#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xxm h PRO 27 N 0.00 0.28 -0.86 1.57 0.11 -1.98 -2.29 132.00 128.83 1xxm h PRO 27 Ca 0.00 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 66.14 1xxm h PRO 27 Cb 0.00 -0.06 -0.06 0.00 0.11 0.00 0.00 31.00 30.99 1xxm h PRO 27 CO 0.00 0.19 0.55 0.93 -0.21 0.00 0.00 178.00 179.45 1xxm h GLU 28 N 0.29 1.01 -0.70 1.05 4.39 -2.00 -1.40 114.58 117.22 1xxm h GLU 28 Ca 0.39 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.99 1xxm h GLU 28 Cb 1.09 -0.23 -0.03 0.00 -0.10 0.00 0.00 28.75 29.48 1xxm h GLU 28 CO -0.10 0.67 0.28 1.15 -1.16 0.00 0.00 179.01 179.84 1xxm h THR 29 N 1.04 1.24 -0.07 1.13 2.02 -1.74 -1.23 112.91 115.30 1xxm h THR 29 Ca 0.36 -0.75 -0.04 0.00 0.77 0.00 0.00 66.41 66.75 1xxm h THR 29 Cb 0.08 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 66.88 1xxm h THR 29 CO -0.14 0.30 -0.13 -0.07 0.37 0.00 0.00 175.52 175.85 1xxm h LEU 30 N 1.01 0.09 -0.74 2.58 4.07 -1.33 -0.89 115.31 120.10 1xxm h LEU 30 Ca 0.24 -0.02 -0.09 0.00 0.08 0.00 0.00 57.88 58.09 1xxm h LEU 30 Cb 0.19 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 41.89 1xxm h LEU 30 CO -0.02 0.24 -0.06 0.58 -1.08 0.00 0.00 178.44 178.10 1xxm h VAL 31 N 0.10 1.26 -0.18 1.22 2.07 -0.47 -2.16 116.25 118.09 1xxm h VAL 31 Ca 0.02 -1.15 -0.15 0.00 0.82 0.00 0.00 66.70 66.24 1xxm h VAL 31 Cb 0.30 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1xxm h VAL 31 CO 0.02 0.40 -0.52 0.50 0.02 0.00 0.00 177.57 178.00 1xxm h LYS 32 N 0.82 0.49 -0.24 1.57 1.63 -0.78 -1.68 116.57 118.39 1xxm h LYS 32 Ca 0.14 -0.30 -0.02 0.00 -0.85 0.00 0.00 60.65 59.63 1xxm h LYS 32 Cb 0.57 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.22 1xxm h LYS 32 CO 0.03 0.89 0.08 0.28 -3.45 0.00 0.00 179.45 177.28 1xxm h VAL 33 N 0.39 1.19 -0.18 2.00 2.07 -0.96 0.12 116.25 120.87 1xxm h VAL 33 Ca 0.01 -0.61 -0.07 0.00 0.82 0.00 0.00 66.70 66.85 1xxm h VAL 33 Cb 1.04 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1xxm h VAL 33 CO 0.09 0.20 -0.22 0.50 0.02 0.00 0.00 177.57 178.17 1xxm h LYS 34 N 0.22 0.32 -0.83 1.57 3.64 -1.38 -1.95 116.57 118.17 1xxm h LYS 34 Ca 0.08 -0.10 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 1xxm h LYS 34 Cb 0.23 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.99 1xxm h LYS 34 CO -0.00 0.53 0.37 0.22 -2.27 0.00 0.00 179.45 178.29 1xxm h ASP 35 N 0.29 1.11 -0.72 4.20 -0.00 -0.72 -1.85 116.42 118.73 1xxm h ASP 35 Ca 0.05 -0.15 0.00 0.00 -0.00 0.00 0.00 57.03 56.93 1xxm h ASP 35 Cb 0.55 -0.29 -0.04 0.00 -0.00 0.00 0.00 39.33 39.56 1xxm h ASP 35 CO 0.04 0.95 0.47 0.00 -0.00 0.00 0.00 179.24 180.70 1xxm h ALA 36 N 1.20 0.92 -0.46 -0.78 0.00 -0.04 -1.02 119.26 119.08 1xxm h ALA 36 Ca 0.28 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1xxm h ALA 36 Cb 0.16 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1xxm h ALA 36 CO -0.03 0.36 0.29 0.93 0.00 0.00 0.00 179.25 180.80 1xxm h GLU 37 N 0.98 0.57 -0.59 0.00 5.08 -0.88 0.41 114.58 120.16 1xxm h GLU 37 Ca 0.26 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.57 1xxm h GLU 37 Cb -0.09 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.00 1xxm h GLU 37 CO -0.05 0.38 0.27 -0.44 -1.00 0.00 0.00 179.01 178.17 1xxm h ASP 38 N 0.59 0.78 0.88 1.42 3.32 -0.87 0.26 116.42 122.81 1xxm h ASP 38 Ca 0.17 -0.14 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 1xxm h ASP 38 Cb -0.04 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 1xxm h ASP 38 CO -0.06 0.70 -0.50 1.56 -1.72 0.00 0.00 179.24 179.22 1xxm h GLN 39 N 0.81 0.00 0.00 3.56 4.20 -0.90 -3.21 115.11 119.57 1xxm h GLN 39 Ca 0.20 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.90 1xxm h GLN 39 Cb 0.14 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.91 1xxm h GLN 39 CO -0.02 0.50 -1.38 1.28 -0.67 0.00 0.00 178.83 178.54 1xxm n LEU 40 N -3.55 0.55 -2.06 1.46 4.77 0.11 -4.97 117.00 113.31 1xxm n LEU 40 Ca -0.00 0.21 -0.14 0.00 -0.03 0.00 0.00 56.01 56.05 1xxm n LEU 40 Cb 0.60 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.69 1xxm n LEU 40 CO 0.39 -0.10 0.05 0.61 -1.33 0.00 0.00 177.39 177.01 1xxm n GLY 41 N 1.22 -0.01 3.41 -0.72 0.00 0.90 -4.24 105.19 105.75 1xxm n GLY 41 Ca -0.02 -0.19 -0.11 0.00 0.00 0.00 0.00 46.02 45.69 1xxm n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xxm s ALA 42 N -3.01 -1.33 0.39 4.61 0.00 -1.09 -4.61 121.76 116.72 1xxm s ALA 42 Ca 0.24 0.24 -0.25 0.00 0.00 0.00 0.00 51.96 52.19 1xxm s ALA 42 Cb -0.11 0.83 -0.09 0.00 0.00 0.00 0.00 23.12 23.75 1xxm s ALA 42 CO 0.30 -0.75 1.06 1.03 0.00 0.00 0.00 175.76 177.41 1xxm s ARG 43 N -3.78 4.20 -0.08 0.00 0.52 -1.26 -4.34 118.95 114.22 1xxm s ARG 43 Ca 0.03 1.57 0.03 0.00 -0.52 0.00 0.00 55.73 56.84 1xxm s ARG 43 Cb -0.00 -2.62 0.00 0.00 0.52 0.00 0.00 34.95 32.85 1xxm s ARG 43 CO -0.11 -0.12 -0.18 0.08 0.02 0.00 0.00 175.30 174.98 1xxm s VAL 44 N -1.58 1.60 -0.14 3.52 1.01 -1.26 -3.26 120.40 120.29 1xxm s VAL 44 Ca 0.56 -0.76 -0.05 0.00 0.00 0.00 0.00 61.98 61.73 1xxm s VAL 44 Cb -0.24 -1.40 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 1xxm s VAL 44 CO 0.30 0.46 0.02 -0.83 0.00 0.00 0.00 175.10 175.05 1xxm s GLY 45 N 0.40 1.85 -0.03 4.51 0.00 0.21 -4.64 107.32 109.62 1xxm s GLY 45 Ca -0.14 -0.78 -0.05 0.00 0.00 0.00 0.00 44.72 43.75 1xxm s GLY 45 CO 0.06 -0.21 0.12 -0.47 0.00 0.00 0.00 173.10 172.60 1xxm s TYR 46 N -0.13 -0.06 -0.21 1.90 5.04 -0.31 -1.15 117.35 122.44 1xxm s TYR 46 Ca 0.05 0.14 -0.16 0.00 -2.44 0.00 0.00 57.07 54.66 1xxm s TYR 46 Cb -0.12 0.00 0.06 0.00 0.35 0.00 0.00 41.96 42.25 1xxm s TYR 46 CO 0.02 -0.15 0.54 0.42 -1.34 0.00 0.00 175.55 175.04 1xxm s ILE 47 N -0.50 -0.01 -0.18 3.14 1.01 -0.65 -0.90 121.20 123.12 1xxm s ILE 47 Ca -0.06 0.03 0.01 0.00 0.00 0.00 0.00 60.65 60.63 1xxm s ILE 47 Cb -0.04 -0.77 0.02 0.00 0.01 0.00 0.00 42.46 41.69 1xxm s ILE 47 CO 0.01 0.01 -0.20 -0.70 0.00 0.00 0.00 174.94 174.06 1xxm s GLU 48 N 0.89 2.95 0.10 2.79 2.12 -0.50 -1.34 118.70 125.71 1xxm s GLU 48 Ca -0.05 -0.83 0.10 0.00 0.36 0.00 0.00 54.97 54.55 1xxm s GLU 48 Cb -0.05 -2.56 -0.04 0.00 0.26 0.00 0.00 34.13 31.74 1xxm s GLU 48 CO -0.08 -0.22 -0.25 -1.17 -0.54 0.00 0.00 175.26 173.00 1xxm s LEU 49 N 1.29 2.35 -0.30 2.70 2.96 0.99 -0.60 118.68 128.07 1xxm s LEU 49 Ca 0.05 -0.67 -0.27 0.00 -0.22 0.00 0.00 54.13 53.02 1xxm s LEU 49 Cb -0.13 -1.29 0.01 0.00 0.50 0.00 0.00 46.19 45.27 1xxm s LEU 49 CO -0.13 0.20 0.95 -0.62 -1.32 0.00 0.00 176.35 175.43 1xxm s ASP 50 N -1.85 6.83 0.28 3.68 -1.08 -0.63 -0.58 116.67 123.32 1xxm s ASP 50 Ca 0.14 0.92 0.00 0.00 -0.52 0.00 0.00 52.55 53.09 1xxm s ASP 50 Cb -0.10 -2.48 0.51 0.00 -1.46 0.00 0.00 42.92 39.39 1xxm s ASP 50 CO 0.06 -0.75 1.84 0.25 0.52 0.00 0.00 175.17 177.09 1xxm h LEU 51 N 9.75 0.92 0.20 -1.34 5.85 -1.42 0.49 115.31 129.76 1xxm h LEU 51 Ca -0.22 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 1xxm h LEU 51 Cb 1.08 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.96 1xxm h LEU 51 CO 0.96 0.51 -0.10 0.78 -0.34 0.00 0.00 178.44 180.26 1xxm h ASN 52 N 1.00 -0.23 0.12 1.25 2.35 -1.92 -3.38 115.58 114.78 1xxm h ASN 52 Ca 0.48 0.01 -0.17 0.00 -0.55 0.00 0.00 56.30 56.06 1xxm h ASN 52 Cb 0.43 0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.85 1xxm h ASN 52 CO -0.25 -0.00 -0.64 0.77 -1.65 0.00 0.00 177.43 175.65 1xxm h SER 53 N -0.59 0.58 0.00 5.81 4.64 -1.94 -3.47 113.55 118.57 1xxm h SER 53 Ca -0.03 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1xxm h SER 53 Cb 0.21 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1xxm h SER 53 CO 0.05 1.07 0.00 0.61 -0.87 0.00 0.00 176.83 177.69 1xxm n GLY 54 N 0.41 0.70 3.80 -0.77 0.00 0.17 -5.02 105.19 104.49 1xxm n GLY 54 Ca -0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 1xxm n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xxm s LYS 55 N -0.38 4.35 -0.09 1.61 1.02 -1.26 -4.74 119.74 120.27 1xxm s LYS 55 Ca 0.00 0.96 -0.30 0.00 0.02 0.00 0.00 55.97 56.65 1xxm s LYS 55 Cb 0.00 -3.03 -0.03 0.00 -0.52 0.00 0.00 37.83 34.25 1xxm s LYS 55 CO 0.00 0.47 1.33 0.42 -0.92 0.00 0.00 175.35 176.65 1xxm s ILE 56 N -1.37 4.07 -0.18 2.17 1.01 -1.26 -1.61 121.20 124.03 1xxm s ILE 56 Ca 0.39 1.35 0.19 0.00 0.00 0.00 0.00 60.65 62.59 1xxm s ILE 56 Cb -0.19 -3.87 -0.04 0.00 0.01 0.00 0.00 42.46 38.37 1xxm s ILE 56 CO 0.22 -0.07 1.02 -0.07 0.00 0.00 0.00 174.94 176.05 1xxm h LEU 57 N 9.14 0.00 -7.00 2.97 3.38 -1.21 -3.48 115.31 119.11 1xxm h LEU 57 Ca -0.32 0.00 0.18 0.00 0.09 0.00 0.00 57.88 57.83 1xxm h LEU 57 Cb 1.14 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.59 1xxm h LEU 57 CO 0.93 0.34 0.83 -1.83 0.09 0.00 0.00 178.44 178.80 1xxm s GLU 58 N -3.10 0.14 0.19 1.13 -1.05 -1.19 -4.55 118.70 110.28 1xxm s GLU 58 Ca -0.01 0.12 -0.10 0.00 -0.15 0.00 0.00 54.97 54.84 1xxm s GLU 58 Cb 0.09 0.07 -0.01 0.00 -0.44 0.00 0.00 34.13 33.84 1xxm s GLU 58 CO 0.79 -0.03 0.34 -1.54 0.95 0.00 0.00 175.26 175.77 1xxm s SER 59 N -0.25 -0.01 -0.22 0.83 1.04 -1.26 -1.42 113.70 112.41 1xxm s SER 59 Ca 0.07 -0.90 -0.07 0.00 0.48 0.00 0.00 55.95 55.53 1xxm s SER 59 Cb -0.04 0.48 0.11 0.00 0.10 0.00 0.00 66.02 66.67 1xxm s SER 59 CO -0.12 -0.97 0.46 0.12 0.98 0.00 0.00 173.24 173.72 1xxm s PHE 60 N -3.99 -0.93 -1.41 5.02 5.36 -0.08 -4.89 117.98 117.06 1xxm s PHE 60 Ca 0.20 1.61 -0.04 0.00 -0.96 0.00 0.00 56.93 57.74 1xxm s PHE 60 Cb 0.02 0.38 0.03 0.00 -0.34 0.00 0.00 43.02 43.11 1xxm s PHE 60 CO 0.03 -0.55 0.66 0.54 -1.46 0.00 0.00 175.22 174.44 1xxm n ARG 61 N 5.40 -4.31 0.29 10.12 1.74 -1.26 -1.16 116.66 127.47 1xxm n ARG 61 Ca -0.08 0.52 0.16 0.00 -0.77 0.00 0.00 57.85 57.67 1xxm n ARG 61 Cb 0.49 -5.00 0.86 0.00 -1.02 0.00 0.00 32.46 27.80 1xxm n ARG 61 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1xxm h PRO 62 N -1.87 0.00 -0.26 5.56 0.13 -1.90 -2.96 132.00 130.70 1xxm h PRO 62 Ca -0.61 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 1xxm h PRO 62 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1xxm h PRO 62 CO 0.62 0.06 0.00 0.39 -0.23 0.00 0.00 178.00 178.84 1xxm n GLU 63 N -3.56 2.84 -3.63 0.86 1.02 -1.26 -1.94 120.64 114.98 1xxm n GLU 63 Ca -0.02 -2.63 -0.32 0.00 -0.02 0.00 0.00 57.16 54.16 1xxm n GLU 63 Cb 0.17 -1.69 -0.05 0.00 -0.02 0.00 0.00 31.44 29.85 1xxm n GLU 63 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1xxm s GLU 64 N -2.39 3.67 0.20 3.49 2.02 -1.12 -4.99 118.70 119.58 1xxm s GLU 64 Ca 0.37 0.01 -0.19 0.00 0.02 0.00 0.00 54.97 55.17 1xxm s GLU 64 Cb 0.28 -2.87 -0.08 0.00 0.10 0.00 0.00 34.13 31.57 1xxm s GLU 64 CO 0.10 0.48 0.69 1.03 0.02 0.00 0.00 175.26 177.58 1xxm s ARG 65 N -2.48 4.21 0.01 1.61 0.52 -1.26 -4.10 118.95 117.46 1xxm s ARG 65 Ca 0.39 0.81 -0.01 0.00 -0.52 0.00 0.00 55.73 56.40 1xxm s ARG 65 Cb -0.12 -2.92 -0.01 0.00 0.52 0.00 0.00 34.95 32.42 1xxm s ARG 65 CO 0.22 0.43 0.01 -0.06 0.02 0.00 0.00 175.30 175.92 1xxm s PHE 66 N -1.48 0.16 0.26 -0.53 0.40 -0.71 -4.96 117.98 111.12 1xxm s PHE 66 Ca 0.41 -0.33 -0.30 0.00 -0.60 0.00 0.00 56.93 56.11 1xxm s PHE 66 Cb -0.17 -0.12 -0.10 0.00 0.51 0.00 0.00 43.02 43.14 1xxm s PHE 66 CO 0.21 -0.16 1.43 -2.14 0.70 0.00 0.00 175.22 175.25 1xxm s PRO 67 N -1.10 4.27 0.18 0.24 0.02 -1.26 -2.03 135.00 135.31 1xxm s PRO 67 Ca -0.12 2.30 -0.03 0.00 0.02 0.00 0.00 61.00 63.17 1xxm s PRO 67 Cb -0.07 -3.10 0.06 0.00 0.02 0.00 0.00 34.50 31.41 1xxm s PRO 67 CO -0.00 -0.40 1.45 0.52 -0.33 0.00 0.00 177.00 178.23 1xxm h MET 68 N 4.81 0.50 0.00 5.54 2.86 -1.61 -3.47 114.93 123.55 1xxm h MET 68 Ca -0.46 -0.37 0.00 0.00 -2.06 0.00 0.00 59.70 56.81 1xxm h MET 68 Cb 1.22 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.94 1xxm h MET 68 CO 0.76 0.99 0.00 -1.33 1.06 0.00 0.00 176.91 178.39 1xxm n MET 69 N -3.89 0.00 0.00 1.72 2.81 -1.26 -2.11 117.12 114.38 1xxm n MET 69 Ca -0.04 0.00 0.04 0.00 -1.81 0.00 0.00 57.70 55.89 1xxm n MET 69 Cb 0.67 0.00 0.20 0.00 -0.71 0.00 0.00 33.22 33.38 1xxm n MET 69 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1xxm n SER 70 N -2.39 0.00 0.31 7.83 7.64 -1.26 -2.50 113.62 123.24 1xxm n SER 70 Ca 0.00 0.33 0.20 0.00 1.01 0.00 0.00 58.87 60.41 1xxm n SER 70 Cb 0.00 -0.39 0.95 0.00 -1.01 0.00 0.00 64.21 63.76 1xxm n SER 70 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1xxm h THR 71 N 0.00 0.01 0.00 0.44 1.35 -1.49 -1.93 112.91 111.29 1xxm h THR 71 Ca 0.00 -0.26 -0.01 0.00 -0.55 0.00 0.00 66.41 65.59 1xxm h THR 71 Cb 0.11 1.26 -0.00 0.00 -1.73 0.00 0.00 68.15 67.79 1xxm h THR 71 CO 0.00 0.00 -0.04 2.19 -0.25 0.00 0.00 175.52 177.42 1xxm h PHE 72 N 0.00 0.00 0.00 4.73 -5.15 -1.65 -3.00 116.94 111.87 1xxm h PHE 72 Ca -0.00 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.75 1xxm h PHE 72 Cb 0.26 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.43 1xxm h PHE 72 CO 0.00 0.04 -0.07 0.87 -2.00 0.00 0.00 178.31 177.15 1xxm h LYS 73 N 0.00 0.00 -0.43 6.09 1.57 -1.59 0.19 116.57 122.40 1xxm h LYS 73 Ca -0.00 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.63 1xxm h LYS 73 Cb 0.33 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 1xxm h LYS 73 CO 0.01 0.07 -0.32 0.28 -0.57 0.00 0.00 179.45 178.92 1xxm h VAL 74 N 0.00 1.27 -0.49 0.50 2.07 -1.74 -1.14 116.25 116.72 1xxm h VAL 74 Ca -0.00 -1.49 -0.10 0.00 0.82 0.00 0.00 66.70 65.93 1xxm h VAL 74 Cb 0.15 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1xxm h VAL 74 CO 0.01 0.51 -0.11 -0.07 0.02 0.00 0.00 177.57 177.93 1xxm h LEU 75 N 0.81 0.89 0.10 2.57 3.38 -1.30 -1.51 115.31 120.25 1xxm h LEU 75 Ca 0.08 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.77 1xxm h LEU 75 Cb 0.91 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1xxm h LEU 75 CO 0.08 1.01 -0.05 0.25 0.09 0.00 0.00 178.44 179.83 1xxm h LEU 76 N 0.80 -0.11 -1.51 1.67 5.85 -0.82 -1.56 115.31 119.63 1xxm h LEU 76 Ca 0.13 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1xxm h LEU 76 Cb 0.63 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.68 1xxm h LEU 76 CO 0.04 -0.08 -0.10 0.00 -0.34 0.00 0.00 178.44 177.96 1xxm h GLY 78 N 1.72 0.91 1.30 0.00 0.00 -0.81 0.75 103.07 106.94 1xxm h GLY 78 Ca -0.00 -0.87 -0.08 0.00 0.00 0.00 0.00 47.33 46.38 1xxm h GLY 78 CO 0.01 0.79 -0.01 0.00 0.00 0.00 0.00 176.54 177.33 1xxm h ALA 79 N 0.78 1.04 -0.30 3.60 0.00 -0.57 -0.79 119.26 123.03 1xxm h ALA 79 Ca 0.07 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 1xxm h ALA 79 Cb 0.83 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1xxm h ALA 79 CO 0.07 0.60 -0.02 0.28 0.00 0.00 0.00 179.25 180.17 1xxm h VAL 80 N 0.79 1.27 -0.11 0.00 2.07 -1.09 -2.62 116.25 116.55 1xxm h VAL 80 Ca 0.15 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.65 1xxm h VAL 80 Cb 0.49 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1xxm h VAL 80 CO 0.02 0.32 -0.03 -0.07 0.02 0.00 0.00 177.57 177.83 1xxm h LEU 81 N 0.32 0.14 -0.43 2.57 3.38 -0.53 -1.54 115.31 119.22 1xxm h LEU 81 Ca 0.08 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 1xxm h LEU 81 Cb 0.48 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1xxm h LEU 81 CO 0.02 0.21 -0.02 -1.28 0.09 0.00 0.00 178.44 177.45 1xxm h SER 82 N 0.16 0.77 -0.49 -0.43 0.87 -0.90 -0.04 113.55 113.49 1xxm h SER 82 Ca 0.04 -0.32 -0.04 0.00 -1.23 0.00 0.00 61.79 60.24 1xxm h SER 82 Cb 0.17 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 61.89 1xxm h SER 82 CO 0.01 0.91 0.17 0.03 -0.53 0.00 0.00 176.83 177.42 1xxm h ARG 83 N 0.62 0.80 -0.32 2.24 3.08 -0.99 -1.29 114.38 118.51 1xxm h ARG 83 Ca 0.12 -0.14 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 1xxm h ARG 83 Cb 0.53 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 1xxm h ARG 83 CO 0.03 0.69 -0.09 0.82 -1.07 0.00 0.00 179.97 180.35 1xxm h ILE 84 N 0.78 1.28 -0.45 2.04 2.04 -0.99 0.26 117.51 122.47 1xxm h ILE 84 Ca 0.18 -1.14 0.01 0.00 1.00 0.00 0.00 64.86 64.91 1xxm h ILE 84 Cb 0.22 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 1xxm h ILE 84 CO -0.01 0.37 0.30 0.44 0.00 0.00 0.00 178.15 179.25 1xxm h ASP 85 N 0.41 0.49 -0.18 1.72 3.45 -0.52 -0.73 116.42 121.06 1xxm h ASP 85 Ca 0.08 -0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.53 1xxm h ASP 85 Cb 0.59 -0.12 0.00 0.00 -0.56 0.00 0.00 39.33 39.23 1xxm h ASP 85 CO 0.03 0.35 0.00 0.00 -1.57 0.00 0.00 179.24 178.06 1xxm n ALA 86 N -2.47 2.50 -1.78 3.45 0.00 -0.53 -4.91 120.51 116.77 1xxm n ALA 86 Ca 0.04 -0.41 -0.12 0.00 0.00 0.00 0.00 53.44 52.95 1xxm n ALA 86 Cb 0.08 -1.06 -0.03 0.00 0.00 0.00 0.00 19.45 18.45 1xxm n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xxm n GLY 87 N 0.95 0.59 0.61 0.00 0.00 -0.28 -4.90 105.19 102.16 1xxm n GLY 87 Ca 0.11 -0.44 0.07 0.00 0.00 0.00 0.00 46.02 45.77 1xxm n GLY 87 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xxm n GLN 88 N -2.40 1.33 -3.56 1.61 1.13 0.90 -5.00 117.38 111.39 1xxm n GLN 88 Ca -0.13 -1.51 -0.11 0.00 -1.94 0.00 0.00 57.00 53.31 1xxm n GLN 88 Cb 0.50 -1.28 -0.04 0.00 0.11 0.00 0.00 30.24 29.53 1xxm n GLN 88 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1xxm s GLU 89 N -1.13 1.14 -0.03 -1.09 2.56 -1.14 -4.86 118.70 114.16 1xxm s GLU 89 Ca 0.19 -0.61 0.01 0.00 0.00 0.00 0.00 54.97 54.56 1xxm s GLU 89 Cb 0.12 0.51 0.02 0.00 2.00 0.00 0.00 34.13 36.78 1xxm s GLU 89 CO 0.18 -0.46 -0.03 -0.65 -0.56 0.00 0.00 175.26 173.74 1xxm s GLN 90 N -3.73 0.50 0.37 4.30 1.11 -1.26 -4.29 119.66 116.66 1xxm s GLN 90 Ca 0.02 -0.05 0.07 0.00 0.01 0.00 0.00 55.36 55.42 1xxm s GLN 90 Cb 0.01 -0.58 0.79 0.00 -1.01 0.00 0.00 33.01 32.22 1xxm s GLN 90 CO -0.12 -0.06 1.95 -0.07 0.01 0.00 0.00 175.29 177.00 1xxm h LEU 91 N 6.93 0.63 -0.51 2.90 3.38 -1.97 -2.30 115.31 124.37 1xxm h LEU 91 Ca -0.38 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1xxm h LEU 91 Cb 1.15 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1xxm h LEU 91 CO 0.48 0.39 0.00 0.61 0.09 0.00 0.00 178.44 180.02 1xxm n GLY 92 N -1.45 -0.46 3.67 0.83 0.00 -1.26 -1.30 105.19 105.22 1xxm n GLY 92 Ca 0.11 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 1xxm n GLY 92 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1xxm s ARG 93 N -1.98 4.22 0.05 1.61 3.52 -0.86 -4.82 118.95 120.70 1xxm s ARG 93 Ca 0.40 1.97 -0.24 0.00 -0.13 0.00 0.00 55.73 57.73 1xxm s ARG 93 Cb 0.20 -3.81 -0.06 0.00 -1.56 0.00 0.00 34.95 29.73 1xxm s ARG 93 CO 0.33 -0.73 0.74 0.50 -0.81 0.00 0.00 175.30 175.33 1xxm s ARG 94 N 3.43 4.48 -0.17 5.12 3.52 -1.26 -1.79 118.95 132.27 1xxm s ARG 94 Ca 0.65 1.03 -0.03 0.00 -0.13 0.00 0.00 55.73 57.25 1xxm s ARG 94 Cb -0.29 -3.35 -0.02 0.00 -1.56 0.00 0.00 34.95 29.73 1xxm s ARG 94 CO 0.24 0.34 -0.06 0.42 -0.81 0.00 0.00 175.30 175.43 1xxm s ILE 95 N -0.23 3.55 -0.29 4.11 1.01 0.24 -4.94 121.20 124.66 1xxm s ILE 95 Ca 0.37 -0.46 -0.09 0.00 0.00 0.00 0.00 60.65 60.47 1xxm s ILE 95 Cb -0.21 -2.57 -0.02 0.00 0.01 0.00 0.00 42.46 39.68 1xxm s ILE 95 CO 0.23 0.47 0.13 -1.00 0.00 0.00 0.00 174.94 174.76 1xxm s HIS 96 N 0.77 3.15 0.44 3.97 3.76 -1.26 -1.88 115.29 124.23 1xxm s HIS 96 Ca -0.02 -0.50 0.02 0.00 -0.15 0.00 0.00 55.06 54.41 1xxm s HIS 96 Cb -0.15 -2.32 0.02 0.00 1.11 0.00 0.00 32.58 31.25 1xxm s HIS 96 CO 0.02 -0.41 0.16 2.48 -0.85 0.00 0.00 174.74 176.14 1xxm n TYR 97 N 4.96 0.14 -4.27 1.40 4.11 -1.26 -5.07 117.16 117.18 1xxm n TYR 97 Ca -0.15 -2.00 -0.18 0.00 -0.00 0.00 0.00 57.90 55.57 1xxm n TYR 97 Cb 0.50 -0.32 -0.08 0.00 -0.00 0.00 0.00 39.34 39.43 1xxm n TYR 97 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.86 175.32 1xxm s SER 98 N -3.48 1.46 0.30 9.48 1.04 -1.26 -4.92 113.70 116.32 1xxm s SER 98 Ca 0.12 -1.70 0.06 0.00 0.48 0.00 0.00 55.95 54.92 1xxm s SER 98 Cb -0.01 0.53 0.81 0.00 0.10 0.00 0.00 66.02 67.45 1xxm s SER 98 CO 0.08 -1.03 1.69 1.56 0.98 0.00 0.00 173.24 176.52 1xxm h GLN 99 N 2.21 0.39 -0.03 4.02 1.08 -1.98 0.13 115.11 120.92 1xxm h GLN 99 Ca -0.27 -0.02 0.01 0.00 -1.45 0.00 0.00 58.65 56.92 1xxm h GLN 99 Cb 1.23 -0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 28.58 1xxm h GLN 99 CO 0.39 0.26 0.03 -0.97 -0.95 0.00 0.00 178.83 177.59 1xxm h ASN 100 N 0.40 0.00 1.13 1.46 -1.24 -2.05 -2.08 115.58 113.20 1xxm h ASN 100 Ca 0.60 0.00 -0.10 0.00 0.71 0.00 0.00 56.30 57.52 1xxm h ASN 100 Cb 1.20 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.23 1xxm h ASN 100 CO -0.55 0.00 -0.46 0.44 -1.29 0.00 0.00 177.43 175.58 1xxm h ASP 101 N 0.00 0.00 -3.42 1.15 3.32 -1.14 -3.46 116.42 112.87 1xxm h ASP 101 Ca 0.02 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.54 1xxm h ASP 101 Cb 0.08 0.00 0.06 0.00 0.22 0.00 0.00 39.33 39.69 1xxm h ASP 101 CO -0.00 0.46 0.76 -0.76 -1.72 0.00 0.00 179.24 177.98 1xxm s LEU 102 N -6.78 4.38 0.26 1.55 2.01 -0.78 -4.86 118.68 114.46 1xxm s LEU 102 Ca 0.02 2.70 0.05 0.00 0.01 0.00 0.00 54.13 56.90 1xxm s LEU 102 Cb 0.09 -3.63 -0.05 0.00 0.01 0.00 0.00 46.19 42.61 1xxm s LEU 102 CO 0.72 -0.71 -0.02 0.68 1.01 0.00 0.00 176.35 178.03 1xxm s VAL 103 N -0.10 1.25 0.98 -1.59 -7.23 -1.26 -5.07 120.40 107.38 1xxm s VAL 103 Ca 0.59 -2.06 -0.11 0.00 -1.81 0.00 0.00 61.98 58.59 1xxm s VAL 103 Cb -0.42 -2.42 0.18 0.00 0.56 0.00 0.00 36.38 34.28 1xxm s VAL 103 CO 0.45 -0.29 1.10 0.00 -0.31 0.00 0.00 175.10 176.05 1xxm s ALA 104 N -3.27 0.95 -1.15 1.32 0.00 -1.26 -4.08 121.76 114.27 1xxm s ALA 104 Ca 0.29 0.31 -0.02 0.00 0.00 0.00 0.00 51.96 52.55 1xxm s ALA 104 Cb 0.05 -3.36 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 1xxm s ALA 104 CO 0.10 -2.99 0.97 0.00 0.00 0.00 0.00 175.76 173.84 1xxm n ALA 105 N -4.37 -2.15 -3.24 0.00 0.00 -1.26 -4.48 120.51 105.01 1xxm n ALA 105 Ca 0.09 -0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.28 1xxm n ALA 105 Cb 0.53 -3.41 -0.07 0.00 0.00 0.00 0.00 19.45 16.51 1xxm n ALA 105 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1xxm n SER 106 N -3.15 1.51 -0.26 0.00 7.64 -1.26 -1.61 113.62 116.49 1xxm n SER 106 Ca -0.22 -3.00 0.02 0.00 1.01 0.00 0.00 58.87 56.68 1xxm n SER 106 Cb 0.65 -0.64 0.24 0.00 -1.01 0.00 0.00 64.21 63.46 1xxm n SER 106 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1xxm h PRO 107 N 3.86 1.00 0.00 1.43 0.13 -1.94 -2.09 132.00 134.39 1xxm h PRO 107 Ca 0.11 -0.06 -0.09 0.00 -0.87 0.00 0.00 66.00 65.09 1xxm h PRO 107 Cb 0.81 -0.23 -0.01 0.00 0.13 0.00 0.00 31.00 31.70 1xxm h PRO 107 CO 0.59 0.66 -0.52 0.28 -0.23 0.00 0.00 178.00 178.78 1xxm h VAL 108 N 1.03 1.31 -0.29 1.56 2.07 -1.95 -3.24 116.25 116.73 1xxm h VAL 108 Ca 0.34 -2.18 0.00 0.00 0.82 0.00 0.00 66.70 65.68 1xxm h VAL 108 Cb 0.05 2.67 -0.01 0.00 -1.52 0.00 0.00 31.29 32.48 1xxm h VAL 108 CO -0.10 0.44 0.19 0.71 0.02 0.00 0.00 177.57 178.83 1xxm h THR 109 N -1.00 1.08 -0.77 2.57 1.35 -1.96 -0.66 112.91 113.52 1xxm h THR 109 Ca -0.14 -0.15 -0.05 0.00 -0.55 0.00 0.00 66.41 65.52 1xxm h THR 109 Cb 1.06 0.66 -0.03 0.00 -1.73 0.00 0.00 68.15 68.11 1xxm h THR 109 CO -0.09 0.07 0.28 -0.08 -0.25 0.00 0.00 175.52 175.45 1xxm h GLU 110 N 0.39 1.17 -0.29 4.72 4.22 -1.52 -2.54 114.58 120.73 1xxm h GLU 110 Ca 0.11 -0.23 -0.13 0.00 0.08 0.00 0.00 59.36 59.18 1xxm h GLU 110 Cb -0.04 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 1xxm h GLU 110 CO -0.02 0.97 -0.36 -0.22 -2.18 0.00 0.00 179.01 177.20 1xxm h LYS 111 N 1.13 0.66 -0.94 1.92 3.11 -1.18 -3.17 116.57 118.10 1xxm h LYS 111 Ca 0.25 -0.32 -0.41 0.00 -2.81 0.00 0.00 60.65 57.37 1xxm h LYS 111 Cb 0.26 -0.00 -0.24 0.00 -1.00 0.00 0.00 32.23 31.25 1xxm h LYS 111 CO -0.01 0.91 0.51 0.72 -2.81 0.00 0.00 179.45 178.78 1xxm n HIS 112 N -4.05 2.72 0.12 1.91 8.25 -0.69 -4.57 115.22 118.90 1xxm n HIS 112 Ca -0.01 -1.58 0.03 0.00 -0.26 0.00 0.00 57.72 55.89 1xxm n HIS 112 Cb 0.50 -0.83 0.41 0.00 1.12 0.00 0.00 29.99 31.18 1xxm n HIS 112 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1xxm h LEU 113 N 1.44 0.22 0.00 2.41 6.46 -1.43 -1.12 115.31 123.30 1xxm h LEU 113 Ca 0.50 -0.04 -0.15 0.00 -0.12 0.00 0.00 57.88 58.07 1xxm h LEU 113 Cb 2.61 -0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 42.46 1xxm h LEU 113 CO 0.94 0.35 -1.20 0.71 -0.62 0.00 0.00 178.44 178.62 1xxm h THR 114 N 0.23 0.57 -0.31 1.05 1.35 -1.87 -3.38 112.91 110.54 1xxm h THR 114 Ca 0.05 -2.02 0.00 0.00 -0.55 0.00 0.00 66.41 63.89 1xxm h THR 114 Cb 0.32 2.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.84 1xxm h THR 114 CO 0.02 0.32 0.00 -0.90 -0.25 0.00 0.00 175.52 174.71 1xxm n ASP 115 N -2.96 2.82 -0.92 5.36 5.68 -1.16 -5.09 116.55 120.30 1xxm n ASP 115 Ca -0.07 -1.95 0.12 0.00 -0.50 0.00 0.00 54.79 52.40 1xxm n ASP 115 Cb 0.81 -0.21 -0.03 0.00 -1.14 0.00 0.00 41.12 40.55 1xxm n ASP 115 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1xxm n GLY 116 N 0.52 -1.69 3.14 6.12 0.00 -0.43 -4.98 105.19 107.87 1xxm n GLY 116 Ca 0.11 -1.30 -0.13 0.00 0.00 0.00 0.00 46.02 44.71 1xxm n GLY 116 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xxm s MET 117 N -1.81 0.35 0.72 1.61 -1.94 -0.79 -4.83 119.30 112.62 1xxm s MET 117 Ca 0.00 0.22 -0.11 0.00 -1.71 0.00 0.00 55.69 54.08 1xxm s MET 117 Cb 0.00 0.16 0.03 0.00 2.01 0.00 0.00 34.83 37.03 1xxm s MET 117 CO 0.00 -0.06 1.09 0.95 -0.01 0.00 0.00 175.02 176.99 1xxm s THR 118 N -0.17 3.54 0.28 2.05 -4.23 -1.26 -0.59 115.64 115.26 1xxm s THR 118 Ca -0.03 0.50 -0.01 0.00 -1.18 0.00 0.00 61.69 60.97 1xxm s THR 118 Cb -0.03 -3.39 0.28 0.00 1.34 0.00 0.00 72.50 70.70 1xxm s THR 118 CO 0.01 -0.65 1.89 0.58 -0.54 0.00 0.00 174.62 175.90 1xxm h VAL 119 N -0.76 1.07 -0.08 2.29 2.07 -1.16 0.16 116.25 119.84 1xxm h VAL 119 Ca -0.45 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 1xxm h VAL 119 Cb 1.25 -0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1xxm h VAL 119 CO 0.61 0.21 0.05 -0.09 0.02 0.00 0.00 177.57 178.37 1xxm h ARG 120 N 1.13 0.11 -0.37 1.57 2.43 -1.49 -1.26 114.38 116.51 1xxm h ARG 120 Ca 0.43 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.55 1xxm h ARG 120 Cb 0.20 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 1xxm h ARG 120 CO -0.17 0.13 0.05 0.93 -1.51 0.00 0.00 179.97 179.40 1xxm h GLU 121 N 0.07 0.55 -0.33 0.20 5.08 -1.63 -0.89 114.58 117.63 1xxm h GLU 121 Ca 0.03 -0.10 -0.09 0.00 -1.00 0.00 0.00 59.36 58.19 1xxm h GLU 121 Cb 0.04 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1xxm h GLU 121 CO -0.01 0.54 -0.16 -0.07 -1.00 0.00 0.00 179.01 178.31 1xxm h LEU 122 N 0.54 0.71 -0.83 1.33 3.38 -0.62 0.13 115.31 119.95 1xxm h LEU 122 Ca 0.12 -0.41 -0.10 0.00 0.09 0.00 0.00 57.88 57.58 1xxm h LEU 122 Cb 0.26 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1xxm h LEU 122 CO 0.00 0.96 -0.20 0.00 0.09 0.00 0.00 178.44 179.29 1xxm h SER 124 N 0.57 0.95 -0.25 0.00 0.87 -0.97 -1.19 113.55 113.54 1xxm h SER 124 Ca 0.09 -0.18 -0.10 0.00 -1.23 0.00 0.00 61.79 60.37 1xxm h SER 124 Cb 0.66 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 62.37 1xxm h SER 124 CO 0.05 0.88 -0.23 0.00 -0.53 0.00 0.00 176.83 176.99 1xxm h ALA 125 N 1.11 0.36 -0.61 6.23 0.00 -0.57 -0.75 119.26 125.04 1xxm h ALA 125 Ca 0.22 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1xxm h ALA 125 Cb 0.23 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1xxm h ALA 125 CO -0.02 0.33 0.26 0.00 0.00 0.00 0.00 179.25 179.83 1xxm h ALA 126 N 0.68 0.79 0.00 0.00 0.00 -0.73 -1.29 119.26 118.71 1xxm h ALA 126 Ca 0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1xxm h ALA 126 Cb 0.79 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1xxm h ALA 126 CO 0.06 0.38 -0.00 0.82 0.00 0.00 0.00 179.25 180.50 1xxm h ILE 127 N 0.84 1.66 0.00 0.00 2.04 -1.23 -2.25 117.51 118.57 1xxm h ILE 127 Ca 0.21 -2.24 -0.03 0.00 1.00 0.00 0.00 64.86 63.80 1xxm h ILE 127 Cb 0.17 3.13 -0.00 0.00 -0.74 0.00 0.00 36.82 39.37 1xxm h ILE 127 CO -0.02 0.56 -0.12 0.71 0.00 0.00 0.00 178.15 179.28 1xxm h THR 128 N -1.00 0.21 0.00 -0.27 1.35 -1.23 -3.36 112.91 108.60 1xxm h THR 128 Ca -0.00 -1.27 0.00 0.00 -0.55 0.00 0.00 66.41 64.59 1xxm h THR 128 Cb 0.92 2.08 0.00 0.00 -1.73 0.00 0.00 68.15 69.42 1xxm h THR 128 CO -0.00 0.12 0.00 0.23 -0.25 0.00 0.00 175.52 175.62 1xxm n MET 129 N -3.13 0.63 -3.40 4.72 2.81 -0.53 -1.72 117.12 116.51 1xxm n MET 129 Ca 0.03 -0.76 -0.24 0.00 -1.81 0.00 0.00 57.70 54.93 1xxm n MET 129 Cb 0.57 -0.85 0.00 0.00 -0.71 0.00 0.00 33.22 32.23 1xxm n MET 129 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1xxm n SER 130 N -0.17 -3.98 -4.63 7.83 7.64 -0.84 -4.84 113.62 114.63 1xxm n SER 130 Ca 0.00 -0.43 -0.43 0.00 1.01 0.00 0.00 58.87 59.03 1xxm n SER 130 Cb 0.19 -3.27 -0.03 0.00 -1.01 0.00 0.00 64.21 60.09 1xxm n SER 130 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1xxm s ASP 131 N -2.77 6.17 0.10 6.43 2.15 -0.95 -4.87 116.67 122.93 1xxm s ASP 131 Ca 0.42 1.99 -0.17 0.00 0.43 0.00 0.00 52.55 55.21 1xxm s ASP 131 Cb -0.22 -2.53 -0.06 0.00 -0.30 0.00 0.00 42.92 39.82 1xxm s ASP 131 CO 0.52 -1.37 1.57 0.78 -0.17 0.00 0.00 175.17 176.50 1xxm h ASN 132 N 11.75 0.48 -0.60 -0.34 -0.26 -1.53 -2.80 115.58 122.28 1xxm h ASN 132 Ca -0.40 -0.27 -0.06 0.00 -0.56 0.00 0.00 56.30 55.01 1xxm h ASN 132 Cb 1.20 -0.13 -0.03 0.00 -1.06 0.00 0.00 38.32 38.30 1xxm h ASN 132 CO 0.97 0.63 0.15 0.74 -1.06 0.00 0.00 177.43 178.86 1xxm h THR 133 N 0.32 1.25 -0.85 2.81 2.02 -1.81 -2.09 112.91 114.56 1xxm h THR 133 Ca 0.09 -0.91 0.05 0.00 0.77 0.00 0.00 66.41 66.41 1xxm h THR 133 Cb 0.35 0.60 -0.06 0.00 -1.74 0.00 0.00 68.15 67.30 1xxm h THR 133 CO 0.01 0.35 0.54 0.00 0.37 0.00 0.00 175.52 176.78 1xxm h ALA 134 N 1.21 1.15 -0.49 6.16 0.00 -1.89 -0.00 119.26 125.40 1xxm h ALA 134 Ca 0.20 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1xxm h ALA 134 Cb 0.34 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1xxm h ALA 134 CO 0.00 0.32 0.24 0.00 0.00 0.00 0.00 179.25 179.80 1xxm h ALA 135 N 1.38 0.63 -0.61 0.00 0.00 -1.14 -1.49 119.26 118.03 1xxm h ALA 135 Ca 0.36 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 1xxm h ALA 135 Cb 0.11 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1xxm h ALA 135 CO -0.15 0.19 0.05 -0.91 0.00 0.00 0.00 179.25 178.42 1xxm h ASN 136 N 0.64 1.00 -0.70 0.00 2.35 -0.70 0.06 115.58 118.24 1xxm h ASN 136 Ca 0.17 -0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 55.64 1xxm h ASN 136 Cb 0.11 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.19 1xxm h ASN 136 CO -0.02 1.03 0.36 -0.07 -1.65 0.00 0.00 177.43 177.08 1xxm h LEU 137 N 0.96 0.89 -0.57 1.61 3.38 -0.81 -1.07 115.31 119.71 1xxm h LEU 137 Ca 0.18 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1xxm h LEU 137 Cb 0.49 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1xxm h LEU 137 CO 0.02 0.75 -0.07 -0.07 0.09 0.00 0.00 178.44 179.16 1xxm h LEU 138 N 0.97 1.04 -1.02 1.67 3.38 -1.02 -2.57 115.31 117.76 1xxm h LEU 138 Ca 0.24 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 57.92 1xxm h LEU 138 Cb 0.08 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.48 1xxm h LEU 138 CO -0.04 1.13 0.65 -0.07 0.09 0.00 0.00 178.44 180.21 1xxm h LEU 139 N 0.94 1.09 -0.69 1.67 3.38 -0.49 -1.81 115.31 119.38 1xxm h LEU 139 Ca 0.15 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1xxm h LEU 139 Cb 0.64 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1xxm h LEU 139 CO 0.04 0.74 0.37 0.74 0.09 0.00 0.00 178.44 180.42 1xxm h THR 140 N 1.26 1.22 0.00 0.22 2.02 -0.90 0.48 112.91 117.21 1xxm h THR 140 Ca 0.40 -0.58 -0.00 0.00 0.77 0.00 0.00 66.41 67.00 1xxm h THR 140 Cb 0.02 0.33 -0.00 0.00 -1.74 0.00 0.00 68.15 66.76 1xxm h THR 140 CO -0.13 0.25 -0.02 0.71 0.37 0.00 0.00 175.52 176.70 1xxm h THR 141 N 0.96 0.57 -0.01 3.16 1.35 -0.95 -2.36 112.91 115.63 1xxm h THR 141 Ca 0.24 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 66.02 1xxm h THR 141 Cb 0.07 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.54 1xxm h THR 141 CO -0.04 0.02 -0.45 2.30 -0.25 0.00 0.00 175.52 177.11 1xxm n ILE 142 N -3.87 0.00 0.00 6.82 -5.35 -0.97 -4.97 119.36 111.02 1xxm n ILE 142 Ca -0.03 -0.28 0.00 0.00 -0.27 0.00 0.00 62.75 62.17 1xxm n ILE 142 Cb 0.10 1.24 0.00 0.00 -1.74 0.00 0.00 39.64 39.24 1xxm n ILE 142 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1xxm n GLY 143 N 1.35 1.17 0.00 3.28 0.00 -0.84 -4.73 105.19 105.41 1xxm n GLY 143 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1xxm n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xxm n GLY 144 N -1.52 -0.42 0.29 -0.02 0.00 0.16 -4.29 105.19 99.39 1xxm n GLY 144 Ca 0.00 -1.82 0.07 0.00 0.00 0.00 0.00 46.02 44.27 1xxm n GLY 144 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1xxm h PRO 145 N 0.00 0.45 -0.84 1.61 0.11 -1.85 -1.68 132.00 129.79 1xxm h PRO 145 Ca 0.00 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 66.18 1xxm h PRO 145 Cb 0.00 -0.10 -0.06 0.00 0.11 0.00 0.00 31.00 30.95 1xxm h PRO 145 CO 0.00 0.29 0.55 1.57 -0.21 0.00 0.00 178.00 180.20 1xxm h LYS 146 N 0.46 0.80 0.00 1.05 2.10 -1.81 -1.11 116.57 118.06 1xxm h LYS 146 Ca 0.45 -0.05 -0.13 0.00 -2.00 0.00 0.00 60.65 58.92 1xxm h LYS 146 Cb 0.72 -0.18 -0.02 0.00 -0.90 0.00 0.00 32.23 31.85 1xxm h LYS 146 CO -0.43 0.53 -0.62 0.93 -2.00 0.00 0.00 179.45 177.86 1xxm h GLU 147 N 0.82 0.00 -0.25 0.07 4.39 -1.49 -1.19 114.58 116.92 1xxm h GLU 147 Ca 0.39 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 60.00 1xxm h GLU 147 Cb 0.40 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1xxm h GLU 147 CO -0.16 0.62 -0.18 1.25 -1.16 0.00 0.00 179.01 179.39 1xxm h LEU 148 N 0.00 0.60 -0.42 1.33 5.85 -1.02 -1.53 115.31 120.11 1xxm h LEU 148 Ca -0.01 -0.44 -0.00 0.00 0.84 0.00 0.00 57.88 58.27 1xxm h LEU 148 Cb 1.20 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 1xxm h LEU 148 CO 0.08 0.91 0.25 0.74 -0.34 0.00 0.00 178.44 180.09 1xxm h THR 149 N 0.29 1.14 -0.62 1.05 2.02 -1.15 -0.95 112.91 114.68 1xxm h THR 149 Ca 0.05 -0.31 0.07 0.00 0.77 0.00 0.00 66.41 66.99 1xxm h THR 149 Cb 0.71 0.58 -0.06 0.00 -1.74 0.00 0.00 68.15 67.64 1xxm h THR 149 CO 0.05 0.14 0.31 0.00 0.37 0.00 0.00 175.52 176.38 1xxm h ALA 150 N 1.12 0.81 -0.40 6.16 0.00 -1.12 0.14 119.26 125.96 1xxm h ALA 150 Ca 0.15 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.15 1xxm h ALA 150 Cb 0.00 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 1xxm h ALA 150 CO -0.03 -0.05 0.14 0.35 0.00 0.00 0.00 179.25 179.65 1xxm h PHE 151 N 0.56 0.24 -0.54 0.00 3.57 -0.64 0.37 116.94 120.51 1xxm h PHE 151 Ca 0.29 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.76 1xxm h PHE 151 Cb 0.24 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1xxm h PHE 151 CO -0.11 0.09 0.14 -0.07 -2.23 0.00 0.00 178.31 176.13 1xxm h LEU 152 N 0.30 0.82 -0.50 0.59 3.38 -0.27 -2.60 115.31 117.03 1xxm h LEU 152 Ca 0.19 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1xxm h LEU 152 Cb 0.17 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1xxm h LEU 152 CO -0.19 0.84 0.24 -0.74 0.09 0.00 0.00 178.44 178.68 1xxm h HIS 153 N 0.77 0.71 0.00 1.13 2.76 -0.23 0.03 115.15 120.32 1xxm h HIS 153 Ca 0.17 -0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 1xxm h HIS 153 Cb 0.33 -0.22 -0.00 0.00 1.55 0.00 0.00 27.41 29.07 1xxm h HIS 153 CO 0.02 0.56 -0.06 -0.91 -1.30 0.00 0.00 177.93 176.24 1xxm h ASN 154 N 0.66 0.00 -0.63 3.26 2.35 -0.75 -1.70 115.58 118.77 1xxm h ASN 154 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1xxm h ASN 154 Cb 0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1xxm h ASN 154 CO -0.02 0.06 0.00 1.15 -1.65 0.00 0.00 177.43 176.97 1xxm n MET 155 N -3.77 2.57 0.00 0.81 0.00 -0.97 -4.93 117.12 110.82 1xxm n MET 155 Ca -0.02 -2.30 0.00 0.00 0.00 0.00 0.00 57.70 55.38 1xxm n MET 155 Cb 0.16 -1.53 0.00 0.00 0.00 0.00 0.00 33.22 31.85 1xxm n MET 155 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1xxm n GLY 156 N 1.45 0.56 3.36 3.17 0.00 -0.64 -5.05 105.19 108.04 1xxm n GLY 156 Ca 0.21 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.78 1xxm n GLY 156 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xxm s ASP 157 N -2.04 6.54 -0.07 1.61 -1.08 -0.04 -4.87 116.67 116.72 1xxm s ASP 157 Ca 0.00 -2.19 0.10 0.00 -0.52 0.00 0.00 52.55 49.94 1xxm s ASP 157 Cb 0.00 -2.27 0.40 0.00 -1.46 0.00 0.00 42.92 39.60 1xxm s ASP 157 CO 0.00 -0.82 1.23 1.41 0.52 0.00 0.00 175.17 177.52 1xxm n HIS 158 N 5.13 0.86 -0.01 -5.34 8.25 -1.26 -3.08 115.22 119.76 1xxm n HIS 158 Ca 0.07 -0.34 -0.03 0.00 -0.26 0.00 0.00 57.72 57.17 1xxm n HIS 158 Cb 0.45 -0.17 -0.01 0.00 1.12 0.00 0.00 29.99 31.38 1xxm n HIS 158 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1xxm n VAL 159 N 0.50 0.14 -1.88 1.59 0.31 -1.26 -5.04 118.33 112.69 1xxm n VAL 159 Ca 0.14 -0.04 -0.42 0.00 -0.01 0.00 0.00 64.34 64.02 1xxm n VAL 159 Cb 0.57 -1.40 -0.02 0.00 -0.91 0.00 0.00 33.84 32.07 1xxm n VAL 159 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1xxm s THR 160 N -2.05 2.37 -0.10 2.52 2.01 -1.26 -4.80 115.64 114.34 1xxm s THR 160 Ca -0.04 0.29 -0.08 0.00 0.31 0.00 0.00 61.69 62.18 1xxm s THR 160 Cb 0.01 -3.19 0.03 0.00 0.01 0.00 0.00 72.50 69.36 1xxm s THR 160 CO 0.05 0.04 0.25 0.00 -0.69 0.00 0.00 174.62 174.26 1xxm s ARG 161 N 0.17 0.28 -0.12 4.92 1.70 -0.74 -4.85 118.95 120.32 1xxm s ARG 161 Ca 0.65 0.38 0.01 0.00 -0.47 0.00 0.00 55.73 56.30 1xxm s ARG 161 Cb -0.45 0.10 -0.01 0.00 -0.57 0.00 0.00 34.95 34.01 1xxm s ARG 161 CO 0.40 -0.06 -0.16 -1.17 -1.08 0.00 0.00 175.30 173.24 1xxm s LEU 162 N 0.32 2.56 0.00 -1.89 2.96 -1.26 -2.38 118.68 118.99 1xxm s LEU 162 Ca -0.02 -0.38 0.00 0.00 -0.22 0.00 0.00 54.13 53.51 1xxm s LEU 162 Cb -0.03 -1.56 0.00 0.00 0.50 0.00 0.00 46.19 45.10 1xxm s LEU 162 CO -0.01 0.17 0.00 0.47 -1.32 0.00 0.00 176.35 175.66 1xxm n ASP 163 N 3.47 4.69 -4.39 3.68 9.92 -1.26 -4.19 116.55 128.47 1xxm n ASP 163 Ca -0.18 0.00 -0.23 0.00 -0.53 0.00 0.00 54.79 53.85 1xxm n ASP 163 Cb 0.53 0.92 -0.10 0.00 -0.64 0.00 0.00 41.12 41.82 1xxm n ASP 163 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1xxm s ARG 164 N -1.88 1.74 0.52 -1.24 0.52 -1.26 -4.88 118.95 112.47 1xxm s ARG 164 Ca 0.00 -1.99 0.09 0.00 -0.52 0.00 0.00 55.73 53.31 1xxm s ARG 164 Cb 0.00 -0.83 0.06 0.00 0.52 0.00 0.00 34.95 34.70 1xxm s ARG 164 CO 0.00 -0.26 0.72 -1.58 0.02 0.00 0.00 175.30 174.20 1xxm s TRP 165 N -3.27 1.86 0.34 -0.53 0.52 -1.26 -4.70 118.94 111.90 1xxm s TRP 165 Ca 0.32 -0.62 -0.26 0.00 0.02 0.00 0.00 56.10 55.56 1xxm s TRP 165 Cb 0.07 -2.26 -0.09 0.00 -1.15 0.00 0.00 33.47 30.04 1xxm s TRP 165 CO 0.15 -0.92 1.02 -1.21 0.02 0.00 0.00 176.95 176.01 1xxm s GLU 166 N -4.56 4.45 0.00 4.98 0.41 -1.26 -2.04 118.70 120.68 1xxm s GLU 166 Ca 0.60 1.52 0.25 0.00 -0.41 0.00 0.00 54.97 56.92 1xxm s GLU 166 Cb -0.07 -2.82 0.37 0.00 -1.78 0.00 0.00 34.13 29.83 1xxm s GLU 166 CO 0.37 0.12 1.33 -0.35 -0.49 0.00 0.00 175.26 176.24 1xxm n PRO 167 N 0.52 1.44 0.30 0.39 -0.04 -1.26 -4.92 135.00 131.44 1xxm n PRO 167 Ca 0.02 -1.09 0.18 0.00 -0.04 0.00 0.00 63.50 62.57 1xxm n PRO 167 Cb 0.48 -1.48 0.99 0.00 -0.04 0.00 0.00 33.50 33.46 1xxm n PRO 167 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1xxm h GLU 168 N 2.66 0.00 0.00 0.54 3.07 -1.85 -2.46 114.58 116.54 1xxm h GLU 168 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1xxm h GLU 168 Cb 0.72 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.63 1xxm h GLU 168 CO 0.00 0.00 0.00 1.47 -1.40 0.00 0.00 179.01 179.08 1xxm n LEU 169 N -3.58 0.00 -1.36 1.33 -0.00 -0.86 -2.30 117.00 110.22 1xxm n LEU 169 Ca -0.02 0.29 0.11 0.00 -0.00 0.00 0.00 56.01 56.39 1xxm n LEU 169 Cb 0.12 -0.29 0.32 0.00 -0.00 0.00 0.00 43.42 43.57 1xxm n LEU 169 CO 0.25 -0.16 0.78 0.59 -0.00 0.00 0.00 177.39 178.84 1xxm n ASN 170 N -1.29 3.96 -0.19 1.45 3.02 -0.92 -4.58 115.26 116.71 1xxm n ASN 170 Ca 0.06 -2.04 -0.02 0.00 -0.03 0.00 0.00 54.58 52.56 1xxm n ASN 170 Cb 0.11 -0.49 0.08 0.00 -0.61 0.00 0.00 39.78 38.87 1xxm n ASN 170 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1xxm h GLU 171 N 4.23 0.46 -4.98 3.52 4.81 -1.67 -1.45 114.58 119.50 1xxm h GLU 171 Ca 0.00 -0.03 -0.30 0.00 -0.13 0.00 0.00 59.36 58.90 1xxm h GLU 171 Cb 1.01 -0.10 0.13 0.00 0.63 0.00 0.00 28.75 30.42 1xxm h GLU 171 CO 0.02 0.30 -0.59 0.00 -0.73 0.00 0.00 179.01 178.01 1xxm n ALA 172 N -2.40 -1.37 -1.97 2.92 0.00 -1.26 -4.40 120.51 112.03 1xxm n ALA 172 Ca 0.07 0.14 -0.42 0.00 0.00 0.00 0.00 53.44 53.22 1xxm n ALA 172 Cb 0.20 -3.31 -0.03 0.00 0.00 0.00 0.00 19.45 16.32 1xxm n ALA 172 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1xxm s ILE 173 N -3.28 3.02 0.03 0.00 -1.09 -1.26 -4.83 121.20 113.79 1xxm s ILE 173 Ca 0.23 0.56 -0.37 0.00 -2.23 0.00 0.00 60.65 58.84 1xxm s ILE 173 Cb -0.10 -3.36 -0.16 0.00 -1.58 0.00 0.00 42.46 37.26 1xxm s ILE 173 CO 0.60 0.01 1.44 -2.65 -1.23 0.00 0.00 174.94 173.10 1xxm n PRO 174 N 5.09 1.26 0.00 2.79 -0.02 -1.26 -0.67 135.00 142.18 1xxm n PRO 174 Ca 0.15 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1xxm n PRO 174 Cb 0.40 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 1xxm n PRO 174 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1xxm n ASN 175 N 3.13 0.00 -4.71 2.55 3.02 -1.26 -4.97 115.26 113.02 1xxm n ASN 175 Ca 0.20 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.33 1xxm n ASN 175 Cb 0.19 -0.35 -0.03 0.00 -0.61 0.00 0.00 39.78 38.98 1xxm n ASN 175 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1xxm s ASP 176 N -2.69 6.69 0.00 6.41 -1.08 0.15 -4.90 116.67 121.25 1xxm s ASP 176 Ca 0.00 2.46 0.25 0.00 -0.52 0.00 0.00 52.55 54.74 1xxm s ASP 176 Cb 0.00 -2.59 0.74 0.00 -1.46 0.00 0.00 42.92 39.61 1xxm s ASP 176 CO 0.00 -0.76 1.56 -0.62 0.52 0.00 0.00 175.17 175.87 1xxm n GLU 177 N 4.25 1.90 -2.16 4.34 1.02 -1.26 -4.82 120.64 123.91 1xxm n GLU 177 Ca 0.13 -1.33 -0.41 0.00 -0.02 0.00 0.00 57.16 55.54 1xxm n GLU 177 Cb 0.40 -1.45 -0.02 0.00 -0.02 0.00 0.00 31.44 30.34 1xxm n GLU 177 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1xxm s ARG 178 N -1.88 4.39 -1.45 3.49 0.52 -1.26 -3.20 118.95 119.56 1xxm s ARG 178 Ca 0.35 2.15 -0.09 0.00 -0.52 0.00 0.00 55.73 57.62 1xxm s ARG 178 Cb 0.20 -3.11 0.02 0.00 0.52 0.00 0.00 34.95 32.59 1xxm s ARG 178 CO 0.30 -0.17 0.94 -0.25 0.02 0.00 0.00 175.30 176.15 1xxm n ASP 179 N 1.25 -5.93 -4.57 0.23 10.43 -1.08 -4.92 116.55 111.97 1xxm n ASP 179 Ca 0.01 -0.50 -0.26 0.00 2.57 0.00 0.00 54.79 56.62 1xxm n ASP 179 Cb 0.42 -4.72 -0.11 0.00 1.84 0.00 0.00 41.12 38.55 1xxm n ASP 179 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 1xxm s THR 180 N -3.25 1.85 0.35 -3.53 -4.23 -1.00 -1.56 115.64 104.26 1xxm s THR 180 Ca 0.51 -2.03 0.00 0.00 -1.18 0.00 0.00 61.69 58.99 1xxm s THR 180 Cb -0.23 -2.88 -0.00 0.00 1.34 0.00 0.00 72.50 70.72 1xxm s THR 180 CO 0.63 -0.04 0.44 0.28 -0.54 0.00 0.00 174.62 175.38 1xxm s THR 181 N -2.83 0.00 0.03 3.99 -1.32 -0.86 -1.78 115.64 112.86 1xxm s THR 181 Ca 0.35 -1.69 0.09 0.00 -1.21 0.00 0.00 61.69 59.22 1xxm s THR 181 Cb 0.08 -2.63 -0.03 0.00 -1.51 0.00 0.00 72.50 68.42 1xxm s THR 181 CO 0.17 0.00 -0.25 -0.04 -2.21 0.00 0.00 174.62 172.29 1xxm s MET 182 N -3.08 1.80 0.26 7.08 -1.94 -1.26 -1.74 119.30 120.42 1xxm s MET 182 Ca 0.33 -1.04 -0.03 0.00 -1.71 0.00 0.00 55.69 53.24 1xxm s MET 182 Cb 0.00 -1.91 0.54 0.00 2.01 0.00 0.00 34.83 35.47 1xxm s MET 182 CO 0.23 0.50 1.65 -1.35 -0.01 0.00 0.00 175.02 176.04 1xxm h PRO 183 N 4.97 0.19 -0.46 2.03 0.11 -1.69 0.10 132.00 137.25 1xxm h PRO 183 Ca -0.45 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.54 1xxm h PRO 183 Cb 1.14 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1xxm h PRO 183 CO 0.44 0.12 -0.14 0.00 -0.21 0.00 0.00 178.00 178.21 1xxm h ALA 184 N 1.70 0.63 -0.41 -0.75 0.00 -1.73 -1.59 119.26 117.12 1xxm h ALA 184 Ca 0.46 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1xxm h ALA 184 Cb 0.85 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1xxm h ALA 184 CO -0.61 0.56 0.06 0.00 0.00 0.00 0.00 179.25 179.26 1xxm h ALA 185 N 0.87 0.55 -0.59 0.00 0.00 -1.44 -1.59 119.26 117.04 1xxm h ALA 185 Ca 0.11 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1xxm h ALA 185 Cb 0.70 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1xxm h ALA 185 CO 0.05 0.27 0.08 1.98 0.00 0.00 0.00 179.25 181.63 1xxm h MET 186 N 0.53 0.99 -0.48 0.00 -1.53 -0.83 -0.94 114.93 112.67 1xxm h MET 186 Ca 0.12 -0.27 -0.04 0.00 -3.44 0.00 0.00 59.70 56.08 1xxm h MET 186 Cb 0.38 -0.11 -0.02 0.00 -0.55 0.00 0.00 31.60 31.30 1xxm h MET 186 CO 0.01 0.94 0.16 0.00 0.14 0.00 0.00 176.91 178.16 1xxm h ALA 187 N 1.01 0.63 -0.48 0.39 0.00 -1.18 -0.04 119.26 119.58 1xxm h ALA 187 Ca 0.18 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1xxm h ALA 187 Cb 0.44 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1xxm h ALA 187 CO 0.01 0.27 -0.15 1.15 0.00 0.00 0.00 179.25 180.54 1xxm h THR 188 N 0.64 1.27 -0.47 0.00 2.02 -1.18 -2.44 112.91 112.75 1xxm h THR 188 Ca 0.16 -1.29 -0.07 0.00 0.77 0.00 0.00 66.41 65.98 1xxm h THR 188 Cb 0.25 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.74 1xxm h THR 188 CO -0.01 0.45 0.03 0.74 0.37 0.00 0.00 175.52 177.10 1xxm h THR 189 N 0.81 1.26 -0.34 3.16 2.02 -0.98 -2.37 112.91 116.46 1xxm h THR 189 Ca 0.12 -1.00 -0.05 0.00 0.77 0.00 0.00 66.41 66.26 1xxm h THR 189 Cb 0.71 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 1xxm h THR 189 CO 0.05 0.35 0.02 0.25 0.37 0.00 0.00 175.52 176.56 1xxm h LEU 190 N 0.66 0.49 -0.37 2.58 5.85 -0.95 -1.74 115.31 121.83 1xxm h LEU 190 Ca 0.14 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 1xxm h LEU 190 Cb 0.46 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 1xxm h LEU 190 CO 0.02 0.55 0.11 -0.09 -0.34 0.00 0.00 178.44 178.68 1xxm h ARG 191 N 0.51 0.59 -0.07 1.25 2.43 -1.17 -2.06 114.38 115.85 1xxm h ARG 191 Ca 0.11 -0.13 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 1xxm h ARG 191 Cb 0.31 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1xxm h ARG 191 CO 0.01 0.61 -0.34 0.87 -1.51 0.00 0.00 179.97 179.60 1xxm h LYS 192 N 0.46 0.15 0.00 0.20 1.57 -1.05 0.22 116.57 118.12 1xxm h LYS 192 Ca 0.12 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1xxm h LYS 192 Cb 0.28 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1xxm h LYS 192 CO -0.00 0.48 0.00 -0.07 -0.57 0.00 0.00 179.45 179.29 1xxm h LEU 193 N 0.13 0.00 0.00 2.94 3.38 -1.16 -2.22 115.31 118.38 1xxm h LEU 193 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1xxm h LEU 193 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1xxm h LEU 193 CO 0.05 0.00 -1.58 0.18 0.09 0.00 0.00 178.44 177.18 1xxm n LEU 194 N -2.98 0.12 0.00 1.67 4.77 -0.79 -4.71 117.00 115.08 1xxm n LEU 194 Ca 0.04 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1xxm n LEU 194 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1xxm n LEU 194 CO 0.32 0.03 -0.10 0.35 -1.33 0.00 0.00 177.39 176.66 1xxm n THR 195 N -1.95 0.00 -0.36 -5.08 -2.24 0.03 -4.92 114.28 99.75 1xxm n THR 195 Ca -0.02 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.62 1xxm n THR 195 Cb 0.39 0.06 0.13 0.00 -2.10 0.00 0.00 70.33 68.81 1xxm n THR 195 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xxm n GLY 196 N 0.58 -3.33 0.56 3.38 0.00 -0.83 -4.91 105.19 100.63 1xxm n GLY 196 Ca 0.00 -1.34 0.12 0.00 0.00 0.00 0.00 46.02 44.80 1xxm n GLY 196 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xxm n GLU 197 N -3.44 1.54 -0.25 1.61 -0.58 -1.26 -4.32 120.64 113.94 1xxm n GLU 197 Ca 0.07 -1.13 0.04 0.00 -0.42 0.00 0.00 57.16 55.72 1xxm n GLU 197 Cb 0.27 -1.48 0.17 0.00 -0.57 0.00 0.00 31.44 29.84 1xxm n GLU 197 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1xxm h LEU 198 N 2.77 0.22 -9.16 -4.62 5.85 -1.91 -3.41 115.31 105.04 1xxm h LEU 198 Ca 0.00 0.11 -0.66 0.00 0.84 0.00 0.00 57.88 58.17 1xxm h LEU 198 Cb 0.71 0.10 -0.17 0.00 0.37 0.00 0.00 40.66 41.67 1xxm h LEU 198 CO 0.00 0.08 -0.78 -0.76 -0.34 0.00 0.00 178.44 176.64 1xxm s LEU 199 N -10.47 2.74 1.03 2.25 1.43 -1.26 -4.98 118.68 109.43 1xxm s LEU 199 Ca -0.13 -0.61 -0.12 0.00 -1.03 0.00 0.00 54.13 52.24 1xxm s LEU 199 Cb 0.20 -1.52 0.20 0.00 0.03 0.00 0.00 46.19 45.10 1xxm s LEU 199 CO 0.76 0.15 1.07 0.42 0.23 0.00 0.00 176.35 178.98 1xxm s THR 200 N -1.40 2.21 0.19 5.49 -4.23 -1.26 -4.74 115.64 111.91 1xxm s THR 200 Ca 0.20 0.07 -0.12 0.00 -1.18 0.00 0.00 61.69 60.67 1xxm s THR 200 Cb -0.10 -2.34 0.11 0.00 1.34 0.00 0.00 72.50 71.52 1xxm s THR 200 CO 0.12 -0.09 1.84 0.25 -0.54 0.00 0.00 174.62 176.20 1xxm h LEU 201 N -2.08 0.66 -0.65 4.79 5.85 -1.96 -1.43 115.31 120.50 1xxm h LEU 201 Ca -0.55 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.17 1xxm h LEU 201 Cb 1.31 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.16 1xxm h LEU 201 CO 0.52 0.47 0.38 0.00 -0.34 0.00 0.00 178.44 179.47 1xxm h ALA 202 N 1.26 0.83 -0.26 1.25 0.00 -2.00 -1.64 119.26 118.69 1xxm h ALA 202 Ca 0.25 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 1xxm h ALA 202 Cb -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1xxm h ALA 202 CO -0.09 0.31 -0.30 0.77 0.00 0.00 0.00 179.25 179.94 1xxm h SER 203 N 0.88 0.56 -0.33 0.00 0.02 -1.83 -1.44 113.55 111.41 1xxm h SER 203 Ca 0.23 -0.21 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1xxm h SER 203 Cb -0.01 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 1xxm h SER 203 CO -0.04 0.84 0.11 0.03 -1.14 0.00 0.00 176.83 176.62 1xxm h ARG 204 N 0.47 0.51 -0.19 3.45 3.08 -0.97 -1.43 114.38 119.31 1xxm h ARG 204 Ca 0.06 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 1xxm h ARG 204 Cb 0.76 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 1xxm h ARG 204 CO 0.06 0.54 0.09 0.37 -1.07 0.00 0.00 179.97 179.96 1xxm h GLN 205 N 0.38 0.27 -0.28 0.04 5.75 -1.13 -2.01 115.11 118.14 1xxm h GLN 205 Ca 0.11 -0.04 0.04 0.00 -0.15 0.00 0.00 58.65 58.61 1xxm h GLN 205 Cb 0.23 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.70 1xxm h GLN 205 CO -0.00 0.29 0.03 0.37 -2.65 0.00 0.00 178.83 176.87 1xxm h GLN 206 N 0.18 0.12 0.11 1.69 5.75 -1.15 0.31 115.11 122.11 1xxm h GLN 206 Ca 0.06 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.56 1xxm h GLN 206 Cb 0.11 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 1xxm h GLN 206 CO -0.01 0.08 -0.11 1.25 -2.65 0.00 0.00 178.83 177.39 1xxm h LEU 207 N 0.13 -0.30 -1.36 -2.39 5.85 -1.13 0.21 115.31 116.32 1xxm h LEU 207 Ca 0.13 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 1xxm h LEU 207 Cb 0.15 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1xxm h LEU 207 CO -0.19 -0.17 -0.20 -0.29 -0.34 0.00 0.00 178.44 177.25 1xxm h ILE 208 N -0.25 1.20 -0.41 4.05 2.10 -1.14 -1.81 117.51 121.25 1xxm h ILE 208 Ca 0.01 -0.90 -0.04 0.00 1.08 0.00 0.00 64.86 65.01 1xxm h ILE 208 Cb 0.24 1.34 -0.02 0.00 -1.09 0.00 0.00 36.82 37.29 1xxm h ILE 208 CO -0.03 0.27 0.12 0.44 -1.08 0.00 0.00 178.15 177.87 1xxm h ASP 209 N 0.17 0.61 -0.40 2.19 3.32 0.31 0.14 116.42 122.76 1xxm h ASP 209 Ca 0.03 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 56.86 1xxm h ASP 209 Cb 0.45 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 1xxm h ASP 209 CO 0.03 0.66 0.24 -0.50 -1.72 0.00 0.00 179.24 177.96 1xxm h TRP 210 N 0.52 0.53 -0.56 4.55 6.55 -0.55 -2.05 115.95 124.94 1xxm h TRP 210 Ca 0.13 -0.00 -0.02 0.00 0.95 0.00 0.00 58.89 59.95 1xxm h TRP 210 Cb 0.28 -0.17 -0.03 0.00 -0.86 0.00 0.00 29.16 28.38 1xxm h TRP 210 CO 0.01 0.38 0.26 0.52 -1.05 0.00 0.00 178.44 178.56 1xxm h MET 211 N 0.53 0.80 -0.09 0.49 2.86 -0.99 -1.97 114.93 116.55 1xxm h MET 211 Ca 0.14 -0.10 -0.09 0.00 -2.06 0.00 0.00 59.70 57.59 1xxm h MET 211 Cb 0.00 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.50 1xxm h MET 211 CO -0.03 0.63 -0.35 1.49 1.06 0.00 0.00 176.91 179.71 1xxm h GLU 212 N 0.79 0.19 -0.02 1.72 4.81 -0.32 -1.85 114.58 119.90 1xxm h GLU 212 Ca 0.20 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1xxm h GLU 212 Cb 0.11 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1xxm h GLU 212 CO -0.02 0.52 0.00 0.00 -0.73 0.00 0.00 179.01 178.78 1xxm n ALA 213 N -2.47 2.54 -1.57 2.92 0.00 -0.75 -4.87 120.51 116.31 1xxm n ALA 213 Ca -0.01 -0.09 -0.55 0.00 0.00 0.00 0.00 53.44 52.79 1xxm n ALA 213 Cb 0.42 -1.11 -0.07 0.00 0.00 0.00 0.00 19.45 18.70 1xxm n ALA 213 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xxm n ASP 214 N -0.52 1.07 -0.00 0.00 -0.08 -0.93 -4.82 116.55 111.26 1xxm n ASP 214 Ca 0.06 1.13 0.07 0.00 -1.51 0.00 0.00 54.79 54.55 1xxm n ASP 214 Cb 0.05 -1.08 -0.10 0.00 2.34 0.00 0.00 41.12 42.33 1xxm n ASP 214 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1xxm n LYS 215 N 2.32 1.57 -0.25 -0.67 4.76 -0.70 -4.65 118.16 120.53 1xxm n LYS 215 Ca 0.20 -0.04 0.08 0.00 -2.87 0.00 0.00 58.31 55.67 1xxm n LYS 215 Cb 0.14 -1.25 0.18 0.00 -1.84 0.00 0.00 35.03 32.26 1xxm n LYS 215 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1xxm n VAL 216 N -1.57 1.88 -1.07 -0.18 0.24 -1.22 -4.62 118.33 111.78 1xxm n VAL 216 Ca 0.01 -1.81 0.08 0.00 -2.04 0.00 0.00 64.34 60.58 1xxm n VAL 216 Cb 0.29 -0.08 0.22 0.00 -1.47 0.00 0.00 33.84 32.80 1xxm n VAL 216 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xxm n ALA 217 N -0.67 2.97 -0.20 2.33 0.00 -1.26 -4.77 120.51 118.91 1xxm n ALA 217 Ca 0.16 -2.50 -0.03 0.00 0.00 0.00 0.00 53.44 51.08 1xxm n ALA 217 Cb 0.69 -0.63 0.07 0.00 0.00 0.00 0.00 19.45 19.59 1xxm n ALA 217 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1xxm h GLY 218 N 1.26 0.86 0.48 0.00 0.00 -1.91 -2.36 103.07 101.39 1xxm h GLY 218 Ca 0.02 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.13 1xxm h GLY 218 CO 0.18 0.15 0.00 -1.55 0.00 0.00 0.00 176.54 175.32 1xxm n PRO 219 N -4.82 0.75 0.00 4.80 -0.04 -1.26 -2.28 135.00 132.14 1xxm n PRO 219 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1xxm n PRO 219 Cb 0.15 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 1xxm n PRO 219 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1xxm n LEU 220 N -0.74 0.00 0.01 1.53 4.77 -0.89 -4.54 117.00 117.15 1xxm n LEU 220 Ca 0.09 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.16 1xxm n LEU 220 Cb 0.04 0.00 0.52 0.00 -2.33 0.00 0.00 43.42 41.65 1xxm n LEU 220 CO 0.06 0.00 1.16 -0.07 -1.33 0.00 0.00 177.39 177.21 1xxm h LEU 221 N 0.00 0.29 -1.69 2.23 3.38 -1.83 -2.23 115.31 115.46 1xxm h LEU 221 Ca 0.00 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1xxm h LEU 221 Cb 0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1xxm h LEU 221 CO 0.00 0.19 -0.04 0.03 0.09 0.00 0.00 178.44 178.72 1xxm h ARG 222 N 0.33 0.15 0.00 1.13 3.08 -1.76 -1.83 114.38 115.48 1xxm h ARG 222 Ca 0.19 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1xxm h ARG 222 Cb 0.31 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1xxm h ARG 222 CO -0.04 0.20 0.00 -1.13 -1.07 0.00 0.00 179.97 177.93 1xxm n SER 223 N -4.41 0.00 0.00 7.04 3.41 -0.84 -2.43 113.62 116.39 1xxm n SER 223 Ca -0.01 -0.63 0.00 0.00 -0.26 0.00 0.00 58.87 57.96 1xxm n SER 223 Cb 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 1xxm n SER 223 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xxm n ALA 224 N -1.00 1.59 -2.55 7.33 0.00 -0.72 -5.04 120.51 120.12 1xxm n ALA 224 Ca 0.15 -0.26 -0.43 0.00 0.00 0.00 0.00 53.44 52.90 1xxm n ALA 224 Cb 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.50 1xxm n ALA 224 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1xxm s LEU 225 N -0.29 4.17 0.61 0.00 2.96 -1.02 -4.74 118.68 120.37 1xxm s LEU 225 Ca 0.00 1.56 -0.17 0.00 -0.22 0.00 0.00 54.13 55.30 1xxm s LEU 225 Cb 0.00 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.12 1xxm s LEU 225 CO 0.00 -0.66 1.14 -2.84 -1.32 0.00 0.00 176.35 172.66 1xxm s PRO 226 N 3.03 2.97 0.43 0.98 0.02 -1.26 -4.96 135.00 136.21 1xxm s PRO 226 Ca 0.50 1.56 -0.25 0.00 0.02 0.00 0.00 61.00 62.83 1xxm s PRO 226 Cb -0.19 -1.96 -0.09 0.00 0.02 0.00 0.00 34.50 32.28 1xxm s PRO 226 CO 0.13 -1.15 1.32 0.00 -0.33 0.00 0.00 177.00 176.97 1xxm n ALA 227 N -1.92 1.52 0.00 -1.55 0.00 -1.26 -2.46 120.51 114.83 1xxm n ALA 227 Ca 0.12 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1xxm n ALA 227 Cb 0.51 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.66 1xxm n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xxm n GLY 228 N 0.74 3.15 3.82 0.00 0.00 -1.26 -4.96 105.19 106.68 1xxm n GLY 228 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 1xxm n GLY 228 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1xxm s TRP 229 N -2.55 3.13 0.02 1.61 0.52 -1.03 0.67 118.94 121.32 1xxm s TRP 229 Ca 0.00 1.43 0.03 0.00 0.02 0.00 0.00 56.10 57.58 1xxm s TRP 229 Cb 0.00 -2.89 -0.04 0.00 -1.15 0.00 0.00 33.47 29.39 1xxm s TRP 229 CO 0.00 -1.15 -0.04 0.12 0.02 0.00 0.00 176.95 175.90 1xxm s PHE 230 N -2.93 2.94 -0.23 -1.98 5.36 -0.38 -4.58 117.98 116.18 1xxm s PHE 230 Ca 0.59 -0.02 -0.14 0.00 -0.96 0.00 0.00 56.93 56.41 1xxm s PHE 230 Cb -0.14 -1.60 0.07 0.00 -0.34 0.00 0.00 43.02 41.01 1xxm s PHE 230 CO 0.51 0.41 0.57 -1.50 -1.46 0.00 0.00 175.22 173.75 1xxm s ILE 231 N -1.08 -0.01 -0.13 3.12 2.07 -1.26 -2.36 121.20 121.56 1xxm s ILE 231 Ca 0.19 0.04 0.01 0.00 -1.41 0.00 0.00 60.65 59.48 1xxm s ILE 231 Cb -0.11 -0.82 0.02 0.00 0.13 0.00 0.00 42.46 41.67 1xxm s ILE 231 CO 0.10 0.02 -0.14 0.00 -1.91 0.00 0.00 174.94 173.01 1xxm s ALA 232 N 1.40 1.70 0.30 1.50 0.00 -0.58 -4.42 121.76 121.65 1xxm s ALA 232 Ca -0.09 -0.77 -0.04 0.00 0.00 0.00 0.00 51.96 51.06 1xxm s ALA 232 Cb -0.06 -0.93 -0.01 0.00 0.00 0.00 0.00 23.12 22.11 1xxm s ALA 232 CO -0.15 -0.26 0.40 0.16 0.00 0.00 0.00 175.76 175.92 1xxm s ASP 233 N 1.31 0.63 -0.19 0.00 3.84 -0.74 -1.05 116.67 120.46 1xxm s ASP 233 Ca 0.00 -1.37 -0.07 0.00 -0.00 0.00 0.00 52.55 51.11 1xxm s ASP 233 Cb -0.14 0.59 0.08 0.00 -1.38 0.00 0.00 42.92 42.08 1xxm s ASP 233 CO -0.06 -1.17 0.41 -0.75 -0.00 0.00 0.00 175.17 173.60 1xxm s LYS 234 N -3.49 0.33 0.46 2.11 2.47 -0.45 -4.66 119.74 116.52 1xxm s LYS 234 Ca 0.31 0.98 0.07 0.00 -1.56 0.00 0.00 55.97 55.78 1xxm s LYS 234 Cb 0.01 0.26 0.03 0.00 -1.46 0.00 0.00 37.83 36.66 1xxm s LYS 234 CO 0.17 -0.24 0.63 -1.54 0.16 0.00 0.00 175.35 174.53 1xxm s SER 235 N 2.41 5.51 -0.03 1.43 1.04 -1.26 -1.63 113.70 121.17 1xxm s SER 235 Ca -0.03 -0.42 -0.23 0.00 0.48 0.00 0.00 55.95 55.75 1xxm s SER 235 Cb -0.11 -0.55 0.05 0.00 0.10 0.00 0.00 66.02 65.50 1xxm s SER 235 CO -0.13 -0.90 0.49 -0.83 0.98 0.00 0.00 173.24 172.85 1xxm s GLY 236 N -4.41 -0.36 -0.09 7.32 0.00 -0.40 -3.65 107.32 105.74 1xxm s GLY 236 Ca 0.56 0.80 -0.08 0.00 0.00 0.00 0.00 44.72 46.01 1xxm s GLY 236 CO 0.35 0.52 0.24 0.00 0.00 0.00 0.00 173.10 174.20 1xxm s ALA 237 N -1.26 -0.58 0.00 3.20 0.00 -1.26 -1.64 121.76 120.21 1xxm s ALA 237 Ca -0.12 0.72 0.00 0.00 0.00 0.00 0.00 51.96 52.56 1xxm s ALA 237 Cb -0.03 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.66 1xxm s ALA 237 CO 0.07 -0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.11 1xxm n GLY 238 N 3.16 4.79 3.90 0.00 0.00 -0.10 -4.66 105.19 112.28 1xxm n GLY 238 Ca -0.15 -1.25 -0.29 0.00 0.00 0.00 0.00 46.02 44.33 1xxm n GLY 238 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xxm s GLU 239 N 1.14 1.91 -1.47 1.61 0.41 -0.55 -3.66 118.70 118.09 1xxm s GLU 239 Ca 0.00 0.11 -0.12 0.00 -0.41 0.00 0.00 54.97 54.56 1xxm s GLU 239 Cb 0.00 -1.94 0.06 0.00 -1.78 0.00 0.00 34.13 30.46 1xxm s GLU 239 CO 0.00 -1.64 1.03 0.54 -0.49 0.00 0.00 175.26 174.71 1xxm n ARG 240 N -3.35 -6.25 -1.61 1.61 5.12 -1.26 -1.49 116.66 109.43 1xxm n ARG 240 Ca 0.08 0.67 -0.19 0.00 -1.93 0.00 0.00 57.85 56.49 1xxm n ARG 240 Cb 0.61 -5.60 -0.07 0.00 -1.16 0.00 0.00 32.46 26.24 1xxm n ARG 240 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1xxm n GLY 241 N -1.77 1.62 3.72 -0.13 0.00 -1.18 0.34 105.19 107.78 1xxm n GLY 241 Ca 0.01 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 1xxm n GLY 241 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xxm s SER 242 N -2.75 6.70 -0.01 1.61 0.01 -0.55 -4.40 113.70 114.30 1xxm s SER 242 Ca 0.00 2.48 -0.15 0.00 1.31 0.00 0.00 55.95 59.59 1xxm s SER 242 Cb 0.00 -2.59 0.02 0.00 0.21 0.00 0.00 66.02 63.66 1xxm s SER 242 CO 0.00 -0.75 0.31 -0.60 0.41 0.00 0.00 173.24 172.61 1xxm s ARG 243 N 1.21 0.68 0.01 12.44 6.06 -0.39 -0.92 118.95 138.04 1xxm s ARG 243 Ca 0.68 -0.22 -0.29 0.00 -2.50 0.00 0.00 55.73 53.40 1xxm s ARG 243 Cb -0.40 0.30 0.11 0.00 0.06 0.00 0.00 34.95 35.02 1xxm s ARG 243 CO 0.31 -0.19 1.25 0.20 -2.50 0.00 0.00 175.30 174.36 1xxm s GLY 244 N -1.39 -0.32 -0.22 8.12 0.00 -0.65 -1.02 107.32 111.83 1xxm s GLY 244 Ca -0.13 0.47 -0.27 0.00 0.00 0.00 0.00 44.72 44.79 1xxm s GLY 244 CO 0.04 1.21 0.84 -1.50 0.00 0.00 0.00 173.10 173.68 1xxm s ILE 245 N -2.41 0.00 0.01 0.90 2.07 0.47 -1.27 121.20 120.96 1xxm s ILE 245 Ca 0.17 0.00 0.07 0.00 -1.41 0.00 0.00 60.65 59.48 1xxm s ILE 245 Cb 0.03 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.60 1xxm s ILE 245 CO -0.02 0.00 -0.21 0.27 -1.91 0.00 0.00 174.94 173.07 1xxm s ILE 246 N -0.10 1.68 0.14 2.00 -4.36 -0.64 -1.15 121.20 118.76 1xxm s ILE 246 Ca -0.01 -1.01 -0.22 0.00 -0.26 0.00 0.00 60.65 59.15 1xxm s ILE 246 Cb -0.04 -1.41 0.06 0.00 1.25 0.00 0.00 42.46 42.32 1xxm s ILE 246 CO 0.00 0.38 0.56 0.00 0.24 0.00 0.00 174.94 176.13 1xxm s ALA 247 N -0.60 -1.47 -0.15 2.27 0.00 0.16 -1.34 121.76 120.63 1xxm s ALA 247 Ca 0.08 0.43 0.01 0.00 0.00 0.00 0.00 51.96 52.48 1xxm s ALA 247 Cb -0.08 0.79 0.02 0.00 0.00 0.00 0.00 23.12 23.84 1xxm s ALA 247 CO 0.00 -0.71 -0.17 0.00 0.00 0.00 0.00 175.76 174.87 1xxm s ALA 248 N -3.58 2.06 0.18 0.00 0.00 -0.22 -0.65 121.76 119.55 1xxm s ALA 248 Ca 0.01 -1.02 -0.09 0.00 0.00 0.00 0.00 51.96 50.85 1xxm s ALA 248 Cb -0.00 -1.07 -0.01 0.00 0.00 0.00 0.00 23.12 22.04 1xxm s ALA 248 CO -0.11 -0.30 0.30 -0.48 0.00 0.00 0.00 175.76 175.17 1xxm s LEU 249 N 1.29 0.87 0.00 0.00 2.34 -0.39 -1.53 118.68 121.26 1xxm s LEU 249 Ca 0.02 -0.92 0.00 0.00 0.06 0.00 0.00 54.13 53.30 1xxm s LEU 249 Cb -0.13 1.22 0.00 0.00 -0.56 0.00 0.00 46.19 46.72 1xxm s LEU 249 CO -0.10 -0.93 0.00 0.61 -1.06 0.00 0.00 176.35 174.88 1xxm n GLY 250 N -0.24 0.63 3.86 -3.48 0.00 -0.99 -1.42 105.19 103.54 1xxm n GLY 250 Ca -0.06 -0.77 -0.29 0.00 0.00 0.00 0.00 46.02 44.90 1xxm n GLY 250 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xxm s PRO 251 N -2.00 1.51 -1.29 1.61 0.04 -1.24 -1.25 135.00 132.38 1xxm s PRO 251 Ca 0.00 0.11 -0.02 0.00 0.04 0.00 0.00 61.00 61.13 1xxm s PRO 251 Cb 0.00 -1.90 -0.00 0.00 0.04 0.00 0.00 34.50 32.64 1xxm s PRO 251 CO 0.00 -1.91 0.69 -0.25 0.04 0.00 0.00 177.00 175.57 1xxm n ASP 252 N -3.53 -1.74 -2.10 6.66 9.92 -1.24 -2.72 116.55 121.81 1xxm n ASP 252 Ca 0.08 -0.85 -0.10 0.00 -0.53 0.00 0.00 54.79 53.39 1xxm n ASP 252 Cb 0.60 -3.94 -0.02 0.00 -0.64 0.00 0.00 41.12 37.12 1xxm n ASP 252 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1xxm n GLY 253 N -1.61 -0.06 2.98 0.44 0.00 0.21 -4.92 105.19 102.24 1xxm n GLY 253 Ca -0.27 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.62 1xxm n GLY 253 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xxm s LYS 254 N -4.35 0.14 0.17 1.61 1.02 -1.10 -4.71 119.74 112.51 1xxm s LYS 254 Ca 0.00 0.28 -0.30 0.00 0.02 0.00 0.00 55.97 55.97 1xxm s LYS 254 Cb 0.00 -0.03 -0.07 0.00 -0.52 0.00 0.00 37.83 37.21 1xxm s LYS 254 CO 0.00 -0.08 1.10 -1.25 -0.92 0.00 0.00 175.35 174.20 1xxm s PRO 255 N 0.54 4.59 0.00 -1.68 0.04 -1.26 -3.44 135.00 133.78 1xxm s PRO 255 Ca -0.04 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.72 1xxm s PRO 255 Cb -0.05 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 31.20 1xxm s PRO 255 CO -0.03 0.06 0.00 -1.13 0.04 0.00 0.00 177.00 175.95 1xxm n SER 256 N 2.44 0.94 -3.95 6.66 3.41 -0.51 -4.84 113.62 117.77 1xxm n SER 256 Ca 0.03 -0.15 -0.08 0.00 -0.26 0.00 0.00 58.87 58.41 1xxm n SER 256 Cb 0.46 0.49 -0.09 0.00 -0.26 0.00 0.00 64.21 64.81 1xxm n SER 256 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1xxm s ARG 257 N -0.67 0.71 -0.10 4.33 0.52 -0.69 -1.11 118.95 121.93 1xxm s ARG 257 Ca 0.00 -1.01 0.01 0.00 -0.52 0.00 0.00 55.73 54.21 1xxm s ARG 257 Cb 0.00 0.27 -0.02 0.00 0.52 0.00 0.00 34.95 35.72 1xxm s ARG 257 CO 0.00 -0.19 -0.12 0.42 0.02 0.00 0.00 175.30 175.43 1xxm s ILE 258 N -3.63 3.18 -0.08 1.52 1.01 0.25 -1.26 121.20 122.19 1xxm s ILE 258 Ca 0.04 -0.64 0.04 0.00 0.00 0.00 0.00 60.65 60.09 1xxm s ILE 258 Cb 0.05 -2.31 -0.00 0.00 0.01 0.00 0.00 42.46 40.20 1xxm s ILE 258 CO -0.09 0.55 -0.21 -0.69 0.00 0.00 0.00 174.94 174.49 1xxm s VAL 259 N -0.05 1.82 -0.07 2.92 1.01 0.18 -0.01 120.40 126.21 1xxm s VAL 259 Ca -0.02 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.07 1xxm s VAL 259 Cb -0.14 -1.57 0.02 0.00 0.00 0.00 0.00 36.38 34.69 1xxm s VAL 259 CO 0.04 0.51 -0.09 -0.69 0.00 0.00 0.00 175.10 174.87 1xxm s VAL 260 N 0.23 0.96 -0.04 2.92 1.01 -0.45 -0.67 120.40 124.36 1xxm s VAL 260 Ca -0.13 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.52 1xxm s VAL 260 Cb -0.16 -0.92 0.03 0.00 0.00 0.00 0.00 36.38 35.32 1xxm s VAL 260 CO 0.06 0.33 -0.02 -0.63 0.00 0.00 0.00 175.10 174.84 1xxm s ILE 261 N 1.02 0.35 0.06 2.22 1.01 -0.30 -1.63 121.20 123.92 1xxm s ILE 261 Ca -0.08 0.02 0.02 0.00 0.00 0.00 0.00 60.65 60.61 1xxm s ILE 261 Cb -0.15 -0.43 -0.03 0.00 0.01 0.00 0.00 42.46 41.87 1xxm s ILE 261 CO -0.00 0.20 -0.08 -0.31 0.00 0.00 0.00 174.94 174.75 1xxm s TYR 262 N 1.17 0.74 -0.11 3.97 1.51 -0.30 -0.40 117.35 123.95 1xxm s TYR 262 Ca -0.07 -0.63 -0.20 0.00 -1.01 0.00 0.00 57.07 55.16 1xxm s TYR 262 Cb -0.14 -0.44 0.05 0.00 -0.11 0.00 0.00 41.96 41.32 1xxm s TYR 262 CO -0.02 -0.10 0.49 -0.08 -1.11 0.00 0.00 175.55 174.73 1xxm s THR 263 N -2.07 0.02 -0.08 -0.71 -1.32 -0.19 0.66 115.64 111.95 1xxm s THR 263 Ca -0.03 -0.14 -0.23 0.00 -1.21 0.00 0.00 61.69 60.08 1xxm s THR 263 Cb -0.05 -0.75 0.05 0.00 -1.51 0.00 0.00 72.50 70.24 1xxm s THR 263 CO -0.01 -0.08 0.52 0.28 -2.21 0.00 0.00 174.62 173.12 1xxm s THR 264 N -0.54 0.02 0.00 5.08 -1.32 -1.20 -1.26 115.64 116.42 1xxm s THR 264 Ca -0.07 -0.16 0.00 0.00 -1.21 0.00 0.00 61.69 60.26 1xxm s THR 264 Cb -0.03 -0.81 0.00 0.00 -1.51 0.00 0.00 72.50 70.15 1xxm s THR 264 CO 0.04 -0.09 0.00 0.61 -2.21 0.00 0.00 174.62 172.97 1xxm n GLY 265 N 1.51 1.20 3.77 6.08 0.00 0.15 -4.02 105.19 113.89 1xxm n GLY 265 Ca -0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 1xxm n GLY 265 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xxm s SER 266 N -1.74 6.26 0.00 1.61 0.15 -1.19 -4.83 113.70 113.96 1xxm s SER 266 Ca 0.00 2.25 0.15 0.00 0.70 0.00 0.00 55.95 59.05 1xxm s SER 266 Cb 0.00 -2.60 0.27 0.00 -1.71 0.00 0.00 66.02 61.98 1xxm s SER 266 CO 0.00 -0.85 1.16 0.00 1.20 0.00 0.00 173.24 174.76 1xxm n GLN 267 N -0.45 1.93 -1.65 5.44 6.02 -1.26 -3.12 117.38 124.30 1xxm n GLN 267 Ca 0.07 -1.82 -0.32 0.00 -0.01 0.00 0.00 57.00 54.91 1xxm n GLN 267 Cb 0.48 -1.34 0.06 0.00 1.02 0.00 0.00 30.24 30.46 1xxm n GLN 267 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xxm s ALA 268 N -1.17 2.45 1.21 -1.58 0.00 -1.26 -5.02 121.76 116.39 1xxm s ALA 268 Ca 0.25 0.43 -0.15 0.00 0.00 0.00 0.00 51.96 52.49 1xxm s ALA 268 Cb 0.15 -3.29 0.30 0.00 0.00 0.00 0.00 23.12 20.28 1xxm s ALA 268 CO 0.21 -1.35 1.01 0.95 0.00 0.00 0.00 175.76 176.58 1xxm s THR 269 N -2.53 1.85 0.16 0.00 -4.23 -1.26 -4.82 115.64 104.80 1xxm s THR 269 Ca 0.65 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 61.08 1xxm s THR 269 Cb -0.19 -2.12 -0.05 0.00 1.34 0.00 0.00 72.50 71.48 1xxm s THR 269 CO 0.45 0.00 1.48 -0.03 -0.54 0.00 0.00 174.62 175.99 1xxm h MET 270 N -2.74 0.79 -0.62 3.99 4.05 -1.99 -2.55 114.93 115.86 1xxm h MET 270 Ca -0.58 -0.45 0.03 0.00 -0.28 0.00 0.00 59.70 58.42 1xxm h MET 270 Cb 1.34 0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 32.13 1xxm h MET 270 CO 0.47 1.08 0.37 -0.44 0.23 0.00 0.00 176.91 178.63 1xxm h ASP 271 N 0.63 0.61 -0.34 1.39 3.32 -1.99 0.20 116.42 120.24 1xxm h ASP 271 Ca 0.03 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.06 1xxm h ASP 271 Cb 1.04 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.45 1xxm h ASP 271 CO 0.10 0.42 0.08 -0.08 -1.72 0.00 0.00 179.24 178.05 1xxm h GLU 272 N 0.73 0.55 -0.49 3.56 4.57 -1.90 0.11 114.58 121.71 1xxm h GLU 272 Ca 0.25 -0.13 -0.00 0.00 -1.18 0.00 0.00 59.36 58.30 1xxm h GLU 272 Cb 0.03 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 1xxm h GLU 272 CO -0.11 0.60 0.30 0.00 -1.18 0.00 0.00 179.01 178.62 1xxm h ARG 273 N 0.40 0.66 0.12 1.92 3.08 -1.02 -0.46 114.38 119.07 1xxm h ARG 273 Ca 0.11 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 1xxm h ARG 273 Cb 0.30 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.21 1xxm h ARG 273 CO 0.00 0.48 -0.06 -0.91 -1.07 0.00 0.00 179.97 178.41 1xxm h ASN 274 N 0.65 -0.13 -0.51 7.04 2.35 -0.40 -2.48 115.58 122.10 1xxm h ASN 274 Ca 0.17 -0.03 0.10 0.00 -0.55 0.00 0.00 56.30 56.00 1xxm h ASN 274 Cb -0.01 0.03 -0.09 0.00 0.05 0.00 0.00 38.32 38.30 1xxm h ASN 274 CO -0.03 -0.06 -0.09 0.03 -1.65 0.00 0.00 177.43 175.62 1xxm h ARG 275 N -0.19 0.03 -0.96 0.81 3.08 -0.43 0.32 114.38 117.03 1xxm h ARG 275 Ca -0.02 -0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.07 1xxm h ARG 275 Cb 0.15 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.14 1xxm h ARG 275 CO 0.03 0.02 0.63 1.96 -1.07 0.00 0.00 179.97 181.53 1xxm h GLN 276 N 0.03 1.19 -0.50 0.04 1.08 -0.91 0.16 115.11 116.20 1xxm h GLN 276 Ca 0.25 -0.07 -0.12 0.00 -1.45 0.00 0.00 58.65 57.26 1xxm h GLN 276 Cb 0.38 -0.27 -0.02 0.00 -0.05 0.00 0.00 27.48 27.53 1xxm h GLN 276 CO -0.50 0.79 -0.17 0.82 -0.95 0.00 0.00 178.83 178.82 1xxm h ILE 277 N 1.23 1.27 -0.63 2.54 2.04 -0.82 -2.18 117.51 120.94 1xxm h ILE 277 Ca 0.38 -1.32 -0.08 0.00 1.00 0.00 0.00 64.86 64.84 1xxm h ILE 277 Cb -0.01 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1xxm h ILE 277 CO -0.12 0.46 0.09 0.00 0.00 0.00 0.00 178.15 178.58 1xxm h ALA 278 N 0.94 0.84 -0.42 1.87 0.00 -0.17 -1.80 119.26 120.53 1xxm h ALA 278 Ca 0.12 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 1xxm h ALA 278 Cb 0.73 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1xxm h ALA 278 CO 0.06 0.61 0.01 0.93 0.00 0.00 0.00 179.25 180.86 1xxm h GLU 279 N 0.97 0.67 -0.34 0.00 5.08 -0.55 0.23 114.58 120.63 1xxm h GLU 279 Ca 0.19 -0.16 -0.11 0.00 -1.00 0.00 0.00 59.36 58.28 1xxm h GLU 279 Cb 0.45 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1xxm h GLU 279 CO 0.01 0.68 -0.24 0.82 -1.00 0.00 0.00 179.01 179.28 1xxm h ILE 280 N 0.64 1.27 -0.36 3.13 2.04 -1.14 -1.71 117.51 121.38 1xxm h ILE 280 Ca 0.13 -1.34 -0.08 0.00 1.00 0.00 0.00 64.86 64.57 1xxm h ILE 280 Cb 0.38 1.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 1xxm h ILE 280 CO 0.01 0.44 -0.10 1.23 0.00 0.00 0.00 178.15 179.73 1xxm h GLY 281 N 0.99 0.76 2.00 5.37 0.00 -0.46 -2.10 103.07 109.63 1xxm h GLY 281 Ca 0.08 -0.64 -0.01 0.00 0.00 0.00 0.00 47.33 46.76 1xxm h GLY 281 CO 0.06 0.58 -0.06 0.00 0.00 0.00 0.00 176.54 177.12 1xxm h ALA 282 N 0.81 1.78 0.07 3.60 0.00 -0.31 -2.54 119.26 122.67 1xxm h ALA 282 Ca 0.09 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1xxm h ALA 282 Cb 0.62 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1xxm h ALA 282 CO 0.04 0.07 -0.04 1.03 0.00 0.00 0.00 179.25 180.35 1xxm h SER 283 N 0.00 -0.08 0.39 0.00 0.87 -0.95 -3.00 113.55 110.78 1xxm h SER 283 Ca -0.00 -0.46 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 1xxm h SER 283 Cb 0.11 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1xxm h SER 283 CO 0.01 0.59 0.00 0.17 -0.53 0.00 0.00 176.83 177.07 1xxm h LEU 284 N -0.94 0.00 0.05 2.23 -0.00 -1.35 -1.72 115.31 113.59 1xxm h LEU 284 Ca -0.01 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.78 1xxm h LEU 284 Cb 0.54 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.21 1xxm h LEU 284 CO 0.02 0.00 -0.38 0.40 -0.00 0.00 0.00 178.44 178.48 1xxm h ILE 285 N 0.00 1.61 0.20 0.15 2.04 -1.53 -3.06 117.51 116.92 1xxm h ILE 285 Ca 0.00 -2.29 -0.01 0.00 1.00 0.00 0.00 64.86 63.57 1xxm h ILE 285 Cb 0.19 3.12 -0.00 0.00 -0.74 0.00 0.00 36.82 39.38 1xxm h ILE 285 CO 0.00 0.63 -0.13 0.50 0.00 0.00 0.00 178.15 179.15 1xxm h LYS 286 N -0.60 -0.31 -1.25 2.37 3.64 -1.26 -2.50 116.57 116.66 1xxm h LYS 286 Ca -0.06 0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.19 1xxm h LYS 286 Cb 1.24 0.07 -0.08 0.00 -0.41 0.00 0.00 32.23 33.05 1xxm h LYS 286 CO 0.07 -0.21 0.19 0.72 -2.27 0.00 0.00 179.45 177.96 1xxm n HIS 287 N -5.24 0.82 1.98 1.91 8.25 -0.70 -5.13 115.22 117.12 1xxm n HIS 287 Ca -0.09 -1.08 0.16 0.00 -0.26 0.00 0.00 57.72 56.45 1xxm n HIS 287 Cb 0.16 -0.54 0.94 0.00 1.12 0.00 0.00 29.99 31.67 1xxm n HIS 287 CO 0.00 0.00 0.00 1.87 0.64 0.00 0.00 176.34 178.85