#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2buf s LEU 3 N 0.00 -0.77 1.07 -4.42 2.96 -1.26 -5.17 118.68 111.09 2buf s LEU 3 Ca 0.00 1.07 -0.17 0.00 -0.22 0.00 0.00 54.13 54.81 2buf s LEU 3 Cb 0.00 1.89 0.08 0.00 0.50 0.00 0.00 46.19 48.66 2buf s LEU 3 CO 0.00 -0.15 0.07 -1.54 -1.32 0.00 0.00 176.35 173.41 2buf n SER 4 N 5.06 -2.36 0.03 3.68 3.41 -1.26 -4.90 113.62 117.28 2buf n SER 4 Ca -0.11 0.01 0.13 0.00 -0.26 0.00 0.00 58.87 58.64 2buf n SER 4 Cb 0.52 -1.01 0.34 0.00 -0.26 0.00 0.00 64.21 63.79 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 -1.79 0.12 0.03 4.33 0.00 -1.26 -2.93 116.66 115.16 2buf n ARG 5 Ca 0.02 0.05 -0.05 0.00 -0.00 0.00 0.00 57.85 57.88 2buf n ARG 5 Cb 0.60 -1.60 -0.10 0.00 -0.00 0.00 0.00 32.46 31.36 2buf n ARG 5 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 2buf h ASP 6 N 0.00 0.00 -0.33 2.89 3.32 -2.01 -3.36 116.42 116.93 2buf h ASP 6 Ca 0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 2buf h ASP 6 Cb 0.60 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.08 2buf h ASP 6 CO 0.00 0.84 -0.02 0.47 -1.72 0.00 0.00 179.24 178.81 2buf n ASP 7 N -3.10 3.06 0.00 6.45 8.00 -1.15 -3.60 116.55 126.21 2buf n ASP 7 Ca -0.09 -3.45 0.00 0.00 0.71 0.00 0.00 54.79 51.96 2buf n ASP 7 Cb 0.94 -0.60 0.00 0.00 -0.02 0.00 0.00 41.12 41.43 2buf n ASP 7 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2buf n ALA 8 N -0.90 0.52 -0.15 2.24 0.00 -1.18 -4.12 120.51 116.92 2buf n ALA 8 Ca 0.29 -0.17 0.02 0.00 0.00 0.00 0.00 53.44 53.58 2buf n ALA 8 Cb 0.99 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.50 2buf n ALA 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2buf n ALA 9 N -2.32 0.09 0.37 0.00 0.00 -1.26 -0.31 120.51 117.09 2buf n ALA 9 Ca 0.00 0.47 -0.17 0.00 0.00 0.00 0.00 53.44 53.74 2buf n ALA 9 Cb 0.00 -0.28 -0.09 0.00 0.00 0.00 0.00 19.45 19.09 2buf n ALA 9 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2buf h GLN 10 N 0.00 -1.01 -0.77 0.00 4.15 -1.78 -2.80 115.11 112.89 2buf h GLN 10 Ca 0.20 0.07 0.18 0.00 0.77 0.00 0.00 58.65 59.87 2buf h GLN 10 Cb 0.31 0.23 -0.12 0.00 0.21 0.00 0.00 27.48 28.11 2buf h GLN 10 CO -0.44 -0.68 0.14 0.28 -1.93 0.00 0.00 178.83 176.20 2buf h VAL 11 N -1.05 0.43 -0.90 2.39 2.07 -0.82 -1.78 116.25 116.59 2buf h VAL 11 Ca -0.09 -0.07 0.06 0.00 0.82 0.00 0.00 66.70 67.41 2buf h VAL 11 Cb 0.85 0.20 -0.06 0.00 -1.52 0.00 0.00 31.29 30.76 2buf h VAL 11 CO 0.09 0.04 0.57 0.00 0.02 0.00 0.00 177.57 178.28 2buf h ALA 12 N 1.67 1.23 -0.00 1.67 0.00 -1.37 -1.84 119.26 120.62 2buf h ALA 12 Ca 0.44 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 55.17 2buf h ALA 12 Cb 0.79 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2buf h ALA 12 CO -0.58 0.35 -0.78 -0.22 0.00 0.00 0.00 179.25 178.02 2buf h LYS 13 N 1.05 0.01 0.00 0.00 3.64 -1.09 -0.50 116.57 119.68 2buf h LYS 13 Ca 0.38 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 2buf h LYS 13 Cb 0.14 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2buf h LYS 13 CO -0.16 0.78 0.00 0.28 -2.27 0.00 0.00 179.45 178.08 2buf n VAL 14 N -3.62 0.00 -0.31 2.00 0.31 -0.75 -3.34 118.33 112.62 2buf n VAL 14 Ca -0.01 1.44 0.07 0.00 -0.01 0.00 0.00 64.34 65.83 2buf n VAL 14 Cb 0.75 -2.44 0.22 0.00 -0.91 0.00 0.00 33.84 31.46 2buf n VAL 14 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2buf h LEU 15 N 0.00 0.66 -1.27 7.52 3.38 -1.43 0.26 115.31 124.42 2buf h LEU 15 Ca 0.00 0.07 0.16 0.00 0.09 0.00 0.00 57.88 58.21 2buf h LEU 15 Cb 0.00 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 40.63 2buf h LEU 15 CO 0.00 0.31 0.59 -1.28 0.09 0.00 0.00 178.44 178.15 2buf h SER 16 N 0.74 0.64 0.00 -0.43 0.87 -1.14 0.29 113.55 114.51 2buf h SER 16 Ca 0.46 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 61.08 2buf h SER 16 Cb 0.58 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 2buf h SER 16 CO -0.32 0.29 -0.92 -0.62 -0.53 0.00 0.00 176.83 174.73 2buf n GLU 17 N -4.59 1.29 -0.13 2.24 1.02 -0.99 -4.15 120.64 115.33 2buf n GLU 17 Ca 0.19 -0.02 0.10 0.00 -0.02 0.00 0.00 57.16 57.41 2buf n GLU 17 Cb 0.54 -1.32 0.30 0.00 -0.02 0.00 0.00 31.44 30.94 2buf n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2buf n ALA 18 N -1.49 2.48 0.05 0.62 0.00 0.87 -4.37 120.51 118.67 2buf n ALA 18 Ca 0.02 -0.68 -0.03 0.00 0.00 0.00 0.00 53.44 52.75 2buf n ALA 18 Cb 0.29 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.71 2buf n ALA 18 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2buf h LEU 19 N 2.86 -0.19 -0.43 0.00 5.85 -0.65 -3.19 115.31 119.56 2buf h LEU 19 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2buf h LEU 19 Cb 0.63 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.71 2buf h LEU 19 CO 0.00 0.26 0.82 -0.65 -0.34 0.00 0.00 178.44 178.53 2buf h PRO 20 N -1.01 0.00 0.01 5.25 0.11 -1.85 1.67 132.00 136.18 2buf h PRO 20 Ca -0.02 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.80 2buf h PRO 20 Cb 0.17 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.24 2buf h PRO 20 CO 0.04 0.00 -1.64 1.88 -0.21 0.00 0.00 178.00 178.06 2buf h TYR 21 N 0.00 0.04 0.00 0.65 0.99 -1.84 -3.34 116.97 113.48 2buf h TYR 21 Ca 0.00 -0.03 -0.12 0.00 2.00 0.00 0.00 58.73 60.58 2buf h TYR 21 Cb 1.64 -0.00 -0.02 0.00 1.00 0.00 0.00 36.73 39.35 2buf h TYR 21 CO 0.00 1.06 -0.75 0.82 -0.00 0.00 0.00 178.16 179.29 2buf h ILE 22 N 0.01 0.79 0.00 -2.88 2.04 0.24 -3.31 117.51 114.39 2buf h ILE 22 Ca -0.26 -2.19 0.00 0.00 1.00 0.00 0.00 64.86 63.41 2buf h ILE 22 Cb 1.99 2.33 0.00 0.00 -0.74 0.00 0.00 36.82 40.40 2buf h ILE 22 CO 0.09 0.45 0.00 0.54 0.00 0.00 0.00 178.15 179.23 2buf n ARG 23 N -3.14 0.32 -0.56 2.37 1.74 0.23 -2.64 116.66 114.98 2buf n ARG 23 Ca -0.01 0.09 0.03 0.00 -0.77 0.00 0.00 57.85 57.19 2buf n ARG 23 Cb 0.77 -1.50 0.20 0.00 -1.02 0.00 0.00 32.46 30.91 2buf n ARG 23 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2buf n ARG 24 N -1.21 1.88 0.00 5.56 1.85 -1.25 -4.41 116.66 119.08 2buf n ARG 24 Ca 0.09 -3.04 0.00 0.00 -1.00 0.00 0.00 57.85 53.90 2buf n ARG 24 Cb 0.12 -1.72 0.00 0.00 -1.05 0.00 0.00 32.46 29.81 2buf n ARG 24 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2buf n PHE 25 N -1.07 0.00 -1.89 2.89 3.01 -1.08 -4.95 117.46 114.37 2buf n PHE 25 Ca 0.25 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.29 2buf n PHE 25 Cb 0.86 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 40.31 2buf n PHE 25 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 2buf s VAL 26 N 0.00 2.37 0.00 -4.37 -7.23 -1.19 -1.85 120.40 108.13 2buf s VAL 26 Ca 0.00 0.30 0.00 0.00 -1.81 0.00 0.00 61.98 60.47 2buf s VAL 26 Cb 0.00 -3.19 0.00 0.00 0.56 0.00 0.00 36.38 33.75 2buf s VAL 26 CO 0.00 0.05 0.00 0.61 -0.31 0.00 0.00 175.10 175.45 2buf n GLY 27 N 2.40 1.51 3.70 2.32 0.00 -0.80 -4.98 105.19 109.34 2buf n GLY 27 Ca 0.08 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 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 0.00 1.64 -0.07 1.61 3.01 -0.77 -4.77 119.74 120.39 2buf s LYS 28 Ca 0.00 1.74 0.04 0.00 -1.01 0.00 0.00 55.97 56.74 2buf s LYS 28 Cb 0.00 -1.78 -0.02 0.00 -1.01 0.00 0.00 37.83 35.02 2buf s LYS 28 CO 0.00 -2.21 -0.18 0.99 0.51 0.00 0.00 175.35 174.47 2buf s THR 29 N -2.17 2.74 -0.21 2.17 2.01 -1.26 -2.07 115.64 116.85 2buf s THR 29 Ca 0.73 -0.82 0.01 0.00 0.31 0.00 0.00 61.69 61.91 2buf s THR 29 Cb -0.28 -2.07 0.03 0.00 0.01 0.00 0.00 72.50 70.19 2buf s THR 29 CO 0.51 0.57 -0.16 -0.76 -0.69 0.00 0.00 174.62 174.09 2buf s LEU 30 N -0.33 2.59 -0.38 4.42 1.43 0.81 -2.42 118.68 124.79 2buf s LEU 30 Ca 0.02 -0.84 -0.24 0.00 -1.03 0.00 0.00 54.13 52.05 2buf s LEU 30 Cb -0.13 -1.53 0.01 0.00 0.03 0.00 0.00 46.19 44.58 2buf s LEU 30 CO 0.02 -0.06 0.83 -0.69 0.23 0.00 0.00 176.35 176.69 2buf s VAL 31 N 1.26 4.67 -0.19 -1.59 1.01 -1.02 -0.92 120.40 123.63 2buf s VAL 31 Ca 0.01 0.92 -0.05 0.00 0.00 0.00 0.00 61.98 62.87 2buf s VAL 31 Cb -0.15 -4.27 -0.02 0.00 0.00 0.00 0.00 36.38 31.94 2buf s VAL 31 CO -0.10 -0.51 -0.01 -0.63 0.00 0.00 0.00 175.10 173.85 2buf s ILE 32 N 3.26 3.91 -0.45 2.22 1.01 0.60 -0.76 121.20 130.99 2buf s ILE 32 Ca 0.33 -0.34 -0.17 0.00 0.00 0.00 0.00 60.65 60.48 2buf s ILE 32 Cb -0.13 -2.75 0.04 0.00 0.01 0.00 0.00 42.46 39.64 2buf s ILE 32 CO 0.18 0.45 0.45 -0.75 0.00 0.00 0.00 174.94 175.27 2buf s LYS 33 N 0.83 3.05 -0.33 2.79 2.36 0.05 -0.05 119.74 128.44 2buf s LYS 33 Ca 0.00 -0.99 -0.28 0.00 -2.55 0.00 0.00 55.97 52.15 2buf s LYS 33 Cb -0.14 -4.04 0.02 0.00 -1.05 0.00 0.00 37.83 32.61 2buf s LYS 33 CO 0.02 -0.97 1.05 -0.47 1.55 0.00 0.00 175.35 176.53 2buf s TYR 34 N 2.04 3.14 0.10 4.03 5.04 0.24 -2.16 117.35 129.77 2buf s TYR 34 Ca 0.09 1.12 -0.04 0.00 -2.44 0.00 0.00 57.07 55.81 2buf s TYR 34 Cb -0.20 -3.69 0.01 0.00 0.35 0.00 0.00 41.96 38.44 2buf s TYR 34 CO 0.11 -0.78 0.20 0.41 -1.34 0.00 0.00 175.55 174.15 2buf n GLY 35 N 3.97 1.82 2.84 8.97 0.00 -1.25 -3.81 105.19 117.73 2buf n GLY 35 Ca 0.11 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.14 0.40 0.37 -0.02 0.00 -1.26 -4.40 105.19 100.15 2buf n GLY 36 Ca -0.02 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.13 2buf n GLY 36 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2buf h ASN 37 N 0.00 0.55 0.00 1.61 -1.07 -1.89 -3.42 115.58 111.36 2buf h ASN 37 Ca 0.00 0.03 0.00 0.00 0.07 0.00 0.00 56.30 56.40 2buf h ASN 37 Cb 0.26 -0.08 0.00 0.00 -2.07 0.00 0.00 38.32 36.43 2buf h ASN 37 CO 0.00 0.28 0.00 0.00 0.07 0.00 0.00 177.43 177.78 2buf n ALA 38 N -2.47 0.00 0.58 4.14 0.00 -1.26 -0.08 120.51 121.42 2buf n ALA 38 Ca 0.16 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.63 2buf n ALA 38 Cb 0.48 0.00 0.21 0.00 0.00 0.00 0.00 19.45 20.14 2buf n ALA 38 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2buf n MET 39 N 0.00 0.29 -3.77 0.00 2.81 -1.26 -4.76 117.12 110.43 2buf n MET 39 Ca 0.00 0.00 -0.24 0.00 -1.81 0.00 0.00 57.70 55.65 2buf n MET 39 Cb 0.00 -1.39 0.02 0.00 -0.71 0.00 0.00 33.22 31.14 2buf n MET 39 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 2buf n GLU 40 N -0.89 -3.71 0.00 0.03 4.07 0.89 -4.95 120.64 116.08 2buf n GLU 40 Ca 0.05 0.53 0.00 0.00 -0.06 0.00 0.00 57.16 57.68 2buf n GLU 40 Cb 0.02 -4.82 0.00 0.00 -0.06 0.00 0.00 31.44 26.59 2buf n GLU 40 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 2buf n SER 41 N -2.98 -0.15 0.00 4.31 2.88 -1.21 -5.02 113.62 111.44 2buf n SER 41 Ca -0.27 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.21 2buf n SER 41 Cb 0.67 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.13 2buf n SER 41 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2buf n GLU 42 N -0.22 1.73 -0.08 -1.46 -0.58 -1.26 -4.71 120.64 114.06 2buf n GLU 42 Ca 0.00 0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.60 2buf n GLU 42 Cb 0.00 -0.64 -0.05 0.00 -0.57 0.00 0.00 31.44 30.18 2buf n GLU 42 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 2buf h GLU 43 N 0.00 0.70 0.00 3.49 4.81 -1.99 -2.12 114.58 119.47 2buf h GLU 43 Ca 0.00 -0.41 -0.04 0.00 -0.13 0.00 0.00 59.36 58.78 2buf h GLU 43 Cb 0.22 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 2buf h GLU 43 CO 0.00 1.03 -0.19 -0.07 -0.73 0.00 0.00 179.01 179.05 2buf h LEU 44 N 0.42 0.00 0.38 1.64 3.38 -1.89 0.31 115.31 119.55 2buf h LEU 44 Ca 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2buf h LEU 44 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 2buf h LEU 44 CO 0.09 0.19 -0.18 0.11 0.09 0.00 0.00 178.44 178.73 2buf h LYS 45 N 0.00 -0.50 0.20 1.13 1.57 -1.79 -2.58 116.57 114.61 2buf h LYS 45 Ca -0.00 0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 2buf h LYS 45 Cb 0.73 0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.12 2buf h LYS 45 CO 0.02 -0.19 -0.46 0.00 -0.57 0.00 0.00 179.45 178.26 2buf h ALA 46 N -0.68 -0.87 -0.91 3.86 0.00 -1.25 -0.39 119.26 119.01 2buf h ALA 46 Ca -0.05 -0.11 0.26 0.00 0.00 0.00 0.00 54.91 55.01 2buf h ALA 46 Cb 0.53 0.74 -0.16 0.00 0.00 0.00 0.00 17.79 18.91 2buf h ALA 46 CO 0.09 -1.05 0.18 0.78 0.00 0.00 0.00 179.25 179.24 2buf h GLY 47 N -0.75 1.36 0.33 0.00 0.00 -1.01 0.40 103.07 103.41 2buf h GLY 47 Ca -0.00 0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 2buf h GLY 47 CO -0.21 -0.44 -0.16 -2.75 0.00 0.00 0.00 176.54 172.98 2buf h PHE 48 N 0.12 -0.41 -0.99 5.60 3.57 -0.99 -0.58 116.94 123.26 2buf h PHE 48 Ca 0.58 -0.01 0.36 0.00 3.53 0.00 0.00 57.97 62.43 2buf h PHE 48 Cb 1.21 0.13 -0.18 0.00 2.79 0.00 0.00 35.95 39.91 2buf h PHE 48 CO -0.33 -0.25 0.39 0.00 -2.23 0.00 0.00 178.31 175.89 2buf h ALA 49 N -1.64 1.82 0.00 2.41 0.00 -0.15 0.88 119.26 122.58 2buf h ALA 49 Ca -0.04 0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.98 2buf h ALA 49 Cb 0.34 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2buf h ALA 49 CO 0.07 -0.78 -0.76 0.00 0.00 0.00 0.00 179.25 177.79 2buf h ARG 50 N 0.05 0.00 -0.25 0.00 3.08 -0.21 -2.84 114.38 114.21 2buf h ARG 50 Ca 0.75 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.65 2buf h ARG 50 Cb 1.84 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.89 2buf h ARG 50 CO -0.79 0.76 -0.43 -0.44 -1.07 0.00 0.00 179.97 178.00 2buf h ASP 51 N 0.00 0.80 0.33 7.04 5.19 0.24 -2.69 116.42 127.33 2buf h ASP 51 Ca -0.01 -0.53 0.00 0.00 -0.62 0.00 0.00 57.03 55.87 2buf h ASP 51 Cb 1.34 -0.23 -0.03 0.00 0.18 0.00 0.00 39.33 40.59 2buf h ASP 51 CO 0.10 1.18 -0.40 0.58 -3.12 0.00 0.00 179.24 177.58 2buf h VAL 52 N 0.45 0.20 -0.92 -1.35 2.07 -1.23 -1.17 116.25 114.30 2buf h VAL 52 Ca 0.02 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.75 2buf h VAL 52 Cb 1.03 0.20 -0.12 0.00 -1.52 0.00 0.00 31.29 30.88 2buf h VAL 52 CO 0.10 0.00 0.47 0.58 0.02 0.00 0.00 177.57 178.73 2buf h VAL 53 N -0.77 0.54 -0.66 2.57 2.07 -1.53 0.23 116.25 118.70 2buf h VAL 53 Ca -0.02 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 67.29 2buf h VAL 53 Cb 0.71 -0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 2buf h VAL 53 CO -0.10 0.09 0.27 0.25 0.02 0.00 0.00 177.57 178.10 2buf h LEU 54 N 0.50 0.88 -1.23 2.57 5.85 -1.02 0.11 115.31 122.97 2buf h LEU 54 Ca 0.57 -0.12 -0.07 0.00 0.84 0.00 0.00 57.88 59.10 2buf h LEU 54 Cb 1.03 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.83 2buf h LEU 54 CO -0.48 0.78 -0.32 0.24 -0.34 0.00 0.00 178.44 178.33 2buf h MET 55 N 0.95 0.00 0.01 1.25 2.86 0.61 -0.49 114.93 120.11 2buf h MET 55 Ca 0.22 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.73 2buf h MET 55 Cb 0.17 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.84 2buf h MET 55 CO -0.02 0.32 -0.54 -0.22 1.06 0.00 0.00 176.91 177.51 2buf h LYS 56 N 0.00 0.35 -0.03 1.72 1.63 0.10 2.05 116.57 122.39 2buf h LYS 56 Ca -0.00 -0.39 -0.00 0.00 -0.85 0.00 0.00 60.65 59.41 2buf h LYS 56 Cb 0.71 0.11 -0.00 0.00 -0.60 0.00 0.00 32.23 32.46 2buf h LYS 56 CO 0.04 1.07 0.01 0.00 -3.45 0.00 0.00 179.45 177.12 2buf h ALA 57 N 0.29 0.04 0.00 5.00 0.00 -0.70 -3.02 119.26 120.86 2buf h ALA 57 Ca -0.07 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2buf h ALA 57 Cb 1.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2buf h ALA 57 CO 0.11 -0.34 0.00 0.28 0.00 0.00 0.00 179.25 179.30 2buf n VAL 58 N -4.95 1.08 0.00 0.00 0.31 -0.21 -4.88 118.33 109.69 2buf n VAL 58 Ca -0.07 0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.53 2buf n VAL 58 Cb 0.14 -1.08 0.00 0.00 -0.91 0.00 0.00 33.84 31.99 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 -0.33 0.69 3.88 2.92 0.00 -1.04 -4.86 105.19 106.44 2buf n GLY 59 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.00 4.89 -0.46 -0.61 1.01 0.69 -1.90 121.20 122.83 2buf s ILE 60 Ca 0.00 0.47 -0.03 0.00 0.00 0.00 0.00 60.65 61.09 2buf s ILE 60 Cb 0.00 -3.66 0.12 0.00 0.01 0.00 0.00 42.46 38.93 2buf s ILE 60 CO 0.00 -0.21 0.26 0.20 0.00 0.00 0.00 174.94 175.19 2buf s ASN 61 N -2.64 5.30 -0.11 3.58 0.01 -0.88 -3.34 114.94 116.86 2buf s ASN 61 Ca 0.48 -2.18 -0.22 0.00 -0.71 0.00 0.00 52.86 50.24 2buf s ASN 61 Cb -0.11 -1.85 -0.03 0.00 0.41 0.00 0.00 41.25 39.67 2buf s ASN 61 CO 0.24 -0.53 0.64 -2.16 -1.51 0.00 0.00 177.10 173.78 2buf s PRO 62 N 0.94 4.37 -0.14 -0.60 0.04 -1.26 -0.14 135.00 138.21 2buf s PRO 62 Ca 0.10 0.73 -0.01 0.00 0.04 0.00 0.00 61.00 61.86 2buf s PRO 62 Cb -0.23 -3.47 -0.02 0.00 0.04 0.00 0.00 34.50 30.83 2buf s PRO 62 CO -0.04 0.02 -0.12 0.08 0.04 0.00 0.00 177.00 176.98 2buf s VAL 63 N 1.01 3.11 -0.09 -0.36 1.01 -0.09 -4.49 120.40 120.49 2buf s VAL 63 Ca 0.33 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.66 2buf s VAL 63 Cb -0.17 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 2buf s VAL 63 CO 0.15 0.52 -0.03 -0.69 0.00 0.00 0.00 175.10 175.04 2buf s VAL 64 N 0.40 4.00 -0.05 2.92 1.01 -0.15 -0.29 120.40 128.25 2buf s VAL 64 Ca -0.10 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 61.53 2buf s VAL 64 Cb -0.16 -2.67 0.02 0.00 0.00 0.00 0.00 36.38 33.57 2buf s VAL 64 CO 0.05 0.58 -0.04 -0.69 0.00 0.00 0.00 175.10 175.00 2buf s VAL 65 N -0.65 0.52 0.44 2.92 1.01 0.92 0.15 120.40 125.71 2buf s VAL 65 Ca 0.10 -0.10 0.06 0.00 0.00 0.00 0.00 61.98 62.04 2buf s VAL 65 Cb -0.12 -0.56 -0.06 0.00 0.00 0.00 0.00 36.38 35.65 2buf s VAL 65 CO 0.02 0.23 0.05 -1.38 0.00 0.00 0.00 175.10 174.02 2buf s HIS 66 N 1.00 2.36 0.34 5.22 -3.43 -1.14 -0.59 115.29 119.04 2buf s HIS 66 Ca -0.10 -0.73 0.09 0.00 -0.80 0.00 0.00 55.06 53.53 2buf s HIS 66 Cb -0.14 -1.78 -0.06 0.00 -1.43 0.00 0.00 32.58 29.17 2buf s HIS 66 CO -0.00 0.32 -0.06 0.20 -2.00 0.00 0.00 174.74 173.19 2buf s GLY 67 N -3.80 2.12 0.00 -1.38 0.00 -1.25 -4.33 107.32 98.68 2buf s GLY 67 Ca 0.29 -2.03 0.00 0.00 0.00 0.00 0.00 44.72 42.99 2buf s GLY 67 CO 0.16 -1.98 0.00 0.61 0.00 0.00 0.00 173.10 171.89 2buf n GLY 68 N -0.84 0.10 7.00 0.20 0.00 -1.26 -5.00 105.19 105.39 2buf n GLY 68 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 2.82 1.40 0.00 -0.02 0.00 -1.26 -4.36 105.19 103.77 2buf n GLY 69 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2buf n GLY 69 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2buf n PRO 70 N 0.00 0.00 -0.33 1.61 -0.05 -1.26 -2.64 135.00 132.33 2buf n PRO 70 Ca 0.00 0.56 0.17 0.00 -0.05 0.00 0.00 63.50 64.18 2buf n PRO 70 Cb 0.00 -1.31 0.33 0.00 -0.05 0.00 0.00 33.50 32.47 2buf n PRO 70 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 175.50 177.41 2buf h GLN 71 N 0.00 0.06 -0.82 0.54 7.50 -1.99 0.68 115.11 121.08 2buf h GLN 71 Ca 0.00 -0.00 0.04 0.00 0.50 0.00 0.00 58.65 59.18 2buf h GLN 71 Cb 0.00 -0.01 -0.05 0.00 0.05 0.00 0.00 27.48 27.47 2buf h GLN 71 CO 0.00 0.04 0.54 0.82 -1.50 0.00 0.00 178.83 178.73 2buf h ILE 72 N 0.06 1.13 0.01 2.54 2.04 -1.82 -1.67 117.51 119.79 2buf h ILE 72 Ca 0.62 -0.35 -0.21 0.00 1.00 0.00 0.00 64.86 65.93 2buf h ILE 72 Cb 1.35 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 2buf h ILE 72 CO -0.83 0.18 -0.90 1.23 0.00 0.00 0.00 178.15 177.83 2buf h GLY 73 N 1.01 0.28 0.97 5.37 0.00 0.57 -1.97 103.07 109.29 2buf h GLY 73 Ca 0.33 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 2buf h GLY 73 CO -0.10 0.45 0.20 -1.80 0.00 0.00 0.00 176.54 175.28 2buf h ASP 74 N 0.14 0.43 -0.03 0.19 1.82 -0.67 0.31 116.42 118.62 2buf h ASP 74 Ca -0.06 -0.08 -0.01 0.00 -0.39 0.00 0.00 57.03 56.50 2buf h ASP 74 Cb 1.54 -0.11 -0.00 0.00 0.68 0.00 0.00 39.33 41.44 2buf h ASP 74 CO 0.14 0.38 -0.02 0.25 -1.61 0.00 0.00 179.24 178.39 2buf h LEU 75 N 0.44 0.07 -0.73 2.28 5.85 -1.38 -2.04 115.31 119.79 2buf h LEU 75 Ca 0.12 -0.42 0.15 0.00 0.84 0.00 0.00 57.88 58.57 2buf h LEU 75 Cb 0.05 -0.02 -0.14 0.00 0.37 0.00 0.00 40.66 40.92 2buf h LEU 75 CO -0.02 0.48 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.29 2buf h LEU 76 N -0.34 -0.72 0.82 2.25 3.38 -1.12 -0.54 115.31 119.04 2buf h LEU 76 Ca 0.01 0.22 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 2buf h LEU 76 Cb 0.45 0.47 0.01 0.00 0.09 0.00 0.00 40.66 41.68 2buf h LEU 76 CO 0.00 -0.25 -0.39 0.50 0.09 0.00 0.00 178.44 178.39 2buf h LYS 77 N -0.01 -1.06 -1.19 1.13 3.64 -0.29 0.24 116.57 119.03 2buf h LYS 77 Ca 0.35 0.07 0.35 0.00 -1.27 0.00 0.00 60.65 60.15 2buf h LYS 77 Cb 0.54 0.24 -0.10 0.00 -0.41 0.00 0.00 32.23 32.50 2buf h LYS 77 CO -0.76 -0.70 0.78 0.00 -2.27 0.00 0.00 179.45 176.50 2buf h ARG 78 N -1.14 0.21 0.00 1.90 3.08 -0.66 0.34 114.38 118.11 2buf h ARG 78 Ca -0.11 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.92 2buf h ARG 78 Cb 0.85 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.85 2buf h ARG 78 CO 0.19 0.14 -0.55 1.28 -1.07 0.00 0.00 179.97 179.96 2buf n LEU 79 N -4.57 0.55 -1.71 3.04 4.77 -0.28 -4.97 117.00 113.84 2buf n LEU 79 Ca 0.30 0.11 -0.04 0.00 -0.03 0.00 0.00 56.01 56.34 2buf n LEU 79 Cb 1.16 -0.23 0.02 0.00 -2.33 0.00 0.00 43.42 42.04 2buf n LEU 79 CO 0.26 0.05 0.03 -1.20 -1.33 0.00 0.00 177.39 175.20 2buf n SER 80 N -1.74 -2.24 -4.37 -1.43 7.64 0.12 -5.05 113.62 106.55 2buf n SER 80 Ca 0.05 -0.17 -0.34 0.00 1.01 0.00 0.00 58.87 59.42 2buf n SER 80 Cb 0.38 -1.74 -0.14 0.00 -1.01 0.00 0.00 64.21 61.69 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 -3.10 3.31 0.00 0.44 -1.09 0.69 -5.02 121.20 116.43 2buf s ILE 81 Ca 0.02 -0.55 0.00 0.00 -2.23 0.00 0.00 60.65 57.90 2buf s ILE 81 Cb -0.00 -2.45 0.00 0.00 -1.58 0.00 0.00 42.46 38.43 2buf s ILE 81 CO 0.20 0.48 0.81 -1.84 -1.23 0.00 0.00 174.94 173.35 2buf n GLU 82 N 4.03 0.00 -1.93 2.79 0.28 -1.26 -4.22 120.64 120.32 2buf n GLU 82 Ca -0.18 0.81 -0.00 0.00 -0.16 0.00 0.00 57.16 57.62 2buf n GLU 82 Cb 0.52 -1.25 -0.00 0.00 1.43 0.00 0.00 31.44 32.14 2buf n GLU 82 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2buf n SER 83 N -2.51 -7.11 -3.66 -1.84 2.88 -1.26 -4.99 113.62 95.12 2buf n SER 83 Ca 0.00 1.28 -0.12 0.00 -1.33 0.00 0.00 58.87 58.70 2buf n SER 83 Cb 0.00 -3.90 -0.08 0.00 -0.75 0.00 0.00 64.21 59.48 2buf n SER 83 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 2buf s HIS 84 N -0.41 -0.76 0.20 0.66 -3.43 -1.26 -5.12 115.29 105.17 2buf s HIS 84 Ca -0.00 1.73 0.04 0.00 -0.80 0.00 0.00 55.06 56.03 2buf s HIS 84 Cb 0.00 0.32 -0.03 0.00 -1.43 0.00 0.00 32.58 31.44 2buf s HIS 84 CO 0.01 -0.37 0.30 -0.06 -2.00 0.00 0.00 174.74 172.62 2buf s PHE 85 N 0.72 3.40 -0.19 0.38 2.99 -1.26 -2.21 117.98 121.80 2buf s PHE 85 Ca -0.03 0.02 -0.08 0.00 0.00 0.00 0.00 56.93 56.83 2buf s PHE 85 Cb -0.05 -1.58 0.08 0.00 0.00 0.00 0.00 43.02 41.47 2buf s PHE 85 CO -0.05 0.48 0.43 0.42 -0.00 0.00 0.00 175.22 176.50 2buf s ILE 86 N -1.90 -0.40 -1.16 0.64 1.01 -0.39 -4.92 121.20 114.09 2buf s ILE 86 Ca 0.34 0.13 -0.07 0.00 0.00 0.00 0.00 60.65 61.04 2buf s ILE 86 Cb -0.10 -0.67 0.06 0.00 0.01 0.00 0.00 42.46 41.76 2buf s ILE 86 CO 0.28 0.05 0.36 -0.67 0.00 0.00 0.00 174.94 174.96 2buf n ASP 87 N 4.93 -3.47 0.00 3.58 -0.08 -1.26 -0.93 116.55 119.32 2buf n ASP 87 Ca -0.15 -0.24 0.00 0.00 -1.51 0.00 0.00 54.79 52.90 2buf n ASP 87 Cb 0.52 -2.90 0.00 0.00 2.34 0.00 0.00 41.12 41.08 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 -1.05 3.06 3.99 0.27 0.00 -1.26 -4.79 105.19 105.41 2buf n GLY 88 Ca -0.03 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.19 3.07 -0.21 1.61 -1.94 -0.10 -4.65 119.30 116.89 2buf s MET 89 Ca 0.00 -1.05 -0.12 0.00 -1.71 0.00 0.00 55.69 52.81 2buf s MET 89 Cb 0.00 -2.80 -0.05 0.00 2.01 0.00 0.00 34.83 33.99 2buf s MET 89 CO 0.00 0.02 0.20 0.50 -0.01 0.00 0.00 175.02 175.74 2buf s ARG 90 N -4.19 4.15 0.15 2.03 3.52 -1.26 -1.26 118.95 122.09 2buf s ARG 90 Ca 0.46 -0.13 -0.31 0.00 -0.13 0.00 0.00 55.73 55.62 2buf s ARG 90 Cb -0.09 -3.48 -0.10 0.00 -1.56 0.00 0.00 34.95 29.71 2buf s ARG 90 CO 0.31 0.15 1.67 0.08 -0.81 0.00 0.00 175.30 176.70 2buf s VAL 91 N 0.78 2.54 -0.25 7.11 1.01 -0.94 -4.83 120.40 125.83 2buf s VAL 91 Ca 0.11 0.28 0.01 0.00 0.00 0.00 0.00 61.98 62.37 2buf s VAL 91 Cb -0.13 -3.18 0.07 0.00 0.00 0.00 0.00 36.38 33.14 2buf s VAL 91 CO 0.03 0.01 -0.03 -0.89 0.00 0.00 0.00 175.10 174.22 2buf s THR 92 N 1.74 1.51 0.32 3.92 2.01 -0.66 -4.75 115.64 119.73 2buf s THR 92 Ca 0.74 -1.30 0.06 0.00 0.31 0.00 0.00 61.69 61.51 2buf s THR 92 Cb -0.45 -1.83 -0.01 0.00 0.01 0.00 0.00 72.50 70.22 2buf s THR 92 CO 0.33 -0.18 0.44 -1.81 -0.69 0.00 0.00 174.62 172.71 2buf s ASP 93 N 1.39 6.01 0.06 3.53 1.11 -1.26 -2.15 116.67 125.36 2buf s ASP 93 Ca -0.04 -0.15 -0.11 0.00 0.18 0.00 0.00 52.55 52.44 2buf s ASP 93 Cb -0.19 -1.34 -0.02 0.00 1.07 0.00 0.00 42.92 42.43 2buf s ASP 93 CO -0.08 -0.36 0.80 0.00 1.18 0.00 0.00 175.17 176.72 2buf n ALA 94 N -1.58 -0.23 0.16 5.23 0.00 -1.26 -0.25 120.51 122.59 2buf n ALA 94 Ca -0.02 0.30 0.06 0.00 0.00 0.00 0.00 53.44 53.78 2buf n ALA 94 Cb 0.58 0.08 0.55 0.00 0.00 0.00 0.00 19.45 20.65 2buf n ALA 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2buf h ALA 95 N -0.08 1.85 -0.41 0.00 0.00 -2.03 -2.98 119.26 115.61 2buf h ALA 95 Ca 0.06 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 2buf h ALA 95 Cb 0.14 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2buf h ALA 95 CO -0.33 0.13 -0.13 1.15 0.00 0.00 0.00 179.25 180.07 2buf h THR 96 N 0.20 1.28 -0.15 0.00 2.02 -0.99 -3.24 112.91 112.03 2buf h THR 96 Ca 0.05 -1.24 0.04 0.00 0.77 0.00 0.00 66.41 66.03 2buf h THR 96 Cb 0.02 1.22 -0.07 0.00 -1.74 0.00 0.00 68.15 67.58 2buf h THR 96 CO -0.01 0.42 -0.47 -0.03 0.37 0.00 0.00 175.52 175.80 2buf h MET 97 N 0.64 -0.50 -0.08 6.66 4.05 -1.21 -2.96 114.93 121.52 2buf h MET 97 Ca 0.10 0.03 0.01 0.00 -0.28 0.00 0.00 59.70 59.56 2buf h MET 97 Cb 0.67 0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 31.57 2buf h MET 97 CO 0.05 -0.33 -0.04 -0.25 0.23 0.00 0.00 176.91 176.56 2buf n ASP 98 N -5.44 -0.08 -0.14 1.39 8.00 -1.22 -0.47 116.55 118.59 2buf n ASP 98 Ca -0.05 0.49 -0.08 0.00 0.71 0.00 0.00 54.79 55.87 2buf n ASP 98 Cb 0.37 -0.20 -0.02 0.00 -0.02 0.00 0.00 41.12 41.25 2buf n ASP 98 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2buf h VAL 99 N 0.00 0.16 -0.03 2.53 2.07 -1.66 -1.32 116.25 118.00 2buf h VAL 99 Ca 0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 2buf h VAL 99 Cb 0.03 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 29.96 2buf h VAL 99 CO -0.07 0.00 -0.03 0.58 0.02 0.00 0.00 177.57 178.07 2buf h VAL 100 N -0.27 0.00 -1.20 2.57 2.07 -0.76 0.21 116.25 118.87 2buf h VAL 100 Ca 0.17 0.00 0.35 0.00 0.82 0.00 0.00 66.70 68.04 2buf h VAL 100 Cb 0.56 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.23 2buf h VAL 100 CO -0.58 0.00 0.79 -0.08 0.02 0.00 0.00 177.57 177.71 2buf h GLU 101 N -0.01 0.21 0.05 1.57 4.81 -0.92 0.88 114.58 121.16 2buf h GLU 101 Ca 0.00 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2buf h GLU 101 Cb 0.03 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.36 2buf h GLU 101 CO -0.03 0.14 -0.02 1.98 -0.73 0.00 0.00 179.01 180.34 2buf h MET 102 N 0.21 -0.06 -0.10 1.92 4.05 0.06 -3.06 114.93 117.96 2buf h MET 102 Ca 0.69 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 60.10 2buf h MET 102 Cb 2.09 0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 32.90 2buf h MET 102 CO -0.30 0.57 0.01 0.28 0.23 0.00 0.00 176.91 177.69 2buf h VAL 103 N -0.90 1.23 -0.29 -5.77 2.07 0.16 0.45 116.25 113.20 2buf h VAL 103 Ca -0.01 -0.72 0.02 0.00 0.82 0.00 0.00 66.70 66.81 2buf h VAL 103 Cb 0.65 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 2buf h VAL 103 CO 0.01 0.20 0.20 -0.07 0.02 0.00 0.00 177.57 177.93 2buf h LEU 104 N -0.08 0.29 0.00 2.57 3.38 -1.03 -1.13 115.31 119.31 2buf h LEU 104 Ca 0.03 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 2buf h LEU 104 Cb 0.31 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 2buf h LEU 104 CO 0.00 0.20 -1.03 0.61 0.09 0.00 0.00 178.44 178.31 2buf n GLY 105 N -1.51 -0.78 0.22 0.83 0.00 -1.16 -2.41 105.19 100.38 2buf n GLY 105 Ca 0.02 -0.13 -0.04 0.00 0.00 0.00 0.00 46.02 45.87 2buf n GLY 105 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2buf h GLY 106 N -1.00 0.47 0.00 -0.02 0.00 -0.16 -3.26 103.07 99.10 2buf h GLY 106 Ca -0.17 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.74 2buf h GLY 106 CO -0.10 0.39 0.00 -0.18 0.00 0.00 0.00 176.54 176.65 2buf n GLN 107 N -4.07 0.00 -0.29 4.80 7.27 -0.47 -4.57 117.38 120.05 2buf n GLN 107 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.06 2buf n GLN 107 Cb 0.46 -0.08 0.20 0.00 2.41 0.00 0.00 30.24 33.23 2buf n GLN 107 CO 0.00 0.00 0.00 -0.39 0.07 0.00 0.00 177.06 176.74 2buf h VAL 108 N 0.00 1.19 0.91 1.69 -1.51 -1.66 0.72 116.25 117.59 2buf h VAL 108 Ca 0.00 -0.39 -0.04 0.00 -1.23 0.00 0.00 66.70 65.04 2buf h VAL 108 Cb 0.00 -0.04 0.01 0.00 -2.13 0.00 0.00 31.29 29.13 2buf h VAL 108 CO 0.00 0.21 -0.44 -1.13 -1.23 0.00 0.00 177.57 174.98 2buf h ASN 109 N 1.14 -1.03 0.23 4.19 -0.73 -1.62 0.67 115.58 118.43 2buf h ASN 109 Ca 0.33 0.03 -0.01 0.00 1.87 0.00 0.00 56.30 58.52 2buf h ASN 109 Cb -0.08 0.27 -0.00 0.00 0.27 0.00 0.00 38.32 38.78 2buf h ASN 109 CO -0.08 -0.73 -0.05 0.11 -0.37 0.00 0.00 177.43 176.31 2buf h LYS 110 N -1.24 0.00 0.38 6.67 1.79 -1.56 -1.64 116.57 120.97 2buf h LYS 110 Ca -0.12 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.33 2buf h LYS 110 Cb 0.94 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.59 2buf h LYS 110 CO 0.21 0.05 -0.18 0.22 -1.08 0.00 0.00 179.45 178.66 2buf h ASP 111 N 0.00 -0.43 -0.28 0.86 -0.00 0.13 -0.78 116.42 115.92 2buf h ASP 111 Ca -0.00 -0.14 0.04 0.00 -0.00 0.00 0.00 57.03 56.94 2buf h ASP 111 Cb 0.18 0.11 -0.04 0.00 -0.00 0.00 0.00 39.33 39.58 2buf h ASP 111 CO 0.01 -0.06 0.04 0.40 -0.00 0.00 0.00 179.24 179.62 2buf h ILE 112 N -0.84 0.84 -0.18 2.25 2.04 -0.53 -0.67 117.51 120.42 2buf h ILE 112 Ca -0.05 -0.05 0.02 0.00 1.00 0.00 0.00 64.86 65.78 2buf h ILE 112 Cb 0.54 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 2buf h ILE 112 CO 0.08 0.03 -0.25 0.58 0.00 0.00 0.00 178.15 178.59 2buf h VAL 113 N 0.14 0.00 -1.03 1.67 2.07 -1.24 0.32 116.25 118.18 2buf h VAL 113 Ca 0.13 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.91 2buf h VAL 113 Cb 0.15 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 29.82 2buf h VAL 113 CO -0.19 0.00 0.65 -1.13 0.02 0.00 0.00 177.57 176.92 2buf h ASN 114 N -0.19 0.49 0.80 0.57 -0.00 -0.77 -0.11 115.58 116.37 2buf h ASN 114 Ca 0.03 0.09 -0.04 0.00 -0.00 0.00 0.00 56.30 56.38 2buf h ASN 114 Cb 0.27 0.01 0.01 0.00 -0.00 0.00 0.00 38.32 38.61 2buf h ASN 114 CO -0.26 0.11 -0.38 0.25 -0.00 0.00 0.00 177.43 177.14 2buf h LEU 115 N 0.44 -0.91 -0.25 0.34 5.85 0.10 0.74 115.31 121.63 2buf h LEU 115 Ca 0.59 0.02 0.06 0.00 0.84 0.00 0.00 57.88 59.39 2buf h LEU 115 Cb 1.41 0.23 -0.06 0.00 0.37 0.00 0.00 40.66 42.62 2buf h LEU 115 CO -0.31 -0.62 -0.16 0.40 -0.34 0.00 0.00 178.44 177.41 2buf h ILE 116 N -1.11 0.55 -0.19 4.05 2.04 0.85 -1.24 117.51 122.46 2buf h ILE 116 Ca -0.11 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.80 2buf h ILE 116 Cb 0.83 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 2buf h ILE 116 CO 0.18 0.00 -0.16 0.78 0.00 0.00 0.00 178.15 178.95 2buf h ASN 117 N -0.14 -0.50 -0.98 1.72 2.35 -1.03 -0.57 115.58 116.42 2buf h ASN 117 Ca 0.14 0.10 0.23 0.00 -0.55 0.00 0.00 56.30 56.22 2buf h ASN 117 Cb 0.34 0.25 -0.09 0.00 0.05 0.00 0.00 38.32 38.88 2buf h ASN 117 CO -0.33 -0.20 0.63 -0.09 -1.65 0.00 0.00 177.43 175.79 2buf h ARG 118 N -0.17 0.46 -0.42 0.81 2.43 0.29 0.31 114.38 118.09 2buf h ARG 118 Ca 0.11 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2buf h ARG 118 Cb 0.34 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2buf h ARG 118 CO -0.29 0.30 0.00 0.72 -1.51 0.00 0.00 179.97 179.19 2buf n HIS 119 N -4.60 0.55 0.00 2.20 8.25 -0.72 -4.89 115.22 116.00 2buf n HIS 119 Ca 0.23 -0.28 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 2buf n HIS 119 Cb 0.75 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.86 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 1.27 1.58 3.59 -1.41 0.00 0.09 -4.93 105.19 105.37 2buf n GLY 120 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 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 2.44 -0.26 -0.02 0.00 -0.28 -4.99 107.32 102.21 2buf s GLY 121 Ca 0.00 -2.14 0.01 0.00 0.00 0.00 0.00 44.72 42.59 2buf s GLY 121 CO 0.00 -2.04 -0.08 -0.45 0.00 0.00 0.00 173.10 170.54 2buf s SER 122 N -3.67 4.45 0.18 1.64 0.15 -1.26 -3.13 113.70 112.05 2buf s SER 122 Ca 0.34 -1.20 0.10 0.00 0.70 0.00 0.00 55.95 55.88 2buf s SER 122 Cb 0.09 -1.61 -0.04 0.00 -1.71 0.00 0.00 66.02 62.75 2buf s SER 122 CO 0.17 -0.18 -0.20 0.00 1.20 0.00 0.00 173.24 174.22 2buf s ALA 123 N 1.20 2.20 -0.10 5.45 0.00 -1.26 -0.82 121.76 128.44 2buf s ALA 123 Ca -0.05 -1.54 0.02 0.00 0.00 0.00 0.00 51.96 50.39 2buf s ALA 123 Cb -0.19 -0.24 0.01 0.00 0.00 0.00 0.00 23.12 22.70 2buf s ALA 123 CO -0.04 0.31 -0.17 0.42 0.00 0.00 0.00 175.76 176.27 2buf s ILE 124 N -1.90 1.58 -0.45 0.00 1.09 -1.15 -4.94 121.20 115.44 2buf s ILE 124 Ca 0.18 -0.72 -0.23 0.00 -1.10 0.00 0.00 60.65 58.77 2buf s ILE 124 Cb -0.07 -1.41 0.03 0.00 -1.06 0.00 0.00 42.46 39.94 2buf s ILE 124 CO 0.08 0.46 0.81 -0.83 -0.10 0.00 0.00 174.94 175.35 2buf s GLY 125 N 0.72 1.58 -0.02 6.18 0.00 -1.26 -1.49 107.32 113.02 2buf s GLY 125 Ca -0.12 -0.95 0.07 0.00 0.00 0.00 0.00 44.72 43.72 2buf s GLY 125 CO 0.03 1.83 -0.24 1.08 0.00 0.00 0.00 173.10 175.79 2buf s LEU 126 N 3.36 2.05 0.29 0.66 1.43 -0.39 -5.00 118.68 121.09 2buf s LEU 126 Ca 0.31 -0.44 0.08 0.00 -1.03 0.00 0.00 54.13 53.05 2buf s LEU 126 Cb -0.12 -1.25 -0.04 0.00 0.03 0.00 0.00 46.19 44.81 2buf s LEU 126 CO 0.23 0.29 0.15 0.42 0.23 0.00 0.00 176.35 177.67 2buf s THR 127 N -0.53 3.69 -1.50 5.49 -4.23 -1.26 -0.99 115.64 116.31 2buf s THR 127 Ca 0.08 -1.59 0.01 0.00 -1.18 0.00 0.00 61.69 59.01 2buf s THR 127 Cb -0.10 -3.12 0.02 0.00 1.34 0.00 0.00 72.50 70.65 2buf s THR 127 CO -0.01 -0.28 0.81 0.61 -0.54 0.00 0.00 174.62 175.21 2buf n GLY 128 N -1.14 -0.29 0.08 3.99 0.00 -0.21 -2.58 105.19 105.04 2buf n GLY 128 Ca -0.05 -0.01 -0.11 0.00 0.00 0.00 0.00 46.02 45.85 2buf n GLY 128 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2buf h LYS 129 N 0.00 0.11 -6.19 1.61 1.57 -1.82 -1.38 116.57 110.47 2buf h LYS 129 Ca 0.00 -0.19 -0.59 0.00 -1.87 0.00 0.00 60.65 58.00 2buf h LYS 129 Cb 0.01 0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.40 2buf h LYS 129 CO 0.00 1.03 1.29 -0.25 -0.57 0.00 0.00 179.45 180.94 2buf n ASP 130 N -3.39 3.52 -2.18 0.86 9.92 -1.06 -0.83 116.55 123.38 2buf n ASP 130 Ca -0.06 0.68 -0.11 0.00 -0.53 0.00 0.00 54.79 54.77 2buf n ASP 130 Cb 0.99 -1.46 -0.01 0.00 -0.64 0.00 0.00 41.12 39.99 2buf n ASP 130 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2buf n ALA 131 N 8.65 -0.66 -3.97 2.24 0.00 -1.26 -0.35 120.51 125.17 2buf n ALA 131 Ca 0.26 0.11 -0.26 0.00 0.00 0.00 0.00 53.44 53.55 2buf n ALA 131 Cb 0.37 -1.33 -0.02 0.00 0.00 0.00 0.00 19.45 18.47 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 -2.52 -3.23 -0.33 0.00 1.02 -0.01 -4.84 120.64 110.73 2buf n GLU 132 Ca -0.12 0.39 0.09 0.00 -0.02 0.00 0.00 57.16 57.50 2buf n GLU 132 Cb 0.54 -4.51 0.26 0.00 -0.02 0.00 0.00 31.44 27.71 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 -1.83 0.74 -7.57 -4.62 5.85 -0.02 -3.36 115.31 104.50 2buf h LEU 133 Ca -0.63 0.08 -0.60 0.00 0.84 0.00 0.00 57.88 57.57 2buf h LEU 133 Cb 1.38 -0.05 -0.39 0.00 0.37 0.00 0.00 40.66 41.97 2buf h LEU 133 CO 0.63 0.32 -0.78 -0.63 -0.34 0.00 0.00 178.44 177.64 2buf s ILE 134 N -5.93 1.37 0.12 4.05 1.01 -0.58 -1.49 121.20 119.75 2buf s ILE 134 Ca -0.12 -1.15 -0.02 0.00 0.00 0.00 0.00 60.65 59.36 2buf s ILE 134 Cb 0.23 -1.70 -0.05 0.00 0.01 0.00 0.00 42.46 40.96 2buf s ILE 134 CO 0.80 -0.15 0.32 -0.13 0.00 0.00 0.00 174.94 175.78 2buf s ARG 135 N 1.46 3.53 -0.01 2.79 0.52 -0.44 -1.88 118.95 124.93 2buf s ARG 135 Ca -0.04 -0.27 -0.28 0.00 -0.52 0.00 0.00 55.73 54.62 2buf s ARG 135 Cb -0.19 -2.92 0.09 0.00 0.52 0.00 0.00 34.95 32.46 2buf s ARG 135 CO -0.07 0.51 0.77 0.00 0.02 0.00 0.00 175.30 176.53 2buf s ALA 136 N -1.64 -1.77 0.20 2.13 0.00 -1.06 -1.76 121.76 117.86 2buf s ALA 136 Ca 0.38 1.10 0.08 0.00 0.00 0.00 0.00 51.96 53.53 2buf s ALA 136 Cb -0.12 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.12 2buf s ALA 136 CO 0.27 -0.53 -0.01 0.21 0.00 0.00 0.00 175.76 175.70 2buf s LYS 137 N -2.24 2.33 -0.49 0.00 2.20 -1.16 -3.33 119.74 117.06 2buf s LYS 137 Ca -0.03 -1.22 -0.28 0.00 -0.36 0.00 0.00 55.97 54.08 2buf s LYS 137 Cb -0.01 -2.27 -0.01 0.00 -1.51 0.00 0.00 37.83 34.03 2buf s LYS 137 CO -0.02 0.42 1.70 0.21 -0.36 0.00 0.00 175.35 177.30 2buf s LYS 138 N -3.16 3.10 0.45 4.03 2.20 -1.26 -1.77 119.74 123.32 2buf s LYS 138 Ca 0.28 0.87 -0.22 0.00 -0.36 0.00 0.00 55.97 56.55 2buf s LYS 138 Cb -0.08 -4.23 -0.12 0.00 -1.51 0.00 0.00 37.83 31.89 2buf s LYS 138 CO 0.19 -2.15 0.59 -0.11 -0.36 0.00 0.00 175.35 173.50 2buf n LEU 139 N 10.85 0.40 -3.52 5.43 7.94 0.18 -4.91 117.00 133.37 2buf n LEU 139 Ca 0.19 0.89 -0.34 0.00 -1.11 0.00 0.00 56.01 55.64 2buf n LEU 139 Cb 0.49 -1.15 -0.03 0.00 0.53 0.00 0.00 43.42 43.26 2buf n LEU 139 CO 0.70 -2.78 0.63 0.41 -1.11 0.00 0.00 177.39 175.24 2buf n THR 140 N -1.00 4.01 0.00 1.96 -1.04 -1.26 -4.90 114.28 112.05 2buf n THR 140 Ca 0.11 -5.64 0.00 0.00 -2.04 0.00 0.00 64.05 56.48 2buf n THR 140 Cb 0.41 -1.85 0.00 0.00 -1.82 0.00 0.00 70.33 67.07 2buf n THR 140 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2buf n VAL 141 N 0.58 0.00 -1.93 12.58 0.31 -1.26 -4.88 118.33 123.74 2buf n VAL 141 Ca 0.32 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 64.25 2buf n VAL 141 Cb 0.36 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.29 2buf n VAL 141 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2buf s THR 142 N 0.00 2.34 0.00 2.52 2.01 -1.26 -4.75 115.64 116.50 2buf s THR 142 Ca 0.00 0.32 0.00 0.00 0.31 0.00 0.00 61.69 62.32 2buf s THR 142 Cb 0.00 -3.19 0.00 0.00 0.01 0.00 0.00 72.50 69.32 2buf s THR 142 CO 0.00 0.05 0.00 0.54 -0.69 0.00 0.00 174.62 174.52 2buf n ARG 143 N 0.15 3.47 -0.02 4.92 3.00 -1.26 -4.97 116.66 121.95 2buf n ARG 143 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.87 2buf n ARG 143 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.88 2buf n ARG 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2buf n GLN 144 N 0.00 0.00 -0.01 5.56 10.64 -1.26 -5.14 117.38 127.17 2buf n GLN 144 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2buf n GLN 144 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 2buf n GLN 144 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2buf n LYS 150 N 0.00 0.30 -4.75 2.61 5.02 -1.26 -5.12 118.16 114.97 2buf n LYS 150 Ca 0.00 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.04 2buf n LYS 150 Cb 0.19 -0.01 -0.15 0.00 -0.02 0.00 0.00 35.03 35.04 2buf n LYS 150 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2buf s PRO 151 N -0.03 1.41 -0.29 1.97 0.04 -1.26 -5.11 135.00 131.73 2buf s PRO 151 Ca 0.00 -0.79 0.04 0.00 0.04 0.00 0.00 61.00 60.30 2buf s PRO 151 Cb 0.00 -1.43 0.18 0.00 0.04 0.00 0.00 34.50 33.29 2buf s PRO 151 CO 0.00 0.38 0.50 -1.21 0.04 0.00 0.00 177.00 176.71 2buf s GLU 152 N -0.80 0.49 0.19 4.56 0.41 -1.26 -5.15 118.70 117.14 2buf s GLU 152 Ca 0.07 0.32 -0.30 0.00 -0.41 0.00 0.00 54.97 54.65 2buf s GLU 152 Cb -0.08 -0.04 -0.08 0.00 -1.78 0.00 0.00 34.13 32.16 2buf s GLU 152 CO 0.00 -1.05 1.18 0.42 -0.49 0.00 0.00 175.26 175.33 2buf s ILE 153 N 2.67 3.59 -0.25 -1.63 1.01 -1.26 -4.99 121.20 120.34 2buf s ILE 153 Ca 0.10 1.35 -0.06 0.00 0.00 0.00 0.00 60.65 62.04 2buf s ILE 153 Cb -0.11 -3.86 -0.01 0.00 0.01 0.00 0.00 42.46 38.48 2buf s ILE 153 CO -0.28 0.22 0.03 -0.51 0.00 0.00 0.00 174.94 174.40 2buf s ILE 154 N -0.12 3.87 0.87 2.92 2.07 -1.26 -5.07 121.20 124.48 2buf s ILE 154 Ca 0.52 -0.39 -0.13 0.00 -1.41 0.00 0.00 60.65 59.24 2buf s ILE 154 Cb -0.32 -2.82 0.05 0.00 0.13 0.00 0.00 42.46 39.49 2buf s ILE 154 CO 0.37 0.33 0.72 -0.90 -1.91 0.00 0.00 174.94 173.54 2buf n ASP 155 N 4.86 -0.85 -0.26 4.50 5.75 -1.26 -4.81 116.55 124.49 2buf n ASP 155 Ca -0.17 0.46 0.03 0.00 -0.01 0.00 0.00 54.79 55.10 2buf n ASP 155 Cb 0.51 -1.32 0.03 0.00 -1.03 0.00 0.00 41.12 39.31 2buf n ASP 155 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 2buf n ILE 156 N -3.36 0.11 0.00 2.12 5.41 -1.26 -5.07 119.36 117.30 2buf n ILE 156 Ca 0.10 -0.55 0.00 0.00 1.00 0.00 0.00 62.75 63.29 2buf n ILE 156 Cb 0.52 1.06 0.00 0.00 -0.71 0.00 0.00 39.64 40.51 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 0.31 -0.36 3.56 7.39 0.00 -1.26 -1.65 105.19 113.18 2buf n GLY 157 Ca 0.04 -2.14 -0.40 0.00 0.00 0.00 0.00 46.02 43.52 2buf n GLY 157 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2buf s HIS 158 N 0.00 2.37 -0.05 1.61 3.76 -0.91 -4.87 115.29 117.20 2buf s HIS 158 Ca 0.00 -0.44 -0.02 0.00 -0.15 0.00 0.00 55.06 54.45 2buf s HIS 158 Cb 0.00 -4.61 0.03 0.00 1.11 0.00 0.00 32.58 29.11 2buf s HIS 158 CO 0.00 -1.98 0.06 0.08 -0.85 0.00 0.00 174.74 172.04 2buf s VAL 159 N 5.69 -0.06 0.37 -0.90 1.01 -1.26 -2.37 120.40 122.88 2buf s VAL 159 Ca 0.45 0.35 0.08 0.00 0.00 0.00 0.00 61.98 62.86 2buf s VAL 159 Cb -0.03 -0.22 -0.05 0.00 0.00 0.00 0.00 36.38 36.08 2buf s VAL 159 CO -0.00 0.15 0.16 -0.83 0.00 0.00 0.00 175.10 174.57 2buf s GLY 160 N 2.15 2.11 -0.10 4.51 0.00 -1.14 -0.65 107.32 114.20 2buf s GLY 160 Ca 0.05 -1.95 0.03 0.00 0.00 0.00 0.00 44.72 42.85 2buf s GLY 160 CO -0.04 -1.82 -0.19 -1.83 0.00 0.00 0.00 173.10 169.22 2buf s GLU 161 N -3.87 3.01 0.17 2.90 -1.05 -0.73 -4.72 118.70 114.40 2buf s GLU 161 Ca 0.39 -0.79 -0.34 0.00 -0.15 0.00 0.00 54.97 54.09 2buf s GLU 161 Cb -0.00 -2.41 -0.15 0.00 -0.44 0.00 0.00 34.13 31.13 2buf s GLU 161 CO 0.23 0.29 1.43 0.28 0.95 0.00 0.00 175.26 178.44 2buf n VAL 162 N 3.25 0.36 -0.00 1.83 0.31 -1.26 -2.99 118.33 119.83 2buf n VAL 162 Ca -0.18 -0.09 0.01 0.00 -0.01 0.00 0.00 64.34 64.07 2buf n VAL 162 Cb 0.53 -1.28 -0.02 0.00 -0.91 0.00 0.00 33.84 32.16 2buf n VAL 162 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2buf n THR 163 N 2.59 0.02 -3.62 2.52 -2.24 -0.72 -4.93 114.28 107.91 2buf n THR 163 Ca 0.16 -0.05 -0.05 0.00 -2.27 0.00 0.00 64.05 61.83 2buf n THR 163 Cb 0.27 0.20 -0.05 0.00 -2.10 0.00 0.00 70.33 68.65 2buf n THR 163 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2buf s GLY 164 N -2.42 -0.03 -0.02 3.38 0.00 -1.22 -4.99 107.32 102.03 2buf s GLY 164 Ca -0.01 2.59 0.04 0.00 0.00 0.00 0.00 44.72 47.34 2buf s GLY 164 CO 0.09 1.14 -0.14 0.14 0.00 0.00 0.00 173.10 174.32 2buf s VAL 165 N -0.97 1.13 -0.58 1.40 1.01 -1.26 -1.33 120.40 119.80 2buf s VAL 165 Ca 0.05 -0.58 -0.23 0.00 0.00 0.00 0.00 61.98 61.22 2buf s VAL 165 Cb -0.01 -0.96 0.05 0.00 0.00 0.00 0.00 36.38 35.46 2buf s VAL 165 CO -0.05 0.33 0.91 0.21 0.00 0.00 0.00 175.10 176.50 2buf s ASN 166 N -0.14 6.27 0.21 3.32 3.84 -0.56 -4.79 114.94 123.09 2buf s ASN 166 Ca 0.02 -0.63 0.22 0.00 0.21 0.00 0.00 52.86 52.68 2buf s ASN 166 Cb -0.08 -2.41 0.00 0.00 -0.55 0.00 0.00 41.25 38.22 2buf s ASN 166 CO 0.00 -1.25 1.05 -0.37 -2.79 0.00 0.00 177.10 173.74 2buf h VAL 167 N 5.98 0.01 0.39 -5.21 -1.51 -1.90 -3.07 116.25 110.95 2buf h VAL 167 Ca -0.27 -1.01 -0.01 0.00 -1.23 0.00 0.00 66.70 64.18 2buf h VAL 167 Cb 1.08 1.51 -0.02 0.00 -2.13 0.00 0.00 31.29 31.73 2buf h VAL 167 CO 1.10 0.00 -0.36 1.23 -1.23 0.00 0.00 177.57 178.32 2buf h GLY 168 N 4.00 -0.86 0.52 5.19 0.00 -1.98 0.70 103.07 110.64 2buf h GLY 168 Ca -0.00 0.41 0.04 0.00 0.00 0.00 0.00 47.33 47.78 2buf h GLY 168 CO 0.00 -0.31 -0.09 -2.00 0.00 0.00 0.00 176.54 174.14 2buf h LEU 169 N -0.76 -0.31 0.53 3.11 5.85 -1.97 -1.46 115.31 120.30 2buf h LEU 169 Ca -0.03 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2buf h LEU 169 Cb 0.68 0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.87 2buf h LEU 169 CO -0.05 -0.12 -0.32 -0.07 -0.34 0.00 0.00 178.44 177.54 2buf h LEU 170 N -0.08 -0.81 -0.53 2.25 3.38 -1.37 -2.31 115.31 115.84 2buf h LEU 170 Ca 0.10 0.05 0.08 0.00 0.09 0.00 0.00 57.88 58.20 2buf h LEU 170 Cb 0.23 0.24 -0.07 0.00 0.09 0.00 0.00 40.66 41.15 2buf h LEU 170 CO -0.23 -0.51 0.17 0.78 0.09 0.00 0.00 178.44 178.74 2buf h ASN 171 N -0.81 0.14 -0.18 -0.43 2.35 0.54 0.13 115.58 117.32 2buf h ASN 171 Ca -0.06 0.07 0.03 0.00 -0.55 0.00 0.00 56.30 55.79 2buf h ASN 171 Cb 0.66 0.07 -0.03 0.00 0.05 0.00 0.00 38.32 39.07 2buf h ASN 171 CO 0.07 0.10 0.00 -0.03 -1.65 0.00 0.00 177.43 175.92 2buf h MET 172 N 0.33 0.06 -0.35 0.81 1.85 -1.25 0.51 114.93 116.89 2buf h MET 172 Ca 0.26 -0.00 0.06 0.00 -0.61 0.00 0.00 59.70 59.41 2buf h MET 172 Cb 0.32 -0.01 -0.05 0.00 0.43 0.00 0.00 31.60 32.28 2buf h MET 172 CO -0.29 0.04 0.05 -0.07 -0.40 0.00 0.00 176.91 176.24 2buf h LEU 173 N 0.06 -0.03 -0.58 3.39 3.38 -0.66 -0.45 115.31 120.41 2buf h LEU 173 Ca 0.08 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 2buf h LEU 173 Cb 0.10 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2buf h LEU 173 CO -0.14 0.02 0.29 0.58 0.09 0.00 0.00 178.44 179.28 2buf h VAL 174 N 0.16 1.20 -0.98 1.22 2.07 -0.13 -2.19 116.25 117.61 2buf h VAL 174 Ca 0.17 -0.56 0.06 0.00 0.82 0.00 0.00 66.70 67.19 2buf h VAL 174 Cb 0.21 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.41 2buf h VAL 174 CO -0.24 0.23 0.63 0.50 0.02 0.00 0.00 177.57 178.71 2buf h LYS 175 N 0.79 1.14 0.00 1.57 3.64 0.61 -1.26 116.57 123.07 2buf h LYS 175 Ca 0.20 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2buf h LYS 175 Cb 0.10 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 31.66 2buf h LYS 175 CO -0.03 0.76 0.00 0.41 -2.27 0.00 0.00 179.45 178.32 2buf n GLY 176 N -1.36 -0.57 2.65 5.01 0.00 -0.23 -4.82 105.19 105.86 2buf n GLY 176 Ca 0.14 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.54 -3.86 -4.57 1.61 10.43 -0.47 -5.05 116.55 114.11 2buf n ASP 177 Ca 0.01 -0.33 -0.25 0.00 2.57 0.00 0.00 54.79 56.79 2buf n ASP 177 Cb 0.00 -3.19 -0.09 0.00 1.84 0.00 0.00 41.12 39.68 2buf n ASP 177 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 2buf s PHE 178 N -3.20 2.46 -0.39 1.24 2.99 -1.07 -4.77 117.98 115.24 2buf s PHE 178 Ca 0.25 -0.39 0.04 0.00 0.00 0.00 0.00 56.93 56.82 2buf s PHE 178 Cb -0.11 -1.28 0.11 0.00 0.00 0.00 0.00 43.02 41.74 2buf s PHE 178 CO 0.43 0.59 0.11 0.42 -0.00 0.00 0.00 175.22 176.78 2buf s ILE 179 N -2.51 2.29 0.53 0.64 1.01 -0.00 -4.43 121.20 118.72 2buf s ILE 179 Ca 0.32 -2.57 -0.19 0.00 0.00 0.00 0.00 60.65 58.21 2buf s ILE 179 Cb -0.02 -2.66 -0.07 0.00 0.01 0.00 0.00 42.46 39.72 2buf s ILE 179 CO 0.17 -0.66 1.08 -2.16 0.00 0.00 0.00 174.94 173.38 2buf s PRO 180 N 0.60 3.53 -0.23 2.79 0.04 -1.26 -2.91 135.00 137.56 2buf s PRO 180 Ca 0.13 1.47 0.01 0.00 0.04 0.00 0.00 61.00 62.64 2buf s PRO 180 Cb -0.21 -2.04 0.06 0.00 0.04 0.00 0.00 34.50 32.34 2buf s PRO 180 CO -0.06 -0.68 -0.07 0.08 0.04 0.00 0.00 177.00 176.31 2buf s VAL 181 N -1.93 1.62 -0.27 -0.36 1.01 -0.56 -0.97 120.40 118.93 2buf s VAL 181 Ca 0.69 -1.22 -0.09 0.00 0.00 0.00 0.00 61.98 61.37 2buf s VAL 181 Cb -0.20 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 2buf s VAL 181 CO 0.25 -0.03 0.14 -0.63 0.00 0.00 0.00 175.10 174.82 2buf s ILE 182 N 1.36 4.78 0.49 2.22 1.01 0.12 -1.26 121.20 129.93 2buf s ILE 182 Ca -0.05 -0.08 -0.19 0.00 0.00 0.00 0.00 60.65 60.33 2buf s ILE 182 Cb -0.18 -3.29 -0.08 0.00 0.01 0.00 0.00 42.46 38.91 2buf s ILE 182 CO -0.06 0.25 1.00 0.00 0.00 0.00 0.00 174.94 176.12 2buf s ALA 183 N 1.68 2.96 -0.17 9.38 0.00 -0.16 -2.87 121.76 132.58 2buf s ALA 183 Ca 0.06 0.39 0.00 0.00 0.00 0.00 0.00 51.96 52.41 2buf s ALA 183 Cb -0.16 -3.18 0.15 0.00 0.00 0.00 0.00 23.12 19.93 2buf s ALA 183 CO 0.07 -0.22 1.76 -0.35 0.00 0.00 0.00 175.76 177.02 2buf n PRO 184 N -1.19 1.44 -3.42 0.00 -0.05 -1.26 -4.06 135.00 126.45 2buf n PRO 184 Ca 0.08 -0.91 -0.33 0.00 -0.05 0.00 0.00 63.50 62.29 2buf n PRO 184 Cb 0.53 -1.36 -0.05 0.00 -0.05 0.00 0.00 33.50 32.57 2buf n PRO 184 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 175.50 175.87 2buf s ILE 185 N -1.23 4.94 0.07 0.52 1.01 -1.26 -3.00 121.20 122.25 2buf s ILE 185 Ca 0.18 0.53 -0.00 0.00 0.00 0.00 0.00 60.65 61.35 2buf s ILE 185 Cb 0.14 -3.64 -0.04 0.00 0.01 0.00 0.00 42.46 38.93 2buf s ILE 185 CO 0.01 0.02 -0.04 -0.83 0.00 0.00 0.00 174.94 174.10 2buf s GLY 186 N -2.19 0.59 -0.21 6.18 0.00 -0.95 -1.04 107.32 109.71 2buf s GLY 186 Ca 0.44 -1.27 0.02 0.00 0.00 0.00 0.00 44.72 43.91 2buf s GLY 186 CO 0.21 -1.37 -0.17 0.14 0.00 0.00 0.00 173.10 171.91 2buf s VAL 187 N -3.82 2.08 1.15 1.40 1.01 -0.79 -0.76 120.40 120.67 2buf s VAL 187 Ca 0.09 -1.16 -0.15 0.00 0.00 0.00 0.00 61.98 60.76 2buf s VAL 187 Cb 0.07 -1.98 0.26 0.00 0.00 0.00 0.00 36.38 34.73 2buf s VAL 187 CO -0.08 0.35 1.06 -0.83 0.00 0.00 0.00 175.10 175.60 2buf s GLY 188 N 1.24 1.54 0.18 4.51 0.00 -1.00 -2.57 107.32 111.21 2buf s GLY 188 Ca 0.00 -0.53 -0.23 0.00 0.00 0.00 0.00 44.72 43.96 2buf s GLY 188 CO -0.10 0.23 1.58 1.48 0.00 0.00 0.00 173.10 176.28 2buf h SER 189 N -2.45 -1.32 -0.21 1.64 4.64 -1.92 -2.58 113.55 111.35 2buf h SER 189 Ca -0.53 0.24 -0.19 0.00 -0.47 0.00 0.00 61.79 60.84 2buf h SER 189 Cb 1.33 0.63 -0.07 0.00 -0.31 0.00 0.00 62.40 63.98 2buf h SER 189 CO 0.47 -0.32 -0.06 -3.20 -0.87 0.00 0.00 176.83 172.85 2buf n ASN 190 N -5.42 5.60 0.00 4.97 2.85 -1.26 -4.84 115.26 117.15 2buf n ASN 190 Ca 0.03 -2.63 0.00 0.00 -0.11 0.00 0.00 54.58 51.87 2buf n ASN 190 Cb 0.35 -1.26 0.00 0.00 1.24 0.00 0.00 39.78 40.12 2buf n ASN 190 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2buf n GLY 191 N 1.70 0.76 3.03 8.20 0.00 -0.97 -4.95 105.19 112.96 2buf n GLY 191 Ca 0.29 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.08 2buf n GLY 191 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2buf n GLU 192 N -1.36 -3.16 -4.37 1.61 4.71 -1.26 -4.68 120.64 112.13 2buf n GLU 192 Ca 0.00 -1.08 -0.22 0.00 -0.01 0.00 0.00 57.16 55.85 2buf n GLU 192 Cb 0.00 -1.65 -0.11 0.00 -1.01 0.00 0.00 31.44 28.66 2buf n GLU 192 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2buf s SER 193 N -2.56 2.90 -0.01 1.62 0.01 -1.26 -2.39 113.70 112.02 2buf s SER 193 Ca 0.50 -0.90 0.01 0.00 1.31 0.00 0.00 55.95 56.87 2buf s SER 193 Cb -0.09 -0.19 0.00 0.00 0.21 0.00 0.00 66.02 65.96 2buf s SER 193 CO 0.42 -0.02 -0.04 -0.31 0.41 0.00 0.00 173.24 173.70 2buf s TYR 194 N -2.15 0.43 -0.05 2.43 1.51 0.06 -4.88 117.35 114.70 2buf s TYR 194 Ca 0.19 -0.08 -0.22 0.00 -1.01 0.00 0.00 57.07 55.95 2buf s TYR 194 Cb -0.05 -0.33 -0.04 0.00 -0.11 0.00 0.00 41.96 41.42 2buf s TYR 194 CO 0.08 -0.05 0.64 1.21 -1.11 0.00 0.00 175.55 176.33 2buf s ASN 195 N 0.19 6.94 -0.02 2.29 3.04 -1.00 -2.23 114.94 124.16 2buf s ASN 195 Ca -0.02 1.13 0.02 0.00 0.04 0.00 0.00 52.86 54.04 2buf s ASN 195 Cb -0.05 -2.38 0.00 0.00 -1.54 0.00 0.00 41.25 37.28 2buf s ASN 195 CO -0.00 -0.04 -0.08 -0.63 -3.04 0.00 0.00 177.10 173.31 2buf s ILE 196 N 0.50 0.68 0.08 -5.21 1.01 -1.16 -2.88 121.20 114.21 2buf s ILE 196 Ca 0.34 -0.33 -0.31 0.00 0.00 0.00 0.00 60.65 60.36 2buf s ILE 196 Cb -0.18 -0.60 -0.09 0.00 0.01 0.00 0.00 42.46 41.60 2buf s ILE 196 CO 0.17 0.21 1.81 0.21 0.00 0.00 0.00 174.94 177.34 2buf s ASN 197 N 0.07 6.49 0.55 3.58 3.04 -1.26 -4.76 114.94 122.65 2buf s ASN 197 Ca -0.01 2.64 0.33 0.00 0.04 0.00 0.00 52.86 55.86 2buf s ASN 197 Cb -0.06 -2.55 1.50 0.00 -1.54 0.00 0.00 41.25 38.59 2buf s ASN 197 CO 0.00 -0.98 1.84 0.00 -3.04 0.00 0.00 177.10 174.91 2buf h ALA 198 N 9.10 2.88 -0.18 1.71 0.00 -1.90 -0.63 119.26 130.25 2buf h ALA 198 Ca -0.46 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.25 2buf h ALA 198 Cb 1.22 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2buf h ALA 198 CO 0.94 -1.23 -0.57 -0.44 0.00 0.00 0.00 179.25 177.95 2buf h ASP 199 N 0.00 0.63 0.76 0.00 3.32 -1.91 0.31 116.42 119.53 2buf h ASP 199 Ca 0.46 -0.35 -0.09 0.00 0.02 0.00 0.00 57.03 57.07 2buf h ASP 199 Cb 1.91 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 41.27 2buf h ASP 199 CO -0.00 1.07 -0.44 -0.07 -1.72 0.00 0.00 179.24 178.07 2buf h LEU 200 N 0.43 0.00 0.10 1.55 3.38 -1.43 -1.55 115.31 117.79 2buf h LEU 200 Ca 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 2buf h LEU 200 Cb 1.12 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.89 2buf h LEU 200 CO 0.11 0.44 -0.61 0.58 0.09 0.00 0.00 178.44 179.05 2buf h VAL 201 N 0.00 1.57 0.00 1.22 2.07 -1.37 -2.34 116.25 117.40 2buf h VAL 201 Ca -0.00 -2.47 -0.00 0.00 0.82 0.00 0.00 66.70 65.05 2buf h VAL 201 Cb 0.94 3.21 -0.00 0.00 -1.52 0.00 0.00 31.29 33.92 2buf h VAL 201 CO 0.06 0.69 -0.02 0.00 0.02 0.00 0.00 177.57 178.31 2buf h ALA 202 N 0.08 1.44 0.23 1.67 0.00 -0.88 0.18 119.26 121.99 2buf h ALA 202 Ca -0.11 -0.02 -0.34 0.00 0.00 0.00 0.00 54.91 54.45 2buf h ALA 202 Cb 1.47 -0.00 0.03 0.00 0.00 0.00 0.00 17.79 19.29 2buf h ALA 202 CO 0.12 0.02 -1.54 0.78 0.00 0.00 0.00 179.25 178.63 2buf h GLY 203 N 0.14 0.56 1.44 0.00 0.00 -1.27 -2.92 103.07 101.02 2buf h GLY 203 Ca -0.00 -1.43 -0.18 0.00 0.00 0.00 0.00 47.33 45.73 2buf h GLY 203 CO 0.00 1.25 -0.63 0.50 0.00 0.00 0.00 176.54 177.66 2buf h LYS 204 N 0.13 0.57 -0.36 4.80 1.79 -0.78 0.76 116.57 123.49 2buf h LYS 204 Ca -0.27 -0.40 -0.05 0.00 -2.18 0.00 0.00 60.65 57.75 2buf h LYS 204 Cb 2.14 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 32.84 2buf h LYS 204 CO 0.25 1.02 0.01 0.28 -1.08 0.00 0.00 179.45 179.93 2buf h VAL 205 N 0.42 1.20 -0.15 0.50 2.07 -0.78 0.13 116.25 119.64 2buf h VAL 205 Ca -0.01 -0.78 -0.18 0.00 0.82 0.00 0.00 66.70 66.55 2buf h VAL 205 Cb 1.20 0.91 0.01 0.00 -1.52 0.00 0.00 31.29 31.89 2buf h VAL 205 CO 0.12 0.27 -0.60 0.00 0.02 0.00 0.00 177.57 177.38 2buf h ALA 206 N 1.49 0.28 -0.42 1.67 0.00 -1.27 -1.73 119.26 119.27 2buf h ALA 206 Ca 0.12 -0.54 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 2buf h ALA 206 Cb 0.32 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2buf h ALA 206 CO 0.01 0.52 0.25 0.93 0.00 0.00 0.00 179.25 180.96 2buf h GLU 207 N 0.35 0.57 0.00 0.00 5.08 -0.37 -0.82 114.58 119.39 2buf h GLU 207 Ca -0.03 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2buf h GLU 207 Cb 1.23 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 2buf h GLU 207 CO 0.13 0.43 -0.03 0.00 -1.00 0.00 0.00 179.01 178.54 2buf h ALA 208 N 1.11 1.02 -0.02 3.43 0.00 -0.72 -2.90 119.26 121.19 2buf h ALA 208 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2buf h ALA 208 Cb 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2buf h ALA 208 CO -0.03 0.03 -0.10 1.28 0.00 0.00 0.00 179.25 180.44 2buf n LEU 209 N -3.15 2.17 -3.92 0.00 4.77 -0.66 -4.89 117.00 111.33 2buf n LEU 209 Ca -0.00 -0.93 -0.25 0.00 -0.03 0.00 0.00 56.01 54.80 2buf n LEU 209 Cb 0.26 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.34 2buf n LEU 209 CO 0.26 0.39 -0.21 0.29 -1.33 0.00 0.00 177.39 176.79 2buf n LYS 210 N 0.63 -3.46 -2.43 3.23 4.76 -0.35 -4.92 118.16 115.63 2buf n LYS 210 Ca 0.09 0.43 -0.40 0.00 -2.87 0.00 0.00 58.31 55.56 2buf n LYS 210 Cb 0.39 -4.60 -0.04 0.00 -1.84 0.00 0.00 35.03 28.95 2buf n LYS 210 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2buf s ALA 211 N -3.92 3.41 0.40 7.82 0.00 -1.12 -4.91 121.76 123.44 2buf s ALA 211 Ca 0.01 0.94 0.14 0.00 0.00 0.00 0.00 51.96 53.05 2buf s ALA 211 Cb -0.00 -3.35 0.88 0.00 0.00 0.00 0.00 23.12 20.66 2buf s ALA 211 CO 0.88 -0.23 1.91 1.49 0.00 0.00 0.00 175.76 179.81 2buf h GLU 212 N 3.73 0.00 -2.77 0.00 4.57 -1.83 -3.10 114.58 115.17 2buf h GLU 212 Ca -0.47 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 57.56 2buf h GLU 212 Cb 1.21 0.00 -0.29 0.00 -0.16 0.00 0.00 28.75 29.52 2buf h GLU 212 CO 0.67 0.27 -0.40 0.21 -1.18 0.00 0.00 179.01 178.58 2buf s LYS 213 N -4.38 0.29 -0.30 1.92 2.20 -1.25 -3.17 119.74 115.04 2buf s LYS 213 Ca -0.03 0.74 -0.11 0.00 -0.36 0.00 0.00 55.97 56.22 2buf s LYS 213 Cb 0.15 -0.00 -0.02 0.00 -1.51 0.00 0.00 37.83 36.44 2buf s LYS 213 CO 0.70 -0.19 0.17 -1.17 -0.36 0.00 0.00 175.35 174.51 2buf s LEU 214 N 1.70 4.10 -0.22 5.43 2.96 -0.74 -2.43 118.68 129.47 2buf s LEU 214 Ca -0.07 -0.31 -0.06 0.00 -0.22 0.00 0.00 54.13 53.47 2buf s LEU 214 Cb -0.10 -2.06 -0.02 0.00 0.50 0.00 0.00 46.19 44.51 2buf s LEU 214 CO -0.11 -0.14 0.02 -0.04 -1.32 0.00 0.00 176.35 174.76 2buf s MET 215 N 1.68 3.62 -0.32 1.98 -1.94 0.06 -1.13 119.30 123.26 2buf s MET 215 Ca 0.06 -0.51 -0.03 0.00 -1.71 0.00 0.00 55.69 53.50 2buf s MET 215 Cb -0.17 -3.16 0.06 0.00 2.01 0.00 0.00 34.83 33.57 2buf s MET 215 CO 0.08 -0.07 0.04 -0.51 -0.01 0.00 0.00 175.02 174.56 2buf s LEU 216 N 1.23 4.15 -0.13 -0.03 1.43 -0.06 -0.77 118.68 124.50 2buf s LEU 216 Ca 0.04 -1.36 -0.21 0.00 -1.03 0.00 0.00 54.13 51.57 2buf s LEU 216 Cb -0.15 -1.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 2buf s LEU 216 CO 0.02 -0.31 0.60 -0.76 0.23 0.00 0.00 176.35 176.13 2buf s LEU 217 N 1.26 4.25 0.23 1.79 1.43 -0.92 0.44 118.68 127.16 2buf s LEU 217 Ca -0.03 0.94 -0.02 0.00 -1.03 0.00 0.00 54.13 54.00 2buf s LEU 217 Cb -0.20 -2.88 -0.03 0.00 0.03 0.00 0.00 46.19 43.10 2buf s LEU 217 CO -0.01 -0.13 0.23 0.28 0.23 0.00 0.00 176.35 176.95 2buf s THR 218 N 1.10 0.00 -0.60 5.49 -1.32 -0.62 -3.84 115.64 115.85 2buf s THR 218 Ca 0.31 -1.88 0.25 0.00 -1.21 0.00 0.00 61.69 59.15 2buf s THR 218 Cb -0.16 -2.46 0.21 0.00 -1.51 0.00 0.00 72.50 68.58 2buf s THR 218 CO 0.13 0.00 1.56 -0.55 -2.21 0.00 0.00 174.62 173.55 2buf h ASN 219 N 2.46 0.00 -2.19 8.08 7.08 -1.86 0.92 115.58 130.07 2buf h ASN 219 Ca -0.32 -0.05 -0.44 0.00 -3.08 0.00 0.00 56.30 52.40 2buf h ASN 219 Cb 1.25 0.00 0.02 0.00 -2.08 0.00 0.00 38.32 37.51 2buf h ASN 219 CO 0.47 0.03 -0.19 -0.51 -2.08 0.00 0.00 177.43 175.14 2buf s ILE 220 N -3.17 3.63 -0.50 6.14 2.07 -1.26 -4.84 121.20 123.27 2buf s ILE 220 Ca 0.08 -0.77 0.24 0.00 -1.41 0.00 0.00 60.65 58.78 2buf s ILE 220 Cb 0.11 -3.29 0.25 0.00 0.13 0.00 0.00 42.46 39.65 2buf s ILE 220 CO 0.66 -0.16 1.72 0.00 -1.91 0.00 0.00 174.94 175.25 2buf n ALA 221 N -1.95 1.71 0.00 1.50 0.00 -1.26 -4.05 120.51 116.47 2buf n ALA 221 Ca 0.03 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2buf n ALA 221 Cb 0.58 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.64 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 0.10 -1.38 3.68 0.00 0.00 -1.26 -3.97 105.19 102.36 2buf n GLY 222 Ca 0.02 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 44.06 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 4.27 -0.02 0.99 0.20 -1.26 -4.89 118.68 117.96 2buf s LEU 223 Ca 0.00 1.91 0.05 0.00 0.69 0.00 0.00 54.13 56.79 2buf s LEU 223 Cb 0.00 -3.55 -0.03 0.00 -0.43 0.00 0.00 46.19 42.18 2buf s LEU 223 CO 0.00 -0.70 -0.18 -0.04 -0.29 0.00 0.00 176.35 175.14 2buf s MET 224 N 2.76 2.31 1.21 1.98 -1.94 -1.25 0.14 119.30 124.51 2buf s MET 224 Ca 0.60 -0.82 -0.18 0.00 -1.71 0.00 0.00 55.69 53.58 2buf s MET 224 Cb -0.27 -2.26 0.28 0.00 2.01 0.00 0.00 34.83 34.60 2buf s MET 224 CO 0.22 0.59 1.07 0.16 -0.01 0.00 0.00 175.02 177.05 2buf s ASP 225 N -0.88 0.85 0.52 3.03 1.47 0.67 -4.83 116.67 117.50 2buf s ASP 225 Ca 0.12 0.85 0.34 0.00 1.18 0.00 0.00 52.55 55.03 2buf s ASP 225 Cb -0.10 -1.24 1.84 0.00 -0.34 0.00 0.00 42.92 43.07 2buf s ASP 225 CO 0.01 -4.19 2.03 0.11 0.68 0.00 0.00 175.17 173.81 2buf h LYS 226 N -2.62 0.00 -0.02 2.11 1.57 -1.90 -2.19 116.57 113.52 2buf h LYS 226 Ca -0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 2buf h LYS 226 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.62 2buf h LYS 226 CO 0.39 0.00 -0.01 1.04 -0.57 0.00 0.00 179.45 180.30 2buf n GLN 227 N -2.70 1.80 0.00 3.15 3.00 -1.26 -4.97 117.38 116.40 2buf n GLN 227 Ca -0.02 -1.18 0.00 0.00 -0.01 0.00 0.00 57.00 55.78 2buf n GLN 227 Cb 0.08 -1.48 0.00 0.00 0.00 0.00 0.00 30.24 28.84 2buf n GLN 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2buf n GLY 228 N 1.22 1.60 3.76 1.08 0.00 -0.82 -5.08 105.19 106.95 2buf n GLY 228 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.91 4.65 0.29 1.61 -1.52 -1.26 -4.78 119.66 117.74 2buf s GLN 229 Ca 0.00 1.55 -0.18 0.00 -1.95 0.00 0.00 55.36 54.78 2buf s GLN 229 Cb 0.00 -3.06 -0.09 0.00 -0.22 0.00 0.00 33.01 29.64 2buf s GLN 229 CO 0.00 0.30 0.76 0.08 -0.25 0.00 0.00 175.29 176.18 2buf s VAL 230 N -1.33 4.59 -0.10 1.09 1.01 -1.25 -0.24 120.40 124.18 2buf s VAL 230 Ca 0.46 1.17 -0.03 0.00 0.00 0.00 0.00 61.98 63.58 2buf s VAL 230 Cb -0.26 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 2buf s VAL 230 CO 0.32 -0.02 0.02 -0.76 0.00 0.00 0.00 175.10 174.67 2buf s LEU 231 N -2.53 3.69 0.14 3.92 1.43 0.38 -4.89 118.68 120.81 2buf s LEU 231 Ca 0.50 0.18 0.10 0.00 -1.03 0.00 0.00 54.13 53.88 2buf s LEU 231 Cb -0.13 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 2buf s LEU 231 CO 0.19 0.37 -0.25 -0.89 0.23 0.00 0.00 176.35 176.00 2buf s THR 232 N -0.80 2.15 -0.70 5.49 2.01 -1.26 -4.17 115.64 118.36 2buf s THR 232 Ca 0.12 -1.78 -0.11 0.00 0.31 0.00 0.00 61.69 60.24 2buf s THR 232 Cb -0.12 -1.93 0.02 0.00 0.01 0.00 0.00 72.50 70.48 2buf s THR 232 CO 0.02 0.00 0.63 0.61 -0.69 0.00 0.00 174.62 175.20 2buf n GLY 233 N 0.79 -0.93 3.88 4.40 0.00 0.07 -4.84 105.19 108.57 2buf n GLY 233 Ca -0.17 0.77 -0.33 0.00 0.00 0.00 0.00 46.02 46.29 2buf n GLY 233 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2buf s LEU 234 N -4.06 4.31 0.68 0.99 1.43 -1.26 -4.94 118.68 115.82 2buf s LEU 234 Ca 0.11 0.66 -0.04 0.00 -1.03 0.00 0.00 54.13 53.83 2buf s LEU 234 Cb -0.01 -3.12 0.06 0.00 0.03 0.00 0.00 46.19 43.15 2buf s LEU 234 CO 0.87 0.12 0.96 -0.94 0.23 0.00 0.00 176.35 177.59 2buf s SER 235 N -2.10 4.84 0.12 2.29 1.04 -1.26 -4.73 113.70 113.89 2buf s SER 235 Ca 0.36 0.27 -0.16 0.00 0.48 0.00 0.00 55.95 56.90 2buf s SER 235 Cb -0.13 -0.94 -0.03 0.00 0.10 0.00 0.00 66.02 65.02 2buf s SER 235 CO 0.21 -1.54 1.60 0.74 0.98 0.00 0.00 173.24 175.23 2buf h THR 236 N -0.46 1.23 0.08 2.02 2.02 -1.99 -2.69 112.91 113.12 2buf h THR 236 Ca -0.43 -0.81 -0.00 0.00 0.77 0.00 0.00 66.41 65.93 2buf h THR 236 Cb 1.30 1.08 0.00 0.00 -1.74 0.00 0.00 68.15 68.80 2buf h THR 236 CO 0.56 0.27 -0.04 -0.33 0.37 0.00 0.00 175.52 176.36 2buf h GLU 237 N 0.43 -0.10 0.00 6.66 3.07 -2.02 -2.17 114.58 120.45 2buf h GLU 237 Ca 0.11 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 2buf h GLU 237 Cb 0.34 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 2buf h GLU 237 CO 0.01 0.05 0.12 1.96 -1.40 0.00 0.00 179.01 179.74 2buf h GLN 238 N -0.23 0.00 0.05 2.33 4.20 -1.93 -2.54 115.11 116.98 2buf h GLN 238 Ca -0.01 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.39 2buf h GLN 238 Cb 0.20 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.95 2buf h GLN 238 CO 0.02 0.00 -1.72 0.28 -0.67 0.00 0.00 178.83 176.74 2buf h VAL 239 N 0.00 0.88 -0.17 -0.54 2.07 -1.04 -3.30 116.25 114.15 2buf h VAL 239 Ca 0.00 -2.66 -0.12 0.00 0.82 0.00 0.00 66.70 64.74 2buf h VAL 239 Cb 0.24 2.52 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 2buf h VAL 239 CO 0.00 0.67 -0.42 0.78 0.02 0.00 0.00 177.57 178.62 2buf h ASN 240 N 0.03 0.41 -0.59 0.57 2.35 -1.36 -1.93 115.58 115.06 2buf h ASN 240 Ca -0.30 -0.18 0.05 0.00 -0.55 0.00 0.00 56.30 55.31 2buf h ASN 240 Cb 2.01 -0.12 -0.05 0.00 0.05 0.00 0.00 38.32 40.21 2buf h ASN 240 CO 0.10 0.79 0.32 -0.08 -1.65 0.00 0.00 177.43 176.91 2buf h GLU 241 N 0.32 0.60 0.00 0.81 4.81 -1.68 0.19 114.58 119.63 2buf h GLU 241 Ca 0.03 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2buf h GLU 241 Cb 0.88 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.12 2buf h GLU 241 CO 0.07 0.40 0.00 -0.07 -0.73 0.00 0.00 179.01 178.68 2buf h LEU 242 N 0.62 0.00 -0.03 1.64 3.38 -1.56 0.91 115.31 120.26 2buf h LEU 242 Ca 0.26 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.97 2buf h LEU 242 Cb 0.13 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.90 2buf h LEU 242 CO -0.16 0.00 -1.02 0.40 0.09 0.00 0.00 178.44 177.75 2buf h ILE 243 N 0.00 1.29 0.03 1.22 2.04 0.07 -1.21 117.51 120.96 2buf h ILE 243 Ca 0.00 -2.26 -0.00 0.00 1.00 0.00 0.00 64.86 63.60 2buf h ILE 243 Cb 0.56 2.37 0.00 0.00 -0.74 0.00 0.00 36.82 39.01 2buf h ILE 243 CO 0.00 0.70 -0.02 0.00 0.00 0.00 0.00 178.15 178.83 2buf h ALA 244 N 0.46 -0.04 -0.73 1.87 0.00 -0.77 -3.30 119.26 116.74 2buf h ALA 244 Ca -0.12 -0.34 0.25 0.00 0.00 0.00 0.00 54.91 54.70 2buf h ALA 244 Cb 1.67 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 19.34 2buf h ALA 244 CO 0.20 -0.14 0.19 -3.47 0.00 0.00 0.00 179.25 176.03 2buf n ASP 245 N -4.76 0.07 0.00 0.00 -0.08 0.29 -4.71 116.55 107.36 2buf n ASP 245 Ca -0.09 1.22 0.00 0.00 -1.51 0.00 0.00 54.79 54.42 2buf n ASP 245 Cb 0.34 -0.52 0.00 0.00 2.34 0.00 0.00 41.12 43.29 2buf n ASP 245 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2buf n GLY 246 N -1.28 0.88 0.21 0.27 0.00 -1.20 -4.96 105.19 99.10 2buf n GLY 246 Ca 0.22 -0.02 -0.17 0.00 0.00 0.00 0.00 46.02 46.05 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 1.29 -3.68 2.61 2.02 -1.73 -3.41 112.91 110.01 2buf h THR 247 Ca 0.00 -2.09 -0.69 0.00 0.77 0.00 0.00 66.41 64.39 2buf h THR 247 Cb 0.00 2.13 -0.29 0.00 -1.74 0.00 0.00 68.15 68.25 2buf h THR 247 CO 0.00 0.65 -0.62 -0.63 0.37 0.00 0.00 175.52 175.30 2buf s ILE 248 N -3.59 3.68 0.29 3.11 1.01 -0.50 -4.77 121.20 120.43 2buf s ILE 248 Ca -0.09 -1.18 0.02 0.00 0.00 0.00 0.00 60.65 59.40 2buf s ILE 248 Cb 0.08 -3.10 -0.06 0.00 0.01 0.00 0.00 42.46 39.40 2buf s ILE 248 CO 0.90 -0.18 0.08 -0.72 0.00 0.00 0.00 174.94 175.02 2buf s TYR 249 N 1.38 1.74 0.00 3.97 -0.85 -1.26 -4.66 117.35 117.67 2buf s TYR 249 Ca -0.02 -1.08 0.00 0.00 -0.52 0.00 0.00 57.07 55.45 2buf s TYR 249 Cb -0.20 -1.08 0.00 0.00 0.38 0.00 0.00 41.96 41.06 2buf s TYR 249 CO 0.02 -0.18 0.00 0.41 -1.52 0.00 0.00 175.55 174.28 2buf n GLY 250 N -0.57 2.34 0.00 5.49 0.00 -1.26 -2.74 105.19 108.45 2buf n GLY 250 Ca -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 0.00 0.00 -0.02 0.00 -1.26 -0.26 105.19 103.65 2buf n GLY 251 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 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 -0.82 1.49 -0.10 1.61 0.00 -1.11 -3.96 117.12 114.24 2buf n MET 252 Ca 0.00 -0.02 -0.12 0.00 0.00 0.00 0.00 57.70 57.57 2buf n MET 252 Cb 0.00 -1.28 -0.04 0.00 0.00 0.00 0.00 33.22 31.90 2buf n MET 252 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 2buf h LEU 253 N 0.00 0.62 -0.09 -0.89 3.38 -0.76 -2.33 115.31 115.24 2buf h LEU 253 Ca 0.00 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 2buf h LEU 253 Cb 0.42 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 2buf h LEU 253 CO 0.00 0.87 0.02 -0.65 0.09 0.00 0.00 178.44 178.77 2buf h PRO 254 N 0.36 0.15 -0.28 1.13 0.11 -1.76 -2.30 132.00 129.40 2buf h PRO 254 Ca 0.07 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 66.18 2buf h PRO 254 Cb 0.63 -0.02 -0.07 0.00 0.11 0.00 0.00 31.00 31.65 2buf h PRO 254 CO 0.04 0.35 -0.55 -0.22 -0.21 0.00 0.00 178.00 177.41 2buf h LYS 255 N -0.08 -0.46 0.00 1.05 3.64 -1.66 0.57 116.57 119.63 2buf h LYS 255 Ca 0.03 0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.39 2buf h LYS 255 Cb 0.27 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 2buf h LYS 255 CO 0.00 -0.31 -0.23 0.97 -2.27 0.00 0.00 179.45 177.62 2buf h ILE 256 N -0.48 0.63 0.03 2.00 2.10 -1.47 -2.57 117.51 117.76 2buf h ILE 256 Ca 0.05 -1.06 -0.00 0.00 1.08 0.00 0.00 64.86 64.94 2buf h ILE 256 Cb 0.63 1.69 0.00 0.00 -1.09 0.00 0.00 36.82 38.05 2buf h ILE 256 CO -0.52 0.23 -0.02 -0.09 -1.08 0.00 0.00 178.15 176.67 2buf h ARG 257 N 0.00 -0.04 -0.98 2.19 2.43 -0.57 -2.43 114.38 114.98 2buf h ARG 257 Ca -0.00 0.00 0.19 0.00 -0.81 0.00 0.00 59.98 59.36 2buf h ARG 257 Cb 0.68 0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 30.14 2buf h ARG 257 CO 0.03 0.49 0.61 0.00 -1.51 0.00 0.00 179.97 179.59 2buf n ALA 259 N -2.39 2.45 -0.03 0.00 0.00 -0.98 -1.19 120.51 118.38 2buf n ALA 259 Ca 0.22 -0.09 -0.21 0.00 0.00 0.00 0.00 53.44 53.36 2buf n ALA 259 Cb 0.61 -1.40 -0.13 0.00 0.00 0.00 0.00 19.45 18.52 2buf n ALA 259 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2buf h LEU 260 N 0.00 0.26 -1.15 0.00 3.38 -0.84 -3.21 115.31 113.74 2buf h LEU 260 Ca 0.00 -0.77 0.06 0.00 0.09 0.00 0.00 57.88 57.26 2buf h LEU 260 Cb 0.70 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.30 2buf h LEU 260 CO 0.00 1.64 0.58 -0.33 0.09 0.00 0.00 178.44 180.42 2buf h GLU 261 N -0.44 0.99 -0.83 1.13 5.08 -1.37 0.15 114.58 119.30 2buf h GLU 261 Ca -0.35 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 2buf h GLU 261 Cb 1.67 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 30.66 2buf h GLU 261 CO -0.02 0.65 0.52 0.00 -1.00 0.00 0.00 179.01 179.16 2buf h ALA 262 N 1.51 1.36 0.00 3.43 0.00 -1.25 0.29 119.26 124.60 2buf h ALA 262 Ca 0.39 -0.08 -0.20 0.00 0.00 0.00 0.00 54.91 55.02 2buf h ALA 262 Cb 0.20 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2buf h ALA 262 CO -0.14 0.57 -1.09 0.28 0.00 0.00 0.00 179.25 178.87 2buf h VAL 263 N 1.13 1.23 0.00 0.00 2.07 -1.14 -0.32 116.25 119.22 2buf h VAL 263 Ca 0.30 -2.88 -0.01 0.00 0.82 0.00 0.00 66.70 64.93 2buf h VAL 263 Cb -0.08 2.59 -0.00 0.00 -1.52 0.00 0.00 31.29 32.27 2buf h VAL 263 CO -0.06 0.70 -0.21 -0.61 0.02 0.00 0.00 177.57 177.42 2buf h GLN 264 N 0.00 0.00 -0.12 1.57 5.75 -0.88 -3.14 115.11 118.29 2buf h GLN 264 Ca -0.08 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.42 2buf h GLN 264 Cb 1.72 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.27 2buf h GLN 264 CO 0.10 0.02 0.00 0.41 -2.65 0.00 0.00 178.83 176.71 2buf n GLY 265 N 1.12 -0.08 0.19 2.39 0.00 1.00 -4.92 105.19 104.88 2buf n GLY 265 Ca 0.03 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 1.02 0.94 3.78 -0.02 0.00 -1.15 -4.80 105.19 104.96 2buf n GLY 266 Ca 0.15 -0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 2buf n GLY 266 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2buf s VAL 267 N -2.00 5.06 0.41 1.61 1.01 -0.14 -4.62 120.40 121.73 2buf s VAL 267 Ca 0.00 0.92 0.15 0.00 0.00 0.00 0.00 61.98 63.04 2buf s VAL 267 Cb 0.00 -3.77 0.15 0.00 0.00 0.00 0.00 36.38 32.76 2buf s VAL 267 CO 0.00 0.47 1.92 0.74 0.00 0.00 0.00 175.10 178.24 2buf h THR 268 N 4.11 1.14 -1.72 3.92 2.02 -1.65 -3.39 112.91 117.34 2buf h THR 268 Ca -0.47 -0.91 0.05 0.00 0.77 0.00 0.00 66.41 65.86 2buf h THR 268 Cb 1.20 1.50 -0.25 0.00 -1.74 0.00 0.00 68.15 68.86 2buf h THR 268 CO 0.68 0.26 0.30 -0.94 0.37 0.00 0.00 175.52 176.18 2buf s SER 269 N -6.90 -0.61 0.02 4.18 1.04 -1.19 -4.44 113.70 105.81 2buf s SER 269 Ca -0.03 1.07 -0.00 0.00 0.48 0.00 0.00 55.95 57.46 2buf s SER 269 Cb 0.15 1.16 -0.04 0.00 0.10 0.00 0.00 66.02 67.39 2buf s SER 269 CO 0.70 -0.18 0.12 0.00 0.98 0.00 0.00 173.24 174.86 2buf s ALA 270 N 0.83 3.71 -0.20 5.32 0.00 0.59 -1.79 121.76 130.21 2buf s ALA 270 Ca -0.03 -0.87 -0.04 0.00 0.00 0.00 0.00 51.96 51.02 2buf s ALA 270 Cb -0.05 -1.65 0.09 0.00 0.00 0.00 0.00 23.12 21.52 2buf s ALA 270 CO -0.10 0.73 0.22 -1.58 0.00 0.00 0.00 175.76 175.03 2buf s HIS 271 N -1.30 -0.26 -0.20 0.00 2.46 -0.28 -0.52 115.29 115.19 2buf s HIS 271 Ca 0.27 0.18 -0.28 0.00 0.47 0.00 0.00 55.06 55.70 2buf s HIS 271 Cb -0.12 -0.38 0.00 0.00 -0.13 0.00 0.00 32.58 31.95 2buf s HIS 271 CO 0.18 -0.61 0.98 0.42 -2.47 0.00 0.00 174.74 173.24 2buf s ILE 272 N 2.32 4.75 0.02 0.89 -1.09 0.14 -0.89 121.20 127.34 2buf s ILE 272 Ca 0.07 1.92 0.05 0.00 -2.23 0.00 0.00 60.65 60.46 2buf s ILE 272 Cb -0.16 -4.26 -0.02 0.00 -1.58 0.00 0.00 42.46 36.44 2buf s ILE 272 CO -0.13 -0.10 -0.16 -0.63 -1.23 0.00 0.00 174.94 172.69 2buf s ILE 273 N 2.80 1.29 -0.45 2.92 1.01 0.17 -2.87 121.20 126.07 2buf s ILE 273 Ca 0.43 -0.94 -0.27 0.00 0.00 0.00 0.00 60.65 59.86 2buf s ILE 273 Cb -0.16 -1.13 -0.04 0.00 0.01 0.00 0.00 42.46 41.14 2buf s ILE 273 CO 0.09 0.17 2.07 -0.62 0.00 0.00 0.00 174.94 176.65 2buf s ASP 274 N -0.90 5.19 0.00 3.58 -1.08 -1.25 -1.59 116.67 120.61 2buf s ASP 274 Ca 0.05 1.02 0.00 0.00 -0.52 0.00 0.00 52.55 53.10 2buf s ASP 274 Cb -0.07 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 38.87 2buf s ASP 274 CO 0.01 -2.31 0.76 0.61 0.52 0.00 0.00 175.17 174.75 2buf n GLY 275 N 5.74 -0.75 0.11 2.66 0.00 0.32 -3.30 105.19 109.97 2buf n GLY 275 Ca 0.27 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.50 0.67 -1.70 1.61 1.74 -1.26 -4.72 116.66 112.51 2buf n ARG 276 Ca 0.00 0.10 -0.57 0.00 -0.77 0.00 0.00 57.85 56.61 2buf n ARG 276 Cb 0.00 -1.55 -0.07 0.00 -1.02 0.00 0.00 32.46 29.82 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 -3.05 0.28 -0.00 1.55 0.31 -1.21 -4.77 118.33 111.44 2buf n VAL 277 Ca -0.37 -0.05 -0.00 0.00 -0.01 0.00 0.00 64.34 63.91 2buf n VAL 277 Cb 1.07 -1.18 -0.00 0.00 -0.91 0.00 0.00 33.84 32.82 2buf n VAL 277 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2buf n PRO 278 N 5.14 -0.00 -3.32 5.55 -0.02 -1.26 -2.18 135.00 138.90 2buf n PRO 278 Ca 0.26 0.02 -0.27 0.00 -2.02 0.00 0.00 63.50 61.50 2buf n PRO 278 Cb 0.13 -0.04 -0.07 0.00 -0.02 0.00 0.00 33.50 33.50 2buf n PRO 278 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2buf n ASN 279 N -2.37 3.74 0.25 2.55 0.23 -1.26 -4.40 115.26 114.00 2buf n ASN 279 Ca 0.00 -3.46 0.07 0.00 -0.53 0.00 0.00 54.58 50.67 2buf n ASN 279 Cb 0.00 -0.65 0.60 0.00 -2.08 0.00 0.00 39.78 37.65 2buf n ASN 279 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2buf h ALA 280 N 3.94 1.80 0.55 -2.53 0.00 -1.76 -2.49 119.26 118.78 2buf h ALA 280 Ca 0.18 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2buf h ALA 280 Cb 0.64 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.42 2buf h ALA 280 CO 0.82 0.11 -0.26 0.28 0.00 0.00 0.00 179.25 180.20 2buf h VAL 281 N 0.00 0.00 -0.87 0.00 2.07 -1.90 -3.04 116.25 112.51 2buf h VAL 281 Ca -0.00 -0.05 0.22 0.00 0.82 0.00 0.00 66.70 67.69 2buf h VAL 281 Cb 0.16 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 29.80 2buf h VAL 281 CO 0.01 0.00 0.32 -0.07 0.02 0.00 0.00 177.57 177.85 2buf h LEU 282 N -0.79 0.18 -1.83 2.57 3.38 -1.87 -1.05 115.31 115.91 2buf h LEU 282 Ca -0.08 0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2buf h LEU 282 Cb 0.57 0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 2buf h LEU 282 CO 0.12 -0.06 -0.11 -0.07 0.09 0.00 0.00 178.44 178.41 2buf h LEU 283 N 0.32 0.00 -0.05 1.67 3.38 -1.41 0.25 115.31 119.46 2buf h LEU 283 Ca 0.55 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.52 2buf h LEU 283 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2buf h LEU 283 CO -0.57 0.11 -0.45 1.21 0.09 0.00 0.00 178.44 178.82 2buf n GLU 284 N -4.31 0.10 0.00 1.13 4.07 -0.42 -3.56 120.64 117.65 2buf n GLU 284 Ca -0.03 -0.05 0.00 0.00 -0.06 0.00 0.00 57.16 57.02 2buf n GLU 284 Cb 0.18 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.07 2buf n GLU 284 CO 0.00 0.00 0.00 -0.89 -0.06 0.00 0.00 177.13 176.18 2buf n ILE 285 N -1.40 0.00 0.13 6.31 2.08 -0.69 -4.69 119.36 121.11 2buf n ILE 285 Ca 0.06 0.14 0.07 0.00 0.56 0.00 0.00 62.75 63.59 2buf n ILE 285 Cb 0.34 -1.05 0.39 0.00 -0.75 0.00 0.00 39.64 38.56 2buf n ILE 285 CO 0.00 0.00 0.00 0.49 0.56 0.00 0.00 176.55 177.60 2buf n PHE 286 N -1.80 0.48 -3.87 1.39 3.01 0.81 -4.59 117.46 112.89 2buf n PHE 286 Ca 0.00 0.25 -0.10 0.00 1.01 0.00 0.00 57.45 58.61 2buf n PHE 286 Cb 0.00 -0.80 -0.09 0.00 -0.01 0.00 0.00 39.48 38.58 2buf n PHE 286 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2buf s THR 287 N -3.32 0.11 -0.52 4.37 2.01 -1.23 -4.81 115.64 112.25 2buf s THR 287 Ca -0.02 -0.94 0.01 0.00 0.31 0.00 0.00 61.69 61.05 2buf s THR 287 Cb 0.04 -0.88 0.14 0.00 0.01 0.00 0.00 72.50 71.81 2buf s THR 287 CO 0.13 -0.52 0.29 -0.62 -0.69 0.00 0.00 174.62 173.21 2buf s ASP 288 N -2.06 4.77 -0.16 3.53 2.15 -1.26 -4.01 116.67 119.64 2buf s ASP 288 Ca -0.06 -2.77 -0.00 0.00 0.43 0.00 0.00 52.55 50.15 2buf s ASP 288 Cb -0.01 -1.73 -0.00 0.00 -0.30 0.00 0.00 42.92 40.88 2buf s ASP 288 CO -0.04 -0.32 -0.15 -0.55 -0.17 0.00 0.00 175.17 173.94 2buf s SER 289 N 0.38 3.68 -0.12 -0.34 0.15 -1.26 -5.05 113.70 111.14 2buf s SER 289 Ca 0.15 -0.48 -0.05 0.00 0.70 0.00 0.00 55.95 56.28 2buf s SER 289 Cb -0.23 -1.57 -0.15 0.00 -1.71 0.00 0.00 66.02 62.36 2buf s SER 289 CO -0.03 0.07 3.20 0.61 1.20 0.00 0.00 173.24 178.30 2buf n GLY 290 N 4.17 3.31 3.88 9.45 0.00 -1.26 -4.92 105.19 119.81 2buf n GLY 290 Ca -0.19 -1.25 -0.35 0.00 0.00 0.00 0.00 46.02 44.23 2buf n GLY 290 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2buf s VAL 291 N 0.01 5.23 0.00 1.61 -7.23 -1.26 -4.98 120.40 113.78 2buf s VAL 291 Ca 0.57 0.30 0.00 0.00 -1.81 0.00 0.00 61.98 61.04 2buf s VAL 291 Cb 0.30 -3.59 0.00 0.00 0.56 0.00 0.00 36.38 33.65 2buf s VAL 291 CO -0.05 0.37 0.00 0.61 -0.31 0.00 0.00 175.10 175.72 2buf n GLY 292 N 1.16 0.54 3.65 2.32 0.00 -1.26 -4.91 105.19 106.68 2buf n GLY 292 Ca -0.11 -1.87 -0.43 0.00 0.00 0.00 0.00 46.02 43.61 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 -2.05 4.66 -0.40 2.61 2.01 -1.14 -4.73 115.64 116.60 2buf s THR 293 Ca 0.00 1.80 -0.03 0.00 0.31 0.00 0.00 61.69 63.76 2buf s THR 293 Cb 0.00 -4.30 0.10 0.00 0.01 0.00 0.00 72.50 68.31 2buf s THR 293 CO 0.00 -0.26 0.18 -0.22 -0.69 0.00 0.00 174.62 173.63 2buf s LEU 294 N 3.26 5.07 -0.00 4.42 2.96 -1.26 -0.69 118.68 132.44 2buf s LEU 294 Ca 0.42 -1.87 -0.29 0.00 -0.22 0.00 0.00 54.13 52.16 2buf s LEU 294 Cb -0.14 -1.83 -0.03 0.00 0.50 0.00 0.00 46.19 44.69 2buf s LEU 294 CO 0.10 -0.51 0.95 -0.63 -1.32 0.00 0.00 176.35 174.94 2buf s ILE 295 N 1.19 4.88 -0.01 6.68 1.01 0.32 -0.75 121.20 134.53 2buf s ILE 295 Ca 0.06 2.00 -0.19 0.00 0.00 0.00 0.00 60.65 62.51 2buf s ILE 295 Cb -0.22 -4.29 0.04 0.00 0.01 0.00 0.00 42.46 37.99 2buf s ILE 295 CO -0.03 0.17 0.42 -0.55 0.00 0.00 0.00 174.94 174.95 2buf s SER 296 N 0.97 -0.32 -0.65 3.58 0.15 -1.26 -0.30 113.70 115.87 2buf s SER 296 Ca 0.51 0.20 -0.15 0.00 0.70 0.00 0.00 55.95 57.21 2buf s SER 296 Cb -0.21 0.39 0.16 0.00 -1.71 0.00 0.00 66.02 64.66 2buf s SER 296 CO 0.27 -0.54 0.60 0.21 1.20 0.00 0.00 173.24 174.98 2buf s ASN 297 N -1.48 6.40 0.04 5.45 3.04 -1.26 -4.91 114.94 122.22 2buf s ASN 297 Ca -0.11 -2.13 -0.24 0.00 0.04 0.00 0.00 52.86 50.42 2buf s ASN 297 Cb -0.03 -2.21 -0.06 0.00 -1.54 0.00 0.00 41.25 37.42 2buf s ASN 297 CO 0.04 -0.75 0.72 -0.13 -3.04 0.00 0.00 177.10 173.94 2buf s ARG 298 N 1.05 4.45 0.49 0.43 0.52 -1.26 -5.06 118.95 119.58 2buf s ARG 298 Ca 0.09 0.99 0.01 0.00 -0.52 0.00 0.00 55.73 56.30 2buf s ARG 298 Cb -0.23 -3.35 -0.01 0.00 0.52 0.00 0.00 34.95 31.89 2buf s ARG 298 CO -0.02 0.33 0.04 0.15 0.02 0.00 0.00 175.30 175.82 2buf s LYS 299 N -0.18 2.15 0.00 3.54 1.02 -1.26 -5.26 119.74 119.76 2buf s LYS 299 Ca 0.36 -2.37 0.00 0.00 0.02 0.00 0.00 55.97 53.98 2buf s LYS 299 Cb -0.20 -1.27 0.00 0.00 -0.52 0.00 0.00 37.83 35.84 2buf s LYS 299 CO 0.22 -0.42 0.00 -2.13 -0.92 0.00 0.00 175.35 172.09