#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dtm h PRO 27 N 0.00 0.25 -0.24 1.57 0.11 -1.98 -1.03 132.00 130.68 3dtm h PRO 27 Ca 0.00 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.06 3dtm h PRO 27 Cb 0.00 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 3dtm h PRO 27 CO 0.00 0.16 -0.03 0.93 -0.21 0.00 0.00 178.00 178.86 3dtm h GLU 28 N 0.25 0.36 -0.49 1.05 5.08 -1.99 -1.53 114.58 117.32 3dtm h GLU 28 Ca 0.62 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.86 3dtm h GLU 28 Cb 1.85 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 31.02 3dtm h GLU 28 CO -0.24 0.42 0.10 1.15 -1.00 0.00 0.00 179.01 179.44 3dtm h THR 29 N 0.35 1.22 -0.03 1.13 2.02 -1.49 -2.33 112.91 113.78 3dtm h THR 29 Ca 0.08 -0.79 -0.11 0.00 0.77 0.00 0.00 66.41 66.36 3dtm h THR 29 Cb 0.28 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.41 3dtm h THR 29 CO 0.01 0.29 -0.50 -0.07 0.37 0.00 0.00 175.52 175.62 3dtm h LEU 30 N 0.72 0.09 -0.32 2.58 3.38 -1.28 0.44 115.31 120.92 3dtm h LEU 30 Ca 0.16 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 3dtm h LEU 30 Cb 0.29 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3dtm h LEU 30 CO 0.00 0.58 0.10 0.58 0.09 0.00 0.00 178.44 179.79 3dtm h VAL 31 N 0.07 1.21 -0.36 1.22 2.07 -1.14 -1.25 116.25 118.06 3dtm h VAL 31 Ca -0.00 -0.67 -0.12 0.00 0.82 0.00 0.00 66.70 66.73 3dtm h VAL 31 Cb 0.92 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 3dtm h VAL 31 CO 0.07 0.23 -0.25 0.50 0.02 0.00 0.00 177.57 178.14 3dtm h LYS 32 N 0.37 0.73 -0.31 1.57 1.63 -1.06 -0.00 116.57 119.49 3dtm h LYS 32 Ca 0.10 -0.30 0.02 0.00 -0.85 0.00 0.00 60.65 59.62 3dtm h LYS 32 Cb 0.25 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.83 3dtm h LYS 32 CO -0.00 0.90 0.17 0.28 -3.45 0.00 0.00 179.45 177.35 3dtm h VAL 33 N 0.63 1.01 -0.60 2.00 2.07 -0.72 0.98 116.25 121.63 3dtm h VAL 33 Ca 0.08 -0.12 -0.08 0.00 0.82 0.00 0.00 66.70 67.40 3dtm h VAL 33 Cb 0.75 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 3dtm h VAL 33 CO 0.06 0.06 0.05 0.50 0.02 0.00 0.00 177.57 178.26 3dtm h LYS 34 N 0.35 1.00 -0.70 1.57 3.64 -1.05 -0.78 116.57 120.60 3dtm h LYS 34 Ca 0.13 -0.28 0.09 0.00 -1.27 0.00 0.00 60.65 59.32 3dtm h LYS 34 Cb 0.02 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 31.66 3dtm h LYS 34 CO -0.07 0.96 0.34 0.22 -2.27 0.00 0.00 179.45 178.63 3dtm h ASP 35 N 0.93 0.44 -0.59 4.20 3.58 -0.50 0.93 116.42 125.42 3dtm h ASP 35 Ca 0.18 0.06 -0.10 0.00 0.42 0.00 0.00 57.03 57.58 3dtm h ASP 35 Cb 0.48 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.49 3dtm h ASP 35 CO 0.02 0.25 -0.04 0.00 -2.88 0.00 0.00 179.24 176.59 3dtm h ALA 36 N 1.43 0.80 0.28 -0.78 0.00 -0.27 -1.26 119.26 119.47 3dtm h ALA 36 Ca 0.35 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3dtm h ALA 36 Cb 0.37 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3dtm h ALA 36 CO -0.27 0.68 -0.22 0.93 0.00 0.00 0.00 179.25 180.36 3dtm h GLU 37 N 0.97 -0.50 -0.34 0.00 5.08 -0.46 0.22 114.58 119.55 3dtm h GLU 37 Ca 0.16 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 3dtm h GLU 37 Cb 0.61 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 3dtm h GLU 37 CO 0.04 -0.33 0.14 -0.44 -1.00 0.00 0.00 179.01 177.42 3dtm h ASP 38 N -0.52 0.46 -0.49 1.42 3.32 -0.79 0.21 116.42 120.04 3dtm h ASP 38 Ca -0.02 -0.16 -0.13 0.00 0.02 0.00 0.00 57.03 56.74 3dtm h ASP 38 Cb 0.46 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 3dtm h ASP 38 CO -0.01 0.49 -0.21 1.56 -1.72 0.00 0.00 179.24 179.35 3dtm h GLN 39 N 0.40 1.00 0.00 3.56 1.08 -1.22 -2.71 115.11 117.22 3dtm h GLN 39 Ca 0.11 -0.43 -0.09 0.00 -1.45 0.00 0.00 58.65 56.80 3dtm h GLN 39 Cb 0.17 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.55 3dtm h GLN 39 CO -0.01 1.11 -0.42 -0.07 -0.95 0.00 0.00 178.83 178.49 3dtm h LEU 40 N 0.87 0.00 0.54 1.46 3.38 -0.83 -3.47 115.31 117.26 3dtm h LEU 40 Ca 0.11 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.91 3dtm h LEU 40 Cb 0.79 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.55 3dtm h LEU 40 CO 0.07 0.42 -0.25 0.61 0.09 0.00 0.00 178.44 179.37 3dtm n GLY 41 N 0.60 0.10 3.31 0.83 0.00 0.65 -4.34 105.19 106.33 3dtm n GLY 41 Ca 0.01 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 3dtm n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dtm s ALA 42 N -2.68 -1.02 0.08 4.61 0.00 -0.70 -4.70 121.76 117.34 3dtm s ALA 42 Ca 0.08 0.68 -0.35 0.00 0.00 0.00 0.00 51.96 52.38 3dtm s ALA 42 Cb -0.04 -0.09 -0.14 0.00 0.00 0.00 0.00 23.12 22.85 3dtm s ALA 42 CO 0.11 -0.27 1.60 0.54 0.00 0.00 0.00 175.76 177.73 3dtm n ARG 43 N 1.52 1.92 -4.92 0.00 1.74 -1.25 -4.41 116.66 111.25 3dtm n ARG 43 Ca -0.19 0.69 -0.33 0.00 -0.77 0.00 0.00 57.85 57.25 3dtm n ARG 43 Cb 0.56 -2.45 -0.14 0.00 -1.02 0.00 0.00 32.46 29.42 3dtm n ARG 43 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3dtm s VAL 44 N 1.54 2.96 -0.10 1.55 1.01 -1.26 -3.25 120.40 122.85 3dtm s VAL 44 Ca 0.83 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 62.09 3dtm s VAL 44 Cb -0.75 -2.16 0.01 0.00 0.00 0.00 0.00 36.38 33.47 3dtm s VAL 44 CO 0.43 0.58 -0.20 -0.83 0.00 0.00 0.00 175.10 175.09 3dtm s GLY 45 N -0.57 1.17 -0.03 4.51 0.00 -0.03 -4.55 107.32 107.82 3dtm s GLY 45 Ca 0.08 -0.83 -0.03 0.00 0.00 0.00 0.00 44.72 43.95 3dtm s GLY 45 CO 0.01 -0.11 0.08 -0.47 0.00 0.00 0.00 173.10 172.61 3dtm s TYR 46 N 0.56 -0.09 0.01 1.90 5.04 -0.11 -1.34 117.35 123.32 3dtm s TYR 46 Ca -0.15 0.23 -0.12 0.00 -2.44 0.00 0.00 57.07 54.59 3dtm s TYR 46 Cb -0.17 0.00 0.01 0.00 0.35 0.00 0.00 41.96 42.16 3dtm s TYR 46 CO 0.05 -0.06 0.25 -1.50 -1.34 0.00 0.00 175.55 172.96 3dtm s ILE 47 N 0.23 0.08 -0.05 3.14 2.07 -0.74 -1.67 121.20 124.25 3dtm s ILE 47 Ca -0.02 -0.63 0.01 0.00 -1.41 0.00 0.00 60.65 58.61 3dtm s ILE 47 Cb -0.03 -0.69 0.02 0.00 0.13 0.00 0.00 42.46 41.89 3dtm s ILE 47 CO -0.01 -0.35 -0.06 -0.70 -1.91 0.00 0.00 174.94 171.91 3dtm s GLU 48 N -1.78 1.02 -0.03 3.50 2.12 -0.60 -1.66 118.70 121.27 3dtm s GLU 48 Ca -0.11 -0.18 0.02 0.00 0.36 0.00 0.00 54.97 55.07 3dtm s GLU 48 Cb -0.04 -0.96 0.01 0.00 0.26 0.00 0.00 34.13 33.40 3dtm s GLU 48 CO 0.01 -0.05 -0.08 -1.17 -0.54 0.00 0.00 175.26 173.43 3dtm s LEU 49 N 0.84 1.65 -0.10 2.70 2.96 0.53 -0.31 118.68 126.94 3dtm s LEU 49 Ca -0.12 -0.18 -0.29 0.00 -0.22 0.00 0.00 54.13 53.31 3dtm s LEU 49 Cb -0.15 -0.54 -0.04 0.00 0.50 0.00 0.00 46.19 45.96 3dtm s LEU 49 CO 0.01 0.03 1.55 -0.62 -1.32 0.00 0.00 176.35 176.00 3dtm s ASP 50 N 0.44 6.70 0.25 3.68 2.15 -0.33 -0.53 116.67 129.03 3dtm s ASP 50 Ca -0.07 2.02 -0.05 0.00 0.43 0.00 0.00 52.55 54.87 3dtm s ASP 50 Cb -0.11 -2.53 0.30 0.00 -0.30 0.00 0.00 42.92 40.27 3dtm s ASP 50 CO 0.01 -0.93 1.90 0.25 -0.17 0.00 0.00 175.17 176.23 3dtm h LEU 51 N 10.30 1.04 0.78 -1.34 5.85 -1.57 0.05 115.31 130.41 3dtm h LEU 51 Ca -0.35 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 3dtm h LEU 51 Cb 1.16 -0.24 0.01 0.00 0.37 0.00 0.00 40.66 41.95 3dtm h LEU 51 CO 0.96 0.72 -0.37 -1.13 -0.34 0.00 0.00 178.44 178.28 3dtm h ASN 52 N 1.21 -0.88 0.57 1.25 -0.00 -1.91 -3.37 115.58 112.45 3dtm h ASN 52 Ca 0.38 0.03 0.00 0.00 -0.00 0.00 0.00 56.30 56.70 3dtm h ASN 52 Cb -0.01 0.23 0.00 0.00 -0.00 0.00 0.00 38.32 38.54 3dtm h ASN 52 CO -0.12 -0.51 -1.29 -1.54 -0.00 0.00 0.00 177.43 173.97 3dtm n SER 53 N -5.47 0.55 0.00 1.15 3.41 -1.23 -4.96 113.62 107.07 3dtm n SER 53 Ca -0.13 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 3dtm n SER 53 Cb 0.41 0.97 0.00 0.00 -0.26 0.00 0.00 64.21 65.34 3dtm n SER 53 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dtm n GLY 54 N 1.25 0.75 3.73 5.00 0.00 0.00 -5.00 105.19 110.91 3dtm n GLY 54 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3dtm n GLY 54 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dtm s LYS 55 N -0.00 4.48 -0.25 1.61 2.20 -1.25 -4.68 119.74 121.84 3dtm s LYS 55 Ca 0.00 1.80 -0.29 0.00 -0.36 0.00 0.00 55.97 57.12 3dtm s LYS 55 Cb 0.00 -3.30 -0.01 0.00 -1.51 0.00 0.00 37.83 33.02 3dtm s LYS 55 CO 0.00 -0.15 1.31 0.42 -0.36 0.00 0.00 175.35 176.58 3dtm s ILE 56 N 0.47 4.15 -0.14 5.43 1.01 -1.26 -1.19 121.20 129.67 3dtm s ILE 56 Ca 0.55 1.34 -0.20 0.00 0.00 0.00 0.00 60.65 62.34 3dtm s ILE 56 Cb -0.31 -4.07 -0.25 0.00 0.01 0.00 0.00 42.46 37.85 3dtm s ILE 56 CO 0.33 -0.35 0.51 -0.07 0.00 0.00 0.00 174.94 175.36 3dtm h LEU 57 N 10.55 0.21 -7.90 2.97 3.38 -1.03 -3.48 115.31 120.02 3dtm h LEU 57 Ca -0.27 -0.79 -0.09 0.00 0.09 0.00 0.00 57.88 56.82 3dtm h LEU 57 Cb 1.10 -0.07 -0.14 0.00 0.09 0.00 0.00 40.66 41.64 3dtm h LEU 57 CO 1.01 1.47 -0.43 -1.61 0.09 0.00 0.00 178.44 178.97 3dtm s GLU 58 N -2.40 0.80 0.06 1.13 0.41 -1.22 -4.78 118.70 112.71 3dtm s GLU 58 Ca -0.22 -1.01 -0.26 0.00 -0.41 0.00 0.00 54.97 53.06 3dtm s GLU 58 Cb 0.03 0.32 0.08 0.00 -1.78 0.00 0.00 34.13 32.78 3dtm s GLU 58 CO 0.71 -0.24 0.68 -1.54 -0.49 0.00 0.00 175.26 174.38 3dtm s SER 59 N -2.87 -0.56 -0.28 -0.19 1.04 -1.26 -1.55 113.70 108.02 3dtm s SER 59 Ca 0.06 0.24 -0.10 0.00 0.48 0.00 0.00 55.95 56.63 3dtm s SER 59 Cb 0.05 0.54 0.12 0.00 0.10 0.00 0.00 66.02 66.83 3dtm s SER 59 CO -0.11 -0.79 0.61 0.12 0.98 0.00 0.00 173.24 174.05 3dtm s PHE 60 N -2.75 -1.21 -0.94 5.02 5.36 -0.67 -4.91 117.98 117.88 3dtm s PHE 60 Ca -0.02 2.15 -0.03 0.00 -0.96 0.00 0.00 56.93 58.07 3dtm s PHE 60 Cb -0.01 0.69 0.02 0.00 -0.34 0.00 0.00 43.02 43.39 3dtm s PHE 60 CO -0.05 -0.62 0.15 0.54 -1.46 0.00 0.00 175.22 173.78 3dtm n ARG 61 N 5.32 -2.67 0.00 10.12 1.74 -1.26 -0.94 116.66 128.97 3dtm n ARG 61 Ca -0.12 0.45 0.09 0.00 -0.77 0.00 0.00 57.85 57.50 3dtm n ARG 61 Cb 0.50 -5.06 0.45 0.00 -1.02 0.00 0.00 32.46 27.34 3dtm n ARG 61 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3dtm n SER 62 N -1.89 0.00 -0.41 0.55 3.41 -1.26 -2.39 113.62 111.63 3dtm n SER 62 Ca -0.08 0.20 0.04 0.00 -0.26 0.00 0.00 58.87 58.77 3dtm n SER 62 Cb 0.57 -0.37 0.09 0.00 -0.26 0.00 0.00 64.21 64.24 3dtm n SER 62 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dtm n GLU 63 N -1.37 2.46 -3.55 4.33 -0.58 -1.26 -1.40 120.64 119.27 3dtm n GLU 63 Ca 0.07 -1.72 -0.34 0.00 -0.42 0.00 0.00 57.16 54.75 3dtm n GLU 63 Cb 0.18 -1.17 -0.05 0.00 -0.57 0.00 0.00 31.44 29.82 3dtm n GLU 63 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 3dtm s GLU 64 N -0.94 3.76 0.26 3.49 2.02 -1.01 -4.96 118.70 121.33 3dtm s GLU 64 Ca 0.14 0.17 -0.28 0.00 0.02 0.00 0.00 54.97 55.03 3dtm s GLU 64 Cb 0.08 -2.91 -0.09 0.00 0.10 0.00 0.00 34.13 31.30 3dtm s GLU 64 CO 0.10 0.50 0.92 1.03 0.02 0.00 0.00 175.26 177.84 3dtm s ARG 65 N -2.18 4.72 0.03 1.61 0.52 -1.26 -4.26 118.95 118.13 3dtm s ARG 65 Ca 0.37 1.39 -0.01 0.00 -0.52 0.00 0.00 55.73 56.96 3dtm s ARG 65 Cb -0.13 -3.09 -0.02 0.00 0.52 0.00 0.00 34.95 32.22 3dtm s ARG 65 CO 0.20 0.43 -0.02 -0.06 0.02 0.00 0.00 175.30 175.87 3dtm s PHE 66 N -1.34 0.31 0.23 -0.53 0.40 0.02 -4.97 117.98 112.10 3dtm s PHE 66 Ca 0.44 -0.64 -0.32 0.00 -0.60 0.00 0.00 56.93 55.81 3dtm s PHE 66 Cb -0.23 -0.23 -0.13 0.00 0.51 0.00 0.00 43.02 42.94 3dtm s PHE 66 CO 0.28 -0.24 1.47 -2.30 0.70 0.00 0.00 175.22 175.13 3dtm n PRO 67 N 1.21 2.15 0.11 0.24 -0.02 -1.26 -1.81 135.00 135.61 3dtm n PRO 67 Ca -0.21 0.77 -0.01 0.00 -2.02 0.00 0.00 63.50 62.02 3dtm n PRO 67 Cb 0.57 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.56 3dtm n PRO 67 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 3dtm h MET 68 N 4.66 0.00 0.00 -0.52 2.86 -1.78 -3.46 114.93 116.69 3dtm h MET 68 Ca -0.45 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.19 3dtm h MET 68 Cb 1.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.92 3dtm h MET 68 CO 0.79 0.70 0.00 -1.33 1.06 0.00 0.00 176.91 178.13 3dtm n MET 69 N -3.29 0.00 0.00 1.72 2.81 -1.26 -1.90 117.12 115.20 3dtm n MET 69 Ca 0.01 0.00 0.14 0.00 -1.81 0.00 0.00 57.70 56.04 3dtm n MET 69 Cb 0.81 0.00 0.54 0.00 -0.71 0.00 0.00 33.22 33.86 3dtm n MET 69 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 3dtm n SER 70 N 3.71 0.51 0.29 7.83 7.64 -1.26 -3.72 113.62 128.62 3dtm n SER 70 Ca 0.00 -0.49 0.17 0.00 1.01 0.00 0.00 58.87 59.57 3dtm n SER 70 Cb 0.00 -0.05 0.84 0.00 -1.01 0.00 0.00 64.21 63.99 3dtm n SER 70 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 3dtm h THR 71 N 0.55 0.18 0.00 0.44 1.35 -1.50 -2.38 112.91 111.55 3dtm h THR 71 Ca 0.00 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 3dtm h THR 71 Cb 0.41 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 3dtm h THR 71 CO 0.00 0.04 0.00 2.19 -0.25 0.00 0.00 175.52 177.50 3dtm h PHE 72 N 0.00 0.00 -0.08 4.73 -0.00 -1.68 -3.02 116.94 116.89 3dtm h PHE 72 Ca -0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.97 57.87 3dtm h PHE 72 Cb 0.33 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.27 3dtm h PHE 72 CO 0.00 0.00 -0.41 0.87 -0.00 0.00 0.00 178.31 178.77 3dtm h LYS 73 N 0.00 0.17 -0.64 6.09 1.57 -1.72 0.09 116.57 122.13 3dtm h LYS 73 Ca 0.00 -0.08 0.09 0.00 -1.87 0.00 0.00 60.65 58.79 3dtm h LYS 73 Cb 0.27 -0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.51 3dtm h LYS 73 CO 0.00 0.55 0.29 0.28 -0.57 0.00 0.00 179.45 180.00 3dtm h VAL 74 N 0.14 0.84 -0.24 0.50 2.07 -1.75 -0.45 116.25 117.36 3dtm h VAL 74 Ca 0.01 -0.18 -0.11 0.00 0.82 0.00 0.00 66.70 67.24 3dtm h VAL 74 Cb 0.79 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 3dtm h VAL 74 CO 0.06 0.09 -0.29 -0.07 0.02 0.00 0.00 177.57 177.38 3dtm h LEU 75 N 0.51 0.68 -0.29 2.57 3.38 -1.40 -1.41 115.31 119.34 3dtm h LEU 75 Ca 0.31 -0.50 0.07 0.00 0.09 0.00 0.00 57.88 57.86 3dtm h LEU 75 Cb 0.33 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 40.82 3dtm h LEU 75 CO -0.27 1.04 -0.28 0.25 0.09 0.00 0.00 178.44 179.27 3dtm h LEU 76 N 0.33 -0.91 -1.11 1.67 5.85 -0.88 -0.13 115.31 120.13 3dtm h LEU 76 Ca 0.03 0.16 -0.07 0.00 0.84 0.00 0.00 57.88 58.85 3dtm h LEU 76 Cb 0.87 0.42 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 3dtm h LEU 76 CO 0.07 -0.30 -0.31 0.00 -0.34 0.00 0.00 178.44 177.55 3dtm h GLY 78 N 1.86 0.13 0.88 0.00 0.00 -0.54 0.83 103.07 106.22 3dtm h GLY 78 Ca -0.00 0.03 0.03 0.00 0.00 0.00 0.00 47.33 47.39 3dtm h GLY 78 CO 0.04 -0.04 0.55 0.00 0.00 0.00 0.00 176.54 177.09 3dtm h ALA 79 N 1.14 1.12 -0.39 3.60 0.00 -0.39 -1.19 119.26 123.14 3dtm h ALA 79 Ca 0.07 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3dtm h ALA 79 Cb 0.09 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3dtm h ALA 79 CO -0.13 0.39 0.01 0.82 0.00 0.00 0.00 179.25 180.34 3dtm h ILE 80 N 1.07 1.26 -0.12 0.00 1.08 -1.11 -1.32 117.51 118.37 3dtm h ILE 80 Ca 0.34 -0.98 -0.08 0.00 -0.39 0.00 0.00 64.86 63.75 3dtm h ILE 80 Cb 0.00 1.12 -0.01 0.00 -3.07 0.00 0.00 36.82 34.87 3dtm h ILE 80 CO -0.11 0.33 -0.26 -0.07 -0.69 0.00 0.00 178.15 177.34 3dtm h LEU 81 N 0.51 0.22 -0.74 1.44 3.38 -0.51 -1.54 115.31 118.06 3dtm h LEU 81 Ca 0.11 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3dtm h LEU 81 Cb 0.46 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 3dtm h LEU 81 CO 0.02 0.49 0.38 -1.28 0.09 0.00 0.00 178.44 178.14 3dtm h SER 82 N 0.20 0.95 -0.21 -0.43 0.87 -0.89 -0.58 113.55 113.45 3dtm h SER 82 Ca 0.03 -0.12 -0.09 0.00 -1.23 0.00 0.00 61.79 60.39 3dtm h SER 82 Cb 0.58 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.28 3dtm h SER 82 CO 0.04 0.79 -0.14 0.03 -0.53 0.00 0.00 176.83 177.02 3dtm h ARG 83 N 1.03 0.61 0.39 2.24 3.08 -0.63 -2.71 114.38 118.39 3dtm h ARG 83 Ca 0.26 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 60.09 3dtm h ARG 83 Cb 0.08 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.08 3dtm h ARG 83 CO -0.04 0.73 -0.19 0.82 -1.07 0.00 0.00 179.97 180.23 3dtm h ILE 84 N 0.56 0.62 -1.02 2.04 2.04 -0.93 0.13 117.51 120.94 3dtm h ILE 84 Ca 0.10 -0.12 0.31 0.00 1.00 0.00 0.00 64.86 66.14 3dtm h ILE 84 Cb 0.57 0.69 -0.14 0.00 -0.74 0.00 0.00 36.82 37.20 3dtm h ILE 84 CO 0.04 0.02 0.60 0.44 0.00 0.00 0.00 178.15 179.25 3dtm h ASP 85 N -0.59 0.54 -0.13 1.72 3.32 -1.06 0.21 116.42 120.43 3dtm h ASP 85 Ca -0.05 0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3dtm h ASP 85 Cb 0.44 0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.09 3dtm h ASP 85 CO 0.09 -0.06 0.00 0.00 -1.72 0.00 0.00 179.24 177.55 3dtm n ALA 86 N -2.32 2.53 -1.29 3.45 0.00 -1.03 -4.93 120.51 116.92 3dtm n ALA 86 Ca 0.30 -0.49 -0.07 0.00 0.00 0.00 0.00 53.44 53.18 3dtm n ALA 86 Cb 0.94 -1.11 -0.03 0.00 0.00 0.00 0.00 19.45 19.25 3dtm n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dtm n GLY 87 N 1.13 0.85 1.05 0.00 0.00 0.73 -4.90 105.19 104.05 3dtm n GLY 87 Ca 0.17 -0.71 0.10 0.00 0.00 0.00 0.00 46.02 45.57 3dtm n GLY 87 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3dtm n GLN 88 N -2.69 2.55 -3.48 1.61 6.02 0.40 -4.95 117.38 116.84 3dtm n GLN 88 Ca -0.07 -2.29 -0.14 0.00 -0.01 0.00 0.00 57.00 54.48 3dtm n GLN 88 Cb 0.27 -1.45 -0.04 0.00 1.02 0.00 0.00 30.24 30.04 3dtm n GLN 88 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 3dtm s GLU 89 N -1.13 1.17 -0.05 -1.09 2.56 -1.09 -4.87 118.70 114.21 3dtm s GLU 89 Ca 0.37 -0.18 0.02 0.00 0.00 0.00 0.00 54.97 55.18 3dtm s GLU 89 Cb 0.20 0.54 0.01 0.00 2.00 0.00 0.00 34.13 36.88 3dtm s GLU 89 CO 0.27 -0.45 -0.11 1.14 -0.56 0.00 0.00 175.26 175.55 3dtm s GLN 90 N -2.68 1.33 0.33 4.30 -2.07 -1.26 -4.17 119.66 115.44 3dtm s GLN 90 Ca -0.04 -0.36 0.12 0.00 -1.82 0.00 0.00 55.36 53.26 3dtm s GLN 90 Cb -0.01 -1.17 1.01 0.00 -1.09 0.00 0.00 33.01 31.75 3dtm s GLN 90 CO -0.03 0.07 1.66 -0.07 -1.32 0.00 0.00 175.29 175.60 3dtm h LEU 91 N 6.69 0.41 -0.51 2.60 3.38 -1.96 -1.00 115.31 124.91 3dtm h LEU 91 Ca -0.33 0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.83 3dtm h LEU 91 Cb 1.17 0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.09 3dtm h LEU 91 CO 0.48 -0.14 -0.06 0.61 0.09 0.00 0.00 178.44 179.43 3dtm n GLY 92 N -1.31 -0.53 3.70 0.83 0.00 -1.26 -1.05 105.19 105.57 3dtm n GLY 92 Ca 0.30 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 3dtm n GLY 92 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3dtm s ARG 93 N -2.18 4.21 0.12 1.61 3.52 -0.38 -4.74 118.95 121.11 3dtm s ARG 93 Ca 0.36 2.34 -0.23 0.00 -0.13 0.00 0.00 55.73 58.08 3dtm s ARG 93 Cb 0.21 -3.43 -0.07 0.00 -1.56 0.00 0.00 34.95 30.09 3dtm s ARG 93 CO 0.40 -0.68 0.69 0.50 -0.81 0.00 0.00 175.30 175.39 3dtm s ARG 94 N 2.07 4.41 -0.07 5.12 3.52 -1.26 -1.22 118.95 131.52 3dtm s ARG 94 Ca 0.72 0.97 0.03 0.00 -0.13 0.00 0.00 55.73 57.32 3dtm s ARG 94 Cb -0.41 -3.26 0.01 0.00 -1.56 0.00 0.00 34.95 29.73 3dtm s ARG 94 CO 0.32 0.58 -0.16 0.42 -0.81 0.00 0.00 175.30 175.65 3dtm s ILE 95 N -1.06 1.40 0.05 4.11 1.01 0.92 -4.96 121.20 122.66 3dtm s ILE 95 Ca 0.33 -0.64 0.03 0.00 0.00 0.00 0.00 60.65 60.37 3dtm s ILE 95 Cb -0.21 -1.24 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 3dtm s ILE 95 CO 0.23 0.41 0.01 -1.00 0.00 0.00 0.00 174.94 174.59 3dtm s HIS 96 N 0.48 3.04 0.35 3.97 3.76 -1.26 -1.40 115.29 124.24 3dtm s HIS 96 Ca -0.14 0.02 -0.08 0.00 -0.15 0.00 0.00 55.06 54.71 3dtm s HIS 96 Cb -0.16 -1.60 0.02 0.00 1.11 0.00 0.00 32.58 31.96 3dtm s HIS 96 CO 0.05 0.47 0.59 1.52 -0.85 0.00 0.00 174.74 176.52 3dtm s TYR 97 N -1.23 0.66 0.43 1.40 1.13 -1.26 -5.07 117.35 113.41 3dtm s TYR 97 Ca 0.24 -1.06 0.04 0.00 -1.41 0.00 0.00 57.07 54.88 3dtm s TYR 97 Cb -0.12 0.28 -0.05 0.00 -1.10 0.00 0.00 41.96 40.97 3dtm s TYR 97 CO 0.15 -1.29 0.03 -1.54 -2.51 0.00 0.00 175.55 170.40 3dtm s SER 98 N -3.16 3.54 0.29 -0.18 1.04 -1.26 -4.84 113.70 109.13 3dtm s SER 98 Ca 0.24 -1.50 0.04 0.00 0.48 0.00 0.00 55.95 55.21 3dtm s SER 98 Cb -0.02 0.07 0.67 0.00 0.10 0.00 0.00 66.02 66.84 3dtm s SER 98 CO 0.16 -0.67 1.77 -0.61 0.98 0.00 0.00 173.24 174.87 3dtm h GLN 99 N 1.70 0.67 0.00 4.02 4.15 -1.98 -1.46 115.11 122.21 3dtm h GLN 99 Ca -0.42 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 58.96 3dtm h GLN 99 Cb 1.27 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.81 3dtm h GLN 99 CO 0.74 0.45 0.00 -0.91 -1.93 0.00 0.00 178.83 177.17 3dtm h ASN 100 N 0.69 0.00 1.67 -0.69 2.35 -2.05 0.02 115.58 117.58 3dtm h ASN 100 Ca 0.54 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.29 3dtm h ASN 100 Cb 0.84 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.21 3dtm h ASN 100 CO -0.39 0.00 -0.05 0.44 -1.65 0.00 0.00 177.43 175.78 3dtm h ASP 101 N 0.00 0.00 -3.05 5.81 3.32 -1.67 -3.46 116.42 117.37 3dtm h ASP 101 Ca 0.00 -0.01 -0.53 0.00 0.02 0.00 0.00 57.03 56.51 3dtm h ASP 101 Cb 0.16 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.73 3dtm h ASP 101 CO 0.00 0.00 0.68 -0.76 -1.72 0.00 0.00 179.24 177.45 3dtm s LEU 102 N -5.27 4.36 0.51 1.55 1.43 -0.01 -4.87 118.68 116.38 3dtm s LEU 102 Ca 0.09 2.19 0.04 0.00 -1.03 0.00 0.00 54.13 55.41 3dtm s LEU 102 Cb 0.09 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.73 3dtm s LEU 102 CO 0.64 -0.60 0.21 0.68 0.23 0.00 0.00 176.35 177.50 3dtm s VAL 103 N 1.28 1.57 0.44 -1.59 -7.23 -1.26 -5.07 120.40 108.53 3dtm s VAL 103 Ca 0.62 -1.73 -0.25 0.00 -1.81 0.00 0.00 61.98 58.82 3dtm s VAL 103 Cb -0.33 -2.30 -0.09 0.00 0.56 0.00 0.00 36.38 34.21 3dtm s VAL 103 CO 0.29 0.00 1.24 -0.62 -0.31 0.00 0.00 175.10 175.70 3dtm n GLU 104 N -1.47 1.81 -3.15 4.82 1.02 -1.26 -3.70 120.64 118.71 3dtm n GLU 104 Ca -0.08 0.65 -0.05 0.00 -0.02 0.00 0.00 57.16 57.65 3dtm n GLU 104 Cb 0.65 -2.35 0.00 0.00 -0.02 0.00 0.00 31.44 29.72 3dtm n GLU 104 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 3dtm n TYR 105 N -0.36 -2.90 -3.21 -0.32 9.36 -1.26 -4.55 117.16 113.92 3dtm n TYR 105 Ca 0.07 1.12 -0.25 0.00 3.32 0.00 0.00 57.90 62.17 3dtm n TYR 105 Cb 0.40 -3.88 -0.06 0.00 -0.63 0.00 0.00 39.34 35.18 3dtm n TYR 105 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 3dtm n SER 106 N -1.72 2.77 -0.22 2.98 7.64 -1.24 -1.09 113.62 122.73 3dtm n SER 106 Ca -0.04 -3.29 0.07 0.00 1.01 0.00 0.00 58.87 56.63 3dtm n SER 106 Cb 0.53 -0.63 0.33 0.00 -1.01 0.00 0.00 64.21 63.44 3dtm n SER 106 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3dtm h PRO 107 N 3.64 0.78 0.00 1.43 0.13 -1.94 -2.09 132.00 133.95 3dtm h PRO 107 Ca 0.14 -0.05 -0.18 0.00 -0.87 0.00 0.00 66.00 65.04 3dtm h PRO 107 Cb 0.71 -0.18 -0.03 0.00 0.13 0.00 0.00 31.00 31.64 3dtm h PRO 107 CO 0.70 0.51 -1.05 0.28 -0.23 0.00 0.00 178.00 178.22 3dtm h VAL 108 N 0.80 0.90 0.00 1.56 2.07 -1.94 -3.40 116.25 116.24 3dtm h VAL 108 Ca 0.35 -2.06 -0.05 0.00 0.82 0.00 0.00 66.70 65.76 3dtm h VAL 108 Cb 0.34 2.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 3dtm h VAL 108 CO -0.13 0.30 -0.23 0.71 0.02 0.00 0.00 177.57 178.25 3dtm h THR 109 N -1.00 1.16 0.00 2.57 1.35 -1.96 -1.03 112.91 113.99 3dtm h THR 109 Ca -0.28 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 64.81 3dtm h THR 109 Cb 1.18 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 69.02 3dtm h THR 109 CO -0.17 0.22 0.00 -1.84 -0.25 0.00 0.00 175.52 173.48 3dtm n GLU 110 N -4.26 0.04 -0.25 4.72 0.28 -0.79 -2.57 120.64 117.81 3dtm n GLU 110 Ca -0.02 0.33 0.12 0.00 -0.16 0.00 0.00 57.16 57.42 3dtm n GLU 110 Cb 0.28 -1.58 0.25 0.00 1.43 0.00 0.00 31.44 31.82 3dtm n GLU 110 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3dtm n LYS 111 N -1.66 2.58 -2.71 3.44 4.01 -0.39 -4.48 118.16 118.96 3dtm n LYS 111 Ca 0.03 -2.41 -0.01 0.00 -0.51 0.00 0.00 58.31 55.41 3dtm n LYS 111 Cb 0.15 -1.53 0.05 0.00 -0.51 0.00 0.00 35.03 33.19 3dtm n LYS 111 CO 0.00 0.00 0.00 0.72 -1.11 0.00 0.00 177.40 177.01 3dtm n HIS 112 N 1.53 1.24 0.11 2.13 8.25 -1.06 -4.92 115.22 122.51 3dtm n HIS 112 Ca 0.21 -2.04 0.02 0.00 -0.26 0.00 0.00 57.72 55.66 3dtm n HIS 112 Cb 0.61 -0.23 0.39 0.00 1.12 0.00 0.00 29.99 31.87 3dtm n HIS 112 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3dtm h LEU 113 N 2.48 0.24 0.14 2.41 3.38 -1.79 -2.12 115.31 120.05 3dtm h LEU 113 Ca -0.12 -0.05 -0.32 0.00 0.09 0.00 0.00 57.88 57.48 3dtm h LEU 113 Cb 1.32 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.01 3dtm h LEU 113 CO 0.20 0.39 -1.66 0.71 0.09 0.00 0.00 178.44 178.17 3dtm h THR 114 N 0.24 0.90 0.00 0.22 1.35 -1.91 -3.39 112.91 110.31 3dtm h THR 114 Ca 0.05 -2.42 0.00 0.00 -0.55 0.00 0.00 66.41 63.49 3dtm h THR 114 Cb 0.37 2.67 0.00 0.00 -1.73 0.00 0.00 68.15 69.46 3dtm h THR 114 CO 0.02 0.79 -0.81 -0.90 -0.25 0.00 0.00 175.52 174.37 3dtm n ASP 115 N -3.73 0.63 -0.76 5.36 5.75 -1.24 -5.06 116.55 117.50 3dtm n ASP 115 Ca -0.27 -0.22 0.07 0.00 -0.01 0.00 0.00 54.79 54.37 3dtm n ASP 115 Cb 0.99 0.54 -0.02 0.00 -1.03 0.00 0.00 41.12 41.60 3dtm n ASP 115 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dtm n GLY 116 N 1.41 -1.78 3.03 6.12 0.00 -0.80 -4.92 105.19 108.25 3dtm n GLY 116 Ca 0.03 -1.25 -0.08 0.00 0.00 0.00 0.00 46.02 44.72 3dtm n GLY 116 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dtm s MET 117 N -1.03 0.44 0.61 1.61 -1.94 -0.49 -4.90 119.30 113.60 3dtm s MET 117 Ca 0.00 -0.85 -0.07 0.00 -1.71 0.00 0.00 55.69 53.06 3dtm s MET 117 Cb 0.00 0.13 0.01 0.00 2.01 0.00 0.00 34.83 36.97 3dtm s MET 117 CO 0.00 -0.07 0.93 0.95 -0.01 0.00 0.00 175.02 176.83 3dtm s THR 118 N -2.40 3.70 0.26 2.05 -4.23 -1.26 -0.06 115.64 113.71 3dtm s THR 118 Ca -0.07 0.12 -0.03 0.00 -1.18 0.00 0.00 61.69 60.53 3dtm s THR 118 Cb -0.03 -3.49 0.27 0.00 1.34 0.00 0.00 72.50 70.59 3dtm s THR 118 CO -0.04 -0.53 1.89 0.58 -0.54 0.00 0.00 174.62 175.98 3dtm h VAL 119 N -0.25 1.11 0.07 2.29 2.07 -0.90 0.10 116.25 120.74 3dtm h VAL 119 Ca -0.45 -0.41 0.01 0.00 0.82 0.00 0.00 66.70 66.66 3dtm h VAL 119 Cb 1.25 -0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 3dtm h VAL 119 CO 0.61 0.22 -0.09 -0.09 0.02 0.00 0.00 177.57 178.24 3dtm h ARG 120 N 1.20 -0.19 -0.69 1.57 2.43 -1.39 -0.19 114.38 117.12 3dtm h ARG 120 Ca 0.43 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.61 3dtm h ARG 120 Cb 0.13 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 3dtm h ARG 120 CO -0.16 -0.13 0.43 0.93 -1.51 0.00 0.00 179.97 179.54 3dtm h GLU 121 N -0.20 0.92 -0.44 0.20 5.08 -1.66 -0.36 114.58 118.13 3dtm h GLU 121 Ca 0.01 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 58.17 3dtm h GLU 121 Cb 0.20 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3dtm h GLU 121 CO -0.04 0.63 -0.26 -0.07 -1.00 0.00 0.00 179.01 178.27 3dtm h LEU 122 N 0.94 0.96 -0.42 1.33 3.38 -0.55 0.08 115.31 121.04 3dtm h LEU 122 Ca 0.25 -0.38 -0.17 0.00 0.09 0.00 0.00 57.88 57.67 3dtm h LEU 122 Cb -0.07 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.41 3dtm h LEU 122 CO -0.05 1.16 -0.53 0.00 0.09 0.00 0.00 178.44 179.11 3dtm h SER 124 N 0.57 0.28 -0.54 0.00 0.87 -1.03 0.23 113.55 113.92 3dtm h SER 124 Ca 0.02 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.60 3dtm h SER 124 Cb 1.10 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.97 3dtm h SER 124 CO 0.11 0.20 0.33 0.00 -0.53 0.00 0.00 176.83 176.94 3dtm h ALA 125 N 1.12 0.69 -0.18 6.23 0.00 -0.83 0.14 119.26 126.44 3dtm h ALA 125 Ca 0.11 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3dtm h ALA 125 Cb -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3dtm h ALA 125 CO -0.05 0.05 -0.03 0.00 0.00 0.00 0.00 179.25 179.22 3dtm h ALA 126 N 1.23 0.24 0.02 0.00 0.00 -0.88 -0.75 119.26 119.11 3dtm h ALA 126 Ca 0.21 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3dtm h ALA 126 Cb -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3dtm h ALA 126 CO -0.08 -0.00 -0.01 0.82 0.00 0.00 0.00 179.25 179.97 3dtm h ILE 127 N 0.05 1.31 0.00 0.00 2.04 -0.51 -2.55 117.51 117.84 3dtm h ILE 127 Ca 0.05 -1.83 -0.11 0.00 1.00 0.00 0.00 64.86 63.97 3dtm h ILE 127 Cb 0.46 2.40 -0.02 0.00 -0.74 0.00 0.00 36.82 38.93 3dtm h ILE 127 CO 0.02 0.42 -0.70 0.71 0.00 0.00 0.00 178.15 178.60 3dtm h THR 128 N -0.94 0.69 0.00 -0.27 1.35 -0.85 -3.34 112.91 109.55 3dtm h THR 128 Ca -0.00 -2.03 0.00 0.00 -0.55 0.00 0.00 66.41 63.82 3dtm h THR 128 Cb 0.71 2.27 0.00 0.00 -1.73 0.00 0.00 68.15 69.40 3dtm h THR 128 CO 0.01 0.39 0.00 0.23 -0.25 0.00 0.00 175.52 175.90 3dtm n MET 129 N -3.12 1.49 -2.11 4.72 2.81 -0.86 -0.84 117.12 119.21 3dtm n MET 129 Ca -0.01 -0.34 -0.21 0.00 -1.81 0.00 0.00 57.70 55.34 3dtm n MET 129 Cb 0.74 -0.84 -0.04 0.00 -0.71 0.00 0.00 33.22 32.37 3dtm n MET 129 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3dtm n SER 130 N -0.31 -5.69 -4.66 7.83 2.88 -0.67 -4.88 113.62 108.12 3dtm n SER 130 Ca 0.00 0.18 -0.44 0.00 -1.33 0.00 0.00 58.87 57.27 3dtm n SER 130 Cb 0.00 -4.84 -0.04 0.00 -0.75 0.00 0.00 64.21 58.59 3dtm n SER 130 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 3dtm n ASP 131 N -1.77 3.85 -0.05 -3.46 -0.08 -0.38 -4.90 116.55 109.76 3dtm n ASP 131 Ca -0.23 0.88 -0.14 0.00 -1.51 0.00 0.00 54.79 53.79 3dtm n ASP 131 Cb 0.68 -1.47 -0.08 0.00 2.34 0.00 0.00 41.12 42.59 3dtm n ASP 131 CO 0.00 0.00 0.00 0.78 0.12 0.00 0.00 177.20 178.10 3dtm h ASN 132 N 10.41 0.37 -0.45 1.67 2.35 -1.35 -2.80 115.58 125.79 3dtm h ASN 132 Ca -0.49 -0.53 -0.04 0.00 -0.55 0.00 0.00 56.30 54.69 3dtm h ASN 132 Cb 1.25 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 39.49 3dtm h ASN 132 CO 0.95 0.83 0.14 0.74 -1.65 0.00 0.00 177.43 178.44 3dtm h THR 133 N -0.08 1.21 -0.61 2.81 2.02 -1.85 -1.89 112.91 114.52 3dtm h THR 133 Ca 0.01 -0.74 0.03 0.00 0.77 0.00 0.00 66.41 66.47 3dtm h THR 133 Cb 0.75 0.67 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 3dtm h THR 133 CO 0.04 0.28 0.38 0.00 0.37 0.00 0.00 175.52 176.59 3dtm h ALA 134 N 1.41 0.79 -0.73 6.16 0.00 -1.91 0.62 119.26 125.61 3dtm h ALA 134 Ca 0.17 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3dtm h ALA 134 Cb 0.25 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3dtm h ALA 134 CO -0.01 0.13 0.48 0.00 0.00 0.00 0.00 179.25 179.85 3dtm h ALA 135 N 1.26 0.93 -0.55 0.00 0.00 -1.12 -1.30 119.26 118.48 3dtm h ALA 135 Ca 0.24 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 3dtm h ALA 135 Cb 0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3dtm h ALA 135 CO -0.10 0.32 0.10 -0.91 0.00 0.00 0.00 179.25 178.66 3dtm h ASN 136 N 0.96 0.86 -0.25 0.00 2.35 -0.79 -0.78 115.58 117.94 3dtm h ASN 136 Ca 0.27 -0.26 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 3dtm h ASN 136 Cb -0.08 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.05 3dtm h ASN 136 CO -0.07 0.90 0.11 -0.07 -1.65 0.00 0.00 177.43 176.65 3dtm h LEU 137 N 0.79 0.33 -0.62 1.61 3.38 -0.77 -0.85 115.31 119.18 3dtm h LEU 137 Ca 0.17 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 58.03 3dtm h LEU 137 Cb 0.40 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 3dtm h LEU 137 CO 0.01 0.38 0.37 -0.07 0.09 0.00 0.00 178.44 179.22 3dtm h LEU 138 N 0.26 0.59 -0.35 1.67 3.38 -1.19 -2.98 115.31 116.69 3dtm h LEU 138 Ca 0.08 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3dtm h LEU 138 Cb 0.14 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3dtm h LEU 138 CO -0.01 0.40 0.22 -0.07 0.09 0.00 0.00 178.44 179.07 3dtm h LEU 139 N 0.72 0.41 -1.78 1.67 3.38 -0.89 -1.85 115.31 116.96 3dtm h LEU 139 Ca 0.26 -0.03 0.27 0.00 0.09 0.00 0.00 57.88 58.47 3dtm h LEU 139 Cb 0.07 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.66 3dtm h LEU 139 CO -0.12 0.32 0.69 0.74 0.09 0.00 0.00 178.44 180.15 3dtm h THR 140 N 0.46 0.53 0.00 0.22 2.02 -1.01 -1.01 112.91 114.13 3dtm h THR 140 Ca 0.13 -0.05 -0.07 0.00 0.77 0.00 0.00 66.41 67.18 3dtm h THR 140 Cb -0.03 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 66.74 3dtm h THR 140 CO -0.03 0.03 -0.35 0.71 0.37 0.00 0.00 175.52 176.25 3dtm h THR 141 N 0.15 1.17 -0.34 3.16 1.35 -1.24 -3.14 112.91 114.02 3dtm h THR 141 Ca 0.50 -1.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 3dtm h THR 141 Cb 1.70 1.69 0.00 0.00 -1.73 0.00 0.00 68.15 69.81 3dtm h THR 141 CO -0.10 0.35 0.00 2.30 -0.25 0.00 0.00 175.52 177.82 3dtm n ILE 142 N -4.00 0.82 -0.33 6.82 -5.35 -0.53 -4.95 119.36 111.84 3dtm n ILE 142 Ca -0.02 -0.91 0.00 0.00 -0.27 0.00 0.00 62.75 61.55 3dtm n ILE 142 Cb 0.40 0.64 0.00 0.00 -1.74 0.00 0.00 39.64 38.94 3dtm n ILE 142 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dtm n GLY 143 N 0.71 1.56 2.14 3.28 0.00 -0.95 -4.22 105.19 107.71 3dtm n GLY 143 Ca 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3dtm n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dtm n GLY 144 N -0.77 -2.39 0.35 -0.02 0.00 -0.50 -2.47 105.19 99.39 3dtm n GLY 144 Ca 0.00 -1.59 0.18 0.00 0.00 0.00 0.00 46.02 44.62 3dtm n GLY 144 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3dtm h PRO 145 N 0.00 0.54 -0.10 1.61 0.11 -1.85 -0.96 132.00 131.34 3dtm h PRO 145 Ca 0.00 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.95 3dtm h PRO 145 Cb 0.00 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 30.98 3dtm h PRO 145 CO 0.00 0.36 -0.49 1.57 -0.21 0.00 0.00 178.00 179.23 3dtm h LYS 146 N 0.55 0.26 -0.44 1.05 5.09 -1.72 -0.58 116.57 120.78 3dtm h LYS 146 Ca 0.65 -0.15 -0.06 0.00 0.09 0.00 0.00 60.65 61.17 3dtm h LYS 146 Cb 1.27 0.01 -0.02 0.00 0.10 0.00 0.00 32.23 33.60 3dtm h LYS 146 CO -0.46 0.70 0.02 0.78 -2.09 0.00 0.00 179.45 178.39 3dtm h GLY 147 N 1.31 0.82 1.05 0.07 0.00 -0.88 0.35 103.07 105.79 3dtm h GLY 147 Ca 0.01 -0.59 -0.01 0.00 0.00 0.00 0.00 47.33 46.74 3dtm h GLY 147 CO 0.08 0.54 0.51 -2.00 0.00 0.00 0.00 176.54 175.67 3dtm h LEU 148 N 0.61 1.11 -0.15 3.11 5.85 -1.16 0.25 115.31 124.92 3dtm h LEU 148 Ca 0.13 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 3dtm h LEU 148 Cb 0.46 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 3dtm h LEU 148 CO 0.02 0.87 0.07 0.74 -0.34 0.00 0.00 178.44 179.80 3dtm h THR 149 N 1.25 1.12 -0.26 1.05 2.02 -0.75 -0.84 112.91 116.50 3dtm h THR 149 Ca 0.32 -0.34 0.05 0.00 0.77 0.00 0.00 66.41 67.21 3dtm h THR 149 Cb -0.00 1.08 -0.05 0.00 -1.74 0.00 0.00 68.15 67.43 3dtm h THR 149 CO -0.05 0.11 -0.08 0.00 0.37 0.00 0.00 175.52 175.86 3dtm h ALA 150 N 0.95 0.15 -0.62 6.16 0.00 -0.20 -0.86 119.26 124.83 3dtm h ALA 150 Ca 0.05 0.10 0.13 0.00 0.00 0.00 0.00 54.91 55.19 3dtm h ALA 150 Cb 0.11 0.23 -0.10 0.00 0.00 0.00 0.00 17.79 18.04 3dtm h ALA 150 CO -0.01 -0.49 0.08 0.35 0.00 0.00 0.00 179.25 179.18 3dtm h PHE 151 N -0.03 0.10 -0.63 0.00 3.57 -0.66 -2.03 116.94 117.25 3dtm h PHE 151 Ca 0.13 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.61 3dtm h PHE 151 Cb 0.23 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 3dtm h PHE 151 CO -0.27 -0.10 0.15 -0.07 -2.23 0.00 0.00 178.31 175.79 3dtm h LEU 152 N 0.19 0.93 0.14 0.59 3.38 -0.63 -2.17 115.31 117.74 3dtm h LEU 152 Ca 0.33 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 58.13 3dtm h LEU 152 Cb 0.52 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3dtm h LEU 152 CO -0.47 0.90 -0.20 -0.74 0.09 0.00 0.00 178.44 178.02 3dtm h HIS 153 N 0.95 -0.54 -0.28 1.13 2.76 -0.65 -0.33 115.15 118.18 3dtm h HIS 153 Ca 0.20 0.01 0.08 0.00 -2.20 0.00 0.00 60.37 58.46 3dtm h HIS 153 Cb 0.34 0.22 -0.01 0.00 1.55 0.00 0.00 27.41 29.50 3dtm h HIS 153 CO 0.02 -0.30 0.25 -0.91 -1.30 0.00 0.00 177.93 175.70 3dtm h ASN 154 N -0.40 0.00 -0.44 3.26 2.35 -0.86 0.59 115.58 120.07 3dtm h ASN 154 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3dtm h ASN 154 Cb 0.41 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 3dtm h ASN 154 CO -0.09 0.00 0.00 1.15 -1.65 0.00 0.00 177.43 176.84 3dtm n MET 155 N -4.06 2.20 -0.11 0.81 0.00 -0.86 -4.93 117.12 110.17 3dtm n MET 155 Ca 0.04 -1.85 0.00 0.00 0.00 0.00 0.00 57.70 55.89 3dtm n MET 155 Cb 0.41 -1.43 0.00 0.00 0.00 0.00 0.00 33.22 32.19 3dtm n MET 155 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3dtm n GLY 156 N 1.35 0.84 3.29 3.17 0.00 0.20 -5.05 105.19 108.99 3dtm n GLY 156 Ca 0.18 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 3dtm n GLY 156 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dtm s ASP 157 N -2.28 5.98 -0.21 1.61 -1.08 -0.16 -4.91 116.67 115.63 3dtm s ASP 157 Ca 0.00 -1.69 0.15 0.00 -0.52 0.00 0.00 52.55 50.49 3dtm s ASP 157 Cb 0.00 -2.12 0.73 0.00 -1.46 0.00 0.00 42.92 40.07 3dtm s ASP 157 CO 0.00 -0.73 1.65 1.41 0.52 0.00 0.00 175.17 178.02 3dtm n HIS 158 N 5.11 1.70 -0.05 -5.34 8.25 -1.26 -2.58 115.22 121.04 3dtm n HIS 158 Ca -0.12 -0.75 -0.11 0.00 -0.26 0.00 0.00 57.72 56.48 3dtm n HIS 158 Cb 0.41 -0.43 -0.04 0.00 1.12 0.00 0.00 29.99 31.06 3dtm n HIS 158 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3dtm n VAL 159 N 0.37 0.68 -2.15 1.59 0.31 -1.26 -5.01 118.33 112.86 3dtm n VAL 159 Ca 0.26 -0.11 -0.41 0.00 -0.01 0.00 0.00 64.34 64.07 3dtm n VAL 159 Cb 1.08 -1.68 -0.03 0.00 -0.91 0.00 0.00 33.84 32.30 3dtm n VAL 159 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3dtm s THR 160 N -2.22 3.03 -0.03 2.52 2.01 -1.26 -4.78 115.64 114.90 3dtm s THR 160 Ca -0.15 0.85 -0.04 0.00 0.31 0.00 0.00 61.69 62.66 3dtm s THR 160 Cb 0.05 -3.54 0.01 0.00 0.01 0.00 0.00 72.50 69.03 3dtm s THR 160 CO 0.19 0.13 0.10 0.00 -0.69 0.00 0.00 174.62 174.35 3dtm s ARG 161 N -0.20 0.19 0.05 4.92 1.70 -0.83 -4.89 118.95 119.88 3dtm s ARG 161 Ca 0.57 0.02 0.08 0.00 -0.47 0.00 0.00 55.73 55.94 3dtm s ARG 161 Cb -0.38 0.08 -0.03 0.00 -0.57 0.00 0.00 34.95 34.05 3dtm s ARG 161 CO 0.40 -0.03 -0.21 -1.17 -1.08 0.00 0.00 175.30 173.20 3dtm s LEU 162 N -0.24 2.45 0.00 -1.89 2.96 -1.26 -2.61 118.68 118.08 3dtm s LEU 162 Ca -0.03 -0.51 0.00 0.00 -0.22 0.00 0.00 54.13 53.37 3dtm s LEU 162 Cb -0.02 -1.42 0.00 0.00 0.50 0.00 0.00 46.19 45.25 3dtm s LEU 162 CO 0.00 0.25 0.00 0.47 -1.32 0.00 0.00 176.35 175.75 3dtm n ASP 163 N 1.55 1.56 -4.64 3.68 9.92 -1.26 -4.15 116.55 123.20 3dtm n ASP 163 Ca -0.16 0.00 -0.27 0.00 -0.53 0.00 0.00 54.79 53.83 3dtm n ASP 163 Cb 0.52 0.12 -0.10 0.00 -0.64 0.00 0.00 41.12 41.02 3dtm n ASP 163 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 3dtm s ARG 164 N -1.33 2.02 0.48 -1.24 0.52 -1.26 -4.79 118.95 113.35 3dtm s ARG 164 Ca 0.00 -2.01 0.06 0.00 -0.52 0.00 0.00 55.73 53.26 3dtm s ARG 164 Cb 0.00 -1.74 0.03 0.00 0.52 0.00 0.00 34.95 33.76 3dtm s ARG 164 CO 0.00 -0.04 0.66 -1.58 0.02 0.00 0.00 175.30 174.36 3dtm s TRP 165 N -2.66 2.62 0.27 -0.53 0.52 -1.26 -4.62 118.94 113.27 3dtm s TRP 165 Ca 0.36 -0.34 -0.29 0.00 0.02 0.00 0.00 56.10 55.85 3dtm s TRP 165 Cb 0.07 -2.47 -0.10 0.00 -1.15 0.00 0.00 33.47 29.82 3dtm s TRP 165 CO 0.19 -0.66 1.29 -1.21 0.02 0.00 0.00 176.95 176.58 3dtm s GLU 166 N -4.52 4.40 0.00 4.98 0.41 -1.26 -1.09 118.70 121.62 3dtm s GLU 166 Ca 0.57 2.11 0.26 0.00 -0.41 0.00 0.00 54.97 57.50 3dtm s GLU 166 Cb -0.09 -3.13 0.75 0.00 -1.78 0.00 0.00 34.13 29.87 3dtm s GLU 166 CO 0.35 -0.17 1.56 -0.35 -0.49 0.00 0.00 175.26 176.16 3dtm n PRO 167 N 1.59 0.82 0.24 0.39 -0.05 -1.26 -4.92 135.00 131.80 3dtm n PRO 167 Ca 0.02 -0.48 0.07 0.00 -0.05 0.00 0.00 63.50 63.06 3dtm n PRO 167 Cb 0.42 -1.49 0.56 0.00 -0.05 0.00 0.00 33.50 32.95 3dtm n PRO 167 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 175.50 176.94 3dtm h GLU 168 N 1.18 0.00 0.00 0.54 4.81 -1.49 -2.51 114.58 117.10 3dtm h GLU 168 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3dtm h GLU 168 Cb 0.51 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.89 3dtm h GLU 168 CO 0.00 0.13 0.00 1.47 -0.73 0.00 0.00 179.01 179.88 3dtm n LEU 169 N -4.30 0.00 -0.88 1.64 -0.00 -0.59 -2.23 117.00 110.64 3dtm n LEU 169 Ca -0.03 0.40 0.10 0.00 -0.00 0.00 0.00 56.01 56.48 3dtm n LEU 169 Cb 0.21 -0.40 0.27 0.00 -0.00 0.00 0.00 43.42 43.50 3dtm n LEU 169 CO 0.35 -0.35 0.72 0.59 -0.00 0.00 0.00 177.39 178.70 3dtm n ASN 170 N -1.40 2.59 0.03 1.45 3.02 -0.95 -4.59 115.26 115.42 3dtm n ASN 170 Ca 0.01 -1.91 0.01 0.00 -0.03 0.00 0.00 54.58 52.66 3dtm n ASN 170 Cb 0.03 -0.25 0.33 0.00 -0.61 0.00 0.00 39.78 39.28 3dtm n ASN 170 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3dtm h GLU 171 N 3.13 0.46 -5.31 3.52 5.08 -1.68 0.16 114.58 119.93 3dtm h GLU 171 Ca 0.00 -0.09 -0.41 0.00 -1.00 0.00 0.00 59.36 57.85 3dtm h GLU 171 Cb 0.70 -0.07 0.02 0.00 0.50 0.00 0.00 28.75 29.90 3dtm h GLU 171 CO 0.00 0.50 -0.64 0.00 -1.00 0.00 0.00 179.01 177.87 3dtm n ALA 172 N -2.48 -1.11 -1.68 3.43 0.00 -1.26 -4.51 120.51 112.89 3dtm n ALA 172 Ca 0.01 0.24 -0.45 0.00 0.00 0.00 0.00 53.44 53.25 3dtm n ALA 172 Cb 0.23 -4.05 -0.04 0.00 0.00 0.00 0.00 19.45 15.60 3dtm n ALA 172 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3dtm n ILE 173 N -4.50 0.46 -1.61 0.00 5.41 -1.26 -4.89 119.36 112.96 3dtm n ILE 173 Ca -0.04 -0.08 -0.47 0.00 1.00 0.00 0.00 62.75 63.16 3dtm n ILE 173 Cb 0.57 -1.98 -0.04 0.00 -0.71 0.00 0.00 39.64 37.49 3dtm n ILE 173 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3dtm n PRO 174 N 5.98 1.46 -0.91 0.38 -0.02 -1.26 -1.27 135.00 139.35 3dtm n PRO 174 Ca 0.20 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 3dtm n PRO 174 Cb 0.34 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 3dtm n PRO 174 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3dtm n ASN 175 N 2.05 -0.30 -4.60 2.55 3.02 -1.26 -4.98 115.26 111.74 3dtm n ASN 175 Ca 0.14 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.27 3dtm n ASN 175 Cb 0.27 -0.54 -0.05 0.00 -0.61 0.00 0.00 39.78 38.86 3dtm n ASN 175 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3dtm s ASP 176 N -2.74 6.62 0.20 6.41 -1.08 -0.40 -4.92 116.67 120.77 3dtm s ASP 176 Ca 0.00 0.54 0.26 0.00 -0.52 0.00 0.00 52.55 52.83 3dtm s ASP 176 Cb 0.00 -2.41 0.84 0.00 -1.46 0.00 0.00 42.92 39.89 3dtm s ASP 176 CO 0.00 -0.68 1.78 -0.62 0.52 0.00 0.00 175.17 176.17 3dtm n GLU 177 N 6.34 0.25 -1.77 4.34 1.02 -1.26 -4.85 120.64 124.71 3dtm n GLU 177 Ca 0.04 0.22 -0.39 0.00 -0.02 0.00 0.00 57.16 57.01 3dtm n GLU 177 Cb 0.48 -1.80 0.03 0.00 -0.02 0.00 0.00 31.44 30.13 3dtm n GLU 177 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3dtm s ARG 178 N -3.11 3.42 -1.49 3.49 0.52 -1.26 -2.89 118.95 117.62 3dtm s ARG 178 Ca 0.10 2.36 -0.06 0.00 -0.52 0.00 0.00 55.73 57.61 3dtm s ARG 178 Cb 0.12 -2.47 0.02 0.00 0.52 0.00 0.00 34.95 33.15 3dtm s ARG 178 CO 0.58 -1.01 0.65 -0.25 0.02 0.00 0.00 175.30 175.28 3dtm n ASP 179 N -0.59 -5.60 -4.52 0.23 8.00 -1.19 -4.94 116.55 107.93 3dtm n ASP 179 Ca 0.08 -0.35 -0.25 0.00 0.71 0.00 0.00 54.79 54.98 3dtm n ASP 179 Cb 0.43 -4.53 -0.11 0.00 -0.02 0.00 0.00 41.12 36.89 3dtm n ASP 179 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3dtm s THR 180 N -3.14 1.94 0.34 -3.53 -4.23 -1.07 -2.24 115.64 103.70 3dtm s THR 180 Ca 0.36 -2.12 0.02 0.00 -1.18 0.00 0.00 61.69 58.77 3dtm s THR 180 Cb -0.17 -2.68 -0.01 0.00 1.34 0.00 0.00 72.50 70.98 3dtm s THR 180 CO 0.45 -0.17 0.39 0.28 -0.54 0.00 0.00 174.62 175.03 3dtm s THR 181 N -2.80 0.00 0.23 3.99 -1.32 -0.75 -1.97 115.64 113.02 3dtm s THR 181 Ca 0.33 -1.78 0.08 0.00 -1.21 0.00 0.00 61.69 59.11 3dtm s THR 181 Cb 0.05 -2.59 -0.04 0.00 -1.51 0.00 0.00 72.50 68.41 3dtm s THR 181 CO 0.15 0.00 0.07 0.42 -2.21 0.00 0.00 174.62 173.05 3dtm s THR 182 N -3.20 3.90 0.29 5.08 -4.23 -1.26 -0.80 115.64 115.41 3dtm s THR 182 Ca 0.35 -1.57 0.02 0.00 -1.18 0.00 0.00 61.69 59.32 3dtm s THR 182 Cb 0.01 -3.05 0.28 0.00 1.34 0.00 0.00 72.50 71.08 3dtm s THR 182 CO 0.24 -0.28 1.80 -0.65 -0.54 0.00 0.00 174.62 175.19 3dtm h PRO 183 N 2.02 0.84 -0.27 3.99 0.11 -1.73 -1.81 132.00 135.16 3dtm h PRO 183 Ca -0.46 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 3dtm h PRO 183 Cb 1.23 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 3dtm h PRO 183 CO 0.60 0.55 -0.02 -0.24 -0.21 0.00 0.00 178.00 178.69 3dtm h VAL 184 N 0.86 1.26 -0.27 3.15 3.04 -1.60 -1.48 116.25 121.21 3dtm h VAL 184 Ca 0.52 -0.96 -0.00 0.00 -1.01 0.00 0.00 66.70 65.25 3dtm h VAL 184 Cb 0.65 1.36 -0.01 0.00 -2.01 0.00 0.00 31.29 31.27 3dtm h VAL 184 CO -0.32 0.30 0.16 0.00 -1.01 0.00 0.00 177.57 176.71 3dtm h ALA 185 N 0.81 0.34 -0.34 3.17 0.00 -1.77 -0.44 119.26 121.04 3dtm h ALA 185 Ca 0.07 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3dtm h ALA 185 Cb 0.45 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3dtm h ALA 185 CO 0.02 -0.15 0.12 1.98 0.00 0.00 0.00 179.25 181.22 3dtm h MET 186 N 0.34 0.51 -0.73 0.00 -1.53 -1.35 -0.04 114.93 112.13 3dtm h MET 186 Ca 0.10 -0.10 -0.03 0.00 -3.44 0.00 0.00 59.70 56.23 3dtm h MET 186 Cb 0.02 -0.08 -0.03 0.00 -0.55 0.00 0.00 31.60 30.95 3dtm h MET 186 CO -0.02 0.52 0.35 0.00 0.14 0.00 0.00 176.91 177.90 3dtm h ALA 187 N 0.97 0.94 0.12 0.39 0.00 -1.10 0.23 119.26 120.80 3dtm h ALA 187 Ca 0.11 -0.15 -0.29 0.00 0.00 0.00 0.00 54.91 54.58 3dtm h ALA 187 Cb 0.21 -0.29 0.03 0.00 0.00 0.00 0.00 17.79 17.74 3dtm h ALA 187 CO -0.01 0.50 -1.24 1.79 0.00 0.00 0.00 179.25 180.30 3dtm h THR 188 N 1.02 1.31 -0.21 0.00 1.35 -0.96 0.17 112.91 115.60 3dtm h THR 188 Ca 0.25 -2.54 -0.01 0.00 -0.55 0.00 0.00 66.41 63.57 3dtm h THR 188 Cb 0.12 2.72 -0.01 0.00 -1.73 0.00 0.00 68.15 69.25 3dtm h THR 188 CO -0.03 0.77 0.11 0.74 -0.25 0.00 0.00 175.52 176.86 3dtm h THR 189 N 0.25 1.12 -0.67 6.82 2.02 -0.96 -0.42 112.91 121.07 3dtm h THR 189 Ca -0.18 -0.32 0.01 0.00 0.77 0.00 0.00 66.41 66.70 3dtm h THR 189 Cb 1.91 0.95 -0.04 0.00 -1.74 0.00 0.00 68.15 69.24 3dtm h THR 189 CO 0.23 0.11 0.43 0.25 0.37 0.00 0.00 175.52 176.92 3dtm h LEU 190 N 0.23 0.73 -1.22 2.58 5.85 -0.54 -1.67 115.31 121.27 3dtm h LEU 190 Ca 0.07 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.72 3dtm h LEU 190 Cb 0.08 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 3dtm h LEU 190 CO -0.01 0.52 -0.09 -0.09 -0.34 0.00 0.00 178.44 178.43 3dtm h ARG 191 N 0.87 0.43 0.00 1.25 2.43 -0.83 -1.61 114.38 116.92 3dtm h ARG 191 Ca 0.25 -0.11 -0.07 0.00 -0.81 0.00 0.00 59.98 59.24 3dtm h ARG 191 Cb -0.06 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 3dtm h ARG 191 CO -0.07 0.53 -0.35 0.87 -1.51 0.00 0.00 179.97 179.44 3dtm h LYS 192 N 0.40 0.00 0.01 0.20 1.57 -0.50 -2.14 116.57 116.11 3dtm h LYS 192 Ca 0.08 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.61 3dtm h LYS 192 Cb 0.42 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.69 3dtm h LYS 192 CO 0.02 0.35 -1.31 -0.07 -0.57 0.00 0.00 179.45 177.87 3dtm h LEU 193 N 0.00 0.02 0.00 2.94 3.38 -0.42 -2.23 115.31 118.99 3dtm h LEU 193 Ca -0.00 -0.03 -0.18 0.00 0.09 0.00 0.00 57.88 57.76 3dtm h LEU 193 Cb 0.76 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 3dtm h LEU 193 CO 0.05 1.02 -1.43 -0.07 0.09 0.00 0.00 178.44 178.09 3dtm h LEU 194 N 0.00 0.00 -0.16 1.67 3.38 -1.31 -3.42 115.31 115.47 3dtm h LEU 194 Ca -0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3dtm h LEU 194 Cb 1.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.63 3dtm h LEU 194 CO 0.11 0.63 0.00 0.35 0.09 0.00 0.00 178.44 179.62 3dtm n THR 195 N -2.91 0.00 -1.76 0.22 -2.24 -0.81 -4.89 114.28 101.89 3dtm n THR 195 Ca -0.10 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 3dtm n THR 195 Cb 0.86 1.54 0.00 0.00 -2.10 0.00 0.00 70.33 70.64 3dtm n THR 195 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dtm n GLY 196 N 0.07 0.12 0.02 3.38 0.00 -0.84 -4.97 105.19 102.97 3dtm n GLY 196 Ca 0.00 -1.85 0.15 0.00 0.00 0.00 0.00 46.02 44.32 3dtm n GLY 196 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dtm n GLU 197 N -0.95 1.02 0.43 1.61 1.02 -1.26 -4.39 120.64 118.12 3dtm n GLU 197 Ca 0.00 -0.03 -0.19 0.00 -0.02 0.00 0.00 57.16 56.92 3dtm n GLU 197 Cb 0.00 -1.48 -0.09 0.00 -0.02 0.00 0.00 31.44 29.85 3dtm n GLU 197 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3dtm h LEU 198 N 0.08 -0.92 -9.62 -4.62 7.12 -1.93 -3.45 115.31 101.98 3dtm h LEU 198 Ca 0.00 0.02 -0.56 0.00 0.13 0.00 0.00 57.88 57.48 3dtm h LEU 198 Cb 0.02 0.24 -0.09 0.00 -0.53 0.00 0.00 40.66 40.30 3dtm h LEU 198 CO 0.00 -0.63 -0.62 -0.76 -0.13 0.00 0.00 178.44 176.30 3dtm s LEU 199 N -9.95 3.37 0.80 2.25 1.43 -1.26 -4.97 118.68 110.35 3dtm s LEU 199 Ca -0.18 -0.49 -0.12 0.00 -1.03 0.00 0.00 54.13 52.30 3dtm s LEU 199 Cb 0.03 -1.92 0.08 0.00 0.03 0.00 0.00 46.19 44.40 3dtm s LEU 199 CO 0.59 0.01 1.16 0.42 0.23 0.00 0.00 176.35 178.77 3dtm s THR 200 N -2.13 2.40 0.22 5.49 -4.23 -1.26 -4.74 115.64 111.39 3dtm s THR 200 Ca 0.31 0.16 -0.08 0.00 -1.18 0.00 0.00 61.69 60.90 3dtm s THR 200 Cb -0.07 -2.51 0.16 0.00 1.34 0.00 0.00 72.50 71.42 3dtm s THR 200 CO 0.21 -0.14 1.77 -0.65 -0.54 0.00 0.00 174.62 175.26 3dtm h PRO 201 N -1.00 0.53 -0.46 3.99 0.11 -1.99 -0.94 132.00 132.24 3dtm h PRO 201 Ca -0.45 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 65.72 3dtm h PRO 201 Cb 1.27 -0.12 -0.09 0.00 0.11 0.00 0.00 31.00 32.17 3dtm h PRO 201 CO 0.47 0.35 -0.15 0.00 -0.21 0.00 0.00 178.00 178.45 3dtm h ALA 202 N 1.42 0.23 -0.79 -0.75 0.00 -2.00 -0.95 119.26 116.43 3dtm h ALA 202 Ca 0.34 0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.37 3dtm h ALA 202 Cb 0.37 0.42 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 3dtm h ALA 202 CO -0.28 -0.49 0.31 0.77 0.00 0.00 0.00 179.25 179.56 3dtm h SER 203 N -0.05 1.09 -0.08 0.00 0.02 -1.73 -1.61 113.55 111.19 3dtm h SER 203 Ca 0.22 -0.18 0.04 0.00 -0.84 0.00 0.00 61.79 61.03 3dtm h SER 203 Cb 0.39 -0.28 -0.05 0.00 0.14 0.00 0.00 62.40 62.60 3dtm h SER 203 CO -0.50 0.97 -0.19 0.03 -1.14 0.00 0.00 176.83 176.01 3dtm h ARG 204 N 1.15 -0.25 -0.88 3.45 3.08 -0.74 -1.72 114.38 118.47 3dtm h ARG 204 Ca 0.26 0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.32 3dtm h ARG 204 Cb 0.22 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.29 3dtm h ARG 204 CO -0.02 -0.17 0.50 0.37 -1.07 0.00 0.00 179.97 179.59 3dtm h GLN 205 N -0.26 1.21 0.17 0.04 5.75 -0.89 -1.22 115.11 119.90 3dtm h GLN 205 Ca 0.08 -0.12 -0.01 0.00 -0.15 0.00 0.00 58.65 58.45 3dtm h GLN 205 Cb 0.38 -0.25 0.00 0.00 1.07 0.00 0.00 27.48 28.68 3dtm h GLN 205 CO -0.24 0.87 -0.08 0.37 -2.65 0.00 0.00 178.83 177.10 3dtm h GLN 206 N 1.22 -0.21 -0.18 1.69 5.75 -1.01 0.24 115.11 122.60 3dtm h GLN 206 Ca 0.31 0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.87 3dtm h GLN 206 Cb -0.01 0.05 -0.05 0.00 1.07 0.00 0.00 27.48 28.54 3dtm h GLN 206 CO -0.05 -0.11 -0.11 1.25 -2.65 0.00 0.00 178.83 177.16 3dtm h LEU 207 N -0.27 -0.36 -0.47 -2.39 5.85 -0.99 0.14 115.31 116.82 3dtm h LEU 207 Ca -0.02 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.87 3dtm h LEU 207 Cb 0.21 0.19 -0.09 0.00 0.37 0.00 0.00 40.66 41.35 3dtm h LEU 207 CO 0.04 -0.15 -0.09 -0.03 -0.34 0.00 0.00 178.44 177.87 3dtm h MET 208 N -0.10 0.03 -0.81 1.25 4.05 -1.15 -0.91 114.93 117.29 3dtm h MET 208 Ca 0.11 -0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.49 3dtm h MET 208 Cb 0.26 -0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.02 3dtm h MET 208 CO -0.25 0.02 0.38 -0.44 0.23 0.00 0.00 176.91 176.85 3dtm h ASP 209 N 0.03 1.06 -0.10 1.39 3.32 0.64 0.23 116.42 122.98 3dtm h ASP 209 Ca 0.23 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3dtm h ASP 209 Cb 0.35 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3dtm h ASP 209 CO -0.46 0.90 0.06 -0.50 -1.72 0.00 0.00 179.24 177.52 3dtm h TRP 210 N 1.14 0.12 -0.79 4.55 6.55 -0.39 -0.98 115.95 126.15 3dtm h TRP 210 Ca 0.28 0.00 -0.05 0.00 0.95 0.00 0.00 58.89 60.07 3dtm h TRP 210 Cb 0.13 -0.04 -0.04 0.00 -0.86 0.00 0.00 29.16 28.35 3dtm h TRP 210 CO 0.01 0.08 0.32 0.52 -1.05 0.00 0.00 178.44 178.32 3dtm h MET 211 N 0.13 1.19 -1.00 0.49 2.86 -0.71 -2.29 114.93 115.60 3dtm h MET 211 Ca 0.04 -0.21 0.02 0.00 -2.06 0.00 0.00 59.70 57.48 3dtm h MET 211 Cb -0.01 -0.19 -0.05 0.00 0.06 0.00 0.00 31.60 31.40 3dtm h MET 211 CO -0.01 0.96 0.66 1.49 1.06 0.00 0.00 176.91 181.07 3dtm h GLU 212 N 1.16 1.29 -0.06 1.72 4.81 -0.36 -1.46 114.58 121.68 3dtm h GLU 212 Ca 0.27 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 3dtm h GLU 212 Cb 0.21 -0.29 0.00 0.00 0.63 0.00 0.00 28.75 29.30 3dtm h GLU 212 CO -0.02 0.85 0.00 0.00 -0.73 0.00 0.00 179.01 179.11 3dtm n ALA 213 N -2.38 2.38 -1.67 2.92 0.00 -0.39 -4.84 120.51 116.54 3dtm n ALA 213 Ca 0.13 0.00 -0.53 0.00 0.00 0.00 0.00 53.44 53.04 3dtm n ALA 213 Cb 0.04 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.43 3dtm n ALA 213 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3dtm n ASP 214 N -0.46 2.56 -0.00 0.00 2.03 -0.68 -4.71 116.55 115.28 3dtm n ASP 214 Ca 0.00 1.06 0.08 0.00 0.52 0.00 0.00 54.79 56.45 3dtm n ASP 214 Cb 0.02 -1.24 -0.10 0.00 -0.72 0.00 0.00 41.12 39.08 3dtm n ASP 214 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 3dtm n LYS 215 N 4.82 1.39 -0.49 -0.67 4.76 -0.02 -4.64 118.16 123.29 3dtm n LYS 215 Ca 0.23 -0.01 0.07 0.00 -2.87 0.00 0.00 58.31 55.72 3dtm n LYS 215 Cb 0.20 -1.30 0.17 0.00 -1.84 0.00 0.00 35.03 32.26 3dtm n LYS 215 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 3dtm n VAL 216 N -1.46 1.89 -0.83 -0.18 0.24 -1.25 -4.51 118.33 112.24 3dtm n VAL 216 Ca 0.03 -2.69 0.08 0.00 -2.04 0.00 0.00 64.34 59.71 3dtm n VAL 216 Cb 0.28 -0.13 0.14 0.00 -1.47 0.00 0.00 33.84 32.65 3dtm n VAL 216 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dtm n ALA 217 N -1.07 2.34 -0.33 2.33 0.00 -1.26 -4.85 120.51 117.66 3dtm n ALA 217 Ca 0.17 -2.22 -0.05 0.00 0.00 0.00 0.00 53.44 51.34 3dtm n ALA 217 Cb 0.71 -0.38 -0.02 0.00 0.00 0.00 0.00 19.45 19.76 3dtm n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dtm n GLY 218 N -1.02 -1.92 0.08 0.00 0.00 -1.26 -2.03 105.19 99.04 3dtm n GLY 218 Ca 0.14 0.96 0.10 0.00 0.00 0.00 0.00 46.02 47.22 3dtm n GLY 218 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3dtm n PRO 219 N -5.14 0.12 0.00 1.61 -0.02 -1.26 -2.72 135.00 127.58 3dtm n PRO 219 Ca 0.05 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 3dtm n PRO 219 Cb 0.28 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 3dtm n PRO 219 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3dtm n LEU 220 N -1.95 0.00 -0.27 2.45 4.77 -0.86 -4.59 117.00 116.55 3dtm n LEU 220 Ca 0.03 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.94 3dtm n LEU 220 Cb 0.21 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.35 3dtm n LEU 220 CO 0.18 0.00 1.03 -0.07 -1.33 0.00 0.00 177.39 177.20 3dtm h LEU 221 N 0.00 1.02 -1.56 2.23 3.38 -1.85 -2.42 115.31 116.11 3dtm h LEU 221 Ca 0.00 -0.17 0.20 0.00 0.09 0.00 0.00 57.88 58.00 3dtm h LEU 221 Cb 0.00 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.42 3dtm h LEU 221 CO 0.00 0.91 0.58 0.03 0.09 0.00 0.00 178.44 180.06 3dtm h ARG 222 N 1.07 0.37 0.00 1.13 3.08 -1.77 -2.08 114.38 116.17 3dtm h ARG 222 Ca 0.25 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.28 3dtm h ARG 222 Cb 0.21 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.18 3dtm h ARG 222 CO -0.02 0.24 0.00 0.66 -1.07 0.00 0.00 179.97 179.78 3dtm h SER 223 N 0.38 0.00 0.00 7.04 4.64 -1.23 -3.13 113.55 121.25 3dtm h SER 223 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 3dtm h SER 223 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3dtm h SER 223 CO -0.15 0.00 -0.00 1.33 -0.87 0.00 0.00 176.83 177.13 3dtm n VAL 224 N -3.05 0.84 -2.92 0.95 0.24 -0.80 -5.02 118.33 108.56 3dtm n VAL 224 Ca -0.01 -0.84 -0.41 0.00 -2.04 0.00 0.00 64.34 61.03 3dtm n VAL 224 Cb 0.17 0.58 -0.04 0.00 -1.47 0.00 0.00 33.84 33.08 3dtm n VAL 224 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 3dtm s LEU 225 N -0.85 4.17 0.55 1.34 2.96 -1.12 -4.84 118.68 120.89 3dtm s LEU 225 Ca 0.00 1.13 -0.20 0.00 -0.22 0.00 0.00 54.13 54.84 3dtm s LEU 225 Cb 0.00 -3.19 -0.05 0.00 0.50 0.00 0.00 46.19 43.45 3dtm s LEU 225 CO 0.00 -0.38 1.19 -2.84 -1.32 0.00 0.00 176.35 172.99 3dtm s PRO 226 N 2.13 3.25 0.20 0.98 0.02 -1.26 -4.96 135.00 135.36 3dtm s PRO 226 Ca 0.37 1.78 -0.32 0.00 0.02 0.00 0.00 61.00 62.84 3dtm s PRO 226 Cb -0.16 -2.06 -0.14 0.00 0.02 0.00 0.00 34.50 32.15 3dtm s PRO 226 CO 0.12 -0.97 1.38 0.00 -0.33 0.00 0.00 177.00 177.20 3dtm n ALA 227 N -1.25 0.61 0.00 -1.55 0.00 -1.26 -2.03 120.51 115.03 3dtm n ALA 227 Ca 0.12 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.99 3dtm n ALA 227 Cb 0.49 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.72 3dtm n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dtm n GLY 228 N 2.35 2.97 3.78 0.00 0.00 -1.26 -4.99 105.19 108.04 3dtm n GLY 228 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 3dtm n GLY 228 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3dtm s TRP 229 N -2.76 3.42 0.01 1.61 0.52 -0.86 -1.71 118.94 119.18 3dtm s TRP 229 Ca 0.00 1.69 -0.18 0.00 0.02 0.00 0.00 56.10 57.63 3dtm s TRP 229 Cb 0.00 -3.06 -0.06 0.00 -1.15 0.00 0.00 33.47 29.20 3dtm s TRP 229 CO 0.00 -0.34 0.52 0.12 0.02 0.00 0.00 176.95 177.28 3dtm s PHE 230 N -1.64 3.72 -0.05 -1.98 2.19 0.13 -4.79 117.98 115.57 3dtm s PHE 230 Ca 0.55 1.14 -0.02 0.00 0.33 0.00 0.00 56.93 58.92 3dtm s PHE 230 Cb -0.21 -2.48 0.03 0.00 -1.31 0.00 0.00 43.02 39.05 3dtm s PHE 230 CO 0.27 0.50 0.10 -1.50 1.83 0.00 0.00 175.22 176.42 3dtm s ILE 231 N -0.68 -0.04 -0.15 3.12 2.07 -1.26 -1.75 121.20 122.50 3dtm s ILE 231 Ca 0.28 0.13 -0.01 0.00 -1.41 0.00 0.00 60.65 59.64 3dtm s ILE 231 Cb -0.18 -0.17 0.04 0.00 0.13 0.00 0.00 42.46 42.28 3dtm s ILE 231 CO 0.16 0.05 -0.03 0.00 -1.91 0.00 0.00 174.94 173.21 3dtm s ALA 232 N 0.81 1.28 0.29 1.50 0.00 -0.21 -4.33 121.76 121.09 3dtm s ALA 232 Ca -0.06 -0.69 -0.00 0.00 0.00 0.00 0.00 51.96 51.21 3dtm s ALA 232 Cb -0.08 -1.06 -0.02 0.00 0.00 0.00 0.00 23.12 21.96 3dtm s ALA 232 CO -0.03 -0.77 0.33 0.16 0.00 0.00 0.00 175.76 175.45 3dtm s ASP 233 N 1.72 0.84 -0.28 0.00 1.47 -0.64 -0.93 116.67 118.86 3dtm s ASP 233 Ca 0.01 -1.48 -0.13 0.00 1.18 0.00 0.00 52.55 52.13 3dtm s ASP 233 Cb -0.15 0.55 0.10 0.00 -0.34 0.00 0.00 42.92 43.08 3dtm s ASP 233 CO -0.07 -1.09 0.66 -0.75 0.68 0.00 0.00 175.17 174.59 3dtm s LYS 234 N -3.56 0.64 0.35 2.11 2.47 -0.28 -4.64 119.74 116.82 3dtm s LYS 234 Ca 0.35 1.31 0.08 0.00 -1.56 0.00 0.00 55.97 56.14 3dtm s LYS 234 Cb 0.02 0.44 -0.03 0.00 -1.46 0.00 0.00 37.83 36.80 3dtm s LYS 234 CO 0.19 -0.17 0.27 -1.54 0.16 0.00 0.00 175.35 174.26 3dtm s SER 235 N 2.17 5.08 0.06 1.43 1.04 -1.26 -1.13 113.70 121.09 3dtm s SER 235 Ca -0.08 -0.62 -0.09 0.00 0.48 0.00 0.00 55.95 55.64 3dtm s SER 235 Cb -0.08 -0.83 0.00 0.00 0.10 0.00 0.00 66.02 65.21 3dtm s SER 235 CO -0.19 -0.40 0.19 -0.83 0.98 0.00 0.00 173.24 172.98 3dtm s GLY 236 N -3.98 0.07 0.07 7.32 0.00 -0.55 -3.97 107.32 106.29 3dtm s GLY 236 Ca 0.41 -0.46 0.02 0.00 0.00 0.00 0.00 44.72 44.69 3dtm s GLY 236 CO 0.26 -0.64 -0.06 0.00 0.00 0.00 0.00 173.10 172.65 3dtm s ALA 237 N -3.21 0.77 0.00 3.20 0.00 -1.26 -2.02 121.76 119.25 3dtm s ALA 237 Ca -0.00 -1.12 0.00 0.00 0.00 0.00 0.00 51.96 50.83 3dtm s ALA 237 Cb 0.02 0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.27 3dtm s ALA 237 CO -0.07 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 175.92 3dtm n GLY 238 N 0.51 2.93 3.81 0.00 0.00 -0.39 -4.62 105.19 107.43 3dtm n GLY 238 Ca -0.16 -1.03 -0.29 0.00 0.00 0.00 0.00 46.02 44.54 3dtm n GLY 238 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dtm s GLU 239 N -0.56 1.71 -1.48 1.61 2.02 0.04 -3.64 118.70 118.40 3dtm s GLU 239 Ca 0.00 0.42 -0.12 0.00 0.02 0.00 0.00 54.97 55.29 3dtm s GLU 239 Cb 0.00 -1.89 0.07 0.00 0.10 0.00 0.00 34.13 32.41 3dtm s GLU 239 CO 0.00 -1.83 0.86 0.54 0.02 0.00 0.00 175.26 174.85 3dtm n ARG 240 N -3.54 -5.20 -1.05 1.61 1.74 -1.26 -2.31 116.66 106.65 3dtm n ARG 240 Ca 0.07 0.63 -0.02 0.00 -0.77 0.00 0.00 57.85 57.76 3dtm n ARG 240 Cb 0.58 -5.50 -0.01 0.00 -1.02 0.00 0.00 32.46 26.52 3dtm n ARG 240 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dtm n GLY 241 N -1.60 0.52 3.73 -0.13 0.00 -1.21 0.13 105.19 106.63 3dtm n GLY 241 Ca 0.01 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 3dtm n GLY 241 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dtm s SER 242 N -2.32 6.74 -0.25 1.61 0.01 -0.98 -4.38 113.70 114.13 3dtm s SER 242 Ca 0.00 2.52 -0.23 0.00 1.31 0.00 0.00 55.95 59.55 3dtm s SER 242 Cb 0.00 -2.61 0.07 0.00 0.21 0.00 0.00 66.02 63.69 3dtm s SER 242 CO 0.00 -0.67 0.67 -0.60 0.41 0.00 0.00 173.24 173.05 3dtm s ARG 243 N 0.28 0.78 0.15 12.44 6.06 0.04 -1.26 118.95 137.43 3dtm s ARG 243 Ca 0.62 0.95 -0.24 0.00 -2.50 0.00 0.00 55.73 54.56 3dtm s ARG 243 Cb -0.40 0.36 0.06 0.00 0.06 0.00 0.00 34.95 35.04 3dtm s ARG 243 CO 0.37 -0.10 0.79 0.20 -2.50 0.00 0.00 175.30 174.07 3dtm s GLY 244 N 0.46 -0.34 -0.18 8.12 0.00 -0.86 0.22 107.32 114.75 3dtm s GLY 244 Ca -0.01 0.30 -0.17 0.00 0.00 0.00 0.00 44.72 44.84 3dtm s GLY 244 CO -0.01 0.09 0.49 -1.50 0.00 0.00 0.00 173.10 172.17 3dtm s ILE 245 N -3.53 0.00 -0.02 0.90 2.07 0.70 -1.48 121.20 119.84 3dtm s ILE 245 Ca 0.08 -0.01 0.08 0.00 -1.41 0.00 0.00 60.65 59.38 3dtm s ILE 245 Cb -0.02 -0.68 -0.02 0.00 0.13 0.00 0.00 42.46 41.86 3dtm s ILE 245 CO -0.03 -0.01 -0.26 0.68 -1.91 0.00 0.00 174.94 173.42 3dtm s VAL 246 N 0.20 2.06 -0.15 4.00 -7.23 -0.28 -0.93 120.40 118.07 3dtm s VAL 246 Ca -0.01 -1.10 -0.17 0.00 -1.81 0.00 0.00 61.98 58.90 3dtm s VAL 246 Cb -0.03 -1.71 0.04 0.00 0.56 0.00 0.00 36.38 35.24 3dtm s VAL 246 CO 0.01 0.58 0.45 0.00 -0.31 0.00 0.00 175.10 175.83 3dtm s ALA 247 N -0.56 -1.12 -0.25 1.32 0.00 -0.44 -1.13 121.76 119.58 3dtm s ALA 247 Ca 0.08 1.17 -0.09 0.00 0.00 0.00 0.00 51.96 53.13 3dtm s ALA 247 Cb -0.10 -0.61 -0.04 0.00 0.00 0.00 0.00 23.12 22.37 3dtm s ALA 247 CO -0.00 -0.23 0.11 0.00 0.00 0.00 0.00 175.76 175.64 3dtm s ALA 248 N -0.03 3.34 0.19 0.00 0.00 -0.10 -0.71 121.76 124.45 3dtm s ALA 248 Ca -0.02 -1.05 -0.07 0.00 0.00 0.00 0.00 51.96 50.83 3dtm s ALA 248 Cb -0.03 -2.20 -0.02 0.00 0.00 0.00 0.00 23.12 20.87 3dtm s ALA 248 CO 0.02 -0.39 0.26 -0.48 0.00 0.00 0.00 175.76 175.16 3dtm s LEU 249 N 1.44 0.96 0.00 0.00 2.34 0.33 -1.05 118.68 122.71 3dtm s LEU 249 Ca 0.06 -1.08 0.00 0.00 0.06 0.00 0.00 54.13 53.17 3dtm s LEU 249 Cb -0.15 0.98 0.00 0.00 -0.56 0.00 0.00 46.19 46.46 3dtm s LEU 249 CO 0.06 -0.92 0.00 0.61 -1.06 0.00 0.00 176.35 175.04 3dtm n GLY 250 N -0.26 1.24 3.91 -3.48 0.00 -0.72 -1.42 105.19 104.45 3dtm n GLY 250 Ca -0.03 -0.80 -0.29 0.00 0.00 0.00 0.00 46.02 44.90 3dtm n GLY 250 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dtm s PRO 251 N -2.00 1.81 -1.45 1.61 0.04 -1.25 0.17 135.00 133.92 3dtm s PRO 251 Ca 0.00 0.01 -0.07 0.00 0.04 0.00 0.00 61.00 60.98 3dtm s PRO 251 Cb 0.00 -1.96 0.01 0.00 0.04 0.00 0.00 34.50 32.59 3dtm s PRO 251 CO 0.00 -1.68 0.89 -0.25 0.04 0.00 0.00 177.00 176.01 3dtm n ASP 252 N -3.34 -6.25 -0.42 6.66 8.00 -1.20 -2.72 116.55 117.28 3dtm n ASP 252 Ca 0.09 -0.41 -0.06 0.00 0.71 0.00 0.00 54.79 55.13 3dtm n ASP 252 Cb 0.61 -4.97 -0.02 0.00 -0.02 0.00 0.00 41.12 36.72 3dtm n ASP 252 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dtm n GLY 253 N -1.76 0.73 2.88 0.44 0.00 -0.70 -4.97 105.19 101.81 3dtm n GLY 253 Ca -0.05 -0.26 -0.17 0.00 0.00 0.00 0.00 46.02 45.53 3dtm n GLY 253 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dtm s LYS 254 N -1.99 0.49 0.26 1.61 -2.85 -1.10 -4.77 119.74 111.39 3dtm s LYS 254 Ca 0.00 -0.05 -0.30 0.00 -1.00 0.00 0.00 55.97 54.62 3dtm s LYS 254 Cb 0.00 -0.56 -0.09 0.00 -2.06 0.00 0.00 37.83 35.12 3dtm s LYS 254 CO 0.00 -0.05 1.12 -1.25 0.10 0.00 0.00 175.35 175.28 3dtm s PRO 255 N 0.65 4.60 0.00 1.78 0.04 -1.26 -3.91 135.00 136.90 3dtm s PRO 255 Ca -0.07 1.83 0.00 0.00 0.04 0.00 0.00 61.00 62.79 3dtm s PRO 255 Cb -0.11 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 31.23 3dtm s PRO 255 CO -0.01 0.14 0.11 -1.13 0.04 0.00 0.00 177.00 176.15 3dtm n SER 256 N 1.47 0.22 -3.91 6.66 3.41 -0.59 -4.88 113.62 116.00 3dtm n SER 256 Ca 0.00 -0.57 -0.10 0.00 -0.26 0.00 0.00 58.87 57.94 3dtm n SER 256 Cb 0.45 0.31 -0.09 0.00 -0.26 0.00 0.00 64.21 64.62 3dtm n SER 256 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3dtm s ARG 257 N -0.31 0.61 -0.10 4.33 0.52 -0.51 -1.46 118.95 122.03 3dtm s ARG 257 Ca 0.00 -0.72 0.02 0.00 -0.52 0.00 0.00 55.73 54.50 3dtm s ARG 257 Cb 0.00 0.24 -0.02 0.00 0.52 0.00 0.00 34.95 35.70 3dtm s ARG 257 CO 0.00 -0.16 -0.15 0.42 0.02 0.00 0.00 175.30 175.43 3dtm s ILE 258 N -2.60 2.91 -0.06 1.52 1.01 0.31 -0.51 121.20 123.78 3dtm s ILE 258 Ca -0.05 -0.73 0.05 0.00 0.00 0.00 0.00 60.65 59.91 3dtm s ILE 258 Cb -0.01 -2.18 -0.00 0.00 0.01 0.00 0.00 42.46 40.27 3dtm s ILE 258 CO -0.04 0.55 -0.21 -0.69 0.00 0.00 0.00 174.94 174.55 3dtm s VAL 259 N 0.01 1.74 -0.09 2.92 1.01 0.11 -0.35 120.40 125.76 3dtm s VAL 259 Ca -0.05 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.08 3dtm s VAL 259 Cb -0.14 -1.49 0.01 0.00 0.00 0.00 0.00 36.38 34.75 3dtm s VAL 259 CO 0.04 0.49 -0.16 -0.69 0.00 0.00 0.00 175.10 174.79 3dtm s VAL 260 N 0.05 1.44 -0.06 2.92 1.01 -0.66 -1.33 120.40 123.77 3dtm s VAL 260 Ca -0.07 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.29 3dtm s VAL 260 Cb -0.14 -1.30 0.02 0.00 0.00 0.00 0.00 36.38 34.96 3dtm s VAL 260 CO 0.04 0.43 -0.09 -0.63 0.00 0.00 0.00 175.10 174.84 3dtm s ILE 261 N 0.72 0.91 0.05 2.22 1.01 -0.11 -1.79 121.20 124.20 3dtm s ILE 261 Ca -0.13 -0.35 0.02 0.00 0.00 0.00 0.00 60.65 60.19 3dtm s ILE 261 Cb -0.16 -0.85 -0.03 0.00 0.01 0.00 0.00 42.46 41.43 3dtm s ILE 261 CO 0.03 0.30 -0.07 -0.31 0.00 0.00 0.00 174.94 174.89 3dtm s TYR 262 N 0.72 0.68 -0.04 3.97 2.02 -0.45 -0.22 117.35 124.04 3dtm s TYR 262 Ca -0.13 -0.56 -0.14 0.00 -0.37 0.00 0.00 57.07 55.86 3dtm s TYR 262 Cb -0.15 -0.41 0.02 0.00 -0.40 0.00 0.00 41.96 41.02 3dtm s TYR 262 CO 0.02 -0.10 0.31 -0.08 -1.57 0.00 0.00 175.55 174.14 3dtm s THR 263 N -1.72 0.05 -0.11 -0.71 -1.32 0.13 -0.85 115.64 111.11 3dtm s THR 263 Ca -0.07 -0.38 -0.13 0.00 -1.21 0.00 0.00 61.69 59.90 3dtm s THR 263 Cb -0.08 -0.58 0.03 0.00 -1.51 0.00 0.00 72.50 70.36 3dtm s THR 263 CO -0.00 -0.21 0.35 0.28 -2.21 0.00 0.00 174.62 172.83 3dtm s THR 264 N -1.03 0.01 0.00 5.08 -1.32 -1.20 -0.78 115.64 116.41 3dtm s THR 264 Ca -0.11 -0.09 0.00 0.00 -1.21 0.00 0.00 61.69 60.28 3dtm s THR 264 Cb -0.05 -0.53 0.00 0.00 -1.51 0.00 0.00 72.50 70.42 3dtm s THR 264 CO 0.03 -0.05 0.00 0.61 -2.21 0.00 0.00 174.62 173.01 3dtm n GLY 265 N 2.56 2.44 3.77 6.08 0.00 0.34 -3.88 105.19 116.51 3dtm n GLY 265 Ca -0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 3dtm n GLY 265 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dtm s SER 266 N -1.65 6.28 -0.06 1.61 0.15 -1.15 -4.78 113.70 114.11 3dtm s SER 266 Ca 0.00 2.34 0.18 0.00 0.70 0.00 0.00 55.95 59.17 3dtm s SER 266 Cb 0.00 -2.61 0.62 0.00 -1.71 0.00 0.00 66.02 62.32 3dtm s SER 266 CO 0.00 -0.84 1.53 0.00 1.20 0.00 0.00 173.24 175.12 3dtm n GLN 267 N -0.28 3.21 -0.94 5.44 6.02 -1.26 -3.28 117.38 126.29 3dtm n GLN 267 Ca 0.06 -2.67 -0.30 0.00 -0.01 0.00 0.00 57.00 54.08 3dtm n GLN 267 Cb 0.47 -1.68 0.16 0.00 1.02 0.00 0.00 30.24 30.22 3dtm n GLN 267 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3dtm s ALA 268 N -1.48 1.25 0.75 -1.58 0.00 -1.26 -5.02 121.76 114.41 3dtm s ALA 268 Ca 0.45 0.17 -0.11 0.00 0.00 0.00 0.00 51.96 52.47 3dtm s ALA 268 Cb 0.27 -3.29 0.04 0.00 0.00 0.00 0.00 23.12 20.14 3dtm s ALA 268 CO 0.25 -2.67 1.09 0.95 0.00 0.00 0.00 175.76 175.38 3dtm s THR 269 N -2.75 3.39 0.25 0.00 -4.23 -1.26 -4.83 115.64 106.20 3dtm s THR 269 Ca 0.65 0.48 -0.03 0.00 -1.18 0.00 0.00 61.69 61.61 3dtm s THR 269 Cb -0.21 -3.00 0.22 0.00 1.34 0.00 0.00 72.50 70.86 3dtm s THR 269 CO 0.59 -0.56 1.79 -0.03 -0.54 0.00 0.00 174.62 175.86 3dtm h MET 270 N -0.90 0.67 -0.91 3.99 4.05 -1.99 -0.05 114.93 119.79 3dtm h MET 270 Ca -0.44 -0.04 0.06 0.00 -0.28 0.00 0.00 59.70 59.00 3dtm h MET 270 Cb 1.23 -0.15 -0.06 0.00 -0.80 0.00 0.00 31.60 31.82 3dtm h MET 270 CO 0.52 0.45 0.59 -0.44 0.23 0.00 0.00 176.91 178.26 3dtm h ASP 271 N 0.69 0.91 -0.16 1.39 3.32 -1.99 0.22 116.42 120.81 3dtm h ASP 271 Ca 0.42 0.01 -0.15 0.00 0.02 0.00 0.00 57.03 57.32 3dtm h ASP 271 Cb 0.49 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.85 3dtm h ASP 271 CO -0.30 0.59 -0.50 -0.08 -1.72 0.00 0.00 179.24 177.23 3dtm h GLU 272 N 1.04 0.62 -0.30 3.56 4.57 -1.59 -1.92 114.58 120.55 3dtm h GLU 272 Ca 0.39 -0.45 0.04 0.00 -1.18 0.00 0.00 59.36 58.16 3dtm h GLU 272 Cb 0.19 0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.82 3dtm h GLU 272 CO -0.14 1.07 0.07 -0.07 -1.18 0.00 0.00 179.01 178.76 3dtm h LEU 273 N 0.28 0.04 -0.49 1.64 3.38 -0.78 -0.20 115.31 119.18 3dtm h LEU 273 Ca -0.02 0.04 0.07 0.00 0.09 0.00 0.00 57.88 58.06 3dtm h LEU 273 Cb 1.12 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.87 3dtm h LEU 273 CO 0.11 0.06 0.17 0.78 0.09 0.00 0.00 178.44 179.65 3dtm h ASN 274 N 0.19 0.18 -0.50 -0.43 2.35 -0.98 -2.59 115.58 113.79 3dtm h ASN 274 Ca 0.14 0.06 -0.05 0.00 -0.55 0.00 0.00 56.30 55.90 3dtm h ASN 274 Cb 0.14 0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 3dtm h ASN 274 CO -0.17 0.13 0.12 -0.09 -1.65 0.00 0.00 177.43 175.77 3dtm h ARG 275 N 0.35 0.80 -0.61 0.81 2.43 -0.91 0.61 114.38 117.86 3dtm h ARG 275 Ca 0.23 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 3dtm h ARG 275 Cb 0.25 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 3dtm h ARG 275 CO -0.24 0.77 0.36 1.96 -1.51 0.00 0.00 179.97 181.32 3dtm h GLN 276 N 0.69 0.84 -0.62 0.20 1.08 -0.97 -0.06 115.11 116.27 3dtm h GLN 276 Ca 0.16 -0.08 -0.08 0.00 -1.45 0.00 0.00 58.65 57.19 3dtm h GLN 276 Cb 0.33 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.56 3dtm h GLN 276 CO 0.00 0.61 0.06 0.82 -0.95 0.00 0.00 178.83 179.38 3dtm h ILE 277 N 0.83 1.26 -0.47 2.54 2.04 -1.13 -1.71 117.51 120.88 3dtm h ILE 277 Ca 0.22 -1.06 -0.07 0.00 1.00 0.00 0.00 64.86 64.95 3dtm h ILE 277 Cb -0.01 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 3dtm h ILE 277 CO -0.04 0.39 0.02 0.00 0.00 0.00 0.00 178.15 178.52 3dtm h ALA 278 N 1.09 0.63 -0.95 1.87 0.00 -0.51 -0.72 119.26 120.67 3dtm h ALA 278 Ca 0.19 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 54.88 3dtm h ALA 278 Cb 0.47 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 3dtm h ALA 278 CO 0.02 0.41 0.61 0.93 0.00 0.00 0.00 179.25 181.22 3dtm h GLU 279 N 0.67 1.11 -0.23 0.00 5.08 -0.98 0.20 114.58 120.43 3dtm h GLU 279 Ca 0.13 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 3dtm h GLU 279 Cb 0.48 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 3dtm h GLU 279 CO 0.02 0.74 0.11 0.82 -1.00 0.00 0.00 179.01 179.70 3dtm h ILE 280 N 1.15 1.13 -0.59 3.13 2.04 -0.87 -1.46 117.51 122.04 3dtm h ILE 280 Ca 0.39 -0.37 0.11 0.00 1.00 0.00 0.00 64.86 65.99 3dtm h ILE 280 Cb 0.08 0.96 -0.09 0.00 -0.74 0.00 0.00 36.82 37.04 3dtm h ILE 280 CO -0.15 0.13 0.11 1.23 0.00 0.00 0.00 178.15 179.48 3dtm h GLY 281 N 0.24 0.74 1.88 5.37 0.00 -0.84 -0.96 103.07 109.50 3dtm h GLY 281 Ca 0.08 -0.02 -0.04 0.00 0.00 0.00 0.00 47.33 47.35 3dtm h GLY 281 CO -0.01 -0.12 -0.14 0.00 0.00 0.00 0.00 176.54 176.28 3dtm h ALA 282 N 1.47 1.60 -0.06 3.60 0.00 -0.25 -0.56 119.26 125.06 3dtm h ALA 282 Ca 0.31 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 3dtm h ALA 282 Cb 0.46 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3dtm h ALA 282 CO -0.40 0.30 -0.30 1.03 0.00 0.00 0.00 179.25 179.87 3dtm h SER 283 N 0.14 0.37 -0.10 0.00 0.87 -0.77 -1.24 113.55 112.82 3dtm h SER 283 Ca 0.03 -0.65 -0.02 0.00 -1.23 0.00 0.00 61.79 59.91 3dtm h SER 283 Cb 0.33 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.18 3dtm h SER 283 CO 0.02 0.96 0.01 0.17 -0.53 0.00 0.00 176.83 177.46 3dtm h LEU 284 N -0.20 0.24 0.01 2.23 8.10 -0.85 0.12 115.31 124.96 3dtm h LEU 284 Ca -0.02 -0.03 -0.00 0.00 0.11 0.00 0.00 57.88 57.94 3dtm h LEU 284 Cb 0.95 -0.06 0.00 0.00 -0.44 0.00 0.00 40.66 41.11 3dtm h LEU 284 CO 0.06 0.28 -0.01 0.40 -4.11 0.00 0.00 178.44 175.07 3dtm h ILE 285 N 0.26 1.43 -0.18 0.15 1.08 -1.13 -2.69 117.51 116.43 3dtm h ILE 285 Ca 0.06 -1.38 0.00 0.00 -0.39 0.00 0.00 64.86 63.15 3dtm h ILE 285 Cb 0.17 2.35 -0.01 0.00 -3.07 0.00 0.00 36.82 36.26 3dtm h ILE 285 CO 0.00 0.35 0.12 0.50 -0.69 0.00 0.00 178.15 178.43 3dtm h LYS 286 N -0.62 0.24 -0.22 2.37 3.64 -0.74 -2.88 116.57 118.36 3dtm h LYS 286 Ca -0.00 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.30 3dtm h LYS 286 Cb 0.59 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.32 3dtm h LYS 286 CO 0.00 0.16 -0.07 0.72 -2.27 0.00 0.00 179.45 178.00 3dtm n HIS 287 N -4.51 0.74 0.00 1.91 8.25 0.36 -5.08 115.22 116.90 3dtm n HIS 287 Ca -0.00 -1.21 0.00 0.00 -0.26 0.00 0.00 57.72 56.25 3dtm n HIS 287 Cb 0.08 -0.34 0.00 0.00 1.12 0.00 0.00 29.99 30.85 3dtm n HIS 287 CO 0.00 0.00 0.00 1.87 0.64 0.00 0.00 176.34 178.85