#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bdf n GLN 2 N 0.00 0.00 -3.57 0.03 1.13 -1.26 -5.16 117.38 108.55 1bdf n GLN 2 Ca 0.00 0.00 -0.16 0.00 -1.94 0.00 0.00 57.00 54.90 1bdf n GLN 2 Cb 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.29 1bdf n GLN 2 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1bdf s GLY 3 N -2.40 -0.56 0.00 1.08 0.00 -1.26 -5.09 107.32 99.09 1bdf s GLY 3 Ca 0.00 1.64 0.00 0.00 0.00 0.00 0.00 44.72 46.36 1bdf s GLY 3 CO 0.00 1.32 0.00 -1.26 0.00 0.00 0.00 173.10 173.16 1bdf n SER 4 N 1.71 -6.70 -1.29 1.64 2.88 -1.26 -4.77 113.62 105.83 1bdf n SER 4 Ca -0.17 0.65 0.00 0.00 -1.33 0.00 0.00 58.87 58.03 1bdf n SER 4 Cb 0.56 -1.46 0.00 0.00 -0.75 0.00 0.00 64.21 62.57 1bdf n SER 4 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1bdf n VAL 5 N 1.88 -6.51 0.00 2.46 0.31 -1.26 -5.12 118.33 110.09 1bdf n VAL 5 Ca 0.00 1.30 0.00 0.00 -0.01 0.00 0.00 64.34 65.63 1bdf n VAL 5 Cb 0.22 -3.75 0.00 0.00 -0.91 0.00 0.00 33.84 29.40 1bdf n VAL 5 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1bdf n THR 6 N 0.73 0.00 0.07 2.52 -2.24 -1.26 -4.87 114.28 109.23 1bdf n THR 6 Ca 0.00 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.63 1bdf n THR 6 Cb 0.00 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.17 1bdf n THR 6 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1bdf h GLU 7 N 0.00 0.45 -6.11 -0.78 5.08 -2.01 -3.45 114.58 107.76 1bdf h GLU 7 Ca 0.00 -0.51 -0.62 0.00 -1.00 0.00 0.00 59.36 57.23 1bdf h GLU 7 Cb 0.00 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1bdf h GLU 7 CO 0.00 1.16 1.32 1.19 -1.00 0.00 0.00 179.01 181.68 1bdf n PHE 8 N -3.75 2.02 -2.19 4.33 3.72 -1.26 -4.95 117.46 115.39 1bdf n PHE 8 Ca -0.08 0.01 -0.39 0.00 -0.05 0.00 0.00 57.45 56.94 1bdf n PHE 8 Cb 0.86 -2.66 -0.02 0.00 -0.94 0.00 0.00 39.48 36.73 1bdf n PHE 8 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1bdf s LEU 9 N 6.32 4.29 -0.01 4.37 1.43 -1.26 -5.03 118.68 128.79 1bdf s LEU 9 Ca 1.00 2.52 -0.00 0.00 -1.03 0.00 0.00 54.13 56.62 1bdf s LEU 9 Cb -0.62 -3.85 -0.04 0.00 0.03 0.00 0.00 46.19 41.71 1bdf s LEU 9 CO 0.45 -0.65 0.05 -1.59 0.23 0.00 0.00 176.35 174.85 1bdf s LYS 10 N -2.07 2.97 0.52 1.70 0.00 -1.26 -4.41 119.74 117.18 1bdf s LYS 10 Ca 0.54 -0.51 -0.06 0.00 0.00 0.00 0.00 55.97 55.93 1bdf s LYS 10 Cb -0.35 -2.79 -0.03 0.00 0.00 0.00 0.00 37.83 34.66 1bdf s LYS 10 CO 0.46 0.65 0.84 -1.25 0.00 0.00 0.00 175.35 176.04 1bdf s PRO 11 N -1.58 3.42 -0.02 1.78 0.04 -0.70 -4.47 135.00 133.46 1bdf s PRO 11 Ca 0.21 0.22 -0.18 0.00 0.04 0.00 0.00 61.00 61.28 1bdf s PRO 11 Cb -0.12 -2.32 0.03 0.00 0.04 0.00 0.00 34.50 32.14 1bdf s PRO 11 CO 0.11 -0.35 0.39 -0.98 0.04 0.00 0.00 177.00 176.22 1bdf s ARG 12 N -4.84 0.77 -0.24 4.56 1.70 -1.26 -4.91 118.95 114.73 1bdf s ARG 12 Ca 0.50 -0.11 -0.28 0.00 -0.47 0.00 0.00 55.73 55.36 1bdf s ARG 12 Cb -0.10 0.35 -0.06 0.00 -0.57 0.00 0.00 34.95 34.57 1bdf s ARG 12 CO 0.46 -0.22 2.23 -0.11 -1.08 0.00 0.00 175.30 176.58 1bdf n LEU 13 N 1.14 3.14 -0.01 -1.89 0.00 -1.26 -2.28 117.00 115.84 1bdf n LEU 13 Ca -0.21 0.18 0.09 0.00 0.00 0.00 0.00 56.01 56.07 1bdf n LEU 13 Cb 0.56 -1.54 -0.13 0.00 0.00 0.00 0.00 43.42 42.32 1bdf n LEU 13 CO 0.22 -0.73 -0.51 0.55 0.00 0.00 0.00 177.39 176.92 1bdf n VAL 14 N 7.75 0.00 -3.56 1.96 3.14 0.82 -4.98 118.33 123.45 1bdf n VAL 14 Ca 0.31 -0.31 -0.12 0.00 -2.96 0.00 0.00 64.34 61.26 1bdf n VAL 14 Cb 0.44 0.36 -0.05 0.00 -1.06 0.00 0.00 33.84 33.53 1bdf n VAL 14 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1bdf s ASP 15 N -3.62 -0.43 -0.11 6.55 -1.08 -1.21 -5.01 116.67 111.76 1bdf s ASP 15 Ca -0.03 0.46 -0.02 0.00 -0.52 0.00 0.00 52.55 52.45 1bdf s ASP 15 Cb 0.12 0.36 0.04 0.00 -1.46 0.00 0.00 42.92 41.98 1bdf s ASP 15 CO 0.73 -0.41 0.03 -0.63 0.52 0.00 0.00 175.17 175.41 1bdf s ILE 16 N -1.17 0.29 -0.46 4.11 1.01 -1.26 -2.26 121.20 121.46 1bdf s ILE 16 Ca -0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 60.65 60.54 1bdf s ILE 16 Cb -0.00 -0.61 0.12 0.00 0.01 0.00 0.00 42.46 41.98 1bdf s ILE 16 CO 0.03 0.07 0.27 -0.70 0.00 0.00 0.00 174.94 174.61 1bdf s GLU 17 N 1.99 2.16 -0.82 2.79 2.12 -0.63 -4.94 118.70 121.38 1bdf s GLU 17 Ca 0.03 -1.96 -0.25 0.00 0.36 0.00 0.00 54.97 53.15 1bdf s GLU 17 Cb -0.14 -3.65 0.00 0.00 0.26 0.00 0.00 34.13 30.61 1bdf s GLU 17 CO -0.06 -1.11 1.62 -0.65 -0.54 0.00 0.00 175.26 174.52 1bdf s GLN 18 N 0.91 3.00 0.56 4.30 -1.52 -1.26 -1.06 119.66 124.59 1bdf s GLN 18 Ca 0.10 -0.26 0.25 0.00 -1.95 0.00 0.00 55.36 53.49 1bdf s GLN 18 Cb -0.23 -4.73 1.59 0.00 -0.22 0.00 0.00 33.01 29.43 1bdf s GLN 18 CO -0.04 -2.59 2.20 0.28 -0.25 0.00 0.00 175.29 174.89 1bdf h VAL 19 N 6.72 0.70 -1.57 1.09 2.07 -0.13 -3.46 116.25 121.67 1bdf h VAL 19 Ca -0.07 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.38 1bdf h VAL 19 Cb 1.06 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1bdf h VAL 19 CO 1.29 0.02 0.00 -1.54 0.02 0.00 0.00 177.57 177.35 1bdf n SER 20 N -4.07 0.00 0.23 0.57 3.41 -0.45 -4.95 113.62 108.37 1bdf n SER 20 Ca -0.03 -0.76 0.10 0.00 -0.26 0.00 0.00 58.87 57.92 1bdf n SER 20 Cb 0.10 0.00 0.52 0.00 -0.26 0.00 0.00 64.21 64.58 1bdf n SER 20 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1bdf h SER 21 N 0.00 0.00 0.00 4.04 4.64 -2.02 -3.29 113.55 116.92 1bdf h SER 21 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1bdf h SER 21 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1bdf h SER 21 CO 0.00 0.21 -0.06 0.35 -0.87 0.00 0.00 176.83 176.45 1bdf n THR 22 N -3.45 0.69 -3.80 2.95 -2.24 -1.26 -4.75 114.28 102.42 1bdf n THR 22 Ca -0.00 -0.75 -0.22 0.00 -2.27 0.00 0.00 64.05 60.80 1bdf n THR 22 Cb 0.39 0.55 -0.17 0.00 -2.10 0.00 0.00 70.33 68.99 1bdf n THR 22 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1bdf s HIS 23 N -0.85 0.59 0.24 4.78 5.65 -1.24 -0.88 115.29 123.59 1bdf s HIS 23 Ca 0.05 -0.12 0.01 0.00 0.25 0.00 0.00 55.06 55.25 1bdf s HIS 23 Cb 0.04 -0.74 -0.05 0.00 -1.18 0.00 0.00 32.58 30.66 1bdf s HIS 23 CO 0.00 -0.29 0.10 0.00 -0.65 0.00 0.00 174.74 173.90 1bdf s ALA 24 N 1.86 1.60 -0.32 1.58 0.00 -0.02 0.64 121.76 127.11 1bdf s ALA 24 Ca 0.03 -1.82 -0.01 0.00 0.00 0.00 0.00 51.96 50.16 1bdf s ALA 24 Cb -0.12 1.07 0.10 0.00 0.00 0.00 0.00 23.12 24.17 1bdf s ALA 24 CO -0.04 -0.47 0.11 0.15 0.00 0.00 0.00 175.76 175.51 1bdf s LYS 25 N -4.05 0.68 0.11 0.00 1.02 -0.23 -0.60 119.74 116.68 1bdf s LYS 25 Ca 0.37 -1.07 -0.14 0.00 0.02 0.00 0.00 55.97 55.14 1bdf s LYS 25 Cb 0.08 -1.90 -0.07 0.00 -0.52 0.00 0.00 37.83 35.42 1bdf s LYS 25 CO 0.13 -1.01 0.52 0.08 -0.92 0.00 0.00 175.35 174.15 1bdf s VAL 26 N 1.59 4.88 -0.11 3.17 1.01 0.43 -1.60 120.40 129.77 1bdf s VAL 26 Ca 0.10 0.84 -0.01 0.00 0.00 0.00 0.00 61.98 62.91 1bdf s VAL 26 Cb -0.18 -3.75 0.04 0.00 0.00 0.00 0.00 36.38 32.49 1bdf s VAL 26 CO -0.25 0.32 -0.01 0.42 0.00 0.00 0.00 175.10 175.59 1bdf s THR 27 N -1.37 0.60 -0.21 3.92 -4.23 -0.96 0.73 115.64 114.12 1bdf s THR 27 Ca 0.35 -0.17 -0.14 0.00 -1.18 0.00 0.00 61.69 60.54 1bdf s THR 27 Cb -0.16 -0.81 -0.04 0.00 1.34 0.00 0.00 72.50 72.83 1bdf s THR 27 CO 0.18 0.16 0.32 -0.76 -0.54 0.00 0.00 174.62 173.99 1bdf s LEU 28 N 1.87 4.15 0.00 4.79 1.43 -0.16 -0.12 118.68 130.64 1bdf s LEU 28 Ca 0.03 0.40 0.00 0.00 -1.03 0.00 0.00 54.13 53.54 1bdf s LEU 28 Cb -0.14 -2.39 0.00 0.00 0.03 0.00 0.00 46.19 43.70 1bdf s LEU 28 CO -0.07 -0.02 0.00 1.21 0.23 0.00 0.00 176.35 177.71 1bdf n GLU 29 N 4.32 0.00 -1.53 1.70 2.13 -0.97 -0.14 120.64 126.16 1bdf n GLU 29 Ca -0.11 0.04 -0.38 0.00 0.66 0.00 0.00 57.16 57.37 1bdf n GLU 29 Cb 0.51 -0.32 -0.08 0.00 0.27 0.00 0.00 31.44 31.83 1bdf n GLU 29 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 1bdf n PRO 30 N -1.89 0.61 -3.85 5.31 -0.02 -1.26 -3.89 135.00 130.00 1bdf n PRO 30 Ca 0.00 -0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.20 1bdf n PRO 30 Cb 0.00 -2.63 -0.17 0.00 -0.02 0.00 0.00 33.50 30.68 1bdf n PRO 30 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1bdf s LEU 31 N 10.88 1.43 0.60 2.45 1.43 -1.09 -1.72 118.68 132.65 1bdf s LEU 31 Ca 1.14 -0.62 -0.19 0.00 -1.03 0.00 0.00 54.13 53.43 1bdf s LEU 31 Cb -0.63 -0.81 -0.03 0.00 0.03 0.00 0.00 46.19 44.75 1bdf s LEU 31 CO 0.36 -0.20 1.28 -1.61 0.23 0.00 0.00 176.35 176.40 1bdf s GLU 32 N 1.70 2.88 0.18 1.70 0.41 -1.26 -1.56 118.70 122.75 1bdf s GLU 32 Ca 0.01 2.02 -0.32 0.00 -0.41 0.00 0.00 54.97 56.27 1bdf s GLU 32 Cb -0.15 -1.99 -0.16 0.00 -1.78 0.00 0.00 34.13 30.05 1bdf s GLU 32 CO -0.07 -1.33 1.03 0.54 -0.49 0.00 0.00 175.26 174.93 1bdf n ARG 33 N -1.54 0.91 0.00 1.61 5.12 -1.26 -1.37 116.66 120.13 1bdf n ARG 33 Ca 0.14 0.32 0.00 0.00 -1.93 0.00 0.00 57.85 56.38 1bdf n ARG 33 Cb 0.48 -1.72 0.00 0.00 -1.16 0.00 0.00 32.46 30.06 1bdf n ARG 33 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1bdf n GLY 34 N 1.83 2.96 0.11 -0.13 0.00 -1.26 -4.84 105.19 103.85 1bdf n GLY 34 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.30 1bdf n GLY 34 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1bdf h PHE 35 N 0.00 0.00 0.68 1.61 0.04 -1.56 -3.09 116.94 114.62 1bdf h PHE 35 Ca 0.00 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 1bdf h PHE 35 Cb 0.00 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.16 1bdf h PHE 35 CO 0.00 0.00 -0.32 0.78 -0.60 0.00 0.00 178.31 178.17 1bdf h GLY 36 N 4.49 -0.95 2.00 -1.45 0.00 -1.89 -2.12 103.07 103.15 1bdf h GLY 36 Ca 0.00 0.35 -0.09 0.00 0.00 0.00 0.00 47.33 47.59 1bdf h GLY 36 CO 0.00 -0.34 -0.44 0.45 0.00 0.00 0.00 176.54 176.20 1bdf h HIS 37 N -0.98 0.00 -0.01 5.60 3.86 -1.97 0.31 115.15 121.96 1bdf h HIS 37 Ca -0.09 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.11 1bdf h HIS 37 Cb 0.72 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.19 1bdf h HIS 37 CO -0.02 0.44 -0.00 1.15 0.86 0.00 0.00 177.93 180.37 1bdf h THR 38 N 0.00 1.27 -0.09 2.45 2.02 -1.47 -0.76 112.91 116.32 1bdf h THR 38 Ca -0.00 -0.79 -0.20 0.00 0.77 0.00 0.00 66.41 66.18 1bdf h THR 38 Cb 0.80 1.78 0.01 0.00 -1.74 0.00 0.00 68.15 69.00 1bdf h THR 38 CO 0.06 0.21 -0.72 -0.07 0.37 0.00 0.00 175.52 175.37 1bdf h LEU 39 N -0.30 0.80 -0.74 2.58 3.38 -1.37 -2.70 115.31 116.95 1bdf h LEU 39 Ca 0.00 -0.67 0.12 0.00 0.09 0.00 0.00 57.88 57.43 1bdf h LEU 39 Cb 0.34 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.77 1bdf h LEU 39 CO 0.00 1.34 0.33 1.23 0.09 0.00 0.00 178.44 181.44 1bdf h GLY 40 N 0.31 1.13 1.79 0.83 0.00 -0.35 0.22 103.07 106.99 1bdf h GLY 40 Ca -0.06 -0.19 -0.22 0.00 0.00 0.00 0.00 47.33 46.87 1bdf h GLY 40 CO 0.15 -0.03 -0.97 3.43 0.00 0.00 0.00 176.54 179.12 1bdf h ASN 41 N 0.52 0.25 0.16 0.19 4.21 -1.20 -1.24 115.58 118.47 1bdf h ASN 41 Ca 0.39 -0.22 -0.01 0.00 1.21 0.00 0.00 56.30 57.67 1bdf h ASN 41 Cb 0.52 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 37.64 1bdf h ASN 41 CO -0.34 1.08 -0.07 0.00 -1.29 0.00 0.00 177.43 176.81 1bdf h ALA 42 N 0.89 -0.21 0.07 -0.83 0.00 -0.94 -2.81 119.26 115.44 1bdf h ALA 42 Ca -0.06 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1bdf h ALA 42 Cb 1.65 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.52 1bdf h ALA 42 CO 0.15 -0.48 -0.03 -0.07 0.00 0.00 0.00 179.25 178.82 1bdf h LEU 43 N -0.49 -0.08 -1.95 0.00 3.38 -0.70 -2.61 115.31 112.85 1bdf h LEU 43 Ca -0.02 -0.23 0.22 0.00 0.09 0.00 0.00 57.88 57.93 1bdf h LEU 43 Cb 0.38 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 1bdf h LEU 43 CO 0.04 0.19 0.60 -0.09 0.09 0.00 0.00 178.44 179.27 1bdf h ARG 44 N -0.35 0.00 0.07 1.13 2.43 -1.28 0.31 114.38 116.68 1bdf h ARG 44 Ca -0.01 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 58.91 1bdf h ARG 44 Cb 0.31 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 1bdf h ARG 44 CO 0.02 0.00 -1.21 0.00 -1.51 0.00 0.00 179.97 177.27 1bdf h ALA 45 N 1.49 0.26 -0.03 2.80 0.00 -1.23 -2.25 119.26 120.32 1bdf h ALA 45 Ca 0.35 -0.96 -0.12 0.00 0.00 0.00 0.00 54.91 54.18 1bdf h ALA 45 Cb 1.56 0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.36 1bdf h ALA 45 CO -0.00 1.15 -0.45 0.82 0.00 0.00 0.00 179.25 180.76 1bdf h ILE 46 N 0.04 1.45 -0.28 0.00 1.08 -0.19 -3.20 117.51 116.40 1bdf h ILE 46 Ca -0.11 -1.95 -0.00 0.00 -0.39 0.00 0.00 64.86 62.41 1bdf h ILE 46 Cb 1.90 2.54 -0.01 0.00 -3.07 0.00 0.00 36.82 38.17 1bdf h ILE 46 CO 0.16 0.56 0.16 -0.07 -0.69 0.00 0.00 178.15 178.27 1bdf h LEU 47 N -0.18 0.35 0.00 1.44 3.38 -0.76 0.30 115.31 119.83 1bdf h LEU 47 Ca -0.05 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1bdf h LEU 47 Cb 1.16 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1bdf h LEU 47 CO 0.09 0.32 0.00 0.18 0.09 0.00 0.00 178.44 179.12 1bdf n LEU 48 N -4.84 0.00 0.00 1.67 4.77 -0.84 -4.29 117.00 113.47 1bdf n LEU 48 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1bdf n LEU 48 Cb 0.07 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1bdf n LEU 48 CO 0.35 0.00 0.00 -1.54 -1.33 0.00 0.00 177.39 174.87 1bdf n SER 49 N -0.69 0.00 -0.47 -1.43 3.41 -1.01 -4.98 113.62 108.44 1bdf n SER 49 Ca 0.05 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.71 1bdf n SER 49 Cb 0.02 0.00 0.11 0.00 -0.26 0.00 0.00 64.21 64.09 1bdf n SER 49 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1bdf n SER 50 N 0.00 2.68 -4.75 4.04 7.64 0.10 -4.56 113.62 118.78 1bdf n SER 50 Ca 0.00 -1.99 -0.40 0.00 1.01 0.00 0.00 58.87 57.49 1bdf n SER 50 Cb 0.00 -0.17 -0.05 0.00 -1.01 0.00 0.00 64.21 62.98 1bdf n SER 50 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1bdf s MET 51 N -1.00 4.80 0.00 1.43 -1.94 -1.21 -4.99 119.30 116.39 1bdf s MET 51 Ca 0.17 1.52 0.00 0.00 -1.71 0.00 0.00 55.69 55.67 1bdf s MET 51 Cb 0.09 -3.29 0.00 0.00 2.01 0.00 0.00 34.83 33.64 1bdf s MET 51 CO 0.12 0.41 0.00 -2.30 -0.01 0.00 0.00 175.02 173.24 1bdf n PRO 52 N 1.78 0.00 0.00 2.03 -0.02 -1.26 -4.42 135.00 133.11 1bdf n PRO 52 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 1bdf n PRO 52 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.95 1bdf n PRO 52 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bdf n GLY 53 N 0.60 -0.54 3.71 -1.23 0.00 -1.24 -3.93 105.19 102.55 1bdf n GLY 53 Ca 0.00 -1.54 -0.32 0.00 0.00 0.00 0.00 46.02 44.17 1bdf n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bdf s ALA 55 N -1.22 -1.14 0.02 0.00 0.00 0.23 -4.70 121.76 114.94 1bdf s ALA 55 Ca 0.24 0.92 -0.30 0.00 0.00 0.00 0.00 51.96 52.81 1bdf s ALA 55 Cb -0.12 -0.26 -0.05 0.00 0.00 0.00 0.00 23.12 22.70 1bdf s ALA 55 CO 0.15 -0.27 1.29 0.08 0.00 0.00 0.00 175.76 177.01 1bdf s VAL 56 N -0.72 3.91 -0.07 0.00 1.01 -1.26 -0.64 120.40 122.63 1bdf s VAL 56 Ca -0.08 1.32 0.04 0.00 0.00 0.00 0.00 61.98 63.26 1bdf s VAL 56 Cb -0.03 -3.85 -0.07 0.00 0.00 0.00 0.00 36.38 32.43 1bdf s VAL 56 CO 0.04 0.04 -0.01 0.35 0.00 0.00 0.00 175.10 175.52 1bdf n THR 57 N 4.36 0.46 -4.06 3.92 -2.24 -0.14 -4.47 114.28 112.10 1bdf n THR 57 Ca 0.11 -0.24 -0.07 0.00 -2.27 0.00 0.00 64.05 61.57 1bdf n THR 57 Cb 0.45 -0.82 -0.10 0.00 -2.10 0.00 0.00 70.33 67.76 1bdf n THR 57 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1bdf s GLU 58 N -2.16 0.58 -0.10 -0.78 2.02 -1.24 -1.10 118.70 115.92 1bdf s GLU 58 Ca -0.06 -1.11 -0.08 0.00 0.02 0.00 0.00 54.97 53.74 1bdf s GLU 58 Cb 0.02 0.20 0.03 0.00 0.10 0.00 0.00 34.13 34.48 1bdf s GLU 58 CO 0.24 -0.11 0.25 0.08 0.02 0.00 0.00 175.26 175.74 1bdf s VAL 59 N -3.53 -0.00 -0.38 2.63 1.01 -0.44 -0.43 120.40 119.26 1bdf s VAL 59 Ca 0.03 0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.05 1bdf s VAL 59 Cb 0.05 -0.36 0.11 0.00 0.00 0.00 0.00 36.38 36.18 1bdf s VAL 59 CO -0.09 0.00 0.12 -0.70 0.00 0.00 0.00 175.10 174.44 1bdf s GLU 60 N 0.23 1.37 -0.10 2.72 2.12 -0.54 -1.77 118.70 122.73 1bdf s GLU 60 Ca -0.01 -1.84 -0.15 0.00 0.36 0.00 0.00 54.97 53.33 1bdf s GLU 60 Cb -0.02 -2.86 -0.05 0.00 0.26 0.00 0.00 34.13 31.46 1bdf s GLU 60 CO -0.00 -1.00 0.38 0.42 -0.54 0.00 0.00 175.26 174.51 1bdf s ILE 61 N 0.79 5.19 0.19 -3.70 1.01 -1.26 -1.68 121.20 121.74 1bdf s ILE 61 Ca 0.13 0.75 -0.31 0.00 0.00 0.00 0.00 60.65 61.22 1bdf s ILE 61 Cb -0.20 -3.71 -0.10 0.00 0.01 0.00 0.00 42.46 38.46 1bdf s ILE 61 CO -0.10 0.44 1.49 -1.81 0.00 0.00 0.00 174.94 174.96 1bdf s ASP 62 N -0.03 6.64 0.00 3.58 1.01 -0.40 -2.75 116.67 124.73 1bdf s ASP 62 Ca 0.22 2.60 0.00 0.00 0.71 0.00 0.00 52.55 56.08 1bdf s ASP 62 Cb -0.15 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.18 1bdf s ASP 62 CO 0.09 -0.75 0.00 0.61 0.21 0.00 0.00 175.17 175.33 1bdf n GLY 63 N 3.05 3.01 3.61 0.21 0.00 -1.26 -4.86 105.19 108.95 1bdf n GLY 63 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1bdf n GLY 63 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bdf s VAL 64 N -1.52 4.91 -0.11 1.61 1.01 -1.11 -4.94 120.40 120.24 1bdf s VAL 64 Ca 0.00 0.99 0.15 0.00 0.00 0.00 0.00 61.98 63.13 1bdf s VAL 64 Cb 0.00 -4.03 -0.07 0.00 0.00 0.00 0.00 36.38 32.28 1bdf s VAL 64 CO 0.00 -0.14 1.09 0.17 0.00 0.00 0.00 175.10 176.22 1bdf h LEU 65 N 9.20 0.00 -7.02 3.92 -0.00 -1.94 -3.43 115.31 116.04 1bdf h LEU 65 Ca -0.26 0.00 0.13 0.00 -0.00 0.00 0.00 57.88 57.75 1bdf h LEU 65 Cb 1.11 0.00 -0.15 0.00 -0.00 0.00 0.00 40.66 41.62 1bdf h LEU 65 CO 0.82 0.60 0.53 -1.38 -0.00 0.00 0.00 178.44 179.01 1bdf s HIS 66 N -2.91 -0.32 -0.07 0.17 -3.43 -1.26 -4.93 115.29 102.54 1bdf s HIS 66 Ca -0.00 0.19 0.03 0.00 -0.80 0.00 0.00 55.06 54.48 1bdf s HIS 66 Cb 0.08 0.54 0.17 0.00 -1.43 0.00 0.00 32.58 31.94 1bdf s HIS 66 CO 0.79 -0.52 0.82 -0.85 -2.00 0.00 0.00 174.74 172.98 1bdf n GLU 67 N -0.24 0.02 -3.14 -0.38 0.00 -1.26 -4.50 120.64 111.16 1bdf n GLU 67 Ca -0.08 0.32 -0.44 0.00 0.00 0.00 0.00 57.16 56.96 1bdf n GLU 67 Cb 0.61 -2.01 -0.06 0.00 0.00 0.00 0.00 31.44 29.99 1bdf n GLU 67 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 1bdf s TYR 68 N -2.70 3.02 0.00 -1.84 1.51 -1.26 -3.64 117.35 112.45 1bdf s TYR 68 Ca -0.00 -0.71 0.00 0.00 -1.01 0.00 0.00 57.07 55.35 1bdf s TYR 68 Cb 0.01 -3.73 0.00 0.00 -0.11 0.00 0.00 41.96 38.13 1bdf s TYR 68 CO 0.03 -1.14 0.00 0.43 -1.11 0.00 0.00 175.55 173.75 1bdf n SER 69 N 6.26 0.00 -2.25 2.29 7.64 -1.26 -5.00 113.62 121.29 1bdf n SER 69 Ca -0.08 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.77 1bdf n SER 69 Cb 0.44 -0.05 -0.03 0.00 -1.01 0.00 0.00 64.21 63.56 1bdf n SER 69 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1bdf n THR 70 N -0.05 -9.72 -3.43 0.44 -1.04 -1.26 -4.80 114.28 94.42 1bdf n THR 70 Ca 0.00 1.86 -0.14 0.00 -2.04 0.00 0.00 64.05 63.73 1bdf n THR 70 Cb 0.00 -5.63 -0.11 0.00 -1.82 0.00 0.00 70.33 62.77 1bdf n THR 70 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1bdf s LYS 71 N -0.81 0.26 -0.43 -2.82 2.47 -1.26 -4.87 119.74 112.27 1bdf s LYS 71 Ca -0.18 0.36 -0.29 0.00 -1.56 0.00 0.00 55.97 54.30 1bdf s LYS 71 Cb 0.01 -0.87 0.01 0.00 -1.46 0.00 0.00 37.83 35.52 1bdf s LYS 71 CO 0.54 -0.65 1.41 -2.00 0.16 0.00 0.00 175.35 174.82 1bdf s GLU 72 N 2.43 3.54 0.00 4.03 2.12 -1.26 -3.28 118.70 126.27 1bdf s GLU 72 Ca 0.09 0.87 0.00 0.00 0.36 0.00 0.00 54.97 56.29 1bdf s GLU 72 Cb -0.16 -4.04 0.00 0.00 0.26 0.00 0.00 34.13 30.20 1bdf s GLU 72 CO -0.14 -1.61 0.00 0.41 -0.54 0.00 0.00 175.26 173.38 1bdf n GLY 73 N 5.10 1.04 3.13 -1.50 0.00 -1.26 -4.67 105.19 107.03 1bdf n GLY 73 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1bdf n GLY 73 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bdf s VAL 74 N -2.00 1.78 0.09 1.61 1.01 -1.21 0.45 120.40 122.13 1bdf s VAL 74 Ca 0.00 -0.82 -0.31 0.00 0.00 0.00 0.00 61.98 60.85 1bdf s VAL 74 Cb 0.00 -1.58 -0.14 0.00 0.00 0.00 0.00 36.38 34.66 1bdf s VAL 74 CO 0.00 0.50 1.49 -0.61 0.00 0.00 0.00 175.10 176.48 1bdf h GLN 75 N 7.19 -0.69 -6.67 2.72 4.15 -0.62 -3.44 115.11 117.75 1bdf h GLN 75 Ca -0.29 0.05 -0.50 0.00 0.77 0.00 0.00 58.65 58.68 1bdf h GLN 75 Cb 1.20 0.16 -0.03 0.00 0.21 0.00 0.00 27.48 29.02 1bdf h GLN 75 CO 0.51 -0.46 0.11 -1.83 -1.93 0.00 0.00 178.83 175.22 1bdf s GLU 76 N -5.46 4.11 0.73 1.69 1.03 -1.26 -5.07 118.70 114.47 1bdf s GLU 76 Ca -0.15 0.76 -0.11 0.00 0.03 0.00 0.00 54.97 55.51 1bdf s GLU 76 Cb 0.05 -2.61 0.03 0.00 -0.80 0.00 0.00 34.13 30.80 1bdf s GLU 76 CO 0.54 0.25 1.08 0.16 -1.33 0.00 0.00 175.26 175.96 1bdf s ASP 77 N -2.01 4.88 0.37 0.83 1.47 -1.26 -4.78 116.67 116.16 1bdf s ASP 77 Ca 0.50 1.77 0.16 0.00 1.18 0.00 0.00 52.55 56.16 1bdf s ASP 77 Cb -0.13 -2.51 1.07 0.00 -0.34 0.00 0.00 42.92 41.01 1bdf s ASP 77 CO 0.19 -1.78 1.72 0.40 0.68 0.00 0.00 175.17 176.38 1bdf h ILE 78 N -0.87 0.45 -0.29 2.11 1.08 -1.87 0.17 117.51 118.30 1bdf h ILE 78 Ca -0.44 -0.14 -0.01 0.00 -0.39 0.00 0.00 64.86 63.89 1bdf h ILE 78 Cb 1.22 0.01 -0.01 0.00 -3.07 0.00 0.00 36.82 34.97 1bdf h ILE 78 CO 0.53 0.07 0.16 -0.07 -0.69 0.00 0.00 178.15 178.16 1bdf h LEU 79 N 0.41 0.36 -1.75 1.44 3.38 -1.91 -0.67 115.31 116.56 1bdf h LEU 79 Ca 0.66 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.54 1bdf h LEU 79 Cb 1.57 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.21 1bdf h LEU 79 CO -0.41 0.34 0.08 -0.33 0.09 0.00 0.00 178.44 178.21 1bdf h GLU 80 N 0.35 0.24 -0.26 1.13 5.08 -1.03 -0.58 114.58 119.51 1bdf h GLU 80 Ca 0.10 -0.02 -0.16 0.00 -1.00 0.00 0.00 59.36 58.28 1bdf h GLU 80 Cb 0.06 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1bdf h GLU 80 CO -0.02 0.20 -0.45 0.82 -1.00 0.00 0.00 179.01 178.56 1bdf h ILE 81 N 0.25 1.30 -0.53 3.13 2.04 -0.53 -1.23 117.51 121.93 1bdf h ILE 81 Ca 0.06 -1.65 -0.07 0.00 1.00 0.00 0.00 64.86 64.20 1bdf h ILE 81 Cb 0.04 1.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 1bdf h ILE 81 CO -0.01 0.53 0.04 -0.07 0.00 0.00 0.00 178.15 178.64 1bdf h LEU 82 N 0.50 0.84 -1.30 1.44 3.38 -0.37 0.22 115.31 120.02 1bdf h LEU 82 Ca 0.02 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.72 1bdf h LEU 82 Cb 1.05 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1bdf h LEU 82 CO 0.10 0.88 -0.28 0.25 0.09 0.00 0.00 178.44 179.48 1bdf h LEU 83 N 0.82 0.10 -0.12 1.67 5.85 -1.04 -1.46 115.31 121.13 1bdf h LEU 83 Ca 0.16 -0.03 -0.24 0.00 0.84 0.00 0.00 57.88 58.61 1bdf h LEU 83 Cb 0.43 -0.03 0.01 0.00 0.37 0.00 0.00 40.66 41.45 1bdf h LEU 83 CO 0.02 0.39 -0.91 0.78 -0.34 0.00 0.00 178.44 178.38 1bdf h ASN 84 N 0.09 0.83 0.36 1.25 2.35 0.00 -3.20 115.58 117.26 1bdf h ASN 84 Ca 0.01 -0.61 -0.06 0.00 -0.55 0.00 0.00 56.30 55.09 1bdf h ASN 84 Cb 0.55 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 1bdf h ASN 84 CO 0.04 1.41 -0.30 -0.07 -1.65 0.00 0.00 177.43 176.86 1bdf h LEU 85 N 0.41 0.00 -1.19 1.61 3.38 -0.18 -2.81 115.31 116.54 1bdf h LEU 85 Ca -0.09 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.90 1bdf h LEU 85 Cb 1.54 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.25 1bdf h LEU 85 CO 0.18 0.30 0.55 0.11 0.09 0.00 0.00 178.44 179.66 1bdf h LYS 86 N 0.00 1.08 -0.61 1.13 1.57 -1.27 -1.19 116.57 117.28 1bdf h LYS 86 Ca -0.00 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1bdf h LYS 86 Cb 0.55 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1bdf h LYS 86 CO 0.04 0.72 0.00 0.41 -0.57 0.00 0.00 179.45 180.04 1bdf n GLY 87 N -1.41 0.78 3.57 3.86 0.00 -1.06 -4.77 105.19 106.16 1bdf n GLY 87 Ca 0.10 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1bdf n GLY 87 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1bdf s LEU 88 N -0.59 3.61 -0.45 0.99 0.20 -0.45 -4.97 118.68 117.02 1bdf s LEU 88 Ca 0.06 0.03 -0.23 0.00 0.69 0.00 0.00 54.13 54.67 1bdf s LEU 88 Cb 0.04 -3.11 0.02 0.00 -0.43 0.00 0.00 46.19 42.72 1bdf s LEU 88 CO 0.03 -1.41 0.80 0.00 -0.29 0.00 0.00 176.35 175.48 1bdf s ALA 89 N 4.69 3.29 -0.03 5.97 0.00 -1.26 -4.69 121.76 129.73 1bdf s ALA 89 Ca 0.40 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.44 1bdf s ALA 89 Cb -0.09 -3.48 -0.00 0.00 0.00 0.00 0.00 23.12 19.55 1bdf s ALA 89 CO 0.24 -1.92 -0.15 0.08 0.00 0.00 0.00 175.76 174.02 1bdf s VAL 90 N 3.33 1.24 -0.31 0.00 1.01 -1.26 -2.30 120.40 122.10 1bdf s VAL 90 Ca 0.31 -0.62 -0.03 0.00 0.00 0.00 0.00 61.98 61.64 1bdf s VAL 90 Cb -0.12 -1.06 0.05 0.00 0.00 0.00 0.00 36.38 35.24 1bdf s VAL 90 CO 0.23 0.36 0.03 -0.60 0.00 0.00 0.00 175.10 175.12 1bdf s ARG 91 N 0.02 2.51 -0.05 2.72 3.52 -0.21 -4.40 118.95 123.05 1bdf s ARG 91 Ca -0.02 -1.22 -0.02 0.00 -0.13 0.00 0.00 55.73 54.34 1bdf s ARG 91 Cb -0.10 -3.26 -0.04 0.00 -1.56 0.00 0.00 34.95 30.00 1bdf s ARG 91 CO 0.01 -0.62 0.05 0.08 -0.81 0.00 0.00 175.30 174.01 1bdf s VAL 92 N 1.30 4.60 0.00 7.11 1.01 -1.26 -1.13 120.40 132.03 1bdf s VAL 92 Ca -0.04 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.66 1bdf s VAL 92 Cb -0.20 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.17 1bdf s VAL 92 CO 0.00 0.49 0.66 1.67 0.00 0.00 0.00 175.10 177.92 1bdf n GLN 93 N 1.70 0.00 -1.14 2.72 7.27 -1.09 -4.63 117.38 122.20 1bdf n GLN 93 Ca -0.16 0.58 -0.03 0.00 0.07 0.00 0.00 57.00 57.46 1bdf n GLN 93 Cb 0.53 -1.16 -0.03 0.00 2.41 0.00 0.00 30.24 31.99 1bdf n GLN 93 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1bdf n GLY 94 N -0.95 0.69 3.59 1.69 0.00 -1.26 -5.10 105.19 103.86 1bdf n GLY 94 Ca 0.00 -0.29 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 1bdf n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bdf s LYS 95 N 0.00 3.86 -0.00 1.61 1.02 -1.26 -4.96 119.74 120.02 1bdf s LYS 95 Ca 0.12 -0.40 0.01 0.00 0.02 0.00 0.00 55.97 55.71 1bdf s LYS 95 Cb 0.13 -3.11 0.02 0.00 -0.52 0.00 0.00 37.83 34.36 1bdf s LYS 95 CO -0.06 0.27 0.98 -0.25 -0.92 0.00 0.00 175.35 175.37 1bdf n ASP 96 N 3.50 0.22 -3.48 2.83 8.00 -1.26 -4.65 116.55 121.72 1bdf n ASP 96 Ca -0.17 -2.00 0.01 0.00 0.71 0.00 0.00 54.79 53.34 1bdf n ASP 96 Cb 0.52 -0.06 -0.05 0.00 -0.02 0.00 0.00 41.12 41.51 1bdf n ASP 96 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1bdf s GLU 97 N -1.89 0.20 -0.01 -1.24 2.12 -1.25 -2.25 118.70 114.38 1bdf s GLU 97 Ca 0.02 0.42 0.00 0.00 0.36 0.00 0.00 54.97 55.77 1bdf s GLU 97 Cb 0.01 0.16 0.01 0.00 0.26 0.00 0.00 34.13 34.57 1bdf s GLU 97 CO 0.01 -0.05 -0.00 0.54 -0.54 0.00 0.00 175.26 175.21 1bdf s VAL 98 N 1.74 0.08 -0.24 3.70 0.11 -0.24 -5.00 120.40 120.56 1bdf s VAL 98 Ca -0.05 0.03 -0.13 0.00 -2.93 0.00 0.00 61.98 58.90 1bdf s VAL 98 Cb -0.03 -0.13 -0.04 0.00 -1.53 0.00 0.00 36.38 34.65 1bdf s VAL 98 CO -0.15 0.06 0.27 -0.63 -3.33 0.00 0.00 175.10 171.33 1bdf s ILE 99 N 0.39 5.27 -0.14 7.04 -1.09 -1.26 -0.98 121.20 130.43 1bdf s ILE 99 Ca -0.03 0.41 -0.04 0.00 -2.23 0.00 0.00 60.65 58.76 1bdf s ILE 99 Cb -0.06 -3.61 -0.03 0.00 -1.58 0.00 0.00 42.46 37.18 1bdf s ILE 99 CO -0.01 0.28 0.00 -0.76 -1.23 0.00 0.00 174.94 173.22 1bdf s LEU 100 N 1.36 3.53 -0.13 2.97 1.43 0.72 -4.90 118.68 123.66 1bdf s LEU 100 Ca 0.12 0.03 -0.04 0.00 -1.03 0.00 0.00 54.13 53.21 1bdf s LEU 100 Cb -0.14 -1.85 -0.03 0.00 0.03 0.00 0.00 46.19 44.20 1bdf s LEU 100 CO 0.07 0.24 0.01 0.42 0.23 0.00 0.00 176.35 177.33 1bdf s THR 101 N -0.07 4.38 -0.29 5.49 -4.23 -1.26 0.12 115.64 119.79 1bdf s THR 101 Ca 0.04 -0.20 0.00 0.00 -1.18 0.00 0.00 61.69 60.35 1bdf s THR 101 Cb -0.13 -2.90 0.09 0.00 1.34 0.00 0.00 72.50 70.90 1bdf s THR 101 CO 0.02 0.55 0.05 -0.22 -0.54 0.00 0.00 174.62 174.47 1bdf s LEU 102 N -0.31 2.69 -0.18 4.79 0.20 0.41 -0.86 118.68 125.42 1bdf s LEU 102 Ca 0.07 -1.54 -0.04 0.00 0.69 0.00 0.00 54.13 53.31 1bdf s LEU 102 Cb -0.12 -1.06 -0.02 0.00 -0.43 0.00 0.00 46.19 44.56 1bdf s LEU 102 CO 0.02 -0.35 -0.03 0.20 -0.29 0.00 0.00 176.35 175.90 1bdf s ASN 103 N 1.45 4.73 -0.24 3.68 0.01 -1.26 -1.71 114.94 121.60 1bdf s ASN 103 Ca 0.05 -0.19 -0.09 0.00 -0.71 0.00 0.00 52.86 51.93 1bdf s ASN 103 Cb -0.18 -1.79 0.10 0.00 0.41 0.00 0.00 41.25 39.80 1bdf s ASN 103 CO -0.16 0.11 0.52 -0.75 -1.51 0.00 0.00 177.10 175.32 1bdf s LYS 104 N 0.70 0.44 -0.09 -0.60 2.36 0.18 -4.97 119.74 117.76 1bdf s LYS 104 Ca -0.02 1.20 0.03 0.00 -2.55 0.00 0.00 55.97 54.64 1bdf s LYS 104 Cb -0.14 0.52 0.01 0.00 -1.05 0.00 0.00 37.83 37.16 1bdf s LYS 104 CO 0.02 -0.22 -0.20 -1.54 1.55 0.00 0.00 175.35 174.96 1bdf s SER 105 N 2.62 2.68 0.00 1.43 1.04 -1.26 -1.05 113.70 119.16 1bdf s SER 105 Ca -0.04 -0.48 0.00 0.00 0.48 0.00 0.00 55.95 55.91 1bdf s SER 105 Cb -0.11 -1.23 0.00 0.00 0.10 0.00 0.00 66.02 64.78 1bdf s SER 105 CO -0.16 0.11 0.00 0.61 0.98 0.00 0.00 173.24 174.78 1bdf n GLY 106 N 3.71 4.56 3.74 7.32 0.00 -1.03 -5.00 105.19 118.49 1bdf n GLY 106 Ca -0.20 -1.05 -0.41 0.00 0.00 0.00 0.00 46.02 44.36 1bdf n GLY 106 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bdf s ILE 107 N -1.84 3.52 -0.32 -0.61 1.01 -1.26 -4.35 121.20 117.35 1bdf s ILE 107 Ca 0.00 1.34 0.00 0.00 0.00 0.00 0.00 60.65 61.99 1bdf s ILE 107 Cb 0.00 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.61 1bdf s ILE 107 CO 0.00 0.25 0.00 0.61 0.00 0.00 0.00 174.94 175.80 1bdf n GLY 108 N 1.87 0.79 3.74 6.18 0.00 -0.81 -4.95 105.19 112.00 1bdf n GLY 108 Ca 0.03 -2.30 -0.41 0.00 0.00 0.00 0.00 46.02 43.33 1bdf n GLY 108 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1bdf s PRO 109 N -0.86 4.50 -0.51 1.61 0.04 -1.26 -1.80 135.00 136.73 1bdf s PRO 109 Ca 0.00 1.86 -0.17 0.00 0.04 0.00 0.00 61.00 62.72 1bdf s PRO 109 Cb 0.00 -3.25 0.08 0.00 0.04 0.00 0.00 34.50 31.37 1bdf s PRO 109 CO 0.00 -0.07 0.52 0.08 0.04 0.00 0.00 177.00 177.57 1bdf s VAL 110 N -0.05 5.06 0.50 -0.36 1.01 0.11 -4.92 120.40 121.75 1bdf s VAL 110 Ca 0.53 -0.93 0.07 0.00 0.00 0.00 0.00 61.98 61.65 1bdf s VAL 110 Cb -0.32 -4.26 0.04 0.00 0.00 0.00 0.00 36.38 31.84 1bdf s VAL 110 CO 0.36 -0.76 0.68 0.42 0.00 0.00 0.00 175.10 175.80 1bdf s THR 111 N 2.09 2.68 -0.09 3.92 -4.23 -1.26 0.59 115.64 119.32 1bdf s THR 111 Ca 0.08 -0.93 0.28 0.00 -1.18 0.00 0.00 61.69 59.94 1bdf s THR 111 Cb -0.23 -2.74 0.29 0.00 1.34 0.00 0.00 72.50 71.15 1bdf s THR 111 CO 0.08 0.00 1.84 0.00 -0.54 0.00 0.00 174.62 176.00 1bdf h ALA 112 N 0.38 1.00 0.00 3.99 0.00 0.12 -0.46 119.26 124.29 1bdf h ALA 112 Ca -0.37 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 1bdf h ALA 112 Cb 1.28 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1bdf h ALA 112 CO 0.44 0.00 -0.10 0.00 0.00 0.00 0.00 179.25 179.60 1bdf h ALA 113 N 2.08 0.99 -0.00 0.00 0.00 -1.10 -2.97 119.26 118.26 1bdf h ALA 113 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1bdf h ALA 113 Cb 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1bdf h ALA 113 CO 0.00 0.12 -0.05 -0.25 0.00 0.00 0.00 179.25 179.07 1bdf n ASP 114 N -3.20 0.08 -4.76 0.00 8.00 -0.18 -4.84 116.55 111.66 1bdf n ASP 114 Ca 0.01 0.14 -0.41 0.00 0.71 0.00 0.00 54.79 55.24 1bdf n ASP 114 Cb 0.40 -0.33 -0.02 0.00 -0.02 0.00 0.00 41.12 41.15 1bdf n ASP 114 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1bdf s ILE 115 N -2.82 2.81 -0.11 0.53 1.01 -1.12 -4.53 121.20 116.97 1bdf s ILE 115 Ca 0.20 0.75 -0.31 0.00 0.00 0.00 0.00 60.65 61.29 1bdf s ILE 115 Cb 0.19 -3.48 -0.09 0.00 0.01 0.00 0.00 42.46 39.09 1bdf s ILE 115 CO 0.52 0.16 2.03 0.35 0.00 0.00 0.00 174.94 177.99 1bdf n THR 116 N 1.46 0.55 -1.52 2.92 -2.24 -0.04 -4.83 114.28 110.58 1bdf n THR 116 Ca 0.02 -0.22 -0.40 0.00 -2.27 0.00 0.00 64.05 61.18 1bdf n THR 116 Cb 0.42 -2.17 -0.07 0.00 -2.10 0.00 0.00 70.33 66.41 1bdf n THR 116 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bdf n HIS 117 N 8.53 1.30 -3.50 4.78 1.44 -1.26 -4.72 115.22 121.79 1bdf n HIS 117 Ca 0.25 0.19 -0.37 0.00 -2.01 0.00 0.00 57.72 55.79 1bdf n HIS 117 Cb 0.36 -2.57 -0.07 0.00 0.12 0.00 0.00 29.99 27.84 1bdf n HIS 117 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1bdf s ASP 118 N 10.28 6.44 0.16 4.39 -1.08 -1.26 -5.01 116.67 130.59 1bdf s ASP 118 Ca 1.09 0.52 -0.26 0.00 -0.52 0.00 0.00 52.55 53.38 1bdf s ASP 118 Cb -0.57 -2.20 0.01 0.00 -1.46 0.00 0.00 42.92 38.71 1bdf s ASP 118 CO 0.36 0.06 1.57 1.23 0.52 0.00 0.00 175.17 178.92 1bdf h GLY 119 N 6.87 -0.53 2.00 2.66 0.00 -2.04 -2.42 103.07 109.61 1bdf h GLY 119 Ca -0.40 0.56 -0.03 0.00 0.00 0.00 0.00 47.33 47.46 1bdf h GLY 119 CO 0.75 -0.17 -0.14 1.29 0.00 0.00 0.00 176.54 178.27 1bdf h ASP 120 N -0.29 0.00 -3.27 0.19 3.04 -1.97 -3.43 116.42 110.69 1bdf h ASP 120 Ca 0.15 0.00 -0.55 0.00 -3.24 0.00 0.00 57.03 53.39 1bdf h ASP 120 Cb 0.57 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.83 1bdf h ASP 120 CO -0.62 0.14 0.54 -0.69 -2.04 0.00 0.00 179.24 176.57 1bdf s VAL 121 N -3.49 4.74 -0.19 4.15 1.01 -0.91 -2.68 120.40 123.03 1bdf s VAL 121 Ca 0.02 2.00 -0.04 0.00 0.00 0.00 0.00 61.98 63.97 1bdf s VAL 121 Cb 0.08 -4.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.16 1bdf s VAL 121 CO 0.63 0.03 -0.04 -0.70 0.00 0.00 0.00 175.10 175.02 1bdf s GLU 122 N 1.83 3.52 -0.43 2.72 2.12 -0.28 -4.59 118.70 123.60 1bdf s GLU 122 Ca 0.50 -0.57 -0.15 0.00 0.36 0.00 0.00 54.97 55.11 1bdf s GLU 122 Cb -0.19 -2.97 0.04 0.00 0.26 0.00 0.00 34.13 31.26 1bdf s GLU 122 CO 0.20 0.02 0.32 0.42 -0.54 0.00 0.00 175.26 175.68 1bdf s ILE 123 N 0.95 5.17 0.13 -3.70 1.01 -1.26 -1.05 121.20 122.46 1bdf s ILE 123 Ca 0.00 -0.83 -0.18 0.00 0.00 0.00 0.00 60.65 59.64 1bdf s ILE 123 Cb -0.15 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 1bdf s ILE 123 CO 0.01 -0.40 1.78 0.58 0.00 0.00 0.00 174.94 176.91 1bdf h VAL 124 N 5.70 1.03 -3.07 2.92 2.07 -1.84 -3.36 116.25 119.69 1bdf h VAL 124 Ca -0.27 -0.11 -0.62 0.00 0.82 0.00 0.00 66.70 66.52 1bdf h VAL 124 Cb 1.11 0.69 -0.41 0.00 -1.52 0.00 0.00 31.29 31.17 1bdf h VAL 124 CO 0.77 0.06 -0.68 -0.75 0.02 0.00 0.00 177.57 177.00 1bdf s LYS 125 N -6.17 1.84 0.56 1.57 2.20 -1.26 -4.95 119.74 113.53 1bdf s LYS 125 Ca -0.13 -2.64 0.25 0.00 -0.36 0.00 0.00 55.97 53.08 1bdf s LYS 125 Cb 0.09 -2.89 1.57 0.00 -1.51 0.00 0.00 37.83 35.10 1bdf s LYS 125 CO 0.70 -1.21 2.17 -1.00 -0.36 0.00 0.00 175.35 175.65 1bdf h PRO 126 N 6.11 0.00 -0.28 4.03 0.13 -1.90 -0.99 132.00 139.10 1bdf h PRO 126 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1bdf h PRO 126 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1bdf h PRO 126 CO 0.61 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.38 1bdf n GLN 127 N -4.11 0.98 -2.52 0.86 0.00 -1.26 -0.57 117.38 110.77 1bdf n GLN 127 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 57.00 56.56 1bdf n GLN 127 Cb 0.18 -1.14 -0.02 0.00 0.00 0.00 0.00 30.24 29.26 1bdf n GLN 127 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.06 175.48 1bdf s HIS 128 N -1.71 2.79 -0.10 2.61 2.46 -0.38 -4.82 115.29 116.14 1bdf s HIS 128 Ca 0.00 0.87 -0.30 0.00 0.47 0.00 0.00 55.06 56.10 1bdf s HIS 128 Cb 0.00 -4.09 -0.03 0.00 -0.13 0.00 0.00 32.58 28.32 1bdf s HIS 128 CO 0.00 -1.39 1.37 0.08 -2.47 0.00 0.00 174.74 172.33 1bdf s VAL 129 N 4.41 4.01 -0.19 0.89 1.01 -1.26 0.11 120.40 129.38 1bdf s VAL 129 Ca 0.52 1.28 0.13 0.00 0.00 0.00 0.00 61.98 63.90 1bdf s VAL 129 Cb -0.12 -3.82 -0.21 0.00 0.00 0.00 0.00 36.38 32.23 1bdf s VAL 129 CO 0.26 -0.08 0.00 -0.38 0.00 0.00 0.00 175.10 174.90 1bdf n ILE 130 N 5.18 1.26 -4.10 2.22 5.41 0.20 -4.90 119.36 124.62 1bdf n ILE 130 Ca 0.14 -0.71 -0.16 0.00 1.00 0.00 0.00 62.75 63.03 1bdf n ILE 130 Cb 0.44 -0.70 -0.04 0.00 -0.71 0.00 0.00 39.64 38.63 1bdf n ILE 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1bdf s HIS 132 N -2.89 -1.25 -0.22 0.00 3.76 -1.26 0.07 115.29 113.50 1bdf s HIS 132 Ca 0.31 0.71 -0.25 0.00 -0.15 0.00 0.00 55.06 55.69 1bdf s HIS 132 Cb -0.01 0.05 -0.01 0.00 1.11 0.00 0.00 32.58 33.73 1bdf s HIS 132 CO 0.22 -0.96 0.84 -0.51 -0.85 0.00 0.00 174.74 173.47 1bdf s LEU 133 N 2.64 4.11 -0.04 0.89 1.43 -0.74 0.16 118.68 127.12 1bdf s LEU 133 Ca 0.11 1.08 -0.11 0.00 -1.03 0.00 0.00 54.13 54.19 1bdf s LEU 133 Cb -0.12 -3.21 -0.06 0.00 0.03 0.00 0.00 46.19 42.83 1bdf s LEU 133 CO -0.26 -0.49 0.48 0.71 0.23 0.00 0.00 176.35 177.02 1bdf h THR 134 N 5.37 0.00 -2.70 5.49 1.35 -0.29 -2.16 112.91 119.97 1bdf h THR 134 Ca -0.25 -0.60 -0.45 0.00 -0.55 0.00 0.00 66.41 64.57 1bdf h THR 134 Cb 1.10 0.00 0.04 0.00 -1.73 0.00 0.00 68.15 67.56 1bdf h THR 134 CO 0.87 0.00 -0.03 1.51 -0.25 0.00 0.00 175.52 177.61 1bdf s ASP 135 N -4.77 5.45 0.00 5.36 1.47 -1.26 -4.75 116.67 118.17 1bdf s ASP 135 Ca -0.06 0.14 0.26 0.00 1.18 0.00 0.00 52.55 54.08 1bdf s ASP 135 Cb 0.01 -1.14 1.15 0.00 -0.34 0.00 0.00 42.92 42.60 1bdf s ASP 135 CO 0.17 -1.01 1.85 -1.84 0.68 0.00 0.00 175.17 175.02 1bdf n GLU 136 N -2.29 0.05 -0.36 2.11 0.28 -1.26 -2.74 120.64 116.43 1bdf n GLU 136 Ca 0.06 0.05 0.10 0.00 -0.16 0.00 0.00 57.16 57.20 1bdf n GLU 136 Cb 0.59 -1.50 0.28 0.00 1.43 0.00 0.00 31.44 32.24 1bdf n GLU 136 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1bdf n ASN 137 N -1.47 3.81 -4.85 -1.84 3.02 -1.26 -4.49 115.26 108.18 1bdf n ASN 137 Ca 0.07 -2.08 -0.34 0.00 -0.03 0.00 0.00 54.58 52.20 1bdf n ASN 137 Cb 0.30 -0.44 -0.06 0.00 -0.61 0.00 0.00 39.78 38.97 1bdf n ASN 137 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bdf s ALA 138 N -1.15 3.48 -0.11 5.41 0.00 -1.11 -5.01 121.76 123.27 1bdf s ALA 138 Ca 0.43 -0.07 -0.30 0.00 0.00 0.00 0.00 51.96 52.01 1bdf s ALA 138 Cb 0.23 -2.61 0.09 0.00 0.00 0.00 0.00 23.12 20.83 1bdf s ALA 138 CO 0.27 0.42 0.79 -1.54 0.00 0.00 0.00 175.76 175.70 1bdf s SER 139 N -2.02 -0.58 0.03 0.00 1.04 -1.26 -2.46 113.70 108.45 1bdf s SER 139 Ca 0.45 0.71 0.07 0.00 0.48 0.00 0.00 55.95 57.66 1bdf s SER 139 Cb -0.13 0.58 -0.02 0.00 0.10 0.00 0.00 66.02 66.54 1bdf s SER 139 CO 0.20 -0.48 -0.21 0.27 0.98 0.00 0.00 173.24 173.99 1bdf s ILE 140 N -0.96 1.72 -0.21 -1.02 -4.36 -0.22 -4.97 121.20 111.19 1bdf s ILE 140 Ca -0.07 -1.16 -0.04 0.00 -0.26 0.00 0.00 60.65 59.12 1bdf s ILE 140 Cb -0.01 -1.48 0.07 0.00 1.25 0.00 0.00 42.46 42.29 1bdf s ILE 140 CO 0.06 0.28 0.10 -0.55 0.24 0.00 0.00 174.94 175.07 1bdf s SER 141 N -1.04 2.77 0.06 4.36 0.15 -1.24 -0.64 113.70 118.12 1bdf s SER 141 Ca 0.08 -0.85 0.02 0.00 0.70 0.00 0.00 55.95 55.90 1bdf s SER 141 Cb -0.09 -0.31 -0.03 0.00 -1.71 0.00 0.00 66.02 63.89 1bdf s SER 141 CO 0.01 -0.38 -0.08 0.00 1.20 0.00 0.00 173.24 174.00 1bdf s MET 142 N 2.10 0.62 -0.32 5.44 0.23 -0.70 -1.27 119.30 125.41 1bdf s MET 142 Ca 0.04 -0.92 -0.02 0.00 -1.03 0.00 0.00 55.69 53.76 1bdf s MET 142 Cb -0.16 -0.29 0.06 0.00 -1.53 0.00 0.00 34.83 32.90 1bdf s MET 142 CO -0.18 0.04 0.04 1.03 -2.03 0.00 0.00 175.02 173.92 1bdf s ARG 143 N -2.18 2.38 -0.32 3.16 3.00 -0.68 -0.45 118.95 123.86 1bdf s ARG 143 Ca -0.04 -1.34 -0.20 0.00 0.00 0.00 0.00 55.73 54.15 1bdf s ARG 143 Cb -0.06 -3.26 -0.01 0.00 0.00 0.00 0.00 34.95 31.63 1bdf s ARG 143 CO -0.01 -0.69 0.63 0.42 0.00 0.00 0.00 175.30 175.66 1bdf s ILE 144 N 1.25 4.92 -0.19 1.52 1.01 0.33 -1.47 121.20 128.57 1bdf s ILE 144 Ca -0.03 0.77 -0.23 0.00 0.00 0.00 0.00 60.65 61.16 1bdf s ILE 144 Cb -0.20 -4.02 -0.02 0.00 0.01 0.00 0.00 42.46 38.23 1bdf s ILE 144 CO -0.01 -0.19 0.74 -0.75 0.00 0.00 0.00 174.94 174.72 1bdf s LYS 145 N 2.64 4.25 -0.19 2.79 2.20 0.42 -0.20 119.74 131.65 1bdf s LYS 145 Ca 0.25 0.82 -0.02 0.00 -0.36 0.00 0.00 55.97 56.66 1bdf s LYS 145 Cb -0.15 -3.58 -0.00 0.00 -1.51 0.00 0.00 37.83 32.59 1bdf s LYS 145 CO 0.13 -0.30 -0.09 0.08 -0.36 0.00 0.00 175.35 174.80 1bdf s VAL 146 N 2.10 3.05 0.19 4.02 1.01 -0.15 -0.97 120.40 129.65 1bdf s VAL 146 Ca 0.34 -0.62 0.10 0.00 0.00 0.00 0.00 61.98 61.80 1bdf s VAL 146 Cb -0.16 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 1bdf s VAL 146 CO 0.11 0.47 -0.21 -1.10 0.00 0.00 0.00 175.10 174.37 1bdf s GLN 147 N 1.16 1.44 0.01 2.72 -0.21 0.18 -1.08 119.66 123.88 1bdf s GLN 147 Ca 0.01 -1.51 -0.19 0.00 0.02 0.00 0.00 55.36 53.70 1bdf s GLN 147 Cb -0.14 -1.62 -0.06 0.00 1.00 0.00 0.00 33.01 32.19 1bdf s GLN 147 CO -0.03 0.33 0.54 0.50 -2.12 0.00 0.00 175.29 174.51 1bdf s ARG 148 N -2.84 4.21 0.00 2.91 6.06 -0.96 -0.60 118.95 127.73 1bdf s ARG 148 Ca 0.20 0.64 0.00 0.00 -2.50 0.00 0.00 55.73 54.07 1bdf s ARG 148 Cb -0.07 -3.30 0.00 0.00 0.06 0.00 0.00 34.95 31.65 1bdf s ARG 148 CO 0.09 0.49 0.00 0.41 -2.50 0.00 0.00 175.30 173.80 1bdf n GLY 149 N 2.18 2.22 3.29 8.12 0.00 -0.48 -4.99 105.19 115.53 1bdf n GLY 149 Ca -0.09 -0.67 -0.12 0.00 0.00 0.00 0.00 46.02 45.13 1bdf n GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bdf s ARG 150 N 1.09 0.44 0.94 1.61 0.52 -1.26 -3.73 118.95 118.55 1bdf s ARG 150 Ca 0.00 0.67 0.00 0.00 -0.52 0.00 0.00 55.73 55.88 1bdf s ARG 150 Cb 0.00 0.12 0.00 0.00 0.52 0.00 0.00 34.95 35.59 1bdf s ARG 150 CO 0.00 -0.10 0.00 0.41 0.02 0.00 0.00 175.30 175.63 1bdf n GLY 151 N 3.50 -1.91 3.82 -3.53 0.00 -1.26 -4.77 105.19 101.04 1bdf n GLY 151 Ca -0.18 -1.35 -0.38 0.00 0.00 0.00 0.00 46.02 44.11 1bdf n GLY 151 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1bdf s TYR 152 N -0.35 3.77 -0.30 1.61 5.04 -1.26 -0.28 117.35 125.58 1bdf s TYR 152 Ca 0.00 1.19 -0.02 0.00 -2.44 0.00 0.00 57.07 55.81 1bdf s TYR 152 Cb 0.00 -2.44 0.12 0.00 0.35 0.00 0.00 41.96 39.99 1bdf s TYR 152 CO 0.00 0.59 0.22 0.08 -1.34 0.00 0.00 175.55 175.09 1bdf s VAL 153 N -1.14 -0.18 1.03 3.14 1.01 0.16 -4.98 120.40 119.44 1bdf s VAL 153 Ca 0.29 -0.81 -0.15 0.00 0.00 0.00 0.00 61.98 61.31 1bdf s VAL 153 Cb -0.18 -0.97 0.08 0.00 0.00 0.00 0.00 36.38 35.30 1bdf s VAL 153 CO 0.18 -0.66 0.25 -0.81 0.00 0.00 0.00 175.10 174.06 1bdf n PRO 154 N 5.03 -0.95 0.00 2.72 -0.04 -1.26 -1.50 135.00 139.00 1bdf n PRO 154 Ca -0.01 -0.25 0.01 0.00 -0.04 0.00 0.00 63.50 63.21 1bdf n PRO 154 Cb 0.43 -1.80 0.05 0.00 -0.04 0.00 0.00 33.50 32.14 1bdf n PRO 154 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bdf n ALA 155 N -4.02 1.57 -2.58 0.55 0.00 -1.26 -4.50 120.51 110.27 1bdf n ALA 155 Ca 0.04 -0.01 -0.42 0.00 0.00 0.00 0.00 53.44 53.05 1bdf n ALA 155 Cb 0.57 -1.03 -0.03 0.00 0.00 0.00 0.00 19.45 18.97 1bdf n ALA 155 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1bdf s SER 156 N -2.00 6.38 -0.28 0.00 1.04 -1.26 -4.95 113.70 112.63 1bdf s SER 156 Ca 0.03 -0.04 -0.23 0.00 0.48 0.00 0.00 55.95 56.19 1bdf s SER 156 Cb 0.01 -2.55 0.12 0.00 0.10 0.00 0.00 66.02 63.69 1bdf s SER 156 CO 0.02 -1.57 0.96 0.28 0.98 0.00 0.00 173.24 173.91 1bdf s THR 157 N 5.13 0.00 0.00 2.02 -1.32 -1.26 -5.12 115.64 115.09 1bdf s THR 157 Ca 0.41 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.89 1bdf s THR 157 Cb -0.08 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.91 1bdf s THR 157 CO 0.23 0.00 0.00 0.54 -2.21 0.00 0.00 174.62 173.18 1bdf n ARG 158 N 2.65 0.00 0.00 7.08 3.00 -1.26 -5.04 116.66 123.09 1bdf n ARG 158 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.70 1bdf n ARG 158 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.02 1bdf n ARG 158 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 1bdf n ILE 159 N -1.22 0.00 0.00 0.55 -0.00 -1.26 -5.27 119.36 112.16 1bdf n ILE 159 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1bdf n ILE 159 Cb 0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 39.64 39.58 1bdf n ILE 159 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1bdf n HIS 160 N -1.63 0.00 0.00 4.28 1.44 -1.26 -5.34 115.22 112.71 1bdf n HIS 160 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1bdf n HIS 160 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 1bdf n HIS 160 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1bdf n GLU 165 N 0.00 0.00 0.45 -1.40 1.02 -1.26 -5.30 120.64 114.15 1bdf n GLU 165 Ca 0.00 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.96 1bdf n GLU 165 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.34 1bdf n GLU 165 CO 0.00 0.00 0.00 0.07 1.18 0.00 0.00 177.13 178.38 1bdf h ARG 166 N 0.00 -1.10 -6.84 3.49 -0.00 -2.13 -3.40 114.38 104.39 1bdf h ARG 166 Ca 0.00 0.08 -0.48 0.00 -0.00 0.00 0.00 59.98 59.58 1bdf h ARG 166 Cb 0.00 0.25 -0.02 0.00 -0.00 0.00 0.00 29.97 30.20 1bdf h ARG 166 CO 0.00 -0.74 0.29 -1.25 -0.00 0.00 0.00 179.97 178.27 1bdf s PRO 167 N -5.53 4.46 0.00 0.08 0.04 -1.26 -5.03 135.00 127.76 1bdf s PRO 167 Ca -0.17 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.07 1bdf s PRO 167 Cb 0.02 -2.74 0.00 0.00 0.04 0.00 0.00 34.50 31.82 1bdf s PRO 167 CO 0.51 0.26 0.00 -0.89 0.04 0.00 0.00 177.00 176.92 1bdf n ILE 168 N 0.43 0.00 0.00 0.56 -0.00 -1.26 -5.15 119.36 113.94 1bdf n ILE 168 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.77 1bdf n ILE 168 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.15 1bdf n ILE 168 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1bdf n GLY 169 N 5.00 1.64 0.40 7.39 0.00 -1.26 -5.09 105.19 113.27 1bdf n GLY 169 Ca 0.00 -0.43 -0.16 0.00 0.00 0.00 0.00 46.02 45.43 1bdf n GLY 169 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1bdf h ARG 170 N 0.00 -0.98 -6.26 1.61 9.65 -1.97 -3.45 114.38 112.98 1bdf h ARG 170 Ca 0.00 0.07 -0.57 0.00 -1.10 0.00 0.00 59.98 58.38 1bdf h ARG 170 Cb 0.00 0.22 -0.04 0.00 -1.39 0.00 0.00 29.97 28.76 1bdf h ARG 170 CO 0.00 -0.65 -0.06 -0.51 2.80 0.00 0.00 179.97 181.54 1bdf s LEU 171 N -8.44 4.44 -0.03 3.80 1.43 -0.73 -4.97 118.68 114.18 1bdf s LEU 171 Ca -0.15 1.17 0.07 0.00 -1.03 0.00 0.00 54.13 54.19 1bdf s LEU 171 Cb 0.01 -3.04 -0.02 0.00 0.03 0.00 0.00 46.19 43.17 1bdf s LEU 171 CO 0.44 0.20 -0.25 -0.76 0.23 0.00 0.00 176.35 176.21 1bdf s LEU 172 N -1.48 2.05 -0.02 1.79 1.43 -1.26 -1.33 118.68 119.87 1bdf s LEU 172 Ca 0.33 -0.48 0.05 0.00 -1.03 0.00 0.00 54.13 53.00 1bdf s LEU 172 Cb -0.17 -1.33 -0.01 0.00 0.03 0.00 0.00 46.19 44.71 1bdf s LEU 172 CO 0.19 0.29 -0.17 0.54 0.23 0.00 0.00 176.35 177.43 1bdf s VAL 173 N -0.43 1.33 0.00 -1.59 0.11 -0.26 -4.97 120.40 114.60 1bdf s VAL 173 Ca 0.05 -0.71 -0.33 0.00 -2.93 0.00 0.00 61.98 58.06 1bdf s VAL 173 Cb -0.11 -1.12 -0.12 0.00 -1.53 0.00 0.00 36.38 33.50 1bdf s VAL 173 CO 0.01 0.38 1.84 0.47 -3.33 0.00 0.00 175.10 174.47 1bdf n ASP 174 N 2.78 3.59 -4.63 3.54 8.00 -1.26 -4.51 116.55 124.05 1bdf n ASP 174 Ca -0.15 0.98 -0.40 0.00 0.71 0.00 0.00 54.79 55.93 1bdf n ASP 174 Cb 0.54 -1.43 -0.07 0.00 -0.02 0.00 0.00 41.12 40.14 1bdf n ASP 174 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bdf s ALA 175 N 3.41 3.59 -0.85 2.24 0.00 -0.56 -4.93 121.76 124.66 1bdf s ALA 175 Ca 0.88 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 52.39 1bdf s ALA 175 Cb -0.62 -2.95 0.23 0.00 0.00 0.00 0.00 23.12 19.77 1bdf s ALA 175 CO 0.46 -0.70 0.80 0.00 0.00 0.00 0.00 175.76 176.32 1bdf h TYR 177 N 5.56 0.00 -2.83 0.00 0.05 -0.94 -3.45 116.97 115.35 1bdf h TYR 177 Ca 0.17 0.00 -0.52 0.00 0.05 0.00 0.00 58.73 58.43 1bdf h TYR 177 Cb 0.76 0.00 0.05 0.00 1.01 0.00 0.00 36.73 38.55 1bdf h TYR 177 CO 0.74 0.03 0.91 0.45 -1.05 0.00 0.00 178.16 179.24 1bdf s SER 178 N -6.27 6.52 -0.02 3.88 0.15 -1.25 -3.92 113.70 112.79 1bdf s SER 178 Ca -0.05 2.70 -0.10 0.00 0.70 0.00 0.00 55.95 59.20 1bdf s SER 178 Cb 0.15 -2.60 -0.31 0.00 -1.71 0.00 0.00 66.02 61.55 1bdf s SER 178 CO 0.57 -0.86 0.76 -0.65 1.20 0.00 0.00 173.24 174.26 1bdf h PRO 179 N 6.62 0.39 -6.53 5.44 0.11 -1.81 -3.45 132.00 132.77 1bdf h PRO 179 Ca -0.43 -0.67 -0.53 0.00 0.11 0.00 0.00 66.00 64.48 1bdf h PRO 179 Cb 1.20 0.25 -0.00 0.00 0.11 0.00 0.00 31.00 32.56 1bdf h PRO 179 CO 0.91 1.30 0.49 0.08 -0.21 0.00 0.00 178.00 180.57 1bdf s VAL 180 N -2.59 4.16 -0.18 3.15 1.01 -1.26 -0.09 120.40 124.61 1bdf s VAL 180 Ca -0.13 1.66 -0.02 0.00 0.00 0.00 0.00 61.98 63.48 1bdf s VAL 180 Cb 0.05 -4.06 -0.10 0.00 0.00 0.00 0.00 36.38 32.27 1bdf s VAL 180 CO 0.87 0.19 -0.18 -0.62 0.00 0.00 0.00 175.10 175.35 1bdf n GLU 181 N 3.35 0.42 -3.74 2.72 1.02 0.13 -4.89 120.64 119.66 1bdf n GLU 181 Ca 0.06 0.13 -0.12 0.00 -0.02 0.00 0.00 57.16 57.20 1bdf n GLU 181 Cb 0.47 -1.28 -0.11 0.00 -0.02 0.00 0.00 31.44 30.50 1bdf n GLU 181 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1bdf s ARG 182 N -2.34 0.36 0.03 3.49 0.52 -1.13 -5.01 118.95 114.87 1bdf s ARG 182 Ca -0.24 0.55 0.08 0.00 -0.52 0.00 0.00 55.73 55.60 1bdf s ARG 182 Cb 0.07 0.09 -0.02 0.00 0.52 0.00 0.00 34.95 35.61 1bdf s ARG 182 CO 0.38 -0.09 -0.23 0.42 0.02 0.00 0.00 175.30 175.79 1bdf s ILE 183 N 0.65 1.86 -0.01 1.52 -1.09 -1.26 -2.49 121.20 120.37 1bdf s ILE 183 Ca -0.04 -1.22 -0.15 0.00 -2.23 0.00 0.00 60.65 57.01 1bdf s ILE 183 Cb -0.05 -1.59 0.03 0.00 -1.58 0.00 0.00 42.46 39.27 1bdf s ILE 183 CO -0.04 0.32 0.33 0.00 -1.23 0.00 0.00 174.94 174.32 1bdf s ALA 184 N -0.75 -0.82 0.03 9.38 0.00 -1.01 -5.01 121.76 123.58 1bdf s ALA 184 Ca 0.09 0.35 -0.06 0.00 0.00 0.00 0.00 51.96 52.34 1bdf s ALA 184 Cb -0.09 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.11 1bdf s ALA 184 CO 0.01 -0.28 0.11 1.52 0.00 0.00 0.00 175.76 177.13 1bdf s TYR 185 N -1.41 0.13 0.01 0.00 -0.85 -1.26 -0.14 117.35 113.83 1bdf s TYR 185 Ca -0.13 -0.35 0.02 0.00 -0.52 0.00 0.00 57.07 56.08 1bdf s TYR 185 Cb -0.05 -0.10 -0.01 0.00 0.38 0.00 0.00 41.96 42.18 1bdf s TYR 185 CO 0.04 -0.34 -0.06 -0.80 -1.52 0.00 0.00 175.55 172.87 1bdf s ASN 186 N -1.84 0.71 -0.05 -0.18 0.01 -0.64 -4.98 114.94 107.97 1bdf s ASN 186 Ca -0.09 -0.19 -0.01 0.00 -0.71 0.00 0.00 52.86 51.86 1bdf s ASN 186 Cb -0.04 -0.05 -0.26 0.00 0.41 0.00 0.00 41.25 41.31 1bdf s ASN 186 CO -0.02 0.02 0.63 0.58 -1.51 0.00 0.00 177.10 176.80 1bdf h VAL 187 N 4.90 0.88 -1.74 1.60 2.07 -1.89 0.74 116.25 122.81 1bdf h VAL 187 Ca -0.30 -2.60 0.00 0.00 0.82 0.00 0.00 66.70 64.62 1bdf h VAL 187 Cb 1.19 2.59 0.00 0.00 -1.52 0.00 0.00 31.29 33.55 1bdf h VAL 187 CO 0.48 0.77 0.00 -0.62 0.02 0.00 0.00 177.57 178.22 1bdf n GLU 188 N -3.37 0.00 -1.66 1.57 1.02 -1.26 -2.05 120.64 114.89 1bdf n GLU 188 Ca -0.22 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.49 1bdf n GLU 188 Cb 1.05 -0.29 -0.03 0.00 -0.02 0.00 0.00 31.44 32.15 1bdf n GLU 188 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bdf s ALA 189 N -0.54 3.25 1.06 0.62 0.00 -1.26 -1.64 121.76 123.24 1bdf s ALA 189 Ca 0.00 1.10 -0.12 0.00 0.00 0.00 0.00 51.96 52.94 1bdf s ALA 189 Cb 0.00 -3.93 0.22 0.00 0.00 0.00 0.00 23.12 19.41 1bdf s ALA 189 CO 0.00 -2.04 1.08 0.00 0.00 0.00 0.00 175.76 174.79 1bdf s ALA 190 N 5.93 0.37 -0.39 0.00 0.00 0.28 -4.82 121.76 123.13 1bdf s ALA 190 Ca 0.92 0.19 0.03 0.00 0.00 0.00 0.00 51.96 53.11 1bdf s ALA 190 Cb -0.38 -3.34 0.11 0.00 0.00 0.00 0.00 23.12 19.51 1bdf s ALA 190 CO 0.39 -3.38 0.12 1.03 0.00 0.00 0.00 175.76 173.92 1bdf s ARG 191 N -4.54 1.51 0.00 0.00 0.52 -1.26 -4.86 118.95 110.32 1bdf s ARG 191 Ca 0.68 -1.99 0.00 0.00 -0.52 0.00 0.00 55.73 53.90 1bdf s ARG 191 Cb -0.24 -3.06 0.00 0.00 0.52 0.00 0.00 34.95 32.17 1bdf s ARG 191 CO 0.62 -1.00 0.06 1.33 0.02 0.00 0.00 175.30 176.33 1bdf n VAL 192 N 3.99 0.00 0.00 3.52 0.24 -1.26 -5.05 118.33 119.76 1bdf n VAL 192 Ca 0.04 -0.33 0.00 0.00 -2.04 0.00 0.00 64.34 62.01 1bdf n VAL 192 Cb 0.39 1.07 0.00 0.00 -1.47 0.00 0.00 33.84 33.83 1bdf n VAL 192 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1bdf n GLU 193 N -0.53 0.00 0.00 7.34 4.07 -1.26 -4.74 120.64 125.52 1bdf n GLU 193 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1bdf n GLU 193 Cb 0.02 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.40 1bdf n GLU 193 CO 0.00 0.00 0.00 0.94 -0.06 0.00 0.00 177.13 178.01 1bdf n GLN 194 N 0.00 0.00 -2.26 5.31 7.27 -1.26 -4.44 117.38 122.00 1bdf n GLN 194 Ca 0.00 0.00 -0.43 0.00 0.07 0.00 0.00 57.00 56.64 1bdf n GLN 194 Cb 0.00 -0.21 -0.02 0.00 2.41 0.00 0.00 30.24 32.42 1bdf n GLN 194 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1bdf s ARG 195 N 0.00 3.95 -0.04 3.69 0.52 -1.26 -4.87 118.95 120.94 1bdf s ARG 195 Ca 0.00 1.58 0.21 0.00 -0.52 0.00 0.00 55.73 57.00 1bdf s ARG 195 Cb 0.00 -3.93 0.68 0.00 0.52 0.00 0.00 34.95 32.22 1bdf s ARG 195 CO 0.00 -1.09 1.57 0.25 0.02 0.00 0.00 175.30 176.06 1bdf n THR 196 N 6.06 1.29 0.00 0.02 -2.24 -1.26 -4.50 114.28 113.65 1bdf n THR 196 Ca 0.16 -1.05 0.00 0.00 -2.27 0.00 0.00 64.05 60.89 1bdf n THR 196 Cb 0.45 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 1bdf n THR 196 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1bdf n ASP 197 N 1.47 0.00 0.00 3.42 2.03 -1.26 -4.86 116.55 117.35 1bdf n ASP 197 Ca 0.25 0.30 0.00 0.00 0.52 0.00 0.00 54.79 55.86 1bdf n ASP 197 Cb 0.72 -0.16 0.00 0.00 -0.72 0.00 0.00 41.12 40.96 1bdf n ASP 197 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1bdf n LEU 198 N -0.97 0.00 -4.81 -2.67 4.77 -1.26 -4.44 117.00 107.62 1bdf n LEU 198 Ca 0.00 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.69 1bdf n LEU 198 Cb 0.00 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 1bdf n LEU 198 CO 0.00 0.00 -0.13 -1.81 -1.33 0.00 0.00 177.39 174.12 1bdf s ASP 199 N 0.00 4.34 -0.05 -1.43 1.01 -0.60 -0.56 116.67 119.38 1bdf s ASP 199 Ca 0.00 -1.43 -0.02 0.00 0.71 0.00 0.00 52.55 51.81 1bdf s ASP 199 Cb 0.00 0.34 0.04 0.00 1.01 0.00 0.00 42.92 44.31 1bdf s ASP 199 CO 0.00 -0.90 0.09 -1.59 0.21 0.00 0.00 175.17 172.98 1bdf s LYS 200 N -4.03 -0.01 -0.23 8.23 -2.85 -0.65 -2.69 119.74 117.52 1bdf s LYS 200 Ca 0.21 0.37 -0.22 0.00 -1.00 0.00 0.00 55.97 55.33 1bdf s LYS 200 Cb 0.01 -0.33 -0.02 0.00 -2.06 0.00 0.00 37.83 35.44 1bdf s LYS 200 CO 0.12 -0.25 0.70 -1.17 0.10 0.00 0.00 175.35 174.85 1bdf s LEU 201 N 1.72 4.10 -0.43 2.77 2.96 0.80 -4.03 118.68 126.58 1bdf s LEU 201 Ca -0.02 0.88 -0.12 0.00 -0.22 0.00 0.00 54.13 54.64 1bdf s LEU 201 Cb -0.12 -2.99 0.06 0.00 0.50 0.00 0.00 46.19 43.65 1bdf s LEU 201 CO -0.04 -0.38 0.31 -0.69 -1.32 0.00 0.00 176.35 174.23 1bdf s VAL 202 N 2.38 4.75 -0.34 1.68 1.01 0.25 -0.99 120.40 129.14 1bdf s VAL 202 Ca 0.30 -1.14 -0.16 0.00 0.00 0.00 0.00 61.98 60.99 1bdf s VAL 202 Cb -0.16 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.39 1bdf s VAL 202 CO 0.09 -0.48 0.39 -0.63 0.00 0.00 0.00 175.10 174.46 1bdf s ILE 203 N 1.55 5.14 -0.27 2.22 1.01 0.22 -1.62 121.20 129.45 1bdf s ILE 203 Ca 0.03 0.12 -0.19 0.00 0.00 0.00 0.00 60.65 60.62 1bdf s ILE 203 Cb -0.23 -3.84 -0.02 0.00 0.01 0.00 0.00 42.46 38.38 1bdf s ILE 203 CO 0.05 -0.10 0.57 -0.70 0.00 0.00 0.00 174.94 174.76 1bdf s GLU 204 N 2.08 4.02 0.01 2.79 2.12 0.80 -0.43 118.70 130.10 1bdf s GLU 204 Ca 0.13 0.34 0.05 0.00 0.36 0.00 0.00 54.97 55.85 1bdf s GLU 204 Cb -0.16 -3.68 -0.03 0.00 0.26 0.00 0.00 34.13 30.52 1bdf s GLU 204 CO 0.12 -0.43 -0.13 1.41 -0.54 0.00 0.00 175.26 175.69 1bdf s MET 205 N 2.42 2.34 -0.38 4.30 1.75 0.23 -2.41 119.30 127.56 1bdf s MET 205 Ca 0.23 -0.83 0.01 0.00 -1.25 0.00 0.00 55.69 53.85 1bdf s MET 205 Cb -0.15 -2.35 0.13 0.00 2.84 0.00 0.00 34.83 35.29 1bdf s MET 205 CO 0.10 0.58 0.20 -2.00 -0.65 0.00 0.00 175.02 173.24 1bdf s GLU 206 N -1.31 0.95 0.54 4.11 2.12 -1.04 -0.84 118.70 123.23 1bdf s GLU 206 Ca 0.15 -1.59 0.02 0.00 0.36 0.00 0.00 54.97 53.92 1bdf s GLU 206 Cb -0.11 -1.98 0.10 0.00 0.26 0.00 0.00 34.13 32.41 1bdf s GLU 206 CO 0.05 -1.13 0.75 -2.37 -0.54 0.00 0.00 175.26 172.02 1bdf n THR 207 N 4.01 0.00 -0.37 -1.70 5.66 -0.06 0.21 114.28 122.03 1bdf n THR 207 Ca 0.06 -1.33 0.10 0.00 -3.05 0.00 0.00 64.05 59.83 1bdf n THR 207 Cb 0.37 -0.89 0.28 0.00 -1.55 0.00 0.00 70.33 68.54 1bdf n THR 207 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1bdf n ASN 208 N -2.80 3.79 0.00 1.09 6.94 0.87 -4.76 115.26 120.40 1bdf n ASN 208 Ca 0.13 -2.10 0.00 0.00 -0.02 0.00 0.00 54.58 52.59 1bdf n ASN 208 Cb 0.47 -0.43 0.00 0.00 -2.36 0.00 0.00 39.78 37.46 1bdf n ASN 208 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1bdf n GLY 209 N 1.19 2.93 0.00 4.83 0.00 -1.26 -4.83 105.19 108.04 1bdf n GLY 209 Ca 0.21 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.30 1bdf n GLY 209 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bdf n THR 210 N -0.94 0.79 -4.12 2.61 -2.24 -1.26 -4.67 114.28 104.46 1bdf n THR 210 Ca 0.00 0.20 -0.16 0.00 -2.27 0.00 0.00 64.05 61.82 1bdf n THR 210 Cb 0.00 -0.97 -0.15 0.00 -2.10 0.00 0.00 70.33 67.12 1bdf n THR 210 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1bdf s ILE 211 N -2.74 0.36 0.33 2.28 2.07 -1.26 -4.80 121.20 117.45 1bdf s ILE 211 Ca 0.11 -0.17 -0.25 0.00 -1.41 0.00 0.00 60.65 58.92 1bdf s ILE 211 Cb 0.09 -0.32 -0.10 0.00 0.13 0.00 0.00 42.46 42.26 1bdf s ILE 211 CO 0.23 0.11 0.94 -1.81 -1.91 0.00 0.00 174.94 172.50 1bdf s ASP 212 N 0.03 7.29 0.12 4.50 1.01 -1.26 -4.86 116.67 123.50 1bdf s ASP 212 Ca 0.00 1.81 -0.30 0.00 0.71 0.00 0.00 52.55 54.78 1bdf s ASP 212 Cb -0.03 -2.57 -0.08 0.00 1.01 0.00 0.00 42.92 41.25 1bdf s ASP 212 CO -0.00 -0.10 1.59 1.55 0.21 0.00 0.00 175.17 178.42 1bdf h PRO 213 N 3.02 -0.55 -0.85 8.23 0.13 -1.99 -0.81 132.00 139.18 1bdf h PRO 213 Ca -0.47 0.04 0.06 0.00 -0.87 0.00 0.00 66.00 64.75 1bdf h PRO 213 Cb 1.19 0.12 -0.05 0.00 0.13 0.00 0.00 31.00 32.39 1bdf h PRO 213 CO 0.64 -0.36 0.56 1.49 -0.23 0.00 0.00 178.00 180.10 1bdf h GLU 214 N -0.57 0.94 0.00 0.86 4.81 -2.00 -1.22 114.58 117.41 1bdf h GLU 214 Ca 0.05 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1bdf h GLU 214 Cb 0.64 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.80 1bdf h GLU 214 CO -0.29 0.62 -0.12 1.05 -0.73 0.00 0.00 179.01 179.55 1bdf h GLU 215 N 0.97 0.00 -0.10 1.92 4.11 -1.89 -0.69 114.58 118.90 1bdf h GLU 215 Ca 0.36 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.61 1bdf h GLU 215 Cb 0.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 1bdf h GLU 215 CO -0.13 0.12 -0.70 0.00 0.07 0.00 0.00 179.01 178.37 1bdf h ALA 216 N 1.88 0.58 -0.03 1.06 0.00 0.01 -2.64 119.26 120.12 1bdf h ALA 216 Ca -0.00 -0.59 -0.07 0.00 0.00 0.00 0.00 54.91 54.25 1bdf h ALA 216 Cb 0.87 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1bdf h ALA 216 CO 0.02 0.74 -0.24 0.82 0.00 0.00 0.00 179.25 180.59 1bdf h ILE 217 N 0.33 1.49 0.00 0.00 1.08 -1.07 -2.42 117.51 116.93 1bdf h ILE 217 Ca -0.03 -1.79 0.00 0.00 -0.39 0.00 0.00 64.86 62.65 1bdf h ILE 217 Cb 1.28 2.56 0.00 0.00 -3.07 0.00 0.00 36.82 37.59 1bdf h ILE 217 CO 0.13 0.50 0.00 0.54 -0.69 0.00 0.00 178.15 178.62 1bdf n ARG 218 N -4.52 0.04 -0.08 2.37 1.74 -0.29 -0.99 116.66 114.92 1bdf n ARG 218 Ca -0.09 0.27 -0.08 0.00 -0.77 0.00 0.00 57.85 57.18 1bdf n ARG 218 Cb 0.47 -1.50 -0.16 0.00 -1.02 0.00 0.00 32.46 30.26 1bdf n ARG 218 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1bdf n ARG 219 N -1.46 0.68 -0.03 5.56 3.00 -1.00 -3.20 116.66 120.21 1bdf n ARG 219 Ca 0.03 0.02 -0.13 0.00 -0.00 0.00 0.00 57.85 57.77 1bdf n ARG 219 Cb 0.13 -1.56 -0.09 0.00 0.00 0.00 0.00 32.46 30.94 1bdf n ARG 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1bdf h ALA 220 N 1.09 0.08 -0.64 5.13 0.00 -0.71 -2.00 119.26 122.21 1bdf h ALA 220 Ca -0.47 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.16 1bdf h ALA 220 Cb 2.11 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.85 1bdf h ALA 220 CO 0.03 -0.07 0.40 0.00 0.00 0.00 0.00 179.25 179.61 1bdf h ALA 221 N 0.50 0.83 -0.23 0.00 0.00 -1.25 -1.57 119.26 117.54 1bdf h ALA 221 Ca 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1bdf h ALA 221 Cb 0.64 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1bdf h ALA 221 CO 0.02 0.16 -0.09 1.15 0.00 0.00 0.00 179.25 180.49 1bdf h THR 222 N 0.79 1.19 -0.16 0.00 2.02 -1.51 0.13 112.91 115.37 1bdf h THR 222 Ca 0.26 -0.81 -0.19 0.00 0.77 0.00 0.00 66.41 66.44 1bdf h THR 222 Cb 0.01 1.11 -0.00 0.00 -1.74 0.00 0.00 68.15 67.53 1bdf h THR 222 CO -0.10 0.26 -0.67 0.40 0.37 0.00 0.00 175.52 175.78 1bdf h ILE 223 N 0.35 1.32 0.68 3.11 2.04 -0.75 -1.97 117.51 122.29 1bdf h ILE 223 Ca 0.07 -1.94 -0.03 0.00 1.00 0.00 0.00 64.86 63.96 1bdf h ILE 223 Cb 0.37 1.91 0.01 0.00 -0.74 0.00 0.00 36.82 38.37 1bdf h ILE 223 CO 0.02 0.60 -0.33 0.25 0.00 0.00 0.00 178.15 178.70 1bdf h LEU 224 N 0.45 -0.77 -1.26 1.44 5.85 -0.82 -2.70 115.31 117.50 1bdf h LEU 224 Ca -0.02 0.03 0.19 0.00 0.84 0.00 0.00 57.88 58.91 1bdf h LEU 224 Cb 1.25 0.20 -0.08 0.00 0.37 0.00 0.00 40.66 42.40 1bdf h LEU 224 CO 0.13 -0.46 0.61 0.00 -0.34 0.00 0.00 178.44 178.38 1bdf h ALA 225 N -1.39 1.92 0.00 1.25 0.00 -0.83 0.19 119.26 120.40 1bdf h ALA 225 Ca -0.09 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1bdf h ALA 225 Cb 0.70 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1bdf h ALA 225 CO 0.15 -0.23 0.00 0.93 0.00 0.00 0.00 179.25 180.10 1bdf h GLU 226 N 0.62 0.00 -0.03 0.00 5.08 -1.35 -2.90 114.58 116.00 1bdf h GLU 226 Ca 0.51 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.70 1bdf h GLU 226 Cb 0.97 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.21 1bdf h GLU 226 CO -0.26 0.00 -0.74 1.96 -1.00 0.00 0.00 179.01 178.97 1bdf h GLN 227 N 0.00 0.19 -0.05 2.33 1.08 -0.61 -3.15 115.11 114.90 1bdf h GLN 227 Ca 0.00 -0.17 0.00 0.00 -1.45 0.00 0.00 58.65 57.03 1bdf h GLN 227 Cb 0.72 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.19 1bdf h GLN 227 CO 0.00 0.84 0.00 1.28 -0.95 0.00 0.00 178.83 180.00 1bdf n LEU 228 N -3.75 0.75 -0.03 1.46 4.77 -1.10 -4.39 117.00 114.71 1bdf n LEU 228 Ca -0.03 -0.29 0.21 0.00 -0.03 0.00 0.00 56.01 55.88 1bdf n LEU 228 Cb 0.71 -0.03 0.69 0.00 -2.33 0.00 0.00 43.42 42.46 1bdf n LEU 228 CO 0.46 0.14 1.20 -0.33 -1.33 0.00 0.00 177.39 177.53 1bdf h GLU 229 N 1.08 0.01 -0.00 3.23 5.08 -1.50 -0.89 114.58 121.59 1bdf h GLU 229 Ca 0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1bdf h GLU 229 Cb 0.23 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1bdf h GLU 229 CO 0.00 0.01 -0.03 0.00 -1.00 0.00 0.00 179.01 177.99 1bdf n ALA 230 N -2.65 2.62 -0.94 3.43 0.00 -1.26 -3.48 120.51 118.23 1bdf n ALA 230 Ca 0.11 -0.20 0.03 0.00 0.00 0.00 0.00 53.44 53.38 1bdf n ALA 230 Cb 0.66 -1.45 0.05 0.00 0.00 0.00 0.00 19.45 18.71 1bdf n ALA 230 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1bdf n PHE 231 N -1.05 0.00 0.00 0.00 3.72 -0.37 -4.98 117.46 114.78 1bdf n PHE 231 Ca 0.18 -0.49 0.00 0.00 -0.05 0.00 0.00 57.45 57.09 1bdf n PHE 231 Cb 0.21 -0.08 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 1bdf n PHE 231 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1bdf n VAL 232 N -0.64 0.00 0.01 -4.37 0.31 -1.04 -5.10 118.33 107.50 1bdf n VAL 232 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 1bdf n VAL 232 Cb 0.52 -0.45 0.00 0.00 -0.91 0.00 0.00 33.84 33.00 1bdf n VAL 232 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1bdf n ASP 233 N -2.35 -0.20 -4.63 4.52 -0.08 -1.26 -5.11 116.55 107.46 1bdf n ASP 233 Ca 0.00 0.09 -0.43 0.00 -1.51 0.00 0.00 54.79 52.94 1bdf n ASP 233 Cb 0.00 0.36 -0.03 0.00 2.34 0.00 0.00 41.12 43.79 1bdf n ASP 233 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1bdf n LEU 234 N -2.30 3.63 0.00 -2.67 4.32 -1.26 -5.06 117.00 113.67 1bdf n LEU 234 Ca 0.00 0.55 0.00 0.00 -0.02 0.00 0.00 56.01 56.54 1bdf n LEU 234 Cb 0.00 -1.52 0.00 0.00 -1.62 0.00 0.00 43.42 40.28 1bdf n LEU 234 CO 0.00 -0.27 0.00 -1.14 -1.22 0.00 0.00 177.39 174.76