#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2buf n LEU 3 N 0.00 3.74 0.00 1.09 7.94 -1.26 -5.05 117.00 123.46 2buf n LEU 3 Ca 0.00 -2.39 0.00 0.00 -1.11 0.00 0.00 56.01 52.51 2buf n LEU 3 Cb 0.00 -0.42 0.00 0.00 0.53 0.00 0.00 43.42 43.53 2buf n LEU 3 CO 0.00 0.75 0.00 -1.54 -1.11 0.00 0.00 177.39 175.49 2buf n SER 4 N 0.46 0.00 0.00 1.96 3.41 -1.26 -1.63 113.62 116.56 2buf n SER 4 Ca 0.19 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 2buf n SER 4 Cb 0.69 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.64 2buf n SER 4 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2buf n ARG 5 N 10.67 0.00 -0.30 4.33 -4.01 -1.26 -4.40 116.66 121.68 2buf n ARG 5 Ca 0.00 0.00 0.07 0.00 -1.04 0.00 0.00 57.85 56.88 2buf n ARG 5 Cb 0.00 0.00 0.16 0.00 -3.04 0.00 0.00 32.46 29.58 2buf n ARG 5 CO 0.00 0.00 0.00 -0.40 -3.04 0.00 0.00 177.63 174.19 2buf n ASP 6 N 0.00 -0.25 -0.28 2.89 5.75 -1.26 0.12 116.55 123.53 2buf n ASP 6 Ca 0.00 1.47 0.16 0.00 -0.01 0.00 0.00 54.79 56.41 2buf n ASP 6 Cb 0.00 -0.47 0.44 0.00 -1.03 0.00 0.00 41.12 40.06 2buf n ASP 6 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 2buf h ASP 7 N 0.00 0.55 0.09 -1.12 3.32 -1.86 0.84 116.42 118.24 2buf h ASP 7 Ca 0.44 0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.57 2buf h ASP 7 Cb 0.75 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.22 2buf h ASP 7 CO -0.86 0.23 -0.27 0.00 -1.72 0.00 0.00 179.24 176.62 2buf h ALA 8 N 1.61 -0.43 -0.95 3.45 0.00 0.20 0.80 119.26 123.93 2buf h ALA 8 Ca 0.49 -0.03 0.23 0.00 0.00 0.00 0.00 54.91 55.60 2buf h ALA 8 Cb 1.02 0.44 -0.07 0.00 0.00 0.00 0.00 17.79 19.18 2buf h ALA 8 CO -0.23 -0.80 0.63 0.00 0.00 0.00 0.00 179.25 178.85 2buf h ALA 9 N 0.28 2.27 0.18 0.00 0.00 0.65 -0.53 119.26 122.11 2buf h ALA 9 Ca 0.04 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2buf h ALA 9 Cb 0.50 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2buf h ALA 9 CO -0.17 -0.58 -0.09 0.37 0.00 0.00 0.00 179.25 178.78 2buf h GLN 10 N 0.37 -0.23 -0.94 0.00 5.75 0.16 -3.23 115.11 116.99 2buf h GLN 10 Ca 0.50 0.02 0.23 0.00 -0.15 0.00 0.00 58.65 59.24 2buf h GLN 10 Cb 1.31 0.05 -0.07 0.00 1.07 0.00 0.00 27.48 29.85 2buf h GLN 10 CO -0.19 -0.13 0.62 0.28 -2.65 0.00 0.00 178.83 176.76 2buf h VAL 11 N -1.06 0.63 -0.84 2.39 2.07 0.92 0.45 116.25 120.81 2buf h VAL 11 Ca -0.02 -0.12 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 2buf h VAL 11 Cb 0.21 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.18 2buf h VAL 11 CO 0.04 0.06 0.42 0.00 0.02 0.00 0.00 177.57 178.12 2buf h ALA 12 N 1.60 1.08 -0.19 1.67 0.00 -1.22 0.52 119.26 122.72 2buf h ALA 12 Ca 0.49 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 55.13 2buf h ALA 12 Cb 1.32 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2buf h ALA 12 CO -0.18 0.62 -0.36 1.57 0.00 0.00 0.00 179.25 180.90 2buf h LYS 13 N 1.18 0.58 0.00 0.00 2.10 -0.20 -2.86 116.57 117.37 2buf h LYS 13 Ca 0.29 -0.37 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 2buf h LYS 13 Cb 0.09 0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.46 2buf h LYS 13 CO -0.04 0.98 -0.23 1.33 -2.00 0.00 0.00 179.45 179.49 2buf n VAL 14 N -4.29 0.11 0.13 0.07 0.24 -0.28 -2.60 118.33 111.72 2buf n VAL 14 Ca -0.06 -0.06 -0.25 0.00 -2.04 0.00 0.00 64.34 61.93 2buf n VAL 14 Cb 0.51 -0.23 -0.16 0.00 -1.47 0.00 0.00 33.84 32.50 2buf n VAL 14 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2buf h LEU 15 N 0.00 0.81 0.56 1.34 3.38 0.05 -2.80 115.31 118.65 2buf h LEU 15 Ca 0.00 -0.92 -0.03 0.00 0.09 0.00 0.00 57.88 57.02 2buf h LEU 15 Cb 0.56 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.05 2buf h LEU 15 CO 0.00 1.73 -0.27 0.77 0.09 0.00 0.00 178.44 180.76 2buf h SER 16 N 0.13 -0.64 -0.54 -0.43 4.64 -1.51 0.13 113.55 115.32 2buf h SER 16 Ca -0.27 0.01 0.06 0.00 -0.47 0.00 0.00 61.79 61.11 2buf h SER 16 Cb 2.16 0.17 -0.09 0.00 -0.31 0.00 0.00 62.40 64.32 2buf h SER 16 CO 0.26 -0.43 -0.54 -0.33 -0.87 0.00 0.00 176.83 174.92 2buf h GLU 17 N -0.79 -0.27 -0.13 4.77 5.08 -1.61 0.81 114.58 122.44 2buf h GLU 17 Ca -0.08 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.34 2buf h GLU 17 Cb 0.60 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 2buf h GLU 17 CO 0.13 -0.18 0.33 0.00 -1.00 0.00 0.00 179.01 178.29 2buf h ALA 18 N 0.03 1.58 0.26 3.43 0.00 -1.18 -3.18 119.26 120.21 2buf h ALA 18 Ca 0.09 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2buf h ALA 18 Cb 0.52 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2buf h ALA 18 CO -0.65 -0.40 -0.20 -0.07 0.00 0.00 0.00 179.25 177.93 2buf h LEU 19 N 0.00 -0.52 -1.08 0.00 3.38 0.18 -1.44 115.31 115.83 2buf h LEU 19 Ca 0.06 0.04 0.13 0.00 0.09 0.00 0.00 57.88 58.20 2buf h LEU 19 Cb 0.72 0.17 -0.08 0.00 0.09 0.00 0.00 40.66 41.56 2buf h LEU 19 CO -0.00 -0.31 0.62 -0.65 0.09 0.00 0.00 178.44 178.18 2buf h PRO 20 N -0.47 0.89 -0.20 1.13 0.11 -1.67 0.74 132.00 132.53 2buf h PRO 20 Ca -0.02 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.03 2buf h PRO 20 Cb 0.42 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 2buf h PRO 20 CO -0.01 0.59 0.09 1.88 -0.21 0.00 0.00 178.00 180.34 2buf h TYR 21 N 0.92 0.30 0.01 0.65 0.99 -1.69 -2.59 116.97 115.55 2buf h TYR 21 Ca 0.49 -0.02 0.02 0.00 2.00 0.00 0.00 58.73 61.22 2buf h TYR 21 Cb 0.55 -0.09 -0.03 0.00 1.00 0.00 0.00 36.73 38.16 2buf h TYR 21 CO -0.00 0.33 -0.15 0.82 -0.00 0.00 0.00 178.16 179.16 2buf h ILE 22 N 0.19 0.64 -0.96 -2.88 2.04 0.11 -2.22 117.51 114.43 2buf h ILE 22 Ca 0.07 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.23 2buf h ILE 22 Cb 0.15 0.64 -0.16 0.00 -0.74 0.00 0.00 36.82 36.71 2buf h ILE 22 CO -0.01 0.00 0.32 0.03 0.00 0.00 0.00 178.15 178.49 2buf h ARG 23 N -0.25 0.12 -0.83 2.37 2.47 0.72 0.10 114.38 119.09 2buf h ARG 23 Ca 0.05 -0.01 0.09 0.00 -1.26 0.00 0.00 59.98 58.85 2buf h ARG 23 Cb 0.31 -0.03 -0.11 0.00 -1.65 0.00 0.00 29.97 28.49 2buf h ARG 23 CO -0.14 0.08 -0.43 0.54 0.56 0.00 0.00 179.97 180.58 2buf n ARG 24 N -5.27 -0.30 -0.08 0.04 1.74 -0.83 -0.84 116.66 111.11 2buf n ARG 24 Ca 0.28 1.26 0.09 0.00 -0.77 0.00 0.00 57.85 58.71 2buf n ARG 24 Cb 0.91 -1.86 0.35 0.00 -1.02 0.00 0.00 32.46 30.84 2buf n ARG 24 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2buf n PHE 25 N -5.10 0.21 -2.03 -1.55 3.01 0.00 -4.84 117.46 107.16 2buf n PHE 25 Ca 0.04 -0.10 -0.42 0.00 1.01 0.00 0.00 57.45 57.98 2buf n PHE 25 Cb 0.26 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.70 2buf n PHE 25 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2buf s VAL 26 N -1.79 2.93 0.00 -4.37 1.01 -0.02 -1.54 120.40 116.63 2buf s VAL 26 Ca 0.29 0.65 0.00 0.00 0.00 0.00 0.00 61.98 62.92 2buf s VAL 26 Cb 0.15 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 33.11 2buf s VAL 26 CO 0.23 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.99 2buf n GLY 27 N 3.66 3.24 3.85 4.51 0.00 -0.89 -4.97 105.19 114.59 2buf n GLY 27 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2buf n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2buf s LYS 28 N -0.49 3.81 -0.05 1.61 -0.14 -0.59 -4.78 119.74 119.11 2buf s LYS 28 Ca 0.00 0.90 -0.03 0.00 -1.36 0.00 0.00 55.97 55.48 2buf s LYS 28 Cb 0.00 -2.11 -0.04 0.00 -1.68 0.00 0.00 37.83 34.00 2buf s LYS 28 CO 0.00 -0.39 0.12 0.99 -0.76 0.00 0.00 175.35 175.30 2buf s THR 29 N -2.79 5.10 -0.22 2.17 2.01 -1.26 -0.98 115.64 119.67 2buf s THR 29 Ca 0.58 -0.14 -0.02 0.00 0.31 0.00 0.00 61.69 62.41 2buf s THR 29 Cb -0.11 -3.29 0.07 0.00 0.01 0.00 0.00 72.50 69.18 2buf s THR 29 CO 0.39 0.45 0.04 -0.76 -0.69 0.00 0.00 174.62 174.05 2buf s LEU 30 N -1.48 1.41 -0.14 4.42 1.43 -0.26 -1.17 118.68 122.89 2buf s LEU 30 Ca 0.21 -0.98 -0.28 0.00 -1.03 0.00 0.00 54.13 52.05 2buf s LEU 30 Cb -0.12 -0.67 -0.01 0.00 0.03 0.00 0.00 46.19 45.42 2buf s LEU 30 CO 0.11 -0.32 0.93 -0.69 0.23 0.00 0.00 176.35 176.61 2buf s VAL 31 N 1.80 4.82 -0.12 -1.59 1.01 -0.47 -1.36 120.40 124.49 2buf s VAL 31 Ca 0.00 1.87 0.03 0.00 0.00 0.00 0.00 61.98 63.89 2buf s VAL 31 Cb -0.17 -4.24 0.00 0.00 0.00 0.00 0.00 36.38 31.97 2buf s VAL 31 CO -0.11 0.01 -0.23 -0.63 0.00 0.00 0.00 175.10 174.14 2buf s ILE 32 N 2.09 2.08 -0.31 2.22 1.01 0.96 -1.14 121.20 128.12 2buf s ILE 32 Ca 0.44 -0.99 -0.14 0.00 0.00 0.00 0.00 60.65 59.95 2buf s ILE 32 Cb -0.17 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.46 2buf s ILE 32 CO 0.15 0.55 0.33 -0.75 0.00 0.00 0.00 174.94 175.22 2buf s LYS 33 N 0.54 3.74 -0.13 2.79 2.36 0.54 -0.66 119.74 128.92 2buf s LYS 33 Ca -0.14 -0.30 -0.10 0.00 -2.55 0.00 0.00 55.97 52.89 2buf s LYS 33 Cb -0.17 -3.74 -0.06 0.00 -1.05 0.00 0.00 37.83 32.81 2buf s LYS 33 CO 0.04 -0.40 -0.22 0.98 1.55 0.00 0.00 175.35 177.30 2buf n TYR 34 N 5.30 0.00 -1.70 4.03 9.36 -0.42 -1.84 117.16 131.88 2buf n TYR 34 Ca -0.10 0.00 -0.59 0.00 3.32 0.00 0.00 57.90 60.53 2buf n TYR 34 Cb 0.50 -0.50 -0.08 0.00 -0.63 0.00 0.00 39.34 38.64 2buf n TYR 34 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2buf n GLY 35 N 2.04 0.69 0.00 2.98 0.00 -1.26 -4.84 105.19 104.79 2buf n GLY 35 Ca -0.24 0.92 0.00 0.00 0.00 0.00 0.00 46.02 46.70 2buf n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2buf n GLY 36 N 3.96 3.89 0.00 -0.02 0.00 -1.26 -3.38 105.19 108.38 2buf n GLY 36 Ca 0.26 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2buf n GLY 36 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2buf n ASN 37 N 0.00 0.00 -0.39 1.61 5.03 -1.26 -4.30 115.26 115.95 2buf n ASN 37 Ca 0.00 0.00 0.32 0.00 0.87 0.00 0.00 54.58 55.77 2buf n ASN 37 Cb 0.00 0.00 0.62 0.00 -1.02 0.00 0.00 39.78 39.38 2buf n ASN 37 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2buf h ALA 38 N -2.00 2.65 -0.22 5.41 0.00 -2.00 0.77 119.26 123.87 2buf h ALA 38 Ca 0.00 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.03 2buf h ALA 38 Cb 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2buf h ALA 38 CO 0.00 -1.14 0.21 0.52 0.00 0.00 0.00 179.25 178.84 2buf h MET 39 N 0.19 0.00 -0.54 0.00 2.86 -1.88 -2.96 114.93 112.60 2buf h MET 39 Ca 0.69 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.33 2buf h MET 39 Cb 2.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.81 2buf h MET 39 CO -0.28 0.00 0.00 -1.91 1.06 0.00 0.00 176.91 175.78 2buf n GLU 40 N -3.96 0.26 -2.12 1.72 4.07 0.27 -4.35 120.64 116.53 2buf n GLU 40 Ca 0.02 0.00 -0.31 0.00 -0.06 0.00 0.00 57.16 56.81 2buf n GLU 40 Cb 0.35 -1.18 -0.01 0.00 -0.06 0.00 0.00 31.44 30.55 2buf n GLU 40 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 2buf s SER 41 N -0.41 6.36 -0.09 4.31 0.15 -1.12 -4.99 113.70 117.90 2buf s SER 41 Ca 0.00 1.42 -0.06 0.00 0.70 0.00 0.00 55.95 58.01 2buf s SER 41 Cb 0.00 -2.46 -0.05 0.00 -1.71 0.00 0.00 66.02 61.80 2buf s SER 41 CO 0.00 -0.74 0.22 -0.08 1.20 0.00 0.00 173.24 173.84 2buf h GLU 42 N 0.16 -0.10 -0.98 5.44 4.57 -1.94 -3.04 114.58 118.70 2buf h GLU 42 Ca -0.45 0.01 0.32 0.00 -1.18 0.00 0.00 59.36 58.06 2buf h GLU 42 Cb 1.19 0.02 -0.18 0.00 -0.16 0.00 0.00 28.75 29.62 2buf h GLU 42 CO 0.62 0.05 0.21 -1.91 -1.18 0.00 0.00 179.01 176.80 2buf n GLU 43 N -4.83 -0.07 0.18 1.92 2.13 -1.26 0.70 120.64 119.41 2buf n GLU 43 Ca -0.02 1.42 0.06 0.00 0.66 0.00 0.00 57.16 59.28 2buf n GLU 43 Cb 0.10 -2.37 0.21 0.00 0.27 0.00 0.00 31.44 29.65 2buf n GLU 43 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 2buf h LEU 44 N 0.00 0.00 -0.22 4.31 5.85 -1.87 -3.26 115.31 120.12 2buf h LEU 44 Ca 0.68 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 59.26 2buf h LEU 44 Cb 1.59 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.62 2buf h LEU 44 CO -0.86 0.38 -0.41 0.50 -0.34 0.00 0.00 178.44 177.71 2buf h LYS 45 N 0.00 0.66 -0.02 1.25 3.64 0.40 -2.96 116.57 119.54 2buf h LYS 45 Ca -0.00 -0.42 -0.00 0.00 -1.27 0.00 0.00 60.65 58.95 2buf h LYS 45 Cb 1.10 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.97 2buf h LYS 45 CO 0.05 1.04 -0.01 0.00 -2.27 0.00 0.00 179.45 178.26 2buf h ALA 46 N 0.62 1.94 -0.17 5.00 0.00 -1.55 -1.69 119.26 123.41 2buf h ALA 46 Ca 0.01 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2buf h ALA 46 Cb 1.01 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2buf h ALA 46 CO 0.09 0.05 -0.23 0.78 0.00 0.00 0.00 179.25 179.94 2buf h GLY 47 N 0.10 0.33 0.99 0.00 0.00 -1.57 -1.21 103.07 101.71 2buf h GLY 47 Ca 0.01 -0.24 -0.16 0.00 0.00 0.00 0.00 47.33 46.93 2buf h GLY 47 CO 0.00 0.22 -0.54 -2.75 0.00 0.00 0.00 176.54 173.47 2buf h PHE 48 N 0.28 0.85 -0.35 5.60 3.57 -1.31 -0.53 116.94 125.05 2buf h PHE 48 Ca 0.05 -0.35 0.01 0.00 3.53 0.00 0.00 57.97 61.21 2buf h PHE 48 Cb 0.56 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 2buf h PHE 48 CO 0.01 1.14 0.22 0.00 -2.23 0.00 0.00 178.31 177.45 2buf h ALA 49 N 0.55 0.44 0.41 2.41 0.00 -1.19 -0.87 119.26 121.00 2buf h ALA 49 Ca -0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2buf h ALA 49 Cb 1.16 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2buf h ALA 49 CO 0.11 -0.12 -0.20 -0.09 0.00 0.00 0.00 179.25 178.96 2buf h ARG 50 N 0.45 -0.53 -1.00 0.00 2.43 -1.20 -1.64 114.38 112.88 2buf h ARG 50 Ca 0.13 0.04 0.23 0.00 -0.81 0.00 0.00 59.98 59.57 2buf h ARG 50 Cb -0.03 0.12 -0.12 0.00 -0.42 0.00 0.00 29.97 29.52 2buf h ARG 50 CO -0.04 -0.31 0.60 -0.44 -1.51 0.00 0.00 179.97 178.26 2buf h ASP 51 N -0.61 0.70 0.02 -3.80 3.32 -0.85 0.14 116.42 115.33 2buf h ASP 51 Ca -0.06 0.13 -0.18 0.00 0.02 0.00 0.00 57.03 56.94 2buf h ASP 51 Cb 0.46 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.02 2buf h ASP 51 CO 0.09 0.15 -0.63 0.58 -1.72 0.00 0.00 179.24 177.71 2buf h VAL 52 N 0.63 1.32 -0.43 -1.35 2.07 -0.87 -1.04 116.25 116.58 2buf h VAL 52 Ca 0.63 -1.90 -0.05 0.00 0.82 0.00 0.00 66.70 66.20 2buf h VAL 52 Cb 1.15 1.87 -0.02 0.00 -1.52 0.00 0.00 31.29 32.77 2buf h VAL 52 CO -0.45 0.59 0.06 0.58 0.02 0.00 0.00 177.57 178.37 2buf h VAL 53 N 0.44 1.25 -0.76 2.57 2.07 -0.12 -1.97 116.25 119.73 2buf h VAL 53 Ca -0.01 -0.90 0.06 0.00 0.82 0.00 0.00 66.70 66.66 2buf h VAL 53 Cb 1.20 1.00 -0.06 0.00 -1.52 0.00 0.00 31.29 31.92 2buf h VAL 53 CO 0.12 0.31 0.45 0.25 0.02 0.00 0.00 177.57 178.72 2buf h LEU 54 N 0.57 0.70 -1.06 2.57 5.85 -0.66 0.59 115.31 123.87 2buf h LEU 54 Ca 0.13 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.88 2buf h LEU 54 Cb 0.39 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 2buf h LEU 54 CO 0.01 0.45 0.62 0.24 -0.34 0.00 0.00 178.44 179.42 2buf h MET 55 N 0.83 1.25 -0.13 1.25 2.86 -0.89 -1.57 114.93 118.53 2buf h MET 55 Ca 0.33 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.88 2buf h MET 55 Cb 0.16 -0.28 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 2buf h MET 55 CO -0.17 0.83 0.04 -0.22 1.06 0.00 0.00 176.91 178.45 2buf h LYS 56 N 1.28 0.21 -0.26 1.72 1.63 -0.28 -1.54 116.57 119.34 2buf h LYS 56 Ca 0.34 -0.05 0.05 0.00 -0.85 0.00 0.00 60.65 60.14 2buf h LYS 56 Cb -0.14 -0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 31.42 2buf h LYS 56 CO -0.07 0.36 -0.02 0.00 -3.45 0.00 0.00 179.45 176.26 2buf h ALA 57 N 0.84 0.21 0.00 5.00 0.00 -0.58 -1.79 119.26 122.94 2buf h ALA 57 Ca 0.04 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2buf h ALA 57 Cb 0.24 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2buf h ALA 57 CO -0.00 -0.44 0.00 0.28 0.00 0.00 0.00 179.25 179.09 2buf n VAL 58 N -5.18 0.28 0.00 0.00 0.31 -0.63 -4.83 118.33 108.28 2buf n VAL 58 Ca -0.01 0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 2buf n VAL 58 Cb 0.14 -0.97 0.00 0.00 -0.91 0.00 0.00 33.84 32.10 2buf n VAL 58 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2buf n GLY 59 N -0.66 2.09 3.81 2.92 0.00 -0.67 -4.85 105.19 107.82 2buf n GLY 59 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 2buf n GLY 59 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2buf s ILE 60 N -2.39 4.51 -0.36 -0.61 1.01 -0.59 -2.10 121.20 120.67 2buf s ILE 60 Ca 0.00 1.36 -0.12 0.00 0.00 0.00 0.00 60.65 61.90 2buf s ILE 60 Cb 0.00 -3.86 0.02 0.00 0.01 0.00 0.00 42.46 38.62 2buf s ILE 60 CO 0.00 0.15 0.21 0.20 0.00 0.00 0.00 174.94 175.51 2buf s ASN 61 N -1.71 5.79 0.03 3.58 0.01 -0.15 -3.42 114.94 119.07 2buf s ASN 61 Ca 0.46 -0.83 -0.12 0.00 -0.71 0.00 0.00 52.86 51.66 2buf s ASN 61 Cb -0.16 -2.05 -0.06 0.00 0.41 0.00 0.00 41.25 39.39 2buf s ASN 61 CO 0.21 -0.34 0.39 -2.16 -1.51 0.00 0.00 177.10 173.69 2buf s PRO 62 N 1.60 3.81 -0.15 -0.60 0.04 -1.26 -1.10 135.00 137.34 2buf s PRO 62 Ca 0.03 0.26 0.00 0.00 0.04 0.00 0.00 61.00 61.34 2buf s PRO 62 Cb -0.19 -3.10 0.02 0.00 0.04 0.00 0.00 34.50 31.27 2buf s PRO 62 CO 0.07 0.63 -0.14 0.08 0.04 0.00 0.00 177.00 177.69 2buf s VAL 63 N -1.24 1.54 -0.22 -0.36 1.01 -0.46 -4.21 120.40 116.46 2buf s VAL 63 Ca 0.28 -0.61 -0.09 0.00 0.00 0.00 0.00 61.98 61.56 2buf s VAL 63 Cb -0.15 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 2buf s VAL 63 CO 0.15 0.45 0.11 -0.69 0.00 0.00 0.00 175.10 175.12 2buf s VAL 64 N 1.50 5.02 -0.20 2.92 1.01 0.71 -0.02 120.40 131.32 2buf s VAL 64 Ca 0.05 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.09 2buf s VAL 64 Cb -0.13 -3.31 0.02 0.00 0.00 0.00 0.00 36.38 32.97 2buf s VAL 64 CO -0.11 0.40 -0.15 -0.69 0.00 0.00 0.00 175.10 174.55 2buf s VAL 65 N 0.81 2.36 0.15 2.92 1.01 0.17 0.86 120.40 128.69 2buf s VAL 65 Ca 0.06 -0.98 0.08 0.00 0.00 0.00 0.00 61.98 61.14 2buf s VAL 65 Cb -0.13 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 2buf s VAL 65 CO 0.02 0.41 -0.11 -1.38 0.00 0.00 0.00 175.10 174.04 2buf s HIS 66 N 1.30 2.65 0.00 5.22 -3.43 -1.08 -1.30 115.29 118.65 2buf s HIS 66 Ca 0.03 -0.21 0.00 0.00 -0.80 0.00 0.00 55.06 54.08 2buf s HIS 66 Cb -0.15 -1.33 0.00 0.00 -1.43 0.00 0.00 32.58 29.67 2buf s HIS 66 CO -0.10 0.47 0.00 0.41 -2.00 0.00 0.00 174.74 173.53 2buf n GLY 67 N 0.32 1.30 1.87 -1.38 0.00 -1.26 -3.90 105.19 102.13 2buf n GLY 67 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2buf n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2buf n GLY 68 N 4.99 -2.45 1.92 -0.02 0.00 -1.22 -4.82 105.19 103.60 2buf n GLY 68 Ca 0.00 -0.05 -0.14 0.00 0.00 0.00 0.00 46.02 45.82 2buf n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2buf n GLY 69 N 1.77 5.25 0.17 -0.02 0.00 -1.26 -4.70 105.19 106.40 2buf n GLY 69 Ca 0.00 -2.13 0.03 0.00 0.00 0.00 0.00 46.02 43.92 2buf n GLY 69 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2buf h PRO 70 N 2.02 0.00 0.00 1.61 0.11 -1.95 -2.84 132.00 130.95 2buf h PRO 70 Ca 0.21 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.30 2buf h PRO 70 Cb 1.43 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.53 2buf h PRO 70 CO 0.52 0.45 -0.10 1.96 -0.21 0.00 0.00 178.00 180.62 2buf h GLN 71 N 0.00 0.00 0.00 1.05 7.50 -2.00 -2.95 115.11 118.71 2buf h GLN 71 Ca -0.00 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.14 2buf h GLN 71 Cb 0.87 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.40 2buf h GLN 71 CO 0.06 0.10 -0.15 0.82 -1.50 0.00 0.00 178.83 178.15 2buf h ILE 72 N 0.00 0.22 -1.25 2.54 2.04 -1.84 -3.16 117.51 116.06 2buf h ILE 72 Ca -0.00 -1.18 0.39 0.00 1.00 0.00 0.00 64.86 65.07 2buf h ILE 72 Cb 0.37 0.43 -0.12 0.00 -0.74 0.00 0.00 36.82 36.76 2buf h ILE 72 CO 0.01 0.07 0.80 1.23 0.00 0.00 0.00 178.15 180.27 2buf h GLY 73 N -1.00 1.27 1.33 5.37 0.00 -1.55 0.64 103.07 109.13 2buf h GLY 73 Ca -0.01 -0.13 -0.16 0.00 0.00 0.00 0.00 47.33 47.03 2buf h GLY 73 CO -0.01 -0.33 -0.47 -1.80 0.00 0.00 0.00 176.54 173.93 2buf h ASP 74 N 0.16 0.78 0.27 0.19 3.58 -1.62 -1.41 116.42 118.37 2buf h ASP 74 Ca 0.76 -0.38 -0.01 0.00 0.42 0.00 0.00 57.03 57.81 2buf h ASP 74 Cb 2.30 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 43.13 2buf h ASP 74 CO -0.39 1.13 -0.13 0.25 -2.88 0.00 0.00 179.24 177.22 2buf h LEU 75 N 0.57 -0.30 -0.81 2.28 5.85 0.22 -1.64 115.31 121.48 2buf h LEU 75 Ca 0.03 -0.20 0.07 0.00 0.84 0.00 0.00 57.88 58.62 2buf h LEU 75 Cb 1.03 0.08 -0.10 0.00 0.37 0.00 0.00 40.66 42.04 2buf h LEU 75 CO 0.10 0.19 -0.47 0.18 -0.34 0.00 0.00 178.44 178.09 2buf n LEU 76 N -5.02 -0.85 -0.09 2.25 4.77 -0.01 -0.04 117.00 118.00 2buf n LEU 76 Ca -0.08 1.44 -0.12 0.00 -0.03 0.00 0.00 56.01 57.23 2buf n LEU 76 Cb 0.25 -0.19 -0.07 0.00 -2.33 0.00 0.00 43.42 41.08 2buf n LEU 76 CO 0.23 -1.18 0.55 0.11 -1.33 0.00 0.00 177.39 175.77 2buf h LYS 77 N 0.00 -0.39 0.00 3.23 6.56 -1.24 0.30 116.57 125.02 2buf h LYS 77 Ca 0.13 0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.75 2buf h LYS 77 Cb 0.33 0.09 0.00 0.00 -0.57 0.00 0.00 32.23 32.08 2buf h LYS 77 CO -0.76 -0.26 0.28 0.00 -2.06 0.00 0.00 179.45 176.65 2buf h ARG 78 N -0.41 0.00 -0.36 3.15 3.08 0.56 1.65 114.38 122.04 2buf h ARG 78 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2buf h ARG 78 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.66 2buf h ARG 78 CO -0.53 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 179.65 2buf n LEU 79 N -2.64 3.26 -3.75 3.04 4.77 0.81 -4.98 117.00 117.50 2buf n LEU 79 Ca -0.02 -2.23 -0.29 0.00 -0.03 0.00 0.00 56.01 53.45 2buf n LEU 79 Cb 0.32 -0.32 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 2buf n LEU 79 CO 0.12 0.74 -0.03 -1.20 -1.33 0.00 0.00 177.39 175.68 2buf n SER 80 N 0.39 -3.34 -4.16 -1.43 7.64 0.56 -4.93 113.62 108.35 2buf n SER 80 Ca 0.15 -0.65 -0.33 0.00 1.01 0.00 0.00 58.87 59.05 2buf n SER 80 Cb 0.55 -2.76 -0.16 0.00 -1.01 0.00 0.00 64.21 60.83 2buf n SER 80 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2buf s ILE 81 N -3.05 2.05 -0.03 0.44 1.01 -0.47 -4.96 121.20 116.19 2buf s ILE 81 Ca 0.55 -0.97 -0.19 0.00 0.00 0.00 0.00 60.65 60.05 2buf s ILE 81 Cb -0.30 -1.82 0.03 0.00 0.01 0.00 0.00 42.46 40.38 2buf s ILE 81 CO 0.68 0.55 0.40 -1.83 0.00 0.00 0.00 174.94 174.73 2buf s GLU 82 N 0.92 0.75 0.16 2.79 -1.05 -1.26 -3.32 118.70 117.69 2buf s GLU 82 Ca -0.04 -0.07 0.00 0.00 -0.15 0.00 0.00 54.97 54.71 2buf s GLU 82 Cb -0.15 0.34 -0.00 0.00 -0.44 0.00 0.00 34.13 33.88 2buf s GLU 82 CO -0.04 -0.21 0.20 -1.13 0.95 0.00 0.00 175.26 175.02 2buf n SER 83 N 1.23 -0.54 -4.47 0.83 3.41 -1.26 -5.12 113.62 107.70 2buf n SER 83 Ca -0.21 -1.91 -0.27 0.00 -0.26 0.00 0.00 58.87 56.23 2buf n SER 83 Cb 0.56 1.05 -0.11 0.00 -0.26 0.00 0.00 64.21 65.45 2buf n SER 83 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2buf s HIS 84 N -3.64 2.42 0.22 7.33 3.76 -1.26 -5.07 115.29 119.06 2buf s HIS 84 Ca 0.15 -0.31 0.00 0.00 -0.15 0.00 0.00 55.06 54.75 2buf s HIS 84 Cb -0.00 -1.20 0.00 0.00 1.11 0.00 0.00 32.58 32.49 2buf s HIS 84 CO 0.10 0.49 0.00 1.97 -0.85 0.00 0.00 174.74 176.46 2buf n PHE 85 N 0.24 -1.81 -2.42 1.40 1.16 -1.26 -4.52 117.46 110.25 2buf n PHE 85 Ca -0.12 0.32 -0.18 0.00 -1.87 0.00 0.00 57.45 55.60 2buf n PHE 85 Cb 0.56 0.46 0.02 0.00 -1.61 0.00 0.00 39.48 38.90 2buf n PHE 85 CO 0.00 0.00 0.00 -0.89 -1.87 0.00 0.00 176.76 174.00 2buf n ILE 86 N -3.37 -1.80 0.00 1.97 2.08 -1.26 -4.64 119.36 112.34 2buf n ILE 86 Ca 0.00 0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.34 2buf n ILE 86 Cb 0.00 -1.63 0.00 0.00 -0.75 0.00 0.00 39.64 37.26 2buf n ILE 86 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 2buf n ASP 87 N 0.11 0.00 0.00 4.38 -0.08 -1.26 -5.00 116.55 114.70 2buf n ASP 87 Ca -0.07 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.21 2buf n ASP 87 Cb 0.34 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.80 2buf n ASP 87 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2buf n GLY 88 N 0.00 1.89 3.92 0.27 0.00 -1.26 -4.97 105.19 105.04 2buf n GLY 88 Ca 0.00 -0.54 -0.26 0.00 0.00 0.00 0.00 46.02 45.22 2buf n GLY 88 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2buf s MET 89 N 0.00 3.05 -0.44 1.61 -1.94 -1.26 -5.07 119.30 115.25 2buf s MET 89 Ca 0.00 -0.05 -0.13 0.00 -1.71 0.00 0.00 55.69 53.79 2buf s MET 89 Cb 0.00 -2.34 0.07 0.00 2.01 0.00 0.00 34.83 34.57 2buf s MET 89 CO 0.00 -0.54 0.33 1.03 -0.01 0.00 0.00 175.02 175.83 2buf s ARG 90 N -4.87 2.86 -0.43 2.03 1.81 -1.26 -4.24 118.95 114.85 2buf s ARG 90 Ca 0.52 -1.33 -0.27 0.00 -1.72 0.00 0.00 55.73 52.93 2buf s ARG 90 Cb -0.10 -3.99 -0.06 0.00 -0.45 0.00 0.00 34.95 30.35 2buf s ARG 90 CO 0.44 -0.96 2.30 0.08 -0.68 0.00 0.00 175.30 176.48 2buf s VAL 91 N 1.58 3.05 -0.40 3.52 1.01 -1.26 -4.92 120.40 122.98 2buf s VAL 91 Ca 0.04 0.04 -0.18 0.00 0.00 0.00 0.00 61.98 61.87 2buf s VAL 91 Cb -0.23 -3.12 0.01 0.00 0.00 0.00 0.00 36.38 33.04 2buf s VAL 91 CO 0.06 -0.10 0.50 -0.89 0.00 0.00 0.00 175.10 174.67 2buf s THR 92 N 10.87 5.01 0.57 3.92 2.01 -1.26 -4.86 115.64 131.90 2buf s THR 92 Ca 0.95 -0.02 -0.06 0.00 0.31 0.00 0.00 61.69 62.87 2buf s THR 92 Cb -0.20 -4.04 -0.00 0.00 0.01 0.00 0.00 72.50 68.26 2buf s THR 92 CO 0.28 -0.39 0.89 1.51 -0.69 0.00 0.00 174.62 176.23 2buf s ASP 93 N 1.84 5.77 0.55 3.53 -4.77 -1.26 -4.56 116.67 117.78 2buf s ASP 93 Ca 0.16 0.83 0.41 0.00 -3.30 0.00 0.00 52.55 50.65 2buf s ASP 93 Cb -0.16 -1.89 1.61 0.00 -1.09 0.00 0.00 42.92 41.39 2buf s ASP 93 CO 0.15 -0.96 1.72 0.00 0.70 0.00 0.00 175.17 176.78 2buf h ALA 94 N -0.12 3.37 0.21 2.11 0.00 -1.99 -1.65 119.26 121.19 2buf h ALA 94 Ca -0.46 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 2buf h ALA 94 Cb 1.24 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2buf h ALA 94 CO 0.61 -1.79 -0.10 0.00 0.00 0.00 0.00 179.25 177.97 2buf h ALA 95 N 1.26 -0.28 -0.69 0.00 0.00 -2.01 -2.86 119.26 114.68 2buf h ALA 95 Ca 0.69 -0.16 0.12 0.00 0.00 0.00 0.00 54.91 55.55 2buf h ALA 95 Cb 2.78 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 20.63 2buf h ALA 95 CO -0.01 -0.29 0.46 1.79 0.00 0.00 0.00 179.25 181.20 2buf h THR 96 N -1.00 0.87 -0.20 0.00 1.35 -1.74 -1.30 112.91 110.89 2buf h THR 96 Ca -0.03 -0.16 -0.00 0.00 -0.55 0.00 0.00 66.41 65.67 2buf h THR 96 Cb 0.41 0.36 -0.01 0.00 -1.73 0.00 0.00 68.15 67.18 2buf h THR 96 CO 0.05 0.08 0.12 -0.03 -0.25 0.00 0.00 175.52 175.49 2buf h MET 97 N 0.46 0.27 -0.77 4.72 -1.53 -1.38 0.82 114.93 117.53 2buf h MET 97 Ca 0.33 -0.02 0.11 0.00 -3.44 0.00 0.00 59.70 56.67 2buf h MET 97 Cb 0.64 -0.06 -0.08 0.00 -0.55 0.00 0.00 31.60 31.55 2buf h MET 97 CO -0.10 0.23 0.39 -0.44 0.14 0.00 0.00 176.91 177.13 2buf h ASP 98 N 0.24 0.51 -0.04 1.39 5.19 -1.01 0.46 116.42 123.16 2buf h ASP 98 Ca 0.07 0.07 -0.02 0.00 -0.62 0.00 0.00 57.03 56.53 2buf h ASP 98 Cb 0.02 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 39.52 2buf h ASP 98 CO -0.01 0.27 -0.06 0.58 -3.12 0.00 0.00 179.24 176.89 2buf h VAL 99 N 0.63 1.42 -0.28 -1.35 2.07 -1.03 -1.91 116.25 115.81 2buf h VAL 99 Ca 0.39 -1.34 0.05 0.00 0.82 0.00 0.00 66.70 66.63 2buf h VAL 99 Cb 0.45 2.22 -0.08 0.00 -1.52 0.00 0.00 31.29 32.36 2buf h VAL 99 CO -0.29 0.36 -0.45 0.58 0.02 0.00 0.00 177.57 177.78 2buf h VAL 100 N -0.39 0.10 -0.03 2.57 2.07 0.12 -0.82 116.25 119.86 2buf h VAL 100 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 2buf h VAL 100 Cb 0.62 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 2buf h VAL 100 CO 0.01 0.00 0.02 -0.08 0.02 0.00 0.00 177.57 177.55 2buf h GLU 101 N -0.42 0.00 0.19 1.57 4.81 -0.97 0.12 114.58 119.87 2buf h GLU 101 Ca 0.10 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 59.01 2buf h GLU 101 Cb 0.61 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.01 2buf h GLU 101 CO -0.50 0.00 -1.45 1.98 -0.73 0.00 0.00 179.01 178.31 2buf h MET 102 N 0.00 0.39 0.19 1.92 4.05 -0.39 -2.97 114.93 118.13 2buf h MET 102 Ca 0.01 -0.67 -0.34 0.00 -0.28 0.00 0.00 59.70 58.42 2buf h MET 102 Cb 0.06 0.25 0.01 0.00 -0.80 0.00 0.00 31.60 31.12 2buf h MET 102 CO -0.00 1.31 -1.64 0.28 0.23 0.00 0.00 176.91 177.08 2buf h VAL 103 N 0.11 1.07 0.78 -5.77 2.07 -1.07 -1.23 116.25 112.20 2buf h VAL 103 Ca -0.23 -2.62 -0.04 0.00 0.82 0.00 0.00 66.70 64.64 2buf h VAL 103 Cb 2.08 2.84 0.01 0.00 -1.52 0.00 0.00 31.29 34.69 2buf h VAL 103 CO 0.22 0.84 -0.38 -0.07 0.02 0.00 0.00 177.57 178.20 2buf h LEU 104 N 0.11 -0.91 -0.07 2.57 3.38 -1.13 0.31 115.31 119.57 2buf h LEU 104 Ca -0.30 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2buf h LEU 104 Cb 2.11 0.24 0.00 0.00 0.09 0.00 0.00 40.66 43.09 2buf h LEU 104 CO 0.20 -0.64 -0.36 0.61 0.09 0.00 0.00 178.44 178.34 2buf n GLY 105 N -1.55 -1.20 0.00 0.83 0.00 -1.12 -0.84 105.19 101.31 2buf n GLY 105 Ca -0.15 -0.31 0.03 0.00 0.00 0.00 0.00 46.02 45.60 2buf n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2buf n GLY 106 N 1.47 0.26 0.93 -0.02 0.00 -0.47 -4.42 105.19 102.94 2buf n GLY 106 Ca 0.07 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2buf n GLY 106 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2buf n GLN 107 N -1.22 0.00 -0.10 1.61 7.27 -0.64 -4.66 117.38 119.65 2buf n GLN 107 Ca 0.01 0.00 -0.10 0.00 0.07 0.00 0.00 57.00 56.98 2buf n GLN 107 Cb 0.12 0.00 -0.07 0.00 2.41 0.00 0.00 30.24 32.70 2buf n GLN 107 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 2buf h VAL 108 N 0.00 0.00 0.02 1.69 2.07 -1.05 -1.00 116.25 117.98 2buf h VAL 108 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 2buf h VAL 108 Cb 0.00 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.72 2buf h VAL 108 CO 0.00 0.00 -0.52 -1.13 0.02 0.00 0.00 177.57 175.94 2buf h ASN 109 N -0.28 -1.60 0.00 0.57 -0.73 -1.19 -0.74 115.58 111.60 2buf h ASN 109 Ca 0.05 0.18 0.00 0.00 1.87 0.00 0.00 56.30 58.40 2buf h ASN 109 Cb 0.42 0.60 0.00 0.00 0.27 0.00 0.00 38.32 39.61 2buf h ASN 109 CO -0.42 -0.52 0.09 0.11 -0.37 0.00 0.00 177.43 176.32 2buf h LYS 110 N -0.67 0.00 0.13 6.67 1.79 -1.69 -1.91 116.57 120.89 2buf h LYS 110 Ca 0.01 0.00 -0.35 0.00 -2.18 0.00 0.00 60.65 58.13 2buf h LYS 110 Cb 0.71 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.35 2buf h LYS 110 CO -0.33 0.00 -1.86 -0.44 -1.08 0.00 0.00 179.45 175.73 2buf h ASP 111 N 0.00 0.42 0.19 0.86 3.32 0.21 -1.87 116.42 119.55 2buf h ASP 111 Ca 0.00 -0.81 -0.02 0.00 0.02 0.00 0.00 57.03 56.22 2buf h ASP 111 Cb 0.17 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 2buf h ASP 111 CO 0.00 1.71 -0.11 0.40 -1.72 0.00 0.00 179.24 179.52 2buf h ILE 112 N 0.07 0.81 0.04 0.35 2.04 -0.75 -0.92 117.51 119.15 2buf h ILE 112 Ca -0.37 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.07 2buf h ILE 112 Cb 2.05 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 39.37 2buf h ILE 112 CO 0.12 0.11 -0.02 0.58 0.00 0.00 0.00 178.15 178.94 2buf h VAL 113 N 0.00 1.32 -0.85 1.67 2.07 -1.42 -3.05 116.25 115.99 2buf h VAL 113 Ca -0.00 -1.23 0.15 0.00 0.82 0.00 0.00 66.70 66.44 2buf h VAL 113 Cb 0.24 2.12 -0.06 0.00 -1.52 0.00 0.00 31.29 32.07 2buf h VAL 113 CO 0.01 0.31 0.55 -1.13 0.02 0.00 0.00 177.57 177.33 2buf h ASN 114 N -0.60 0.56 0.40 0.57 -1.24 -0.36 -1.28 115.58 113.62 2buf h ASN 114 Ca -0.01 0.03 -0.02 0.00 0.71 0.00 0.00 56.30 57.02 2buf h ASN 114 Cb 0.54 -0.08 0.00 0.00 0.73 0.00 0.00 38.32 39.52 2buf h ASN 114 CO 0.01 0.28 -0.19 -0.07 -1.29 0.00 0.00 177.43 176.17 2buf h LEU 115 N 0.59 -0.46 -0.76 0.34 3.38 -1.25 -0.85 115.31 116.31 2buf h LEU 115 Ca 0.42 -0.10 0.17 0.00 0.09 0.00 0.00 57.88 58.46 2buf h LEU 115 Cb 0.78 0.12 -0.11 0.00 0.09 0.00 0.00 40.66 41.53 2buf h LEU 115 CO -0.18 -0.03 0.20 0.40 0.09 0.00 0.00 178.44 178.93 2buf h ILE 116 N -1.01 0.50 -0.00 1.22 2.04 -1.41 0.56 117.51 119.42 2buf h ILE 116 Ca -0.05 -0.10 0.02 0.00 1.00 0.00 0.00 64.86 65.72 2buf h ILE 116 Cb 0.53 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.78 2buf h ILE 116 CO 0.09 0.05 -0.10 0.78 0.00 0.00 0.00 178.15 178.97 2buf h ASN 117 N 0.29 -0.29 -0.64 1.72 4.21 -1.16 -1.34 115.58 118.36 2buf h ASN 117 Ca 0.44 0.05 0.19 0.00 1.21 0.00 0.00 56.30 58.18 2buf h ASN 117 Cb 0.76 0.13 -0.03 0.00 -1.12 0.00 0.00 38.32 38.06 2buf h ASN 117 CO -0.52 -0.15 0.51 0.03 -1.29 0.00 0.00 177.43 176.01 2buf h ARG 118 N -0.17 0.00 -0.60 0.81 3.08 0.58 -1.51 114.38 116.56 2buf h ARG 118 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2buf h ARG 118 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 2buf h ARG 118 CO -0.10 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 179.52 2buf n HIS 119 N -4.13 1.03 0.00 3.04 8.25 -0.65 -4.90 115.22 117.85 2buf n HIS 119 Ca 0.13 -0.42 0.00 0.00 -0.26 0.00 0.00 57.72 57.16 2buf n HIS 119 Cb 0.76 -0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.70 2buf n HIS 119 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2buf n GLY 120 N 0.97 1.04 3.99 -1.41 0.00 -0.57 -4.95 105.19 104.26 2buf n GLY 120 Ca 0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 2buf n GLY 120 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2buf s GLY 121 N -2.00 1.95 -0.34 -0.02 0.00 -0.58 -5.00 107.32 101.33 2buf s GLY 121 Ca 0.00 -1.85 -0.01 0.00 0.00 0.00 0.00 44.72 42.86 2buf s GLY 121 CO 0.00 -1.74 0.16 -0.56 0.00 0.00 0.00 173.10 170.96 2buf s SER 122 N -4.50 3.60 0.07 1.64 0.01 -1.26 -4.31 113.70 108.95 2buf s SER 122 Ca 0.53 -1.88 0.03 0.00 1.31 0.00 0.00 55.95 55.93 2buf s SER 122 Cb -0.05 -0.67 -0.04 0.00 0.21 0.00 0.00 66.02 65.47 2buf s SER 122 CO 0.33 -0.37 0.08 0.00 0.41 0.00 0.00 173.24 173.69 2buf s ALA 123 N 1.35 3.56 -0.16 1.44 0.00 -1.26 0.51 121.76 127.20 2buf s ALA 123 Ca 0.13 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 51.09 2buf s ALA 123 Cb -0.20 -1.44 0.03 0.00 0.00 0.00 0.00 23.12 21.52 2buf s ALA 123 CO -0.17 0.75 -0.11 0.42 0.00 0.00 0.00 175.76 176.65 2buf s ILE 124 N -1.37 1.45 -0.37 0.00 -1.09 -0.85 -4.88 121.20 114.08 2buf s ILE 124 Ca 0.29 -0.69 -0.29 0.00 -2.23 0.00 0.00 60.65 57.73 2buf s ILE 124 Cb -0.12 -1.45 0.02 0.00 -1.58 0.00 0.00 42.46 39.32 2buf s ILE 124 CO 0.21 0.32 1.19 -0.83 -1.23 0.00 0.00 174.94 174.60 2buf s GLY 125 N 1.51 1.39 -0.02 6.18 0.00 -1.26 -0.88 107.32 114.24 2buf s GLY 125 Ca 0.03 -0.15 0.05 0.00 0.00 0.00 0.00 44.72 44.64 2buf s GLY 125 CO -0.09 2.45 -0.16 1.08 0.00 0.00 0.00 173.10 176.38 2buf s LEU 126 N 4.26 1.99 0.00 0.66 1.43 0.10 -4.97 118.68 122.14 2buf s LEU 126 Ca 0.51 -0.29 0.03 0.00 -1.03 0.00 0.00 54.13 53.34 2buf s LEU 126 Cb -0.12 -0.82 0.03 0.00 0.03 0.00 0.00 46.19 45.31 2buf s LEU 126 CO 0.24 0.18 0.24 0.35 0.23 0.00 0.00 176.35 177.59 2buf n THR 127 N 2.83 0.00 0.24 5.49 -2.24 -1.26 -0.14 114.28 119.19 2buf n THR 127 Ca -0.15 -1.75 0.11 0.00 -2.27 0.00 0.00 64.05 59.99 2buf n THR 127 Cb 0.54 -0.00 0.55 0.00 -2.10 0.00 0.00 70.33 69.32 2buf n THR 127 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2buf h GLY 128 N 0.62 0.00 2.00 3.38 0.00 -1.39 -3.08 103.07 104.61 2buf h GLY 128 Ca -0.29 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 2buf h GLY 128 CO 0.46 0.00 -0.16 0.50 0.00 0.00 0.00 176.54 177.33 2buf h LYS 129 N 0.00 0.00 -6.32 4.80 1.79 -1.87 -0.76 116.57 114.21 2buf h LYS 129 Ca -0.00 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.91 2buf h LYS 129 Cb 0.63 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.24 2buf h LYS 129 CO 0.02 0.16 1.21 -0.51 -1.08 0.00 0.00 179.45 179.25 2buf s ASP 130 N -6.16 5.95 -1.36 0.86 1.01 -1.16 -2.76 116.67 113.05 2buf s ASP 130 Ca -0.02 0.86 -0.06 0.00 0.71 0.00 0.00 52.55 54.05 2buf s ASP 130 Cb 0.12 -2.53 0.03 0.00 1.01 0.00 0.00 42.92 41.55 2buf s ASP 130 CO 0.60 -1.74 0.42 0.00 0.21 0.00 0.00 175.17 174.66 2buf n ALA 131 N 10.18 -0.96 -3.92 5.23 0.00 -1.26 -0.52 120.51 129.25 2buf n ALA 131 Ca 0.19 0.16 -0.27 0.00 0.00 0.00 0.00 53.44 53.52 2buf n ALA 131 Cb 0.48 -2.90 0.00 0.00 0.00 0.00 0.00 19.45 17.03 2buf n ALA 131 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2buf n GLU 132 N -3.64 -4.29 -0.27 0.00 1.02 -1.11 -4.84 120.64 107.51 2buf n GLU 132 Ca -0.08 0.51 0.03 0.00 -0.02 0.00 0.00 57.16 57.60 2buf n GLU 132 Cb 0.59 -5.04 0.17 0.00 -0.02 0.00 0.00 31.44 27.13 2buf n GLU 132 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2buf h LEU 133 N -1.86 0.50 -7.16 -4.62 5.85 0.73 -3.37 115.31 105.38 2buf h LEU 133 Ca -0.61 0.07 -0.62 0.00 0.84 0.00 0.00 57.88 57.57 2buf h LEU 133 Cb 1.37 -0.01 -0.40 0.00 0.37 0.00 0.00 40.66 41.99 2buf h LEU 133 CO 0.65 0.26 -0.71 -0.63 -0.34 0.00 0.00 178.44 177.66 2buf s ILE 134 N -6.03 1.68 0.26 4.05 1.01 -1.10 -1.38 121.20 119.70 2buf s ILE 134 Ca -0.12 -2.55 -0.30 0.00 0.00 0.00 0.00 60.65 57.68 2buf s ILE 134 Cb 0.19 -2.19 -0.09 0.00 0.01 0.00 0.00 42.46 40.38 2buf s ILE 134 CO 0.77 -0.82 1.05 -0.13 0.00 0.00 0.00 174.94 175.82 2buf s ARG 135 N 0.43 4.70 0.34 2.79 0.52 -0.09 -1.63 118.95 126.02 2buf s ARG 135 Ca 0.16 1.71 0.02 0.00 -0.52 0.00 0.00 55.73 57.10 2buf s ARG 135 Cb -0.23 -3.22 -0.01 0.00 0.52 0.00 0.00 34.95 32.01 2buf s ARG 135 CO -0.04 0.29 0.40 0.00 0.02 0.00 0.00 175.30 175.98 2buf n ALA 136 N 1.33 0.10 -3.53 2.13 0.00 0.17 -0.61 120.51 120.11 2buf n ALA 136 Ca -0.01 -1.76 -0.05 0.00 0.00 0.00 0.00 53.44 51.62 2buf n ALA 136 Cb 0.45 1.42 -0.01 0.00 0.00 0.00 0.00 19.45 21.31 2buf n ALA 136 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2buf n LYS 137 N -0.60 0.45 0.00 0.00 2.85 -1.21 -4.01 118.16 115.64 2buf n LYS 137 Ca 0.04 -1.44 0.00 0.00 -1.05 0.00 0.00 58.31 55.85 2buf n LYS 137 Cb 0.59 1.49 0.00 0.00 -0.65 0.00 0.00 35.03 36.46 2buf n LYS 137 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 2buf n LYS 138 N -0.31 1.35 -3.96 -1.58 3.00 -1.26 -3.36 118.16 112.04 2buf n LYS 138 Ca -0.01 0.00 -0.10 0.00 -0.00 0.00 0.00 58.31 58.20 2buf n LYS 138 Cb 0.32 0.00 -0.07 0.00 0.00 0.00 0.00 35.03 35.28 2buf n LYS 138 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 2buf s LEU 139 N 0.00 0.91 -0.47 3.14 2.96 -1.23 -3.29 118.68 120.69 2buf s LEU 139 Ca 0.00 -0.87 0.03 0.00 -0.22 0.00 0.00 54.13 53.07 2buf s LEU 139 Cb 0.00 1.23 0.15 0.00 0.50 0.00 0.00 46.19 48.07 2buf s LEU 139 CO 0.00 -0.91 0.30 -0.89 -1.32 0.00 0.00 176.35 173.53 2buf s THR 140 N -3.97 1.35 -0.20 3.68 2.01 -1.26 -4.85 115.64 112.39 2buf s THR 140 Ca 0.18 -2.78 -0.16 0.00 0.31 0.00 0.00 61.69 59.24 2buf s THR 140 Cb 0.03 -1.93 -0.04 0.00 0.01 0.00 0.00 72.50 70.57 2buf s THR 140 CO 0.01 -0.98 0.39 -0.69 -0.69 0.00 0.00 174.62 172.65 2buf s VAL 141 N 0.06 5.21 -0.08 3.82 1.01 -1.26 -5.03 120.40 124.13 2buf s VAL 141 Ca 0.22 0.69 0.00 0.00 0.00 0.00 0.00 61.98 62.89 2buf s VAL 141 Cb -0.16 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 2buf s VAL 141 CO -0.06 0.26 -0.07 -0.89 0.00 0.00 0.00 175.10 174.34 2buf s THR 142 N 1.27 3.67 -0.18 3.92 2.01 -1.26 0.37 115.64 125.45 2buf s THR 142 Ca 0.19 -0.48 -0.28 0.00 0.31 0.00 0.00 61.69 61.42 2buf s THR 142 Cb -0.15 -2.51 -0.00 0.00 0.01 0.00 0.00 72.50 69.85 2buf s THR 142 CO 0.08 0.58 0.99 -0.13 -0.69 0.00 0.00 174.62 175.45 2buf s ARG 143 N -0.60 4.32 -1.22 4.92 0.52 -0.36 -4.89 118.95 121.64 2buf s ARG 143 Ca 0.09 1.30 -0.13 0.00 -0.52 0.00 0.00 55.73 56.47 2buf s ARG 143 Cb -0.12 -3.60 0.17 0.00 0.52 0.00 0.00 34.95 31.93 2buf s ARG 143 CO 0.02 -0.47 1.49 0.00 0.02 0.00 0.00 175.30 176.36 2buf n GLN 144 N 5.68 3.40 -3.92 3.54 10.64 -1.26 -4.44 117.38 131.03 2buf n GLN 144 Ca 0.09 -3.82 -0.31 0.00 -1.83 0.00 0.00 57.00 51.14 2buf n GLN 144 Cb 0.47 -3.03 -0.15 0.00 -0.86 0.00 0.00 30.24 26.68 2buf n GLN 144 CO 0.00 0.00 0.00 -2.14 -1.83 0.00 0.00 177.06 173.09 2buf s PRO 151 N 1.43 1.25 0.02 2.61 0.02 -1.26 -5.30 135.00 133.78 2buf s PRO 151 Ca 0.43 -1.49 -0.07 0.00 0.02 0.00 0.00 61.00 59.88 2buf s PRO 151 Cb -0.01 -2.72 -0.05 0.00 0.02 0.00 0.00 34.50 31.74 2buf s PRO 151 CO 0.00 -0.91 0.28 -1.21 -0.33 0.00 0.00 177.00 174.84 2buf s GLU 152 N 1.20 3.60 0.06 5.54 2.02 -1.26 -5.06 118.70 124.80 2buf s GLU 152 Ca 0.08 -0.05 -0.23 0.00 0.02 0.00 0.00 54.97 54.80 2buf s GLU 152 Cb -0.18 -3.07 -0.06 0.00 0.10 0.00 0.00 34.13 30.92 2buf s GLU 152 CO -0.14 0.63 0.68 0.42 0.02 0.00 0.00 175.26 176.88 2buf s ILE 153 N -1.32 4.72 -0.17 -1.63 1.01 -1.26 -1.22 121.20 121.32 2buf s ILE 153 Ca 0.28 1.45 -0.13 0.00 0.00 0.00 0.00 60.65 62.25 2buf s ILE 153 Cb -0.13 -4.02 -0.05 0.00 0.01 0.00 0.00 42.46 38.27 2buf s ILE 153 CO 0.17 0.44 0.28 -0.63 0.00 0.00 0.00 174.94 175.20 2buf s ILE 154 N -0.49 5.31 -0.64 2.92 1.01 0.16 -4.92 121.20 124.56 2buf s ILE 154 Ca 0.34 0.50 -0.26 0.00 0.00 0.00 0.00 60.65 61.23 2buf s ILE 154 Cb -0.20 -3.62 -0.05 0.00 0.01 0.00 0.00 42.46 38.61 2buf s ILE 154 CO 0.21 0.38 2.06 -0.62 0.00 0.00 0.00 174.94 176.97 2buf s ASP 155 N 0.54 4.92 -0.51 3.58 2.15 -1.26 -4.25 116.67 121.84 2buf s ASP 155 Ca 0.15 0.35 0.06 0.00 0.43 0.00 0.00 52.55 53.54 2buf s ASP 155 Cb -0.13 -2.53 0.22 0.00 -0.30 0.00 0.00 42.92 40.18 2buf s ASP 155 CO 0.03 -2.69 0.54 -0.38 -0.17 0.00 0.00 175.17 172.50 2buf n ILE 156 N 7.64 0.32 -2.31 4.11 5.41 -1.26 -4.87 119.36 128.41 2buf n ILE 156 Ca 0.30 -4.32 0.00 0.00 1.00 0.00 0.00 62.75 59.73 2buf n ILE 156 Cb 0.51 -1.96 0.00 0.00 -0.71 0.00 0.00 39.64 37.48 2buf n ILE 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2buf n GLY 157 N 1.66 1.42 2.28 7.39 0.00 -1.26 -4.14 105.19 112.54 2buf n GLY 157 Ca 0.25 -2.02 -0.09 0.00 0.00 0.00 0.00 46.02 44.16 2buf n GLY 157 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2buf n HIS 158 N -0.76 -1.35 -3.66 1.61 8.25 -1.26 -4.37 115.22 113.68 2buf n HIS 158 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.40 2buf n HIS 158 Cb 0.00 -2.20 -0.07 0.00 1.12 0.00 0.00 29.99 28.83 2buf n HIS 158 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2buf s VAL 159 N -2.28 -0.38 0.11 1.59 1.01 -1.26 -1.25 120.40 117.94 2buf s VAL 159 Ca 0.00 0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.03 2buf s VAL 159 Cb 0.00 -0.86 -0.00 0.00 0.00 0.00 0.00 36.38 35.52 2buf s VAL 159 CO 0.00 0.02 0.02 0.61 0.00 0.00 0.00 175.10 175.75 2buf n GLY 160 N 4.79 3.97 3.26 4.51 0.00 -1.22 -3.54 105.19 116.95 2buf n GLY 160 Ca -0.17 -2.09 -0.32 0.00 0.00 0.00 0.00 46.02 43.44 2buf n GLY 160 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2buf s GLU 161 N -2.41 3.07 0.06 1.61 2.02 -1.21 -4.82 118.70 117.03 2buf s GLU 161 Ca 0.03 -0.84 -0.31 0.00 0.02 0.00 0.00 54.97 53.87 2buf s GLU 161 Cb 0.00 -2.36 -0.06 0.00 0.10 0.00 0.00 34.13 31.81 2buf s GLU 161 CO 0.02 0.21 1.35 0.08 0.02 0.00 0.00 175.26 176.94 2buf s VAL 162 N 0.29 3.62 -0.18 2.63 1.01 -1.26 -3.29 120.40 123.23 2buf s VAL 162 Ca -0.16 1.11 0.05 0.00 0.00 0.00 0.00 61.98 62.99 2buf s VAL 162 Cb -0.17 -3.71 0.12 0.00 0.00 0.00 0.00 36.38 32.61 2buf s VAL 162 CO 0.08 0.05 1.08 0.35 0.00 0.00 0.00 175.10 176.66 2buf n THR 163 N 4.23 1.19 0.00 3.92 -2.24 0.22 -4.99 114.28 116.61 2buf n THR 163 Ca 0.12 -1.24 0.00 0.00 -2.27 0.00 0.00 64.05 60.66 2buf n THR 163 Cb 0.44 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.02 2buf n THR 163 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2buf n GLY 164 N -0.49 2.15 2.93 3.38 0.00 -1.12 -4.88 105.19 107.17 2buf n GLY 164 Ca 0.05 -0.56 -0.15 0.00 0.00 0.00 0.00 46.02 45.37 2buf n GLY 164 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2buf s VAL 165 N -2.00 -0.23 -0.54 1.61 1.01 -1.26 -0.91 120.40 118.08 2buf s VAL 165 Ca 0.00 0.27 -0.27 0.00 0.00 0.00 0.00 61.98 61.98 2buf s VAL 165 Cb 0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 36.03 2buf s VAL 165 CO 0.00 0.11 1.83 0.21 0.00 0.00 0.00 175.10 177.26 2buf s ASN 166 N 1.95 5.44 0.19 3.32 3.84 -0.48 -4.73 114.94 124.47 2buf s ASN 166 Ca -0.02 0.57 0.17 0.00 0.21 0.00 0.00 52.86 53.79 2buf s ASN 166 Cb -0.12 -2.53 -0.01 0.00 -0.55 0.00 0.00 41.25 38.05 2buf s ASN 166 CO -0.07 -2.20 1.16 -0.37 -2.79 0.00 0.00 177.10 172.83 2buf h VAL 167 N 6.86 0.56 -0.48 -5.21 -1.51 -1.93 -3.27 116.25 111.27 2buf h VAL 167 Ca -0.28 -1.91 0.09 0.00 -1.23 0.00 0.00 66.70 63.37 2buf h VAL 167 Cb 1.16 2.13 -0.10 0.00 -2.13 0.00 0.00 31.29 32.35 2buf h VAL 167 CO 1.17 0.32 -0.32 1.23 -1.23 0.00 0.00 177.57 178.75 2buf h GLY 168 N 3.67 -0.15 0.97 5.19 0.00 -1.99 0.22 103.07 110.99 2buf h GLY 168 Ca -0.07 0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.67 2buf h GLY 168 CO 0.05 -0.21 0.12 -2.00 0.00 0.00 0.00 176.54 174.50 2buf h LEU 169 N -0.20 0.23 -1.14 3.11 5.85 -1.97 -1.96 115.31 119.23 2buf h LEU 169 Ca 0.20 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 2buf h LEU 169 Cb 0.54 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.47 2buf h LEU 169 CO -0.59 0.21 0.42 -0.07 -0.34 0.00 0.00 178.44 178.06 2buf h LEU 170 N 0.24 0.90 -0.51 2.25 3.38 -1.38 -1.00 115.31 119.18 2buf h LEU 170 Ca 0.07 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 2buf h LEU 170 Cb 0.01 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 2buf h LEU 170 CO -0.01 0.71 0.01 0.78 0.09 0.00 0.00 178.44 180.02 2buf h ASN 171 N 1.02 0.87 -0.24 -0.43 2.35 -0.31 0.00 115.58 118.85 2buf h ASN 171 Ca 0.26 -0.30 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 2buf h ASN 171 Cb 0.00 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 2buf h ASN 171 CO -0.04 0.96 0.15 -0.03 -1.65 0.00 0.00 177.43 176.82 2buf h MET 172 N 0.76 0.31 -0.39 0.81 4.05 -0.76 -1.07 114.93 118.64 2buf h MET 172 Ca 0.15 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.54 2buf h MET 172 Cb 0.50 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.22 2buf h MET 172 CO 0.02 0.22 0.22 -0.07 0.23 0.00 0.00 176.91 177.53 2buf h LEU 173 N 0.31 0.49 0.51 3.39 3.38 -0.96 -2.50 115.31 119.93 2buf h LEU 173 Ca 0.09 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2buf h LEU 173 Cb -0.02 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.61 2buf h LEU 173 CO -0.02 0.44 -0.24 0.58 0.09 0.00 0.00 178.44 179.28 2buf h VAL 174 N 0.51 0.49 -0.76 1.22 2.07 -0.80 -1.08 116.25 117.89 2buf h VAL 174 Ca 0.14 -0.12 0.22 0.00 0.82 0.00 0.00 66.70 67.75 2buf h VAL 174 Cb 0.05 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 2buf h VAL 174 CO -0.02 0.02 0.58 0.11 0.02 0.00 0.00 177.57 178.28 2buf h LYS 175 N -0.76 0.00 -0.45 1.57 6.56 -1.18 0.94 116.57 123.24 2buf h LYS 175 Ca -0.07 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.52 2buf h LYS 175 Cb 0.56 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.22 2buf h LYS 175 CO 0.11 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.91 2buf n GLY 176 N -1.66 1.00 2.83 3.86 0.00 -0.95 -4.91 105.19 105.36 2buf n GLY 176 Ca 0.15 -0.40 -0.18 0.00 0.00 0.00 0.00 46.02 45.59 2buf n GLY 176 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2buf n ASP 177 N 0.49 -5.29 -4.87 1.61 8.00 0.33 -5.04 116.55 111.78 2buf n ASP 177 Ca 0.12 -0.26 -0.24 0.00 0.71 0.00 0.00 54.79 55.12 2buf n ASP 177 Cb 0.39 -4.10 -0.04 0.00 -0.02 0.00 0.00 41.12 37.35 2buf n ASP 177 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2buf s PHE 178 N -3.09 3.26 -0.37 1.24 0.40 -0.43 -4.64 117.98 114.34 2buf s PHE 178 Ca 0.28 -0.02 -0.05 0.00 -0.60 0.00 0.00 56.93 56.53 2buf s PHE 178 Cb -0.12 -1.52 0.07 0.00 0.51 0.00 0.00 43.02 41.96 2buf s PHE 178 CO 0.34 0.50 0.15 0.42 0.70 0.00 0.00 175.22 177.34 2buf s ILE 179 N -1.91 3.58 0.23 0.64 1.01 0.18 -4.28 121.20 120.65 2buf s ILE 179 Ca 0.33 -1.52 -0.30 0.00 0.00 0.00 0.00 60.65 59.16 2buf s ILE 179 Cb -0.09 -3.20 -0.10 0.00 0.01 0.00 0.00 42.46 39.08 2buf s ILE 179 CO 0.26 -0.39 1.46 -2.84 0.00 0.00 0.00 174.94 173.42 2buf s PRO 180 N 1.30 4.26 -0.30 2.79 0.02 -1.26 -2.01 135.00 139.81 2buf s PRO 180 Ca 0.02 2.30 0.02 0.00 0.02 0.00 0.00 61.00 63.35 2buf s PRO 180 Cb -0.21 -3.12 0.09 0.00 0.02 0.00 0.00 34.50 31.27 2buf s PRO 180 CO -0.00 -0.45 0.03 0.08 -0.33 0.00 0.00 177.00 176.33 2buf s VAL 181 N 0.21 1.62 -0.27 3.83 1.01 -0.06 -0.21 120.40 126.53 2buf s VAL 181 Ca 0.61 -1.70 -0.08 0.00 0.00 0.00 0.00 61.98 60.81 2buf s VAL 181 Cb -0.42 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.85 2buf s VAL 181 CO 0.41 -0.45 0.10 0.27 0.00 0.00 0.00 175.10 175.42 2buf s ILE 182 N 1.27 4.42 0.21 2.22 -4.36 0.25 0.00 121.20 125.22 2buf s ILE 182 Ca 0.05 -0.26 -0.30 0.00 -0.26 0.00 0.00 60.65 59.88 2buf s ILE 182 Cb -0.18 -3.14 -0.08 0.00 1.25 0.00 0.00 42.46 40.30 2buf s ILE 182 CO -0.12 0.24 1.09 0.00 0.24 0.00 0.00 174.94 176.39 2buf s ALA 183 N 1.61 3.38 -1.38 2.27 0.00 0.80 -2.65 121.76 125.79 2buf s ALA 183 Ca 0.06 0.83 -0.16 0.00 0.00 0.00 0.00 51.96 52.69 2buf s ALA 183 Cb -0.16 -3.34 0.04 0.00 0.00 0.00 0.00 23.12 19.67 2buf s ALA 183 CO 0.05 -0.17 2.05 -0.35 0.00 0.00 0.00 175.76 177.34 2buf n PRO 184 N 1.94 2.91 -4.44 0.00 -0.04 -1.25 -3.99 135.00 130.13 2buf n PRO 184 Ca 0.01 -2.81 -0.31 0.00 -0.04 0.00 0.00 63.50 60.36 2buf n PRO 184 Cb 0.46 -3.36 -0.17 0.00 -0.04 0.00 0.00 33.50 30.40 2buf n PRO 184 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2buf s ILE 185 N 3.70 1.78 0.28 0.52 1.01 -1.26 -2.84 121.20 124.38 2buf s ILE 185 Ca 0.50 -0.80 -0.03 0.00 0.00 0.00 0.00 60.65 60.32 2buf s ILE 185 Cb 0.10 -1.61 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 2buf s ILE 185 CO -0.02 0.50 0.51 -0.83 0.00 0.00 0.00 174.94 175.09 2buf s GLY 186 N 1.02 1.73 -0.04 6.18 0.00 -0.51 -1.48 107.32 114.21 2buf s GLY 186 Ca -0.04 -0.71 0.05 0.00 0.00 0.00 0.00 44.72 44.03 2buf s GLY 186 CO -0.04 -0.63 -0.20 0.14 0.00 0.00 0.00 173.10 172.37 2buf s VAL 187 N -2.07 1.68 0.75 1.40 1.01 -0.64 -1.40 120.40 121.12 2buf s VAL 187 Ca 0.42 -0.87 -0.10 0.00 0.00 0.00 0.00 61.98 61.42 2buf s VAL 187 Cb -0.11 -1.42 0.06 0.00 0.00 0.00 0.00 36.38 34.91 2buf s VAL 187 CO 0.31 0.47 1.11 -0.83 0.00 0.00 0.00 175.10 176.17 2buf s GLY 188 N -0.15 1.62 0.00 4.51 0.00 0.14 0.46 107.32 113.89 2buf s GLY 188 Ca -0.01 -0.64 0.07 0.00 0.00 0.00 0.00 44.72 44.14 2buf s GLY 188 CO 0.02 -0.21 1.15 -1.14 0.00 0.00 0.00 173.10 172.93 2buf n SER 189 N -3.12 0.00 -0.03 1.64 3.41 -1.26 -1.02 113.62 113.24 2buf n SER 189 Ca 0.08 0.34 -0.02 0.00 -0.26 0.00 0.00 58.87 59.01 2buf n SER 189 Cb 0.60 -0.39 -0.06 0.00 -0.26 0.00 0.00 64.21 64.10 2buf n SER 189 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2buf n ASN 190 N -1.39 3.25 0.00 4.04 4.13 -1.26 -5.04 115.26 118.99 2buf n ASN 190 Ca 0.03 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.29 2buf n ASN 190 Cb 0.07 0.84 0.00 0.00 -1.54 0.00 0.00 39.78 39.15 2buf n ASN 190 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2buf n GLY 191 N 2.44 1.43 3.85 7.41 0.00 -0.19 -5.12 105.19 115.02 2buf n GLY 191 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 2buf n GLY 191 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2buf s GLU 192 N -0.14 3.88 0.12 1.61 8.01 -1.26 -4.62 118.70 126.29 2buf s GLU 192 Ca 0.00 0.87 -0.05 0.00 0.01 0.00 0.00 54.97 55.81 2buf s GLU 192 Cb 0.00 -2.15 -0.05 0.00 -4.31 0.00 0.00 34.13 27.61 2buf s GLU 192 CO 0.00 -0.29 0.35 -1.12 0.01 0.00 0.00 175.26 174.20 2buf s SER 193 N -3.25 6.48 0.06 -0.19 0.01 -1.26 -0.69 113.70 114.87 2buf s SER 193 Ca 0.58 0.56 0.05 0.00 1.31 0.00 0.00 55.95 58.45 2buf s SER 193 Cb -0.10 -2.08 -0.03 0.00 0.21 0.00 0.00 66.02 64.02 2buf s SER 193 CO 0.35 0.09 -0.15 -0.31 0.41 0.00 0.00 173.24 173.63 2buf s TYR 194 N -1.59 1.32 -0.27 2.43 2.02 -0.49 -4.69 117.35 116.07 2buf s TYR 194 Ca 0.39 -0.40 -0.09 0.00 -0.37 0.00 0.00 57.07 56.59 2buf s TYR 194 Cb -0.12 -0.76 -0.03 0.00 -0.40 0.00 0.00 41.96 40.65 2buf s TYR 194 CO 0.24 0.07 0.12 1.21 -1.57 0.00 0.00 175.55 175.61 2buf s ASN 195 N -1.47 5.46 0.41 2.29 3.84 -0.38 -1.43 114.94 123.65 2buf s ASN 195 Ca 0.01 -0.17 0.08 0.00 0.21 0.00 0.00 52.86 52.98 2buf s ASN 195 Cb -0.09 -1.99 -0.04 0.00 -0.55 0.00 0.00 41.25 38.58 2buf s ASN 195 CO 0.02 -0.06 0.26 -0.63 -2.79 0.00 0.00 177.10 173.91 2buf s ILE 196 N 1.66 2.55 -0.32 -5.21 1.01 -1.13 -3.46 121.20 116.30 2buf s ILE 196 Ca 0.06 -1.54 -0.22 0.00 0.00 0.00 0.00 60.65 58.96 2buf s ILE 196 Cb -0.16 -3.00 -0.00 0.00 0.01 0.00 0.00 42.46 39.31 2buf s ILE 196 CO 0.06 -0.02 0.72 0.21 0.00 0.00 0.00 174.94 175.91 2buf s ASN 197 N -4.00 6.57 0.15 3.58 2.47 -1.26 -4.85 114.94 117.60 2buf s ASN 197 Ca 0.44 0.50 -0.22 0.00 0.42 0.00 0.00 52.86 53.99 2buf s ASN 197 Cb 0.00 -2.37 0.02 0.00 -1.45 0.00 0.00 41.25 37.45 2buf s ASN 197 CO 0.25 -0.58 1.27 0.00 -3.72 0.00 0.00 177.10 174.32 2buf n ALA 198 N 6.10 -0.40 -0.29 1.71 0.00 -1.26 -0.03 120.51 126.33 2buf n ALA 198 Ca 0.01 0.73 0.12 0.00 0.00 0.00 0.00 53.44 54.31 2buf n ALA 198 Cb 0.48 -0.19 0.28 0.00 0.00 0.00 0.00 19.45 20.02 2buf n ALA 198 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2buf h ASP 199 N 0.00 0.13 -0.59 0.00 3.32 -1.94 0.15 116.42 117.49 2buf h ASP 199 Ca 0.18 0.17 -0.10 0.00 0.02 0.00 0.00 57.03 57.30 2buf h ASP 199 Cb 0.38 0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 2buf h ASP 199 CO -0.79 -0.08 -0.00 -0.07 -1.72 0.00 0.00 179.24 176.58 2buf h LEU 200 N 0.29 1.03 0.44 1.55 3.38 -0.83 -0.87 115.31 120.31 2buf h LEU 200 Ca 0.53 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 2buf h LEU 200 Cb 1.03 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2buf h LEU 200 CO -0.58 1.08 -0.21 0.58 0.09 0.00 0.00 178.44 179.40 2buf h VAL 201 N 0.96 0.50 -0.70 1.22 2.07 -0.32 -1.68 116.25 118.29 2buf h VAL 201 Ca 0.17 -0.41 0.15 0.00 0.82 0.00 0.00 66.70 67.43 2buf h VAL 201 Cb 0.56 0.67 -0.13 0.00 -1.52 0.00 0.00 31.29 30.87 2buf h VAL 201 CO 0.03 0.07 -0.08 0.00 0.02 0.00 0.00 177.57 177.61 2buf h ALA 202 N -0.45 0.60 -0.45 1.67 0.00 -0.74 0.53 119.26 120.42 2buf h ALA 202 Ca -0.06 0.25 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 2buf h ALA 202 Cb 0.56 0.45 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2buf h ALA 202 CO 0.10 -0.42 -0.12 0.78 0.00 0.00 0.00 179.25 179.59 2buf h GLY 203 N 0.05 0.90 2.00 0.00 0.00 -1.15 0.87 103.07 105.74 2buf h GLY 203 Ca 0.36 -0.69 -0.06 0.00 0.00 0.00 0.00 47.33 46.94 2buf h GLY 203 CO -0.66 0.63 -0.30 0.50 0.00 0.00 0.00 176.54 176.71 2buf h LYS 204 N 0.75 0.00 0.03 4.80 1.79 -0.01 -0.30 116.57 123.62 2buf h LYS 204 Ca 0.12 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.37 2buf h LYS 204 Cb 0.62 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.26 2buf h LYS 204 CO 0.04 0.30 -0.98 0.28 -1.08 0.00 0.00 179.45 178.01 2buf h VAL 205 N 0.00 1.51 0.16 0.50 2.07 0.40 -2.93 116.25 117.95 2buf h VAL 205 Ca -0.00 -2.79 -0.01 0.00 0.82 0.00 0.00 66.70 64.72 2buf h VAL 205 Cb 0.95 2.61 0.00 0.00 -1.52 0.00 0.00 31.29 33.33 2buf h VAL 205 CO 0.04 0.81 -0.08 0.00 0.02 0.00 0.00 177.57 178.37 2buf h ALA 206 N 0.86 -0.21 -0.59 1.67 0.00 -0.39 -2.73 119.26 117.87 2buf h ALA 206 Ca -0.06 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 54.78 2buf h ALA 206 Cb 1.65 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 19.44 2buf h ALA 206 CO 0.15 -0.46 0.15 0.93 0.00 0.00 0.00 179.25 180.02 2buf h GLU 207 N -0.53 0.28 -0.89 0.00 5.08 -1.14 0.12 114.58 117.51 2buf h GLU 207 Ca -0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2buf h GLU 207 Cb 0.41 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.55 2buf h GLU 207 CO 0.04 0.19 0.56 0.00 -1.00 0.00 0.00 179.01 178.79 2buf h ALA 208 N 1.46 1.32 -0.01 3.43 0.00 -1.49 -1.64 119.26 122.32 2buf h ALA 208 Ca 0.31 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2buf h ALA 208 Cb 0.44 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2buf h ALA 208 CO -0.38 0.61 -0.09 1.28 0.00 0.00 0.00 179.25 180.68 2buf n LEU 209 N -4.38 1.51 -3.88 0.00 4.77 -0.84 -4.94 117.00 109.24 2buf n LEU 209 Ca 0.10 -0.48 -0.32 0.00 -0.03 0.00 0.00 56.01 55.28 2buf n LEU 209 Cb 0.04 -0.03 0.01 0.00 -2.33 0.00 0.00 43.42 41.11 2buf n LEU 209 CO 0.37 0.26 -0.17 0.29 -1.33 0.00 0.00 177.39 176.81 2buf n LYS 210 N 0.04 -1.85 -1.07 3.23 4.01 0.37 -4.90 118.16 117.98 2buf n LYS 210 Ca 0.16 0.36 -0.29 0.00 -0.51 0.00 0.00 58.31 58.03 2buf n LYS 210 Cb 0.38 -4.00 0.17 0.00 -0.51 0.00 0.00 35.03 31.07 2buf n LYS 210 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2buf s ALA 211 N -3.72 0.98 -0.01 7.82 0.00 -0.97 -4.85 121.76 121.02 2buf s ALA 211 Ca 0.27 -0.18 -0.19 0.00 0.00 0.00 0.00 51.96 51.87 2buf s ALA 211 Cb -0.11 -3.18 -0.34 0.00 0.00 0.00 0.00 23.12 19.49 2buf s ALA 211 CO 0.90 -2.80 0.95 1.49 0.00 0.00 0.00 175.76 176.29 2buf h GLU 212 N -1.87 0.43 -3.60 0.00 4.57 -1.49 -2.65 114.58 109.96 2buf h GLU 212 Ca -0.53 -0.74 -0.16 0.00 -1.18 0.00 0.00 59.36 56.75 2buf h GLU 212 Cb 1.31 0.28 -0.22 0.00 -0.16 0.00 0.00 28.75 29.96 2buf h GLU 212 CO 0.55 1.36 -0.55 0.15 -1.18 0.00 0.00 179.01 179.33 2buf s LYS 213 N -2.52 0.39 -0.21 1.92 1.02 -1.22 -0.99 119.74 118.13 2buf s LYS 213 Ca -0.11 -0.35 -0.03 0.00 0.02 0.00 0.00 55.97 55.49 2buf s LYS 213 Cb 0.03 0.16 -0.01 0.00 -0.52 0.00 0.00 37.83 37.49 2buf s LYS 213 CO 0.89 -0.09 -0.06 -1.17 -0.92 0.00 0.00 175.35 174.01 2buf s LEU 214 N -1.17 2.82 -0.20 3.17 2.96 -0.03 -1.37 118.68 124.87 2buf s LEU 214 Ca -0.13 -0.40 -0.02 0.00 -0.22 0.00 0.00 54.13 53.36 2buf s LEU 214 Cb -0.07 -1.71 -0.00 0.00 0.50 0.00 0.00 46.19 44.91 2buf s LEU 214 CO 0.01 -0.00 -0.09 -0.04 -1.32 0.00 0.00 176.35 174.91 2buf s MET 215 N 1.35 3.32 -0.38 1.98 -1.94 -0.29 -0.18 119.30 123.17 2buf s MET 215 Ca 0.04 -0.67 -0.06 0.00 -1.71 0.00 0.00 55.69 53.29 2buf s MET 215 Cb -0.14 -2.87 0.07 0.00 2.01 0.00 0.00 34.83 33.90 2buf s MET 215 CO -0.03 -0.12 0.17 -0.51 -0.01 0.00 0.00 175.02 174.51 2buf s LEU 216 N 1.23 4.75 -0.38 -0.03 1.43 0.20 -0.34 118.68 125.55 2buf s LEU 216 Ca 0.03 -1.49 -0.27 0.00 -1.03 0.00 0.00 54.13 51.37 2buf s LEU 216 Cb -0.14 -1.88 0.02 0.00 0.03 0.00 0.00 46.19 44.22 2buf s LEU 216 CO -0.03 -0.44 1.00 -0.76 0.23 0.00 0.00 176.35 176.34 2buf s LEU 217 N 1.33 3.92 0.00 1.79 1.43 -0.77 -1.28 118.68 125.11 2buf s LEU 217 Ca 0.02 0.66 0.02 0.00 -1.03 0.00 0.00 54.13 53.79 2buf s LEU 217 Cb -0.21 -3.37 0.02 0.00 0.03 0.00 0.00 46.19 42.65 2buf s LEU 217 CO 0.00 -0.93 0.13 1.07 0.23 0.00 0.00 176.35 176.85 2buf n THR 218 N 6.10 0.00 -1.19 5.49 5.66 0.87 -4.78 114.28 126.44 2buf n THR 218 Ca 0.09 -1.04 0.00 0.00 -3.05 0.00 0.00 64.05 60.06 2buf n THR 218 Cb 0.48 -0.12 0.24 0.00 -1.55 0.00 0.00 70.33 69.37 2buf n THR 218 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 2buf n ASN 219 N -1.68 3.43 -3.82 1.09 2.04 -1.26 0.14 115.26 115.20 2buf n ASN 219 Ca -0.04 -3.37 -0.12 0.00 -0.44 0.00 0.00 54.58 50.61 2buf n ASN 219 Cb 0.29 -0.62 -0.13 0.00 -2.53 0.00 0.00 39.78 36.80 2buf n ASN 219 CO 0.00 0.00 0.00 -0.51 -0.44 0.00 0.00 177.26 176.31 2buf s ILE 220 N -3.04 -0.00 -0.33 1.53 -1.16 -1.26 -4.97 121.20 111.97 2buf s ILE 220 Ca 0.45 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.60 2buf s ILE 220 Cb 0.39 -0.22 0.00 0.00 0.61 0.00 0.00 42.46 43.24 2buf s ILE 220 CO 0.06 0.00 0.22 0.00 -2.81 0.00 0.00 174.94 172.41 2buf n ALA 221 N 3.01 0.26 0.00 1.50 0.00 -1.26 -3.40 120.51 120.61 2buf n ALA 221 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2buf n ALA 221 Cb 0.59 -0.19 0.00 0.00 0.00 0.00 0.00 19.45 19.85 2buf n ALA 221 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2buf n GLY 222 N -0.72 0.82 3.54 0.00 0.00 -1.26 -4.34 105.19 103.24 2buf n GLY 222 Ca 0.00 -2.01 -0.43 0.00 0.00 0.00 0.00 46.02 43.58 2buf n GLY 222 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2buf s LEU 223 N 0.00 3.91 0.59 0.99 2.96 -1.26 -4.97 118.68 120.89 2buf s LEU 223 Ca 0.00 -0.18 -0.04 0.00 -0.22 0.00 0.00 54.13 53.69 2buf s LEU 223 Cb 0.00 -2.96 0.02 0.00 0.50 0.00 0.00 46.19 43.75 2buf s LEU 223 CO 0.00 -1.28 0.87 -0.04 -1.32 0.00 0.00 176.35 174.58 2buf s MET 224 N 4.21 2.74 0.00 1.98 -1.94 -1.26 -1.18 119.30 123.85 2buf s MET 224 Ca 0.35 -0.25 0.00 0.00 -1.71 0.00 0.00 55.69 54.08 2buf s MET 224 Cb -0.11 -2.33 0.00 0.00 2.01 0.00 0.00 34.83 34.40 2buf s MET 224 CO 0.22 -0.74 0.00 -0.40 -0.01 0.00 0.00 175.02 174.08 2buf n ASP 225 N -2.54 0.23 0.30 3.03 5.68 -0.75 -4.86 116.55 117.65 2buf n ASP 225 Ca 0.05 0.00 -0.12 0.00 -0.50 0.00 0.00 54.79 54.22 2buf n ASP 225 Cb 0.58 0.00 -0.06 0.00 -1.14 0.00 0.00 41.12 40.50 2buf n ASP 225 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 2buf h LYS 226 N 0.00 -0.77 0.00 0.11 1.57 -1.95 -2.98 116.57 112.56 2buf h LYS 226 Ca 0.00 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2buf h LYS 226 Cb 0.00 0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.48 2buf h LYS 226 CO 0.00 -0.51 0.00 1.04 -0.57 0.00 0.00 179.45 179.41 2buf n GLN 227 N -4.24 0.47 -1.64 3.15 6.02 -1.26 -4.81 117.38 115.07 2buf n GLN 227 Ca -0.10 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.82 2buf n GLN 227 Cb 0.32 -1.06 -0.02 0.00 1.02 0.00 0.00 30.24 30.50 2buf n GLN 227 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2buf n GLY 228 N -0.03 0.51 3.84 1.08 0.00 -1.12 -5.03 105.19 104.43 2buf n GLY 228 Ca 0.01 -0.68 -0.37 0.00 0.00 0.00 0.00 46.02 44.99 2buf n GLY 228 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2buf s GLN 229 N -3.42 3.72 0.21 1.61 -1.52 -1.26 -4.76 119.66 114.24 2buf s GLN 229 Ca 0.00 0.02 -0.32 0.00 -1.95 0.00 0.00 55.36 53.11 2buf s GLN 229 Cb 0.00 -3.25 -0.13 0.00 -0.22 0.00 0.00 33.01 29.42 2buf s GLN 229 CO 0.00 0.65 1.65 0.28 -0.25 0.00 0.00 175.29 177.63 2buf n VAL 230 N 2.27 0.20 -3.59 1.09 0.31 -1.26 -1.81 118.33 115.52 2buf n VAL 230 Ca -0.17 -0.05 -0.20 0.00 -0.01 0.00 0.00 64.34 63.91 2buf n VAL 230 Cb 0.54 -1.84 -0.02 0.00 -0.91 0.00 0.00 33.84 31.60 2buf n VAL 230 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2buf s LEU 231 N 0.81 3.66 0.00 7.52 1.43 -0.32 -4.93 118.68 126.85 2buf s LEU 231 Ca 0.74 -0.46 0.00 0.00 -1.03 0.00 0.00 54.13 53.38 2buf s LEU 231 Cb -0.55 -2.37 0.00 0.00 0.03 0.00 0.00 46.19 43.30 2buf s LEU 231 CO 0.37 -0.47 0.00 1.07 0.23 0.00 0.00 176.35 177.55 2buf n THR 232 N -1.52 0.00 -1.00 5.49 5.66 -1.26 -3.95 114.28 117.70 2buf n THR 232 Ca 0.01 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 60.95 2buf n THR 232 Cb 0.60 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.35 2buf n THR 232 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2buf n GLY 233 N -0.52 0.52 3.79 1.09 0.00 -0.59 -4.84 105.19 104.64 2buf n GLY 233 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2buf n GLY 233 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2buf n LEU 234 N -1.11 0.00 -4.89 0.99 -0.00 -1.22 -4.94 117.00 105.83 2buf n LEU 234 Ca -0.06 -2.00 -0.26 0.00 -0.00 0.00 0.00 56.01 53.70 2buf n LEU 234 Cb 0.23 -0.67 -0.01 0.00 -0.00 0.00 0.00 43.42 42.97 2buf n LEU 234 CO 0.08 -1.02 0.03 -0.94 -0.00 0.00 0.00 177.39 175.54 2buf s SER 235 N -5.04 4.62 0.02 1.45 1.04 -1.26 -3.55 113.70 110.99 2buf s SER 235 Ca 0.65 -1.23 -0.13 0.00 0.48 0.00 0.00 55.95 55.73 2buf s SER 235 Cb -0.03 0.34 -0.07 0.00 0.10 0.00 0.00 66.02 66.36 2buf s SER 235 CO 0.44 -1.05 1.19 0.74 0.98 0.00 0.00 173.24 175.54 2buf h THR 236 N 0.81 0.00 -1.00 2.02 2.02 -1.95 0.41 112.91 115.22 2buf h THR 236 Ca -0.37 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.03 2buf h THR 236 Cb 1.30 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 67.61 2buf h THR 236 CO 0.58 0.00 0.63 -0.08 0.37 0.00 0.00 175.52 177.02 2buf h GLU 237 N -0.42 0.52 -0.16 6.66 4.81 -1.97 0.36 114.58 124.38 2buf h GLU 237 Ca -0.04 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.16 2buf h GLU 237 Cb 0.33 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 2buf h GLU 237 CO 0.04 0.34 0.09 0.37 -0.73 0.00 0.00 179.01 179.12 2buf h GLN 238 N 0.54 0.22 -0.04 1.92 4.15 -1.88 -2.26 115.11 117.75 2buf h GLN 238 Ca 0.58 -0.03 -0.11 0.00 0.77 0.00 0.00 58.65 59.86 2buf h GLN 238 Cb 1.23 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.86 2buf h GLN 238 CO -0.33 0.23 -0.47 0.28 -1.93 0.00 0.00 178.83 176.61 2buf h VAL 239 N 0.16 1.34 0.00 2.39 2.07 0.37 -1.39 116.25 121.18 2buf h VAL 239 Ca 0.06 -1.65 -0.03 0.00 0.82 0.00 0.00 66.70 65.90 2buf h VAL 239 Cb 0.07 1.84 -0.00 0.00 -1.52 0.00 0.00 31.29 31.68 2buf h VAL 239 CO -0.01 0.48 -0.15 0.78 0.02 0.00 0.00 177.57 178.69 2buf h ASN 240 N 0.09 0.00 0.10 0.57 2.35 -0.62 -2.94 115.58 115.12 2buf h ASN 240 Ca 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2buf h ASN 240 Cb 0.87 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.24 2buf h ASN 240 CO 0.07 0.15 -0.05 -0.33 -1.65 0.00 0.00 177.43 175.62 2buf h GLU 241 N 0.00 -0.13 0.00 0.81 5.08 -0.65 -3.18 114.58 116.51 2buf h GLU 241 Ca -0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2buf h GLU 241 Cb 0.34 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.62 2buf h GLU 241 CO 0.02 -0.09 0.03 1.28 -1.00 0.00 0.00 179.01 179.26 2buf n LEU 242 N -2.37 0.33 -0.13 1.33 4.77 -1.16 0.20 117.00 119.97 2buf n LEU 242 Ca -0.02 0.64 -0.11 0.00 -0.03 0.00 0.00 56.01 56.49 2buf n LEU 242 Cb 0.05 -0.67 -0.02 0.00 -2.33 0.00 0.00 43.42 40.45 2buf n LEU 242 CO 0.04 -0.75 0.71 -0.29 -1.33 0.00 0.00 177.39 175.77 2buf h ILE 243 N 0.00 1.28 -0.78 -0.08 6.09 -1.50 -2.20 117.51 120.32 2buf h ILE 243 Ca 0.00 -1.20 -0.04 0.00 -1.37 0.00 0.00 64.86 62.26 2buf h ILE 243 Cb 0.06 1.27 -0.03 0.00 0.47 0.00 0.00 36.82 38.58 2buf h ILE 243 CO 0.00 0.40 0.34 0.00 -3.07 0.00 0.00 178.15 175.82 2buf h ALA 244 N 0.83 1.00 -0.27 0.18 0.00 -0.30 0.85 119.26 121.55 2buf h ALA 244 Ca 0.09 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 54.91 2buf h ALA 244 Cb 0.63 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2buf h ALA 244 CO 0.04 0.60 0.40 0.22 0.00 0.00 0.00 179.25 180.51 2buf h ASP 245 N 1.11 0.00 -0.15 0.00 1.82 -1.26 -3.43 116.42 114.51 2buf h ASP 245 Ca 0.26 0.00 -0.06 0.00 -0.39 0.00 0.00 57.03 56.84 2buf h ASP 245 Cb 0.17 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.16 2buf h ASP 245 CO -0.03 0.00 -0.06 0.61 -1.61 0.00 0.00 179.24 178.16 2buf n GLY 246 N -1.40 0.61 0.36 -0.78 0.00 0.29 -4.92 105.19 99.36 2buf n GLY 246 Ca 0.04 -0.42 0.11 0.00 0.00 0.00 0.00 46.02 45.75 2buf n GLY 246 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2buf h THR 247 N 0.00 0.91 -3.52 2.61 2.02 -1.54 -3.43 112.91 109.95 2buf h THR 247 Ca -0.06 -0.21 -0.52 0.00 0.77 0.00 0.00 66.41 66.39 2buf h THR 247 Cb 0.33 0.25 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 2buf h THR 247 CO 0.09 0.11 -0.03 -0.63 0.37 0.00 0.00 175.52 175.43 2buf s ILE 248 N -5.56 4.82 0.31 3.11 1.01 -1.26 -5.02 121.20 118.60 2buf s ILE 248 Ca -0.09 0.73 -0.19 0.00 0.00 0.00 0.00 60.65 61.10 2buf s ILE 248 Cb 0.20 -3.65 0.05 0.00 0.01 0.00 0.00 42.46 39.08 2buf s ILE 248 CO 0.77 -0.05 0.82 -0.72 0.00 0.00 0.00 174.94 175.76 2buf s TYR 249 N -1.81 0.00 0.00 3.97 -0.85 -1.26 -4.86 117.35 112.55 2buf s TYR 249 Ca 0.48 -0.55 0.00 0.00 -0.52 0.00 0.00 57.07 56.48 2buf s TYR 249 Cb -0.12 0.77 0.00 0.00 0.38 0.00 0.00 41.96 42.99 2buf s TYR 249 CO 0.20 -1.32 0.00 0.41 -1.52 0.00 0.00 175.55 173.32 2buf n GLY 250 N -0.53 0.85 0.68 5.49 0.00 -1.26 -2.60 105.19 107.81 2buf n GLY 250 Ca -0.06 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.27 2buf n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2buf n GLY 251 N 0.00 1.52 0.12 -0.02 0.00 -1.26 -2.58 105.19 102.98 2buf n GLY 251 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2buf n GLY 251 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2buf n MET 252 N 0.22 0.66 -0.12 1.61 0.00 -1.07 -4.05 117.12 114.37 2buf n MET 252 Ca 0.00 0.09 -0.14 0.00 0.00 0.00 0.00 57.70 57.65 2buf n MET 252 Cb 0.31 -1.52 -0.10 0.00 0.00 0.00 0.00 33.22 31.91 2buf n MET 252 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 2buf h LEU 253 N 0.00 -1.83 -1.01 -0.89 5.85 -1.56 0.23 115.31 116.09 2buf h LEU 253 Ca -0.57 0.24 -0.10 0.00 0.84 0.00 0.00 57.88 58.29 2buf h LEU 253 Cb 2.03 0.75 -0.01 0.00 0.37 0.00 0.00 40.66 43.79 2buf h LEU 253 CO -0.05 -0.41 -0.49 1.55 -0.34 0.00 0.00 178.44 178.71 2buf h PRO 254 N -0.42 0.01 -0.58 5.25 0.13 -1.80 -1.95 132.00 132.65 2buf h PRO 254 Ca 0.07 -0.01 0.04 0.00 -0.87 0.00 0.00 66.00 65.23 2buf h PRO 254 Cb 0.60 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.69 2buf h PRO 254 CO -0.57 0.50 0.32 -0.22 -0.23 0.00 0.00 178.00 177.80 2buf h LYS 255 N 0.01 0.61 -0.10 0.86 3.64 -1.45 0.93 116.57 121.08 2buf h LYS 255 Ca -0.00 -0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 59.22 2buf h LYS 255 Cb 0.87 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.54 2buf h LYS 255 CO 0.06 0.40 -0.48 0.82 -2.27 0.00 0.00 179.45 177.99 2buf h ILE 256 N 0.63 1.34 0.00 2.00 5.03 -0.70 -2.15 117.51 123.65 2buf h ILE 256 Ca 0.25 -1.68 -0.01 0.00 -0.12 0.00 0.00 64.86 63.29 2buf h ILE 256 Cb 0.10 1.79 -0.00 0.00 -3.03 0.00 0.00 36.82 35.68 2buf h ILE 256 CO -0.14 0.50 -0.06 0.03 -0.68 0.00 0.00 178.15 177.80 2buf h ARG 257 N 0.19 0.00 -0.07 2.37 3.08 -0.34 -1.88 114.38 117.73 2buf h ARG 257 Ca 0.01 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 2buf h ARG 257 Cb 0.91 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.96 2buf h ARG 257 CO 0.07 0.06 -0.02 0.00 -1.07 0.00 0.00 179.97 179.02 2buf h ALA 259 N 0.66 -0.89 -0.52 0.00 0.00 -1.30 -1.85 119.26 115.37 2buf h ALA 259 Ca 0.02 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.83 2buf h ALA 259 Cb 0.42 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 2buf h ALA 259 CO 0.01 -0.84 -0.31 1.28 0.00 0.00 0.00 179.25 179.39 2buf n LEU 260 N -4.35 -0.55 0.10 0.00 4.77 -0.72 0.12 117.00 116.37 2buf n LEU 260 Ca -0.08 1.09 -0.16 0.00 -0.03 0.00 0.00 56.01 56.82 2buf n LEU 260 Cb 0.26 -0.20 -0.09 0.00 -2.33 0.00 0.00 43.42 41.06 2buf n LEU 260 CO 0.20 -0.83 0.53 -0.33 -1.33 0.00 0.00 177.39 175.63 2buf h GLU 261 N 0.00 -0.70 -0.96 3.23 5.08 -1.61 0.18 114.58 119.80 2buf h GLU 261 Ca 0.08 0.05 0.14 0.00 -1.00 0.00 0.00 59.36 58.63 2buf h GLU 261 Cb 0.21 0.16 -0.15 0.00 0.50 0.00 0.00 28.75 29.47 2buf h GLU 261 CO -0.49 -0.46 -0.39 0.00 -1.00 0.00 0.00 179.01 176.67 2buf n ALA 262 N -2.92 -0.16 0.36 3.43 0.00 0.32 0.28 120.51 121.82 2buf n ALA 262 Ca -0.08 0.95 -0.18 0.00 0.00 0.00 0.00 53.44 54.12 2buf n ALA 262 Cb 0.41 -0.40 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 2buf n ALA 262 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2buf h VAL 263 N 0.00 0.00 -0.01 0.00 2.07 0.11 -0.57 116.25 117.86 2buf h VAL 263 Ca 0.32 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.84 2buf h VAL 263 Cb 0.56 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2buf h VAL 263 CO -0.95 0.00 0.10 1.56 0.02 0.00 0.00 177.57 178.30 2buf h GLN 264 N -1.08 0.00 -0.88 1.57 4.20 0.18 -1.11 115.11 117.99 2buf h GLN 264 Ca -0.09 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.56 2buf h GLN 264 Cb 0.89 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.63 2buf h GLN 264 CO 0.04 0.00 0.09 0.41 -0.67 0.00 0.00 178.83 178.69 2buf n GLY 265 N -1.14 2.41 0.00 3.46 0.00 0.78 -4.90 105.19 105.80 2buf n GLY 265 Ca -0.03 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.59 2buf n GLY 265 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2buf n GLY 266 N 0.12 3.03 3.68 -0.02 0.00 -0.42 -4.63 105.19 106.95 2buf n GLY 266 Ca 0.16 -0.52 -0.47 0.00 0.00 0.00 0.00 46.02 45.19 2buf n GLY 266 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2buf n VAL 267 N 0.00 0.27 -0.18 1.61 0.31 -0.97 -4.83 118.33 114.54 2buf n VAL 267 Ca 0.00 -0.05 -0.07 0.00 -0.01 0.00 0.00 64.34 64.21 2buf n VAL 267 Cb 0.00 -1.72 0.02 0.00 -0.91 0.00 0.00 33.84 31.23 2buf n VAL 267 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 2buf h THR 268 N 4.46 1.15 -2.35 2.52 2.02 -1.50 -3.37 112.91 115.85 2buf h THR 268 Ca -0.47 -0.33 -0.08 0.00 0.77 0.00 0.00 66.41 66.30 2buf h THR 268 Cb 1.26 0.44 -0.21 0.00 -1.74 0.00 0.00 68.15 67.91 2buf h THR 268 CO 0.92 0.15 0.00 -0.94 0.37 0.00 0.00 175.52 176.03 2buf s SER 269 N -5.73 -0.54 -0.06 4.18 1.04 -0.16 -4.50 113.70 107.93 2buf s SER 269 Ca -0.13 0.76 0.05 0.00 0.48 0.00 0.00 55.95 57.11 2buf s SER 269 Cb 0.12 0.74 -0.02 0.00 0.10 0.00 0.00 66.02 66.97 2buf s SER 269 CO 0.75 -0.42 -0.21 0.00 0.98 0.00 0.00 173.24 174.34 2buf s ALA 270 N -0.64 2.33 -0.16 5.32 0.00 0.18 -0.85 121.76 127.95 2buf s ALA 270 Ca -0.07 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 50.87 2buf s ALA 270 Cb -0.03 -0.78 0.02 0.00 0.00 0.00 0.00 23.12 22.33 2buf s ALA 270 CO 0.05 0.45 -0.18 -1.01 0.00 0.00 0.00 175.76 175.07 2buf s HIS 271 N -0.31 2.48 -0.34 0.00 3.76 0.75 -0.10 115.29 121.54 2buf s HIS 271 Ca 0.01 -1.41 -0.11 0.00 -0.15 0.00 0.00 55.06 53.40 2buf s HIS 271 Cb -0.13 -1.75 0.00 0.00 1.11 0.00 0.00 32.58 31.81 2buf s HIS 271 CO 0.02 -0.72 0.19 0.42 -0.85 0.00 0.00 174.74 173.81 2buf s ILE 272 N 1.30 4.76 0.08 0.60 1.01 -0.52 0.59 121.20 129.02 2buf s ILE 272 Ca 0.03 -0.51 0.04 0.00 0.00 0.00 0.00 60.65 60.21 2buf s ILE 272 Cb -0.13 -3.50 -0.03 0.00 0.01 0.00 0.00 42.46 38.81 2buf s ILE 272 CO -0.10 -0.04 -0.11 -0.63 0.00 0.00 0.00 174.94 174.05 2buf s ILE 273 N 1.62 0.92 -0.40 2.92 1.01 -0.40 -2.27 121.20 124.60 2buf s ILE 273 Ca 0.04 -1.42 -0.29 0.00 0.00 0.00 0.00 60.65 58.98 2buf s ILE 273 Cb -0.18 -1.12 0.01 0.00 0.01 0.00 0.00 42.46 41.19 2buf s ILE 273 CO 0.07 -0.41 1.34 -0.62 0.00 0.00 0.00 174.94 175.32 2buf s ASP 274 N -2.04 6.45 -0.08 3.58 -1.08 -1.22 -0.09 116.67 122.19 2buf s ASP 274 Ca -0.00 0.83 0.03 0.00 -0.52 0.00 0.00 52.55 52.89 2buf s ASP 274 Cb -0.07 -2.54 0.20 0.00 -1.46 0.00 0.00 42.92 39.05 2buf s ASP 274 CO 0.01 -1.34 0.98 0.61 0.52 0.00 0.00 175.17 175.95 2buf n GLY 275 N 4.89 2.17 0.13 2.66 0.00 0.12 -3.29 105.19 111.87 2buf n GLY 275 Ca 0.15 -0.26 -0.19 0.00 0.00 0.00 0.00 46.02 45.73 2buf n GLY 275 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2buf n ARG 276 N 0.13 0.67 -1.63 1.61 1.74 -1.26 -4.83 116.66 113.08 2buf n ARG 276 Ca 0.10 0.17 -0.49 0.00 -0.77 0.00 0.00 57.85 56.87 2buf n ARG 276 Cb 0.61 -1.55 -0.05 0.00 -1.02 0.00 0.00 32.46 30.45 2buf n ARG 276 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2buf n VAL 277 N -3.30 0.10 -2.33 1.55 0.31 -1.21 -4.90 118.33 108.55 2buf n VAL 277 Ca -0.43 -0.03 -0.37 0.00 -0.01 0.00 0.00 64.34 63.51 2buf n VAL 277 Cb 1.00 -1.19 -0.02 0.00 -0.91 0.00 0.00 33.84 32.72 2buf n VAL 277 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 2buf s PRO 278 N 0.58 3.80 -1.33 5.55 0.02 -1.26 -2.38 135.00 139.99 2buf s PRO 278 Ca 0.80 1.68 0.00 0.00 0.02 0.00 0.00 61.00 63.50 2buf s PRO 278 Cb -0.80 -2.38 0.00 0.00 0.02 0.00 0.00 34.50 31.34 2buf s PRO 278 CO 0.43 -0.49 0.00 0.09 -0.33 0.00 0.00 177.00 176.70 2buf n ASN 279 N -0.51 -4.46 -0.34 2.53 5.03 -1.26 -4.81 115.26 111.44 2buf n ASN 279 Ca 0.07 0.31 0.11 0.00 0.87 0.00 0.00 54.58 55.95 2buf n ASN 279 Cb 0.49 -3.69 0.30 0.00 -1.02 0.00 0.00 39.78 35.85 2buf n ASN 279 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2buf h ALA 280 N 0.32 1.57 -0.36 5.41 0.00 -1.80 -0.62 119.26 123.77 2buf h ALA 280 Ca -0.26 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 2buf h ALA 280 Cb 1.01 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2buf h ALA 280 CO 0.37 -0.05 -0.12 -0.24 0.00 0.00 0.00 179.25 179.22 2buf h VAL 281 N 0.74 1.25 -0.21 0.00 3.04 -1.87 -2.60 116.25 116.59 2buf h VAL 281 Ca 0.55 -1.10 -0.10 0.00 -1.01 0.00 0.00 66.70 65.04 2buf h VAL 281 Cb 0.83 1.09 -0.01 0.00 -2.01 0.00 0.00 31.29 31.19 2buf h VAL 281 CO -0.38 0.37 -0.32 -0.07 -1.01 0.00 0.00 177.57 176.16 2buf h LEU 282 N 0.58 0.43 -2.11 3.16 3.38 -1.52 -1.98 115.31 117.26 2buf h LEU 282 Ca 0.10 -0.16 0.05 0.00 0.09 0.00 0.00 57.88 57.96 2buf h LEU 282 Cb 0.54 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2buf h LEU 282 CO 0.03 0.73 0.14 -0.07 0.09 0.00 0.00 178.44 179.36 2buf h LEU 283 N 0.36 0.00 -0.30 1.67 3.38 -0.98 -1.03 115.31 118.41 2buf h LEU 283 Ca 0.05 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.81 2buf h LEU 283 Cb 0.74 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.49 2buf h LEU 283 CO 0.06 0.00 -0.81 -0.08 0.09 0.00 0.00 178.44 177.69 2buf h GLU 284 N 0.00 0.42 0.00 1.13 4.57 -1.30 -3.06 114.58 116.33 2buf h GLU 284 Ca 0.08 -0.38 -0.15 0.00 -1.18 0.00 0.00 59.36 57.73 2buf h GLU 284 Cb 0.35 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.01 2buf h GLU 284 CO -0.00 1.03 -1.24 -0.84 -1.18 0.00 0.00 179.01 176.78 2buf h ILE 285 N 0.26 0.53 0.00 2.32 3.07 -1.25 -3.38 117.51 119.07 2buf h ILE 285 Ca -0.05 -1.97 -0.17 0.00 1.55 0.00 0.00 64.86 64.22 2buf h ILE 285 Cb 1.41 2.06 -0.02 0.00 -0.27 0.00 0.00 36.82 40.00 2buf h ILE 285 CO 0.14 0.30 -0.82 -0.26 -1.05 0.00 0.00 178.15 176.46 2buf h PHE 286 N 0.00 0.00 -3.61 0.16 0.05 -1.33 -3.38 116.94 108.83 2buf h PHE 286 Ca -0.13 0.00 -0.68 0.00 3.82 0.00 0.00 57.97 60.98 2buf h PHE 286 Cb 1.52 0.00 -0.28 0.00 2.00 0.00 0.00 35.95 39.19 2buf h PHE 286 CO 0.00 0.82 -0.65 0.99 -0.18 0.00 0.00 178.31 179.30 2buf s THR 287 N -2.85 3.66 0.16 -1.55 2.01 -1.16 -4.78 115.64 111.14 2buf s THR 287 Ca 0.02 -0.89 -0.03 0.00 0.31 0.00 0.00 61.69 61.10 2buf s THR 287 Cb 0.09 -2.93 0.26 0.00 0.01 0.00 0.00 72.50 69.93 2buf s THR 287 CO 0.79 0.04 0.89 -0.67 -0.69 0.00 0.00 174.62 174.98 2buf n ASP 288 N 4.80 -0.16 0.02 3.53 2.03 -1.26 -2.69 116.55 122.81 2buf n ASP 288 Ca -0.14 0.98 -0.01 0.00 0.52 0.00 0.00 54.79 56.13 2buf n ASP 288 Cb 0.47 -0.31 -0.01 0.00 -0.72 0.00 0.00 41.12 40.55 2buf n ASP 288 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2buf h SER 289 N 0.00 -0.13 0.00 1.67 4.64 -1.93 -3.50 113.55 114.30 2buf h SER 289 Ca 0.29 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 2buf h SER 289 Cb 0.50 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 2buf h SER 289 CO -0.57 -0.05 0.00 0.61 -0.87 0.00 0.00 176.83 175.95 2buf n GLY 290 N -1.04 4.10 0.33 -0.77 0.00 -1.09 -4.98 105.19 101.74 2buf n GLY 290 Ca -0.01 -1.09 0.13 0.00 0.00 0.00 0.00 46.02 45.05 2buf n GLY 290 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2buf n VAL 291 N -0.16 0.00 0.00 1.61 0.31 -1.26 -4.90 118.33 113.93 2buf n VAL 291 Ca 0.00 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 2buf n VAL 291 Cb 0.00 0.46 0.00 0.00 -0.91 0.00 0.00 33.84 33.39 2buf n VAL 291 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2buf n GLY 292 N 1.29 2.74 3.25 2.92 0.00 -1.26 -5.05 105.19 109.09 2buf n GLY 292 Ca 0.14 -0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 2buf n GLY 292 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2buf s THR 293 N 2.73 2.78 -0.26 2.61 2.01 -0.96 -4.65 115.64 119.91 2buf s THR 293 Ca 0.00 -0.71 -0.01 0.00 0.31 0.00 0.00 61.69 61.28 2buf s THR 293 Cb 0.00 -2.21 0.03 0.00 0.01 0.00 0.00 72.50 70.34 2buf s THR 293 CO 0.00 0.49 -0.06 -0.22 -0.69 0.00 0.00 174.62 174.15 2buf s LEU 294 N 1.12 3.33 -0.19 4.42 0.20 -1.26 -1.44 118.68 124.86 2buf s LEU 294 Ca 0.01 -0.99 -0.07 0.00 0.69 0.00 0.00 54.13 53.77 2buf s LEU 294 Cb -0.14 -1.66 -0.04 0.00 -0.43 0.00 0.00 46.19 43.92 2buf s LEU 294 CO -0.04 -0.16 0.06 -0.63 -0.29 0.00 0.00 176.35 175.29 2buf s ILE 295 N 1.29 4.64 0.28 6.68 1.01 0.86 -1.55 121.20 134.41 2buf s ILE 295 Ca -0.01 -0.08 -0.21 0.00 0.00 0.00 0.00 60.65 60.34 2buf s ILE 295 Cb -0.17 -3.10 0.03 0.00 0.01 0.00 0.00 42.46 39.22 2buf s ILE 295 CO -0.04 0.44 0.74 -0.94 0.00 0.00 0.00 174.94 175.15 2buf s SER 296 N 0.56 -0.23 0.00 3.58 1.04 -1.23 0.49 113.70 117.92 2buf s SER 296 Ca 0.03 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 55.81 2buf s SER 296 Cb -0.13 0.72 0.00 0.00 0.10 0.00 0.00 66.02 66.71 2buf s SER 296 CO 0.01 -1.35 0.59 -0.46 0.98 0.00 0.00 173.24 173.01 2buf n ASN 297 N -0.55 0.00 0.00 7.02 0.23 -1.26 -4.12 115.26 116.59 2buf n ASN 297 Ca -0.04 -1.33 0.00 0.00 -0.53 0.00 0.00 54.58 52.68 2buf n ASN 297 Cb 0.59 -0.07 0.00 0.00 -2.08 0.00 0.00 39.78 38.23 2buf n ASN 297 CO 0.00 0.00 0.00 -1.14 -0.93 0.00 0.00 177.26 175.19 2buf n ARG 298 N 0.00 0.00 0.00 -3.83 3.00 -1.26 -5.00 116.66 109.57 2buf n ARG 298 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2buf n ARG 298 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.03 2buf n ARG 298 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26