#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xdm s LEU 7 N 0.00 2.70 -0.02 0.00 1.43 -1.26 -4.98 118.68 116.55 1xdm s LEU 7 Ca 0.00 -1.32 0.08 0.00 -1.03 0.00 0.00 54.13 51.85 1xdm s LEU 7 Cb 0.00 -1.12 -0.02 0.00 0.03 0.00 0.00 46.19 45.08 1xdm s LEU 7 CO 0.00 -0.85 -0.26 0.42 0.23 0.00 0.00 176.35 175.89 1xdm s THR 8 N -2.75 2.06 0.24 5.49 -4.23 -1.26 -5.04 115.64 110.15 1xdm s THR 8 Ca 0.27 -1.10 -0.16 0.00 -1.18 0.00 0.00 61.69 59.51 1xdm s THR 8 Cb 0.01 -1.71 0.26 0.00 1.34 0.00 0.00 72.50 72.41 1xdm s THR 8 CO 0.16 0.58 1.55 1.67 -0.54 0.00 0.00 174.62 178.04 1xdm n GLN 9 N 2.45 -0.22 0.03 3.99 -0.06 -1.26 0.36 117.38 122.67 1xdm n GLN 9 Ca -0.16 1.54 0.02 0.00 -2.00 0.00 0.00 57.00 56.40 1xdm n GLN 9 Cb 0.51 -2.29 0.37 0.00 -4.06 0.00 0.00 30.24 24.77 1xdm n GLN 9 CO 0.00 0.00 0.00 1.49 -0.20 0.00 0.00 177.06 178.35 1xdm h GLU 10 N 0.00 0.46 0.00 3.69 4.81 -2.01 -1.94 114.58 119.59 1xdm h GLU 10 Ca 0.36 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 1xdm h GLU 10 Cb 0.61 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.91 1xdm h GLU 10 CO -1.00 0.43 0.00 0.94 -0.73 0.00 0.00 179.01 178.65 1xdm n GLN 11 N -4.36 0.20 0.05 1.92 7.27 0.16 -2.46 117.38 120.16 1xdm n GLN 11 Ca 0.02 0.34 -0.20 0.00 0.07 0.00 0.00 57.00 57.22 1xdm n GLN 11 Cb 0.17 -1.82 -0.14 0.00 2.41 0.00 0.00 30.24 30.86 1xdm n GLN 11 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 1xdm h LYS 12 N 0.00 0.39 -0.80 3.69 1.57 -0.61 -3.05 116.57 117.77 1xdm h LYS 12 Ca 0.00 -0.58 0.19 0.00 -1.87 0.00 0.00 60.65 58.39 1xdm h LYS 12 Cb 0.48 0.20 -0.12 0.00 0.08 0.00 0.00 32.23 32.87 1xdm h LYS 12 CO 0.00 1.25 0.20 -0.22 -0.57 0.00 0.00 179.45 180.11 1xdm h LYS 13 N -0.18 0.24 0.30 3.15 3.64 -1.34 1.23 116.57 123.61 1xdm h LYS 13 Ca -0.14 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.21 1xdm h LYS 13 Cb 1.65 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.42 1xdm h LYS 13 CO 0.17 0.16 -0.14 1.49 -2.27 0.00 0.00 179.45 178.86 1xdm h GLU 14 N 0.25 -0.38 -0.82 1.90 4.81 -1.63 0.82 114.58 119.52 1xdm h GLU 14 Ca 0.47 0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.83 1xdm h GLU 14 Cb 0.85 0.09 -0.08 0.00 0.63 0.00 0.00 28.75 30.24 1xdm h GLU 14 CO -0.57 -0.06 0.46 -0.07 -0.73 0.00 0.00 179.01 178.04 1xdm h LEU 15 N -0.77 0.64 0.36 1.64 3.38 -1.15 0.59 115.31 119.99 1xdm h LEU 15 Ca -0.04 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1xdm h LEU 15 Cb 0.50 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1xdm h LEU 15 CO 0.07 0.35 -0.17 -1.28 0.09 0.00 0.00 178.44 177.49 1xdm h SER 16 N 0.75 -0.41 -1.07 -0.43 0.87 0.16 -1.66 113.55 111.75 1xdm h SER 16 Ca 0.41 0.01 0.31 0.00 -1.23 0.00 0.00 61.79 61.29 1xdm h SER 16 Cb 0.42 0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 62.43 1xdm h SER 16 CO -0.27 -0.24 0.77 -0.33 -0.53 0.00 0.00 176.83 176.23 1xdm h GLU 17 N -0.59 0.03 0.02 2.24 5.08 0.99 -1.25 114.58 121.10 1xdm h GLU 17 Ca -0.05 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1xdm h GLU 17 Cb 0.37 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1xdm h GLU 17 CO 0.08 0.02 -0.01 0.82 -1.00 0.00 0.00 179.01 178.92 1xdm h ILE 18 N 0.03 1.45 -0.36 3.13 2.04 0.24 -2.68 117.51 121.36 1xdm h ILE 18 Ca 0.52 -1.81 -0.02 0.00 1.00 0.00 0.00 64.86 64.55 1xdm h ILE 18 Cb 2.01 2.61 -0.02 0.00 -0.74 0.00 0.00 36.82 40.68 1xdm h ILE 18 CO -0.03 0.44 0.14 0.00 0.00 0.00 0.00 178.15 178.70 1xdm h ALA 19 N 0.01 1.57 0.07 1.87 0.00 -0.35 -2.81 119.26 119.62 1xdm h ALA 19 Ca -0.00 -0.11 -0.19 0.00 0.00 0.00 0.00 54.91 54.61 1xdm h ALA 19 Cb 0.75 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 18.40 1xdm h ALA 19 CO 0.00 0.34 -0.78 1.96 0.00 0.00 0.00 179.25 180.78 1xdm h GLN 20 N 0.51 0.40 0.00 0.00 4.20 -1.39 -3.20 115.11 115.62 1xdm h GLN 20 Ca 0.13 -0.53 0.00 0.00 0.06 0.00 0.00 58.65 58.31 1xdm h GLN 20 Cb 0.11 0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.07 1xdm h GLN 20 CO -0.01 1.20 0.00 -1.13 -0.67 0.00 0.00 178.83 178.21 1xdm n SER 21 N -4.12 0.15 0.08 1.46 3.41 -1.01 -1.00 113.62 112.60 1xdm n SER 21 Ca -0.12 0.56 -0.17 0.00 -0.26 0.00 0.00 58.87 58.88 1xdm n SER 21 Cb 0.77 -0.59 -0.14 0.00 -0.26 0.00 0.00 64.21 63.99 1xdm n SER 21 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1xdm h ILE 22 N 0.00 1.27 -2.53 -1.33 2.04 -1.49 -3.39 117.51 112.08 1xdm h ILE 22 Ca 0.00 -2.87 -0.60 0.00 1.00 0.00 0.00 64.86 62.39 1xdm h ILE 22 Cb 0.05 2.84 -0.40 0.00 -0.74 0.00 0.00 36.82 38.57 1xdm h ILE 22 CO 0.00 0.84 -0.79 1.33 0.00 0.00 0.00 178.15 179.53 1xdm n VAL 23 N -3.50 0.45 -0.10 1.67 0.24 -0.17 -3.94 118.33 112.98 1xdm n VAL 23 Ca -0.14 -4.32 -0.21 0.00 -2.04 0.00 0.00 64.34 57.63 1xdm n VAL 23 Cb 1.04 -1.96 -0.07 0.00 -1.47 0.00 0.00 33.84 31.38 1xdm n VAL 23 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xdm n ALA 24 N 1.97 1.57 -3.15 2.33 0.00 -0.89 -4.77 120.51 117.57 1xdm n ALA 24 Ca 0.25 -0.83 -0.31 0.00 0.00 0.00 0.00 53.44 52.55 1xdm n ALA 24 Cb 0.43 0.20 -0.05 0.00 0.00 0.00 0.00 19.45 20.04 1xdm n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1xdm n ASN 25 N -4.01 4.72 -2.54 0.00 5.03 -1.26 -4.77 115.26 112.42 1xdm n ASN 25 Ca -0.38 -3.54 -0.17 0.00 0.87 0.00 0.00 54.58 51.37 1xdm n ASN 25 Cb 0.75 -0.77 -0.00 0.00 -1.02 0.00 0.00 39.78 38.73 1xdm n ASN 25 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1xdm n GLY 26 N 0.52 -0.50 3.89 7.41 0.00 -1.26 -4.93 105.19 110.31 1xdm n GLY 26 Ca 0.31 0.02 -0.30 0.00 0.00 0.00 0.00 46.02 46.04 1xdm n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xdm s LYS 27 N -5.15 3.70 0.00 1.61 1.02 -1.26 -4.54 119.74 115.12 1xdm s LYS 27 Ca 0.05 0.12 0.00 0.00 0.02 0.00 0.00 55.97 56.16 1xdm s LYS 27 Cb -0.02 -2.66 0.00 0.00 -0.52 0.00 0.00 37.83 34.62 1xdm s LYS 27 CO 0.06 0.28 0.00 0.41 -0.92 0.00 0.00 175.35 175.18 1xdm n GLY 28 N -0.49 6.45 3.08 -3.33 0.00 0.95 -4.36 105.19 107.49 1xdm n GLY 28 Ca -0.01 -2.08 -0.24 0.00 0.00 0.00 0.00 46.02 43.70 1xdm n GLY 28 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xdm s ILE 29 N 0.58 1.19 -0.09 -0.61 1.01 -0.42 -1.26 121.20 121.60 1xdm s ILE 29 Ca 0.00 -0.58 -0.11 0.00 0.00 0.00 0.00 60.65 59.96 1xdm s ILE 29 Cb 0.00 -1.04 -0.05 0.00 0.01 0.00 0.00 42.46 41.39 1xdm s ILE 29 CO 0.00 0.35 0.26 -0.22 0.00 0.00 0.00 174.94 175.33 1xdm s LEU 30 N 0.12 4.38 -1.11 2.97 2.96 -0.44 -2.75 118.68 124.81 1xdm s LEU 30 Ca -0.04 0.62 -0.05 0.00 -0.22 0.00 0.00 54.13 54.44 1xdm s LEU 30 Cb -0.11 -2.30 0.29 0.00 0.50 0.00 0.00 46.19 44.57 1xdm s LEU 30 CO 0.02 0.30 1.47 0.00 -1.32 0.00 0.00 176.35 176.82 1xdm n ALA 31 N 2.36 5.06 -1.04 5.97 0.00 -0.06 -0.74 120.51 132.06 1xdm n ALA 31 Ca -0.16 -4.74 -0.25 0.00 0.00 0.00 0.00 53.44 48.29 1xdm n ALA 31 Cb 0.53 -2.43 0.10 0.00 0.00 0.00 0.00 19.45 17.65 1xdm n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xdm n ALA 32 N 1.79 5.58 -1.24 0.00 0.00 -0.94 -4.27 120.51 121.42 1xdm n ALA 32 Ca 0.27 -2.68 0.00 0.00 0.00 0.00 0.00 53.44 51.03 1xdm n ALA 32 Cb 0.34 -1.53 0.22 0.00 0.00 0.00 0.00 19.45 18.49 1xdm n ALA 32 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1xdm n ASP 33 N -0.65 3.16 -4.63 0.00 3.85 -1.21 -3.34 116.55 113.74 1xdm n ASP 33 Ca 0.51 -3.44 -0.43 0.00 -0.71 0.00 0.00 54.79 50.73 1xdm n ASP 33 Cb 0.98 -0.61 -0.03 0.00 -1.35 0.00 0.00 41.12 40.12 1xdm n ASP 33 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1xdm s GLU 34 N -3.07 3.58 0.73 0.11 8.01 -1.26 -4.63 118.70 122.18 1xdm s GLU 34 Ca 0.44 2.18 -0.17 0.00 0.01 0.00 0.00 54.97 57.43 1xdm s GLU 34 Cb 0.38 -4.25 -0.09 0.00 -4.31 0.00 0.00 34.13 25.86 1xdm s GLU 34 CO 0.04 -1.58 0.02 -1.13 0.01 0.00 0.00 175.26 172.62 1xdm n SER 35 N 9.76 -3.08 -0.34 -0.19 3.41 -1.26 -4.12 113.62 117.79 1xdm n SER 35 Ca 0.25 0.50 -0.06 0.00 -0.26 0.00 0.00 58.87 59.30 1xdm n SER 35 Cb 0.44 -1.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.35 1xdm n SER 35 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1xdm n VAL 36 N -2.21 -0.52 0.20 -3.33 0.31 -1.26 -0.86 118.33 110.66 1xdm n VAL 36 Ca 0.06 2.03 -0.15 0.00 -0.01 0.00 0.00 64.34 66.28 1xdm n VAL 36 Cb 0.51 -2.58 -0.08 0.00 -0.91 0.00 0.00 33.84 30.77 1xdm n VAL 36 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1xdm h GLY 37 N 0.00 -0.49 0.00 2.92 0.00 -2.02 -3.21 103.07 100.27 1xdm h GLY 37 Ca 0.21 0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.72 1xdm h GLY 37 CO -0.82 -0.18 0.00 2.41 0.00 0.00 0.00 176.54 177.95 1xdm n THR 38 N -5.25 0.00 -0.25 4.70 -1.04 -0.04 -0.24 114.28 112.17 1xdm n THR 38 Ca -0.10 1.20 0.10 0.00 -2.04 0.00 0.00 64.05 63.21 1xdm n THR 38 Cb 0.23 -1.65 0.20 0.00 -1.82 0.00 0.00 70.33 67.30 1xdm n THR 38 CO 0.00 0.00 0.00 0.80 -0.64 0.00 0.00 175.07 175.23 1xdm n MET 39 N -2.32 -0.06 -0.23 -2.82 1.56 -0.70 -0.23 117.12 112.33 1xdm n MET 39 Ca 0.00 1.09 0.02 0.00 -0.27 0.00 0.00 57.70 58.54 1xdm n MET 39 Cb 0.00 -1.72 0.11 0.00 2.15 0.00 0.00 33.22 33.76 1xdm n MET 39 CO 0.00 0.00 0.00 0.78 -0.73 0.00 0.00 175.97 176.02 1xdm h GLY 40 N 0.00 0.64 1.80 -5.12 0.00 -0.61 0.72 103.07 100.49 1xdm h GLY 40 Ca 0.43 0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.91 1xdm h GLY 40 CO -0.69 -0.25 0.00 0.70 0.00 0.00 0.00 176.54 176.30 1xdm n ASN 41 N -5.37 0.00 0.07 0.19 3.02 0.69 -1.29 115.26 112.56 1xdm n ASN 41 Ca 0.10 0.27 -0.22 0.00 -0.03 0.00 0.00 54.58 54.69 1xdm n ASN 41 Cb 0.39 -0.40 -0.15 0.00 -0.61 0.00 0.00 39.78 39.01 1xdm n ASN 41 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1xdm h ARG 42 N 0.00 0.38 -0.00 3.52 2.47 0.50 -3.14 114.38 118.10 1xdm h ARG 42 Ca 0.00 -0.65 0.00 0.00 -1.26 0.00 0.00 59.98 58.07 1xdm h ARG 42 Cb 0.26 0.24 0.00 0.00 -1.65 0.00 0.00 29.97 28.82 1xdm h ARG 42 CO 0.00 1.30 -0.01 1.28 0.56 0.00 0.00 179.97 183.10 1xdm n LEU 43 N -3.58 0.31 0.07 3.04 4.77 -0.28 -3.26 117.00 118.07 1xdm n LEU 43 Ca -0.24 -0.06 -0.09 0.00 -0.03 0.00 0.00 56.01 55.59 1xdm n LEU 43 Cb 1.07 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 42.06 1xdm n LEU 43 CO 0.51 0.05 0.30 -0.61 -1.33 0.00 0.00 177.39 176.31 1xdm h GLN 44 N 0.47 -0.26 -0.71 3.23 5.75 -1.14 0.32 115.11 122.77 1xdm h GLN 44 Ca 0.00 0.02 0.15 0.00 -0.15 0.00 0.00 58.65 58.67 1xdm h GLN 44 Cb 0.14 0.06 -0.11 0.00 1.07 0.00 0.00 27.48 28.64 1xdm h GLN 44 CO 0.00 0.08 0.13 0.00 -2.65 0.00 0.00 178.83 176.38 1xdm h ARG 45 N -0.96 0.22 0.00 1.69 -0.00 -1.58 0.45 114.38 114.19 1xdm h ARG 45 Ca -0.03 -0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.44 1xdm h ARG 45 Cb 0.45 -0.05 0.00 0.00 0.00 0.00 0.00 29.97 30.38 1xdm h ARG 45 CO 0.04 0.14 0.00 0.44 0.00 0.00 0.00 179.97 180.60 1xdm n ILE 46 N -5.20 0.01 -2.81 2.04 -5.35 -1.25 -4.93 119.36 101.87 1xdm n ILE 46 Ca 0.13 0.00 -0.07 0.00 -0.27 0.00 0.00 62.75 62.54 1xdm n ILE 46 Cb 0.43 -0.51 0.03 0.00 -1.74 0.00 0.00 39.64 37.86 1xdm n ILE 46 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1xdm n LYS 47 N -1.14 -1.49 -4.18 6.28 5.02 0.16 -4.91 118.16 117.90 1xdm n LYS 47 Ca 0.19 0.90 -0.12 0.00 -2.02 0.00 0.00 58.31 57.26 1xdm n LYS 47 Cb 0.17 -4.86 -0.10 0.00 -0.02 0.00 0.00 35.03 30.22 1xdm n LYS 47 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1xdm s VAL 48 N -3.19 0.85 0.42 -0.18 1.01 0.11 -5.02 120.40 114.39 1xdm s VAL 48 Ca 0.23 -1.85 -0.17 0.00 0.00 0.00 0.00 61.98 60.19 1xdm s VAL 48 Cb -0.03 -1.59 -0.09 0.00 0.00 0.00 0.00 36.38 34.67 1xdm s VAL 48 CO 0.58 -0.75 0.87 -1.61 0.00 0.00 0.00 175.10 174.19 1xdm s GLU 49 N -3.46 4.03 -0.42 2.72 0.41 -1.26 -4.37 118.70 116.35 1xdm s GLU 49 Ca 0.10 0.85 -0.24 0.00 -0.41 0.00 0.00 54.97 55.28 1xdm s GLU 49 Cb 0.02 -2.27 0.02 0.00 -1.78 0.00 0.00 34.13 30.12 1xdm s GLU 49 CO -0.02 -0.04 0.83 1.21 -0.49 0.00 0.00 175.26 176.75 1xdm s ASN 50 N -2.58 6.50 0.10 -0.19 3.04 -1.26 -4.83 114.94 115.72 1xdm s ASN 50 Ca 0.57 0.15 0.07 0.00 0.04 0.00 0.00 52.86 53.69 1xdm s ASN 50 Cb -0.10 -2.41 -0.03 0.00 -1.54 0.00 0.00 41.25 37.17 1xdm s ASN 50 CO 0.22 -0.89 -0.17 -0.89 -3.04 0.00 0.00 177.10 172.33 1xdm s THR 51 N 3.38 1.41 -1.30 -5.21 2.01 -1.26 -4.96 115.64 109.70 1xdm s THR 51 Ca 0.33 -1.53 0.08 0.00 0.31 0.00 0.00 61.69 60.88 1xdm s THR 51 Cb -0.12 -1.39 0.11 0.00 0.01 0.00 0.00 72.50 71.11 1xdm s THR 51 CO 0.22 -0.23 1.15 1.21 -0.69 0.00 0.00 174.62 176.28 1xdm n GLU 52 N 0.96 0.08 -0.08 4.92 0.00 -1.26 -2.70 120.64 122.56 1xdm n GLU 52 Ca -0.19 0.26 -0.10 0.00 0.00 0.00 0.00 57.16 57.13 1xdm n GLU 52 Cb 0.55 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.45 1xdm n GLU 52 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1xdm n GLU 53 N -1.35 0.47 -0.31 5.31 4.07 -1.26 -4.18 120.64 123.39 1xdm n GLU 53 Ca 0.03 0.19 -0.01 0.00 -0.06 0.00 0.00 57.16 57.30 1xdm n GLU 53 Cb 0.07 -1.31 0.04 0.00 -0.06 0.00 0.00 31.44 30.18 1xdm n GLU 53 CO 0.00 0.00 0.00 -0.91 -0.06 0.00 0.00 177.13 176.16 1xdm h ASN 54 N -0.86 -1.23 0.03 4.31 2.35 -1.84 0.30 115.58 118.63 1xdm h ASN 54 Ca -0.08 0.27 0.01 0.00 -0.55 0.00 0.00 56.30 55.95 1xdm h ASN 54 Cb 0.96 0.66 -0.04 0.00 0.05 0.00 0.00 38.32 39.95 1xdm h ASN 54 CO -0.05 -0.29 -0.37 0.03 -1.65 0.00 0.00 177.43 175.09 1xdm h ARG 55 N -0.06 -0.47 -0.73 0.81 3.08 -1.77 -0.09 114.38 115.16 1xdm h ARG 55 Ca 0.32 0.03 0.15 0.00 0.07 0.00 0.00 59.98 60.56 1xdm h ARG 55 Cb 0.59 0.11 -0.13 0.00 0.08 0.00 0.00 29.97 30.61 1xdm h ARG 55 CO -0.87 -0.31 -0.11 -0.09 -1.07 0.00 0.00 179.97 177.52 1xdm h ARG 56 N -0.49 0.04 0.60 0.04 2.43 -1.22 -1.51 114.38 114.26 1xdm h ARG 56 Ca 0.00 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 1xdm h ARG 56 Cb 0.51 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.06 1xdm h ARG 56 CO -0.23 0.02 -0.29 1.96 -1.51 0.00 0.00 179.97 179.92 1xdm h GLN 57 N 0.04 -0.77 -0.94 0.20 4.20 0.21 0.76 115.11 118.80 1xdm h GLN 57 Ca 0.37 0.05 0.26 0.00 0.06 0.00 0.00 58.65 59.39 1xdm h GLN 57 Cb 0.60 0.18 -0.14 0.00 0.30 0.00 0.00 27.48 28.42 1xdm h GLN 57 CO -0.71 -0.51 0.45 0.35 -0.67 0.00 0.00 178.83 177.74 1xdm h PHE 58 N -0.82 0.73 0.00 2.96 3.57 -0.87 0.71 116.94 123.22 1xdm h PHE 58 Ca -0.08 0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.37 1xdm h PHE 58 Cb 0.61 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 1xdm h PHE 58 CO 0.09 -0.10 -0.40 0.00 -2.23 0.00 0.00 178.31 175.66 1xdm h ARG 59 N 0.36 0.00 -0.36 1.11 3.08 -1.01 -2.47 114.38 115.09 1xdm h ARG 59 Ca 0.63 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.58 1xdm h ARG 59 Cb 1.29 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.32 1xdm h ARG 59 CO -0.57 0.40 -0.19 1.49 -1.07 0.00 0.00 179.97 180.03 1xdm h GLU 60 N 0.00 0.68 0.29 0.04 4.81 0.68 -2.33 114.58 118.74 1xdm h GLU 60 Ca -0.00 -0.25 -0.01 0.00 -0.13 0.00 0.00 59.36 58.97 1xdm h GLU 60 Cb 0.93 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.26 1xdm h GLU 60 CO 0.05 0.82 -0.20 0.82 -0.73 0.00 0.00 179.01 179.77 1xdm h ILE 61 N 0.60 0.57 0.16 2.32 2.04 -0.78 -2.36 117.51 120.08 1xdm h ILE 61 Ca 0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.95 1xdm h ILE 61 Cb 0.65 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1xdm h ILE 61 CO 0.05 0.00 -0.14 -0.07 0.00 0.00 0.00 178.15 177.99 1xdm h LEU 62 N -0.48 -0.36 -1.83 1.44 3.38 -1.40 -3.01 115.31 113.04 1xdm h LEU 62 Ca -0.02 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1xdm h LEU 62 Cb 0.41 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1xdm h LEU 62 CO 0.01 -0.22 0.00 -0.26 0.09 0.00 0.00 178.44 178.06 1xdm h PHE 63 N -0.32 0.00 0.00 1.13 0.05 -1.42 -2.92 116.94 113.47 1xdm h PHE 63 Ca -0.00 0.00 -0.01 0.00 3.82 0.00 0.00 57.97 61.77 1xdm h PHE 63 Cb 0.29 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 38.24 1xdm h PHE 63 CO -0.12 0.00 -0.86 0.66 -0.18 0.00 0.00 178.31 177.82 1xdm h SER 64 N 0.00 0.00 -2.03 2.17 4.64 -1.30 -3.44 113.55 113.59 1xdm h SER 64 Ca 0.00 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.73 1xdm h SER 64 Cb 0.34 0.00 0.20 0.00 -0.31 0.00 0.00 62.40 62.63 1xdm h SER 64 CO 0.00 0.05 -1.33 0.55 -0.87 0.00 0.00 176.83 175.23 1xdm n VAL 65 N -2.78 0.05 -0.96 0.95 3.14 -1.10 -4.77 118.33 112.86 1xdm n VAL 65 Ca -0.00 -0.50 -0.32 0.00 -2.96 0.00 0.00 64.34 60.57 1xdm n VAL 65 Cb 0.57 -0.02 -0.01 0.00 -1.06 0.00 0.00 33.84 33.33 1xdm n VAL 65 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1xdm n ASP 66 N 2.71 -1.77 0.00 6.55 10.43 -1.26 -4.70 116.55 128.50 1xdm n ASP 66 Ca 0.05 0.65 0.03 0.00 2.57 0.00 0.00 54.79 58.10 1xdm n ASP 66 Cb 0.50 -0.65 0.18 0.00 1.84 0.00 0.00 41.12 42.98 1xdm n ASP 66 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 1xdm n SER 67 N 1.63 0.00 0.18 -2.24 3.41 -1.26 -1.82 113.62 113.52 1xdm n SER 67 Ca 0.09 -0.24 0.05 0.00 -0.26 0.00 0.00 58.87 58.51 1xdm n SER 67 Cb 0.26 0.00 0.29 0.00 -0.26 0.00 0.00 64.21 64.50 1xdm n SER 67 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1xdm h SER 68 N 0.00 0.00 -0.40 4.04 4.64 -1.97 -2.64 113.55 117.21 1xdm h SER 68 Ca 0.00 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.44 1xdm h SER 68 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1xdm h SER 68 CO 0.00 0.41 0.36 -0.29 -0.87 0.00 0.00 176.83 176.44 1xdm h ILE 69 N 0.00 0.54 0.00 0.95 6.09 -1.66 0.46 117.51 123.89 1xdm h ILE 69 Ca -0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1xdm h ILE 69 Cb 0.96 0.73 0.00 0.00 0.47 0.00 0.00 36.82 38.98 1xdm h ILE 69 CO 0.05 0.00 0.00 -0.46 -3.07 0.00 0.00 178.15 174.67 1xdm n ASN 70 N -3.99 0.00 -0.27 2.19 0.23 -1.00 -0.88 115.26 111.54 1xdm n ASN 70 Ca 0.07 -0.65 0.07 0.00 -0.53 0.00 0.00 54.58 53.54 1xdm n ASN 70 Cb 0.54 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 38.23 1xdm n ASN 70 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1xdm n GLN 71 N -0.70 1.91 -0.01 -3.83 6.02 0.15 -4.65 117.38 116.27 1xdm n GLN 71 Ca 0.04 -0.62 -0.02 0.00 -0.01 0.00 0.00 57.00 56.39 1xdm n GLN 71 Cb 0.02 -1.21 -0.01 0.00 1.02 0.00 0.00 30.24 30.06 1xdm n GLN 71 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1xdm n SER 72 N -0.36 2.23 -4.22 1.08 7.64 -0.06 -4.73 113.62 115.20 1xdm n SER 72 Ca 0.05 0.01 -0.40 0.00 1.01 0.00 0.00 58.87 59.54 1xdm n SER 72 Cb 0.29 -0.05 -0.10 0.00 -1.01 0.00 0.00 64.21 63.34 1xdm n SER 72 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1xdm s ILE 73 N -2.04 4.02 -2.30 0.44 -1.09 -0.54 -0.04 121.20 119.65 1xdm s ILE 73 Ca -0.03 -1.61 0.22 0.00 -2.23 0.00 0.00 60.65 56.99 1xdm s ILE 73 Cb 0.01 -3.55 0.47 0.00 -1.58 0.00 0.00 42.46 37.80 1xdm s ILE 73 CO 0.05 -0.60 1.57 0.61 -1.23 0.00 0.00 174.94 175.34 1xdm n GLY 74 N 4.85 0.27 3.64 6.18 0.00 -0.39 -4.58 105.19 115.17 1xdm n GLY 74 Ca -0.08 -0.43 -0.05 0.00 0.00 0.00 0.00 46.02 45.46 1xdm n GLY 74 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xdm s GLY 75 N -1.61 -0.14 -0.12 -0.02 0.00 -1.11 -3.10 107.32 101.22 1xdm s GLY 75 Ca 0.33 2.91 0.03 0.00 0.00 0.00 0.00 44.72 47.99 1xdm s GLY 75 CO 0.27 2.39 -0.22 0.14 0.00 0.00 0.00 173.10 175.68 1xdm s VAL 76 N 1.13 2.16 0.02 1.40 1.01 0.18 -1.33 120.40 124.97 1xdm s VAL 76 Ca -0.06 -0.97 -0.20 0.00 0.00 0.00 0.00 61.98 60.74 1xdm s VAL 76 Cb -0.04 -1.84 -0.06 0.00 0.00 0.00 0.00 36.38 34.44 1xdm s VAL 76 CO -0.14 0.55 0.59 -0.63 0.00 0.00 0.00 175.10 175.47 1xdm s ILE 77 N 0.49 4.85 0.26 2.22 1.01 0.08 0.11 121.20 130.23 1xdm s ILE 77 Ca -0.14 1.24 0.11 0.00 0.00 0.00 0.00 60.65 61.85 1xdm s ILE 77 Cb -0.17 -3.92 -0.05 0.00 0.01 0.00 0.00 42.46 38.33 1xdm s ILE 77 CO 0.05 0.47 -0.18 -0.76 0.00 0.00 0.00 174.94 174.52 1xdm s LEU 78 N -0.51 2.58 0.12 2.97 1.43 0.38 -2.22 118.68 123.45 1xdm s LEU 78 Ca 0.30 -1.04 -0.12 0.00 -1.03 0.00 0.00 54.13 52.24 1xdm s LEU 78 Cb -0.19 -0.97 -0.06 0.00 0.03 0.00 0.00 46.19 45.00 1xdm s LEU 78 CO 0.18 -0.04 0.49 0.12 0.23 0.00 0.00 176.35 177.33 1xdm s PHE 79 N -2.65 3.59 0.16 0.29 5.36 -1.21 -1.95 117.98 121.57 1xdm s PHE 79 Ca 0.28 0.94 -0.09 0.00 -0.96 0.00 0.00 56.93 57.10 1xdm s PHE 79 Cb -0.03 -2.28 0.22 0.00 -0.34 0.00 0.00 43.02 40.58 1xdm s PHE 79 CO 0.13 0.46 1.00 1.58 -1.46 0.00 0.00 175.22 176.93 1xdm n HIS 80 N 0.81 0.11 0.21 10.12 -0.00 -1.26 -1.51 115.22 123.70 1xdm n HIS 80 Ca -0.06 0.79 -0.08 0.00 -0.00 0.00 0.00 57.72 58.37 1xdm n HIS 80 Cb 0.52 -0.80 -0.04 0.00 -0.00 0.00 0.00 29.99 29.67 1xdm n HIS 80 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.34 177.83 1xdm h GLU 81 N 0.00 -0.52 -1.10 1.57 4.81 -1.98 -3.28 114.58 114.07 1xdm h GLU 81 Ca 0.26 0.04 0.30 0.00 -0.13 0.00 0.00 59.36 59.83 1xdm h GLU 81 Cb 0.42 0.12 -0.08 0.00 0.63 0.00 0.00 28.75 29.84 1xdm h GLU 81 CO -0.65 -0.35 0.74 1.15 -0.73 0.00 0.00 179.01 179.17 1xdm h THR 82 N -0.55 0.46 -0.98 0.32 2.02 -1.67 -1.90 112.91 110.61 1xdm h THR 82 Ca -0.06 -0.08 0.25 0.00 0.77 0.00 0.00 66.41 67.29 1xdm h THR 82 Cb 0.42 0.19 -0.07 0.00 -1.74 0.00 0.00 68.15 66.95 1xdm h THR 82 CO 0.09 0.04 0.66 0.25 0.37 0.00 0.00 175.52 176.94 1xdm h LEU 83 N 0.25 0.30 -1.90 2.58 5.85 -1.42 0.39 115.31 121.35 1xdm h LEU 83 Ca 0.60 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.36 1xdm h LEU 83 Cb 1.81 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.84 1xdm h LEU 83 CO -0.21 0.09 0.00 -1.22 -0.34 0.00 0.00 178.44 176.75 1xdm n TYR 84 N -4.47 0.06 -1.58 1.25 4.02 -0.72 -4.33 117.16 111.39 1xdm n TYR 84 Ca 0.22 -0.03 -0.30 0.00 -0.01 0.00 0.00 57.90 57.78 1xdm n TYR 84 Cb 0.87 0.00 0.22 0.00 -0.02 0.00 0.00 39.34 40.41 1xdm n TYR 84 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 1xdm s GLN 85 N -1.94 -0.28 0.14 -0.72 -0.21 0.12 -4.94 119.66 111.83 1xdm s GLN 85 Ca 0.30 -0.33 -0.12 0.00 0.02 0.00 0.00 55.36 55.23 1xdm s GLN 85 Cb 0.20 -1.73 0.01 0.00 1.00 0.00 0.00 33.01 32.49 1xdm s GLN 85 CO 0.30 -3.04 0.32 0.15 -2.12 0.00 0.00 175.29 170.90 1xdm s LYS 86 N -5.73 1.09 0.47 2.91 1.02 -1.26 -2.50 119.74 115.73 1xdm s LYS 86 Ca 0.74 -0.97 -0.07 0.00 0.02 0.00 0.00 55.97 55.68 1xdm s LYS 86 Cb -0.05 0.41 0.11 0.00 -0.52 0.00 0.00 37.83 37.77 1xdm s LYS 86 CO 0.54 -0.40 0.65 -0.40 -0.92 0.00 0.00 175.35 174.81 1xdm n ASP 87 N -0.19 0.15 0.27 2.83 3.85 -0.28 -4.88 116.55 118.30 1xdm n ASP 87 Ca -0.12 -1.30 -0.13 0.00 -0.71 0.00 0.00 54.79 52.53 1xdm n ASP 87 Cb 0.63 -0.48 -0.07 0.00 -1.35 0.00 0.00 41.12 39.85 1xdm n ASP 87 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.20 176.47 1xdm h SER 88 N -0.79 -0.88 0.00 -1.12 0.02 -1.98 -2.76 113.55 106.04 1xdm h SER 88 Ca -0.21 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 1xdm h SER 88 Cb 0.60 0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1xdm h SER 88 CO 0.16 -0.50 0.00 0.00 -1.14 0.00 0.00 176.83 175.35 1xdm n GLN 89 N -4.48 0.00 -3.25 3.45 6.02 -1.26 -4.68 117.38 113.17 1xdm n GLN 89 Ca -0.10 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 56.66 1xdm n GLN 89 Cb 0.34 -1.09 0.04 0.00 1.02 0.00 0.00 30.24 30.55 1xdm n GLN 89 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xdm n GLY 90 N 0.60 -0.53 3.70 1.08 0.00 -1.04 -5.01 105.19 103.99 1xdm n GLY 90 Ca 0.00 0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1xdm n GLY 90 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xdm s LYS 91 N -5.94 2.62 -0.36 1.61 2.47 -1.26 -4.90 119.74 113.98 1xdm s LYS 91 Ca 0.41 -0.80 -0.29 0.00 -1.56 0.00 0.00 55.97 53.73 1xdm s LYS 91 Cb -0.18 -2.58 0.02 0.00 -1.46 0.00 0.00 37.83 33.62 1xdm s LYS 91 CO 0.50 0.55 1.17 -0.51 0.16 0.00 0.00 175.35 177.22 1xdm s LEU 92 N -2.27 3.82 0.44 5.43 1.43 -1.26 -1.13 118.68 125.15 1xdm s LEU 92 Ca 0.26 0.93 0.35 0.00 -1.03 0.00 0.00 54.13 54.64 1xdm s LEU 92 Cb -0.12 -3.54 1.46 0.00 0.03 0.00 0.00 46.19 44.02 1xdm s LEU 92 CO 0.18 -1.06 1.45 0.49 0.23 0.00 0.00 176.35 177.65 1xdm n PHE 93 N 7.42 0.45 -0.21 0.29 3.72 -1.04 0.12 117.46 128.21 1xdm n PHE 93 Ca 0.13 0.46 -0.07 0.00 -0.05 0.00 0.00 57.45 57.92 1xdm n PHE 93 Cb 0.47 -0.90 0.03 0.00 -0.94 0.00 0.00 39.48 38.15 1xdm n PHE 93 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1xdm h ARG 94 N 0.00 0.85 0.00 -1.08 2.43 -1.81 -3.19 114.38 111.58 1xdm h ARG 94 Ca 0.84 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 59.78 1xdm h ARG 94 Cb 2.92 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 32.29 1xdm h ARG 94 CO -0.30 0.66 -1.06 -0.91 -1.51 0.00 0.00 179.97 176.84 1xdm h ASN 95 N 0.82 0.00 -0.93 -3.80 2.35 0.52 -2.98 115.58 111.55 1xdm h ASN 95 Ca 0.21 0.00 0.09 0.00 -0.55 0.00 0.00 56.30 56.05 1xdm h ASN 95 Cb 0.06 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.36 1xdm h ASN 95 CO -0.03 0.47 0.58 0.40 -1.65 0.00 0.00 177.43 177.19 1xdm h ILE 96 N 0.00 0.98 0.00 2.81 2.04 -1.39 0.30 117.51 122.25 1xdm h ILE 96 Ca -0.09 -0.34 -0.06 0.00 1.00 0.00 0.00 64.86 65.37 1xdm h ILE 96 Cb 1.44 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 1xdm h ILE 96 CO 0.04 0.18 -0.30 -0.07 0.00 0.00 0.00 178.15 178.00 1xdm h LEU 97 N 0.98 0.00 -0.74 1.44 3.38 -1.63 -1.71 115.31 117.02 1xdm h LEU 97 Ca 0.43 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.27 1xdm h LEU 97 Cb 0.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1xdm h LEU 97 CO -0.22 0.30 -0.57 0.11 0.09 0.00 0.00 178.44 178.15 1xdm h LYS 98 N 0.00 0.17 0.09 1.13 1.79 -0.83 -1.77 116.57 117.15 1xdm h LYS 98 Ca -0.00 -0.11 -0.00 0.00 -2.18 0.00 0.00 60.65 58.35 1xdm h LYS 98 Cb 1.15 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.82 1xdm h LYS 98 CO 0.04 0.69 -0.04 0.93 -1.08 0.00 0.00 179.45 179.99 1xdm h GLU 99 N 0.13 -0.11 -2.04 3.15 3.07 -1.12 -3.34 114.58 114.32 1xdm h GLU 99 Ca -0.00 0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1xdm h GLU 99 Cb 1.05 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.98 1xdm h GLU 99 CO 0.08 0.37 0.02 1.63 -1.40 0.00 0.00 179.01 179.71 1xdm n LYS 100 N -4.81 0.21 -2.86 2.33 5.02 -0.65 -4.66 118.16 112.73 1xdm n LYS 100 Ca -0.07 -0.01 -0.12 0.00 -2.02 0.00 0.00 58.31 56.09 1xdm n LYS 100 Cb 0.26 -1.41 -0.02 0.00 -0.02 0.00 0.00 35.03 33.84 1xdm n LYS 100 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xdm n GLY 101 N 1.95 -0.40 3.61 0.72 0.00 -1.25 -4.55 105.19 105.28 1xdm n GLY 101 Ca 0.00 0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1xdm n GLY 101 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xdm s ILE 102 N -2.13 3.52 -0.09 -0.61 1.01 -0.67 -4.87 121.20 117.37 1xdm s ILE 102 Ca 0.24 -1.31 -0.02 0.00 0.00 0.00 0.00 60.65 59.56 1xdm s ILE 102 Cb -0.14 -2.69 -0.03 0.00 0.01 0.00 0.00 42.46 39.60 1xdm s ILE 102 CO 0.30 0.04 0.01 0.54 0.00 0.00 0.00 174.94 175.83 1xdm s VAL 103 N -1.40 4.41 0.01 2.92 0.11 -1.18 -4.19 120.40 121.07 1xdm s VAL 103 Ca 0.24 -0.21 -0.18 0.00 -2.93 0.00 0.00 61.98 58.89 1xdm s VAL 103 Cb -0.10 -2.86 -0.06 0.00 -1.53 0.00 0.00 36.38 31.83 1xdm s VAL 103 CO 0.16 0.60 0.53 -0.69 -3.33 0.00 0.00 175.10 172.37 1xdm s VAL 104 N -0.87 4.92 0.05 2.04 1.01 -1.26 0.49 120.40 126.77 1xdm s VAL 104 Ca 0.13 1.10 0.08 0.00 0.00 0.00 0.00 61.98 63.29 1xdm s VAL 104 Cb -0.11 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 1xdm s VAL 104 CO 0.02 0.49 -0.22 -0.83 0.00 0.00 0.00 175.10 174.56 1xdm s GLY 105 N -0.57 1.21 -0.18 4.51 0.00 0.30 -2.51 107.32 110.09 1xdm s GLY 105 Ca 0.28 -1.13 0.01 0.00 0.00 0.00 0.00 44.72 43.87 1xdm s GLY 105 CO 0.16 -1.05 -0.11 -1.50 0.00 0.00 0.00 173.10 170.60 1xdm s ILE 106 N -0.82 1.54 0.08 0.90 1.10 -0.66 0.15 121.20 123.49 1xdm s ILE 106 Ca 0.09 -0.84 -0.33 0.00 -0.51 0.00 0.00 60.65 59.06 1xdm s ILE 106 Cb -0.09 -1.58 -0.12 0.00 0.15 0.00 0.00 42.46 40.82 1xdm s ILE 106 CO 0.02 0.25 1.77 1.17 -2.11 0.00 0.00 174.94 176.04 1xdm n LYS 107 N 4.74 2.43 -2.53 3.50 4.81 -0.82 -3.45 118.16 126.84 1xdm n LYS 107 Ca -0.15 0.88 -0.40 0.00 -0.87 0.00 0.00 58.31 57.77 1xdm n LYS 107 Cb 0.48 -2.73 0.02 0.00 0.02 0.00 0.00 35.03 32.82 1xdm n LYS 107 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1xdm n LEU 108 N 5.19 7.25 0.00 3.14 4.77 -1.23 -4.56 117.00 131.55 1xdm n LEU 108 Ca 0.19 -5.31 0.00 0.00 -0.03 0.00 0.00 56.01 50.86 1xdm n LEU 108 Cb 0.33 -1.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.30 1xdm n LEU 108 CO 0.67 2.02 0.00 -0.90 -1.33 0.00 0.00 177.39 177.85 1xdm n ASP 109 N -0.15 0.00 0.04 -1.43 5.75 -1.26 -4.88 116.55 114.61 1xdm n ASP 109 Ca 0.47 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.25 1xdm n ASP 109 Cb 0.26 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.35 1xdm n ASP 109 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 1xdm n LEU 130 N 0.00 -0.28 -0.56 -2.12 7.94 -1.26 -5.02 117.00 115.69 1xdm n LEU 130 Ca 0.00 0.13 0.45 0.00 -1.11 0.00 0.00 56.01 55.48 1xdm n LEU 130 Cb 0.00 0.41 0.74 0.00 0.53 0.00 0.00 43.42 45.10 1xdm n LEU 130 CO 0.00 -0.49 1.36 -1.28 -1.11 0.00 0.00 177.39 175.86 1xdm h SER 131 N 0.00 0.11 0.86 1.96 0.87 -1.99 0.79 113.55 116.15 1xdm h SER 131 Ca 0.00 0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.59 1xdm h SER 131 Cb 0.00 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.03 1xdm h SER 131 CO 0.00 -0.11 -0.48 -0.33 -0.53 0.00 0.00 176.83 175.39 1xdm h GLU 132 N 0.02 -1.19 -0.68 2.24 3.07 -2.01 -1.31 114.58 114.72 1xdm h GLU 132 Ca 0.87 0.08 0.13 0.00 -0.50 0.00 0.00 59.36 59.94 1xdm h GLU 132 Cb 3.17 0.27 -0.04 0.00 -0.84 0.00 0.00 28.75 31.31 1xdm h GLU 132 CO -0.22 -0.80 0.46 0.00 -1.40 0.00 0.00 179.01 177.05 1xdm h ARG 133 N -1.24 0.39 0.00 2.33 3.08 0.11 -2.69 114.38 116.37 1xdm h ARG 133 Ca -0.12 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.91 1xdm h ARG 133 Cb 0.97 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.94 1xdm h ARG 133 CO 0.15 0.26 0.00 0.00 -1.07 0.00 0.00 179.97 179.31 1xdm n ALA 135 N -1.08 0.41 0.37 0.00 0.00 -0.52 0.17 120.51 119.85 1xdm n ALA 135 Ca 0.00 0.58 -0.15 0.00 0.00 0.00 0.00 53.44 53.87 1xdm n ALA 135 Cb 0.00 -0.49 -0.07 0.00 0.00 0.00 0.00 19.45 18.89 1xdm n ALA 135 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1xdm h GLN 136 N 0.00 -0.93 -1.04 0.00 5.75 -1.52 -2.96 115.11 114.42 1xdm h GLN 136 Ca 0.39 0.06 0.32 0.00 -0.15 0.00 0.00 58.65 59.28 1xdm h GLN 136 Cb 0.93 0.21 -0.14 0.00 1.07 0.00 0.00 27.48 29.55 1xdm h GLN 136 CO -0.48 -0.62 0.61 1.88 -2.65 0.00 0.00 178.83 177.57 1xdm h TYR 137 N -1.15 0.88 -0.72 3.99 0.05 0.30 0.53 116.97 120.85 1xdm h TYR 137 Ca -0.10 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.72 1xdm h TYR 137 Cb 0.74 -0.24 -0.04 0.00 1.01 0.00 0.00 36.73 38.21 1xdm h TYR 137 CO 0.02 -0.13 0.47 -0.22 -1.05 0.00 0.00 178.16 177.25 1xdm h LYS 138 N 0.34 0.96 0.53 4.88 1.63 -1.04 -1.02 116.57 122.84 1xdm h LYS 138 Ca 0.72 -0.06 -0.02 0.00 -0.85 0.00 0.00 60.65 60.44 1xdm h LYS 138 Cb 1.70 -0.21 -0.00 0.00 -0.60 0.00 0.00 32.23 33.11 1xdm h LYS 138 CO -0.54 0.64 -0.31 0.87 -3.45 0.00 0.00 179.45 176.65 1xdm h LYS 139 N 0.98 -0.77 -1.20 1.90 1.57 0.21 -2.12 116.57 117.14 1xdm h LYS 139 Ca 0.26 0.05 0.35 0.00 -1.87 0.00 0.00 60.65 59.44 1xdm h LYS 139 Cb -0.10 0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.34 1xdm h LYS 139 CO -0.06 -0.51 0.88 -0.44 -0.57 0.00 0.00 179.45 178.75 1xdm h ASP 140 N -0.80 0.00 0.00 0.86 5.19 -0.86 -3.44 116.42 117.38 1xdm h ASP 140 Ca -0.06 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 1xdm h ASP 140 Cb 0.64 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.15 1xdm h ASP 140 CO 0.07 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.80 1xdm n GLY 141 N -1.77 0.28 3.88 2.75 0.00 -0.51 -5.05 105.19 104.78 1xdm n GLY 141 Ca 0.26 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.97 1xdm n GLY 141 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xdm s VAL 142 N -0.87 4.97 0.00 1.61 1.01 -0.51 -4.61 120.40 122.00 1xdm s VAL 142 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.35 1xdm s VAL 142 Cb 0.00 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.75 1xdm s VAL 142 CO 0.00 -0.10 0.00 0.47 0.00 0.00 0.00 175.10 175.47 1xdm n ASP 143 N -0.23 0.95 -3.60 3.32 8.00 -1.04 -4.23 116.55 119.72 1xdm n ASP 143 Ca -0.00 -0.27 -0.12 0.00 0.71 0.00 0.00 54.79 55.11 1xdm n ASP 143 Cb 0.53 0.73 -0.05 0.00 -0.02 0.00 0.00 41.12 42.31 1xdm n ASP 143 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1xdm s PHE 144 N -0.92 -0.31 0.18 1.24 -0.12 -1.25 -1.88 117.98 114.92 1xdm s PHE 144 Ca 0.00 0.14 -0.01 0.00 -0.05 0.00 0.00 56.93 57.02 1xdm s PHE 144 Cb 0.00 0.30 -0.04 0.00 -0.63 0.00 0.00 43.02 42.65 1xdm s PHE 144 CO 0.00 -0.68 0.10 0.20 -0.05 0.00 0.00 175.22 174.80 1xdm s GLY 145 N -2.43 1.30 0.20 1.99 0.00 -0.71 -1.65 107.32 106.02 1xdm s GLY 145 Ca -0.01 -1.63 0.01 0.00 0.00 0.00 0.00 44.72 43.09 1xdm s GLY 145 CO -0.08 -1.40 0.09 1.17 0.00 0.00 0.00 173.10 172.88 1xdm n LYS 146 N -0.22 1.34 0.00 2.90 4.81 -1.22 -1.79 118.16 123.97 1xdm n LYS 146 Ca -0.01 -1.32 0.00 0.00 -0.87 0.00 0.00 58.31 56.11 1xdm n LYS 146 Cb 0.65 0.23 0.00 0.00 0.02 0.00 0.00 35.03 35.94 1xdm n LYS 146 CO 0.00 0.00 0.00 1.87 1.17 0.00 0.00 177.40 180.44 1xdm n TRP 147 N -0.77 0.00 -0.49 5.64 -0.00 -1.26 -3.52 117.44 117.05 1xdm n TRP 147 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.46 1xdm n TRP 147 Cb 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.55 1xdm n TRP 147 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 1xdm n SER 159 N 0.00 0.00 0.00 5.87 2.88 -1.26 -4.96 113.62 116.15 1xdm n SER 159 Ca 0.00 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.65 1xdm n SER 159 Cb 0.00 -1.19 0.63 0.00 -0.75 0.00 0.00 64.21 62.90 1xdm n SER 159 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1xdm n SER 160 N -2.19 0.00 0.01 -3.46 3.41 -1.26 -2.57 113.62 107.56 1xdm n SER 160 Ca 0.00 -0.34 -0.19 0.00 -0.26 0.00 0.00 58.87 58.07 1xdm n SER 160 Cb 0.00 -0.16 -0.14 0.00 -0.26 0.00 0.00 64.21 63.65 1xdm n SER 160 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1xdm h LEU 161 N 0.00 0.35 0.33 1.04 5.85 -2.05 -3.11 115.31 117.72 1xdm h LEU 161 Ca 0.00 -0.92 -0.02 0.00 0.84 0.00 0.00 57.88 57.79 1xdm h LEU 161 Cb 0.12 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1xdm h LEU 161 CO 0.00 1.39 -0.16 0.00 -0.34 0.00 0.00 178.44 179.33 1xdm h ALA 162 N 0.01 -0.44 -0.57 1.25 0.00 -1.96 -2.02 119.26 115.53 1xdm h ALA 162 Ca -0.17 -0.19 0.16 0.00 0.00 0.00 0.00 54.91 54.72 1xdm h ALA 162 Cb 1.55 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.49 1xdm h ALA 162 CO 0.09 -0.51 0.63 0.82 0.00 0.00 0.00 179.25 180.27 1xdm h ILE 163 N -0.92 0.28 0.03 0.00 2.04 -1.67 0.52 117.51 117.79 1xdm h ILE 163 Ca -0.05 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.81 1xdm h ILE 163 Cb 0.52 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 1xdm h ILE 163 CO 0.07 0.00 -0.01 -0.61 0.00 0.00 0.00 178.15 177.60 1xdm h GLN 164 N 0.00 -0.04 0.14 2.37 4.15 -1.45 -3.12 115.11 117.15 1xdm h GLN 164 Ca 0.27 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.69 1xdm h GLN 164 Cb 1.52 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 29.21 1xdm h GLN 164 CO -0.00 0.46 -0.17 0.93 -1.93 0.00 0.00 178.83 178.12 1xdm h GLU 165 N -0.98 -0.31 -0.90 1.69 4.39 -0.20 -2.78 114.58 115.49 1xdm h GLU 165 Ca -0.00 0.02 0.23 0.00 0.34 0.00 0.00 59.36 59.94 1xdm h GLU 165 Cb 0.52 0.07 -0.16 0.00 -0.10 0.00 0.00 28.75 29.07 1xdm h GLU 165 CO 0.01 -0.20 -0.00 -0.91 -1.16 0.00 0.00 179.01 176.74 1xdm h ASN 166 N -0.32 -0.46 -0.03 1.42 -0.26 -1.35 0.12 115.58 114.70 1xdm h ASN 166 Ca -0.02 0.25 0.03 0.00 -0.56 0.00 0.00 56.30 56.01 1xdm h ASN 166 Cb 0.28 0.44 -0.06 0.00 -1.06 0.00 0.00 38.32 37.93 1xdm h ASN 166 CO -0.04 -0.28 -0.39 0.00 -1.06 0.00 0.00 177.43 175.66 1xdm h ALA 167 N 1.88 -0.60 -0.77 -0.83 0.00 -1.45 -0.13 119.26 117.35 1xdm h ALA 167 Ca 0.52 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.37 1xdm h ALA 167 Cb 0.99 0.70 -0.04 0.00 0.00 0.00 0.00 17.79 19.45 1xdm h ALA 167 CO -0.83 -0.92 0.38 -0.91 0.00 0.00 0.00 179.25 176.97 1xdm h ASN 168 N -0.53 1.00 0.00 0.00 2.35 -0.61 0.78 115.58 118.57 1xdm h ASN 168 Ca 0.06 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1xdm h ASN 168 Cb 0.63 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.74 1xdm h ASN 168 CO -0.32 0.85 0.00 0.00 -1.65 0.00 0.00 177.43 176.31 1xdm n ALA 169 N -2.39 -0.32 -0.39 -0.83 0.00 0.14 0.27 120.51 116.99 1xdm n ALA 169 Ca 0.07 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.47 1xdm n ALA 169 Cb 0.13 0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.74 1xdm n ALA 169 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xdm n LEU 170 N -2.20 -0.75 -0.36 0.00 4.77 -0.10 0.13 117.00 118.49 1xdm n LEU 170 Ca 0.00 1.75 0.04 0.00 -0.03 0.00 0.00 56.01 57.76 1xdm n LEU 170 Cb 0.00 -0.35 0.10 0.00 -2.33 0.00 0.00 43.42 40.84 1xdm n LEU 170 CO 0.00 -1.53 0.62 0.00 -1.33 0.00 0.00 177.39 175.15 1xdm n ALA 171 N -3.42 0.11 0.17 -1.18 0.00 0.27 -0.39 120.51 116.08 1xdm n ALA 171 Ca 0.08 1.04 -0.12 0.00 0.00 0.00 0.00 53.44 54.45 1xdm n ALA 171 Cb 0.36 -0.57 -0.07 0.00 0.00 0.00 0.00 19.45 19.17 1xdm n ALA 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xdm h ARG 172 N 0.00 -0.47 -1.37 0.00 3.08 0.57 -2.77 114.38 113.42 1xdm h ARG 172 Ca 0.43 0.03 0.40 0.00 0.07 0.00 0.00 59.98 60.91 1xdm h ARG 172 Cb 0.67 0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.77 1xdm h ARG 172 CO -1.00 -0.16 1.06 -0.92 -1.07 0.00 0.00 179.97 177.89 1xdm h TYR 173 N -0.97 0.00 0.00 3.04 3.20 0.23 -0.26 116.97 122.21 1xdm h TYR 173 Ca -0.05 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.82 1xdm h TYR 173 Cb 0.52 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.79 1xdm h TYR 173 CO 0.03 0.00 0.00 0.00 -1.64 0.00 0.00 178.16 176.55 1xdm n ALA 174 N -2.72 -0.24 0.27 1.82 0.00 0.48 -3.30 120.51 116.83 1xdm n ALA 174 Ca 0.30 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.82 1xdm n ALA 174 Cb 1.50 0.00 0.31 0.00 0.00 0.00 0.00 19.45 21.25 1xdm n ALA 174 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1xdm h SER 175 N 0.00 0.00 0.30 0.00 4.64 -0.79 0.35 113.55 118.05 1xdm h SER 175 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1xdm h SER 175 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1xdm h SER 175 CO 0.00 0.00 -0.15 0.40 -0.87 0.00 0.00 176.83 176.21 1xdm h ILE 176 N 0.00 0.00 -0.83 0.95 2.04 -1.35 -3.07 117.51 115.25 1xdm h ILE 176 Ca 0.05 -0.45 0.20 0.00 1.00 0.00 0.00 64.86 65.67 1xdm h ILE 176 Cb 1.66 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 37.61 1xdm h ILE 176 CO -0.00 0.00 0.20 0.00 0.00 0.00 0.00 178.15 178.35 1xdm h GLN 178 N 0.22 0.52 -0.03 0.00 1.08 -1.44 0.23 115.11 115.69 1xdm h GLN 178 Ca 0.50 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.65 1xdm h GLN 178 Cb 0.95 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 28.26 1xdm h GLN 178 CO -0.61 0.34 -0.05 1.96 -0.95 0.00 0.00 178.83 179.52 1xdm h GLN 179 N 0.53 0.08 0.00 1.46 7.50 0.10 -3.11 115.11 121.68 1xdm h GLN 179 Ca 0.65 -0.05 0.00 0.00 0.50 0.00 0.00 58.65 59.75 1xdm h GLN 179 Cb 1.26 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.79 1xdm h GLN 179 CO -0.50 0.60 0.00 0.09 -1.50 0.00 0.00 178.83 177.52 1xdm n ASN 180 N -4.76 0.00 -0.12 1.46 3.02 0.29 -4.83 115.26 110.32 1xdm n ASN 180 Ca -0.08 -0.82 -0.01 0.00 -0.03 0.00 0.00 54.58 53.64 1xdm n ASN 180 Cb 0.30 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.47 1xdm n ASN 180 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xdm n GLY 181 N 0.13 0.47 3.80 7.41 0.00 0.53 -4.61 105.19 112.92 1xdm n GLY 181 Ca 0.08 -1.00 -0.22 0.00 0.00 0.00 0.00 46.02 44.88 1xdm n GLY 181 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xdm s LEU 182 N -0.35 3.72 -0.32 0.99 1.43 0.28 -4.81 118.68 119.62 1xdm s LEU 182 Ca 0.00 -0.31 -0.05 0.00 -1.03 0.00 0.00 54.13 52.74 1xdm s LEU 182 Cb 0.00 -2.25 0.04 0.00 0.03 0.00 0.00 46.19 44.01 1xdm s LEU 182 CO 0.00 -0.03 0.06 -0.69 0.23 0.00 0.00 176.35 175.92 1xdm s VAL 183 N -2.16 3.48 0.84 -1.59 1.01 -0.79 -3.53 120.40 117.67 1xdm s VAL 183 Ca 0.33 -1.17 -0.13 0.00 0.00 0.00 0.00 61.98 61.00 1xdm s VAL 183 Cb -0.08 -2.96 0.06 0.00 0.00 0.00 0.00 36.38 33.41 1xdm s VAL 183 CO 0.24 -0.11 0.88 -2.65 0.00 0.00 0.00 175.10 173.46 1xdm n PRO 184 N 4.75 0.01 -2.82 2.72 -0.02 -1.26 -1.73 135.00 136.64 1xdm n PRO 184 Ca -0.13 0.07 -0.21 0.00 -2.02 0.00 0.00 63.50 61.20 1xdm n PRO 184 Cb 0.45 -2.18 -0.01 0.00 -0.02 0.00 0.00 33.50 31.74 1xdm n PRO 184 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1xdm n ILE 185 N -3.32 1.73 -1.05 4.25 5.41 -0.74 -3.39 119.36 122.24 1xdm n ILE 185 Ca 0.11 -4.68 -0.41 0.00 1.00 0.00 0.00 62.75 58.77 1xdm n ILE 185 Cb 0.51 -0.69 -0.06 0.00 -0.71 0.00 0.00 39.64 38.69 1xdm n ILE 185 CO 0.00 0.00 0.00 0.55 0.00 0.00 0.00 176.55 177.10 1xdm n VAL 186 N -0.15 0.00 -3.62 1.39 3.14 -1.20 -4.55 118.33 113.34 1xdm n VAL 186 Ca 0.27 0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.36 1xdm n VAL 186 Cb 0.61 -0.15 -0.14 0.00 -1.06 0.00 0.00 33.84 33.10 1xdm n VAL 186 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 1xdm s GLU 187 N 0.89 0.67 0.40 1.45 2.12 -1.26 -2.90 118.70 120.08 1xdm s GLU 187 Ca 0.64 -1.21 -0.25 0.00 0.36 0.00 0.00 54.97 54.51 1xdm s GLU 187 Cb -0.90 -1.70 -0.08 0.00 0.26 0.00 0.00 34.13 31.71 1xdm s GLU 187 CO 0.45 -1.09 1.16 -2.14 -0.54 0.00 0.00 175.26 173.10 1xdm s PRO 188 N 1.33 4.04 -0.18 4.30 0.02 -1.26 -5.02 135.00 138.22 1xdm s PRO 188 Ca 0.13 1.81 -0.08 0.00 0.02 0.00 0.00 61.00 62.88 1xdm s PRO 188 Cb -0.20 -2.64 -0.04 0.00 0.02 0.00 0.00 34.50 31.63 1xdm s PRO 188 CO -0.16 -0.32 0.08 -1.83 -0.33 0.00 0.00 177.00 174.43 1xdm s GLU 189 N -2.34 4.02 0.48 5.54 4.04 -1.26 -4.66 118.70 124.52 1xdm s GLU 189 Ca 0.58 -0.32 0.06 0.00 0.04 0.00 0.00 54.97 55.33 1xdm s GLU 189 Cb -0.30 -3.25 0.01 0.00 0.02 0.00 0.00 34.13 30.60 1xdm s GLU 189 CO 0.37 0.28 0.36 0.08 -1.84 0.00 0.00 175.26 174.52 1xdm s VAL 190 N 0.35 2.07 0.00 1.83 1.01 -1.26 -5.06 120.40 119.33 1xdm s VAL 190 Ca 0.04 -1.48 0.00 0.00 0.00 0.00 0.00 61.98 60.54 1xdm s VAL 190 Cb -0.12 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.71 1xdm s VAL 190 CO -0.00 0.00 0.00 -0.38 0.00 0.00 0.00 175.10 174.72 1xdm n ILE 191 N -1.61 0.00 0.00 2.22 -0.00 -1.26 -5.14 119.36 113.57 1xdm n ILE 191 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1xdm n ILE 191 Cb 0.64 -0.31 0.00 0.00 -0.00 0.00 0.00 39.64 39.96 1xdm n ILE 191 CO 0.00 0.00 0.00 -2.65 -0.00 0.00 0.00 176.55 173.90 1xdm n PRO 192 N -2.08 1.70 -0.31 0.38 -0.02 -1.26 -5.15 135.00 128.26 1xdm n PRO 192 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.21 1xdm n PRO 192 Cb 0.27 0.00 0.26 0.00 -0.02 0.00 0.00 33.50 34.01 1xdm n PRO 192 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1xdm n ASP 197 N 0.00 -3.83 0.11 2.55 3.85 -1.26 -4.87 116.55 113.11 1xdm n ASP 197 Ca 0.00 -0.73 -0.16 0.00 -0.71 0.00 0.00 54.79 53.18 1xdm n ASP 197 Cb 0.00 -0.95 -0.10 0.00 -1.35 0.00 0.00 41.12 38.72 1xdm n ASP 197 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.20 176.12 1xdm h LEU 198 N -3.41 -1.60 -0.52 -2.12 4.07 -1.96 -1.84 115.31 107.93 1xdm h LEU 198 Ca -0.36 0.17 0.09 0.00 0.08 0.00 0.00 57.88 57.86 1xdm h LEU 198 Cb 1.18 0.59 -0.09 0.00 1.08 0.00 0.00 40.66 43.42 1xdm h LEU 198 CO 0.22 -0.56 -0.17 1.21 -1.08 0.00 0.00 178.44 178.07 1xdm n GLU 199 N -5.48 -0.09 0.00 1.13 2.13 -1.26 0.12 120.64 117.20 1xdm n GLU 199 Ca -0.09 0.81 0.00 0.00 0.66 0.00 0.00 57.16 58.54 1xdm n GLU 199 Cb 0.41 -1.20 0.00 0.00 0.27 0.00 0.00 31.44 30.92 1xdm n GLU 199 CO 0.00 0.00 0.00 1.58 -0.41 0.00 0.00 177.13 178.30 1xdm n HIS 200 N -4.81 0.00 0.21 4.31 -0.00 -0.72 0.21 115.22 114.43 1xdm n HIS 200 Ca 0.07 0.00 0.16 0.00 0.46 0.00 0.00 57.72 58.41 1xdm n HIS 200 Cb 0.23 -0.44 0.66 0.00 -0.12 0.00 0.00 29.99 30.32 1xdm n HIS 200 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1xdm h GLN 202 N 0.00 0.00 -0.62 0.00 4.15 0.13 -2.55 115.11 116.21 1xdm h GLN 202 Ca 0.10 0.00 0.12 0.00 0.77 0.00 0.00 58.65 59.64 1xdm h GLN 202 Cb 1.15 0.00 -0.12 0.00 0.21 0.00 0.00 27.48 28.72 1xdm h GLN 202 CO -0.00 0.33 -0.24 -0.92 -1.93 0.00 0.00 178.83 176.07 1xdm h TYR 203 N -1.00 -0.61 0.17 3.99 3.20 0.13 -1.59 116.97 121.26 1xdm h TYR 203 Ca -0.00 0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 1xdm h TYR 203 Cb 0.35 0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.98 1xdm h TYR 203 CO 0.09 -0.33 -0.19 0.28 -1.64 0.00 0.00 178.16 176.36 1xdm h VAL 204 N -0.08 0.00 -1.30 1.81 2.07 -1.43 -2.39 116.25 114.93 1xdm h VAL 204 Ca 0.28 0.00 0.46 0.00 0.82 0.00 0.00 66.70 68.26 1xdm h VAL 204 Cb 0.52 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.15 1xdm h VAL 204 CO -0.68 0.00 0.82 0.41 0.02 0.00 0.00 177.57 178.14 1xdm n THR 205 N -3.48 -0.26 -0.04 2.57 -1.04 -0.92 0.23 114.28 111.34 1xdm n THR 205 Ca -0.04 1.77 -0.13 0.00 -2.04 0.00 0.00 64.05 63.61 1xdm n THR 205 Cb 0.17 -2.91 -0.08 0.00 -1.82 0.00 0.00 70.33 65.70 1xdm n THR 205 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1xdm h GLU 206 N 0.00 0.23 0.21 -2.82 5.08 -0.80 -0.85 114.58 115.62 1xdm h GLU 206 Ca 0.85 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 59.10 1xdm h GLU 206 Cb 2.69 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.92 1xdm h GLU 206 CO -0.49 0.60 -0.16 0.87 -1.00 0.00 0.00 179.01 178.83 1xdm h LYS 207 N -0.15 -0.36 -0.75 2.33 1.57 0.10 -1.41 116.57 117.90 1xdm h LYS 207 Ca 0.02 0.02 0.10 0.00 -1.87 0.00 0.00 60.65 58.92 1xdm h LYS 207 Cb 0.54 0.08 -0.07 0.00 0.08 0.00 0.00 32.23 32.86 1xdm h LYS 207 CO 0.02 -0.24 0.40 0.28 -0.57 0.00 0.00 179.45 179.33 1xdm h VAL 208 N -0.38 0.86 -0.32 0.50 2.07 -1.37 0.19 116.25 117.81 1xdm h VAL 208 Ca -0.01 -0.23 -0.09 0.00 0.82 0.00 0.00 66.70 67.19 1xdm h VAL 208 Cb 0.33 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 1xdm h VAL 208 CO -0.01 0.12 -0.17 -0.07 0.02 0.00 0.00 177.57 177.46 1xdm h LEU 209 N 0.66 0.58 0.33 2.57 3.38 -0.88 -1.20 115.31 120.75 1xdm h LEU 209 Ca 0.37 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1xdm h LEU 209 Cb 0.38 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1xdm h LEU 209 CO -0.27 0.76 -0.16 0.00 0.09 0.00 0.00 178.44 178.87 1xdm h ALA 210 N 1.29 -0.45 -0.85 1.53 0.00 -0.39 0.11 119.26 120.51 1xdm h ALA 210 Ca 0.09 -0.19 0.18 0.00 0.00 0.00 0.00 54.91 54.99 1xdm h ALA 210 Cb 0.60 0.17 -0.16 0.00 0.00 0.00 0.00 17.79 18.40 1xdm h ALA 210 CO 0.04 -0.56 -0.14 0.00 0.00 0.00 0.00 179.25 178.59 1xdm h ALA 211 N -0.35 0.67 0.51 0.00 0.00 -0.55 0.62 119.26 120.16 1xdm h ALA 211 Ca -0.05 0.31 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1xdm h ALA 211 Cb 0.52 0.60 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1xdm h ALA 211 CO 0.08 -0.42 -0.24 0.28 0.00 0.00 0.00 179.25 178.94 1xdm h VAL 212 N 0.02 0.00 0.00 0.00 2.07 -1.06 -0.41 116.25 116.87 1xdm h VAL 212 Ca 0.43 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.78 1xdm h VAL 212 Cb 0.71 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1xdm h VAL 212 CO -0.84 0.00 0.00 1.88 0.02 0.00 0.00 177.57 178.63 1xdm h TYR 213 N -0.85 0.00 0.00 1.57 0.05 -0.08 0.61 116.97 118.27 1xdm h TYR 213 Ca -0.07 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.69 1xdm h TYR 213 Cb 0.52 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.26 1xdm h TYR 213 CO 0.06 0.00 -0.11 -0.22 -1.05 0.00 0.00 178.16 176.84 1xdm h LYS 214 N 0.00 0.00 -0.11 4.88 1.63 0.31 -3.10 116.57 120.18 1xdm h LYS 214 Ca 0.00 0.00 0.02 0.00 -0.85 0.00 0.00 60.65 59.82 1xdm h LYS 214 Cb 0.01 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 31.59 1xdm h LYS 214 CO 0.00 0.90 -0.41 0.00 -3.45 0.00 0.00 179.45 176.48 1xdm h ALA 215 N -0.14 -0.78 -1.34 5.00 0.00 0.70 -0.05 119.26 122.65 1xdm h ALA 215 Ca -0.03 -0.04 0.41 0.00 0.00 0.00 0.00 54.91 55.25 1xdm h ALA 215 Cb 0.93 0.91 -0.11 0.00 0.00 0.00 0.00 17.79 19.53 1xdm h ALA 215 CO -0.02 -0.93 0.90 -0.07 0.00 0.00 0.00 179.25 179.12 1xdm h LEU 216 N -0.44 0.22 -0.13 0.00 3.38 -1.09 0.55 115.31 117.80 1xdm h LEU 216 Ca 0.03 0.09 -0.21 0.00 0.09 0.00 0.00 57.88 57.88 1xdm h LEU 216 Cb 0.52 0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.35 1xdm h LEU 216 CO -0.34 -0.09 -0.72 -1.13 0.09 0.00 0.00 178.44 176.25 1xdm h ASN 217 N 0.12 0.86 -0.41 -0.43 -0.73 -0.95 -0.77 115.58 113.26 1xdm h ASN 217 Ca 0.77 -0.64 0.00 0.00 1.87 0.00 0.00 56.30 58.30 1xdm h ASN 217 Cb 2.52 -0.26 -0.02 0.00 0.27 0.00 0.00 38.32 40.83 1xdm h ASN 217 CO -0.30 1.37 0.27 0.44 -0.37 0.00 0.00 177.43 178.83 1xdm h ASP 218 N 0.42 0.48 -0.31 1.15 3.32 0.92 -1.40 116.42 121.00 1xdm h ASP 218 Ca -0.05 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1xdm h ASP 218 Cb 1.36 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1xdm h ASP 218 CO 0.15 0.36 0.00 1.41 -1.72 0.00 0.00 179.24 179.44 1xdm n HIS 219 N -4.46 1.04 -4.40 4.55 8.25 -0.57 -4.91 115.22 114.72 1xdm n HIS 219 Ca 0.03 -0.37 -0.39 0.00 -0.26 0.00 0.00 57.72 56.74 1xdm n HIS 219 Cb 0.07 -0.29 -0.06 0.00 1.12 0.00 0.00 29.99 30.82 1xdm n HIS 219 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1xdm n HIS 220 N 0.35 -1.37 -0.77 4.41 -0.00 -0.53 -4.84 115.22 112.47 1xdm n HIS 220 Ca 0.14 0.72 -0.29 0.00 0.46 0.00 0.00 57.72 58.75 1xdm n HIS 220 Cb 0.71 -2.39 0.24 0.00 -0.12 0.00 0.00 29.99 28.43 1xdm n HIS 220 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1xdm s VAL 221 N -3.42 1.86 -0.85 3.57 1.01 -0.31 -4.65 120.40 117.61 1xdm s VAL 221 Ca 0.68 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.66 1xdm s VAL 221 Cb -0.39 -2.24 0.21 0.00 0.00 0.00 0.00 36.38 33.96 1xdm s VAL 221 CO 0.99 0.00 0.71 -0.47 0.00 0.00 0.00 175.10 176.33 1xdm s TYR 222 N -2.65 3.82 0.26 5.22 5.04 -1.26 -4.94 117.35 122.84 1xdm s TYR 222 Ca 0.68 -3.12 -0.11 0.00 -2.44 0.00 0.00 57.07 52.07 1xdm s TYR 222 Cb -0.20 -3.10 0.38 0.00 0.35 0.00 0.00 41.96 39.39 1xdm s TYR 222 CO 0.61 -0.68 1.57 -0.07 -1.34 0.00 0.00 175.55 175.63 1xdm h LEU 223 N 5.83 -1.02 -1.89 6.97 3.38 -1.92 0.66 115.31 127.32 1xdm h LEU 223 Ca 0.16 0.29 0.29 0.00 0.09 0.00 0.00 57.88 58.70 1xdm h LEU 223 Cb 0.79 0.63 -0.04 0.00 0.09 0.00 0.00 40.66 42.13 1xdm h LEU 223 CO 0.82 -0.31 0.80 -0.33 0.09 0.00 0.00 178.44 179.51 1xdm h GLU 224 N -0.01 0.00 -0.75 1.13 3.07 -1.92 0.55 114.58 116.65 1xdm h GLU 224 Ca 0.42 0.00 -0.49 0.00 -0.50 0.00 0.00 59.36 58.79 1xdm h GLU 224 Cb 0.67 0.00 -0.29 0.00 -0.84 0.00 0.00 28.75 28.29 1xdm h GLU 224 CO -0.97 0.00 0.06 0.41 -1.40 0.00 0.00 179.01 177.11 1xdm n GLY 225 N -1.70 5.68 1.80 -3.84 0.00 0.23 -4.53 105.19 102.83 1xdm n GLY 225 Ca 0.21 -2.04 -0.14 0.00 0.00 0.00 0.00 46.02 44.05 1xdm n GLY 225 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xdm n THR 226 N -0.93 0.00 -3.15 2.61 -1.04 0.19 -4.33 114.28 107.63 1xdm n THR 226 Ca 0.49 -1.10 0.05 0.00 -2.04 0.00 0.00 64.05 61.46 1xdm n THR 226 Cb 0.94 -0.06 -0.01 0.00 -1.82 0.00 0.00 70.33 69.39 1xdm n THR 226 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1xdm s LEU 227 N 0.00 -0.43 0.11 -4.42 1.43 -1.22 -4.46 118.68 109.70 1xdm s LEU 227 Ca 0.09 0.20 -0.29 0.00 -1.03 0.00 0.00 54.13 53.09 1xdm s LEU 227 Cb -0.01 1.33 -0.06 0.00 0.03 0.00 0.00 46.19 47.48 1xdm s LEU 227 CO 0.05 -0.08 0.93 -0.22 0.23 0.00 0.00 176.35 177.27 1xdm s LEU 228 N 2.96 4.51 -0.53 1.79 2.96 -1.10 -3.24 118.68 126.01 1xdm s LEU 228 Ca 0.06 1.76 0.04 0.00 -0.22 0.00 0.00 54.13 55.77 1xdm s LEU 228 Cb -0.08 -3.54 0.39 0.00 0.50 0.00 0.00 46.19 43.46 1xdm s LEU 228 CO -0.14 -0.03 1.18 1.17 -1.32 0.00 0.00 176.35 177.21 1xdm n LYS 229 N 2.67 3.40 -0.39 1.98 4.81 -1.14 -1.68 118.16 127.80 1xdm n LYS 229 Ca 0.01 -4.52 -0.11 0.00 -0.87 0.00 0.00 58.31 52.83 1xdm n LYS 229 Cb 0.49 -2.26 0.10 0.00 0.02 0.00 0.00 35.03 33.39 1xdm n LYS 229 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 1xdm n PRO 230 N -0.41 -0.84 -4.07 1.64 -0.04 -1.26 -4.27 135.00 125.74 1xdm n PRO 230 Ca 0.39 -0.52 -0.34 0.00 -0.04 0.00 0.00 63.50 62.99 1xdm n PRO 230 Cb 0.54 -1.10 -0.15 0.00 -0.04 0.00 0.00 33.50 32.76 1xdm n PRO 230 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1xdm s ASN 231 N -1.84 3.99 0.14 3.54 2.20 -1.26 -2.07 114.94 119.63 1xdm s ASN 231 Ca 0.24 -0.44 -0.35 0.00 -0.94 0.00 0.00 52.86 51.36 1xdm s ASN 231 Cb -0.04 -1.66 -0.15 0.00 -2.00 0.00 0.00 41.25 37.40 1xdm s ASN 231 CO 0.20 0.01 1.47 0.23 -2.94 0.00 0.00 177.10 176.07 1xdm n MET 232 N 4.59 1.75 -2.23 3.55 2.81 -1.26 -4.82 117.12 121.51 1xdm n MET 232 Ca -0.19 0.63 -0.43 0.00 -1.81 0.00 0.00 57.70 55.91 1xdm n MET 232 Cb 0.51 -2.34 -0.02 0.00 -0.71 0.00 0.00 33.22 30.66 1xdm n MET 232 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1xdm s VAL 233 N 0.68 3.93 0.10 2.03 0.11 -1.26 -4.98 120.40 121.00 1xdm s VAL 233 Ca 0.80 1.15 -0.11 0.00 -2.93 0.00 0.00 61.98 60.90 1xdm s VAL 233 Cb -0.78 -3.74 0.01 0.00 -1.53 0.00 0.00 36.38 30.33 1xdm s VAL 233 CO 0.42 -0.09 0.25 0.42 -3.33 0.00 0.00 175.10 172.77 1xdm s THR 234 N 3.58 0.12 0.00 5.04 -4.23 -1.26 -4.68 115.64 114.21 1xdm s THR 234 Ca 0.63 -0.99 0.00 0.00 -1.18 0.00 0.00 61.69 60.16 1xdm s THR 234 Cb -0.28 -1.26 0.00 0.00 1.34 0.00 0.00 72.50 72.30 1xdm s THR 234 CO 0.22 -0.54 0.00 0.00 -0.54 0.00 0.00 174.62 173.76 1xdm n ALA 235 N -0.06 0.00 0.00 3.99 0.00 -1.26 -4.81 120.51 118.37 1xdm n ALA 235 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1xdm n ALA 235 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 1xdm n ALA 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xdm n ALA 238 N -3.00 0.00 -0.40 0.00 0.00 -1.26 -5.01 120.51 110.83 1xdm n ALA 238 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 1xdm n ALA 238 Cb 0.00 0.00 0.27 0.00 0.00 0.00 0.00 19.45 19.72 1xdm n ALA 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xdm n THR 240 N -5.25 0.91 -1.50 0.00 -2.24 -1.26 -4.99 114.28 99.95 1xdm n THR 240 Ca 0.05 0.29 -0.51 0.00 -2.27 0.00 0.00 64.05 61.61 1xdm n THR 240 Cb 0.56 -2.03 -0.05 0.00 -2.10 0.00 0.00 70.33 66.71 1xdm n THR 240 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1xdm n LYS 241 N -3.71 0.49 -3.25 -0.78 4.81 -1.26 -4.94 118.16 109.53 1xdm n LYS 241 Ca -0.08 0.18 -0.39 0.00 -0.87 0.00 0.00 58.31 57.15 1xdm n LYS 241 Cb 0.28 -1.50 -0.06 0.00 0.02 0.00 0.00 35.03 33.77 1xdm n LYS 241 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1xdm s LYS 242 N -0.56 4.26 -0.12 1.64 2.20 -1.26 -4.99 119.74 120.91 1xdm s LYS 242 Ca 0.74 0.71 0.01 0.00 -0.36 0.00 0.00 55.97 57.07 1xdm s LYS 242 Cb -0.98 -3.30 0.02 0.00 -1.51 0.00 0.00 37.83 32.06 1xdm s LYS 242 CO 0.55 0.48 -0.13 0.71 -0.36 0.00 0.00 175.35 176.60 1xdm s TYR 243 N -0.54 1.89 0.69 4.03 1.51 -1.26 -5.13 117.35 118.54 1xdm s TYR 243 Ca 0.30 -0.95 -0.15 0.00 -1.01 0.00 0.00 57.07 55.25 1xdm s TYR 243 Cb -0.19 -1.41 0.02 0.00 -0.11 0.00 0.00 41.96 40.27 1xdm s TYR 243 CO 0.17 -0.53 1.15 -0.08 -1.11 0.00 0.00 175.55 175.15 1xdm s THR 244 N 1.29 2.83 -1.78 -0.71 -1.32 -1.26 -4.72 115.64 109.98 1xdm s THR 244 Ca -0.01 0.40 0.05 0.00 -1.21 0.00 0.00 61.69 60.92 1xdm s THR 244 Cb -0.14 -2.93 0.13 0.00 -1.51 0.00 0.00 72.50 68.04 1xdm s THR 244 CO -0.06 -0.23 0.86 -2.65 -2.21 0.00 0.00 174.62 170.34 1xdm n PRO 245 N -2.53 0.13 -0.01 7.08 -0.02 -1.26 -0.48 135.00 137.91 1xdm n PRO 245 Ca 0.12 0.09 -0.19 0.00 -2.02 0.00 0.00 63.50 61.50 1xdm n PRO 245 Cb 0.51 -1.50 -0.14 0.00 -0.02 0.00 0.00 33.50 32.36 1xdm n PRO 245 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1xdm h GLU 246 N 0.00 0.16 0.12 -0.52 3.07 -1.94 -2.91 114.58 112.56 1xdm h GLU 246 Ca 0.00 -0.28 -0.01 0.00 -0.50 0.00 0.00 59.36 58.58 1xdm h GLU 246 Cb 0.02 0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.03 1xdm h GLU 246 CO 0.00 1.13 -0.06 1.96 -1.40 0.00 0.00 179.01 180.64 1xdm h GLN 247 N -0.62 -0.16 -0.86 2.33 4.20 -1.12 -1.34 115.11 117.54 1xdm h GLN 247 Ca -0.15 0.01 0.17 0.00 0.06 0.00 0.00 58.65 58.74 1xdm h GLN 247 Cb 1.43 0.04 -0.10 0.00 0.30 0.00 0.00 27.48 29.14 1xdm h GLN 247 CO 0.05 0.22 0.42 0.28 -0.67 0.00 0.00 178.83 179.12 1xdm h VAL 248 N -0.57 0.64 0.92 -0.54 2.07 -1.33 0.50 116.25 117.94 1xdm h VAL 248 Ca -0.02 -0.18 -0.05 0.00 0.82 0.00 0.00 66.70 67.27 1xdm h VAL 248 Cb 0.45 0.05 0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1xdm h VAL 248 CO 0.03 0.10 -0.44 0.00 0.02 0.00 0.00 177.57 177.27 1xdm h ALA 249 N 1.61 -1.24 0.03 1.67 0.00 -1.33 -1.93 119.26 118.07 1xdm h ALA 249 Ca 0.49 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1xdm h ALA 249 Cb 0.79 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 1xdm h ALA 249 CO -0.42 -1.19 -0.18 1.98 0.00 0.00 0.00 179.25 179.44 1xdm h MET 250 N -1.26 -0.24 -0.75 0.00 -1.53 -0.27 -0.62 114.93 110.26 1xdm h MET 250 Ca -0.13 0.02 0.11 0.00 -3.44 0.00 0.00 59.70 56.26 1xdm h MET 250 Cb 0.95 0.05 -0.11 0.00 -0.55 0.00 0.00 31.60 31.94 1xdm h MET 250 CO 0.21 -0.16 -0.32 0.00 0.14 0.00 0.00 176.91 176.78 1xdm n ALA 251 N -2.63 -0.16 0.01 0.39 0.00 0.08 -0.54 120.51 117.65 1xdm n ALA 251 Ca -0.03 0.72 -0.11 0.00 0.00 0.00 0.00 53.44 54.03 1xdm n ALA 251 Cb 0.14 -0.29 -0.05 0.00 0.00 0.00 0.00 19.45 19.25 1xdm n ALA 251 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1xdm h THR 252 N 0.00 0.98 -0.18 0.00 2.02 -0.56 -2.32 112.91 112.85 1xdm h THR 252 Ca 0.23 -0.02 -0.17 0.00 0.77 0.00 0.00 66.41 67.22 1xdm h THR 252 Cb 0.42 0.91 -0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1xdm h THR 252 CO -0.73 0.01 -0.58 0.58 0.37 0.00 0.00 175.52 175.17 1xdm h VAL 253 N 0.07 1.32 -0.51 3.16 2.07 0.34 -0.54 116.25 122.16 1xdm h VAL 253 Ca 0.03 -1.83 0.08 0.00 0.82 0.00 0.00 66.70 65.80 1xdm h VAL 253 Cb 0.02 1.80 -0.06 0.00 -1.52 0.00 0.00 31.29 31.52 1xdm h VAL 253 CO -0.04 0.57 0.16 0.74 0.02 0.00 0.00 177.57 179.02 1xdm h THR 254 N 0.44 0.79 -0.33 2.57 2.02 -0.75 0.24 112.91 117.89 1xdm h THR 254 Ca 0.00 -0.11 -0.05 0.00 0.77 0.00 0.00 66.41 67.03 1xdm h THR 254 Cb 1.13 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 1xdm h THR 254 CO 0.11 0.06 0.03 0.00 0.37 0.00 0.00 175.52 176.09 1xdm h ALA 255 N 1.36 0.45 -0.33 6.16 0.00 -1.24 -2.96 119.26 122.69 1xdm h ALA 255 Ca 0.25 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1xdm h ALA 255 Cb 0.29 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1xdm h ALA 255 CO -0.27 0.17 -0.02 -0.07 0.00 0.00 0.00 179.25 179.06 1xdm h LEU 256 N 0.39 0.59 0.00 0.00 3.38 -0.39 -2.91 115.31 116.37 1xdm h LEU 256 Ca 0.10 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1xdm h LEU 256 Cb 0.40 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1xdm h LEU 256 CO 0.01 0.77 0.00 0.00 0.09 0.00 0.00 178.44 179.31 1xdm n HIS 257 N -4.51 0.00 -0.00 1.13 1.44 0.79 -1.48 115.22 112.59 1xdm n HIS 257 Ca -0.02 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.75 1xdm n HIS 257 Cb 0.28 -0.24 -0.13 0.00 0.12 0.00 0.00 29.99 30.03 1xdm n HIS 257 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1xdm n ARG 258 N -1.24 0.65 0.00 -1.40 1.74 -1.11 -4.82 116.66 110.49 1xdm n ARG 258 Ca 0.09 -0.06 -0.01 0.00 -0.77 0.00 0.00 57.85 57.11 1xdm n ARG 258 Cb 0.13 -1.61 -0.00 0.00 -1.02 0.00 0.00 32.46 29.95 1xdm n ARG 258 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1xdm n THR 259 N -2.50 0.38 -1.55 0.55 -2.24 -0.90 -5.01 114.28 103.02 1xdm n THR 259 Ca -0.09 0.19 -0.38 0.00 -2.27 0.00 0.00 64.05 61.50 1xdm n THR 259 Cb 0.70 -1.32 -0.05 0.00 -2.10 0.00 0.00 70.33 67.56 1xdm n THR 259 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1xdm n VAL 260 N -2.87 -0.01 -1.08 2.28 0.31 -0.55 -4.92 118.33 111.50 1xdm n VAL 260 Ca -0.01 -0.64 -0.35 0.00 -0.01 0.00 0.00 64.34 63.33 1xdm n VAL 260 Cb 0.04 -2.47 0.02 0.00 -0.91 0.00 0.00 33.84 30.52 1xdm n VAL 260 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1xdm n PRO 261 N 8.88 0.00 0.15 5.55 -0.02 -1.26 -4.80 135.00 143.50 1xdm n PRO 261 Ca 0.39 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 62.00 1xdm n PRO 261 Cb 0.46 -0.91 0.52 0.00 -0.02 0.00 0.00 33.50 33.55 1xdm n PRO 261 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xdm h ALA 262 N -0.25 1.00 0.00 3.55 0.00 -1.95 -3.10 119.26 118.51 1xdm h ALA 262 Ca -0.38 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1xdm h ALA 262 Cb 1.28 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1xdm h ALA 262 CO 0.33 0.00 -0.12 0.00 0.00 0.00 0.00 179.25 179.47 1xdm h ALA 263 N 2.24 0.95 -2.54 0.00 0.00 -1.93 -3.44 119.26 114.53 1xdm h ALA 263 Ca 0.00 -0.11 -0.53 0.00 0.00 0.00 0.00 54.91 54.28 1xdm h ALA 263 Cb 0.42 -0.02 0.04 0.00 0.00 0.00 0.00 17.79 18.22 1xdm h ALA 263 CO 0.00 0.15 0.95 0.08 0.00 0.00 0.00 179.25 180.42 1xdm s VAL 264 N -3.34 2.75 -0.84 0.00 1.01 -1.17 -3.88 120.40 114.92 1xdm s VAL 264 Ca 0.04 0.41 0.27 0.00 0.00 0.00 0.00 61.98 62.70 1xdm s VAL 264 Cb 0.07 -3.27 0.26 0.00 0.00 0.00 0.00 36.38 33.45 1xdm s VAL 264 CO 0.65 0.02 1.83 -0.81 0.00 0.00 0.00 175.10 176.78 1xdm n PRO 265 N 4.71 0.15 -3.57 2.72 -0.04 -1.26 -4.70 135.00 133.01 1xdm n PRO 265 Ca 0.15 0.14 -0.12 0.00 -0.04 0.00 0.00 63.50 63.62 1xdm n PRO 265 Cb 0.39 -1.68 -0.05 0.00 -0.04 0.00 0.00 33.50 32.12 1xdm n PRO 265 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1xdm s GLY 266 N -3.33 -0.34 -0.61 0.55 0.00 -1.26 -3.39 107.32 98.94 1xdm s GLY 266 Ca 0.12 1.88 0.05 0.00 0.00 0.00 0.00 44.72 46.77 1xdm s GLY 266 CO 0.55 1.05 0.45 1.39 0.00 0.00 0.00 173.10 176.54 1xdm n ILE 267 N 0.84 0.69 -2.55 0.90 5.41 0.10 -2.73 119.36 122.02 1xdm n ILE 267 Ca -0.12 -4.39 -0.41 0.00 1.00 0.00 0.00 62.75 58.83 1xdm n ILE 267 Cb 0.58 -2.01 -0.03 0.00 -0.71 0.00 0.00 39.64 37.47 1xdm n ILE 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1xdm n PHE 269 N 9.17 -2.02 -5.12 0.00 3.01 -1.03 -3.97 117.46 117.50 1xdm n PHE 269 Ca 0.16 0.06 -0.30 0.00 1.01 0.00 0.00 57.45 58.39 1xdm n PHE 269 Cb 0.50 -1.44 -0.17 0.00 -0.01 0.00 0.00 39.48 38.37 1xdm n PHE 269 CO 0.00 0.00 0.00 -0.48 1.01 0.00 0.00 176.76 177.29 1xdm s LEU 270 N 0.10 2.01 0.02 4.37 0.05 -0.88 -0.66 118.68 123.69 1xdm s LEU 270 Ca 0.43 -0.48 -0.19 0.00 0.05 0.00 0.00 54.13 53.93 1xdm s LEU 270 Cb -0.07 -1.27 -0.20 0.00 -2.05 0.00 0.00 46.19 42.61 1xdm s LEU 270 CO 0.46 0.18 1.18 0.77 -0.55 0.00 0.00 176.35 178.39 1xdm h SER 271 N 6.41 0.53 -5.68 1.48 4.64 -1.90 -3.36 113.55 115.66 1xdm h SER 271 Ca -0.27 -0.68 -0.16 0.00 -0.47 0.00 0.00 61.79 60.21 1xdm h SER 271 Cb 1.20 -0.16 0.01 0.00 -0.31 0.00 0.00 62.40 63.14 1xdm h SER 271 CO 0.47 1.12 -0.93 0.61 -0.87 0.00 0.00 176.83 177.23 1xdm n GLY 272 N 0.80 0.08 2.90 -0.77 0.00 -1.26 -2.91 105.19 104.03 1xdm n GLY 272 Ca -0.09 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.40 1xdm n GLY 272 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xdm n GLY 273 N 0.54 0.88 3.88 -0.02 0.00 -1.26 -5.03 105.19 104.18 1xdm n GLY 273 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1xdm n GLY 273 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xdm s MET 274 N -0.06 3.78 0.91 1.61 -1.94 -1.15 -5.05 119.30 117.41 1xdm s MET 274 Ca 0.00 0.29 -0.11 0.00 -1.71 0.00 0.00 55.69 54.16 1xdm s MET 274 Cb 0.00 -2.58 0.14 0.00 2.01 0.00 0.00 34.83 34.40 1xdm s MET 274 CO 0.00 0.22 1.10 -1.54 -0.01 0.00 0.00 175.02 174.79 1xdm s SER 275 N -2.66 3.16 0.55 3.03 1.04 -1.26 -4.58 113.70 112.98 1xdm s SER 275 Ca 0.48 1.76 0.25 0.00 0.48 0.00 0.00 55.95 58.92 1xdm s SER 275 Cb -0.11 -2.38 1.45 0.00 0.10 0.00 0.00 66.02 65.08 1xdm s SER 275 CO 0.24 -2.88 2.03 -0.33 0.98 0.00 0.00 173.24 173.29 1xdm h GLU 276 N -1.71 0.00 0.09 4.02 5.08 -1.89 0.36 114.58 120.53 1xdm h GLU 276 Ca -0.48 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.87 1xdm h GLU 276 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1xdm h GLU 276 CO 0.50 0.00 -0.04 1.49 -1.00 0.00 0.00 179.01 179.95 1xdm h GLU 277 N 0.00 -0.12 -0.90 2.33 4.57 -1.90 -2.89 114.58 115.68 1xdm h GLU 277 Ca 0.18 0.01 0.18 0.00 -1.18 0.00 0.00 59.36 58.55 1xdm h GLU 277 Cb 0.80 0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 29.34 1xdm h GLU 277 CO -0.00 0.17 0.59 -0.44 -1.18 0.00 0.00 179.01 178.14 1xdm h ASP 278 N -1.00 0.52 0.50 1.04 3.32 -1.78 1.09 116.42 120.11 1xdm h ASP 278 Ca -0.01 0.05 -0.08 0.00 0.02 0.00 0.00 57.03 57.00 1xdm h ASP 278 Cb 0.34 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1xdm h ASP 278 CO 0.02 0.22 -0.39 0.00 -1.72 0.00 0.00 179.24 177.37 1xdm h ALA 279 N 1.61 1.23 0.13 3.45 0.00 -1.03 -1.49 119.26 123.17 1xdm h ALA 279 Ca 0.47 -0.36 -0.28 0.00 0.00 0.00 0.00 54.91 54.74 1xdm h ALA 279 Cb 1.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1xdm h ALA 279 CO -0.21 0.49 -1.40 1.15 0.00 0.00 0.00 179.25 179.28 1xdm h THR 280 N 0.00 1.07 0.57 0.00 2.02 0.63 -2.92 112.91 114.28 1xdm h THR 280 Ca -0.00 -2.44 -0.02 0.00 0.77 0.00 0.00 66.41 64.72 1xdm h THR 280 Cb 0.75 2.78 -0.01 0.00 -1.74 0.00 0.00 68.15 69.92 1xdm h THR 280 CO 0.05 0.73 -0.40 -0.07 0.37 0.00 0.00 175.52 176.20 1xdm h LEU 281 N -0.24 -1.04 -1.00 2.58 3.38 0.88 -0.53 115.31 119.33 1xdm h LEU 281 Ca -0.29 0.07 0.03 0.00 0.09 0.00 0.00 57.88 57.78 1xdm h LEU 281 Cb 1.81 0.32 -0.06 0.00 0.09 0.00 0.00 40.66 42.82 1xdm h LEU 281 CO 0.09 -0.60 0.66 0.78 0.09 0.00 0.00 178.44 179.45 1xdm h ASN 282 N -0.94 1.10 -0.35 -0.43 4.21 -1.44 1.07 115.58 118.79 1xdm h ASN 282 Ca -0.07 -0.01 -0.03 0.00 1.21 0.00 0.00 56.30 57.40 1xdm h ASN 282 Cb 0.78 -0.26 -0.01 0.00 -1.12 0.00 0.00 38.32 37.71 1xdm h ASN 282 CO 0.04 0.76 0.11 0.25 -1.29 0.00 0.00 177.43 177.29 1xdm h LEU 283 N 1.28 0.52 0.40 1.61 5.85 -1.38 0.43 115.31 124.01 1xdm h LEU 283 Ca 0.39 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 1xdm h LEU 283 Cb -0.02 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1xdm h LEU 283 CO -0.12 0.59 -0.28 -1.13 -0.34 0.00 0.00 178.44 177.16 1xdm h ASN 284 N 0.42 -0.74 -1.13 1.25 -1.24 -0.13 -1.92 115.58 112.10 1xdm h ASN 284 Ca 0.11 0.05 0.37 0.00 0.71 0.00 0.00 56.30 57.54 1xdm h ASN 284 Cb 0.26 0.23 -0.14 0.00 0.73 0.00 0.00 38.32 39.40 1xdm h ASN 284 CO -0.00 -0.41 0.69 0.00 -1.29 0.00 0.00 177.43 176.41 1xdm h ALA 285 N -1.41 2.32 -0.37 1.57 0.00 0.12 0.75 119.26 122.24 1xdm h ALA 285 Ca -0.05 0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1xdm h ALA 285 Cb 0.53 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1xdm h ALA 285 CO 0.03 -0.93 -0.11 0.82 0.00 0.00 0.00 179.25 179.06 1xdm h ILE 286 N 0.21 1.25 -0.00 0.00 2.04 -0.32 -0.72 117.51 119.96 1xdm h ILE 286 Ca 0.76 -1.10 0.00 0.00 1.00 0.00 0.00 64.86 65.52 1xdm h ILE 286 Cb 2.06 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 39.22 1xdm h ILE 286 CO -0.51 0.37 -0.03 0.59 0.00 0.00 0.00 178.15 178.57 1xdm n ASN 287 N -4.18 0.44 -0.42 1.72 4.13 0.25 -3.07 115.26 114.13 1xdm n ASN 287 Ca 0.01 -0.89 0.05 0.00 1.68 0.00 0.00 54.58 55.43 1xdm n ASN 287 Cb 0.34 -0.05 0.07 0.00 -1.54 0.00 0.00 39.78 38.60 1xdm n ASN 287 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1xdm n LEU 288 N -0.78 2.10 -4.75 3.41 4.77 -0.59 -4.80 117.00 116.35 1xdm n LEU 288 Ca 0.19 -1.33 -0.41 0.00 -0.03 0.00 0.00 56.01 54.43 1xdm n LEU 288 Cb 0.22 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.22 1xdm n LEU 288 CO 0.20 0.46 0.96 0.00 -1.33 0.00 0.00 177.39 177.68 1xdm n PRO 290 N 1.98 2.48 -4.36 0.00 -0.04 -1.26 -4.87 135.00 128.92 1xdm n PRO 290 Ca 0.04 -1.52 -0.28 0.00 -0.04 0.00 0.00 63.50 61.70 1xdm n PRO 290 Cb 0.43 -2.19 -0.06 0.00 -0.04 0.00 0.00 33.50 31.63 1xdm n PRO 290 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1xdm n LEU 291 N 2.42 0.00 -4.84 1.53 7.99 -1.26 -5.12 117.00 117.72 1xdm n LEU 291 Ca 0.51 -2.87 -0.32 0.00 -0.01 0.00 0.00 56.01 53.33 1xdm n LEU 291 Cb 0.71 0.46 -0.04 0.00 -0.11 0.00 0.00 43.42 44.44 1xdm n LEU 291 CO 0.31 -0.41 0.61 -2.84 -1.51 0.00 0.00 177.39 173.55 1xdm s PRO 292 N -3.60 3.99 -0.46 3.23 0.02 -1.26 -4.99 135.00 131.93 1xdm s PRO 292 Ca 0.04 0.89 0.04 0.00 0.02 0.00 0.00 61.00 61.99 1xdm s PRO 292 Cb 0.00 -2.21 0.22 0.00 0.02 0.00 0.00 34.50 32.53 1xdm s PRO 292 CO 0.03 -0.15 0.89 1.63 -0.33 0.00 0.00 177.00 179.08 1xdm n LYS 293 N -1.23 0.51 0.00 5.54 5.02 -1.26 -4.78 118.16 121.96 1xdm n LYS 293 Ca 0.06 -1.61 0.03 0.00 -2.02 0.00 0.00 58.31 54.77 1xdm n LYS 293 Cb 0.54 -1.11 0.19 0.00 -0.02 0.00 0.00 35.03 34.63 1xdm n LYS 293 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1xdm n PRO 294 N 2.30 0.26 -3.92 1.97 -0.04 -1.26 -4.69 135.00 129.62 1xdm n PRO 294 Ca 0.12 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.46 1xdm n PRO 294 Cb 0.61 -1.38 -0.14 0.00 -0.04 0.00 0.00 33.50 32.56 1xdm n PRO 294 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 1xdm s TRP 295 N -2.00 0.09 -0.37 0.54 -0.00 -1.26 -4.96 118.94 110.98 1xdm s TRP 295 Ca 0.10 -0.08 -0.40 0.00 -0.00 0.00 0.00 56.10 55.71 1xdm s TRP 295 Cb 0.04 -0.06 -0.16 0.00 -0.00 0.00 0.00 33.47 33.30 1xdm s TRP 295 CO 0.07 -0.03 1.94 1.63 -0.00 0.00 0.00 176.95 180.57 1xdm n LYS 296 N 2.86 0.79 -3.27 3.25 4.76 -1.22 -4.75 118.16 120.59 1xdm n LYS 296 Ca -0.14 0.26 -0.45 0.00 -2.87 0.00 0.00 58.31 55.11 1xdm n LYS 296 Cb 0.59 -2.03 -0.06 0.00 -1.84 0.00 0.00 35.03 31.70 1xdm n LYS 296 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1xdm s LEU 297 N 5.07 5.64 0.00 -0.35 1.43 -1.26 0.02 118.68 129.23 1xdm s LEU 297 Ca 1.07 -1.42 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 1xdm s LEU 297 Cb -1.14 -2.26 0.00 0.00 0.03 0.00 0.00 46.19 42.82 1xdm s LEU 297 CO 0.63 -0.85 0.00 -0.24 0.23 0.00 0.00 176.35 176.12 1xdm n SER 298 N 5.61 0.00 -3.94 2.29 2.88 -0.85 -4.69 113.62 114.92 1xdm n SER 298 Ca -0.11 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.35 1xdm n SER 298 Cb 0.43 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.80 1xdm n SER 298 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1xdm s PHE 299 N 3.29 0.28 -0.42 0.66 -0.71 -1.26 -2.45 117.98 117.36 1xdm s PHE 299 Ca 0.00 -0.75 0.09 0.00 -1.04 0.00 0.00 56.93 55.22 1xdm s PHE 299 Cb 0.00 -0.18 0.32 0.00 -1.21 0.00 0.00 43.02 41.95 1xdm s PHE 299 CO 0.00 -0.49 0.89 0.45 -1.34 0.00 0.00 175.22 174.73 1xdm n SER 300 N -0.00 -0.89 -4.88 1.98 2.88 0.17 -1.29 113.62 111.59 1xdm n SER 300 Ca -0.15 -3.30 -0.31 0.00 -1.33 0.00 0.00 58.87 53.79 1xdm n SER 300 Cb 0.62 0.66 -0.05 0.00 -0.75 0.00 0.00 64.21 64.69 1xdm n SER 300 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1xdm s TYR 301 N -0.91 3.44 0.00 0.66 4.12 -1.11 -4.53 117.35 119.01 1xdm s TYR 301 Ca 0.31 0.93 0.00 0.00 0.02 0.00 0.00 57.07 58.33 1xdm s TYR 301 Cb 0.30 -2.32 0.00 0.00 -1.52 0.00 0.00 41.96 38.42 1xdm s TYR 301 CO -0.09 0.13 0.00 0.41 0.02 0.00 0.00 175.55 176.02 1xdm n GLY 302 N -0.61 0.34 0.30 0.71 0.00 -1.26 -0.88 105.19 103.79 1xdm n GLY 302 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 1xdm n GLY 302 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1xdm h ARG 303 N 0.00 -0.10 0.00 1.61 -0.00 -1.96 0.17 114.38 114.11 1xdm h ARG 303 Ca 0.00 0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.49 1xdm h ARG 303 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 29.97 29.99 1xdm h ARG 303 CO 0.00 -0.06 0.04 0.00 0.00 0.00 0.00 179.97 179.95 1xdm n ALA 304 N -3.12 0.93 0.06 0.04 0.00 -1.26 -1.79 120.51 115.36 1xdm n ALA 304 Ca 0.06 0.03 0.02 0.00 0.00 0.00 0.00 53.44 53.55 1xdm n ALA 304 Cb 0.35 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.80 1xdm n ALA 304 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1xdm n LEU 305 N -1.58 0.06 -0.09 0.00 4.77 0.47 -4.59 117.00 116.04 1xdm n LEU 305 Ca -0.00 -0.14 -0.19 0.00 -0.03 0.00 0.00 56.01 55.65 1xdm n LEU 305 Cb 0.05 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.07 1xdm n LEU 305 CO 0.01 0.01 -1.11 0.00 -1.33 0.00 0.00 177.39 174.98 1xdm n GLN 306 N -1.50 0.38 0.00 3.23 6.02 -0.40 -4.68 117.38 120.42 1xdm n GLN 306 Ca -0.00 0.16 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 1xdm n GLN 306 Cb 0.10 -1.13 0.00 0.00 1.02 0.00 0.00 30.24 30.23 1xdm n GLN 306 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xdm n ALA 307 N -3.77 0.00 -0.06 -1.58 0.00 -0.76 0.05 120.51 114.39 1xdm n ALA 307 Ca -0.35 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 52.98 1xdm n ALA 307 Cb 0.75 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.15 1xdm n ALA 307 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1xdm h SER 308 N 0.00 0.32 0.55 0.00 4.64 -1.87 -1.44 113.55 115.75 1xdm h SER 308 Ca 0.00 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1xdm h SER 308 Cb 0.00 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1xdm h SER 308 CO 0.00 0.49 0.00 0.00 -0.87 0.00 0.00 176.83 176.45 1xdm n ALA 309 N -2.29 1.54 0.01 5.18 0.00 0.11 -1.55 120.51 123.50 1xdm n ALA 309 Ca -0.04 0.08 0.01 0.00 0.00 0.00 0.00 53.44 53.49 1xdm n ALA 309 Cb 0.18 -1.34 -0.10 0.00 0.00 0.00 0.00 19.45 18.20 1xdm n ALA 309 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1xdm n LEU 310 N -2.09 0.62 0.04 0.00 7.94 -0.22 -3.56 117.00 119.73 1xdm n LEU 310 Ca 0.02 0.27 -0.04 0.00 -1.11 0.00 0.00 56.01 55.14 1xdm n LEU 310 Cb 0.18 0.12 -0.09 0.00 0.53 0.00 0.00 43.42 44.16 1xdm n LEU 310 CO 0.16 0.15 -0.09 0.00 -1.11 0.00 0.00 177.39 176.51 1xdm h ALA 311 N 1.48 0.60 0.00 1.96 0.00 -0.63 -2.88 119.26 119.79 1xdm h ALA 311 Ca -0.19 -0.97 -0.10 0.00 0.00 0.00 0.00 54.91 53.65 1xdm h ALA 311 Cb 1.56 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 1xdm h ALA 311 CO 0.03 1.16 -0.46 0.00 0.00 0.00 0.00 179.25 179.98 1xdm h ALA 312 N 1.19 1.11 0.00 0.00 0.00 -1.42 -3.25 119.26 116.89 1xdm h ALA 312 Ca -0.12 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.33 1xdm h ALA 312 Cb 1.73 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.44 1xdm h ALA 312 CO 0.08 0.57 -0.26 2.35 0.00 0.00 0.00 179.25 181.99 1xdm h TRP 313 N 0.00 0.00 -1.15 0.00 7.01 -1.63 -3.42 115.95 116.76 1xdm h TRP 313 Ca -0.00 0.00 -0.18 0.00 2.11 0.00 0.00 58.89 60.82 1xdm h TRP 313 Cb 0.88 0.00 -0.07 0.00 -2.10 0.00 0.00 29.16 27.87 1xdm h TRP 313 CO 0.00 0.71 -0.16 0.41 -2.79 0.00 0.00 178.44 176.61 1xdm n GLY 314 N 1.63 0.82 0.00 2.65 0.00 -1.09 -1.62 105.19 107.58 1xdm n GLY 314 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1xdm n GLY 314 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xdm n GLY 315 N -0.04 3.06 3.51 -0.02 0.00 -1.26 -4.92 105.19 105.51 1xdm n GLY 315 Ca -0.09 -0.86 -0.16 0.00 0.00 0.00 0.00 46.02 44.92 1xdm n GLY 315 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xdm n LYS 316 N 0.00 0.28 0.00 1.61 5.02 -0.64 -4.65 118.16 119.78 1xdm n LYS 316 Ca 0.00 -0.53 0.00 0.00 -2.02 0.00 0.00 58.31 55.76 1xdm n LYS 316 Cb 0.00 -2.51 0.00 0.00 -0.02 0.00 0.00 35.03 32.50 1xdm n LYS 316 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xdm n ALA 317 N 12.88 1.11 0.95 7.82 0.00 -1.26 0.25 120.51 142.26 1xdm n ALA 317 Ca 0.52 0.00 0.10 0.00 0.00 0.00 0.00 53.44 54.06 1xdm n ALA 317 Cb 0.32 -0.88 -0.12 0.00 0.00 0.00 0.00 19.45 18.78 1xdm n ALA 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xdm n ALA 318 N -0.02 4.64 -1.40 0.00 0.00 -1.26 -4.29 120.51 118.18 1xdm n ALA 318 Ca 0.00 -0.58 -0.30 0.00 0.00 0.00 0.00 53.44 52.56 1xdm n ALA 318 Cb 0.00 -0.74 0.10 0.00 0.00 0.00 0.00 19.45 18.80 1xdm n ALA 318 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1xdm n ASN 319 N -1.50 6.47 -0.20 0.00 3.02 0.14 -4.72 115.26 118.47 1xdm n ASN 319 Ca 0.04 -3.76 -0.00 0.00 -0.03 0.00 0.00 54.58 50.83 1xdm n ASN 319 Cb 0.32 -0.87 0.10 0.00 -0.61 0.00 0.00 39.78 38.73 1xdm n ASN 319 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1xdm h LYS 320 N 1.80 0.37 0.39 3.52 3.64 -1.78 -1.58 116.57 122.93 1xdm h LYS 320 Ca 0.57 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.91 1xdm h LYS 320 Cb 1.29 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1xdm h LYS 320 CO 1.36 0.25 -0.19 0.93 -2.27 0.00 0.00 179.45 179.53 1xdm h GLU 321 N 0.38 -0.50 -1.15 1.90 5.08 -1.96 -2.53 114.58 115.80 1xdm h GLU 321 Ca 0.30 0.03 0.40 0.00 -1.00 0.00 0.00 59.36 59.09 1xdm h GLU 321 Cb 0.37 0.11 -0.15 0.00 0.50 0.00 0.00 28.75 29.59 1xdm h GLU 321 CO -0.31 -0.34 0.69 0.00 -1.00 0.00 0.00 179.01 178.06 1xdm h ALA 322 N -1.38 2.38 -0.05 3.43 0.00 -1.91 0.77 119.26 122.49 1xdm h ALA 322 Ca -0.05 0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 1xdm h ALA 322 Cb 0.40 0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.43 1xdm h ALA 322 CO 0.09 -1.05 -0.54 1.15 0.00 0.00 0.00 179.25 178.90 1xdm h THR 323 N 0.12 1.39 0.00 0.00 2.02 -1.35 -3.26 112.91 111.83 1xdm h THR 323 Ca 0.81 -1.94 0.00 0.00 0.77 0.00 0.00 66.41 66.05 1xdm h THR 323 Cb 2.25 2.38 0.00 0.00 -1.74 0.00 0.00 68.15 71.04 1xdm h THR 323 CO -0.56 0.57 0.00 1.56 0.37 0.00 0.00 175.52 177.46 1xdm h GLN 324 N 0.01 0.00 0.42 6.66 4.20 -0.41 -3.14 115.11 122.85 1xdm h GLN 324 Ca -0.05 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 1xdm h GLN 324 Cb 1.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.00 1xdm h GLN 324 CO 0.11 0.00 -0.20 0.93 -0.67 0.00 0.00 178.83 179.00 1xdm h GLU 325 N 0.00 -0.54 0.00 1.46 4.39 -1.41 0.22 114.58 118.69 1xdm h GLU 325 Ca 0.00 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.74 1xdm h GLU 325 Cb 0.31 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 1xdm h GLU 325 CO 0.00 -0.36 0.52 0.00 -1.16 0.00 0.00 179.01 178.01 1xdm h ALA 326 N -1.49 1.45 0.01 3.43 0.00 -1.63 0.57 119.26 121.60 1xdm h ALA 326 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 54.91 54.47 1xdm h ALA 326 Cb 0.43 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.16 1xdm h ALA 326 CO 0.09 -0.45 -2.42 0.34 0.00 0.00 0.00 179.25 176.82 1xdm n PHE 327 N -2.35 0.10 0.26 0.00 7.35 -1.15 -3.72 117.46 117.94 1xdm n PHE 327 Ca -0.01 0.02 0.13 0.00 -0.76 0.00 0.00 57.45 56.84 1xdm n PHE 327 Cb 0.54 -1.01 0.67 0.00 0.35 0.00 0.00 39.48 40.03 1xdm n PHE 327 CO 0.00 0.00 0.00 0.52 -0.76 0.00 0.00 176.76 176.52 1xdm h MET 328 N 0.00 0.00 0.00 -4.13 2.86 0.33 -1.59 114.93 112.41 1xdm h MET 328 Ca -0.56 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.03 1xdm h MET 328 Cb 1.98 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.64 1xdm h MET 328 CO -0.05 0.13 -0.29 -0.22 1.06 0.00 0.00 176.91 177.53 1xdm h LYS 329 N 0.00 0.00 -0.13 1.72 3.64 -0.81 -3.06 116.57 117.93 1xdm h LYS 329 Ca -0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1xdm h LYS 329 Cb 0.48 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 1xdm h LYS 329 CO 0.02 0.85 -0.01 0.00 -2.27 0.00 0.00 179.45 178.04 1xdm h ARG 330 N -1.00 0.18 -0.23 1.90 2.47 -1.63 0.81 114.38 116.88 1xdm h ARG 330 Ca -0.08 -0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 58.60 1xdm h ARG 330 Cb 0.94 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 29.21 1xdm h ARG 330 CO -0.05 0.22 0.08 0.00 0.56 0.00 0.00 179.97 180.78 1xdm h ALA 331 N 1.81 0.30 -0.01 0.04 0.00 -1.39 -0.64 119.26 119.37 1xdm h ALA 331 Ca 0.04 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.62 1xdm h ALA 331 Cb 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1xdm h ALA 331 CO 0.00 -0.09 -0.88 0.52 0.00 0.00 0.00 179.25 178.80 1xdm h MET 332 N 0.20 0.30 0.19 0.00 2.86 -1.28 -3.06 114.93 114.14 1xdm h MET 332 Ca 0.07 -0.31 -0.01 0.00 -2.06 0.00 0.00 59.70 57.40 1xdm h MET 332 Cb 0.21 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 1xdm h MET 332 CO -0.00 1.01 -0.19 0.00 1.06 0.00 0.00 176.91 178.78 1xdm h ALA 333 N 0.88 -0.90 0.00 6.32 0.00 0.89 -1.32 119.26 125.13 1xdm h ALA 333 Ca -0.06 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1xdm h ALA 333 Cb 1.51 0.44 0.00 0.00 0.00 0.00 0.00 17.79 19.73 1xdm h ALA 333 CO 0.14 -0.91 0.00 0.09 0.00 0.00 0.00 179.25 178.57 1xdm n ASN 334 N -3.48 0.00 -0.09 0.00 3.02 -0.27 -1.40 115.26 113.04 1xdm n ASN 334 Ca -0.05 -0.30 -0.19 0.00 -0.03 0.00 0.00 54.58 54.02 1xdm n ASN 334 Cb 0.17 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.22 1xdm n ASN 334 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xdm h GLN 336 N -1.00 0.36 -0.87 0.00 4.20 -0.42 0.26 115.11 117.64 1xdm h GLN 336 Ca -0.22 -0.05 0.04 0.00 0.06 0.00 0.00 58.65 58.48 1xdm h GLN 336 Cb 1.19 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.85 1xdm h GLN 336 CO -0.13 0.33 0.57 0.00 -0.67 0.00 0.00 178.83 178.93 1xdm h ALA 337 N 1.72 1.47 0.00 3.87 0.00 -1.33 0.80 119.26 125.79 1xdm h ALA 337 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1xdm h ALA 337 Cb 0.13 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1xdm h ALA 337 CO -0.00 0.44 0.00 0.00 0.00 0.00 0.00 179.25 179.68 1xdm n ALA 338 N -2.40 2.13 0.42 0.00 0.00 -0.03 -2.51 120.51 118.12 1xdm n ALA 338 Ca 0.12 -0.02 0.11 0.00 0.00 0.00 0.00 53.44 53.65 1xdm n ALA 338 Cb 0.12 -1.44 0.04 0.00 0.00 0.00 0.00 19.45 18.17 1xdm n ALA 338 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xdm n LYS 339 N -2.06 0.39 -1.66 0.00 4.76 0.23 -4.86 118.16 114.96 1xdm n LYS 339 Ca 0.05 0.04 -0.08 0.00 -2.87 0.00 0.00 58.31 55.45 1xdm n LYS 339 Cb 0.36 -1.67 -0.02 0.00 -1.84 0.00 0.00 35.03 31.86 1xdm n LYS 339 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xdm n GLY 340 N 1.31 0.53 0.03 0.72 0.00 0.14 -4.89 105.19 103.02 1xdm n GLY 340 Ca 0.01 -0.64 0.02 0.00 0.00 0.00 0.00 46.02 45.41 1xdm n GLY 340 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xdm n GLN 341 N -2.28 4.81 -2.17 1.61 6.02 -0.41 -4.95 117.38 120.01 1xdm n GLN 341 Ca -0.08 -0.10 -0.39 0.00 -0.01 0.00 0.00 57.00 56.41 1xdm n GLN 341 Cb 0.40 -0.75 -0.02 0.00 1.02 0.00 0.00 30.24 30.89 1xdm n GLN 341 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1xdm s TYR 342 N -1.28 3.00 -0.11 1.08 5.04 -1.16 -4.94 117.35 118.98 1xdm s TYR 342 Ca 0.02 1.48 0.01 0.00 -2.44 0.00 0.00 57.07 56.14 1xdm s TYR 342 Cb 0.03 -3.56 0.02 0.00 0.35 0.00 0.00 41.96 38.80 1xdm s TYR 342 CO 0.16 -1.69 -0.14 0.08 -1.34 0.00 0.00 175.55 172.62 1xdm s VAL 343 N -1.27 1.42 -2.00 3.14 1.01 -1.26 -4.96 120.40 116.48 1xdm s VAL 343 Ca 0.54 -0.59 0.16 0.00 0.00 0.00 0.00 61.98 62.10 1xdm s VAL 343 Cb -0.36 -1.31 0.46 0.00 0.00 0.00 0.00 36.38 35.18 1xdm s VAL 343 CO 0.46 0.43 1.38 1.57 0.00 0.00 0.00 175.10 178.94