#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bdf s GLN 2 N 0.00 0.55 0.00 2.12 -2.07 -1.26 -5.16 119.66 113.85 1bdf s GLN 2 Ca 0.00 0.98 0.00 0.00 -1.82 0.00 0.00 55.36 54.52 1bdf s GLN 2 Cb 0.00 0.08 0.00 0.00 -1.09 0.00 0.00 33.01 32.00 1bdf s GLN 2 CO 0.00 -0.15 0.00 0.41 -1.32 0.00 0.00 175.29 174.23 1bdf n GLY 3 N 4.16 2.56 0.07 2.60 0.00 -1.26 -5.08 105.19 108.24 1bdf n GLY 3 Ca -0.21 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1bdf n GLY 3 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1bdf n SER 4 N 0.00 0.00 -3.66 1.61 2.88 -1.26 -5.09 113.62 108.10 1bdf n SER 4 Ca 0.00 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.28 1bdf n SER 4 Cb 0.00 0.02 -0.17 0.00 -0.75 0.00 0.00 64.21 63.31 1bdf n SER 4 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1bdf s VAL 5 N -1.03 0.11 0.12 2.46 0.11 -1.26 -5.13 120.40 115.77 1bdf s VAL 5 Ca 0.00 -0.19 -0.24 0.00 -2.93 0.00 0.00 61.98 58.62 1bdf s VAL 5 Cb 0.00 -0.65 -0.07 0.00 -1.53 0.00 0.00 36.38 34.13 1bdf s VAL 5 CO 0.00 -0.18 0.74 0.42 -3.33 0.00 0.00 175.10 172.75 1bdf s THR 6 N 2.05 4.52 0.00 5.04 -4.23 -1.26 -4.98 115.64 116.79 1bdf s THR 6 Ca 0.02 1.60 0.02 0.00 -1.18 0.00 0.00 61.69 62.14 1bdf s THR 6 Cb -0.16 -4.09 0.03 0.00 1.34 0.00 0.00 72.50 69.62 1bdf s THR 6 CO -0.08 0.49 0.95 -0.62 -0.54 0.00 0.00 174.62 174.82 1bdf n GLU 7 N 1.90 0.00 0.00 3.99 -0.58 -1.26 -5.13 120.64 119.57 1bdf n GLU 7 Ca -0.06 -0.94 0.00 0.00 -0.42 0.00 0.00 57.16 55.74 1bdf n GLU 7 Cb 0.49 0.39 0.00 0.00 -0.57 0.00 0.00 31.44 31.76 1bdf n GLU 7 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1bdf n PHE 8 N 0.03 0.00 -2.56 -0.32 3.72 -1.26 -5.06 117.46 112.01 1bdf n PHE 8 Ca -0.22 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.14 1bdf n PHE 8 Cb 0.70 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.26 1bdf n PHE 8 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 1bdf n LEU 9 N 0.00 -4.80 -4.75 4.37 -0.00 -1.26 -4.91 117.00 105.65 1bdf n LEU 9 Ca 0.00 -0.22 -0.40 0.00 -0.00 0.00 0.00 56.01 55.39 1bdf n LEU 9 Cb 0.00 -2.40 -0.06 0.00 -0.00 0.00 0.00 43.42 40.96 1bdf n LEU 9 CO 0.00 -0.39 0.65 -1.59 -0.00 0.00 0.00 177.39 176.06 1bdf s LYS 10 N -3.38 4.85 0.67 1.96 0.00 -1.26 -4.30 119.74 118.27 1bdf s LYS 10 Ca 0.13 1.50 -0.11 0.00 0.00 0.00 0.00 55.97 57.48 1bdf s LYS 10 Cb -0.02 -3.28 -0.01 0.00 0.00 0.00 0.00 37.83 34.52 1bdf s LYS 10 CO 0.48 0.50 1.06 -1.25 0.00 0.00 0.00 175.35 176.14 1bdf s PRO 11 N -1.15 3.19 -0.01 1.78 0.04 -0.70 -4.64 135.00 133.51 1bdf s PRO 11 Ca 0.41 0.72 -0.14 0.00 0.04 0.00 0.00 61.00 62.03 1bdf s PRO 11 Cb -0.26 -2.04 0.02 0.00 0.04 0.00 0.00 34.50 32.26 1bdf s PRO 11 CO 0.32 -0.86 0.30 -0.98 0.04 0.00 0.00 177.00 175.82 1bdf s ARG 12 N -5.19 0.68 -0.26 4.56 1.70 -1.26 -4.90 118.95 114.28 1bdf s ARG 12 Ca 0.57 -0.24 -0.28 0.00 -0.47 0.00 0.00 55.73 55.30 1bdf s ARG 12 Cb -0.12 0.30 -0.05 0.00 -0.57 0.00 0.00 34.95 34.51 1bdf s ARG 12 CO 0.54 -0.19 2.20 -1.17 -1.08 0.00 0.00 175.30 175.60 1bdf s LEU 13 N -1.43 3.43 -0.01 -1.89 0.20 -1.26 -2.18 118.68 115.55 1bdf s LEU 13 Ca -0.13 1.76 0.17 0.00 0.69 0.00 0.00 54.13 56.63 1bdf s LEU 13 Cb -0.05 -3.42 -0.23 0.00 -0.43 0.00 0.00 46.19 42.07 1bdf s LEU 13 CO 0.03 -2.04 0.57 0.55 -0.29 0.00 0.00 176.35 175.17 1bdf n VAL 14 N 7.76 0.00 -3.59 1.68 3.14 0.86 -4.99 118.33 123.20 1bdf n VAL 14 Ca 0.30 -0.24 -0.10 0.00 -2.96 0.00 0.00 64.34 61.34 1bdf n VAL 14 Cb 0.46 0.58 -0.06 0.00 -1.06 0.00 0.00 33.84 33.76 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 -3.28 -0.39 -0.12 6.55 -1.08 -1.21 -5.01 116.67 112.14 1bdf s ASP 15 Ca 0.00 0.50 -0.02 0.00 -0.52 0.00 0.00 52.55 52.52 1bdf s ASP 15 Cb 0.12 0.42 0.04 0.00 -1.46 0.00 0.00 42.92 42.04 1bdf s ASP 15 CO 0.72 -0.31 0.01 -0.63 0.52 0.00 0.00 175.17 175.48 1bdf s ILE 16 N -0.83 0.47 -0.47 4.11 1.01 -1.26 -2.16 121.20 122.07 1bdf s ILE 16 Ca -0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 60.65 60.48 1bdf s ILE 16 Cb -0.01 -0.74 0.13 0.00 0.01 0.00 0.00 42.46 41.84 1bdf s ILE 16 CO 0.00 0.11 0.27 -0.70 0.00 0.00 0.00 174.94 174.62 1bdf s GLU 17 N 1.92 2.14 -0.84 2.79 2.12 -0.76 -4.94 118.70 121.13 1bdf s GLU 17 Ca 0.03 -2.06 -0.25 0.00 0.36 0.00 0.00 54.97 53.05 1bdf s GLU 17 Cb -0.14 -3.60 0.00 0.00 0.26 0.00 0.00 34.13 30.65 1bdf s GLU 17 CO -0.06 -1.10 1.66 -0.65 -0.54 0.00 0.00 175.26 174.56 1bdf s GLN 18 N 0.74 2.98 0.60 4.30 -1.52 -1.26 -1.06 119.66 124.44 1bdf s GLN 18 Ca 0.11 -0.31 0.31 0.00 -1.95 0.00 0.00 55.36 53.53 1bdf s GLN 18 Cb -0.22 -4.81 1.87 0.00 -0.22 0.00 0.00 33.01 29.63 1bdf s GLN 18 CO -0.04 -2.66 2.25 0.28 -0.25 0.00 0.00 175.29 174.87 1bdf h VAL 19 N 6.80 0.46 -1.48 1.09 2.07 -0.41 -3.46 116.25 121.32 1bdf h VAL 19 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1bdf h VAL 19 Cb 1.05 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1bdf h VAL 19 CO 1.29 0.00 0.00 -1.54 0.02 0.00 0.00 177.57 177.34 1bdf n SER 20 N -3.75 0.00 0.23 0.57 3.41 -0.59 -4.94 113.62 108.54 1bdf n SER 20 Ca -0.02 -0.81 0.10 0.00 -0.26 0.00 0.00 58.87 57.87 1bdf n SER 20 Cb 0.11 0.00 0.53 0.00 -0.26 0.00 0.00 64.21 64.59 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 -3.28 113.55 116.93 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 0.22 -0.04 0.35 -0.87 0.00 0.00 176.83 176.50 1bdf n THR 22 N -3.56 0.68 -3.89 2.95 -2.24 -1.26 -4.72 114.28 102.25 1bdf n THR 22 Ca -0.01 -0.72 -0.23 0.00 -2.27 0.00 0.00 64.05 60.82 1bdf n THR 22 Cb 0.37 0.59 -0.17 0.00 -2.10 0.00 0.00 70.33 69.02 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 -0.79 0.90 0.23 4.78 5.65 -1.24 0.01 115.29 124.83 1bdf s HIS 23 Ca 0.03 -0.32 0.01 0.00 0.25 0.00 0.00 55.06 55.03 1bdf s HIS 23 Cb 0.03 -0.89 -0.05 0.00 -1.18 0.00 0.00 32.58 30.49 1bdf s HIS 23 CO 0.00 -0.35 0.10 0.00 -0.65 0.00 0.00 174.74 173.84 1bdf s ALA 24 N 1.71 1.49 -0.32 1.58 0.00 -0.22 0.38 121.76 126.37 1bdf s ALA 24 Ca 0.02 -1.78 -0.01 0.00 0.00 0.00 0.00 51.96 50.20 1bdf s ALA 24 Cb -0.13 1.10 0.10 0.00 0.00 0.00 0.00 23.12 24.19 1bdf s ALA 24 CO -0.05 -0.49 0.11 0.15 0.00 0.00 0.00 175.76 175.48 1bdf s LYS 25 N -4.06 0.71 0.10 0.00 1.02 -0.22 -0.39 119.74 116.89 1bdf s LYS 25 Ca 0.36 -1.10 -0.14 0.00 0.02 0.00 0.00 55.97 55.11 1bdf s LYS 25 Cb 0.07 -1.95 -0.06 0.00 -0.52 0.00 0.00 37.83 35.37 1bdf s LYS 25 CO 0.12 -1.00 0.50 0.08 -0.92 0.00 0.00 175.35 174.12 1bdf s VAL 26 N 1.56 4.92 -0.12 3.17 1.01 0.60 -1.83 120.40 129.72 1bdf s VAL 26 Ca 0.10 0.81 -0.01 0.00 0.00 0.00 0.00 61.98 62.88 1bdf s VAL 26 Cb -0.18 -3.74 0.03 0.00 0.00 0.00 0.00 36.38 32.50 1bdf s VAL 26 CO -0.24 0.36 -0.02 0.42 0.00 0.00 0.00 175.10 175.62 1bdf s THR 27 N -1.33 0.70 -0.18 3.92 -4.23 -0.92 0.93 115.64 114.53 1bdf s THR 27 Ca 0.33 -0.23 -0.15 0.00 -1.18 0.00 0.00 61.69 60.46 1bdf s THR 27 Cb -0.16 -0.88 -0.04 0.00 1.34 0.00 0.00 72.50 72.76 1bdf s THR 27 CO 0.18 0.19 0.35 -0.76 -0.54 0.00 0.00 174.62 174.03 1bdf s LEU 28 N 1.82 4.20 0.00 4.79 1.43 -0.04 -0.10 118.68 130.78 1bdf s LEU 28 Ca 0.03 0.51 0.00 0.00 -1.03 0.00 0.00 54.13 53.64 1bdf s LEU 28 Cb -0.14 -2.44 0.00 0.00 0.03 0.00 0.00 46.19 43.64 1bdf s LEU 28 CO -0.07 0.01 0.00 1.21 0.23 0.00 0.00 176.35 177.73 1bdf n GLU 29 N 4.05 0.00 -1.52 1.70 2.13 -0.93 0.45 120.64 126.53 1bdf n GLU 29 Ca -0.10 0.01 -0.40 0.00 0.66 0.00 0.00 57.16 57.33 1bdf n GLU 29 Cb 0.51 -0.30 -0.07 0.00 0.27 0.00 0.00 31.44 31.85 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 -2.05 0.75 -3.85 5.31 -0.02 -1.26 -3.75 135.00 130.14 1bdf n PRO 30 Ca 0.00 0.06 -0.27 0.00 -2.02 0.00 0.00 63.50 61.27 1bdf n PRO 30 Cb 0.00 -2.68 -0.17 0.00 -0.02 0.00 0.00 33.50 30.63 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 10.34 1.31 0.56 2.45 1.43 -1.06 -1.71 118.68 131.99 1bdf s LEU 31 Ca 1.12 -0.54 -0.20 0.00 -1.03 0.00 0.00 54.13 53.48 1bdf s LEU 31 Cb -0.63 -0.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.78 1bdf s LEU 31 CO 0.37 -0.20 1.23 -1.61 0.23 0.00 0.00 176.35 176.38 1bdf s GLU 32 N 1.74 3.13 0.19 1.70 0.41 -1.26 -1.11 118.70 123.50 1bdf s GLU 32 Ca 0.02 1.91 -0.31 0.00 -0.41 0.00 0.00 54.97 56.18 1bdf s GLU 32 Cb -0.15 -2.08 -0.16 0.00 -1.78 0.00 0.00 34.13 29.96 1bdf s GLU 32 CO -0.07 -1.10 0.93 0.54 -0.49 0.00 0.00 175.26 175.06 1bdf n ARG 33 N -1.29 0.76 0.00 1.61 5.12 -1.25 -1.20 116.66 120.41 1bdf n ARG 33 Ca 0.12 0.27 0.00 0.00 -1.93 0.00 0.00 57.85 56.31 1bdf n ARG 33 Cb 0.48 -1.59 0.00 0.00 -1.16 0.00 0.00 32.46 30.19 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 1.75 2.99 0.12 -0.13 0.00 -1.26 -4.84 105.19 103.82 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 0.56 1.61 0.04 -1.49 -3.14 116.94 114.52 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 -0.27 0.78 -0.60 0.00 0.00 178.31 178.22 1bdf h GLY 36 N 4.44 -0.79 2.00 -1.45 0.00 -1.89 -2.08 103.07 103.31 1bdf h GLY 36 Ca 0.00 0.29 -0.10 0.00 0.00 0.00 0.00 47.33 47.52 1bdf h GLY 36 CO 0.00 -0.29 -0.48 0.45 0.00 0.00 0.00 176.54 176.23 1bdf h HIS 37 N -0.85 0.00 -0.02 5.60 3.86 -1.97 0.30 115.15 122.08 1bdf h HIS 37 Ca -0.08 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.13 1bdf h HIS 37 Cb 0.61 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.08 1bdf h HIS 37 CO -0.02 0.48 -0.00 1.15 0.86 0.00 0.00 177.93 180.40 1bdf h THR 38 N 0.00 1.27 -0.06 2.45 2.02 -1.48 -0.93 112.91 116.18 1bdf h THR 38 Ca -0.00 -0.81 -0.20 0.00 0.77 0.00 0.00 66.41 66.17 1bdf h THR 38 Cb 0.87 1.78 0.01 0.00 -1.74 0.00 0.00 68.15 69.07 1bdf h THR 38 CO 0.06 0.21 -0.75 -0.07 0.37 0.00 0.00 175.52 175.35 1bdf h LEU 39 N -0.30 0.76 -0.82 2.58 3.38 -1.37 -2.69 115.31 116.84 1bdf h LEU 39 Ca 0.01 -0.70 0.15 0.00 0.09 0.00 0.00 57.88 57.43 1bdf h LEU 39 Cb 0.35 -0.23 -0.10 0.00 0.09 0.00 0.00 40.66 40.77 1bdf h LEU 39 CO 0.00 1.35 0.39 1.23 0.09 0.00 0.00 178.44 181.50 1bdf h GLY 40 N 0.24 1.32 1.76 0.83 0.00 -0.40 0.27 103.07 107.09 1bdf h GLY 40 Ca -0.08 -0.21 -0.25 0.00 0.00 0.00 0.00 47.33 46.79 1bdf h GLY 40 CO 0.15 -0.07 -1.13 3.43 0.00 0.00 0.00 176.54 178.92 1bdf h ASN 41 N 0.55 0.28 0.32 0.19 4.21 -1.23 -1.73 115.58 118.17 1bdf h ASN 41 Ca 0.45 -0.29 -0.02 0.00 1.21 0.00 0.00 56.30 57.66 1bdf h ASN 41 Cb 0.67 -0.09 0.00 0.00 -1.12 0.00 0.00 38.32 37.79 1bdf h ASN 41 CO -0.39 1.21 -0.15 0.00 -1.29 0.00 0.00 177.43 176.81 1bdf h ALA 42 N 0.75 -0.43 0.14 -0.83 0.00 -0.93 -2.82 119.26 115.14 1bdf h ALA 42 Ca -0.09 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1bdf h ALA 42 Cb 1.86 0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.82 1bdf h ALA 42 CO 0.17 -0.60 -0.07 -0.07 0.00 0.00 0.00 179.25 178.68 1bdf h LEU 43 N -0.71 -0.16 -1.90 0.00 3.38 -0.63 -2.53 115.31 112.76 1bdf h LEU 43 Ca -0.04 -0.07 0.17 0.00 0.09 0.00 0.00 57.88 58.02 1bdf h LEU 43 Cb 0.49 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1bdf h LEU 43 CO 0.07 -0.03 0.57 -0.09 0.09 0.00 0.00 178.44 179.05 1bdf h ARG 44 N -0.28 0.00 0.07 1.13 2.43 -1.37 0.29 114.38 116.65 1bdf h ARG 44 Ca -0.02 0.00 -0.27 0.00 -0.81 0.00 0.00 59.98 58.88 1bdf h ARG 44 Cb 0.22 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.76 1bdf h ARG 44 CO 0.03 0.00 -1.34 0.00 -1.51 0.00 0.00 179.97 177.15 1bdf h ALA 45 N 1.42 0.33 -0.04 2.80 0.00 -1.19 -2.42 119.26 120.16 1bdf h ALA 45 Ca 0.28 -1.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.07 1bdf h ALA 45 Cb 1.41 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1bdf h ALA 45 CO -0.00 1.20 -0.24 0.82 0.00 0.00 0.00 179.25 181.03 1bdf h ILE 46 N 0.04 1.47 -0.53 0.00 1.08 -0.19 -3.20 117.51 116.18 1bdf h ILE 46 Ca -0.16 -1.74 0.00 0.00 -0.39 0.00 0.00 64.86 62.58 1bdf h ILE 46 Cb 1.93 2.48 -0.03 0.00 -3.07 0.00 0.00 36.82 38.13 1bdf h ILE 46 CO 0.15 0.48 0.34 -0.07 -0.69 0.00 0.00 178.15 178.36 1bdf h LEU 47 N -0.33 0.63 0.00 1.44 3.38 -0.85 0.27 115.31 119.84 1bdf h LEU 47 Ca -0.02 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1bdf h LEU 47 Cb 0.91 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1bdf h LEU 47 CO 0.05 0.47 0.00 0.18 0.09 0.00 0.00 178.44 179.23 1bdf n LEU 48 N -4.69 0.00 0.00 1.67 4.77 -0.91 -4.34 117.00 113.50 1bdf n LEU 48 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1bdf n LEU 48 Cb 0.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 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 -0.63 0.00 -0.43 -1.43 3.41 -1.01 -4.98 113.62 108.56 1bdf n SER 49 Ca 0.05 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.69 1bdf n SER 49 Cb 0.02 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.07 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 2.62 -4.75 4.04 7.64 0.92 -4.19 113.62 119.90 1bdf n SER 50 Ca 0.00 -2.00 -0.40 0.00 1.01 0.00 0.00 58.87 57.48 1bdf n SER 50 Cb 0.00 -0.15 -0.06 0.00 -1.01 0.00 0.00 64.21 62.99 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 4.81 0.00 1.43 -1.94 -1.21 -4.96 119.30 116.43 1bdf s MET 51 Ca 0.15 1.51 0.00 0.00 -1.71 0.00 0.00 55.69 55.64 1bdf s MET 51 Cb 0.08 -3.29 0.00 0.00 2.01 0.00 0.00 34.83 33.63 1bdf s MET 51 CO 0.11 0.43 0.00 -2.30 -0.01 0.00 0.00 175.02 173.25 1bdf n PRO 52 N 1.73 0.00 0.00 2.03 -0.02 -1.26 -3.89 135.00 133.60 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 0.36 1.15 3.85 -1.23 0.00 -1.23 -3.77 105.19 104.32 1bdf n GLY 53 Ca 0.00 -1.76 -0.34 0.00 0.00 0.00 0.00 46.02 43.92 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 -1.24 -1.22 0.02 0.00 0.00 0.72 -4.64 121.76 115.40 1bdf s ALA 55 Ca 0.24 0.90 -0.30 0.00 0.00 0.00 0.00 51.96 52.80 1bdf s ALA 55 Cb -0.12 -0.14 -0.05 0.00 0.00 0.00 0.00 23.12 22.81 1bdf s ALA 55 CO 0.15 -0.29 1.22 0.08 0.00 0.00 0.00 175.76 176.92 1bdf s VAL 56 N -0.95 4.06 -0.05 0.00 1.01 -1.26 0.01 120.40 123.22 1bdf s VAL 56 Ca -0.10 1.45 0.03 0.00 0.00 0.00 0.00 61.98 63.36 1bdf s VAL 56 Cb -0.03 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 1bdf s VAL 56 CO 0.05 0.06 -0.01 0.35 0.00 0.00 0.00 175.10 175.56 1bdf n THR 57 N 4.23 0.33 -4.07 3.92 -2.24 0.06 -4.24 114.28 112.27 1bdf n THR 57 Ca 0.10 -0.17 -0.07 0.00 -2.27 0.00 0.00 64.05 61.64 1bdf n THR 57 Cb 0.46 -0.81 -0.10 0.00 -2.10 0.00 0.00 70.33 67.78 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 -2.11 0.55 -0.10 -0.78 2.02 -1.21 -1.14 118.70 115.91 1bdf s GLU 58 Ca -0.05 -1.09 -0.08 0.00 0.02 0.00 0.00 54.97 53.77 1bdf s GLU 58 Cb 0.02 0.19 0.03 0.00 0.10 0.00 0.00 34.13 34.47 1bdf s GLU 58 CO 0.17 -0.10 0.27 0.08 0.02 0.00 0.00 175.26 175.70 1bdf s VAL 59 N -3.39 -0.01 -0.37 2.63 1.01 0.62 0.60 120.40 121.48 1bdf s VAL 59 Ca 0.02 0.04 0.03 0.00 0.00 0.00 0.00 61.98 62.07 1bdf s VAL 59 Cb 0.04 -0.38 0.11 0.00 0.00 0.00 0.00 36.38 36.15 1bdf s VAL 59 CO -0.08 0.02 0.11 -0.70 0.00 0.00 0.00 175.10 174.44 1bdf s GLU 60 N 0.45 1.41 -0.11 2.72 2.12 -0.11 -1.30 118.70 123.88 1bdf s GLU 60 Ca -0.03 -1.86 -0.15 0.00 0.36 0.00 0.00 54.97 53.29 1bdf s GLU 60 Cb -0.04 -2.93 -0.05 0.00 0.26 0.00 0.00 34.13 31.37 1bdf s GLU 60 CO -0.02 -0.99 0.36 0.42 -0.54 0.00 0.00 175.26 174.48 1bdf s ILE 61 N 0.79 5.22 0.19 -3.70 1.01 -1.26 -1.07 121.20 122.38 1bdf s ILE 61 Ca 0.12 0.70 -0.31 0.00 0.00 0.00 0.00 60.65 61.16 1bdf s ILE 61 Cb -0.20 -3.68 -0.10 0.00 0.01 0.00 0.00 42.46 38.48 1bdf s ILE 61 CO -0.09 0.44 1.55 -1.81 0.00 0.00 0.00 174.94 175.02 1bdf s ASP 62 N 0.02 6.58 0.00 3.58 1.01 -0.11 -2.67 116.67 125.07 1bdf s ASP 62 Ca 0.21 2.66 0.00 0.00 0.71 0.00 0.00 52.55 56.12 1bdf s ASP 62 Cb -0.14 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.18 1bdf s ASP 62 CO 0.08 -0.81 0.00 0.61 0.21 0.00 0.00 175.17 175.26 1bdf n GLY 63 N 3.34 3.02 3.52 0.21 0.00 -1.26 -4.83 105.19 109.19 1bdf n GLY 63 Ca 0.12 0.00 -0.43 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 -1.57 4.63 -0.05 1.61 1.01 -1.09 -4.88 120.40 120.06 1bdf s VAL 64 Ca 0.00 0.26 -0.23 0.00 0.00 0.00 0.00 61.98 62.01 1bdf s VAL 64 Cb 0.00 -4.36 -0.18 0.00 0.00 0.00 0.00 36.38 31.84 1bdf s VAL 64 CO 0.00 -0.82 0.96 0.25 0.00 0.00 0.00 175.10 175.49 1bdf h LEU 65 N 10.25 -0.12 -9.01 3.92 5.85 -1.92 -3.42 115.31 120.85 1bdf h LEU 65 Ca -0.25 -0.45 -0.49 0.00 0.84 0.00 0.00 57.88 57.53 1bdf h LEU 65 Cb 1.08 0.03 -0.13 0.00 0.37 0.00 0.00 40.66 42.01 1bdf h LEU 65 CO 0.99 0.46 -0.49 -1.38 -0.34 0.00 0.00 178.44 177.67 1bdf s HIS 66 N -3.50 1.76 0.22 1.25 -3.43 -1.26 -3.76 115.29 106.57 1bdf s HIS 66 Ca -0.14 -1.60 -0.08 0.00 -0.80 0.00 0.00 55.06 52.44 1bdf s HIS 66 Cb 0.00 -0.80 0.18 0.00 -1.43 0.00 0.00 32.58 30.54 1bdf s HIS 66 CO 0.54 -0.77 1.84 0.93 -2.00 0.00 0.00 174.74 175.29 1bdf h GLU 67 N 2.06 1.19 -0.97 -0.38 5.08 -1.94 -2.74 114.58 116.88 1bdf h GLU 67 Ca -0.27 -0.14 -0.10 0.00 -1.00 0.00 0.00 59.36 57.85 1bdf h GLU 67 Cb 1.24 -0.23 -0.06 0.00 0.50 0.00 0.00 28.75 30.20 1bdf h GLU 67 CO 0.40 0.88 0.13 0.66 -1.00 0.00 0.00 179.01 180.08 1bdf n TYR 68 N -4.37 0.74 -0.20 4.33 4.02 -1.26 -4.13 117.16 116.30 1bdf n TYR 68 Ca 0.08 -0.69 0.00 0.00 -0.01 0.00 0.00 57.90 57.28 1bdf n TYR 68 Cb 0.10 -0.38 0.00 0.00 -0.02 0.00 0.00 39.34 39.04 1bdf n TYR 68 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1bdf n SER 69 N 0.09 0.00 -3.83 7.72 7.64 -1.03 -5.10 113.62 119.11 1bdf n SER 69 Ca 0.14 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.90 1bdf n SER 69 Cb 0.73 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.83 1bdf n SER 69 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1bdf s THR 70 N 0.45 0.05 -0.40 0.44 -4.23 -1.26 -4.79 115.64 105.90 1bdf s THR 70 Ca 0.00 -0.38 0.02 0.00 -1.18 0.00 0.00 61.69 60.15 1bdf s THR 70 Cb 0.00 -0.38 0.15 0.00 1.34 0.00 0.00 72.50 73.61 1bdf s THR 70 CO 0.00 -0.21 0.27 -0.54 -0.54 0.00 0.00 174.62 173.60 1bdf s LYS 71 N -0.75 0.86 0.18 3.99 -0.14 -1.26 -4.71 119.74 117.91 1bdf s LYS 71 Ca -0.08 -1.79 -0.25 0.00 -1.36 0.00 0.00 55.97 52.49 1bdf s LYS 71 Cb -0.05 -1.58 0.05 0.00 -1.68 0.00 0.00 37.83 34.57 1bdf s LYS 71 CO 0.01 -1.27 1.50 0.39 -0.76 0.00 0.00 175.35 175.22 1bdf n GLU 72 N 3.46 -0.35 -0.02 1.68 1.02 -1.26 -1.09 120.64 124.07 1bdf n GLU 72 Ca 0.18 1.48 0.00 0.00 -0.02 0.00 0.00 57.16 58.80 1bdf n GLU 72 Cb 0.40 -2.18 0.01 0.00 -0.02 0.00 0.00 31.44 29.65 1bdf n GLU 72 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bdf n GLY 73 N -1.33 1.56 3.07 0.62 0.00 -1.26 -4.77 105.19 103.07 1bdf n GLY 73 Ca 0.05 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.00 1.55 0.10 1.61 1.01 -0.25 -0.78 120.40 122.64 1bdf s VAL 74 Ca 0.01 -0.68 -0.33 0.00 0.00 0.00 0.00 61.98 60.99 1bdf s VAL 74 Cb 0.01 -1.41 -0.14 0.00 0.00 0.00 0.00 36.38 34.84 1bdf s VAL 74 CO 0.00 0.45 1.53 -0.61 0.00 0.00 0.00 175.10 176.48 1bdf h GLN 75 N 7.41 -0.67 -6.69 2.72 4.15 -1.23 -3.44 115.11 117.36 1bdf h GLN 75 Ca -0.31 0.05 -0.50 0.00 0.77 0.00 0.00 58.65 58.66 1bdf h GLN 75 Cb 1.18 0.15 -0.03 0.00 0.21 0.00 0.00 27.48 28.99 1bdf h GLN 75 CO 0.50 -0.45 0.08 -1.83 -1.93 0.00 0.00 178.83 175.19 1bdf s GLU 76 N -5.64 4.00 0.68 1.69 1.03 -1.26 -5.07 118.70 114.12 1bdf s GLU 76 Ca -0.16 0.64 -0.12 0.00 0.03 0.00 0.00 54.97 55.36 1bdf s GLU 76 Cb 0.06 -2.48 0.00 0.00 -0.80 0.00 0.00 34.13 30.91 1bdf s GLU 76 CO 0.58 0.19 1.07 0.16 -1.33 0.00 0.00 175.26 175.93 1bdf s ASP 77 N -2.24 5.32 0.40 0.83 1.47 -1.26 -4.79 116.67 116.40 1bdf s ASP 77 Ca 0.53 1.73 0.21 0.00 1.18 0.00 0.00 52.55 56.20 1bdf s ASP 77 Cb -0.11 -2.51 1.17 0.00 -0.34 0.00 0.00 42.92 41.13 1bdf s ASP 77 CO 0.18 -1.48 1.74 0.40 0.68 0.00 0.00 175.17 176.68 1bdf h ILE 78 N -0.42 0.43 -0.18 2.11 1.08 -1.87 0.22 117.51 118.88 1bdf h ILE 78 Ca -0.45 -0.11 -0.01 0.00 -0.39 0.00 0.00 64.86 63.90 1bdf h ILE 78 Cb 1.22 0.08 -0.01 0.00 -3.07 0.00 0.00 36.82 35.04 1bdf h ILE 78 CO 0.56 0.06 0.08 -0.07 -0.69 0.00 0.00 178.15 178.09 1bdf h LEU 79 N 0.32 0.24 -1.66 1.44 3.38 -1.92 -0.87 115.31 116.24 1bdf h LEU 79 Ca 0.65 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.51 1bdf h LEU 79 Cb 1.74 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 42.40 1bdf h LEU 79 CO -0.33 0.30 0.26 -0.33 0.09 0.00 0.00 178.44 178.43 1bdf h GLU 80 N 0.16 0.44 -0.32 1.13 5.08 -0.95 -0.67 114.58 119.45 1bdf h GLU 80 Ca 0.06 -0.03 -0.14 0.00 -1.00 0.00 0.00 59.36 58.26 1bdf h GLU 80 Cb 0.13 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 1bdf h GLU 80 CO -0.01 0.29 -0.34 0.82 -1.00 0.00 0.00 179.01 178.77 1bdf h ILE 81 N 0.45 1.29 -0.34 3.13 2.04 -0.60 -1.05 117.51 122.43 1bdf h ILE 81 Ca 0.15 -1.52 -0.07 0.00 1.00 0.00 0.00 64.86 64.42 1bdf h ILE 81 Cb 0.06 1.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.66 1bdf h ILE 81 CO -0.04 0.49 -0.10 -0.07 0.00 0.00 0.00 178.15 178.44 1bdf h LEU 82 N 0.57 0.55 -1.05 1.44 3.38 -0.28 0.20 115.31 120.12 1bdf h LEU 82 Ca 0.05 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 1bdf h LEU 82 Cb 0.93 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1bdf h LEU 82 CO 0.08 0.69 -0.37 0.25 0.09 0.00 0.00 178.44 179.19 1bdf h LEU 83 N 0.53 0.20 -0.23 1.67 5.85 -1.04 -1.74 115.31 120.56 1bdf h LEU 83 Ca 0.10 -0.08 -0.21 0.00 0.84 0.00 0.00 57.88 58.53 1bdf h LEU 83 Cb 0.49 -0.06 0.01 0.00 0.37 0.00 0.00 40.66 41.47 1bdf h LEU 83 CO 0.03 0.56 -0.76 0.78 -0.34 0.00 0.00 178.44 178.71 1bdf h ASN 84 N 0.17 0.84 0.36 1.25 2.35 0.15 -3.15 115.58 117.55 1bdf h ASN 84 Ca 0.02 -0.55 -0.06 0.00 -0.55 0.00 0.00 56.30 55.16 1bdf h ASN 84 Cb 0.74 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 1bdf h ASN 84 CO 0.06 1.33 -0.29 -0.07 -1.65 0.00 0.00 177.43 176.81 1bdf h LEU 85 N 0.48 0.00 -1.37 1.61 3.38 -0.37 -2.74 115.31 116.31 1bdf h LEU 85 Ca -0.05 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1bdf h LEU 85 Cb 1.38 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.10 1bdf h LEU 85 CO 0.15 0.29 0.36 0.11 0.09 0.00 0.00 178.44 179.44 1bdf h LYS 86 N 0.00 0.79 -0.69 1.13 1.57 -1.27 -1.05 116.57 117.05 1bdf h LYS 86 Ca -0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1bdf h LYS 86 Cb 0.55 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1bdf h LYS 86 CO 0.04 0.55 0.00 0.41 -0.57 0.00 0.00 179.45 179.87 1bdf n GLY 87 N -1.37 1.23 3.56 3.86 0.00 -1.03 -4.73 105.19 106.70 1bdf n GLY 87 Ca 0.06 -0.20 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.74 3.65 -0.41 0.99 0.20 -0.40 -4.97 118.68 117.00 1bdf s LEU 88 Ca 0.12 -0.02 -0.22 0.00 0.69 0.00 0.00 54.13 54.70 1bdf s LEU 88 Cb 0.08 -3.07 0.02 0.00 -0.43 0.00 0.00 46.19 42.79 1bdf s LEU 88 CO 0.05 -1.40 0.72 0.00 -0.29 0.00 0.00 176.35 175.42 1bdf s ALA 89 N 4.65 3.37 -0.03 5.97 0.00 -1.26 -4.64 121.76 129.82 1bdf s ALA 89 Ca 0.39 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.44 1bdf s ALA 89 Cb -0.09 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 1bdf s ALA 89 CO 0.24 -1.68 -0.15 0.08 0.00 0.00 0.00 175.76 174.25 1bdf s VAL 90 N 3.01 1.24 -0.28 0.00 1.01 -1.26 -2.41 120.40 121.70 1bdf s VAL 90 Ca 0.27 -0.63 -0.02 0.00 0.00 0.00 0.00 61.98 61.60 1bdf s VAL 90 Cb -0.13 -1.05 0.04 0.00 0.00 0.00 0.00 36.38 35.24 1bdf s VAL 90 CO 0.19 0.36 -0.02 -0.60 0.00 0.00 0.00 175.10 175.03 1bdf s ARG 91 N -0.10 2.54 -0.04 2.72 3.52 0.86 -4.39 118.95 124.05 1bdf s ARG 91 Ca 0.00 -1.19 -0.00 0.00 -0.13 0.00 0.00 55.73 54.41 1bdf s ARG 91 Cb -0.09 -3.12 -0.04 0.00 -1.56 0.00 0.00 34.95 30.15 1bdf s ARG 91 CO 0.01 -0.56 0.02 0.08 -0.81 0.00 0.00 175.30 174.04 1bdf s VAL 92 N 1.27 4.34 0.00 7.11 1.01 -1.26 -0.11 120.40 132.76 1bdf s VAL 92 Ca -0.04 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 61.55 1bdf s VAL 92 Cb -0.19 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.30 1bdf s VAL 92 CO -0.02 0.48 0.52 1.67 0.00 0.00 0.00 175.10 177.75 1bdf n GLN 93 N 1.71 0.00 0.00 2.72 7.27 -1.00 -4.69 117.38 123.39 1bdf n GLN 93 Ca -0.16 0.51 0.00 0.00 0.07 0.00 0.00 57.00 57.42 1bdf n GLN 93 Cb 0.53 -1.02 0.00 0.00 2.41 0.00 0.00 30.24 32.16 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 -0.99 0.55 3.77 1.69 0.00 -1.26 -5.10 105.19 103.85 1bdf n GLY 94 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 2.80 -0.09 1.61 3.01 -1.26 -4.95 119.74 120.86 1bdf s LYS 95 Ca 0.00 1.44 0.18 0.00 -1.01 0.00 0.00 55.97 56.58 1bdf s LYS 95 Cb 0.00 -1.95 0.66 0.00 -1.01 0.00 0.00 37.83 35.53 1bdf s LYS 95 CO 0.00 -1.26 1.57 -0.25 0.51 0.00 0.00 175.35 175.92 1bdf n ASP 96 N -2.34 4.41 -3.50 2.83 8.00 -1.26 -4.75 116.55 119.94 1bdf n ASP 96 Ca 0.11 -2.38 0.01 0.00 0.71 0.00 0.00 54.79 53.24 1bdf n ASP 96 Cb 0.52 -0.53 -0.05 0.00 -0.02 0.00 0.00 41.12 41.04 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 -1.71 0.21 -0.01 -1.24 2.12 -1.26 -2.24 118.70 114.58 1bdf s GLU 97 Ca 0.47 0.42 -0.00 0.00 0.36 0.00 0.00 54.97 56.22 1bdf s GLU 97 Cb 0.30 0.14 0.01 0.00 0.26 0.00 0.00 34.13 34.84 1bdf s GLU 97 CO 0.24 -0.05 0.01 0.54 -0.54 0.00 0.00 175.26 175.46 1bdf s VAL 98 N 1.67 -0.02 -0.23 3.70 0.11 -0.28 -5.01 120.40 120.33 1bdf s VAL 98 Ca -0.05 0.06 -0.12 0.00 -2.93 0.00 0.00 61.98 58.94 1bdf s VAL 98 Cb -0.03 -0.04 -0.05 0.00 -1.53 0.00 0.00 36.38 34.73 1bdf s VAL 98 CO -0.14 0.03 0.22 -0.63 -3.33 0.00 0.00 175.10 171.24 1bdf s ILE 99 N 0.31 5.32 -0.14 7.04 -1.09 -1.26 -1.32 121.20 130.05 1bdf s ILE 99 Ca -0.03 0.31 -0.05 0.00 -2.23 0.00 0.00 60.65 58.66 1bdf s ILE 99 Cb -0.04 -3.56 -0.03 0.00 -1.58 0.00 0.00 42.46 37.25 1bdf s ILE 99 CO -0.01 0.31 0.02 -0.76 -1.23 0.00 0.00 174.94 173.28 1bdf s LEU 100 N 1.17 3.62 -0.12 2.97 1.43 0.21 -4.93 118.68 123.03 1bdf s LEU 100 Ca 0.10 0.07 -0.02 0.00 -1.03 0.00 0.00 54.13 53.25 1bdf s LEU 100 Cb -0.14 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.18 1bdf s LEU 100 CO 0.06 0.25 -0.03 0.42 0.23 0.00 0.00 176.35 177.28 1bdf s THR 101 N -0.12 4.01 -0.28 5.49 -4.23 -1.26 0.57 115.64 119.82 1bdf s THR 101 Ca 0.05 -0.34 -0.00 0.00 -1.18 0.00 0.00 61.69 60.22 1bdf s THR 101 Cb -0.12 -2.71 0.08 0.00 1.34 0.00 0.00 72.50 71.09 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 -0.24 2.49 -0.18 4.79 0.20 0.31 -1.00 118.68 125.05 1bdf s LEU 102 Ca 0.05 -1.47 -0.04 0.00 0.69 0.00 0.00 54.13 53.35 1bdf s LEU 102 Cb -0.13 -1.00 -0.02 0.00 -0.43 0.00 0.00 46.19 44.61 1bdf s LEU 102 CO 0.02 -0.35 -0.02 0.20 -0.29 0.00 0.00 176.35 175.91 1bdf s ASN 103 N 1.51 4.78 -0.24 3.68 0.01 -1.26 -1.51 114.94 121.92 1bdf s ASN 103 Ca 0.05 -0.18 -0.09 0.00 -0.71 0.00 0.00 52.86 51.93 1bdf s ASN 103 Cb -0.18 -1.80 0.10 0.00 0.41 0.00 0.00 41.25 39.78 1bdf s ASN 103 CO -0.16 0.11 0.52 -0.75 -1.51 0.00 0.00 177.10 175.31 1bdf s LYS 104 N 0.72 0.45 -0.06 -0.60 2.36 0.46 -4.94 119.74 118.13 1bdf s LYS 104 Ca -0.01 1.17 0.04 0.00 -2.55 0.00 0.00 55.97 54.62 1bdf s LYS 104 Cb -0.14 0.46 -0.00 0.00 -1.05 0.00 0.00 37.83 37.09 1bdf s LYS 104 CO 0.02 -0.22 -0.19 -1.54 1.55 0.00 0.00 175.35 174.97 1bdf s SER 105 N 2.49 2.44 0.00 1.43 1.04 -1.26 -0.32 113.70 119.52 1bdf s SER 105 Ca -0.05 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 55.97 1bdf s SER 105 Cb -0.11 -0.78 0.00 0.00 0.10 0.00 0.00 66.02 65.23 1bdf s SER 105 CO -0.15 0.16 0.00 0.61 0.98 0.00 0.00 173.24 174.84 1bdf n GLY 106 N 3.22 -0.55 3.23 7.32 0.00 -0.63 -4.99 105.19 112.78 1bdf n GLY 106 Ca -0.19 -1.54 -0.34 0.00 0.00 0.00 0.00 46.02 43.96 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 -2.35 2.78 -2.94 -0.61 1.09 -1.26 -4.48 121.20 113.43 1bdf s ILE 107 Ca 0.00 -0.70 0.00 0.00 -1.10 0.00 0.00 60.65 58.85 1bdf s ILE 107 Cb 0.00 -2.23 0.00 0.00 -1.06 0.00 0.00 42.46 39.17 1bdf s ILE 107 CO 0.00 0.48 0.00 0.61 -0.10 0.00 0.00 174.94 175.93 1bdf n GLY 108 N 4.66 0.80 3.74 6.18 0.00 -0.34 -4.96 105.19 115.27 1bdf n GLY 108 Ca -0.19 -2.09 -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 -1.10 4.52 -0.51 1.61 0.04 -1.26 -0.91 135.00 137.38 1bdf s PRO 109 Ca 0.00 1.81 -0.17 0.00 0.04 0.00 0.00 61.00 62.68 1bdf s PRO 109 Cb 0.00 -3.26 0.08 0.00 0.04 0.00 0.00 34.50 31.36 1bdf s PRO 109 CO 0.00 -0.05 0.53 0.08 0.04 0.00 0.00 177.00 177.60 1bdf s VAL 110 N -0.01 5.07 0.54 -0.36 1.01 0.20 -4.90 120.40 121.95 1bdf s VAL 110 Ca 0.52 -0.98 0.06 0.00 0.00 0.00 0.00 61.98 61.58 1bdf s VAL 110 Cb -0.31 -4.27 0.06 0.00 0.00 0.00 0.00 36.38 31.85 1bdf s VAL 110 CO 0.35 -0.78 0.74 0.42 0.00 0.00 0.00 175.10 175.83 1bdf s THR 111 N 2.07 2.53 0.11 3.92 -4.23 -1.26 0.02 115.64 118.80 1bdf s THR 111 Ca 0.08 -0.89 0.33 0.00 -1.18 0.00 0.00 61.69 60.03 1bdf s THR 111 Cb -0.24 -2.64 0.34 0.00 1.34 0.00 0.00 72.50 71.30 1bdf s THR 111 CO 0.07 0.00 1.98 0.00 -0.54 0.00 0.00 174.62 176.14 1bdf h ALA 112 N 0.22 1.00 0.00 3.99 0.00 0.72 -1.13 119.26 124.06 1bdf h ALA 112 Ca -0.36 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 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 -0.05 0.00 0.00 0.00 0.00 179.25 179.64 1bdf h ALA 113 N 2.05 1.00 -0.00 0.00 0.00 -0.71 -2.81 119.26 118.79 1bdf h ALA 113 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1bdf h ALA 113 Cb 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1bdf h ALA 113 CO 0.00 0.06 -0.06 -0.25 0.00 0.00 0.00 179.25 178.99 1bdf n ASP 114 N -3.15 0.12 -4.76 0.00 8.00 -0.43 -4.85 116.55 111.48 1bdf n ASP 114 Ca 0.01 0.06 -0.41 0.00 0.71 0.00 0.00 54.79 55.16 1bdf n ASP 114 Cb 0.35 -0.29 -0.02 0.00 -0.02 0.00 0.00 41.12 41.13 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 -2.78 2.85 -0.10 0.53 1.01 -1.06 -4.45 121.20 117.20 1bdf s ILE 115 Ca 0.21 0.81 -0.31 0.00 0.00 0.00 0.00 60.65 61.35 1bdf s ILE 115 Cb 0.19 -3.51 -0.09 0.00 0.01 0.00 0.00 42.46 39.06 1bdf s ILE 115 CO 0.52 0.17 2.04 0.35 0.00 0.00 0.00 174.94 178.02 1bdf n THR 116 N 1.32 0.56 -1.51 2.92 -2.24 -0.17 -4.83 114.28 110.33 1bdf n THR 116 Ca 0.02 -0.23 -0.43 0.00 -2.27 0.00 0.00 64.05 61.14 1bdf n THR 116 Cb 0.42 -2.21 -0.07 0.00 -2.10 0.00 0.00 70.33 66.37 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 8.65 1.38 -3.62 4.78 1.44 -1.26 -4.75 115.22 121.83 1bdf n HIS 117 Ca 0.25 0.19 -0.36 0.00 -2.01 0.00 0.00 57.72 55.80 1bdf n HIS 117 Cb 0.37 -2.56 -0.07 0.00 0.12 0.00 0.00 29.99 27.85 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 9.57 6.39 0.13 4.39 -1.08 -1.26 -5.01 116.67 129.80 1bdf s ASP 118 Ca 1.09 0.46 -0.18 0.00 -0.52 0.00 0.00 52.55 53.40 1bdf s ASP 118 Cb -0.63 -2.15 -0.03 0.00 -1.46 0.00 0.00 42.92 38.65 1bdf s ASP 118 CO 0.39 0.17 1.73 1.23 0.52 0.00 0.00 175.17 179.21 1bdf h GLY 119 N 6.37 0.46 -1.18 2.66 0.00 -2.04 -2.97 103.07 106.37 1bdf h GLY 119 Ca -0.43 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.69 1bdf h GLY 119 CO 0.73 0.20 0.00 2.09 0.00 0.00 0.00 176.54 179.56 1bdf n ASP 120 N -4.81 1.40 -4.15 0.19 5.68 -1.26 -4.80 116.55 108.80 1bdf n ASP 120 Ca -0.01 -2.09 -0.24 0.00 -0.50 0.00 0.00 54.79 51.94 1bdf n ASP 120 Cb 0.07 -0.48 -0.15 0.00 -1.14 0.00 0.00 41.12 39.43 1bdf n ASP 120 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1bdf s VAL 121 N -1.25 1.32 -0.15 2.12 1.01 -1.12 -2.38 120.40 119.95 1bdf s VAL 121 Ca 0.06 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.33 1bdf s VAL 121 Cb 0.04 -1.10 0.02 0.00 0.00 0.00 0.00 36.38 35.34 1bdf s VAL 121 CO 0.02 0.37 -0.18 -0.70 0.00 0.00 0.00 175.10 174.60 1bdf s GLU 122 N -0.41 2.71 -0.45 2.72 2.12 0.84 -4.75 118.70 121.48 1bdf s GLU 122 Ca 0.06 -0.73 -0.15 0.00 0.36 0.00 0.00 54.97 54.51 1bdf s GLU 122 Cb -0.06 -2.32 0.05 0.00 0.26 0.00 0.00 34.13 32.06 1bdf s GLU 122 CO -0.01 -0.14 0.36 0.42 -0.54 0.00 0.00 175.26 175.35 1bdf s ILE 123 N 1.17 5.24 0.11 -3.70 1.01 -1.26 -0.10 121.20 123.67 1bdf s ILE 123 Ca 0.00 -0.89 -0.22 0.00 0.00 0.00 0.00 60.65 59.55 1bdf s ILE 123 Cb -0.14 -4.05 -0.08 0.00 0.01 0.00 0.00 42.46 38.19 1bdf s ILE 123 CO -0.08 -0.48 1.72 0.58 0.00 0.00 0.00 174.94 176.68 1bdf h VAL 124 N 5.71 0.87 -3.12 2.92 2.07 -1.86 -3.36 116.25 119.49 1bdf h VAL 124 Ca -0.28 0.00 -0.62 0.00 0.82 0.00 0.00 66.70 66.62 1bdf h VAL 124 Cb 1.11 0.87 -0.41 0.00 -1.52 0.00 0.00 31.29 31.35 1bdf h VAL 124 CO 0.82 0.00 -0.67 -0.75 0.02 0.00 0.00 177.57 176.99 1bdf s LYS 125 N -6.19 1.82 0.59 1.57 2.20 -1.26 -4.94 119.74 113.52 1bdf s LYS 125 Ca -0.13 -2.59 0.29 0.00 -0.36 0.00 0.00 55.97 53.17 1bdf s LYS 125 Cb 0.08 -2.92 1.79 0.00 -1.51 0.00 0.00 37.83 35.27 1bdf s LYS 125 CO 0.67 -1.19 2.25 -1.00 -0.36 0.00 0.00 175.35 175.72 1bdf h PRO 126 N 6.22 0.00 -0.25 4.03 0.13 -1.90 -1.03 132.00 139.21 1bdf h PRO 126 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1bdf h PRO 126 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 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 -3.89 1.09 -2.54 0.86 0.00 -1.26 -0.02 117.38 111.62 1bdf n GLN 127 Ca -0.03 -0.12 -0.43 0.00 0.00 0.00 0.00 57.00 56.42 1bdf n GLN 127 Cb 0.09 -1.14 -0.02 0.00 0.00 0.00 0.00 30.24 29.17 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 -1.76 2.82 -0.05 2.61 2.46 -0.39 -4.81 115.29 116.17 1bdf s HIS 128 Ca 0.02 0.86 -0.30 0.00 0.47 0.00 0.00 55.06 56.11 1bdf s HIS 128 Cb 0.01 -4.14 -0.04 0.00 -0.13 0.00 0.00 32.58 28.27 1bdf s HIS 128 CO 0.01 -1.32 1.38 0.08 -2.47 0.00 0.00 174.74 172.42 1bdf s VAL 129 N 4.38 3.90 -0.15 0.89 1.01 -1.26 0.67 120.40 129.84 1bdf s VAL 129 Ca 0.51 1.21 0.13 0.00 0.00 0.00 0.00 61.98 63.83 1bdf s VAL 129 Cb -0.11 -3.78 -0.19 0.00 0.00 0.00 0.00 36.38 32.31 1bdf s VAL 129 CO 0.26 -0.04 0.04 -0.38 0.00 0.00 0.00 175.10 174.99 1bdf n ILE 130 N 4.92 1.05 -4.08 2.22 5.41 0.10 -4.93 119.36 124.05 1bdf n ILE 130 Ca 0.14 -0.64 -0.14 0.00 1.00 0.00 0.00 62.75 63.10 1bdf n ILE 130 Cb 0.44 -0.62 -0.04 0.00 -0.71 0.00 0.00 39.64 38.72 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 -3.06 -1.04 -0.22 0.00 3.76 -1.26 0.62 115.29 114.09 1bdf s HIS 132 Ca 0.30 0.49 -0.25 0.00 -0.15 0.00 0.00 55.06 55.45 1bdf s HIS 132 Cb -0.00 -0.08 -0.01 0.00 1.11 0.00 0.00 32.58 33.60 1bdf s HIS 132 CO 0.20 -0.94 0.84 -0.51 -0.85 0.00 0.00 174.74 173.48 1bdf s LEU 133 N 2.57 4.11 -0.03 0.89 1.43 -0.09 -0.77 118.68 126.78 1bdf s LEU 133 Ca 0.11 1.10 -0.09 0.00 -1.03 0.00 0.00 54.13 54.21 1bdf s LEU 133 Cb -0.13 -3.22 -0.05 0.00 0.03 0.00 0.00 46.19 42.82 1bdf s LEU 133 CO -0.27 -0.49 0.47 0.71 0.23 0.00 0.00 176.35 177.00 1bdf h THR 134 N 5.36 0.00 -3.54 5.49 1.35 -1.18 -0.90 112.91 119.49 1bdf h THR 134 Ca -0.25 -0.47 -0.51 0.00 -0.55 0.00 0.00 66.41 64.64 1bdf h THR 134 Cb 1.10 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 67.51 1bdf h THR 134 CO 0.87 0.00 0.01 1.51 -0.25 0.00 0.00 175.52 177.66 1bdf s ASP 135 N -4.34 6.57 0.00 5.36 -4.77 -1.26 -4.72 116.67 113.51 1bdf s ASP 135 Ca -0.05 1.03 0.07 0.00 -3.30 0.00 0.00 52.55 50.30 1bdf s ASP 135 Cb 0.00 -2.27 0.31 0.00 -1.09 0.00 0.00 42.92 39.87 1bdf s ASP 135 CO 0.14 -0.25 1.16 -1.84 0.70 0.00 0.00 175.17 175.09 1bdf n GLU 136 N -0.80 0.04 -0.22 2.11 0.00 -1.26 -0.94 120.64 119.57 1bdf n GLU 136 Ca 0.01 0.32 0.06 0.00 0.00 0.00 0.00 57.16 57.55 1bdf n GLU 136 Cb 0.53 -1.50 0.17 0.00 0.00 0.00 0.00 31.44 30.64 1bdf n GLU 136 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1bdf n ASN 137 N -1.42 3.08 -4.86 -1.84 3.02 -1.26 -4.54 115.26 107.44 1bdf n ASN 137 Ca 0.02 -2.15 -0.34 0.00 -0.03 0.00 0.00 54.58 52.09 1bdf n ASN 137 Cb 0.07 -0.28 -0.06 0.00 -0.61 0.00 0.00 39.78 38.91 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 -1.26 3.53 -0.07 5.41 0.00 -0.11 -4.98 121.76 124.28 1bdf s ALA 138 Ca 0.26 -0.15 -0.31 0.00 0.00 0.00 0.00 51.96 51.76 1bdf s ALA 138 Cb 0.15 -2.53 0.08 0.00 0.00 0.00 0.00 23.12 20.83 1bdf s ALA 138 CO 0.15 0.46 0.76 -1.54 0.00 0.00 0.00 175.76 175.58 1bdf s SER 139 N -2.04 -0.58 0.03 0.00 1.04 -1.26 -1.60 113.70 109.29 1bdf s SER 139 Ca 0.44 0.61 0.07 0.00 0.48 0.00 0.00 55.95 57.54 1bdf s SER 139 Cb -0.13 0.48 -0.02 0.00 0.10 0.00 0.00 66.02 66.45 1bdf s SER 139 CO 0.20 -0.55 -0.19 0.27 0.98 0.00 0.00 173.24 173.94 1bdf s ILE 140 N -1.27 1.53 -0.20 -1.02 -4.36 0.56 -4.97 121.20 111.47 1bdf s ILE 140 Ca -0.08 -1.09 -0.05 0.00 -0.26 0.00 0.00 60.65 59.17 1bdf s ILE 140 Cb -0.00 -1.33 0.07 0.00 1.25 0.00 0.00 42.46 42.45 1bdf s ILE 140 CO 0.07 0.21 0.10 -0.55 0.24 0.00 0.00 174.94 175.01 1bdf s SER 141 N -1.03 2.68 0.06 4.36 0.15 -1.24 -0.40 113.70 118.28 1bdf s SER 141 Ca 0.06 -0.80 0.02 0.00 0.70 0.00 0.00 55.95 55.93 1bdf s SER 141 Cb -0.08 -0.28 -0.03 0.00 -1.71 0.00 0.00 66.02 63.92 1bdf s SER 141 CO 0.01 -0.37 -0.08 0.00 1.20 0.00 0.00 173.24 174.00 1bdf s MET 142 N 2.12 0.63 -0.34 5.44 0.23 -0.57 -0.94 119.30 125.88 1bdf s MET 142 Ca 0.04 -0.92 -0.02 0.00 -1.03 0.00 0.00 55.69 53.75 1bdf s MET 142 Cb -0.16 -0.32 0.07 0.00 -1.53 0.00 0.00 34.83 32.89 1bdf s MET 142 CO -0.17 0.04 0.07 1.03 -2.03 0.00 0.00 175.02 173.97 1bdf s ARG 143 N -2.18 2.29 -0.33 3.16 3.00 -0.23 -0.53 118.95 124.14 1bdf s ARG 143 Ca -0.04 -1.44 -0.21 0.00 0.00 0.00 0.00 55.73 54.04 1bdf s ARG 143 Cb -0.06 -3.33 -0.00 0.00 0.00 0.00 0.00 34.95 31.56 1bdf s ARG 143 CO -0.01 -0.77 0.68 0.42 0.00 0.00 0.00 175.30 175.62 1bdf s ILE 144 N 1.22 4.87 -0.17 1.52 1.01 0.19 -0.94 121.20 128.91 1bdf s ILE 144 Ca -0.00 0.86 -0.23 0.00 0.00 0.00 0.00 60.65 61.27 1bdf s ILE 144 Cb -0.21 -4.07 -0.02 0.00 0.01 0.00 0.00 42.46 38.17 1bdf s ILE 144 CO -0.02 -0.24 0.73 -0.75 0.00 0.00 0.00 174.94 174.66 1bdf s LYS 145 N 2.77 4.27 -0.19 2.79 2.20 0.20 -0.62 119.74 131.15 1bdf s LYS 145 Ca 0.27 0.83 -0.02 0.00 -0.36 0.00 0.00 55.97 56.70 1bdf s LYS 145 Cb -0.14 -3.56 0.00 0.00 -1.51 0.00 0.00 37.83 32.61 1bdf s LYS 145 CO 0.13 -0.26 -0.11 0.08 -0.36 0.00 0.00 175.35 174.84 1bdf s VAL 146 N 1.93 2.88 0.23 4.02 1.01 -0.43 -0.76 120.40 129.28 1bdf s VAL 146 Ca 0.34 -0.67 0.11 0.00 0.00 0.00 0.00 61.98 61.76 1bdf s VAL 146 Cb -0.16 -2.27 -0.05 0.00 0.00 0.00 0.00 36.38 33.90 1bdf s VAL 146 CO 0.12 0.48 -0.20 -1.10 0.00 0.00 0.00 175.10 174.39 1bdf s GLN 147 N 1.26 1.54 -0.16 2.72 -0.21 0.10 -1.13 119.66 123.78 1bdf s GLN 147 Ca 0.03 -1.62 -0.18 0.00 0.02 0.00 0.00 55.36 53.61 1bdf s GLN 147 Cb -0.14 -1.66 -0.04 0.00 1.00 0.00 0.00 33.01 32.17 1bdf s GLN 147 CO -0.05 0.33 0.48 0.50 -2.12 0.00 0.00 175.29 174.42 1bdf s ARG 148 N -3.16 4.25 0.00 2.91 6.06 -0.95 -0.20 118.95 127.87 1bdf s ARG 148 Ca 0.24 0.39 0.00 0.00 -2.50 0.00 0.00 55.73 53.86 1bdf s ARG 148 Cb -0.06 -3.50 0.00 0.00 0.06 0.00 0.00 34.95 31.45 1bdf s ARG 148 CO 0.11 0.01 0.00 0.41 -2.50 0.00 0.00 175.30 173.33 1bdf n GLY 149 N 3.61 3.37 2.94 8.12 0.00 -0.41 -4.98 105.19 117.83 1bdf n GLY 149 Ca -0.06 -0.95 -0.12 0.00 0.00 0.00 0.00 46.02 44.89 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 0.57 0.08 6.03 1.61 0.52 -1.26 -3.54 118.95 122.97 1bdf s ARG 150 Ca 0.00 0.09 0.00 0.00 -0.52 0.00 0.00 55.73 55.30 1bdf s ARG 150 Cb 0.00 0.04 0.00 0.00 0.52 0.00 0.00 34.95 35.51 1bdf s ARG 150 CO 0.00 -0.01 0.00 0.41 0.02 0.00 0.00 175.30 175.72 1bdf n GLY 151 N 3.03 0.90 2.73 -3.53 0.00 -1.25 -4.64 105.19 102.42 1bdf n GLY 151 Ca -0.12 -0.69 -0.14 0.00 0.00 0.00 0.00 46.02 45.07 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 0.00 -0.51 -0.54 1.61 5.04 -1.26 -2.25 117.35 119.43 1bdf s TYR 152 Ca 0.00 -0.98 -0.20 0.00 -2.44 0.00 0.00 57.07 53.45 1bdf s TYR 152 Cb 0.00 -0.24 0.07 0.00 0.35 0.00 0.00 41.96 42.14 1bdf s TYR 152 CO 0.00 -1.05 0.69 0.14 -1.34 0.00 0.00 175.55 173.99 1bdf s VAL 153 N 1.00 4.79 1.04 3.14 -7.23 -1.02 -4.93 120.40 117.19 1bdf s VAL 153 Ca 0.24 -0.56 -0.14 0.00 -1.81 0.00 0.00 61.98 59.71 1bdf s VAL 153 Cb -0.05 -4.39 0.21 0.00 0.56 0.00 0.00 36.38 32.70 1bdf s VAL 153 CO -0.08 -0.96 1.11 -2.16 -0.31 0.00 0.00 175.10 172.71 1bdf s PRO 154 N 2.84 0.10 0.35 4.82 0.04 -1.26 -1.75 135.00 140.13 1bdf s PRO 154 Ca 0.16 0.28 0.03 0.00 0.04 0.00 0.00 61.00 61.51 1bdf s PRO 154 Cb -0.20 -1.72 0.64 0.00 0.04 0.00 0.00 34.50 33.26 1bdf s PRO 154 CO 0.11 -2.90 2.00 0.00 0.04 0.00 0.00 177.00 176.24 1bdf h ALA 155 N -2.01 1.57 -1.34 8.56 0.00 -1.92 -3.32 119.26 120.80 1bdf h ALA 155 Ca -0.52 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1bdf h ALA 155 Cb 1.32 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1bdf h ALA 155 CO 0.52 0.38 0.00 -1.13 0.00 0.00 0.00 179.25 179.02 1bdf n SER 156 N -4.45 0.00 -4.55 0.00 3.41 -1.26 -4.01 113.62 102.77 1bdf n SER 156 Ca 0.08 0.78 -0.22 0.00 -0.26 0.00 0.00 58.87 59.24 1bdf n SER 156 Cb 0.08 -0.28 -0.08 0.00 -0.26 0.00 0.00 64.21 63.67 1bdf n SER 156 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1bdf n THR 157 N -2.10 -0.03 -3.75 6.66 -2.24 -1.25 -4.78 114.28 106.80 1bdf n THR 157 Ca 0.00 -0.56 -0.04 0.00 -2.27 0.00 0.00 64.05 61.18 1bdf n THR 157 Cb 0.00 -1.93 0.02 0.00 -2.10 0.00 0.00 70.33 66.32 1bdf n THR 157 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1bdf n ARG 158 N 8.50 0.68 -2.79 -0.78 3.00 -1.26 -4.95 116.66 119.07 1bdf n ARG 158 Ca 0.47 -1.44 -0.02 0.00 -0.00 0.00 0.00 57.85 56.86 1bdf n ARG 158 Cb 0.41 1.88 0.05 0.00 0.00 0.00 0.00 32.46 34.81 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 -0.53 1.10 -4.20 5.15 -0.00 -1.26 -5.23 119.36 114.40 1bdf n ILE 159 Ca -0.04 -2.78 -0.16 0.00 -0.00 0.00 0.00 62.75 59.77 1bdf n ILE 159 Cb 0.48 1.16 -0.07 0.00 -0.00 0.00 0.00 39.64 41.20 1bdf n ILE 159 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.55 175.55 1bdf s HIS 160 N -3.32 1.36 0.03 4.28 4.02 -1.26 -5.32 115.29 115.09 1bdf s HIS 160 Ca 0.26 -1.45 0.00 0.00 1.02 0.00 0.00 55.06 54.89 1bdf s HIS 160 Cb 0.36 -0.46 0.00 0.00 -1.02 0.00 0.00 32.58 31.46 1bdf s HIS 160 CO -0.03 -0.90 0.00 1.51 1.02 0.00 0.00 174.74 176.34 1bdf n ILE 168 N -0.52 -7.70 -1.03 0.60 0.00 -1.26 -5.07 119.36 104.39 1bdf n ILE 168 Ca 0.04 1.61 -0.15 0.00 0.00 0.00 0.00 62.75 64.25 1bdf n ILE 168 Cb 0.63 -4.34 -0.15 0.00 0.00 0.00 0.00 39.64 35.78 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 0.91 3.13 3.54 4.50 0.00 -1.25 -4.86 105.19 111.16 1bdf n GLY 169 Ca 0.00 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 1bdf n GLY 169 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bdf s ARG 170 N 1.16 3.36 -0.39 1.61 1.81 -1.26 -4.42 118.95 120.82 1bdf s ARG 170 Ca 0.67 -0.11 -0.18 0.00 -1.72 0.00 0.00 55.73 54.39 1bdf s ARG 170 Cb 0.30 -4.07 0.01 0.00 -0.45 0.00 0.00 34.95 30.74 1bdf s ARG 170 CO -0.01 -1.68 0.52 -0.51 -0.68 0.00 0.00 175.30 172.94 1bdf s LEU 171 N 4.60 4.54 0.13 2.53 1.02 -0.42 -4.96 118.68 126.12 1bdf s LEU 171 Ca 0.35 -0.31 -0.27 0.00 0.02 0.00 0.00 54.13 53.92 1bdf s LEU 171 Cb -0.10 -2.55 -0.07 0.00 0.02 0.00 0.00 46.19 43.48 1bdf s LEU 171 CO 0.20 -0.59 0.82 -0.76 0.02 0.00 0.00 176.35 176.05 1bdf s LEU 172 N 2.42 4.54 -0.02 1.79 1.43 -1.26 -0.28 118.68 127.30 1bdf s LEU 172 Ca 0.17 1.64 0.06 0.00 -1.03 0.00 0.00 54.13 54.98 1bdf s LEU 172 Cb -0.16 -3.36 -0.01 0.00 0.03 0.00 0.00 46.19 42.69 1bdf s LEU 172 CO 0.15 0.09 -0.21 0.54 0.23 0.00 0.00 176.35 177.16 1bdf s VAL 173 N -0.60 1.64 0.05 -1.59 0.11 -0.30 -4.94 120.40 114.79 1bdf s VAL 173 Ca 0.39 -0.88 -0.33 0.00 -2.93 0.00 0.00 61.98 58.23 1bdf s VAL 173 Cb -0.23 -1.37 -0.12 0.00 -1.53 0.00 0.00 36.38 33.13 1bdf s VAL 173 CO 0.26 0.47 1.78 0.47 -3.33 0.00 0.00 175.10 174.75 1bdf n ASP 174 N 2.63 3.54 -4.63 3.54 8.00 -1.26 -4.47 116.55 123.91 1bdf n ASP 174 Ca -0.16 1.01 -0.40 0.00 0.71 0.00 0.00 54.79 55.95 1bdf n ASP 174 Cb 0.53 -1.44 -0.07 0.00 -0.02 0.00 0.00 41.12 40.11 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 2.73 3.59 -0.87 2.24 0.00 -0.72 -4.73 121.76 124.00 1bdf s ALA 175 Ca 0.85 -0.54 -0.00 0.00 0.00 0.00 0.00 51.96 52.27 1bdf s ALA 175 Cb -0.62 -2.90 0.24 0.00 0.00 0.00 0.00 23.12 19.84 1bdf s ALA 175 CO 0.43 -0.70 0.89 0.00 0.00 0.00 0.00 175.76 176.37 1bdf h TYR 177 N 5.46 0.82 -2.35 0.00 0.05 -1.73 -3.44 116.97 115.77 1bdf h TYR 177 Ca 0.18 -0.09 -0.54 0.00 0.05 0.00 0.00 58.73 58.32 1bdf h TYR 177 Cb 0.74 -0.23 0.03 0.00 1.01 0.00 0.00 36.73 38.27 1bdf h TYR 177 CO 0.77 0.72 1.16 0.45 -1.05 0.00 0.00 178.16 180.21 1bdf n SER 178 N -4.25 3.99 0.06 3.88 2.88 -1.10 -3.94 113.62 115.14 1bdf n SER 178 Ca 0.03 0.95 0.11 0.00 -1.33 0.00 0.00 58.87 58.62 1bdf n SER 178 Cb 0.25 -1.51 0.43 0.00 -0.75 0.00 0.00 64.21 62.64 1bdf n SER 178 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1bdf n PRO 179 N 6.62 0.10 -3.51 -1.46 -0.02 -1.26 -4.59 135.00 130.87 1bdf n PRO 179 Ca 0.20 0.27 -0.40 0.00 -2.02 0.00 0.00 63.50 61.55 1bdf n PRO 179 Cb 0.38 -1.67 -0.10 0.00 -0.02 0.00 0.00 33.50 32.08 1bdf n PRO 179 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1bdf s VAL 180 N -3.12 5.27 -0.09 -1.45 1.01 -1.26 -1.40 120.40 119.36 1bdf s VAL 180 Ca 0.08 -0.09 0.10 0.00 0.00 0.00 0.00 61.98 62.07 1bdf s VAL 180 Cb 0.11 -3.70 -0.24 0.00 0.00 0.00 0.00 36.38 32.55 1bdf s VAL 180 CO 0.39 0.02 0.48 1.21 0.00 0.00 0.00 175.10 177.20 1bdf n GLU 181 N 5.15 0.66 -3.64 2.72 2.13 0.37 -4.87 120.64 123.16 1bdf n GLU 181 Ca -0.12 0.23 -0.04 0.00 0.66 0.00 0.00 57.16 57.90 1bdf n GLU 181 Cb 0.50 -1.72 -0.05 0.00 0.27 0.00 0.00 31.44 30.44 1bdf n GLU 181 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1bdf s ARG 182 N -2.57 0.63 -0.02 5.31 3.00 -0.47 -4.97 118.95 119.86 1bdf s ARG 182 Ca -0.10 1.35 0.06 0.00 -1.00 0.00 0.00 55.73 56.04 1bdf s ARG 182 Cb 0.07 0.55 -0.03 0.00 0.00 0.00 0.00 34.95 35.55 1bdf s ARG 182 CO 0.81 -0.18 -0.19 0.42 0.00 0.00 0.00 175.30 176.16 1bdf s ILE 183 N 2.34 2.66 -0.03 4.11 -1.09 -1.26 -1.33 121.20 126.61 1bdf s ILE 183 Ca -0.08 -0.94 -0.13 0.00 -2.23 0.00 0.00 60.65 57.27 1bdf s ILE 183 Cb -0.09 -2.02 0.02 0.00 -1.58 0.00 0.00 42.46 38.79 1bdf s ILE 183 CO -0.19 0.54 0.29 0.00 -1.23 0.00 0.00 174.94 174.34 1bdf s ALA 184 N -0.73 -0.72 0.02 9.38 0.00 -0.43 -5.01 121.76 124.27 1bdf s ALA 184 Ca 0.12 0.35 -0.04 0.00 0.00 0.00 0.00 51.96 52.39 1bdf s ALA 184 Cb -0.10 -0.02 -0.01 0.00 0.00 0.00 0.00 23.12 22.99 1bdf s ALA 184 CO 0.01 -0.23 0.07 1.52 0.00 0.00 0.00 175.76 177.12 1bdf s TYR 185 N -1.09 0.16 -0.00 0.00 -0.85 -1.26 0.59 117.35 114.90 1bdf s TYR 185 Ca -0.12 -0.38 0.03 0.00 -0.52 0.00 0.00 57.07 56.09 1bdf s TYR 185 Cb -0.05 -0.13 -0.01 0.00 0.38 0.00 0.00 41.96 42.15 1bdf s TYR 185 CO 0.03 -0.27 -0.09 -0.80 -1.52 0.00 0.00 175.55 172.90 1bdf s ASN 186 N -1.61 1.03 -0.02 -0.18 0.01 -0.13 -4.99 114.94 109.03 1bdf s ASN 186 Ca -0.13 -0.19 0.00 0.00 -0.71 0.00 0.00 52.86 51.83 1bdf s ASN 186 Cb -0.07 -0.10 -0.26 0.00 0.41 0.00 0.00 41.25 41.23 1bdf s ASN 186 CO -0.01 0.08 0.74 0.58 -1.51 0.00 0.00 177.10 176.99 1bdf h VAL 187 N 4.88 1.01 -1.33 1.60 2.07 -1.87 0.56 116.25 123.17 1bdf h VAL 187 Ca -0.31 -2.72 0.00 0.00 0.82 0.00 0.00 66.70 64.49 1bdf h VAL 187 Cb 1.18 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 33.59 1bdf h VAL 187 CO 0.49 0.76 0.00 -0.62 0.02 0.00 0.00 177.57 178.22 1bdf n GLU 188 N -3.36 0.00 -2.12 1.57 1.02 -1.26 -2.78 120.64 113.71 1bdf n GLU 188 Ca -0.19 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.53 1bdf n GLU 188 Cb 1.04 -0.28 -0.02 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 -1.29 3.11 -1.35 0.62 0.00 -1.26 -1.78 121.76 119.80 1bdf s ALA 189 Ca 0.00 0.30 -0.12 0.00 0.00 0.00 0.00 51.96 52.14 1bdf s ALA 189 Cb 0.00 -3.92 0.11 0.00 0.00 0.00 0.00 23.12 19.31 1bdf s ALA 189 CO 0.00 -2.24 1.99 0.00 0.00 0.00 0.00 175.76 175.51 1bdf n ALA 190 N 9.10 5.23 -1.23 0.00 0.00 -0.90 -4.82 120.51 127.89 1bdf n ALA 190 Ca 0.20 -4.10 -0.09 0.00 0.00 0.00 0.00 53.44 49.45 1bdf n ALA 190 Cb 0.46 -3.26 -0.06 0.00 0.00 0.00 0.00 19.45 16.58 1bdf n ALA 190 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1bdf n ARG 191 N 5.22 0.04 -2.50 0.00 5.12 -1.26 -4.54 116.66 118.74 1bdf n ARG 191 Ca 0.45 -0.85 -0.35 0.00 -1.93 0.00 0.00 57.85 55.18 1bdf n ARG 191 Cb 0.38 -2.45 -0.03 0.00 -1.16 0.00 0.00 32.46 29.20 1bdf n ARG 191 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1bdf s VAL 192 N 8.66 3.68 0.02 1.55 -7.23 -1.26 -4.97 120.40 120.86 1bdf s VAL 192 Ca 0.42 1.10 -0.24 0.00 -1.81 0.00 0.00 61.98 61.44 1bdf s VAL 192 Cb -0.01 -3.47 -0.17 0.00 0.56 0.00 0.00 36.38 33.28 1bdf s VAL 192 CO 0.11 -0.18 1.42 1.05 -0.31 0.00 0.00 175.10 177.20 1bdf h GLU 193 N 1.71 0.06 0.00 4.82 4.11 -2.03 -3.38 114.58 119.87 1bdf h GLU 193 Ca -0.49 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 58.92 1bdf h GLU 193 Cb 1.22 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1bdf h GLU 193 CO 0.59 0.38 0.00 1.04 0.07 0.00 0.00 179.01 181.09 1bdf n GLN 194 N -4.89 0.00 0.00 1.06 1.13 -1.26 -4.81 117.38 108.61 1bdf n GLN 194 Ca -0.07 0.24 0.00 0.00 -1.94 0.00 0.00 57.00 55.22 1bdf n GLN 194 Cb 0.19 -0.86 0.00 0.00 0.11 0.00 0.00 30.24 29.68 1bdf n GLN 194 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1bdf n ARG 195 N -0.60 2.02 0.00 -1.09 1.74 -1.26 -5.08 116.66 112.39 1bdf n ARG 195 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1bdf n ARG 195 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1bdf n ARG 195 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1bdf n THR 196 N 0.00 0.00 -0.33 0.55 -2.24 -1.26 -4.80 114.28 106.19 1bdf n THR 196 Ca 0.00 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.83 1bdf n THR 196 Cb 0.00 0.00 0.15 0.00 -2.10 0.00 0.00 70.33 68.38 1bdf n THR 196 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1bdf n ASP 197 N 0.00 2.91 -4.83 3.42 5.75 -1.26 -4.97 116.55 117.58 1bdf n ASP 197 Ca 0.00 -2.23 -0.36 0.00 -0.01 0.00 0.00 54.79 52.19 1bdf n ASP 197 Cb 0.01 -0.26 -0.06 0.00 -1.03 0.00 0.00 41.12 39.79 1bdf n ASP 197 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1bdf s LEU 198 N -1.42 4.36 0.50 -2.12 1.43 -1.26 -3.77 118.68 116.40 1bdf s LEU 198 Ca 0.23 1.22 0.04 0.00 -1.03 0.00 0.00 54.13 54.59 1bdf s LEU 198 Cb 0.15 -3.35 -0.01 0.00 0.03 0.00 0.00 46.19 43.01 1bdf s LEU 198 CO 0.11 0.09 0.16 -1.81 0.23 0.00 0.00 176.35 175.13 1bdf s ASP 199 N -1.63 4.32 -0.05 2.29 1.01 -0.27 -2.11 116.67 120.23 1bdf s ASP 199 Ca 0.39 -1.42 -0.02 0.00 0.71 0.00 0.00 52.55 52.21 1bdf s ASP 199 Cb -0.16 0.27 0.04 0.00 1.01 0.00 0.00 42.92 44.08 1bdf s ASP 199 CO 0.20 -0.86 0.09 -1.59 0.21 0.00 0.00 175.17 173.23 1bdf s LYS 200 N -4.00 -0.01 -0.27 8.23 -2.85 -0.74 -2.56 119.74 117.55 1bdf s LYS 200 Ca 0.22 0.37 -0.22 0.00 -1.00 0.00 0.00 55.97 55.34 1bdf s LYS 200 Cb 0.01 -0.32 -0.01 0.00 -2.06 0.00 0.00 37.83 35.45 1bdf s LYS 200 CO 0.13 -0.25 0.70 -1.17 0.10 0.00 0.00 175.35 174.86 1bdf s LEU 201 N 1.71 4.08 -0.43 2.77 2.96 0.17 -4.04 118.68 125.90 1bdf s LEU 201 Ca -0.02 0.74 -0.13 0.00 -0.22 0.00 0.00 54.13 54.50 1bdf s LEU 201 Cb -0.12 -2.97 0.06 0.00 0.50 0.00 0.00 46.19 43.66 1bdf s LEU 201 CO -0.04 -0.46 0.30 -0.69 -1.32 0.00 0.00 176.35 174.14 1bdf s VAL 202 N 2.68 4.81 -0.36 1.68 1.01 0.19 -0.86 120.40 129.55 1bdf s VAL 202 Ca 0.29 -1.05 -0.16 0.00 0.00 0.00 0.00 61.98 61.06 1bdf s VAL 202 Cb -0.15 -3.82 -0.00 0.00 0.00 0.00 0.00 36.38 32.40 1bdf s VAL 202 CO 0.09 -0.44 0.41 -0.63 0.00 0.00 0.00 175.10 174.53 1bdf s ILE 203 N 1.57 5.12 -0.24 2.22 1.01 0.26 -0.96 121.20 130.19 1bdf s ILE 203 Ca 0.03 0.03 -0.18 0.00 0.00 0.00 0.00 60.65 60.53 1bdf s ILE 203 Cb -0.22 -3.89 -0.03 0.00 0.01 0.00 0.00 42.46 38.33 1bdf s ILE 203 CO 0.06 -0.18 0.52 -0.70 0.00 0.00 0.00 174.94 174.64 1bdf s GLU 204 N 2.11 4.11 0.03 2.79 2.12 0.20 -0.29 118.70 129.78 1bdf s GLU 204 Ca 0.13 0.36 0.08 0.00 0.36 0.00 0.00 54.97 55.90 1bdf s GLU 204 Cb -0.16 -3.62 -0.03 0.00 0.26 0.00 0.00 34.13 30.58 1bdf s GLU 204 CO 0.12 -0.28 -0.21 1.41 -0.54 0.00 0.00 175.26 175.77 1bdf s MET 205 N 2.07 2.01 -0.38 4.30 1.75 0.48 -1.32 119.30 128.20 1bdf s MET 205 Ca 0.22 -1.01 0.01 0.00 -1.25 0.00 0.00 55.69 53.66 1bdf s MET 205 Cb -0.16 -2.12 0.13 0.00 2.84 0.00 0.00 34.83 35.52 1bdf s MET 205 CO 0.09 0.54 0.20 -2.00 -0.65 0.00 0.00 175.02 173.20 1bdf s GLU 206 N -1.30 0.88 0.71 4.11 2.12 -0.44 -1.05 118.70 123.73 1bdf s GLU 206 Ca 0.13 -1.54 0.02 0.00 0.36 0.00 0.00 54.97 53.94 1bdf s GLU 206 Cb -0.10 -1.87 0.13 0.00 0.26 0.00 0.00 34.13 32.56 1bdf s GLU 206 CO 0.04 -1.14 0.98 -0.08 -0.54 0.00 0.00 175.26 174.51 1bdf s THR 207 N 0.90 2.02 -1.73 -1.70 -1.32 0.10 -0.48 115.64 113.43 1bdf s THR 207 Ca 0.16 -0.71 0.21 0.00 -1.21 0.00 0.00 61.69 60.14 1bdf s THR 207 Cb -0.22 -2.31 0.66 0.00 -1.51 0.00 0.00 72.50 69.12 1bdf s THR 207 CO -0.05 0.00 1.56 -0.46 -2.21 0.00 0.00 174.62 173.46 1bdf n ASN 208 N -2.75 4.17 0.00 8.08 0.23 -0.49 -4.71 115.26 119.79 1bdf n ASN 208 Ca 0.17 -2.12 0.00 0.00 -0.53 0.00 0.00 54.58 52.10 1bdf n ASN 208 Cb 0.61 -0.51 0.00 0.00 -2.08 0.00 0.00 39.78 37.80 1bdf n ASN 208 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1bdf n GLY 209 N 1.50 2.86 0.00 4.83 0.00 -1.26 -4.83 105.19 108.28 1bdf n GLY 209 Ca 0.25 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.32 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 -0.64 0.95 -4.10 2.61 -2.24 -1.26 -4.65 114.28 104.94 1bdf n THR 210 Ca 0.00 0.24 -0.16 0.00 -2.27 0.00 0.00 64.05 61.86 1bdf n THR 210 Cb 0.00 -1.04 -0.15 0.00 -2.10 0.00 0.00 70.33 67.04 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 -2.78 0.35 0.36 2.28 2.07 -1.26 -4.92 121.20 117.29 1bdf s ILE 211 Ca 0.08 -0.15 -0.25 0.00 -1.41 0.00 0.00 60.65 58.93 1bdf s ILE 211 Cb 0.08 -0.33 -0.10 0.00 0.13 0.00 0.00 42.46 42.24 1bdf s ILE 211 CO 0.20 0.12 0.97 -1.81 -1.91 0.00 0.00 174.94 172.51 1bdf s ASP 212 N 0.15 7.14 0.11 4.50 1.01 -1.26 -4.86 116.67 123.45 1bdf s ASP 212 Ca -0.01 1.87 -0.32 0.00 0.71 0.00 0.00 52.55 54.80 1bdf s ASP 212 Cb -0.05 -2.58 -0.11 0.00 1.01 0.00 0.00 42.92 41.20 1bdf s ASP 212 CO -0.00 -0.22 1.58 1.55 0.21 0.00 0.00 175.17 178.29 1bdf h PRO 213 N 2.83 -0.66 -0.85 8.23 0.13 -1.98 -0.16 132.00 139.54 1bdf h PRO 213 Ca -0.47 0.04 0.09 0.00 -0.87 0.00 0.00 66.00 64.79 1bdf h PRO 213 Cb 1.20 0.15 -0.06 0.00 0.13 0.00 0.00 31.00 32.42 1bdf h PRO 213 CO 0.64 -0.44 0.55 1.49 -0.23 0.00 0.00 178.00 180.01 1bdf h GLU 214 N -0.68 0.83 0.00 0.86 4.81 -2.00 -0.23 114.58 118.17 1bdf h GLU 214 Ca 0.02 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1bdf h GLU 214 Cb 0.71 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.90 1bdf h GLU 214 CO -0.26 0.55 -0.04 1.05 -0.73 0.00 0.00 179.01 179.58 1bdf h GLU 215 N 0.86 0.00 -0.10 1.92 4.11 -1.86 -0.71 114.58 118.79 1bdf h GLU 215 Ca 0.38 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.62 1bdf h GLU 215 Cb 0.35 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 1bdf h GLU 215 CO -0.15 0.04 -0.73 0.00 0.07 0.00 0.00 179.01 178.24 1bdf h ALA 216 N 1.96 0.54 -0.03 1.06 0.00 0.72 -2.52 119.26 121.00 1bdf h ALA 216 Ca -0.00 -0.60 -0.06 0.00 0.00 0.00 0.00 54.91 54.25 1bdf h ALA 216 Cb 0.89 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1bdf h ALA 216 CO 0.00 0.74 -0.21 0.82 0.00 0.00 0.00 179.25 180.61 1bdf h ILE 217 N 0.34 1.50 0.00 0.00 1.08 -1.05 -2.39 117.51 116.98 1bdf h ILE 217 Ca -0.03 -1.77 0.00 0.00 -0.39 0.00 0.00 64.86 62.67 1bdf h ILE 217 Cb 1.32 2.56 0.00 0.00 -3.07 0.00 0.00 36.82 37.63 1bdf h ILE 217 CO 0.13 0.49 0.00 0.54 -0.69 0.00 0.00 178.15 178.62 1bdf n ARG 218 N -4.54 0.09 -0.06 2.37 1.74 -0.30 -0.88 116.66 115.07 1bdf n ARG 218 Ca -0.09 0.43 -0.08 0.00 -0.77 0.00 0.00 57.85 57.34 1bdf n ARG 218 Cb 0.46 -1.71 -0.15 0.00 -1.02 0.00 0.00 32.46 30.04 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 -1.88 0.67 -0.04 5.56 3.00 -0.95 -2.99 116.66 120.03 1bdf n ARG 219 Ca 0.01 0.10 -0.13 0.00 -0.00 0.00 0.00 57.85 57.83 1bdf n ARG 219 Cb 0.13 -1.63 -0.08 0.00 0.00 0.00 0.00 32.46 30.88 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 1.06 0.15 -0.79 5.13 0.00 -0.74 -1.94 119.26 122.12 1bdf h ALA 220 Ca -0.42 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.19 1bdf h ALA 220 Cb 2.09 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.81 1bdf h ALA 220 CO 0.05 0.00 0.52 0.00 0.00 0.00 0.00 179.25 179.81 1bdf h ALA 221 N 0.57 1.00 -0.25 0.00 0.00 -1.18 -1.86 119.26 117.55 1bdf h ALA 221 Ca 0.01 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1bdf h ALA 221 Cb 0.64 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1bdf h ALA 221 CO 0.03 0.43 -0.14 1.15 0.00 0.00 0.00 179.25 180.72 1bdf h THR 222 N 1.08 1.22 -0.30 0.00 2.02 -1.46 0.71 112.91 116.18 1bdf h THR 222 Ca 0.29 -0.97 -0.18 0.00 0.77 0.00 0.00 66.41 66.32 1bdf h THR 222 Cb -0.11 1.18 -0.00 0.00 -1.74 0.00 0.00 68.15 67.48 1bdf h THR 222 CO -0.06 0.31 -0.51 0.40 0.37 0.00 0.00 175.52 176.03 1bdf h ILE 223 N 0.38 1.28 0.80 3.11 2.04 -0.92 -2.24 117.51 121.97 1bdf h ILE 223 Ca 0.07 -1.70 -0.04 0.00 1.00 0.00 0.00 64.86 64.19 1bdf h ILE 223 Cb 0.47 1.59 0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1bdf h ILE 223 CO 0.03 0.55 -0.39 0.25 0.00 0.00 0.00 178.15 178.60 1bdf h LEU 224 N 0.66 -0.91 -1.44 1.44 5.85 -0.88 -2.50 115.31 117.53 1bdf h LEU 224 Ca 0.02 0.03 0.14 0.00 0.84 0.00 0.00 57.88 58.92 1bdf h LEU 224 Cb 1.11 0.24 -0.06 0.00 0.37 0.00 0.00 40.66 42.31 1bdf h LEU 224 CO 0.11 -0.56 0.54 0.00 -0.34 0.00 0.00 178.44 178.19 1bdf h ALA 225 N -1.31 1.97 0.00 1.25 0.00 -0.96 0.20 119.26 120.42 1bdf h ALA 225 Ca -0.11 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1bdf h ALA 225 Cb 0.83 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1bdf h ALA 225 CO 0.18 -0.19 -0.10 0.93 0.00 0.00 0.00 179.25 180.08 1bdf h GLU 226 N 0.56 0.00 -0.07 0.00 5.08 -1.35 -2.93 114.58 115.86 1bdf h GLU 226 Ca 0.40 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.63 1bdf h GLU 226 Cb 0.77 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 1bdf h GLU 226 CO -0.16 0.10 -0.57 1.96 -1.00 0.00 0.00 179.01 179.34 1bdf h GLN 227 N 0.00 0.22 -0.07 2.33 1.08 -0.48 -3.06 115.11 115.13 1bdf h GLN 227 Ca -0.00 -0.14 0.00 0.00 -1.45 0.00 0.00 58.65 57.06 1bdf h GLN 227 Cb 0.87 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.32 1bdf h GLN 227 CO 0.01 0.73 0.00 1.28 -0.95 0.00 0.00 178.83 179.90 1bdf n LEU 228 N -3.89 0.78 0.01 1.46 4.77 -1.11 -4.38 117.00 114.64 1bdf n LEU 228 Ca -0.02 -0.32 0.20 0.00 -0.03 0.00 0.00 56.01 55.84 1bdf n LEU 228 Cb 0.59 -0.04 0.69 0.00 -2.33 0.00 0.00 43.42 42.34 1bdf n LEU 228 CO 0.44 0.16 1.18 -0.33 -1.33 0.00 0.00 177.39 177.51 1bdf h GLU 229 N 1.06 0.00 -0.00 3.23 5.08 -1.49 -0.58 114.58 121.89 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 0.00 -0.04 0.00 -1.00 0.00 0.00 179.01 177.97 1bdf n ALA 230 N -2.62 2.66 -2.04 3.43 0.00 -1.26 -3.58 120.51 117.09 1bdf n ALA 230 Ca 0.09 -0.24 -0.22 0.00 0.00 0.00 0.00 53.44 53.07 1bdf n ALA 230 Cb 0.59 -1.41 0.03 0.00 0.00 0.00 0.00 19.45 18.66 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 -0.90 2.58 0.00 0.00 3.72 -0.22 -4.96 117.46 117.68 1bdf n PHE 231 Ca 0.18 -2.19 0.00 0.00 -0.05 0.00 0.00 57.45 55.40 1bdf n PHE 231 Cb 0.22 -0.33 0.00 0.00 -0.94 0.00 0.00 39.48 38.43 1bdf n PHE 231 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 1bdf n VAL 232 N -0.72 0.00 -3.19 -4.37 3.14 -1.24 -4.95 118.33 107.00 1bdf n VAL 232 Ca 0.41 1.36 -0.03 0.00 -2.96 0.00 0.00 64.34 63.12 1bdf n VAL 232 Cb 0.95 -1.93 0.00 0.00 -1.06 0.00 0.00 33.84 31.81 1bdf n VAL 232 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1bdf n ASP 233 N -2.34 -6.54 -4.68 6.55 2.03 -1.26 -4.78 116.55 105.52 1bdf n ASP 233 Ca 0.00 0.40 -0.42 0.00 0.52 0.00 0.00 54.79 55.29 1bdf n ASP 233 Cb 0.00 -1.77 -0.03 0.00 -0.72 0.00 0.00 41.12 38.60 1bdf n ASP 233 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1bdf s LEU 234 N -1.16 4.27 0.00 -2.67 2.96 -1.26 -5.28 118.68 115.54 1bdf s LEU 234 Ca 0.03 1.94 0.00 0.00 -0.22 0.00 0.00 54.13 55.89 1bdf s LEU 234 Cb -0.00 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.14 1bdf s LEU 234 CO 0.12 -0.74 0.00 -1.14 -1.32 0.00 0.00 176.35 173.27