.33 0.18 -1.26 -4.77 117.16 120.66 1xt9 n TYR 161 Ca 0.17 0.00 0.05 0.00 1.88 0.00 0.00 57.90 60.01 1xt9 n TYR 161 Cb 0.43 0.00 0.20 0.00 -0.38 0.00 0.00 39.34 39.59 1xt9 n TYR 161 CO 0.00 0.00 0.00 -0.25 -2.08 0.00 0.00 176.86 174.53 1xt9 n ASP 162 N -1.06 1.05 -0.30 9.48 10.43 -1.26 -4.34 116.55 130.55 1xt9 n ASP 162 Ca 0.00 -1.87 0.09 0.00 2.57 0.00 0.00 54.79 55.57 1xt9 n ASP 162 Cb 0.00 -0.11 0.25 0.00 1.84 0.00 0.00 41.12 43.09 1xt9 n ASP 162 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1xt9 h GLY 164 N 0.56 0.96 1.73 0.00 0.00 -1.85 -2.06 103.07 102.41 1xt9 h GLY 164 Ca 0.49 -0.39 -0.13 0.00 0.00 0.00 0.00 47.33 47.30 1xt9 h GLY 164 CO -0.41 0.38 -0.51 -0.33 0.00 0.00 0.00 176.54 175.67 1xt9 h MET 165 N 0.91 0.29 -0.68 4.80 2.07 -1.17 -2.53 114.93 118.62 1xt9 h MET 165 Ca 0.24 -0.17 -0.07 0.00 -2.07 0.00 0.00 59.70 57.63 1xt9 h MET 165 Cb -0.03 0.01 -0.03 0.00 -1.87 0.00 0.00 31.60 29.68 1xt9 h MET 165 CO -0.04 0.74 0.15 1.88 1.07 0.00 0.00 176.91 180.70 1xt9 h TYR 166 N 0.23 1.15 -0.36 -0.22 -1.99 -0.68 0.47 116.97 115.56 1xt9 h TYR 166 Ca 0.01 -0.14 0.01 0.00 2.00 0.00 0.00 58.73 60.61 1xt9 h TYR 166 Cb 0.98 -0.32 -0.02 0.00 2.00 0.00 0.00 36.73 39.37 1xt9 h TYR 166 CO 0.02 0.94 0.22 0.28 -0.00 0.00 0.00 178.16 179.63 1xt9 h VAL 167 N 1.03 1.06 -0.42 -2.88 2.07 -1.32 0.26 116.25 116.06 1xt9 h VAL 167 Ca 0.21 -0.16 -0.07 0.00 0.82 0.00 0.00 66.70 67.50 1xt9 h VAL 167 Cb 0.38 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1xt9 h VAL 167 CO 0.00 0.08 -0.02 0.40 0.02 0.00 0.00 177.57 178.05 1xt9 h ILE 168 N 0.45 1.26 -0.41 4.57 1.08 -0.98 -2.54 117.51 120.95 1xt9 h ILE 168 Ca 0.14 -1.06 -0.15 0.00 -0.39 0.00 0.00 64.86 63.39 1xt9 h ILE 168 Cb -0.02 1.12 -0.01 0.00 -3.07 0.00 0.00 36.82 34.84 1xt9 h ILE 168 CO -0.05 0.36 -0.35 0.00 -0.69 0.00 0.00 178.15 177.42 1xt9 h ASN 170 N 0.79 0.20 -0.05 0.00 -0.26 -0.51 -0.65 115.58 115.09 1xt9 h ASN 170 Ca 0.07 0.01 0.03 0.00 -0.56 0.00 0.00 56.30 55.85 1xt9 h ASN 170 Cb 0.94 -0.04 -0.04 0.00 -1.06 0.00 0.00 38.32 38.13 1xt9 h ASN 170 CO 0.09 0.15 -0.14 0.74 -1.06 0.00 0.00 177.43 177.20 1xt9 h THR 171 N 0.26 0.64 -0.33 2.81 2.02 -1.34 0.17 112.91 117.14 1xt9 h THR 171 Ca 0.09 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.27 1xt9 h THR 171 Cb 0.01 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.04 1xt9 h THR 171 CO -0.05 0.00 0.21 -0.08 0.37 0.00 0.00 175.52 175.97 1xt9 h GLU 172 N -0.21 0.45 -0.44 6.66 4.81 -1.23 -1.20 114.58 123.41 1xt9 h GLU 172 Ca 0.07 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1xt9 h GLU 172 Cb 0.30 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 1xt9 h GLU 172 CO -0.18 0.32 0.25 0.00 -0.73 0.00 0.00 179.01 178.68 1xt9 h ALA 173 N 1.10 0.56 -0.64 2.92 0.00 -0.71 -0.67 119.26 121.81 1xt9 h ALA 173 Ca 0.12 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1xt9 h ALA 173 Cb -0.02 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1xt9 h ALA 173 CO -0.02 0.07 0.42 -0.07 0.00 0.00 0.00 179.25 179.64 1xt9 h LEU 174 N 0.58 0.70 -1.88 0.00 3.38 -0.50 -1.23 115.31 116.37 1xt9 h LEU 174 Ca 0.16 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1xt9 h LEU 174 Cb 0.02 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 1xt9 h LEU 174 CO -0.03 0.50 -0.09 0.00 0.09 0.00 0.00 178.44 178.91 1xt9 h GLN 176 N 0.00 0.31 -0.47 0.00 1.08 0.02 -1.18 115.11 114.87 1xt9 h GLN 176 Ca -0.00 -0.15 -0.08 0.00 -1.45 0.00 0.00 58.65 56.96 1xt9 h GLN 176 Cb 0.18 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.59 1xt9 h GLN 176 CO 0.01 0.68 -0.04 -0.91 -0.95 0.00 0.00 178.83 177.62 1xt9 h ASN 177 N -0.05 0.85 -0.13 1.46 4.21 -0.72 0.16 115.58 121.35 1xt9 h ASN 177 Ca 0.03 -0.33 -0.06 0.00 1.21 0.00 0.00 56.30 57.15 1xt9 h ASN 177 Cb 0.61 -0.23 -0.00 0.00 -1.12 0.00 0.00 38.32 37.58 1xt9 h ASN 177 CO 0.03 0.97 -0.17 -0.26 -1.29 0.00 0.00 177.43 176.71 1xt9 h PHE 178 N 0.71 0.43 0.00 1.19 0.05 -0.70 -3.34 116.94 115.28 1xt9 h PHE 178 Ca 0.13 -0.14 -0.02 0.00 3.82 0.00 0.00 57.97 61.76 1xt9 h PHE 178 Cb 0.56 -0.09 -0.00 0.00 2.00 0.00 0.00 35.95 38.42 1xt9 h PHE 178 CO 0.04 0.77 -1.50 1.19 -0.18 0.00 0.00 178.31 178.63 1xt9 n PHE 179 N -4.54 0.00 -1.05 -0.55 3.01 -0.45 -4.59 117.46 109.29 1xt9 n PHE 179 Ca -0.06 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.41 1xt9 n PHE 179 Cb 0.38 -0.27 0.30 0.00 -0.01 0.00 0.00 39.48 39.88 1xt9 n PHE 179 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1xt9 n ARG 180 N -1.93 3.48 -1.37 -1.08 5.12 0.54 -4.95 116.66 116.47 1xt9 n ARG 180 Ca -0.04 -3.04 -0.13 0.00 -1.93 0.00 0.00 57.85 52.71 1xt9 n ARG 180 Cb 0.35 -2.07 -0.06 0.00 -1.16 0.00 0.00 32.46 29.52 1xt9 n ARG 180 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1xt9 n GLN 181 N -0.24 -1.34 -1.77 5.56 6.02 -1.11 -4.87 117.38 119.63 1xt9 n GLN 181 Ca 0.32 0.80 -0.31 0.00 -0.01 0.00 0.00 57.00 57.80 1xt9 n GLN 181 Cb 1.16 -5.03 0.04 0.00 1.02 0.00 0.00 30.24 27.43 1xt9 n GLN 181 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1xt9 s GLN 182 N -3.08 3.13 -0.29 -1.09 -1.52 -1.02 -4.97 119.66 110.81 1xt9 s GLN 182 Ca 0.00 0.73 0.18 0.00 -1.95 0.00 0.00 55.36 54.32 1xt9 s GLN 182 Cb 0.00 -2.03 0.49 0.00 -0.22 0.00 0.00 33.01 31.25 1xt9 s GLN 182 CO 0.00 -0.90 1.10 0.25 -0.25 0.00 0.00 175.29 175.48 1xt9 n THR 183 N -2.97 1.53 -2.55 -0.19 -2.24 -1.26 -4.23 114.28 102.38 1xt9 n THR 183 Ca 0.07 -3.31 -0.33 0.00 -2.27 0.00 0.00 64.05 58.20 1xt9 n THR 183 Cb 0.55 0.58 -0.04 0.00 -2.10 0.00 0.00 70.33 69.32 1xt9 n THR 183 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1xt9 s GLU 184 N -3.64 3.86 -0.35 -0.78 2.56 -1.26 -5.02 118.70 114.07 1xt9 s GLU 184 Ca 0.33 1.26 -0.16 0.00 0.00 0.00 0.00 54.97 56.40 1xt9 s GLU 184 Cb 0.37 -2.11 -0.01 0.00 2.00 0.00 0.00 34.13 34.38 1xt9 s GLU 184 CO -0.02 -0.36 0.41 0.45 -0.56 0.00 0.00 175.26 175.17 1xt9 s SER 185 N -2.19 6.22 0.24 -1.70 0.15 -1.26 -4.95 113.70 110.20 1xt9 s SER 185 Ca 0.65 -0.19 -0.06 0.00 0.70 0.00 0.00 55.95 57.05 1xt9 s SER 185 Cb -0.14 -2.22 0.42 0.00 -1.71 0.00 0.00 66.02 62.37 1xt9 s SER 185 CO 0.21 -0.39 1.70 -0.07 1.20 0.00 0.00 173.24 175.89 1xt9 h LEU 186 N 8.85 0.07 -1.71 3.45 3.38 -1.98 0.35 115.31 127.73 1xt9 h LEU 186 Ca -0.29 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1xt9 h LEU 186 Cb 1.14 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 1xt9 h LEU 186 CO 0.72 0.01 0.08 -0.07 0.09 0.00 0.00 178.44 179.27 1xt9 h LEU 187 N 0.31 0.24 0.14 1.67 3.38 -1.91 0.16 115.31 119.30 1xt9 h LEU 187 Ca 0.39 -0.02 -0.32 0.00 0.09 0.00 0.00 57.88 58.03 1xt9 h LEU 187 Cb 0.63 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1xt9 h LEU 187 CO -0.46 0.22 -1.56 -0.61 0.09 0.00 0.00 178.44 176.12 1xt9 h GLN 188 N 0.28 0.30 0.04 1.13 4.15 -1.23 -3.39 115.11 116.38 1xt9 h GLN 188 Ca 0.07 -0.52 -0.09 0.00 0.77 0.00 0.00 58.65 58.88 1xt9 h GLN 188 Cb 0.06 0.19 0.01 0.00 0.21 0.00 0.00 27.48 27.95 1xt9 h GLN 188 CO -0.01 1.19 -0.37 1.25 -1.93 0.00 0.00 178.83 178.96 1xt9 h LEU 189 N 0.08 0.25 -7.87 -2.39 5.85 0.02 -3.41 115.31 107.85 1xt9 h LEU 189 Ca -0.26 -0.89 -0.68 0.00 0.84 0.00 0.00 57.88 56.89 1xt9 h LEU 189 Cb 2.04 -0.08 -0.08 0.00 0.37 0.00 0.00 40.66 42.91 1xt9 h LEU 189 CO 0.18 1.12 2.16 -0.76 -0.34 0.00 0.00 178.44 180.79 1xt9 s LEU 190 N -8.24 3.84 0.57 2.25 1.43 0.53 -4.81 118.68 114.26 1xt9 s LEU 190 Ca -0.16 -2.40 -0.03 0.00 -1.03 0.00 0.00 54.13 50.51 1xt9 s LEU 190 Cb -0.00 -2.58 0.03 0.00 0.03 0.00 0.00 46.19 43.67 1xt9 s LEU 190 CO 0.76 -1.18 0.84 0.42 0.23 0.00 0.00 176.35 177.42 1xt9 s THR 191 N 4.23 3.13 0.20 5.49 -4.23 -1.26 -4.83 115.64 118.36 1xt9 s THR 191 Ca 0.53 -0.37 -0.10 0.00 -1.18 0.00 0.00 61.69 60.57 1xt9 s THR 191 Cb 0.04 -3.22 0.12 0.00 1.34 0.00 0.00 72.50 70.78 1xt9 s THR 191 CO 0.07 -0.19 1.80 -0.65 -0.54 0.00 0.00 174.62 175.11 1xt9 h PRO 192 N -0.07 0.62 -0.64 3.99 0.11 -1.93 -2.04 132.00 132.04 1xt9 h PRO 192 Ca -0.44 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.64 1xt9 h PRO 192 Cb 1.28 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1xt9 h PRO 192 CO 0.57 0.41 0.42 0.00 -0.21 0.00 0.00 178.00 179.19 1xt9 h ALA 193 N 1.33 0.82 -0.85 -0.75 0.00 -1.97 -1.58 119.26 116.25 1xt9 h ALA 193 Ca 0.28 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.21 1xt9 h ALA 193 Cb 0.17 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 1xt9 h ALA 193 CO -0.17 0.23 0.52 -0.92 0.00 0.00 0.00 179.25 178.91 1xt9 h TYR 194 N 0.86 0.96 -0.18 0.00 3.20 -1.71 -0.89 116.97 119.22 1xt9 h TYR 194 Ca 0.24 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.10 1xt9 h TYR 194 Cb -0.09 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 37.87 1xt9 h TYR 194 CO -0.03 0.48 -0.04 0.82 -1.64 0.00 0.00 178.16 177.75 1xt9 h ILE 195 N 0.95 1.28 0.00 1.81 1.08 -0.74 -2.02 117.51 119.87 1xt9 h ILE 195 Ca 0.37 -0.99 -0.04 0.00 -0.39 0.00 0.00 64.86 63.81 1xt9 h ILE 195 Cb 0.18 1.58 -0.01 0.00 -3.07 0.00 0.00 36.82 35.50 1xt9 h ILE 195 CO -0.18 0.30 -0.20 0.71 -0.69 0.00 0.00 178.15 178.09 1xt9 h THR 196 N 0.05 0.58 -0.41 -0.27 1.35 -1.11 -1.66 112.91 111.45 1xt9 h THR 196 Ca 0.05 -0.95 -0.08 0.00 -0.55 0.00 0.00 66.41 64.88 1xt9 h THR 196 Cb 0.47 1.63 -0.01 0.00 -1.73 0.00 0.00 68.15 68.51 1xt9 h THR 196 CO 0.02 0.20 -0.04 0.50 -0.25 0.00 0.00 175.52 175.94 1xt9 h LYS 197 N 0.00 0.75 0.00 4.72 3.64 -0.95 -2.72 116.57 122.01 1xt9 h LYS 197 Ca -0.00 -0.26 -0.07 0.00 -1.27 0.00 0.00 60.65 59.04 1xt9 h LYS 197 Cb 0.62 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 1xt9 h LYS 197 CO 0.03 0.86 -0.35 0.87 -2.27 0.00 0.00 179.45 178.58 1xt9 h LYS 198 N 0.58 0.00 -0.92 1.90 1.79 -0.81 -1.21 116.57 117.90 1xt9 h LYS 198 Ca 0.11 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.61 1xt9 h LYS 198 Cb 0.55 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.14 1xt9 h LYS 198 CO 0.03 0.35 0.60 0.00 -1.08 0.00 0.00 179.45 179.35 1xt9 h ARG 199 N 0.00 1.13 -0.06 3.15 3.08 -1.00 0.14 114.38 120.82 1xt9 h ARG 199 Ca -0.00 -0.07 -0.23 0.00 0.07 0.00 0.00 59.98 59.75 1xt9 h ARG 199 Cb 0.69 -0.25 0.02 0.00 0.08 0.00 0.00 29.97 30.50 1xt9 h ARG 199 CO 0.05 0.75 -0.87 0.78 -1.07 0.00 0.00 179.97 179.60 1xt9 h GLY 200 N 1.16 0.77 0.99 0.04 0.00 -1.29 -2.37 103.07 102.38 1xt9 h GLY 200 Ca 0.36 -1.24 -0.00 0.00 0.00 0.00 0.00 47.33 46.45 1xt9 h GLY 200 CO -0.12 1.10 0.30 0.83 0.00 0.00 0.00 176.54 178.65 1xt9 h GLU 201 N 0.38 0.67 -0.31 4.80 5.08 -0.76 0.92 114.58 125.36 1xt9 h GLU 201 Ca -0.09 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.14 1xt9 h GLU 201 Cb 1.52 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 30.61 1xt9 h GLU 201 CO 0.17 0.48 -0.10 -1.49 -1.00 0.00 0.00 179.01 177.08 1xt9 h TRP 202 N 0.66 0.54 -0.40 4.33 4.06 -0.78 -0.85 115.95 123.51 1xt9 h TRP 202 Ca 0.18 -0.08 -0.14 0.00 2.06 0.00 0.00 58.89 60.91 1xt9 h TRP 202 Cb -0.02 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 27.98 1xt9 h TRP 202 CO -0.03 0.60 -0.30 -0.22 -3.56 0.00 0.00 178.44 174.93 1xt9 h LYS 203 N 0.47 0.89 -0.30 0.49 3.64 -0.83 -2.36 116.57 118.58 1xt9 h LYS 203 Ca 0.09 -0.42 -0.15 0.00 -1.27 0.00 0.00 60.65 58.90 1xt9 h LYS 203 Cb 0.46 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1xt9 h LYS 203 CO 0.03 1.06 -0.42 -0.44 -2.27 0.00 0.00 179.45 177.41 1xt9 h ASP 204 N 0.75 0.79 0.22 4.20 3.32 -0.50 -2.47 116.42 122.74 1xt9 h ASP 204 Ca 0.08 -0.37 -0.00 0.00 0.02 0.00 0.00 57.03 56.76 1xt9 h ASP 204 Cb 0.87 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.18 1xt9 h ASP 204 CO 0.08 1.10 -0.19 0.25 -1.72 0.00 0.00 179.24 178.77 1xt9 h LEU 205 N 0.60 -0.49 -0.27 1.55 5.85 -1.01 0.26 115.31 121.80 1xt9 h LEU 205 Ca 0.04 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.87 1xt9 h LEU 205 Cb 0.97 0.16 -0.07 0.00 0.37 0.00 0.00 40.66 42.10 1xt9 h LEU 205 CO 0.09 -0.29 -0.20 0.40 -0.34 0.00 0.00 178.44 178.11 1xt9 h ILE 206 N -0.43 0.46 -0.60 4.05 2.04 -1.41 0.24 117.51 121.88 1xt9 h ILE 206 Ca -0.01 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.90 1xt9 h ILE 206 Cb 0.38 0.46 -0.05 0.00 -0.74 0.00 0.00 36.82 36.88 1xt9 h ILE 206 CO -0.02 0.00 0.33 0.71 0.00 0.00 0.00 178.15 179.17 1xt9 h THR 207 N -0.18 0.99 0.25 -0.27 1.35 -1.08 0.21 112.91 114.18 1xt9 h THR 207 Ca 0.15 -0.22 -0.00 0.00 -0.55 0.00 0.00 66.41 65.79 1xt9 h THR 207 Cb 0.40 0.30 -0.01 0.00 -1.73 0.00 0.00 68.15 67.11 1xt9 h THR 207 CO -0.38 0.12 -0.21 0.74 -0.25 0.00 0.00 175.52 175.53 1xt9 h THR 208 N 0.64 0.54 0.00 6.82 2.02 0.55 -1.39 112.91 122.09 1xt9 h THR 208 Ca 0.26 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.44 1xt9 h THR 208 Cb 0.12 0.54 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1xt9 h THR 208 CO -0.15 0.00 -0.01 -0.07 0.37 0.00 0.00 175.52 175.66 1xt9 h LEU 209 N -0.48 0.00 -0.07 2.58 3.38 -0.13 -0.99 115.31 119.60 1xt9 h LEU 209 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1xt9 h LEU 209 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1xt9 h LEU 209 CO -0.03 0.01 0.00 0.00 0.09 0.00 0.00 178.44 178.52 1xt9 n ALA 210 N -2.13 2.22 -0.68 1.53 0.00 0.69 -5.00 120.51 117.14 1xt9 n ALA 210 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1xt9 n ALA 210 Cb 0.13 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.12 1xt9 n ALA 210 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13