#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dvt s GLN 2 N 0.00 2.58 -0.82 2.12 -1.52 -1.26 -4.41 119.66 116.35 2dvt s GLN 2 Ca 0.00 -1.45 0.00 0.00 -1.95 0.00 0.00 55.36 51.96 2dvt s GLN 2 Cb 0.00 -2.37 0.00 0.00 -0.22 0.00 0.00 33.01 30.42 2dvt s GLN 2 CO 0.00 -0.01 0.00 0.41 -0.25 0.00 0.00 175.29 175.44 2dvt n GLY 3 N -1.39 0.61 3.80 3.09 0.00 -1.06 -4.97 105.19 105.27 2dvt n GLY 3 Ca -0.00 -0.61 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 2dvt n GLY 3 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dvt s LYS 4 N -3.42 2.66 -0.07 1.61 1.02 -0.06 -4.52 119.74 116.96 2dvt s LYS 4 Ca 0.00 1.05 0.05 0.00 0.02 0.00 0.00 55.97 57.08 2dvt s LYS 4 Cb 0.00 -1.95 -0.01 0.00 -0.52 0.00 0.00 37.83 35.35 2dvt s LYS 4 CO 0.00 -1.32 -0.22 0.08 -0.92 0.00 0.00 175.35 172.97 2dvt s VAL 5 N -2.98 2.26 -0.05 3.17 1.01 -0.06 -0.70 120.40 123.05 2dvt s VAL 5 Ca 0.59 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.63 2dvt s VAL 5 Cb -0.15 -1.85 -0.00 0.00 0.00 0.00 0.00 36.38 34.38 2dvt s VAL 5 CO 0.55 0.56 -0.17 0.00 0.00 0.00 0.00 175.10 176.05 2dvt s ALA 6 N -0.04 1.49 -0.05 5.51 0.00 -0.39 -4.50 121.76 123.79 2dvt s ALA 6 Ca -0.06 -0.66 0.07 0.00 0.00 0.00 0.00 51.96 51.30 2dvt s ALA 6 Cb -0.15 -0.51 0.10 0.00 0.00 0.00 0.00 23.12 22.56 2dvt s ALA 6 CO 0.05 0.26 0.98 1.47 0.00 0.00 0.00 175.76 178.51 2dvt n LEU 7 N 3.22 1.19 -3.35 0.00 -0.00 -1.25 -1.03 117.00 115.78 2dvt n LEU 7 Ca -0.19 -1.77 -0.26 0.00 -0.00 0.00 0.00 56.01 53.80 2dvt n LEU 7 Cb 0.53 -0.15 -0.08 0.00 -0.00 0.00 0.00 43.42 43.72 2dvt n LEU 7 CO 0.25 0.42 -0.12 1.21 -0.00 0.00 0.00 177.39 179.15 2dvt n GLU 8 N -0.60 1.55 -3.98 1.47 2.13 -1.26 -4.85 120.64 115.10 2dvt n GLU 8 Ca 0.06 -3.94 -0.30 0.00 0.66 0.00 0.00 57.16 53.64 2dvt n GLU 8 Cb 0.57 -1.77 -0.16 0.00 0.27 0.00 0.00 31.44 30.35 2dvt n GLU 8 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2dvt s GLU 9 N -1.70 2.00 0.24 5.31 0.41 -1.25 -0.78 118.70 122.93 2dvt s GLU 9 Ca 0.36 -0.64 0.06 0.00 -0.41 0.00 0.00 54.97 54.34 2dvt s GLU 9 Cb 0.14 -2.18 -0.03 0.00 -1.78 0.00 0.00 34.13 30.28 2dvt s GLU 9 CO -0.08 -0.35 0.28 -1.01 -0.49 0.00 0.00 175.26 173.62 2dvt s HIS 10 N 1.49 3.30 0.21 1.61 3.76 0.22 -1.53 115.29 124.34 2dvt s HIS 10 Ca 0.02 -0.05 -0.09 0.00 -0.15 0.00 0.00 55.06 54.79 2dvt s HIS 10 Cb -0.15 -1.50 -0.02 0.00 1.11 0.00 0.00 32.58 32.03 2dvt s HIS 10 CO -0.09 0.48 0.33 -0.59 -0.85 0.00 0.00 174.74 174.02 2dvt s PHE 11 N -2.03 0.60 0.09 1.40 -0.12 -0.64 -4.35 117.98 112.94 2dvt s PHE 11 Ca 0.33 -0.92 -0.01 0.00 -0.05 0.00 0.00 56.93 56.29 2dvt s PHE 11 Cb -0.09 -0.08 -0.04 0.00 -0.63 0.00 0.00 43.02 42.18 2dvt s PHE 11 CO 0.27 -0.83 0.01 0.00 -0.05 0.00 0.00 175.22 174.62 2dvt s ALA 12 N -4.05 0.72 0.28 1.99 0.00 -0.55 -0.99 121.76 119.15 2dvt s ALA 12 Ca 0.26 -1.34 0.10 0.00 0.00 0.00 0.00 51.96 50.98 2dvt s ALA 12 Cb 0.02 0.54 -0.05 0.00 0.00 0.00 0.00 23.12 23.63 2dvt s ALA 12 CO 0.08 -0.41 -0.06 0.96 0.00 0.00 0.00 175.76 176.32 2dvt s ILE 13 N -3.95 3.07 0.32 0.00 -4.36 -1.26 -4.59 121.20 110.43 2dvt s ILE 13 Ca 0.15 -2.07 0.09 0.00 -0.26 0.00 0.00 60.65 58.57 2dvt s ILE 13 Cb 0.08 -2.68 0.31 0.00 1.25 0.00 0.00 42.46 41.42 2dvt s ILE 13 CO -0.04 -0.36 1.68 -0.65 0.24 0.00 0.00 174.94 175.81 2dvt h PRO 14 N 1.99 0.37 0.00 0.37 0.11 -2.00 0.02 132.00 132.86 2dvt h PRO 14 Ca -0.43 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 2dvt h PRO 14 Cb 1.25 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 2dvt h PRO 14 CO 0.61 0.24 -0.01 0.93 -0.21 0.00 0.00 178.00 179.57 2dvt h GLU 15 N 0.38 0.00 -0.00 1.05 3.07 -2.02 -3.07 114.58 113.99 2dvt h GLU 15 Ca 0.65 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.51 2dvt h GLU 15 Cb 1.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.26 2dvt h GLU 15 CO -0.57 0.01 -0.02 0.25 -1.40 0.00 0.00 179.01 177.28 2dvt n THR 16 N -3.11 0.00 -0.16 1.13 -2.24 -0.13 -4.78 114.28 105.00 2dvt n THR 16 Ca -0.01 -0.49 -0.02 0.00 -2.27 0.00 0.00 64.05 61.25 2dvt n THR 16 Cb 0.18 1.03 0.06 0.00 -2.10 0.00 0.00 70.33 69.50 2dvt n THR 16 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2dvt h LEU 17 N 0.29 -0.15 -2.43 3.22 5.85 -1.13 -1.99 115.31 118.97 2dvt h LEU 17 Ca 0.00 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 2dvt h LEU 17 Cb 0.07 0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.28 2dvt h LEU 17 CO 0.00 -0.04 0.04 1.56 -0.34 0.00 0.00 178.44 179.65 2dvt h GLN 18 N 0.15 0.00 0.00 1.25 1.08 -1.86 -2.01 115.11 113.71 2dvt h GLN 18 Ca 0.25 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.44 2dvt h GLN 18 Cb 0.37 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.79 2dvt h GLN 18 CO -0.39 0.00 -0.06 -0.44 -0.95 0.00 0.00 178.83 177.00 2dvt h ASP 19 N 0.00 0.00 0.02 1.46 5.19 -1.66 -2.08 116.42 119.34 2dvt h ASP 19 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2dvt h ASP 19 Cb 0.08 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.59 2dvt h ASP 19 CO 0.00 0.06 -0.11 -1.20 -3.12 0.00 0.00 179.24 174.87 2dvt n SER 20 N -3.82 2.05 -0.09 6.45 7.64 -0.76 -4.41 113.62 120.68 2dvt n SER 20 Ca -0.03 -1.59 0.16 0.00 1.01 0.00 0.00 58.87 58.42 2dvt n SER 20 Cb 0.15 0.09 0.56 0.00 -1.01 0.00 0.00 64.21 64.00 2dvt n SER 20 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dvt h ALA 21 N 4.32 2.21 -0.01 -0.43 0.00 -1.51 -1.50 119.26 122.34 2dvt h ALA 21 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2dvt h ALA 21 Cb 0.72 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2dvt h ALA 21 CO 0.00 -0.38 -0.17 0.41 0.00 0.00 0.00 179.25 179.11 2dvt n GLY 22 N -1.56 -0.55 0.21 0.00 0.00 -1.26 -4.11 105.19 97.92 2dvt n GLY 22 Ca 0.12 -0.38 -0.03 0.00 0.00 0.00 0.00 46.02 45.72 2dvt n GLY 22 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2dvt h PHE 23 N 1.31 0.40 -3.68 1.61 0.04 -1.56 -3.45 116.94 111.62 2dvt h PHE 23 Ca 0.00 -0.11 -0.33 0.00 2.80 0.00 0.00 57.97 60.33 2dvt h PHE 23 Cb 0.47 -0.09 -0.17 0.00 2.20 0.00 0.00 35.95 38.35 2dvt h PHE 23 CO 0.00 0.68 -0.73 0.14 -0.60 0.00 0.00 178.31 177.80 2dvt s VAL 24 N -4.22 1.01 1.39 -0.55 -7.23 -1.26 -5.09 120.40 104.46 2dvt s VAL 24 Ca -0.05 -1.70 -0.23 0.00 -1.81 0.00 0.00 61.98 58.19 2dvt s VAL 24 Cb 0.13 -1.44 0.35 0.00 0.56 0.00 0.00 36.38 35.99 2dvt s VAL 24 CO 0.79 -0.57 0.97 -2.84 -0.31 0.00 0.00 175.10 173.14 2dvt s PRO 25 N -2.90 -2.68 1.29 4.82 0.02 -1.26 -4.76 135.00 129.53 2dvt s PRO 25 Ca 0.07 0.04 -0.21 0.00 0.02 0.00 0.00 61.00 60.91 2dvt s PRO 25 Cb -0.02 -1.42 0.32 0.00 0.02 0.00 0.00 34.50 33.40 2dvt s PRO 25 CO 0.00 -4.69 1.06 0.20 -0.33 0.00 0.00 177.00 173.25 2dvt s GLY 26 N -3.37 1.54 0.00 0.52 0.00 -1.26 -3.22 107.32 101.52 2dvt s GLY 26 Ca 0.69 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 44.40 2dvt s GLY 26 CO 0.57 -0.05 0.00 1.22 0.00 0.00 0.00 173.10 174.84 2dvt n ASP 27 N -5.08 0.00 0.01 1.64 8.00 -1.26 -4.28 116.55 115.58 2dvt n ASP 27 Ca 0.15 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.76 2dvt n ASP 27 Cb 0.60 0.00 0.20 0.00 -0.02 0.00 0.00 41.12 41.90 2dvt n ASP 27 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2dvt n TYR 28 N 0.00 0.12 -0.24 1.24 4.02 -1.23 -4.18 117.16 116.91 2dvt n TYR 28 Ca 0.00 0.04 -0.06 0.00 -0.01 0.00 0.00 57.90 57.86 2dvt n TYR 28 Cb 0.00 -0.33 0.04 0.00 -0.02 0.00 0.00 39.34 39.03 2dvt n TYR 28 CO 0.00 0.00 0.00 2.35 -1.01 0.00 0.00 176.86 178.20 2dvt h TRP 29 N 0.00 0.90 -0.64 -0.72 -0.00 -1.73 -0.93 115.95 112.83 2dvt h TRP 29 Ca 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 58.89 58.87 2dvt h TRP 29 Cb 0.57 -0.29 -0.03 0.00 -0.00 0.00 0.00 29.16 29.41 2dvt h TRP 29 CO 0.00 0.64 0.41 0.87 -0.00 0.00 0.00 178.44 180.37 2dvt h LYS 30 N 0.90 0.85 -0.39 2.65 1.57 -1.92 -0.63 116.57 119.59 2dvt h LYS 30 Ca 0.23 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.89 2dvt h LYS 30 Cb 0.04 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 2dvt h LYS 30 CO -0.04 0.57 0.00 1.49 -0.57 0.00 0.00 179.45 180.91 2dvt h GLU 31 N 0.86 0.68 -0.65 3.15 4.57 -1.71 -1.94 114.58 119.54 2dvt h GLU 31 Ca 0.23 -0.21 -0.02 0.00 -1.18 0.00 0.00 59.36 58.17 2dvt h GLU 31 Cb -0.08 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.41 2dvt h GLU 31 CO -0.05 0.77 0.30 1.25 -1.18 0.00 0.00 179.01 180.11 2dvt h LEU 32 N 0.51 0.83 -0.22 1.64 5.85 -0.86 -0.49 115.31 122.57 2dvt h LEU 32 Ca 0.11 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 2dvt h LEU 32 Cb 0.46 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 2dvt h LEU 32 CO 0.02 0.71 0.08 1.56 -0.34 0.00 0.00 178.44 180.47 2dvt h GLN 33 N 0.92 0.33 -0.62 1.25 4.20 -0.93 -0.40 115.11 119.87 2dvt h GLN 33 Ca 0.22 -0.07 0.07 0.00 0.06 0.00 0.00 58.65 58.93 2dvt h GLN 33 Cb 0.11 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 27.78 2dvt h GLN 33 CO -0.03 0.41 0.31 1.25 -0.67 0.00 0.00 178.83 180.10 2dvt h HIS 34 N 0.19 0.56 -0.31 2.96 2.76 -0.78 -1.20 115.15 119.33 2dvt h HIS 34 Ca 0.07 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.25 2dvt h HIS 34 Cb 0.21 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.00 2dvt h HIS 34 CO -0.00 0.24 0.15 0.00 -1.30 0.00 0.00 177.93 177.01 2dvt h ARG 35 N 0.57 0.45 -0.25 5.26 3.08 -0.82 -1.66 114.38 121.01 2dvt h ARG 35 Ca 0.29 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.23 2dvt h ARG 35 Cb 0.23 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 2dvt h ARG 35 CO -0.21 0.43 -0.02 -0.07 -1.07 0.00 0.00 179.97 179.03 2dvt h LEU 36 N 0.37 0.35 0.00 3.04 3.38 -0.58 -2.88 115.31 118.99 2dvt h LEU 36 Ca 0.11 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2dvt h LEU 36 Cb 0.13 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2dvt h LEU 36 CO -0.01 0.43 -0.67 -0.07 0.09 0.00 0.00 178.44 178.20 2dvt h LEU 37 N 0.37 0.00 -9.32 1.67 3.38 -1.09 -1.47 115.31 108.85 2dvt h LEU 37 Ca 0.08 -0.01 -0.57 0.00 0.09 0.00 0.00 57.88 57.47 2dvt h LEU 37 Cb 0.28 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.96 2dvt h LEU 37 CO 0.01 0.01 -0.00 -0.62 0.09 0.00 0.00 178.44 177.92 2dvt s ASP 38 N -5.55 6.82 0.00 -0.43 -1.08 -0.64 -4.91 116.67 110.88 2dvt s ASP 38 Ca 0.02 0.99 0.00 0.00 -0.52 0.00 0.00 52.55 53.04 2dvt s ASP 38 Cb 0.08 -2.35 0.00 0.00 -1.46 0.00 0.00 42.92 39.19 2dvt s ASP 38 CO 0.75 -0.09 0.00 -0.38 0.52 0.00 0.00 175.17 175.97 2dvt n ILE 39 N 3.85 0.00 0.18 4.11 5.41 -1.26 -4.68 119.36 126.96 2dvt n ILE 39 Ca -0.04 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.83 2dvt n ILE 39 Cb 0.51 -0.71 0.10 0.00 -0.71 0.00 0.00 39.64 38.84 2dvt n ILE 39 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 2dvt h GLN 40 N 0.00 0.00 0.00 0.38 1.08 -1.95 -3.33 115.11 111.29 2dvt h GLN 40 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2dvt h GLN 40 Cb 0.61 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.04 2dvt h GLN 40 CO 0.00 0.02 0.00 -0.25 -0.95 0.00 0.00 178.83 177.65 2dvt n ASP 41 N -2.96 0.00 -0.23 1.46 8.00 -1.26 -4.48 116.55 117.08 2dvt n ASP 41 Ca 0.02 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.51 2dvt n ASP 41 Cb 0.55 0.00 0.11 0.00 -0.02 0.00 0.00 41.12 41.75 2dvt n ASP 41 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2dvt h THR 42 N 0.00 0.95 -0.49 -3.53 2.02 -1.92 -2.00 112.91 107.93 2dvt h THR 42 Ca 0.00 -0.23 0.06 0.00 0.77 0.00 0.00 66.41 67.01 2dvt h THR 42 Cb 0.00 0.21 -0.05 0.00 -1.74 0.00 0.00 68.15 66.57 2dvt h THR 42 CO 0.00 0.12 0.19 -0.09 0.37 0.00 0.00 175.52 176.11 2dvt h ARG 43 N 0.67 0.36 -0.43 6.66 2.43 -1.83 -0.90 114.38 121.34 2dvt h ARG 43 Ca 0.31 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.37 2dvt h ARG 43 Cb 0.22 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 2dvt h ARG 43 CO -0.20 0.24 -0.10 1.25 -1.51 0.00 0.00 179.97 179.65 2dvt h LEU 44 N 0.37 0.76 -0.91 3.80 7.12 -1.56 -1.61 115.31 123.28 2dvt h LEU 44 Ca 0.23 -0.22 -0.08 0.00 0.13 0.00 0.00 57.88 57.94 2dvt h LEU 44 Cb 0.23 -0.21 -0.02 0.00 -0.53 0.00 0.00 40.66 40.14 2dvt h LEU 44 CO -0.23 0.89 -0.05 0.11 -0.13 0.00 0.00 178.44 179.04 2dvt h LYS 45 N 0.70 0.75 -0.22 1.25 1.57 -0.68 -1.02 116.57 118.92 2dvt h LYS 45 Ca 0.12 -0.22 -0.14 0.00 -1.87 0.00 0.00 60.65 58.54 2dvt h LYS 45 Cb 0.58 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 2dvt h LYS 45 CO 0.04 0.79 -0.46 -0.07 -0.57 0.00 0.00 179.45 179.18 2dvt h LEU 46 N 0.69 0.62 -0.59 2.94 3.38 -0.90 -1.89 115.31 119.56 2dvt h LEU 46 Ca 0.13 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 2dvt h LEU 46 Cb 0.49 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 2dvt h LEU 46 CO 0.03 0.99 0.19 0.24 0.09 0.00 0.00 178.44 179.98 2dvt h MET 47 N 0.46 0.91 -0.14 1.13 2.86 -0.84 -0.43 114.93 118.88 2dvt h MET 47 Ca 0.03 -0.19 -0.09 0.00 -2.06 0.00 0.00 59.70 57.38 2dvt h MET 47 Cb 0.98 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.50 2dvt h MET 47 CO 0.09 0.81 -0.33 -0.44 1.06 0.00 0.00 176.91 178.10 2dvt h ASP 48 N 0.83 0.29 1.57 1.22 3.32 -1.04 -1.50 116.42 121.11 2dvt h ASP 48 Ca 0.19 -0.10 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 2dvt h ASP 48 Cb 0.27 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 2dvt h ASP 48 CO -0.01 0.61 -0.44 0.00 -1.72 0.00 0.00 179.24 177.68 2dvt h ALA 49 N 1.41 0.78 -0.38 3.45 0.00 -1.06 -3.36 119.26 120.10 2dvt h ALA 49 Ca 0.03 -0.26 -0.26 0.00 0.00 0.00 0.00 54.91 54.42 2dvt h ALA 49 Cb 0.71 -0.01 -0.19 0.00 0.00 0.00 0.00 17.79 18.30 2dvt h ALA 49 CO 0.05 0.33 -0.50 0.72 0.00 0.00 0.00 179.25 179.85 2dvt n HIS 50 N -3.09 1.34 -3.66 0.00 8.25 -0.19 -5.00 115.22 112.87 2dvt n HIS 50 Ca 0.02 -1.85 -0.27 0.00 -0.26 0.00 0.00 57.72 55.35 2dvt n HIS 50 Cb 0.64 -0.37 0.03 0.00 1.12 0.00 0.00 29.99 31.41 2dvt n HIS 50 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dvt n GLY 51 N -0.96 -0.51 3.30 -1.41 0.00 -1.11 -4.91 105.19 99.59 2dvt n GLY 51 Ca 0.32 0.17 -0.36 0.00 0.00 0.00 0.00 46.02 46.16 2dvt n GLY 51 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dvt s ILE 52 N -3.22 3.47 -0.14 -0.61 1.01 -0.58 -0.88 121.20 120.25 2dvt s ILE 52 Ca 0.56 -0.68 -0.15 0.00 0.00 0.00 0.00 60.65 60.38 2dvt s ILE 52 Cb -0.28 -2.70 -0.24 0.00 0.01 0.00 0.00 42.46 39.25 2dvt s ILE 52 CO 0.70 0.25 0.39 -0.08 0.00 0.00 0.00 174.94 176.19 2dvt h GLU 53 N 8.13 0.17 -5.54 2.79 4.81 -1.15 -3.40 114.58 120.38 2dvt h GLU 53 Ca -0.36 -0.29 -0.68 0.00 -0.13 0.00 0.00 59.36 57.90 2dvt h GLU 53 Cb 1.14 0.11 -0.32 0.00 0.63 0.00 0.00 28.75 30.30 2dvt h GLU 53 CO 0.59 1.14 -0.87 0.99 -0.73 0.00 0.00 179.01 180.13 2dvt s THR 54 N -2.46 2.16 -0.16 0.32 2.01 -0.95 -4.45 115.64 112.11 2dvt s THR 54 Ca -0.24 -1.00 0.01 0.00 0.31 0.00 0.00 61.69 60.77 2dvt s THR 54 Cb 0.05 -1.82 0.02 0.00 0.01 0.00 0.00 72.50 70.77 2dvt s THR 54 CO 0.71 0.56 -0.15 -0.32 -0.69 0.00 0.00 174.62 174.73 2dvt s MET 55 N 0.18 2.47 -0.44 4.92 1.75 0.05 -1.26 119.30 126.97 2dvt s MET 55 Ca -0.13 -0.68 -0.19 0.00 -1.25 0.00 0.00 55.69 53.44 2dvt s MET 55 Cb -0.16 -2.28 0.03 0.00 2.84 0.00 0.00 34.83 35.25 2dvt s MET 55 CO 0.07 -0.25 0.54 0.42 -0.65 0.00 0.00 175.02 175.15 2dvt s ILE 56 N 1.42 4.96 0.41 10.11 1.01 -0.20 -1.67 121.20 137.24 2dvt s ILE 56 Ca 0.04 -0.22 -0.18 0.00 0.00 0.00 0.00 60.65 60.29 2dvt s ILE 56 Cb -0.13 -4.14 -0.10 0.00 0.01 0.00 0.00 42.46 38.10 2dvt s ILE 56 CO -0.11 -0.55 0.88 -0.76 0.00 0.00 0.00 174.94 174.40 2dvt s LEU 57 N 2.45 3.92 -0.02 2.97 1.43 -0.19 -3.94 118.68 125.30 2dvt s LEU 57 Ca 0.16 1.50 -0.14 0.00 -1.03 0.00 0.00 54.13 54.62 2dvt s LEU 57 Cb -0.16 -4.36 0.02 0.00 0.03 0.00 0.00 46.19 41.72 2dvt s LEU 57 CO 0.15 -0.35 0.31 -0.94 0.23 0.00 0.00 176.35 175.75 2dvt s SER 58 N -2.42 -0.20 0.86 2.29 1.04 -0.59 -1.29 113.70 113.40 2dvt s SER 58 Ca 0.58 0.13 -0.10 0.00 0.48 0.00 0.00 55.95 57.04 2dvt s SER 58 Cb -0.10 0.35 0.12 0.00 0.10 0.00 0.00 66.02 66.48 2dvt s SER 58 CO 0.19 -0.41 1.13 -0.22 0.98 0.00 0.00 173.24 174.90 2dvt s LEU 59 N -1.18 2.92 0.00 2.42 2.96 -1.26 -1.62 118.68 122.92 2dvt s LEU 59 Ca -0.12 2.09 -0.07 0.00 -0.22 0.00 0.00 54.13 55.80 2dvt s LEU 59 Cb -0.05 -4.55 0.10 0.00 0.50 0.00 0.00 46.19 42.19 2dvt s LEU 59 CO 0.04 -2.75 0.51 -0.46 -1.32 0.00 0.00 176.35 172.36 2dvt n ASN 60 N -3.97 -0.52 -4.31 3.68 6.94 -0.16 -4.67 115.26 112.25 2dvt n ASN 60 Ca 0.11 -1.04 -0.21 0.00 -0.02 0.00 0.00 54.58 53.42 2dvt n ASN 60 Cb 0.52 -0.42 -0.11 0.00 -2.36 0.00 0.00 39.78 37.41 2dvt n ASN 60 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2dvt s ALA 61 N -3.62 1.90 -0.81 -2.53 0.00 -1.26 -3.99 121.76 111.46 2dvt s ALA 61 Ca 0.30 -1.43 0.27 0.00 0.00 0.00 0.00 51.96 51.10 2dvt s ALA 61 Cb -0.02 -0.17 0.92 0.00 0.00 0.00 0.00 23.12 23.85 2dvt s ALA 61 CO 0.22 0.23 1.81 -0.35 0.00 0.00 0.00 175.76 177.66 2dvt n PRO 62 N 0.41 0.19 0.00 0.00 -0.04 -1.26 -4.39 135.00 129.90 2dvt n PRO 62 Ca -0.14 0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 2dvt n PRO 62 Cb 0.57 -1.71 0.00 0.00 -0.04 0.00 0.00 33.50 32.32 2dvt n PRO 62 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dvt n ALA 63 N -1.70 0.00 -0.18 0.55 0.00 -1.26 -1.87 120.51 116.05 2dvt n ALA 63 Ca 0.06 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.62 2dvt n ALA 63 Cb 0.40 0.00 0.44 0.00 0.00 0.00 0.00 19.45 20.29 2dvt n ALA 63 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2dvt h VAL 64 N 0.00 0.87 0.00 0.00 2.07 -1.91 -1.40 116.25 115.88 2dvt h VAL 64 Ca 0.00 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.33 2dvt h VAL 64 Cb 0.00 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.03 2dvt h VAL 64 CO 0.00 0.10 0.00 0.00 0.02 0.00 0.00 177.57 177.69 2dvt n GLN 65 N -4.50 0.15 -0.38 1.57 3.00 -0.78 -2.10 117.38 114.35 2dvt n GLN 65 Ca 0.14 0.47 0.09 0.00 -0.01 0.00 0.00 57.00 57.69 2dvt n GLN 65 Cb 0.42 -1.84 0.27 0.00 0.00 0.00 0.00 30.24 29.10 2dvt n GLN 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2dvt n ALA 66 N -1.73 2.54 -3.39 -1.58 0.00 -0.53 -1.71 120.51 114.12 2dvt n ALA 66 Ca 0.01 -1.42 -0.44 0.00 0.00 0.00 0.00 53.44 51.59 2dvt n ALA 66 Cb 0.15 -0.76 -0.06 0.00 0.00 0.00 0.00 19.45 18.78 2dvt n ALA 66 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2dvt s ILE 67 N -1.38 4.89 0.34 0.00 1.01 -0.89 -4.95 121.20 120.21 2dvt s ILE 67 Ca 0.40 -1.62 0.03 0.00 0.00 0.00 0.00 60.65 59.46 2dvt s ILE 67 Cb 0.24 -4.16 0.28 0.00 0.01 0.00 0.00 42.46 38.83 2dvt s ILE 67 CO 0.23 -0.84 1.95 -0.65 0.00 0.00 0.00 174.94 175.63 2dvt h PRO 68 N 8.71 0.87 -6.21 2.79 0.11 -1.88 -3.42 132.00 132.97 2dvt h PRO 68 Ca -0.26 -0.05 -0.57 0.00 0.11 0.00 0.00 66.00 65.22 2dvt h PRO 68 Cb 1.09 -0.20 -0.06 0.00 0.11 0.00 0.00 31.00 31.95 2dvt h PRO 68 CO 0.97 0.57 0.87 0.34 -0.21 0.00 0.00 178.00 180.54 2dvt s ASP 69 N -6.20 6.94 0.16 -2.05 -1.08 -1.26 -1.46 116.67 111.73 2dvt s ASP 69 Ca -0.10 1.32 -0.17 0.00 -0.52 0.00 0.00 52.55 53.07 2dvt s ASP 69 Cb 0.19 -2.54 0.09 0.00 -1.46 0.00 0.00 42.92 39.20 2dvt s ASP 69 CO 0.78 -0.82 1.67 0.03 0.52 0.00 0.00 175.17 177.35 2dvt h ARG 70 N 8.12 -0.01 -0.21 4.34 3.08 -1.93 0.73 114.38 128.50 2dvt h ARG 70 Ca -0.22 0.00 0.04 0.00 0.07 0.00 0.00 59.98 59.87 2dvt h ARG 70 Cb 1.08 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.09 2dvt h ARG 70 CO 1.00 -0.00 -0.02 0.00 -1.07 0.00 0.00 179.97 179.88 2dvt h ARG 71 N -0.01 0.04 -0.74 0.04 3.08 -1.96 -0.60 114.38 114.23 2dvt h ARG 71 Ca 0.19 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.20 2dvt h ARG 71 Cb 0.29 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 2dvt h ARG 71 CO -0.40 0.03 0.33 -0.22 -1.07 0.00 0.00 179.97 178.64 2dvt h LYS 72 N 0.04 1.08 -0.43 0.04 1.63 -1.84 -1.67 116.57 115.43 2dvt h LYS 72 Ca 0.10 -0.17 -0.00 0.00 -0.85 0.00 0.00 60.65 59.72 2dvt h LYS 72 Cb 0.14 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 31.56 2dvt h LYS 72 CO -0.19 0.86 0.26 0.00 -3.45 0.00 0.00 179.45 176.94 2dvt h ALA 73 N 1.17 0.55 -0.84 5.00 0.00 -0.40 -0.72 119.26 124.00 2dvt h ALA 73 Ca 0.25 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 2dvt h ALA 73 Cb 0.16 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 2dvt h ALA 73 CO -0.03 0.04 0.43 0.82 0.00 0.00 0.00 179.25 180.51 2dvt h ILE 74 N 0.57 1.25 -0.14 0.00 2.04 -0.87 -1.28 117.51 119.07 2dvt h ILE 74 Ca 0.15 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.32 2dvt h ILE 74 Cb 0.00 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.23 2dvt h ILE 74 CO -0.03 0.30 0.03 -0.08 0.00 0.00 0.00 178.15 178.37 2dvt h GLU 75 N 1.19 0.23 -0.61 2.37 4.81 -0.82 -2.02 114.58 119.73 2dvt h GLU 75 Ca 0.29 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.37 2dvt h GLU 75 Cb 0.08 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 2dvt h GLU 75 CO -0.04 0.40 0.02 0.82 -0.73 0.00 0.00 179.01 179.48 2dvt h ILE 76 N 0.03 1.26 -0.20 2.32 1.08 -1.00 -1.45 117.51 119.56 2dvt h ILE 76 Ca 0.04 -1.12 -0.00 0.00 -0.39 0.00 0.00 64.86 63.39 2dvt h ILE 76 Cb 0.28 0.77 -0.01 0.00 -3.07 0.00 0.00 36.82 34.79 2dvt h ILE 76 CO 0.00 0.41 0.10 0.00 -0.69 0.00 0.00 178.15 177.98 2dvt h ALA 77 N 1.04 0.25 -0.73 1.87 0.00 -1.20 0.73 119.26 121.23 2dvt h ALA 77 Ca 0.18 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2dvt h ALA 77 Cb 0.53 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2dvt h ALA 77 CO 0.03 -0.21 0.41 0.00 0.00 0.00 0.00 179.25 179.48 2dvt h ARG 78 N 0.21 1.00 -0.24 0.00 3.08 -1.23 0.12 114.38 117.33 2dvt h ARG 78 Ca 0.07 -0.11 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 2dvt h ARG 78 Cb 0.08 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 2dvt h ARG 78 CO -0.01 0.74 0.04 -0.09 -1.07 0.00 0.00 179.97 179.58 2dvt h ARG 79 N 1.00 0.39 -0.78 0.04 2.43 -1.03 0.06 114.38 116.49 2dvt h ARG 79 Ca 0.26 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.31 2dvt h ARG 79 Cb 0.02 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.48 2dvt h ARG 79 CO -0.04 0.52 0.45 0.00 -1.51 0.00 0.00 179.97 179.38 2dvt h ALA 80 N 0.85 1.33 -0.17 2.80 0.00 -0.60 -0.70 119.26 122.77 2dvt h ALA 80 Ca 0.07 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 54.71 2dvt h ALA 80 Cb 0.32 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2dvt h ALA 80 CO 0.00 0.57 -0.59 -0.91 0.00 0.00 0.00 179.25 178.32 2dvt h ASN 81 N 1.07 0.64 -0.51 0.00 2.35 -0.74 -1.61 115.58 116.78 2dvt h ASN 81 Ca 0.28 -0.36 -0.11 0.00 -0.55 0.00 0.00 56.30 55.56 2dvt h ASN 81 Cb -0.01 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 2dvt h ASN 81 CO -0.05 1.08 -0.10 0.44 -1.65 0.00 0.00 177.43 177.15 2dvt h ASP 82 N 0.43 0.97 -0.41 5.81 3.32 -0.49 -1.16 116.42 124.88 2dvt h ASP 82 Ca -0.00 -0.35 -0.03 0.00 0.02 0.00 0.00 57.03 56.67 2dvt h ASP 82 Cb 1.15 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 40.42 2dvt h ASP 82 CO 0.11 1.10 0.15 0.58 -1.72 0.00 0.00 179.24 179.46 2dvt h VAL 83 N 0.83 1.21 -0.88 -1.35 2.07 -1.09 -1.61 116.25 115.43 2dvt h VAL 83 Ca 0.13 -0.66 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 2dvt h VAL 83 Cb 0.66 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 2dvt h VAL 83 CO 0.05 0.24 0.49 0.25 0.02 0.00 0.00 177.57 178.62 2dvt h LEU 84 N 0.52 1.08 -0.68 2.57 5.85 -1.13 -0.47 115.31 123.06 2dvt h LEU 84 Ca 0.14 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 2dvt h LEU 84 Cb 0.22 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 2dvt h LEU 84 CO -0.01 0.86 0.15 0.00 -0.34 0.00 0.00 178.44 179.10 2dvt h ALA 85 N 1.32 0.89 -0.49 1.25 0.00 -0.96 -0.94 119.26 120.33 2dvt h ALA 85 Ca 0.31 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2dvt h ALA 85 Cb 0.00 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2dvt h ALA 85 CO -0.05 0.62 0.19 1.05 0.00 0.00 0.00 179.25 181.06 2dvt h GLU 86 N 1.02 0.74 -0.62 0.00 -0.00 -0.58 -1.77 114.58 113.36 2dvt h GLU 86 Ca 0.21 -0.14 -0.10 0.00 -0.00 0.00 0.00 59.36 59.33 2dvt h GLU 86 Cb 0.39 -0.12 -0.02 0.00 -0.00 0.00 0.00 28.75 29.00 2dvt h GLU 86 CO 0.00 0.67 0.01 0.93 -0.00 0.00 0.00 179.01 180.62 2dvt h GLU 87 N 0.65 1.09 -0.52 1.06 4.39 -0.86 -2.96 114.58 117.43 2dvt h GLU 87 Ca 0.16 -0.34 -0.08 0.00 0.34 0.00 0.00 59.36 59.44 2dvt h GLU 87 Cb 0.21 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.74 2dvt h GLU 87 CO -0.01 1.05 -0.01 0.00 -1.16 0.00 0.00 179.01 178.88 2dvt h ALA 89 N 1.17 1.21 0.00 0.00 0.00 -1.16 -0.21 119.26 120.28 2dvt h ALA 89 Ca 0.15 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 2dvt h ALA 89 Cb 0.50 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2dvt h ALA 89 CO 0.02 0.03 -0.67 0.87 0.00 0.00 0.00 179.25 179.50 2dvt h LYS 90 N 0.00 0.00 -1.48 0.00 1.57 -1.37 -3.36 116.57 111.93 2dvt h LYS 90 Ca -0.00 0.00 -0.44 0.00 -1.87 0.00 0.00 60.65 58.34 2dvt h LYS 90 Cb 0.11 0.00 -0.33 0.00 0.08 0.00 0.00 32.23 32.09 2dvt h LYS 90 CO 0.00 0.67 -0.98 -2.13 -0.57 0.00 0.00 179.45 176.45 2dvt n ARG 91 N -3.65 0.87 0.25 3.15 3.00 -0.66 -4.98 116.66 114.64 2dvt n ARG 91 Ca -0.01 -2.92 0.16 0.00 -0.00 0.00 0.00 57.85 55.08 2dvt n ARG 91 Cb 0.68 -1.42 0.83 0.00 0.00 0.00 0.00 32.46 32.56 2dvt n ARG 91 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 2dvt h PRO 92 N 3.46 0.00 -0.00 -0.14 0.13 -1.24 -1.01 132.00 133.20 2dvt h PRO 92 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 2dvt h PRO 92 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 2dvt h PRO 92 CO 0.41 0.00 -0.21 -0.40 -0.23 0.00 0.00 178.00 177.57 2dvt n ASP 93 N -2.63 0.64 0.00 1.44 5.75 -1.26 -4.30 116.55 116.19 2dvt n ASP 93 Ca -0.02 -0.56 0.00 0.00 -0.01 0.00 0.00 54.79 54.19 2dvt n ASP 93 Cb 0.13 0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 2dvt n ASP 93 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2dvt n ARG 94 N -0.96 2.39 -5.10 0.11 5.12 -0.47 -4.82 116.66 112.93 2dvt n ARG 94 Ca 0.12 0.00 -0.32 0.00 -1.93 0.00 0.00 57.85 55.72 2dvt n ARG 94 Cb 0.31 -0.81 -0.15 0.00 -1.16 0.00 0.00 32.46 30.66 2dvt n ARG 94 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 2dvt s PHE 95 N -1.42 2.54 0.34 -1.55 2.99 -0.70 -0.77 117.98 119.41 2dvt s PHE 95 Ca 0.00 -0.51 0.05 0.00 0.00 0.00 0.00 56.93 56.47 2dvt s PHE 95 Cb 0.00 -1.62 -0.07 0.00 0.00 0.00 0.00 43.02 41.33 2dvt s PHE 95 CO 0.00 -0.07 0.04 -0.51 -0.00 0.00 0.00 175.22 174.68 2dvt s LEU 96 N -0.33 2.35 0.03 -0.37 1.43 -0.67 -4.68 118.68 116.44 2dvt s LEU 96 Ca 0.02 -1.37 0.01 0.00 -1.03 0.00 0.00 54.13 51.76 2dvt s LEU 96 Cb -0.13 -0.51 -0.02 0.00 0.03 0.00 0.00 46.19 45.56 2dvt s LEU 96 CO 0.02 -0.56 -0.05 0.00 0.23 0.00 0.00 176.35 175.99 2dvt s ALA 97 N -3.15 0.33 -0.10 4.21 0.00 -1.26 -1.03 121.76 120.76 2dvt s ALA 97 Ca 0.36 -0.60 -0.03 0.00 0.00 0.00 0.00 51.96 51.70 2dvt s ALA 97 Cb 0.09 0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.25 2dvt s ALA 97 CO 0.16 -0.07 0.01 -0.06 0.00 0.00 0.00 175.76 175.80 2dvt s PHE 98 N -1.22 3.17 0.35 0.00 2.99 -0.41 -1.22 117.98 121.63 2dvt s PHE 98 Ca -0.11 0.14 -0.23 0.00 0.00 0.00 0.00 56.93 56.73 2dvt s PHE 98 Cb -0.09 -1.84 -0.10 0.00 0.00 0.00 0.00 43.02 41.00 2dvt s PHE 98 CO -0.00 0.39 0.92 0.00 -0.00 0.00 0.00 175.22 176.53 2dvt s ALA 99 N -0.64 3.18 -0.10 5.36 0.00 0.38 -4.71 121.76 125.21 2dvt s ALA 99 Ca 0.10 0.43 -0.12 0.00 0.00 0.00 0.00 51.96 52.38 2dvt s ALA 99 Cb -0.12 -3.12 -0.05 0.00 0.00 0.00 0.00 23.12 19.84 2dvt s ALA 99 CO 0.02 0.18 0.27 0.00 0.00 0.00 0.00 175.76 176.23 2dvt s ALA 100 N -1.81 3.72 -0.02 0.00 0.00 -1.26 -1.67 121.76 120.71 2dvt s ALA 100 Ca 0.53 -0.46 0.05 0.00 0.00 0.00 0.00 51.96 52.09 2dvt s ALA 100 Cb -0.15 -2.25 -0.01 0.00 0.00 0.00 0.00 23.12 20.71 2dvt s ALA 100 CO 0.20 0.37 -0.17 -0.51 0.00 0.00 0.00 175.76 175.64 2dvt s LEU 101 N -0.44 1.99 -1.31 0.00 1.43 -1.26 -4.81 118.68 114.29 2dvt s LEU 101 Ca 0.18 -0.32 -0.10 0.00 -1.03 0.00 0.00 54.13 52.85 2dvt s LEU 101 Cb -0.14 -0.90 0.15 0.00 0.03 0.00 0.00 46.19 45.33 2dvt s LEU 101 CO 0.06 0.19 1.93 -0.81 0.23 0.00 0.00 176.35 177.96 2dvt n PRO 102 N 2.81 3.50 0.00 1.29 -0.04 -1.26 -4.71 135.00 136.58 2dvt n PRO 102 Ca -0.16 -3.38 0.05 0.00 -0.04 0.00 0.00 63.50 59.98 2dvt n PRO 102 Cb 0.54 -2.98 0.32 0.00 -0.04 0.00 0.00 33.50 31.33 2dvt n PRO 102 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2dvt n LEU 103 N 4.23 0.00 0.00 1.53 4.77 -1.26 -1.78 117.00 124.49 2dvt n LEU 103 Ca 0.42 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.54 2dvt n LEU 103 Cb 0.37 0.00 0.69 0.00 -2.33 0.00 0.00 43.42 42.15 2dvt n LEU 103 CO 0.83 0.00 0.99 0.00 -1.33 0.00 0.00 177.39 177.88 2dvt n GLN 104 N -0.82 0.27 -3.60 3.23 0.00 -1.26 -4.00 117.38 111.19 2dvt n GLN 104 Ca 0.08 0.01 -0.29 0.00 0.00 0.00 0.00 57.00 56.80 2dvt n GLN 104 Cb 0.04 -1.50 -0.12 0.00 0.00 0.00 0.00 30.24 28.65 2dvt n GLN 104 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2dvt s ASP 105 N -2.73 3.22 0.20 2.61 -1.08 -0.73 -4.95 116.67 113.21 2dvt s ASP 105 Ca 0.23 -2.61 -0.21 0.00 -0.52 0.00 0.00 52.55 49.44 2dvt s ASP 105 Cb 0.19 -0.79 0.15 0.00 -1.46 0.00 0.00 42.92 41.02 2dvt s ASP 105 CO 0.47 -0.26 1.56 -0.65 0.52 0.00 0.00 175.17 176.81 2dvt h PRO 106 N 6.61 -0.07 -0.71 4.34 0.11 -1.77 -0.09 132.00 140.43 2dvt h PRO 106 Ca 0.06 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.19 2dvt h PRO 106 Cb 0.93 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.01 2dvt h PRO 106 CO 0.41 -0.05 0.45 -0.44 -0.21 0.00 0.00 178.00 178.17 2dvt h ASP 107 N -0.07 0.75 -0.56 -2.05 3.32 -1.92 -0.37 116.42 115.51 2dvt h ASP 107 Ca 0.28 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.23 2dvt h ASP 107 Cb 0.56 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 2dvt h ASP 107 CO -0.87 0.53 0.00 0.00 -1.72 0.00 0.00 179.24 177.18 2dvt h ALA 108 N 1.29 0.90 -0.67 3.45 0.00 -1.61 -1.51 119.26 121.10 2dvt h ALA 108 Ca 0.28 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2dvt h ALA 108 Cb -0.02 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2dvt h ALA 108 CO -0.09 0.65 0.16 0.00 0.00 0.00 0.00 179.25 179.97 2dvt h ALA 109 N 1.06 1.01 -0.49 0.00 0.00 -0.53 0.24 119.26 120.54 2dvt h ALA 109 Ca 0.17 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2dvt h ALA 109 Cb 0.53 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2dvt h ALA 109 CO 0.03 0.65 0.12 1.15 0.00 0.00 0.00 179.25 181.20 2dvt h THR 110 N 1.02 1.24 -0.44 0.00 2.02 -0.80 -1.33 112.91 114.62 2dvt h THR 110 Ca 0.21 -0.83 -0.03 0.00 0.77 0.00 0.00 66.41 66.53 2dvt h THR 110 Cb 0.36 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2dvt h THR 110 CO 0.00 0.30 0.14 -0.33 0.37 0.00 0.00 175.52 176.01 2dvt h GLU 111 N 0.68 0.67 -0.42 6.66 5.08 -0.87 -2.42 114.58 123.96 2dvt h GLU 111 Ca 0.16 -0.14 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 2dvt h GLU 111 Cb 0.32 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2dvt h GLU 111 CO 0.00 0.65 -0.04 1.49 -1.00 0.00 0.00 179.01 180.11 2dvt h GLU 112 N 0.56 0.71 -0.49 2.33 4.57 -0.80 -1.32 114.58 120.14 2dvt h GLU 112 Ca 0.14 -0.20 -0.06 0.00 -1.18 0.00 0.00 59.36 58.07 2dvt h GLU 112 Cb 0.25 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 2dvt h GLU 112 CO -0.01 0.75 0.09 1.25 -1.18 0.00 0.00 179.01 179.91 2dvt h LEU 113 N 0.66 0.77 -0.72 1.64 5.85 -1.10 -0.26 115.31 122.14 2dvt h LEU 113 Ca 0.13 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.59 2dvt h LEU 113 Cb 0.47 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 2dvt h LEU 113 CO 0.02 0.83 0.46 1.56 -0.34 0.00 0.00 178.44 180.98 2dvt h GLN 114 N 0.68 0.96 -0.16 1.25 4.20 -1.09 -0.06 115.11 120.89 2dvt h GLN 114 Ca 0.15 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 2dvt h GLN 114 Cb 0.38 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2dvt h GLN 114 CO 0.01 0.65 0.05 -0.09 -0.67 0.00 0.00 178.83 178.78 2dvt h ARG 115 N 0.98 0.24 -0.58 1.46 2.43 -0.95 0.11 114.38 118.08 2dvt h ARG 115 Ca 0.26 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.40 2dvt h ARG 115 Cb -0.09 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.40 2dvt h ARG 115 CO -0.05 0.36 0.37 0.00 -1.51 0.00 0.00 179.97 179.14 2dvt h VAL 117 N 0.74 0.92 -0.14 0.00 2.07 -0.92 0.90 116.25 119.83 2dvt h VAL 117 Ca 0.22 -1.25 -0.23 0.00 0.82 0.00 0.00 66.70 66.26 2dvt h VAL 117 Cb -0.04 1.58 0.01 0.00 -1.52 0.00 0.00 31.29 31.32 2dvt h VAL 117 CO -0.07 0.25 -0.81 0.78 0.02 0.00 0.00 177.57 177.74 2dvt h ASN 118 N -0.87 0.94 0.09 0.57 2.35 -0.82 -2.89 115.58 114.96 2dvt h ASN 118 Ca -0.02 -0.63 -0.36 0.00 -0.55 0.00 0.00 56.30 54.74 2dvt h ASN 118 Cb 0.54 -0.28 -0.06 0.00 0.05 0.00 0.00 38.32 38.57 2dvt h ASN 118 CO 0.03 1.43 -2.27 0.47 -1.65 0.00 0.00 177.43 175.44 2dvt n ASP 119 N -3.92 0.93 -0.20 5.81 8.00 0.35 -4.54 116.55 122.98 2dvt n ASP 119 Ca -0.08 0.05 0.10 0.00 0.71 0.00 0.00 54.79 55.57 2dvt n ASP 119 Cb 0.76 0.23 -0.07 0.00 -0.02 0.00 0.00 41.12 42.02 2dvt n ASP 119 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2dvt n LEU 120 N -3.02 1.40 -0.66 0.64 4.77 -0.83 -4.99 117.00 114.31 2dvt n LEU 120 Ca -0.34 -0.61 -0.08 0.00 -0.03 0.00 0.00 56.01 54.95 2dvt n LEU 120 Cb 1.08 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 42.14 2dvt n LEU 120 CO 0.38 0.30 -0.08 0.61 -1.33 0.00 0.00 177.39 177.27 2dvt n GLY 121 N 1.45 0.94 3.75 -0.72 0.00 -0.24 -4.95 105.19 105.41 2dvt n GLY 121 Ca 0.06 -0.66 -0.35 0.00 0.00 0.00 0.00 46.02 45.07 2dvt n GLY 121 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dvt s PHE 122 N -2.32 2.30 -1.80 1.61 2.99 0.15 -4.80 117.98 116.11 2dvt s PHE 122 Ca 0.00 1.53 0.19 0.00 0.00 0.00 0.00 56.93 58.65 2dvt s PHE 122 Cb 0.00 -3.48 0.44 0.00 0.00 0.00 0.00 43.02 39.98 2dvt s PHE 122 CO 0.00 -2.34 1.36 1.33 -0.00 0.00 0.00 175.22 175.57 2dvt n VAL 123 N -1.93 0.76 -3.53 -0.44 0.24 -0.36 -4.46 118.33 108.61 2dvt n VAL 123 Ca 0.14 -0.88 0.00 0.00 -2.04 0.00 0.00 64.34 61.56 2dvt n VAL 123 Cb 0.50 0.72 0.00 0.00 -1.47 0.00 0.00 33.84 33.59 2dvt n VAL 123 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dvt n GLY 124 N 1.21 -1.21 3.08 7.63 0.00 -1.25 -4.04 105.19 110.62 2dvt n GLY 124 Ca 0.18 -1.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.04 2dvt n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dvt s ALA 125 N -1.00 0.76 -0.10 4.61 0.00 -0.68 -0.47 121.76 124.87 2dvt s ALA 125 Ca 0.00 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.23 2dvt s ALA 125 Cb 0.00 -0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.10 2dvt s ALA 125 CO 0.00 0.07 -0.10 -1.17 0.00 0.00 0.00 175.76 174.56 2dvt s LEU 126 N -1.33 1.44 -0.05 0.00 0.20 -0.67 0.14 118.68 118.41 2dvt s LEU 126 Ca -0.05 -0.33 0.04 0.00 0.69 0.00 0.00 54.13 54.48 2dvt s LEU 126 Cb -0.09 -0.89 0.00 0.00 -0.43 0.00 0.00 46.19 44.79 2dvt s LEU 126 CO 0.01 -0.05 -0.16 -0.69 -0.29 0.00 0.00 176.35 175.17 2dvt s VAL 127 N 1.26 1.37 -1.36 1.68 1.01 -0.58 -4.51 120.40 119.27 2dvt s VAL 127 Ca -0.03 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.18 2dvt s VAL 127 Cb -0.14 -1.20 0.11 0.00 0.00 0.00 0.00 36.38 35.16 2dvt s VAL 127 CO -0.04 0.40 2.04 0.59 0.00 0.00 0.00 175.10 178.09 2dvt n ASN 128 N 3.37 4.66 0.00 3.32 3.02 -1.26 -0.82 115.26 127.55 2dvt n ASN 128 Ca -0.20 -3.00 0.00 0.00 -0.03 0.00 0.00 54.58 51.36 2dvt n ASN 128 Cb 0.53 -1.55 0.00 0.00 -0.61 0.00 0.00 39.78 38.15 2dvt n ASN 128 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dvt n GLY 129 N 3.31 0.45 3.64 7.41 0.00 -0.20 -4.45 105.19 115.36 2dvt n GLY 129 Ca 0.45 -0.86 -0.33 0.00 0.00 0.00 0.00 46.02 45.28 2dvt n GLY 129 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2dvt n PHE 130 N 0.00 0.75 -4.03 1.61 1.16 -1.26 -5.00 117.46 110.69 2dvt n PHE 130 Ca 0.00 0.38 -0.23 0.00 -1.87 0.00 0.00 57.45 55.74 2dvt n PHE 130 Cb 0.00 -2.04 -0.03 0.00 -1.61 0.00 0.00 39.48 35.79 2dvt n PHE 130 CO 0.00 0.00 0.00 -1.12 -1.87 0.00 0.00 176.76 173.77 2dvt s SER 131 N -2.12 5.92 -0.01 5.98 0.01 -0.78 -4.82 113.70 117.89 2dvt s SER 131 Ca 0.70 -0.06 0.06 0.00 1.31 0.00 0.00 55.95 57.96 2dvt s SER 131 Cb -0.28 -1.64 -0.03 0.00 0.21 0.00 0.00 66.02 64.28 2dvt s SER 131 CO 0.54 -0.02 -0.19 -1.10 0.41 0.00 0.00 173.24 172.88 2dvt s GLN 132 N -3.69 2.23 -0.04 12.44 -0.21 -0.69 -1.33 119.66 128.36 2dvt s GLN 132 Ca 0.33 -0.87 -0.18 0.00 0.02 0.00 0.00 55.36 54.66 2dvt s GLN 132 Cb -0.09 -2.21 0.03 0.00 1.00 0.00 0.00 33.01 31.74 2dvt s GLN 132 CO 0.27 0.57 0.40 -2.00 -2.12 0.00 0.00 175.29 172.41 2dvt s GLU 133 N -0.97 0.72 7.70 2.91 -6.30 -1.26 -3.95 118.70 117.55 2dvt s GLU 133 Ca 0.12 0.01 0.00 0.00 -2.50 0.00 0.00 54.97 52.60 2dvt s GLU 133 Cb -0.10 0.33 0.00 0.00 0.00 0.00 0.00 34.13 34.36 2dvt s GLU 133 CO 0.02 -0.20 0.00 0.41 0.02 0.00 0.00 175.26 175.51 2dvt n GLY 134 N 1.42 3.18 0.03 -1.50 0.00 -0.54 -0.96 105.19 106.82 2dvt n GLY 134 Ca -0.20 -0.08 0.10 0.00 0.00 0.00 0.00 46.02 45.85 2dvt n GLY 134 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2dvt n ASP 135 N 9.32 0.18 -1.62 1.61 5.68 -1.26 -4.66 116.55 125.80 2dvt n ASP 135 Ca 0.00 0.53 -0.19 0.00 -0.50 0.00 0.00 54.79 54.64 2dvt n ASP 135 Cb 0.00 -0.58 -0.06 0.00 -1.14 0.00 0.00 41.12 39.34 2dvt n ASP 135 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2dvt n GLY 136 N 0.56 1.22 1.07 6.12 0.00 -0.13 -4.88 105.19 109.15 2dvt n GLY 136 Ca 0.04 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.06 2dvt n GLY 136 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dvt n GLN 137 N -2.55 2.37 -4.02 1.61 1.13 -1.26 -4.75 117.38 109.91 2dvt n GLN 137 Ca -0.20 -2.10 -0.25 0.00 -1.94 0.00 0.00 57.00 52.51 2dvt n GLN 137 Cb 0.63 -1.48 -0.17 0.00 0.11 0.00 0.00 30.24 29.33 2dvt n GLN 137 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2dvt s THR 138 N -1.39 0.92 0.01 5.09 2.01 -1.26 -5.08 115.64 115.94 2dvt s THR 138 Ca 0.39 -0.25 -0.30 0.00 0.31 0.00 0.00 61.69 61.84 2dvt s THR 138 Cb 0.22 -0.94 -0.05 0.00 0.01 0.00 0.00 72.50 71.73 2dvt s THR 138 CO 0.29 0.34 1.35 -2.16 -0.69 0.00 0.00 174.62 173.75 2dvt s PRO 139 N 1.51 4.31 -0.40 4.92 0.04 -1.26 -4.60 135.00 139.51 2dvt s PRO 139 Ca 0.00 1.91 -0.14 0.00 0.04 0.00 0.00 61.00 62.81 2dvt s PRO 139 Cb -0.13 -3.51 0.02 0.00 0.04 0.00 0.00 34.50 30.92 2dvt s PRO 139 CO -0.05 -0.51 0.28 -0.51 0.04 0.00 0.00 177.00 176.25 2dvt s LEU 140 N 2.09 5.03 0.22 -3.56 1.43 -0.44 -4.92 118.68 118.52 2dvt s LEU 140 Ca 0.62 -0.90 -0.10 0.00 -1.03 0.00 0.00 54.13 52.72 2dvt s LEU 140 Cb -0.31 -2.14 -0.07 0.00 0.03 0.00 0.00 46.19 43.71 2dvt s LEU 140 CO 0.26 -0.43 0.54 -0.31 0.23 0.00 0.00 176.35 176.64 2dvt s TYR 141 N 1.66 3.44 -2.00 0.29 1.51 -1.26 -1.87 117.35 119.12 2dvt s TYR 141 Ca 0.05 0.87 0.03 0.00 -1.01 0.00 0.00 57.07 57.01 2dvt s TYR 141 Cb -0.19 -2.25 0.20 0.00 -0.11 0.00 0.00 41.96 39.60 2dvt s TYR 141 CO 0.09 0.30 1.13 0.66 -1.11 0.00 0.00 175.55 176.62 2dvt n TYR 142 N -0.03 0.01 1.06 2.71 0.53 -1.26 -2.87 117.16 117.31 2dvt n TYR 142 Ca -0.00 -0.00 0.12 0.00 -1.02 0.00 0.00 57.90 56.99 2dvt n TYR 142 Cb 0.52 0.00 0.24 0.00 -1.03 0.00 0.00 39.34 39.07 2dvt n TYR 142 CO 0.00 0.00 0.00 -0.40 -1.02 0.00 0.00 176.86 175.44 2dvt n ASP 143 N -0.53 0.73 -4.75 7.72 5.75 -1.26 -4.77 116.55 119.43 2dvt n ASP 143 Ca 0.03 -0.53 -0.37 0.00 -0.01 0.00 0.00 54.79 53.91 2dvt n ASP 143 Cb 0.02 0.30 0.04 0.00 -1.03 0.00 0.00 41.12 40.44 2dvt n ASP 143 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2dvt s LEU 144 N -2.85 3.70 0.29 -2.12 1.43 -1.14 -4.93 118.68 113.07 2dvt s LEU 144 Ca 0.14 2.50 0.04 0.00 -1.03 0.00 0.00 54.13 55.79 2dvt s LEU 144 Cb 0.18 -4.52 0.73 0.00 0.03 0.00 0.00 46.19 42.61 2dvt s LEU 144 CO 0.67 -1.63 1.72 -0.65 0.23 0.00 0.00 176.35 176.69 2dvt h PRO 145 N 1.00 0.51 0.00 1.29 0.11 -1.92 -2.16 132.00 130.83 2dvt h PRO 145 Ca -0.51 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.57 2dvt h PRO 145 Cb 1.30 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2dvt h PRO 145 CO 0.55 0.34 0.00 -0.56 -0.21 0.00 0.00 178.00 178.12 2dvt h GLN 146 N 0.52 0.00 -0.02 1.05 -0.00 -1.96 -1.98 115.11 112.72 2dvt h GLN 146 Ca 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.21 2dvt h GLN 146 Cb 1.01 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.49 2dvt h GLN 146 CO -0.47 0.00 -0.16 0.66 -0.00 0.00 0.00 178.83 178.86 2dvt n TYR 147 N -2.38 0.00 -0.26 0.06 4.02 -0.81 -4.39 117.16 113.40 2dvt n TYR 147 Ca -0.01 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.83 2dvt n TYR 147 Cb 0.08 -0.02 0.06 0.00 -0.02 0.00 0.00 39.34 39.43 2dvt n TYR 147 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2dvt h ARG 148 N 2.86 0.98 -0.85 -0.72 2.47 -1.49 -1.17 114.38 116.47 2dvt h ARG 148 Ca 0.00 -0.08 0.01 0.00 -1.26 0.00 0.00 59.98 58.65 2dvt h ARG 148 Cb 0.71 -0.21 -0.04 0.00 -1.65 0.00 0.00 29.97 28.78 2dvt h ARG 148 CO 0.00 0.69 0.56 -1.35 0.56 0.00 0.00 179.97 180.43 2dvt h PRO 149 N 0.99 1.10 -0.11 0.04 0.11 -1.80 -0.85 132.00 131.49 2dvt h PRO 149 Ca 0.26 -0.07 0.02 0.00 0.11 0.00 0.00 66.00 66.33 2dvt h PRO 149 Cb -0.05 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 30.79 2dvt h PRO 149 CO -0.05 0.73 -0.03 0.35 -0.21 0.00 0.00 178.00 178.79 2dvt h PHE 150 N 1.14 -0.05 -0.33 0.65 3.57 -1.69 -1.83 116.94 118.39 2dvt h PHE 150 Ca 0.31 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.80 2dvt h PHE 150 Cb -0.12 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 2dvt h PHE 150 CO -0.01 -0.04 0.13 -1.49 -2.23 0.00 0.00 178.31 174.66 2dvt h TRP 151 N 0.00 0.45 -0.40 0.41 4.06 -0.75 -0.61 115.95 119.11 2dvt h TRP 151 Ca 0.05 -0.01 -0.06 0.00 2.06 0.00 0.00 58.89 60.93 2dvt h TRP 151 Cb 0.08 -0.14 -0.02 0.00 -1.00 0.00 0.00 29.16 28.07 2dvt h TRP 151 CO -0.15 0.37 -0.01 0.78 -3.56 0.00 0.00 178.44 175.86 2dvt h GLY 152 N 0.62 0.69 1.59 1.49 0.00 -0.53 -1.45 103.07 105.49 2dvt h GLY 152 Ca 0.12 -0.44 -0.20 0.00 0.00 0.00 0.00 47.33 46.81 2dvt h GLY 152 CO -0.01 0.41 -0.81 -2.09 0.00 0.00 0.00 176.54 174.04 2dvt h GLU 153 N 0.61 0.39 -0.48 4.80 4.57 -0.46 -1.25 114.58 122.76 2dvt h GLU 153 Ca 0.12 -0.35 -0.01 0.00 -1.18 0.00 0.00 59.36 57.94 2dvt h GLU 153 Cb 0.40 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.05 2dvt h GLU 153 CO 0.02 1.01 0.26 0.28 -1.18 0.00 0.00 179.01 179.39 2dvt h VAL 154 N 0.24 1.18 -0.61 0.32 2.07 -0.78 0.17 116.25 118.84 2dvt h VAL 154 Ca -0.05 -0.46 -0.08 0.00 0.82 0.00 0.00 66.70 66.92 2dvt h VAL 154 Cb 1.41 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 2dvt h VAL 154 CO 0.14 0.19 0.05 -0.08 0.02 0.00 0.00 177.57 177.88 2dvt h GLU 155 N 0.64 1.03 -0.13 1.57 4.81 -1.20 0.28 114.58 121.58 2dvt h GLU 155 Ca 0.17 -0.29 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 2dvt h GLU 155 Cb 0.07 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 2dvt h GLU 155 CO -0.03 0.98 0.05 0.87 -0.73 0.00 0.00 179.01 180.16 2dvt h LYS 156 N 0.96 0.20 0.00 1.92 1.57 -0.81 -2.13 116.57 118.27 2dvt h LYS 156 Ca 0.18 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 2dvt h LYS 156 Cb 0.49 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.76 2dvt h LYS 156 CO 0.02 0.29 -0.12 -0.07 -0.57 0.00 0.00 179.45 179.00 2dvt h LEU 157 N 0.06 0.00 -2.18 2.94 3.38 -0.86 -3.47 115.31 115.18 2dvt h LEU 157 Ca 0.04 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.68 2dvt h LEU 157 Cb 0.17 0.00 0.15 0.00 0.09 0.00 0.00 40.66 41.06 2dvt h LEU 157 CO -0.00 0.12 -0.84 -0.67 0.09 0.00 0.00 178.44 177.14 2dvt n ASP 158 N -3.41 -3.99 -4.23 -0.43 2.03 0.08 -5.04 116.55 101.56 2dvt n ASP 158 Ca -0.01 -0.75 -0.23 0.00 0.52 0.00 0.00 54.79 54.33 2dvt n ASP 158 Cb 0.29 -4.70 -0.13 0.00 -0.72 0.00 0.00 41.12 35.86 2dvt n ASP 158 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2dvt s VAL 159 N -3.45 1.48 0.71 5.18 -7.23 -1.20 -5.07 120.40 110.83 2dvt s VAL 159 Ca 0.23 -1.29 -0.13 0.00 -1.81 0.00 0.00 61.98 58.99 2dvt s VAL 159 Cb -0.04 -1.34 0.03 0.00 0.56 0.00 0.00 36.38 35.59 2dvt s VAL 159 CO 0.77 0.01 1.10 -2.84 -0.31 0.00 0.00 175.10 173.82 2dvt s PRO 160 N -1.50 2.56 -0.21 4.82 0.02 -1.26 -4.73 135.00 134.71 2dvt s PRO 160 Ca 0.04 1.25 0.02 0.00 0.02 0.00 0.00 61.00 62.33 2dvt s PRO 160 Cb -0.09 -1.93 0.03 0.00 0.02 0.00 0.00 34.50 32.53 2dvt s PRO 160 CO 0.03 -1.42 -0.17 0.12 -0.33 0.00 0.00 177.00 175.23 2dvt s PHE 161 N -2.67 2.91 -0.41 6.54 5.36 -0.48 -1.69 117.98 127.55 2dvt s PHE 161 Ca 0.63 -1.86 -0.19 0.00 -0.96 0.00 0.00 56.93 54.56 2dvt s PHE 161 Cb -0.18 -1.90 0.01 0.00 -0.34 0.00 0.00 43.02 40.61 2dvt s PHE 161 CO 0.49 -0.83 0.54 -0.47 -1.46 0.00 0.00 175.22 173.50 2dvt s TYR 162 N 1.24 3.13 -0.72 10.12 6.04 0.12 -0.95 117.35 136.33 2dvt s TYR 162 Ca 0.00 -0.08 -0.21 0.00 0.04 0.00 0.00 57.07 56.82 2dvt s TYR 162 Cb -0.15 -3.08 0.09 0.00 -1.04 0.00 0.00 41.96 37.77 2dvt s TYR 162 CO -0.10 -0.72 0.98 -1.17 -1.54 0.00 0.00 175.55 173.00 2dvt s LEU 163 N 2.48 4.65 0.35 6.97 2.96 -0.41 -1.52 118.68 134.17 2dvt s LEU 163 Ca 0.18 -1.29 -0.04 0.00 -0.22 0.00 0.00 54.13 52.76 2dvt s LEU 163 Cb -0.15 -2.40 -0.04 0.00 0.50 0.00 0.00 46.19 44.09 2dvt s LEU 163 CO 0.16 -1.32 0.62 -2.28 -1.32 0.00 0.00 176.35 172.21 2dvt s HIS 164 N 3.59 3.50 0.84 5.38 5.65 -0.00 -4.52 115.29 129.72 2dvt s HIS 164 Ca 0.23 0.64 -0.12 0.00 0.25 0.00 0.00 55.06 56.06 2dvt s HIS 164 Cb -0.15 -2.12 0.09 0.00 -1.18 0.00 0.00 32.58 29.23 2dvt s HIS 164 CO 0.05 0.04 1.12 -2.14 -0.65 0.00 0.00 174.74 173.16 2dvt s PRO 165 N -4.02 1.75 0.11 2.88 0.02 -1.26 -1.03 135.00 133.45 2dvt s PRO 165 Ca 0.44 0.47 -0.25 0.00 0.02 0.00 0.00 61.00 61.69 2dvt s PRO 165 Cb -0.10 -1.89 0.08 0.00 0.02 0.00 0.00 34.50 32.60 2dvt s PRO 165 CO 0.35 -1.81 0.67 -0.98 -0.33 0.00 0.00 177.00 174.89 2dvt s ARG 166 N -5.23 1.17 0.42 5.54 1.70 -1.26 -4.52 118.95 116.77 2dvt s ARG 166 Ca 0.62 -0.39 -0.15 0.00 -0.47 0.00 0.00 55.73 55.33 2dvt s ARG 166 Cb -0.14 0.54 -0.08 0.00 -0.57 0.00 0.00 34.95 34.70 2dvt s ARG 166 CO 0.53 -0.50 0.85 -0.80 -1.08 0.00 0.00 175.30 174.30 2dvt s ASN 167 N -2.60 6.68 0.80 -2.89 0.01 -1.26 -4.60 114.94 111.08 2dvt s ASN 167 Ca 0.01 1.39 -0.11 0.00 -0.71 0.00 0.00 52.86 53.44 2dvt s ASN 167 Cb -0.01 -2.42 0.07 0.00 0.41 0.00 0.00 41.25 39.30 2dvt s ASN 167 CO -0.11 -0.40 1.09 -2.16 -1.51 0.00 0.00 177.10 174.01 2dvt s PRO 168 N -3.60 2.05 0.69 -0.60 0.04 -1.26 -5.00 135.00 127.32 2dvt s PRO 168 Ca 0.56 0.78 -0.14 0.00 0.04 0.00 0.00 61.00 62.24 2dvt s PRO 168 Cb -0.10 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.56 2dvt s PRO 168 CO 0.25 -1.68 1.13 -0.51 0.04 0.00 0.00 177.00 176.23 2dvt s LEU 169 N -5.85 3.32 0.25 -3.56 1.43 -1.26 -4.83 118.68 108.17 2dvt s LEU 169 Ca 0.61 2.06 -0.04 0.00 -1.03 0.00 0.00 54.13 55.73 2dvt s LEU 169 Cb -0.15 -4.56 0.48 0.00 0.03 0.00 0.00 46.19 41.99 2dvt s LEU 169 CO 0.55 -1.85 1.70 -0.65 0.23 0.00 0.00 176.35 176.33 2dvt h PRO 170 N -0.22 0.33 0.00 1.29 0.11 -1.96 0.53 132.00 132.07 2dvt h PRO 170 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2dvt h PRO 170 Cb 1.26 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2dvt h PRO 170 CO 0.52 0.22 0.00 -0.56 -0.21 0.00 0.00 178.00 177.97 2dvt h GLN 171 N 0.34 0.00 -0.37 1.05 -0.00 -1.98 -1.07 115.11 113.07 2dvt h GLN 171 Ca 0.43 0.00 -0.09 0.00 -0.00 0.00 0.00 58.65 58.98 2dvt h GLN 171 Cb 0.71 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 28.14 2dvt h GLN 171 CO -0.48 0.00 0.03 -0.25 -0.00 0.00 0.00 178.83 178.14 2dvt n ASP 172 N -2.68 3.63 -0.17 0.06 8.00 0.15 -4.50 116.55 121.03 2dvt n ASP 172 Ca -0.01 -3.27 0.04 0.00 0.71 0.00 0.00 54.79 52.25 2dvt n ASP 172 Cb 0.15 -0.61 0.05 0.00 -0.02 0.00 0.00 41.12 40.69 2dvt n ASP 172 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2dvt n SER 173 N -0.65 1.23 0.01 -2.24 7.64 -0.41 -4.74 113.62 114.47 2dvt n SER 173 Ca 0.28 -2.24 0.18 0.00 1.01 0.00 0.00 58.87 58.10 2dvt n SER 173 Cb 1.02 -0.21 0.66 0.00 -1.01 0.00 0.00 64.21 64.67 2dvt n SER 173 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2dvt h ARG 174 N 0.00 0.05 0.00 1.43 3.08 -1.79 0.42 114.38 117.57 2dvt h ARG 174 Ca 0.00 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 2dvt h ARG 174 Cb 1.02 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.06 2dvt h ARG 174 CO 0.00 0.03 -0.00 0.97 -1.07 0.00 0.00 179.97 179.90 2dvt h ILE 175 N 0.05 0.00 -0.34 2.04 2.10 -1.95 -0.48 117.51 118.93 2dvt h ILE 175 Ca 0.23 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 66.06 2dvt h ILE 175 Cb 0.86 1.12 0.00 0.00 -1.09 0.00 0.00 36.82 37.71 2dvt h ILE 175 CO -0.01 0.00 0.00 -1.22 -1.08 0.00 0.00 178.15 175.84 2dvt n TYR 176 N -3.08 0.44 -1.69 2.19 4.02 0.13 -4.95 117.16 114.22 2dvt n TYR 176 Ca -0.02 -0.23 -0.44 0.00 -0.01 0.00 0.00 57.90 57.20 2dvt n TYR 176 Cb 0.12 -0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.41 2dvt n TYR 176 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2dvt n ASP 177 N 1.40 3.81 0.00 7.72 2.03 -0.19 -0.50 116.55 130.82 2dvt n ASP 177 Ca 0.18 1.02 0.00 0.00 0.52 0.00 0.00 54.79 56.51 2dvt n ASP 177 Cb 0.58 -1.51 0.00 0.00 -0.72 0.00 0.00 41.12 39.47 2dvt n ASP 177 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dvt n GLY 178 N 4.04 1.25 2.41 0.27 0.00 -1.26 -4.94 105.19 106.97 2dvt n GLY 178 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 2dvt n GLY 178 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dvt n HIS 179 N -2.00 1.68 0.33 1.61 8.25 0.35 -4.93 115.22 120.52 2dvt n HIS 179 Ca 0.00 -3.87 0.22 0.00 -0.26 0.00 0.00 57.72 53.81 2dvt n HIS 179 Cb 0.00 -0.45 1.17 0.00 1.12 0.00 0.00 29.99 31.83 2dvt n HIS 179 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2dvt h PRO 180 N 3.50 0.00 0.00 -0.41 0.13 -1.93 -0.84 132.00 132.46 2dvt h PRO 180 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2dvt h PRO 180 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 2dvt h PRO 180 CO 0.64 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.74 2dvt n TRP 181 N -3.15 0.00 0.80 1.56 2.14 -1.26 -2.28 117.44 115.25 2dvt n TRP 181 Ca -0.03 0.00 0.11 0.00 2.07 0.00 0.00 57.50 59.65 2dvt n TRP 181 Cb 0.10 -0.37 0.02 0.00 -0.81 0.00 0.00 31.31 30.25 2dvt n TRP 181 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 2dvt n LEU 182 N -1.37 0.69 -4.82 5.67 4.77 -0.32 -4.71 117.00 116.90 2dvt n LEU 182 Ca 0.07 -0.18 -0.29 0.00 -0.03 0.00 0.00 56.01 55.59 2dvt n LEU 182 Cb 0.18 -0.10 0.12 0.00 -2.33 0.00 0.00 43.42 41.29 2dvt n LEU 182 CO 0.16 0.13 0.74 -0.76 -1.33 0.00 0.00 177.39 176.33 2dvt s LEU 183 N -3.40 2.21 0.00 2.23 1.43 -0.97 -1.36 118.68 118.82 2dvt s LEU 183 Ca 0.06 0.93 0.00 0.00 -1.03 0.00 0.00 54.13 54.09 2dvt s LEU 183 Cb 0.16 -3.33 0.00 0.00 0.03 0.00 0.00 46.19 43.05 2dvt s LEU 183 CO 0.80 -2.30 0.00 0.61 0.23 0.00 0.00 176.35 175.69 2dvt n GLY 184 N -2.56 0.16 0.32 -3.19 0.00 -1.26 -3.75 105.19 94.92 2dvt n GLY 184 Ca 0.07 -0.91 0.19 0.00 0.00 0.00 0.00 46.02 45.36 2dvt n GLY 184 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dvt h PRO 185 N 0.00 0.00 -0.57 1.61 0.13 -1.96 -0.92 132.00 130.29 2dvt h PRO 185 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2dvt h PRO 185 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 2dvt h PRO 185 CO 0.00 0.00 0.37 1.15 -0.23 0.00 0.00 178.00 179.29 2dvt h THR 186 N 0.00 1.15 0.00 1.56 2.02 -1.81 -3.46 112.91 112.37 2dvt h THR 186 Ca 0.01 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.90 2dvt h THR 186 Cb 0.12 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 2dvt h THR 186 CO -0.00 0.15 0.00 1.87 0.37 0.00 0.00 175.52 177.91 2dvt n TRP 187 N -4.68 -2.60 -0.33 3.16 -0.00 -1.10 -4.99 117.44 106.90 2dvt n TRP 187 Ca 0.04 0.08 0.15 0.00 -0.00 0.00 0.00 57.50 57.77 2dvt n TRP 187 Cb 0.03 0.68 0.35 0.00 -0.00 0.00 0.00 31.31 32.36 2dvt n TRP 187 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2dvt h ALA 188 N 0.00 1.66 -0.58 5.87 0.00 -1.11 -1.17 119.26 123.93 2dvt h ALA 188 Ca 0.00 0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.10 2dvt h ALA 188 Cb 0.00 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 2dvt h ALA 188 CO 0.00 -0.26 0.28 0.74 0.00 0.00 0.00 179.25 180.01 2dvt h PHE 189 N 0.55 0.51 -0.11 0.00 0.05 -1.42 -1.80 116.94 114.72 2dvt h PHE 189 Ca 0.61 0.02 -0.01 0.00 3.82 0.00 0.00 57.97 62.41 2dvt h PHE 189 Cb 1.12 -0.14 -0.00 0.00 2.00 0.00 0.00 35.95 38.92 2dvt h PHE 189 CO -0.04 0.22 0.02 0.00 -0.18 0.00 0.00 178.31 178.32 2dvt h ALA 190 N 1.34 0.14 -0.24 2.45 0.00 -1.46 -2.18 119.26 119.30 2dvt h ALA 190 Ca 0.27 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.05 2dvt h ALA 190 Cb 0.22 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2dvt h ALA 190 CO -0.21 -0.21 0.10 0.37 0.00 0.00 0.00 179.25 179.30 2dvt h GLN 191 N -0.05 0.22 -0.67 0.00 5.75 -1.36 0.23 115.11 119.22 2dvt h GLN 191 Ca 0.03 -0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.55 2dvt h GLN 191 Cb 0.28 -0.05 -0.05 0.00 1.07 0.00 0.00 27.48 28.74 2dvt h GLN 191 CO 0.00 0.15 0.41 1.49 -2.65 0.00 0.00 178.83 178.23 2dvt h GLU 192 N 0.23 0.77 0.09 1.69 4.57 -1.32 -2.20 114.58 118.41 2dvt h GLU 192 Ca 0.10 -0.05 -0.29 0.00 -1.18 0.00 0.00 59.36 57.95 2dvt h GLU 192 Cb 0.05 -0.17 0.03 0.00 -0.16 0.00 0.00 28.75 28.49 2dvt h GLU 192 CO -0.09 0.51 -1.18 1.15 -1.18 0.00 0.00 179.01 178.22 2dvt h THR 193 N 0.79 1.30 -0.13 0.32 2.02 -1.12 -2.76 112.91 113.33 2dvt h THR 193 Ca 0.28 -2.44 0.01 0.00 0.77 0.00 0.00 66.41 65.03 2dvt h THR 193 Cb 0.06 2.61 -0.01 0.00 -1.74 0.00 0.00 68.15 69.07 2dvt h THR 193 CO -0.12 0.74 0.06 0.00 0.37 0.00 0.00 175.52 176.57 2dvt h ALA 194 N 0.36 0.15 -0.52 6.16 0.00 -0.46 -1.12 119.26 123.83 2dvt h ALA 194 Ca -0.17 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 2dvt h ALA 194 Cb 1.85 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.60 2dvt h ALA 194 CO 0.23 -0.38 -0.04 0.28 0.00 0.00 0.00 179.25 179.33 2dvt h VAL 195 N 0.13 1.26 -0.75 0.00 2.07 -1.49 -1.00 116.25 116.47 2dvt h VAL 195 Ca 0.05 -1.13 0.01 0.00 0.82 0.00 0.00 66.70 66.46 2dvt h VAL 195 Cb 0.01 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 2dvt h VAL 195 CO -0.04 0.40 0.49 -0.74 0.02 0.00 0.00 177.57 177.70 2dvt h HIS 196 N 0.83 0.93 -0.42 1.57 6.17 -1.25 0.17 115.15 123.15 2dvt h HIS 196 Ca 0.15 0.02 -0.00 0.00 0.71 0.00 0.00 60.37 61.25 2dvt h HIS 196 Cb 0.55 -0.31 -0.02 0.00 2.52 0.00 0.00 27.41 30.14 2dvt h HIS 196 CO 0.03 0.58 0.25 0.00 0.71 0.00 0.00 177.93 179.50 2dvt h ALA 197 N 1.28 0.54 -0.40 5.26 0.00 -0.74 -2.00 119.26 123.19 2dvt h ALA 197 Ca 0.28 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 2dvt h ALA 197 Cb -0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2dvt h ALA 197 CO -0.07 0.04 0.09 -0.07 0.00 0.00 0.00 179.25 179.24 2dvt h LEU 198 N 0.56 0.55 -0.74 0.00 3.38 -0.42 -1.99 115.31 116.64 2dvt h LEU 198 Ca 0.15 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 2dvt h LEU 198 Cb 0.01 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 2dvt h LEU 198 CO -0.03 0.56 0.33 0.03 0.09 0.00 0.00 178.44 179.41 2dvt h ARG 199 N 0.58 1.09 -0.37 1.13 3.08 -0.11 0.67 114.38 120.46 2dvt h ARG 199 Ca 0.13 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 2dvt h ARG 199 Cb 0.24 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 2dvt h ARG 199 CO -0.00 0.88 0.18 -0.07 -1.07 0.00 0.00 179.97 179.88 2dvt h LEU 200 N 1.06 0.48 0.04 3.04 3.38 -0.78 -1.81 115.31 120.71 2dvt h LEU 200 Ca 0.25 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 2dvt h LEU 200 Cb 0.17 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2dvt h LEU 200 CO -0.03 0.47 -0.02 0.24 0.09 0.00 0.00 178.44 179.19 2dvt h MET 201 N 0.46 -0.06 0.00 1.13 2.86 -1.03 -3.09 114.93 115.20 2dvt h MET 201 Ca 0.13 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.74 2dvt h MET 201 Cb 0.11 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.78 2dvt h MET 201 CO -0.02 0.10 -0.14 0.00 1.06 0.00 0.00 176.91 177.92 2dvt h ALA 202 N 0.74 1.77 0.00 6.32 0.00 -0.83 -2.71 119.26 124.54 2dvt h ALA 202 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2dvt h ALA 202 Cb 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2dvt h ALA 202 CO 0.01 0.17 0.00 0.66 0.00 0.00 0.00 179.25 180.09 2dvt h SER 203 N 0.00 0.00 0.00 0.00 4.64 -1.24 -1.94 113.55 115.01 2dvt h SER 203 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2dvt h SER 203 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2dvt h SER 203 CO 0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 2dvt n GLY 204 N -0.30 0.76 0.32 -0.77 0.00 -1.02 -4.41 105.19 99.76 2dvt n GLY 204 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.12 2dvt n GLY 204 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2dvt h LEU 205 N 0.00 0.61 0.00 0.99 5.85 -1.77 -0.45 115.31 120.54 2dvt h LEU 205 Ca 0.00 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.81 2dvt h LEU 205 Cb 0.00 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.02 2dvt h LEU 205 CO 0.00 0.24 0.00 0.49 -0.34 0.00 0.00 178.44 178.83 2dvt n PHE 206 N -4.84 0.00 0.12 1.25 3.01 -1.26 -0.72 117.46 115.02 2dvt n PHE 206 Ca 0.19 0.00 -0.24 0.00 1.01 0.00 0.00 57.45 58.41 2dvt n PHE 206 Cb 0.48 -0.33 -0.16 0.00 -0.01 0.00 0.00 39.48 39.46 2dvt n PHE 206 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 2dvt h ASP 207 N 0.00 0.75 0.20 4.37 3.32 -1.47 -2.72 116.42 120.87 2dvt h ASP 207 Ca 0.00 -0.93 -0.21 0.00 0.02 0.00 0.00 57.03 55.92 2dvt h ASP 207 Cb 0.32 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.63 2dvt h ASP 207 CO 0.00 1.72 -0.81 -0.33 -1.72 0.00 0.00 179.24 178.10 2dvt h GLU 208 N 0.09 0.49 -2.38 3.56 5.08 -1.19 -3.38 114.58 116.85 2dvt h GLU 208 Ca -0.28 -0.44 -0.59 0.00 -1.00 0.00 0.00 59.36 57.06 2dvt h GLU 208 Cb 2.11 0.10 -0.39 0.00 0.50 0.00 0.00 28.75 31.07 2dvt h GLU 208 CO 0.24 1.07 -0.90 0.72 -1.00 0.00 0.00 179.01 179.14 2dvt n HIS 209 N -3.83 0.44 0.29 4.33 8.25 0.10 -4.98 115.22 119.82 2dvt n HIS 209 Ca -0.06 -3.64 0.12 0.00 -0.26 0.00 0.00 57.72 53.88 2dvt n HIS 209 Cb 0.76 -0.14 0.54 0.00 1.12 0.00 0.00 29.99 32.26 2dvt n HIS 209 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2dvt n PRO 210 N 2.10 0.17 -0.01 -0.41 -0.04 -1.02 -2.79 135.00 132.99 2dvt n PRO 210 Ca 0.26 0.53 0.14 0.00 -0.04 0.00 0.00 63.50 64.38 2dvt n PRO 210 Cb 0.46 -1.92 0.48 0.00 -0.04 0.00 0.00 33.50 32.48 2dvt n PRO 210 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2dvt n ARG 211 N -2.25 1.73 -2.06 0.54 1.74 -1.26 -4.91 116.66 110.18 2dvt n ARG 211 Ca 0.00 -1.06 -0.38 0.00 -0.77 0.00 0.00 57.85 55.64 2dvt n ARG 211 Cb 0.14 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 2dvt n ARG 211 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2dvt s LEU 212 N -1.95 4.08 -0.21 0.55 1.43 -1.12 -4.99 118.68 116.46 2dvt s LEU 212 Ca 0.37 2.57 0.01 0.00 -1.03 0.00 0.00 54.13 56.06 2dvt s LEU 212 Cb 0.21 -4.08 0.04 0.00 0.03 0.00 0.00 46.19 42.39 2dvt s LEU 212 CO 0.33 -1.02 -0.11 0.20 0.23 0.00 0.00 176.35 175.97 2dvt s ASN 213 N -0.97 3.66 -0.08 2.29 0.01 -1.26 -4.64 114.94 113.95 2dvt s ASN 213 Ca 0.62 -1.01 -0.01 0.00 -0.71 0.00 0.00 52.86 51.75 2dvt s ASN 213 Cb -0.36 -1.35 -0.03 0.00 0.41 0.00 0.00 41.25 39.93 2dvt s ASN 213 CO 0.44 -0.14 -0.02 -0.63 -1.51 0.00 0.00 177.10 175.24 2dvt s ILE 214 N 1.31 4.14 -0.05 0.60 -1.09 0.59 -1.38 121.20 125.31 2dvt s ILE 214 Ca -0.03 -0.31 0.05 0.00 -2.23 0.00 0.00 60.65 58.14 2dvt s ILE 214 Cb -0.17 -2.73 -0.02 0.00 -1.58 0.00 0.00 42.46 37.96 2dvt s ILE 214 CO -0.08 0.60 -0.22 -0.63 -1.23 0.00 0.00 174.94 173.39 2dvt s ILE 215 N -0.84 2.39 -0.00 2.92 1.01 -0.12 -1.20 121.20 125.36 2dvt s ILE 215 Ca 0.13 -0.96 0.06 0.00 0.00 0.00 0.00 60.65 59.88 2dvt s ILE 215 Cb -0.11 -1.89 -0.02 0.00 0.01 0.00 0.00 42.46 40.45 2dvt s ILE 215 CO 0.02 0.57 -0.20 -0.76 0.00 0.00 0.00 174.94 174.57 2dvt s LEU 216 N -0.36 2.06 0.00 2.97 1.43 -0.16 -1.28 118.68 123.34 2dvt s LEU 216 Ca 0.03 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 2dvt s LEU 216 Cb -0.12 -1.02 0.01 0.00 0.03 0.00 0.00 46.19 45.09 2dvt s LEU 216 CO 0.02 0.23 0.07 0.61 0.23 0.00 0.00 176.35 177.51 2dvt n GLY 217 N 2.45 1.28 3.96 -3.19 0.00 -1.26 -0.54 105.19 107.89 2dvt n GLY 217 Ca -0.15 -2.04 -0.31 0.00 0.00 0.00 0.00 46.02 43.52 2dvt n GLY 217 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dvt n HIS 218 N -1.32 -2.16 -3.81 1.61 8.25 -1.09 -1.67 115.22 115.04 2dvt n HIS 218 Ca 0.01 0.88 -0.28 0.00 -0.26 0.00 0.00 57.72 58.07 2dvt n HIS 218 Cb 0.05 -3.80 0.04 0.00 1.12 0.00 0.00 29.99 27.40 2dvt n HIS 218 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2dvt n MET 219 N -4.60 -6.31 -0.65 -0.41 0.00 0.65 -2.62 117.12 103.18 2dvt n MET 219 Ca 0.02 0.67 0.00 0.00 0.00 0.00 0.00 57.70 58.39 2dvt n MET 219 Cb 0.53 -5.61 0.00 0.00 0.00 0.00 0.00 33.22 28.14 2dvt n MET 219 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2dvt n GLY 220 N -1.79 0.65 2.88 3.03 0.00 -0.67 -4.19 105.19 105.10 2dvt n GLY 220 Ca 0.02 -0.20 -0.19 0.00 0.00 0.00 0.00 46.02 45.65 2dvt n GLY 220 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dvt n GLU 221 N -2.65 -3.21 0.00 1.61 -0.58 -1.08 -1.49 120.64 113.24 2dvt n GLU 221 Ca 0.00 0.68 0.00 0.00 -0.42 0.00 0.00 57.16 57.42 2dvt n GLU 221 Cb 0.00 -5.39 0.00 0.00 -0.57 0.00 0.00 31.44 25.48 2dvt n GLU 221 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2dvt n GLY 222 N -1.13 1.65 0.21 0.62 0.00 -1.26 -4.65 105.19 100.63 2dvt n GLY 222 Ca -0.11 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.88 2dvt n GLY 222 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dvt h LEU 223 N 0.00 0.27 -0.77 0.99 3.38 -1.53 -3.18 115.31 114.47 2dvt h LEU 223 Ca 0.00 0.05 0.15 0.00 0.09 0.00 0.00 57.88 58.17 2dvt h LEU 223 Cb 0.00 0.01 -0.10 0.00 0.09 0.00 0.00 40.66 40.66 2dvt h LEU 223 CO 0.00 0.19 0.31 -0.65 0.09 0.00 0.00 178.44 178.37 2dvt h PRO 224 N 0.42 0.43 -0.08 1.13 0.11 -1.83 0.12 132.00 132.31 2dvt h PRO 224 Ca 0.24 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.28 2dvt h PRO 224 Cb 0.21 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.22 2dvt h PRO 224 CO -0.21 0.28 -0.16 -0.92 -0.21 0.00 0.00 178.00 176.79 2dvt h TYR 225 N 0.44 0.13 -0.07 0.65 3.20 -1.93 -3.10 116.97 116.29 2dvt h TYR 225 Ca 0.43 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.28 2dvt h TYR 225 Cb 0.66 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.89 2dvt h TYR 225 CO -0.16 0.28 0.00 -1.33 -1.64 0.00 0.00 178.16 175.31 2dvt n MET 226 N -4.29 1.15 -0.28 1.82 2.81 -0.86 -4.69 117.12 112.77 2dvt n MET 226 Ca -0.01 -1.43 0.04 0.00 -1.81 0.00 0.00 57.70 54.49 2dvt n MET 226 Cb 0.26 -1.27 0.18 0.00 -0.71 0.00 0.00 33.22 31.68 2dvt n MET 226 CO 0.00 0.00 0.00 1.98 1.51 0.00 0.00 175.97 179.46 2dvt h MET 227 N 2.64 0.65 -0.15 0.03 -1.53 -0.91 -0.69 114.93 114.97 2dvt h MET 227 Ca 0.00 -0.04 0.03 0.00 -3.44 0.00 0.00 59.70 56.25 2dvt h MET 227 Cb 0.60 -0.15 -0.03 0.00 -0.55 0.00 0.00 31.60 31.47 2dvt h MET 227 CO 0.00 0.43 -0.02 2.35 0.14 0.00 0.00 176.91 179.81 2dvt h TRP 228 N 0.67 -0.05 -0.62 1.39 7.01 -1.84 -2.60 115.95 119.91 2dvt h TRP 228 Ca 0.41 0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.38 2dvt h TRP 228 Cb 0.48 0.05 -0.03 0.00 -2.10 0.00 0.00 29.16 27.56 2dvt h TRP 228 CO -0.09 -0.05 0.23 -0.09 -2.79 0.00 0.00 178.44 175.65 2dvt h ARG 229 N 0.02 0.92 -0.97 2.65 2.43 -1.67 0.12 114.38 117.87 2dvt h ARG 229 Ca 0.07 -0.16 0.18 0.00 -0.81 0.00 0.00 59.98 59.26 2dvt h ARG 229 Cb 0.10 -0.15 -0.10 0.00 -0.42 0.00 0.00 29.97 29.39 2dvt h ARG 229 CO -0.14 0.77 0.58 0.82 -1.51 0.00 0.00 179.97 180.48 2dvt h ILE 230 N 0.90 0.72 0.04 1.20 2.04 -0.76 -1.67 117.51 119.98 2dvt h ILE 230 Ca 0.21 -0.26 -0.36 0.00 1.00 0.00 0.00 64.86 65.45 2dvt h ILE 230 Cb 0.21 -0.09 -0.05 0.00 -0.74 0.00 0.00 36.82 36.14 2dvt h ILE 230 CO -0.02 0.14 -2.09 0.47 0.00 0.00 0.00 178.15 176.66 2dvt n ASP 231 N -4.78 1.99 -0.35 1.72 10.43 -1.07 -4.63 116.55 119.86 2dvt n ASP 231 Ca 0.22 0.19 0.14 0.00 2.57 0.00 0.00 54.79 57.91 2dvt n ASP 231 Cb 0.53 -0.76 0.64 0.00 1.84 0.00 0.00 41.12 43.37 2dvt n ASP 231 CO 0.00 0.00 0.00 1.41 -1.07 0.00 0.00 177.20 177.54 2dvt n HIS 232 N -3.79 0.00 -1.72 1.24 8.25 0.40 -4.93 115.22 114.68 2dvt n HIS 232 Ca -0.41 -0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 56.65 2dvt n HIS 232 Cb 0.92 0.00 0.01 0.00 1.12 0.00 0.00 29.99 32.04 2dvt n HIS 232 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 2dvt n ARG 233 N -0.15 2.03 -3.79 -0.41 0.00 -0.64 -2.10 116.66 111.61 2dvt n ARG 233 Ca 0.20 0.72 -0.25 0.00 -0.00 0.00 0.00 57.85 58.52 2dvt n ARG 233 Cb 0.29 -2.46 0.03 0.00 -0.00 0.00 0.00 32.46 30.31 2dvt n ARG 233 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2dvt n ASN 234 N 0.06 -3.01 0.22 2.89 3.02 -1.26 -4.87 115.26 112.31 2dvt n ASN 234 Ca 0.06 -0.79 0.14 0.00 -0.03 0.00 0.00 54.58 53.97 2dvt n ASN 234 Cb 0.40 -4.04 0.78 0.00 -0.61 0.00 0.00 39.78 36.32 2dvt n ASN 234 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dvt h ALA 235 N 0.92 1.87 0.00 5.41 0.00 -1.78 -2.26 119.26 123.42 2dvt h ALA 235 Ca -0.60 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.31 2dvt h ALA 235 Cb 1.37 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 2dvt h ALA 235 CO 0.61 -0.18 -0.01 0.11 0.00 0.00 0.00 179.25 179.78 2dvt h TRP 236 N 0.00 0.00 -2.49 0.00 5.08 -1.89 -3.38 115.95 113.27 2dvt h TRP 236 Ca 0.06 0.00 -0.54 0.00 1.08 0.00 0.00 58.89 59.49 2dvt h TRP 236 Cb 0.28 0.00 -0.07 0.00 -3.00 0.00 0.00 29.16 26.37 2dvt h TRP 236 CO 0.00 0.01 1.09 0.08 -1.28 0.00 0.00 178.44 178.35 2dvt s VAL 237 N -4.34 3.72 -1.44 0.12 1.01 -0.85 -4.90 120.40 113.71 2dvt s VAL 237 Ca -0.04 0.49 -0.08 0.00 0.00 0.00 0.00 61.98 62.34 2dvt s VAL 237 Cb 0.14 -4.69 0.04 0.00 0.00 0.00 0.00 36.38 31.86 2dvt s VAL 237 CO 0.49 -1.56 2.52 0.29 0.00 0.00 0.00 175.10 176.84 2dvt n LYS 238 N 9.12 3.98 -4.21 2.72 4.76 -1.26 -4.88 118.16 128.40 2dvt n LYS 238 Ca 0.07 -2.93 -0.20 0.00 -2.87 0.00 0.00 58.31 52.39 2dvt n LYS 238 Cb 0.49 -2.80 -0.12 0.00 -1.84 0.00 0.00 35.03 30.77 2dvt n LYS 238 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2dvt s LEU 239 N -0.61 2.29 0.73 -0.35 1.43 -1.26 -5.14 118.68 115.76 2dvt s LEU 239 Ca 0.57 -0.64 -0.13 0.00 -1.03 0.00 0.00 54.13 52.90 2dvt s LEU 239 Cb 0.17 -0.62 0.03 0.00 0.03 0.00 0.00 46.19 45.80 2dvt s LEU 239 CO -0.07 -0.04 1.11 -2.16 0.23 0.00 0.00 176.35 175.42 2dvt s PRO 240 N -1.82 2.43 0.84 1.29 0.04 -1.26 -4.99 135.00 131.52 2dvt s PRO 240 Ca 0.01 1.32 -0.12 0.00 0.04 0.00 0.00 61.00 62.25 2dvt s PRO 240 Cb -0.10 -1.91 0.10 0.00 0.04 0.00 0.00 34.50 32.63 2dvt s PRO 240 CO 0.03 -1.53 1.17 -2.14 0.04 0.00 0.00 177.00 174.57 2dvt s PRO 241 N -4.47 1.50 0.02 0.56 0.02 -1.26 -4.95 135.00 126.42 2dvt s PRO 241 Ca 0.65 1.62 0.25 0.00 0.02 0.00 0.00 61.00 63.54 2dvt s PRO 241 Cb -0.20 -1.77 0.49 0.00 0.02 0.00 0.00 34.50 33.04 2dvt s PRO 241 CO 0.49 -2.29 1.41 0.54 -0.33 0.00 0.00 177.00 176.82 2dvt n ARG 242 N -3.63 0.06 -1.74 5.54 1.74 -1.26 -4.94 116.66 112.43 2dvt n ARG 242 Ca 0.12 0.01 -0.30 0.00 -0.77 0.00 0.00 57.85 56.92 2dvt n ARG 242 Cb 0.51 -1.53 0.06 0.00 -1.02 0.00 0.00 32.46 30.48 2dvt n ARG 242 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 2dvt s TYR 243 N -3.04 3.12 0.30 -1.55 -0.85 -1.26 -4.99 117.35 109.10 2dvt s TYR 243 Ca 0.10 1.11 0.01 0.00 -0.52 0.00 0.00 57.07 57.77 2dvt s TYR 243 Cb 0.17 -3.08 0.49 0.00 0.38 0.00 0.00 41.96 39.92 2dvt s TYR 243 CO 0.70 -1.41 1.86 -1.35 -1.52 0.00 0.00 175.55 173.84 2dvt h PRO 244 N -0.82 0.75 -6.79 -3.49 0.11 -1.85 -3.45 132.00 116.46 2dvt h PRO 244 Ca -0.46 -0.14 -0.57 0.00 0.11 0.00 0.00 66.00 64.94 2dvt h PRO 244 Cb 1.26 -0.12 0.15 0.00 0.11 0.00 0.00 31.00 32.40 2dvt h PRO 244 CO 0.62 0.67 0.14 0.00 -0.21 0.00 0.00 178.00 179.21 2dvt n ALA 245 N -2.46 0.22 0.12 -0.75 0.00 -0.73 -4.79 120.51 112.11 2dvt n ALA 245 Ca 0.04 0.06 0.06 0.00 0.00 0.00 0.00 53.44 53.60 2dvt n ALA 245 Cb 0.20 -2.11 0.02 0.00 0.00 0.00 0.00 19.45 17.57 2dvt n ALA 245 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2dvt h LYS 246 N 0.79 0.00 0.00 0.00 1.79 -1.92 -3.48 116.57 113.75 2dvt h LYS 246 Ca -0.48 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 2dvt h LYS 246 Cb 1.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.01 2dvt h LYS 246 CO 0.52 0.20 0.00 0.54 -1.08 0.00 0.00 179.45 179.63 2dvt n ARG 247 N -2.96 3.19 -3.11 3.15 1.74 -1.26 -5.06 116.66 112.34 2dvt n ARG 247 Ca -0.01 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.80 2dvt n ARG 247 Cb 0.67 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 32.09 2dvt n ARG 247 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2dvt s ARG 248 N -0.03 3.58 0.23 5.56 0.52 -1.26 -5.00 118.95 122.55 2dvt s ARG 248 Ca 0.00 0.01 -0.08 0.00 -0.52 0.00 0.00 55.73 55.14 2dvt s ARG 248 Cb 0.00 -2.55 0.25 0.00 0.52 0.00 0.00 34.95 33.17 2dvt s ARG 248 CO 0.00 0.06 1.87 0.74 0.02 0.00 0.00 175.30 177.99 2dvt h PHE 249 N 0.98 1.01 -0.08 -0.53 -1.00 -1.95 -1.41 116.94 113.96 2dvt h PHE 249 Ca -0.48 0.03 0.01 0.00 2.81 0.00 0.00 57.97 60.34 2dvt h PHE 249 Cb 1.20 -0.33 -0.00 0.00 3.61 0.00 0.00 35.95 40.42 2dvt h PHE 249 CO 0.56 0.58 0.06 0.00 -1.61 0.00 0.00 178.31 177.90 2dvt h MET 250 N 1.05 0.07 -0.09 1.51 -0.00 -1.94 0.06 114.93 115.58 2dvt h MET 250 Ca 0.33 -0.00 -0.02 0.00 -0.00 0.00 0.00 59.70 60.01 2dvt h MET 250 Cb 0.00 -0.02 -0.00 0.00 -0.00 0.00 0.00 31.60 31.58 2dvt h MET 250 CO -0.11 0.05 -0.02 -0.44 -0.00 0.00 0.00 176.91 176.38 2dvt h ASP 251 N 0.07 0.17 -0.43 -0.10 3.32 -1.65 0.26 116.42 118.06 2dvt h ASP 251 Ca 0.03 -0.37 -0.12 0.00 0.02 0.00 0.00 57.03 56.60 2dvt h ASP 251 Cb 0.05 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 2dvt h ASP 251 CO -0.00 0.50 -0.17 1.88 -1.72 0.00 0.00 179.24 179.72 2dvt h TYR 252 N -0.16 1.04 -0.31 4.55 -1.99 -1.27 -0.09 116.97 118.73 2dvt h TYR 252 Ca 0.02 -0.23 -0.02 0.00 2.00 0.00 0.00 58.73 60.50 2dvt h TYR 252 Cb 0.42 -0.25 -0.01 0.00 2.00 0.00 0.00 36.73 38.89 2dvt h TYR 252 CO 0.05 1.02 0.11 0.35 -0.00 0.00 0.00 178.16 179.68 2dvt h PHE 253 N 0.81 0.50 -0.07 4.88 3.57 -0.97 0.35 116.94 126.00 2dvt h PHE 253 Ca 0.12 -0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.48 2dvt h PHE 253 Cb 0.72 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 2dvt h PHE 253 CO 0.04 0.50 -0.38 -0.91 -2.23 0.00 0.00 178.31 175.34 2dvt h ASN 254 N 0.35 0.15 0.07 0.41 -0.26 -0.79 -2.87 115.58 112.64 2dvt h ASN 254 Ca 0.10 -0.06 -0.29 0.00 -0.56 0.00 0.00 56.30 55.49 2dvt h ASN 254 Cb 0.23 -0.04 -0.06 0.00 -1.06 0.00 0.00 38.32 37.39 2dvt h ASN 254 CO -0.00 0.52 -2.23 -0.62 -1.06 0.00 0.00 177.43 174.03 2dvt n GLU 255 N -4.06 0.68 0.00 0.81 1.02 -0.06 -4.67 120.64 114.36 2dvt n GLU 255 Ca -0.01 -0.01 0.02 0.00 -0.02 0.00 0.00 57.16 57.13 2dvt n GLU 255 Cb 0.44 -1.55 0.01 0.00 -0.02 0.00 0.00 31.44 30.32 2dvt n GLU 255 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2dvt n ASN 256 N -2.69 1.06 -4.51 1.62 4.13 0.12 -5.00 115.26 109.99 2dvt n ASN 256 Ca -0.26 -1.03 -0.26 0.00 1.68 0.00 0.00 54.58 54.71 2dvt n ASN 256 Cb 1.04 0.25 -0.10 0.00 -1.54 0.00 0.00 39.78 39.43 2dvt n ASN 256 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 2dvt s PHE 257 N -0.60 2.48 0.03 3.10 0.40 -1.08 -0.30 117.98 122.01 2dvt s PHE 257 Ca 0.04 -0.28 0.01 0.00 -0.60 0.00 0.00 56.93 56.10 2dvt s PHE 257 Cb 0.03 -1.20 -0.02 0.00 0.51 0.00 0.00 43.02 42.35 2dvt s PHE 257 CO 0.08 0.54 -0.05 -1.01 0.70 0.00 0.00 175.22 175.48 2dvt s HIS 258 N -1.82 0.43 0.11 0.36 3.76 -0.34 -4.85 115.29 112.94 2dvt s HIS 258 Ca 0.24 -0.44 0.07 0.00 -0.15 0.00 0.00 55.06 54.78 2dvt s HIS 258 Cb -0.08 -0.27 -0.04 0.00 1.11 0.00 0.00 32.58 33.30 2dvt s HIS 258 CO 0.14 -0.12 -0.17 0.96 -0.85 0.00 0.00 174.74 174.70 2dvt s ILE 259 N -1.22 1.49 0.36 0.60 -4.36 -0.41 -0.99 121.20 116.67 2dvt s ILE 259 Ca -0.11 -1.60 0.08 0.00 -0.26 0.00 0.00 60.65 58.77 2dvt s ILE 259 Cb -0.09 -1.48 -0.05 0.00 1.25 0.00 0.00 42.46 42.08 2dvt s ILE 259 CO -0.00 -0.24 0.05 0.42 0.24 0.00 0.00 174.94 175.41 2dvt s THR 260 N -1.60 2.55 -2.02 8.37 -4.23 0.29 -0.07 115.64 118.92 2dvt s THR 260 Ca 0.07 -1.90 0.10 0.00 -1.18 0.00 0.00 61.69 58.78 2dvt s THR 260 Cb -0.08 -2.86 0.29 0.00 1.34 0.00 0.00 72.50 71.19 2dvt s THR 260 CO 0.04 -0.15 1.26 0.35 -0.54 0.00 0.00 174.62 175.58 2dvt n THR 261 N -1.02 0.39 -1.62 3.99 -2.24 0.03 -0.25 114.28 113.56 2dvt n THR 261 Ca -0.04 -0.40 -0.50 0.00 -2.27 0.00 0.00 64.05 60.84 2dvt n THR 261 Cb 0.63 0.21 -0.05 0.00 -2.10 0.00 0.00 70.33 69.02 2dvt n THR 261 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2dvt n SER 262 N 0.38 2.12 -1.71 3.42 3.41 -1.15 -1.95 113.62 118.13 2dvt n SER 262 Ca 0.11 1.11 -0.11 0.00 -0.26 0.00 0.00 58.87 59.71 2dvt n SER 262 Cb 0.26 -1.27 -0.03 0.00 -0.26 0.00 0.00 64.21 62.91 2dvt n SER 262 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dvt n GLY 263 N 2.84 0.53 2.31 5.00 0.00 -1.14 -2.67 105.19 112.05 2dvt n GLY 263 Ca 0.18 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 2dvt n GLY 263 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2dvt n ASN 264 N -0.80 -0.46 -3.66 1.61 2.85 -0.82 -4.96 115.26 109.02 2dvt n ASN 264 Ca -0.12 -2.82 -0.41 0.00 -0.11 0.00 0.00 54.58 51.11 2dvt n ASN 264 Cb 0.45 -0.13 -0.00 0.00 1.24 0.00 0.00 39.78 41.34 2dvt n ASN 264 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 2dvt n PHE 265 N 1.44 2.83 -3.95 1.20 0.99 -1.26 -4.89 117.46 113.83 2dvt n PHE 265 Ca 0.19 -2.86 -0.29 0.00 -0.00 0.00 0.00 57.45 54.49 2dvt n PHE 265 Cb 0.55 -2.05 -0.16 0.00 -1.00 0.00 0.00 39.48 36.82 2dvt n PHE 265 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.76 177.26 2dvt s ARG 266 N 0.44 1.80 0.23 -1.08 6.06 -1.26 -5.03 118.95 120.10 2dvt s ARG 266 Ca 0.49 -0.58 -0.08 0.00 -2.50 0.00 0.00 55.73 53.05 2dvt s ARG 266 Cb 0.14 -2.09 0.21 0.00 0.06 0.00 0.00 34.95 33.27 2dvt s ARG 266 CO -0.05 -0.37 1.90 1.15 -2.50 0.00 0.00 175.30 175.44 2dvt h THR 267 N 6.29 1.21 -0.89 4.11 2.02 -1.97 -1.85 112.91 121.82 2dvt h THR 267 Ca -0.29 -0.40 0.01 0.00 0.77 0.00 0.00 66.41 66.51 2dvt h THR 267 Cb 1.11 -0.05 -0.05 0.00 -1.74 0.00 0.00 68.15 67.43 2dvt h THR 267 CO 0.45 0.21 0.59 1.56 0.37 0.00 0.00 175.52 178.70 2dvt h GLN 268 N 1.16 1.16 -0.71 6.66 7.50 -1.99 -0.20 115.11 128.69 2dvt h GLN 268 Ca 0.32 -0.07 -0.07 0.00 0.50 0.00 0.00 58.65 59.34 2dvt h GLN 268 Cb -0.12 -0.26 -0.03 0.00 0.05 0.00 0.00 27.48 27.12 2dvt h GLN 268 CO -0.08 0.77 0.19 1.15 -1.50 0.00 0.00 178.83 179.36 2dvt h THR 269 N 1.20 1.26 -0.59 -0.54 2.02 -1.86 -1.83 112.91 112.56 2dvt h THR 269 Ca 0.33 -0.95 -0.10 0.00 0.77 0.00 0.00 66.41 66.46 2dvt h THR 269 Cb -0.12 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 66.80 2dvt h THR 269 CO -0.08 0.37 -0.01 0.25 0.37 0.00 0.00 175.52 176.41 2dvt h LEU 270 N 1.06 1.04 -0.52 2.58 5.85 -0.59 -1.42 115.31 123.32 2dvt h LEU 270 Ca 0.22 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 2dvt h LEU 270 Cb 0.35 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 2dvt h LEU 270 CO -0.00 1.10 0.17 0.40 -0.34 0.00 0.00 178.44 179.77 2dvt h ILE 271 N 0.95 1.23 -0.55 4.05 2.04 -0.84 0.22 117.51 124.61 2dvt h ILE 271 Ca 0.17 -0.74 -0.01 0.00 1.00 0.00 0.00 64.86 65.27 2dvt h ILE 271 Cb 0.58 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 2dvt h ILE 271 CO 0.03 0.28 0.29 -0.78 0.00 0.00 0.00 178.15 177.97 2dvt h ASP 272 N 0.70 0.69 -0.78 1.72 1.82 -1.16 -1.17 116.42 118.24 2dvt h ASP 272 Ca 0.17 -0.10 -0.04 0.00 -0.39 0.00 0.00 57.03 56.66 2dvt h ASP 272 Cb 0.25 -0.18 -0.03 0.00 0.68 0.00 0.00 39.33 40.05 2dvt h ASP 272 CO -0.01 0.60 0.32 0.00 -1.61 0.00 0.00 179.24 178.54 2dvt h ALA 273 N 1.12 1.07 -0.63 -0.78 0.00 -0.95 -1.53 119.26 117.56 2dvt h ALA 273 Ca 0.19 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2dvt h ALA 273 Cb 0.07 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2dvt h ALA 273 CO -0.03 0.66 0.31 0.82 0.00 0.00 0.00 179.25 181.01 2dvt h ILE 274 N 1.14 1.20 -0.01 0.00 2.04 -0.42 0.24 117.51 121.71 2dvt h ILE 274 Ca 0.26 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.56 2dvt h ILE 274 Cb 0.21 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.67 2dvt h ILE 274 CO -0.02 0.24 -0.01 0.18 0.00 0.00 0.00 178.15 178.53 2dvt n LEU 275 N -4.35 0.55 -0.02 1.44 4.77 -0.49 -2.40 117.00 116.49 2dvt n LEU 275 Ca 0.06 -0.16 -0.06 0.00 -0.03 0.00 0.00 56.01 55.82 2dvt n LEU 275 Cb 0.12 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 2dvt n LEU 275 CO 0.38 0.09 -0.61 -0.62 -1.33 0.00 0.00 177.39 175.30 2dvt n GLU 276 N -0.61 0.13 -0.01 3.23 -0.58 -0.59 -4.86 120.64 117.35 2dvt n GLU 276 Ca 0.21 0.06 0.07 0.00 -0.42 0.00 0.00 57.16 57.08 2dvt n GLU 276 Cb 0.21 -0.72 -0.12 0.00 -0.57 0.00 0.00 31.44 30.24 2dvt n GLU 276 CO 0.00 0.00 0.00 1.51 -0.48 0.00 0.00 177.13 178.16 2dvt n ILE 277 N -3.36 0.02 0.00 -3.67 3.06 0.73 -5.03 119.36 111.11 2dvt n ILE 277 Ca -0.11 -0.36 0.00 0.00 -2.50 0.00 0.00 62.75 59.79 2dvt n ILE 277 Cb 0.50 0.13 0.00 0.00 0.54 0.00 0.00 39.64 40.81 2dvt n ILE 277 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2dvt n GLY 278 N 1.64 0.61 0.31 4.50 0.00 -1.01 -4.56 105.19 106.68 2dvt n GLY 278 Ca -0.03 -1.55 0.15 0.00 0.00 0.00 0.00 46.02 44.58 2dvt n GLY 278 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dvt h ALA 279 N 0.00 1.69 0.00 4.61 0.00 -1.86 -1.96 119.26 121.74 2dvt h ALA 279 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dvt h ALA 279 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2dvt h ALA 279 CO 0.00 -0.11 0.00 -0.25 0.00 0.00 0.00 179.25 178.89 2dvt n ASP 280 N -3.93 0.56 -0.30 0.00 8.00 -1.26 -2.80 116.55 116.83 2dvt n ASP 280 Ca -0.01 0.67 0.08 0.00 0.71 0.00 0.00 54.79 56.24 2dvt n ASP 280 Cb 0.17 -0.77 0.17 0.00 -0.02 0.00 0.00 41.12 40.67 2dvt n ASP 280 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2dvt n ARG 281 N -2.15 1.50 -5.08 -1.24 1.74 -0.74 -4.93 116.66 105.76 2dvt n ARG 281 Ca 0.01 -2.80 -0.32 0.00 -0.77 0.00 0.00 57.85 53.97 2dvt n ARG 281 Cb 0.17 -1.57 -0.16 0.00 -1.02 0.00 0.00 32.46 29.89 2dvt n ARG 281 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2dvt s ILE 282 N -2.98 2.44 0.01 0.55 1.01 -1.12 -1.29 121.20 119.81 2dvt s ILE 282 Ca 0.35 -0.91 0.07 0.00 0.00 0.00 0.00 60.65 60.16 2dvt s ILE 282 Cb 0.31 -1.95 -0.02 0.00 0.01 0.00 0.00 42.46 40.81 2dvt s ILE 282 CO 0.01 0.56 -0.20 -0.76 0.00 0.00 0.00 174.94 174.54 2dvt s LEU 283 N 0.06 2.09 0.39 2.97 1.43 0.89 -4.33 118.68 122.18 2dvt s LEU 283 Ca -0.08 -0.42 -0.25 0.00 -1.03 0.00 0.00 54.13 52.34 2dvt s LEU 283 Cb -0.15 -1.01 -0.09 0.00 0.03 0.00 0.00 46.19 44.97 2dvt s LEU 283 CO 0.05 0.21 1.14 0.12 0.23 0.00 0.00 176.35 178.10 2dvt s PHE 284 N -0.60 3.14 -0.03 0.29 5.36 0.31 -0.79 117.98 125.66 2dvt s PHE 284 Ca 0.08 1.58 -0.29 0.00 -0.96 0.00 0.00 56.93 57.34 2dvt s PHE 284 Cb -0.08 -3.32 0.11 0.00 -0.34 0.00 0.00 43.02 39.38 2dvt s PHE 284 CO 0.00 -1.11 0.91 -1.12 -1.46 0.00 0.00 175.22 172.44 2dvt s SER 285 N -1.23 -0.37 -0.06 6.13 0.01 -1.26 -3.88 113.70 113.04 2dvt s SER 285 Ca 0.57 0.07 0.01 0.00 1.31 0.00 0.00 55.95 57.92 2dvt s SER 285 Cb -0.29 0.37 -0.05 0.00 0.21 0.00 0.00 66.02 66.27 2dvt s SER 285 CO 0.36 -0.57 -0.04 0.35 0.41 0.00 0.00 173.24 173.74 2dvt n THR 286 N -0.08 0.39 -1.10 1.44 -2.24 -1.26 -2.95 114.28 108.48 2dvt n THR 286 Ca -0.09 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 2dvt n THR 286 Cb 0.61 -0.77 0.00 0.00 -2.10 0.00 0.00 70.33 68.07 2dvt n THR 286 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2dvt n ASP 287 N -2.59 -1.75 -4.75 3.42 -0.08 0.04 -2.88 116.55 107.97 2dvt n ASP 287 Ca -0.11 0.00 -0.38 0.00 -1.51 0.00 0.00 54.79 52.78 2dvt n ASP 287 Cb 0.64 -0.39 0.03 0.00 2.34 0.00 0.00 41.12 43.74 2dvt n ASP 287 CO 0.00 0.00 0.00 0.86 0.12 0.00 0.00 177.20 178.18 2dvt s TRP 288 N -2.00 2.37 -2.13 -0.67 -0.11 -1.23 -0.91 118.94 114.26 2dvt s TRP 288 Ca 0.00 1.38 0.16 0.00 1.22 0.00 0.00 56.10 58.86 2dvt s TRP 288 Cb 0.00 -3.76 0.52 0.00 -1.50 0.00 0.00 33.47 28.72 2dvt s TRP 288 CO 0.00 -2.74 1.39 -0.35 -4.62 0.00 0.00 176.95 170.63 2dvt n PRO 289 N -0.89 1.79 0.23 5.86 -0.04 -1.26 -0.61 135.00 140.08 2dvt n PRO 289 Ca 0.09 -1.21 0.14 0.00 -0.04 0.00 0.00 63.50 62.49 2dvt n PRO 289 Cb 0.45 -1.33 0.40 0.00 -0.04 0.00 0.00 33.50 32.98 2dvt n PRO 289 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2dvt h PHE 290 N 2.16 0.00 -3.98 0.54 0.04 -1.40 -3.43 116.94 110.87 2dvt h PHE 290 Ca 0.00 0.00 -0.45 0.00 2.80 0.00 0.00 57.97 60.32 2dvt h PHE 290 Cb 0.49 0.00 -0.23 0.00 2.20 0.00 0.00 35.95 38.41 2dvt h PHE 290 CO 0.18 0.00 -0.79 -1.21 -0.60 0.00 0.00 178.31 175.89 2dvt s GLU 291 N -3.38 0.91 0.25 1.51 0.41 -0.89 -5.10 118.70 112.41 2dvt s GLU 291 Ca 0.05 -0.92 -0.30 0.00 -0.41 0.00 0.00 54.97 53.39 2dvt s GLU 291 Cb 0.07 -0.95 -0.09 0.00 -1.78 0.00 0.00 34.13 31.38 2dvt s GLU 291 CO 0.60 0.22 1.07 -0.80 -0.49 0.00 0.00 175.26 175.86 2dvt s ASN 292 N -1.55 7.34 0.24 -0.19 -0.87 -1.26 -3.76 114.94 114.88 2dvt s ASN 292 Ca 0.00 2.17 -0.05 0.00 -1.57 0.00 0.00 52.86 53.42 2dvt s ASN 292 Cb -0.09 -2.62 0.26 0.00 -0.02 0.00 0.00 41.25 38.78 2dvt s ASN 292 CO 0.02 -0.10 1.76 0.40 -2.57 0.00 0.00 177.10 176.61 2dvt h ILE 293 N 3.25 1.25 -0.14 0.60 2.04 -1.96 -2.59 117.51 119.95 2dvt h ILE 293 Ca -0.46 -0.92 -0.08 0.00 1.00 0.00 0.00 64.86 64.39 2dvt h ILE 293 Cb 1.21 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 2dvt h ILE 293 CO 0.68 0.35 -0.29 -2.24 0.00 0.00 0.00 178.15 176.65 2dvt h ASP 294 N 0.92 0.27 -0.13 1.72 2.03 -1.93 -0.21 116.42 119.08 2dvt h ASP 294 Ca 0.19 -0.09 -0.01 0.00 -0.73 0.00 0.00 57.03 56.39 2dvt h ASP 294 Cb 0.36 -0.07 -0.01 0.00 -0.83 0.00 0.00 39.33 38.78 2dvt h ASP 294 CO 0.00 0.55 0.03 0.45 -1.03 0.00 0.00 179.24 179.25 2dvt h HIS 295 N 0.24 0.23 0.09 4.15 3.86 -1.87 0.15 115.15 122.00 2dvt h HIS 295 Ca 0.03 -0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2dvt h HIS 295 Cb 0.63 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 29.04 2dvt h HIS 295 CO 0.01 0.39 -0.04 0.00 0.86 0.00 0.00 177.93 179.15 2dvt h ALA 296 N 0.81 -0.12 -0.34 2.45 0.00 -1.26 -2.33 119.26 118.48 2dvt h ALA 296 Ca 0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2dvt h ALA 296 Cb 0.28 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2dvt h ALA 296 CO 0.00 -0.49 0.08 1.03 0.00 0.00 0.00 179.25 179.87 2dvt h SER 297 N -0.26 0.52 -0.75 0.00 0.87 -1.04 -1.15 113.55 111.75 2dvt h SER 297 Ca -0.01 -0.24 -0.04 0.00 -1.23 0.00 0.00 61.79 60.27 2dvt h SER 297 Cb 0.22 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.01 2dvt h SER 297 CO 0.02 0.63 0.31 0.44 -0.53 0.00 0.00 176.83 177.70 2dvt h ASP 298 N 0.40 1.02 -0.16 6.23 3.32 -1.00 -0.56 116.42 125.67 2dvt h ASP 298 Ca 0.11 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 2dvt h ASP 298 Cb 0.31 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 2dvt h ASP 298 CO 0.00 0.91 0.04 -0.25 -1.72 0.00 0.00 179.24 178.22 2dvt h TRP 299 N 1.07 0.27 -0.45 4.55 7.01 -1.32 -3.03 115.95 124.05 2dvt h TRP 299 Ca 0.25 -0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.19 2dvt h TRP 299 Cb 0.19 -0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.16 2dvt h TRP 299 CO 0.02 0.39 0.14 0.35 -2.79 0.00 0.00 178.44 176.54 2dvt h PHE 300 N 0.08 0.67 0.00 2.65 3.57 -0.96 -0.64 116.94 122.30 2dvt h PHE 300 Ca 0.05 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 2dvt h PHE 300 Cb 0.25 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 2dvt h PHE 300 CO 0.01 0.55 -0.20 -0.91 -2.23 0.00 0.00 178.31 175.53 2dvt h ASN 301 N 0.65 0.00 -0.02 0.41 2.35 -1.01 -3.15 115.58 114.81 2dvt h ASN 301 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 2dvt h ASN 301 Cb 0.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.57 2dvt h ASN 301 CO -0.01 0.20 -0.06 0.00 -1.65 0.00 0.00 177.43 175.91 2dvt n ALA 302 N -2.47 2.59 -1.75 -0.83 0.00 -0.86 -4.89 120.51 112.31 2dvt n ALA 302 Ca -0.02 -0.58 -0.37 0.00 0.00 0.00 0.00 53.44 52.46 2dvt n ALA 302 Cb 0.26 -0.45 0.05 0.00 0.00 0.00 0.00 19.45 19.31 2dvt n ALA 302 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2dvt s THR 303 N -1.23 2.21 -1.23 0.00 -1.32 -0.30 -4.86 115.64 108.90 2dvt s THR 303 Ca 0.15 0.14 -0.16 0.00 -1.21 0.00 0.00 61.69 60.61 2dvt s THR 303 Cb 0.11 -3.07 -0.03 0.00 -1.51 0.00 0.00 72.50 68.00 2dvt s THR 303 CO 0.20 -0.01 2.16 -1.20 -2.21 0.00 0.00 174.62 173.56 2dvt n SER 304 N -1.36 3.63 -4.25 8.08 7.64 -1.26 -4.89 113.62 121.21 2dvt n SER 304 Ca 0.12 -2.77 -0.19 0.00 1.01 0.00 0.00 58.87 57.04 2dvt n SER 304 Cb 0.47 -1.47 -0.10 0.00 -1.01 0.00 0.00 64.21 62.10 2dvt n SER 304 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2dvt s ILE 305 N 3.74 0.65 0.41 0.44 -4.36 -1.26 -4.99 121.20 115.83 2dvt s ILE 305 Ca 0.51 -2.00 -0.25 0.00 -0.26 0.00 0.00 60.65 58.65 2dvt s ILE 305 Cb 0.14 -2.61 -0.08 0.00 1.25 0.00 0.00 42.46 41.16 2dvt s ILE 305 CO -0.02 0.00 1.18 0.00 0.24 0.00 0.00 174.94 176.34 2dvt s ALA 306 N -3.56 3.13 0.40 2.27 0.00 -1.26 -4.87 121.76 117.87 2dvt s ALA 306 Ca 0.35 0.99 0.09 0.00 0.00 0.00 0.00 51.96 53.39 2dvt s ALA 306 Cb 0.07 -3.39 0.87 0.00 0.00 0.00 0.00 23.12 20.67 2dvt s ALA 306 CO 0.15 -0.58 2.01 0.93 0.00 0.00 0.00 175.76 178.26 2dvt h GLU 307 N 2.53 0.56 -0.77 0.00 4.39 -1.99 -0.17 114.58 119.14 2dvt h GLU 307 Ca -0.49 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.17 2dvt h GLU 307 Cb 1.24 -0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 29.73 2dvt h GLU 307 CO 0.62 0.37 0.44 0.00 -1.16 0.00 0.00 179.01 179.27 2dvt h ALA 308 N 1.69 1.33 0.00 3.43 0.00 -2.00 -1.96 119.26 121.74 2dvt h ALA 308 Ca 0.24 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 2dvt h ALA 308 Cb 0.22 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2dvt h ALA 308 CO -0.07 0.56 -0.72 -0.44 0.00 0.00 0.00 179.25 178.59 2dvt h ASP 309 N 1.06 0.00 -0.61 0.00 3.32 -1.46 -2.51 116.42 116.22 2dvt h ASP 309 Ca 0.27 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.25 2dvt h ASP 309 Cb -0.00 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 2dvt h ASP 309 CO -0.05 0.72 0.09 -0.09 -1.72 0.00 0.00 179.24 178.19 2dvt h ARG 310 N 0.00 1.05 -0.46 3.56 2.43 -0.56 0.19 114.38 120.59 2dvt h ARG 310 Ca -0.01 -0.28 -0.07 0.00 -0.81 0.00 0.00 59.98 58.82 2dvt h ARG 310 Cb 1.37 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.78 2dvt h ARG 310 CO 0.09 0.97 0.02 0.28 -1.51 0.00 0.00 179.97 179.82 2dvt h VAL 311 N 0.98 1.26 0.13 0.20 2.07 -1.27 0.96 116.25 120.58 2dvt h VAL 311 Ca 0.19 -1.01 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 2dvt h VAL 311 Cb 0.44 1.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 2dvt h VAL 311 CO 0.01 0.35 -0.06 0.11 0.02 0.00 0.00 177.57 178.00 2dvt h LYS 312 N 0.66 -0.17 -0.54 1.57 1.57 -1.07 -0.18 116.57 118.41 2dvt h LYS 312 Ca 0.13 0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.87 2dvt h LYS 312 Cb 0.47 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 2dvt h LYS 312 CO 0.02 0.18 0.11 0.82 -0.57 0.00 0.00 179.45 180.01 2dvt h ILE 313 N -0.55 1.23 0.00 1.86 2.04 -0.66 0.05 117.51 121.48 2dvt h ILE 313 Ca -0.02 -0.85 -0.10 0.00 1.00 0.00 0.00 64.86 64.90 2dvt h ILE 313 Cb 0.43 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 2dvt h ILE 313 CO 0.03 0.31 -0.46 1.23 0.00 0.00 0.00 178.15 179.26 2dvt h GLY 314 N 0.98 0.00 0.00 5.37 0.00 -0.80 0.90 103.07 109.52 2dvt h GLY 314 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 2dvt h GLY 314 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 176.54 174.41 2dvt n ARG 315 N -3.23 0.00 0.18 4.80 0.63 -0.12 -0.88 116.66 118.05 2dvt n ARG 315 Ca 0.02 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 56.99 2dvt n ARG 315 Cb 0.71 0.00 0.45 0.00 0.45 0.00 0.00 32.46 34.07 2dvt n ARG 315 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 2dvt h THR 316 N 0.00 1.16 -0.48 5.15 1.35 -1.35 -2.01 112.91 116.73 2dvt h THR 316 Ca 0.00 -0.72 -0.01 0.00 -0.55 0.00 0.00 66.41 65.13 2dvt h THR 316 Cb 0.00 1.30 -0.02 0.00 -1.73 0.00 0.00 68.15 67.69 2dvt h THR 316 CO 0.00 0.21 0.26 0.78 -0.25 0.00 0.00 175.52 176.52 2dvt h ASN 317 N 0.10 0.60 -0.41 5.36 2.35 -1.24 -0.98 115.58 121.36 2dvt h ASN 317 Ca 0.02 -0.10 -0.13 0.00 -0.55 0.00 0.00 56.30 55.54 2dvt h ASN 317 Cb 0.36 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 2dvt h ASN 317 CO 0.02 0.53 -0.25 0.00 -1.65 0.00 0.00 177.43 176.08 2dvt h ALA 318 N 1.10 0.58 -0.25 -0.83 0.00 -1.71 -0.61 119.26 117.53 2dvt h ALA 318 Ca 0.17 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 2dvt h ALA 318 Cb 0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2dvt h ALA 318 CO -0.03 0.58 -0.06 0.00 0.00 0.00 0.00 179.25 179.75 2dvt h ARG 319 N 0.70 0.40 -0.05 0.00 3.08 -1.19 -0.28 114.38 117.03 2dvt h ARG 319 Ca 0.08 -0.09 -0.05 0.00 0.07 0.00 0.00 59.98 59.99 2dvt h ARG 319 Cb 0.83 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.82 2dvt h ARG 319 CO 0.07 0.47 -0.17 0.00 -1.07 0.00 0.00 179.97 179.27 2dvt h ARG 320 N 0.38 0.21 -0.91 0.04 2.47 -1.02 0.15 114.38 115.69 2dvt h ARG 320 Ca 0.08 -0.15 0.00 0.00 -1.26 0.00 0.00 59.98 58.65 2dvt h ARG 320 Cb 0.35 0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 28.65 2dvt h ARG 320 CO 0.02 0.78 0.58 1.25 0.56 0.00 0.00 179.97 183.16 2dvt h LEU 321 N -0.33 1.07 -2.79 3.04 5.85 -0.80 -2.50 115.31 118.85 2dvt h LEU 321 Ca -0.01 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.67 2dvt h LEU 321 Cb 0.80 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.56 2dvt h LEU 321 CO 0.04 0.79 0.00 0.49 -0.34 0.00 0.00 178.44 179.42 2dvt n PHE 322 N -4.42 1.37 -3.93 1.25 3.01 -0.14 -4.89 117.46 109.71 2dvt n PHE 322 Ca 0.10 -0.53 -0.27 0.00 1.01 0.00 0.00 57.45 57.76 2dvt n PHE 322 Cb 0.03 -0.26 0.00 0.00 -0.01 0.00 0.00 39.48 39.24 2dvt n PHE 322 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2dvt n LYS 323 N 0.87 -4.13 0.00 -1.08 5.02 -0.94 -5.03 118.16 112.88 2dvt n LYS 323 Ca 0.22 0.49 0.15 0.00 -2.02 0.00 0.00 58.31 57.15 2dvt n LYS 323 Cb 0.83 -4.98 0.71 0.00 -0.02 0.00 0.00 35.03 31.57 2dvt n LYS 323 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16