#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bia s LYS 2 N 0.00 3.31 -0.43 2.12 -2.85 -1.26 -4.98 119.74 115.65 1bia s LYS 2 Ca 0.00 2.11 -0.19 0.00 -1.00 0.00 0.00 55.97 56.89 1bia s LYS 2 Cb 0.00 -2.30 0.02 0.00 -2.06 0.00 0.00 37.83 33.49 1bia s LYS 2 CO 0.00 -1.01 0.53 0.34 0.10 0.00 0.00 175.35 175.31 1bia s ASP 3 N -1.06 6.25 -0.25 0.03 -1.08 -1.26 -4.95 116.67 114.35 1bia s ASP 3 Ca 0.69 -0.54 0.12 0.00 -0.52 0.00 0.00 52.55 52.30 1bia s ASP 3 Cb -0.37 -2.27 0.52 0.00 -1.46 0.00 0.00 42.92 39.34 1bia s ASP 3 CO 0.44 -0.68 1.47 0.59 0.52 0.00 0.00 175.17 177.51 1bia n ASN 4 N 5.91 3.08 -0.21 -0.34 4.13 -1.26 -4.79 115.26 121.77 1bia n ASN 4 Ca -0.05 -3.46 -0.01 0.00 1.68 0.00 0.00 54.58 52.74 1bia n ASN 4 Cb 0.47 -0.61 0.10 0.00 -1.54 0.00 0.00 39.78 38.21 1bia n ASN 4 CO 0.00 0.00 0.00 0.74 0.28 0.00 0.00 177.26 178.28 1bia h THR 5 N 1.29 0.88 0.42 3.41 2.02 -1.99 -2.25 112.91 116.68 1bia h THR 5 Ca 0.15 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 1bia h THR 5 Cb 1.63 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 68.33 1bia h THR 5 CO 0.36 0.10 -0.20 0.58 0.37 0.00 0.00 175.52 176.73 1bia h VAL 6 N 0.54 0.49 -0.45 3.16 2.07 -1.98 0.42 116.25 120.50 1bia h VAL 6 Ca 0.30 -0.51 0.09 0.00 0.82 0.00 0.00 66.70 67.40 1bia h VAL 6 Cb 0.28 0.69 -0.09 0.00 -1.52 0.00 0.00 31.29 30.65 1bia h VAL 6 CO -0.23 0.08 -0.13 -0.65 0.02 0.00 0.00 177.57 176.65 1bia h PRO 7 N -0.89 -0.03 0.06 1.57 0.11 -1.89 1.45 132.00 132.37 1bia h PRO 7 Ca -0.06 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.08 1bia h PRO 7 Cb 0.56 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.64 1bia h PRO 7 CO 0.09 -0.02 -0.21 -0.07 -0.21 0.00 0.00 178.00 177.59 1bia h LEU 8 N -0.03 -0.60 -1.29 2.35 3.38 -1.38 2.36 115.31 120.10 1bia h LEU 8 Ca 0.22 0.08 0.19 0.00 0.09 0.00 0.00 57.88 58.46 1bia h LEU 8 Cb 0.36 0.24 -0.08 0.00 0.09 0.00 0.00 40.66 41.26 1bia h LEU 8 CO -0.48 -0.28 0.61 0.11 0.09 0.00 0.00 178.44 178.48 1bia h LYS 9 N -0.36 0.56 0.00 1.13 1.57 0.19 0.19 116.57 119.86 1bia h LYS 9 Ca 0.04 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1bia h LYS 9 Cb 0.41 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1bia h LYS 9 CO -0.15 0.37 -0.00 1.25 -0.57 0.00 0.00 179.45 180.35 1bia h LEU 10 N 0.58 -0.00 -1.82 2.94 5.85 0.51 -1.76 115.31 121.60 1bia h LEU 10 Ca 0.51 -0.58 0.07 0.00 0.84 0.00 0.00 57.88 58.72 1bia h LEU 10 Cb 1.03 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 1bia h LEU 10 CO -0.26 0.58 0.27 -0.29 -0.34 0.00 0.00 178.44 178.41 1bia h ILE 11 N -0.59 0.91 -0.74 4.05 2.10 0.54 0.23 117.51 124.00 1bia h ILE 11 Ca -0.00 -0.07 -0.04 0.00 1.08 0.00 0.00 64.86 65.83 1bia h ILE 11 Cb 0.59 0.68 -0.03 0.00 -1.09 0.00 0.00 36.82 36.96 1bia h ILE 11 CO 0.00 0.04 0.33 0.00 -1.08 0.00 0.00 178.15 177.44 1bia h ALA 12 N 1.79 0.96 -0.11 0.18 0.00 -0.50 0.82 119.26 122.41 1bia h ALA 12 Ca 0.18 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1bia h ALA 12 Cb 0.45 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1bia h ALA 12 CO -0.03 0.56 0.07 -0.07 0.00 0.00 0.00 179.25 179.77 1bia h LEU 13 N 1.06 0.13 -1.10 0.00 3.38 0.33 -2.91 115.31 116.20 1bia h LEU 13 Ca 0.25 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.14 1bia h LEU 13 Cb 0.17 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1bia h LEU 13 CO -0.03 0.14 -0.18 -0.07 0.09 0.00 0.00 178.44 178.39 1bia h LEU 14 N 0.11 0.00 -1.20 1.67 3.38 -1.07 -3.37 115.31 114.83 1bia h LEU 14 Ca 0.04 0.00 0.44 0.00 0.09 0.00 0.00 57.88 58.45 1bia h LEU 14 Cb 0.03 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.64 1bia h LEU 14 CO -0.01 0.18 0.74 0.00 0.09 0.00 0.00 178.44 179.44 1bia n ALA 15 N -2.19 1.20 0.01 1.53 0.00 0.26 -1.26 120.51 120.06 1bia n ALA 15 Ca 0.00 0.88 0.00 0.00 0.00 0.00 0.00 53.44 54.32 1bia n ALA 15 Cb 0.42 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1bia n ALA 15 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1bia n ASN 16 N -4.80 0.00 0.00 0.00 0.23 -1.26 -1.58 115.26 107.84 1bia n ASN 16 Ca 0.38 0.15 0.00 0.00 -0.53 0.00 0.00 54.58 54.58 1bia n ASN 16 Cb 1.42 -0.16 0.00 0.00 -2.08 0.00 0.00 39.78 38.96 1bia n ASN 16 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1bia n GLY 17 N -1.15 0.58 0.00 4.83 0.00 -0.39 -4.61 105.19 104.46 1bia n GLY 17 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1bia n GLY 17 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1bia n GLU 18 N -1.94 0.57 -3.75 1.61 -0.00 -1.26 -4.25 120.64 111.63 1bia n GLU 18 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 57.16 56.80 1bia n GLU 18 Cb 0.02 0.00 -0.06 0.00 -0.00 0.00 0.00 31.44 31.41 1bia n GLU 18 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 1bia s PHE 19 N -0.05 3.60 -0.11 -1.84 0.08 -1.26 -4.13 117.98 114.27 1bia s PHE 19 Ca 0.00 0.62 -0.06 0.00 0.12 0.00 0.00 56.93 57.61 1bia s PHE 19 Cb 0.00 -2.02 0.04 0.00 -0.57 0.00 0.00 43.02 40.47 1bia s PHE 19 CO 0.00 0.64 0.26 -1.01 -0.10 0.00 0.00 175.22 175.01 1bia s HIS 20 N -1.21 -0.34 0.20 0.36 3.76 0.54 -4.97 115.29 113.62 1bia s HIS 20 Ca 0.24 0.80 -0.04 0.00 -0.15 0.00 0.00 55.06 55.91 1bia s HIS 20 Cb -0.13 0.07 -0.05 0.00 1.11 0.00 0.00 32.58 33.57 1bia s HIS 20 CO 0.13 -0.22 0.43 -1.54 -0.85 0.00 0.00 174.74 172.69 1bia s SER 21 N 1.06 6.46 0.23 1.40 1.04 -1.26 0.25 113.70 122.88 1bia s SER 21 Ca -0.08 0.58 -0.07 0.00 0.48 0.00 0.00 55.95 56.87 1bia s SER 21 Cb -0.09 -2.09 0.38 0.00 0.10 0.00 0.00 66.02 64.32 1bia s SER 21 CO -0.07 -0.03 1.72 1.23 0.98 0.00 0.00 173.24 177.07 1bia h GLY 22 N 2.33 0.97 0.23 7.32 0.00 -1.94 0.62 103.07 112.60 1bia h GLY 22 Ca -0.47 -0.10 0.10 0.00 0.00 0.00 0.00 47.33 46.86 1bia h GLY 22 CO 0.70 -0.09 0.05 0.83 0.00 0.00 0.00 176.54 178.03 1bia h GLU 23 N 0.38 0.17 0.40 4.80 3.07 -1.95 0.92 114.58 122.37 1bia h GLU 23 Ca 0.37 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 59.20 1bia h GLU 23 Cb 0.54 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.40 1bia h GLU 23 CO -0.39 0.11 -0.26 1.96 -1.40 0.00 0.00 179.01 179.03 1bia h GLN 24 N 0.17 -0.61 0.50 2.33 4.20 -1.18 -2.42 115.11 118.11 1bia h GLN 24 Ca 0.26 0.04 -0.02 0.00 0.06 0.00 0.00 58.65 59.00 1bia h GLN 24 Cb 0.38 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 1bia h GLN 24 CO -0.39 -0.41 -0.34 -0.07 -0.67 0.00 0.00 178.83 176.95 1bia h LEU 25 N -0.63 -0.88 -0.99 1.46 3.38 0.97 -2.89 115.31 115.72 1bia h LEU 25 Ca -0.04 0.06 0.25 0.00 0.09 0.00 0.00 57.88 58.24 1bia h LEU 25 Cb 0.53 0.27 -0.19 0.00 0.09 0.00 0.00 40.66 41.36 1bia h LEU 25 CO 0.03 -0.52 -0.05 1.23 0.09 0.00 0.00 178.44 179.22 1bia h GLY 26 N -0.81 1.10 0.88 0.83 0.00 0.95 0.27 103.07 106.29 1bia h GLY 26 Ca -0.05 0.21 -0.10 0.00 0.00 0.00 0.00 47.33 47.38 1bia h GLY 26 CO 0.03 -0.48 -0.25 1.05 0.00 0.00 0.00 176.54 176.89 1bia h GLU 27 N 0.00 0.56 -0.26 4.80 9.09 -1.39 2.57 114.58 129.96 1bia h GLU 27 Ca 0.57 -0.31 -0.04 0.00 0.05 0.00 0.00 59.36 59.64 1bia h GLU 27 Cb 1.10 0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 28.20 1bia h GLU 27 CO -0.95 0.90 0.00 1.79 0.05 0.00 0.00 179.01 180.79 1bia h THR 28 N 0.25 1.16 0.00 -1.06 1.35 -0.72 -2.84 112.91 111.06 1bia h THR 28 Ca 0.03 -0.63 0.00 0.00 -0.55 0.00 0.00 66.41 65.26 1bia h THR 28 Cb 0.81 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 68.19 1bia h THR 28 CO 0.06 0.21 -1.22 0.18 -0.25 0.00 0.00 175.52 174.50 1bia n LEU 29 N -4.33 0.64 -2.02 3.87 4.77 0.73 -5.00 117.00 115.67 1bia n LEU 29 Ca 0.01 0.23 -0.03 0.00 -0.03 0.00 0.00 56.01 56.19 1bia n LEU 29 Cb 0.21 -0.05 0.02 0.00 -2.33 0.00 0.00 43.42 41.27 1bia n LEU 29 CO 0.38 -0.13 0.04 0.61 -1.33 0.00 0.00 177.39 176.95 1bia n GLY 30 N 1.21 0.04 3.60 -0.72 0.00 0.85 -5.04 105.19 105.13 1bia n GLY 30 Ca -0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 46.02 45.97 1bia n GLY 30 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1bia s MET 31 N -3.31 0.39 0.67 1.61 0.23 0.00 -5.03 119.30 113.87 1bia s MET 31 Ca 0.10 -0.17 -0.17 0.00 -1.03 0.00 0.00 55.69 54.42 1bia s MET 31 Cb -0.01 0.16 -0.05 0.00 -1.53 0.00 0.00 34.83 33.39 1bia s MET 31 CO 0.23 -0.17 0.54 0.45 -2.03 0.00 0.00 175.02 174.04 1bia n SER 32 N -0.22 -1.07 0.00 -1.18 2.88 -1.26 -4.39 113.62 108.38 1bia n SER 32 Ca -0.03 0.64 0.13 0.00 -1.33 0.00 0.00 58.87 58.28 1bia n SER 32 Cb 0.60 -1.21 0.62 0.00 -0.75 0.00 0.00 64.21 63.47 1bia n SER 32 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1bia n ARG 33 N -0.52 0.26 0.07 -1.46 0.63 -1.26 -1.92 116.66 112.46 1bia n ARG 33 Ca 0.11 0.05 -0.20 0.00 -0.92 0.00 0.00 57.85 56.88 1bia n ARG 33 Cb 0.49 -1.50 -0.15 0.00 0.45 0.00 0.00 32.46 31.75 1bia n ARG 33 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1bia h ALA 34 N 3.12 0.20 0.35 5.13 0.00 -1.97 -2.41 119.26 123.68 1bia h ALA 34 Ca 0.00 -1.11 -0.02 0.00 0.00 0.00 0.00 54.91 53.78 1bia h ALA 34 Cb 0.30 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1bia h ALA 34 CO 0.00 1.06 -0.17 0.00 0.00 0.00 0.00 179.25 180.14 1bia h ALA 35 N 0.31 -0.48 -0.63 0.00 0.00 -1.73 -1.73 119.26 115.00 1bia h ALA 35 Ca -0.29 -0.15 0.12 0.00 0.00 0.00 0.00 54.91 54.60 1bia h ALA 35 Cb 2.06 0.18 -0.12 0.00 0.00 0.00 0.00 17.79 19.92 1bia h ALA 35 CO 0.18 -0.69 -0.21 0.82 0.00 0.00 0.00 179.25 179.35 1bia h ILE 36 N -0.62 0.30 -0.95 0.00 5.03 -1.61 3.13 117.51 122.80 1bia h ILE 36 Ca -0.05 0.00 0.12 0.00 -0.12 0.00 0.00 64.86 64.82 1bia h ILE 36 Cb 0.45 0.30 -0.09 0.00 -3.03 0.00 0.00 36.82 34.46 1bia h ILE 36 CO 0.08 0.00 0.57 -1.13 -0.68 0.00 0.00 178.15 176.99 1bia h ASN 37 N -0.05 0.81 -0.66 1.72 -0.73 -1.24 0.12 115.58 115.56 1bia h ASN 37 Ca 0.29 0.06 -0.00 0.00 1.87 0.00 0.00 56.30 58.52 1bia h ASN 37 Cb 0.50 -0.10 -0.03 0.00 0.27 0.00 0.00 38.32 38.96 1bia h ASN 37 CO -0.67 0.42 0.40 0.11 -0.37 0.00 0.00 177.43 177.32 1bia h LYS 38 N 0.88 0.88 0.00 6.67 1.79 0.65 -2.37 116.57 125.07 1bia h LYS 38 Ca 0.48 -0.08 -0.10 0.00 -2.18 0.00 0.00 60.65 58.77 1bia h LYS 38 Cb 0.52 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.97 1bia h LYS 38 CO -0.28 0.62 -0.47 0.45 -1.08 0.00 0.00 179.45 178.69 1bia h HIS 39 N 0.89 0.00 -0.31 -1.35 3.86 0.22 -2.44 115.15 116.01 1bia h HIS 39 Ca 0.24 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.42 1bia h HIS 39 Cb -0.04 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.41 1bia h HIS 39 CO -0.02 0.47 0.08 0.82 0.86 0.00 0.00 177.93 180.14 1bia h ILE 40 N 0.00 1.15 -0.74 2.45 5.03 -0.27 -2.09 117.51 123.04 1bia h ILE 40 Ca -0.00 -0.52 -0.04 0.00 -0.12 0.00 0.00 64.86 64.17 1bia h ILE 40 Cb 0.93 0.83 -0.03 0.00 -3.03 0.00 0.00 36.82 35.52 1bia h ILE 40 CO 0.06 0.19 0.29 -0.61 -0.68 0.00 0.00 178.15 177.40 1bia h GLN 41 N 0.45 1.09 0.43 2.37 5.75 -1.16 -1.52 115.11 122.52 1bia h GLN 41 Ca 0.11 -0.19 -0.01 0.00 -0.15 0.00 0.00 58.65 58.41 1bia h GLN 41 Cb 0.17 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.52 1bia h GLN 41 CO -0.00 0.89 -0.38 1.15 -2.65 0.00 0.00 178.83 177.83 1bia h THR 42 N 1.07 0.22 -0.85 2.39 2.02 -1.39 0.44 112.91 116.80 1bia h THR 42 Ca 0.25 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.53 1bia h THR 42 Cb 0.21 0.22 -0.12 0.00 -1.74 0.00 0.00 68.15 66.72 1bia h THR 42 CO -0.02 0.00 -0.50 -0.07 0.37 0.00 0.00 175.52 175.30 1bia h LEU 43 N -0.82 -1.80 -1.36 2.58 3.38 -1.20 4.28 115.31 120.36 1bia h LEU 43 Ca -0.04 0.30 0.30 0.00 0.09 0.00 0.00 57.88 58.53 1bia h LEU 43 Cb 0.72 0.83 -0.10 0.00 0.09 0.00 0.00 40.66 42.19 1bia h LEU 43 CO -0.03 -0.28 0.70 0.03 0.09 0.00 0.00 178.44 178.94 1bia h ARG 44 N -0.09 0.33 0.00 1.13 3.08 -0.30 1.25 114.38 119.79 1bia h ARG 44 Ca 0.21 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.19 1bia h ARG 44 Cb 0.51 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1bia h ARG 44 CO -0.87 0.22 -0.22 -0.44 -1.07 0.00 0.00 179.97 177.59 1bia h ASP 45 N 0.34 0.00 -0.33 7.04 3.32 1.29 -2.93 116.42 125.15 1bia h ASP 45 Ca 0.64 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.69 1bia h ASP 45 Cb 1.69 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.24 1bia h ASP 45 CO -0.32 0.22 0.00 0.79 -1.72 0.00 0.00 179.24 178.20 1bia n TRP 46 N -3.51 1.08 -0.21 4.55 8.01 0.43 -4.87 117.44 122.93 1bia n TRP 46 Ca -0.01 -0.38 0.00 0.00 -1.31 0.00 0.00 57.50 55.80 1bia n TRP 46 Cb 0.38 -0.29 0.00 0.00 -2.01 0.00 0.00 31.31 29.39 1bia n TRP 46 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1bia n GLY 47 N 0.44 2.34 3.77 6.99 0.00 -1.11 -1.34 105.19 116.28 1bia n GLY 47 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1bia n GLY 47 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bia s VAL 48 N -3.13 2.23 -0.68 1.61 1.01 -1.12 -4.74 120.40 115.58 1bia s VAL 48 Ca 0.00 0.22 -0.19 0.00 0.00 0.00 0.00 61.98 62.02 1bia s VAL 48 Cb 0.00 -3.14 0.12 0.00 0.00 0.00 0.00 36.38 33.36 1bia s VAL 48 CO 0.00 0.05 0.81 -0.62 0.00 0.00 0.00 175.10 175.34 1bia s ASP 49 N -0.12 6.32 -0.33 3.32 2.15 -1.26 -4.35 116.67 122.40 1bia s ASP 49 Ca 0.53 -1.64 0.03 0.00 0.43 0.00 0.00 52.55 51.91 1bia s ASP 49 Cb -0.45 -2.32 0.10 0.00 -0.30 0.00 0.00 42.92 39.95 1bia s ASP 49 CO 0.58 -1.08 0.05 0.54 -0.17 0.00 0.00 175.17 175.10 1bia s VAL 50 N 2.53 2.12 0.41 1.11 0.11 -1.26 -3.96 120.40 121.46 1bia s VAL 50 Ca 0.17 -2.22 -0.24 0.00 -2.93 0.00 0.00 61.98 56.75 1bia s VAL 50 Cb -0.19 -2.56 -0.08 0.00 -1.53 0.00 0.00 36.38 32.02 1bia s VAL 50 CO 0.02 -0.60 1.12 -0.36 -3.33 0.00 0.00 175.10 171.96 1bia s PHE 51 N 0.99 3.10 -0.06 1.54 2.99 -0.49 -4.85 117.98 121.21 1bia s PHE 51 Ca 0.10 1.59 0.06 0.00 0.00 0.00 0.00 56.93 58.68 1bia s PHE 51 Cb -0.19 -3.29 -0.01 0.00 0.00 0.00 0.00 43.02 39.53 1bia s PHE 51 CO -0.10 -1.09 -0.24 0.99 -0.00 0.00 0.00 175.22 174.78 1bia s THR 52 N -1.53 1.95 -0.18 0.64 2.01 -1.26 -2.22 115.64 115.04 1bia s THR 52 Ca 0.59 -1.00 -0.04 0.00 0.31 0.00 0.00 61.69 61.54 1bia s THR 52 Cb -0.27 -1.65 0.06 0.00 0.01 0.00 0.00 72.50 70.65 1bia s THR 52 CO 0.34 0.54 0.06 0.54 -0.69 0.00 0.00 174.62 175.41 1bia s VAL 53 N -0.09 0.20 0.00 3.82 0.11 0.12 -4.98 120.40 119.58 1bia s VAL 53 Ca -0.05 -0.36 0.00 0.00 -2.93 0.00 0.00 61.98 58.65 1bia s VAL 53 Cb -0.14 -0.79 0.00 0.00 -1.53 0.00 0.00 36.38 33.92 1bia s VAL 53 CO 0.04 -0.25 0.00 -2.65 -3.33 0.00 0.00 175.10 168.91 1bia n PRO 54 N 5.17 0.00 -0.65 1.54 -0.02 -1.26 0.99 135.00 140.77 1bia n PRO 54 Ca -0.08 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.35 1bia n PRO 54 Cb 0.48 0.00 -0.08 0.00 -0.02 0.00 0.00 33.50 33.88 1bia n PRO 54 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bia n GLY 55 N 0.00 2.46 2.01 -1.23 0.00 -1.26 -3.84 105.19 103.33 1bia n GLY 55 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1bia n GLY 55 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bia n LYS 56 N 2.10 0.00 0.00 1.61 5.02 0.28 -5.17 118.16 122.00 1bia n LYS 56 Ca 0.19 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 1bia n LYS 56 Cb 0.61 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.62 1bia n LYS 56 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bia n GLY 57 N 1.04 0.15 3.17 0.72 0.00 -0.26 -4.21 105.19 105.80 1bia n GLY 57 Ca 0.00 -1.50 -0.18 0.00 0.00 0.00 0.00 46.02 44.34 1bia n GLY 57 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bia s TYR 58 N -0.11 1.19 0.28 1.61 1.51 0.14 -0.70 117.35 121.27 1bia s TYR 58 Ca 0.00 -0.48 -0.21 0.00 -1.01 0.00 0.00 57.07 55.37 1bia s TYR 58 Cb 0.00 -0.67 0.03 0.00 -0.11 0.00 0.00 41.96 41.21 1bia s TYR 58 CO 0.00 0.05 0.76 -1.54 -1.11 0.00 0.00 175.55 173.72 1bia s SER 59 N -1.83 -0.21 -0.15 2.29 1.04 -0.94 -0.34 113.70 113.56 1bia s SER 59 Ca -0.01 -0.67 -0.03 0.00 0.48 0.00 0.00 55.95 55.72 1bia s SER 59 Cb -0.09 0.72 -0.02 0.00 0.10 0.00 0.00 66.02 66.72 1bia s SER 59 CO 0.02 -1.35 -0.06 -0.76 0.98 0.00 0.00 173.24 172.07 1bia s LEU 60 N -2.95 3.10 0.02 2.42 1.43 -1.26 -1.39 118.68 120.05 1bia s LEU 60 Ca 0.12 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 53.05 1bia s LEU 60 Cb -0.05 -1.74 0.06 0.00 0.03 0.00 0.00 46.19 44.49 1bia s LEU 60 CO 0.07 0.17 0.88 -0.81 0.23 0.00 0.00 176.35 176.88 1bia n PRO 61 N 3.54 0.01 -3.64 1.29 -0.04 -1.25 -4.39 135.00 130.51 1bia n PRO 61 Ca -0.18 0.35 -0.04 0.00 -0.04 0.00 0.00 63.50 63.60 1bia n PRO 61 Cb 0.52 -1.69 -0.07 0.00 -0.04 0.00 0.00 33.50 32.22 1bia n PRO 61 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1bia s GLU 62 N -2.72 0.38 0.85 0.54 2.12 -1.26 -5.11 118.70 113.50 1bia s GLU 62 Ca -0.00 0.60 -0.12 0.00 0.36 0.00 0.00 54.97 55.81 1bia s GLU 62 Cb 0.00 0.10 0.11 0.00 0.26 0.00 0.00 34.13 34.61 1bia s GLU 62 CO 0.01 -0.07 1.18 -2.30 -0.54 0.00 0.00 175.26 173.54 1bia n PRO 63 N 3.30 -0.07 -3.96 4.30 -0.02 -1.26 -4.69 135.00 132.61 1bia n PRO 63 Ca -0.17 0.06 -0.14 0.00 -2.02 0.00 0.00 63.50 61.23 1bia n PRO 63 Cb 0.57 -2.42 -0.03 0.00 -0.02 0.00 0.00 33.50 31.61 1bia n PRO 63 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1bia n ILE 64 N -3.67 0.00 -4.31 4.25 -5.35 -0.62 -4.93 119.36 104.74 1bia n ILE 64 Ca 0.13 -1.73 -0.29 0.00 -0.27 0.00 0.00 62.75 60.59 1bia n ILE 64 Cb 0.51 1.09 -0.11 0.00 -1.74 0.00 0.00 39.64 39.38 1bia n ILE 64 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 1bia s GLN 65 N -2.76 1.77 -0.02 6.28 0.74 -1.26 -4.81 119.66 119.60 1bia s GLN 65 Ca 0.28 -1.20 0.03 0.00 0.05 0.00 0.00 55.36 54.52 1bia s GLN 65 Cb -0.01 -2.10 -0.00 0.00 1.10 0.00 0.00 33.01 32.00 1bia s GLN 65 CO 0.20 0.47 -0.10 -0.51 -0.55 0.00 0.00 175.29 174.81 1bia s LEU 66 N -2.19 1.92 0.57 3.68 1.02 -1.26 -5.00 118.68 117.42 1bia s LEU 66 Ca 0.18 -0.19 -0.20 0.00 0.02 0.00 0.00 54.13 53.95 1bia s LEU 66 Cb -0.10 -0.54 -0.05 0.00 0.02 0.00 0.00 46.19 45.51 1bia s LEU 66 CO 0.10 0.10 1.04 0.18 0.02 0.00 0.00 176.35 177.79 1bia n LEU 67 N 3.02 3.89 -3.52 1.79 4.77 -1.26 -4.90 117.00 120.81 1bia n LEU 67 Ca -0.16 0.86 -0.25 0.00 -0.03 0.00 0.00 56.01 56.44 1bia n LEU 67 Cb 0.55 -1.42 -0.14 0.00 -2.33 0.00 0.00 43.42 40.09 1bia n LEU 67 CO 0.25 -1.59 -0.29 0.21 -1.33 0.00 0.00 177.39 174.64 1bia s ASN 68 N -1.13 2.77 0.25 -1.43 3.84 -1.26 -5.00 114.94 112.97 1bia s ASN 68 Ca 0.74 -0.97 -0.11 0.00 0.21 0.00 0.00 52.86 52.73 1bia s ASN 68 Cb -0.43 -0.09 0.36 0.00 -0.55 0.00 0.00 41.25 40.54 1bia s ASN 68 CO 0.48 -0.40 1.59 0.00 -2.79 0.00 0.00 177.10 175.98 1bia h ALA 69 N 8.37 0.53 -0.38 1.71 0.00 -1.92 -1.61 119.26 125.97 1bia h ALA 69 Ca -0.18 0.33 0.08 0.00 0.00 0.00 0.00 54.91 55.14 1bia h ALA 69 Cb 1.06 0.66 -0.09 0.00 0.00 0.00 0.00 17.79 19.42 1bia h ALA 69 CO 0.38 -0.41 -0.31 0.87 0.00 0.00 0.00 179.25 179.78 1bia h LYS 70 N -0.00 -0.24 -0.10 0.00 1.79 -1.97 0.39 116.57 116.43 1bia h LYS 70 Ca 0.40 0.02 0.02 0.00 -2.18 0.00 0.00 60.65 58.91 1bia h LYS 70 Cb 0.62 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.30 1bia h LYS 70 CO -0.87 -0.16 -0.05 1.96 -1.08 0.00 0.00 179.45 179.24 1bia h GLN 71 N -0.25 -0.04 0.78 3.15 4.20 -1.74 0.55 115.11 121.76 1bia h GLN 71 Ca 0.17 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.85 1bia h GLN 71 Cb 0.53 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.31 1bia h GLN 71 CO -0.52 -0.03 -0.48 0.82 -0.67 0.00 0.00 178.83 177.95 1bia h ILE 72 N -0.04 0.03 0.00 2.54 2.04 -0.77 -1.80 117.51 119.51 1bia h ILE 72 Ca 0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.92 1bia h ILE 72 Cb 0.13 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.24 1bia h ILE 72 CO -0.13 0.00 0.00 -0.07 0.00 0.00 0.00 178.15 177.95 1bia h LEU 73 N -1.19 0.00 -1.42 1.44 4.07 -0.10 0.10 115.31 118.21 1bia h LEU 73 Ca -0.10 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.82 1bia h LEU 73 Cb 0.95 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.69 1bia h LEU 73 CO 0.10 0.00 -0.18 1.23 -1.08 0.00 0.00 178.44 178.51 1bia h GLY 74 N 1.13 0.00 -1.51 0.83 0.00 1.00 -2.99 103.07 101.52 1bia h GLY 74 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1bia h GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1bia n GLN 75 N -3.46 2.95 -4.32 4.80 10.64 0.34 -4.98 117.38 123.36 1bia n GLN 75 Ca -0.01 -2.47 -0.23 0.00 -1.83 0.00 0.00 57.00 52.46 1bia n GLN 75 Cb 0.36 -1.58 -0.08 0.00 -0.86 0.00 0.00 30.24 28.08 1bia n GLN 75 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1bia s LEU 76 N -1.93 3.10 0.00 2.61 1.43 -1.13 -4.95 118.68 117.80 1bia s LEU 76 Ca 0.34 -0.69 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 1bia s LEU 76 Cb 0.24 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.82 1bia s LEU 76 CO 0.13 0.02 0.00 -0.90 0.23 0.00 0.00 176.35 175.82 1bia n ASP 77 N -0.78 0.00 -4.15 2.29 3.85 -1.26 -4.98 116.55 111.52 1bia n ASP 77 Ca -0.07 0.04 -0.16 0.00 -0.71 0.00 0.00 54.79 53.89 1bia n ASP 77 Cb 0.59 -0.13 -0.11 0.00 -1.35 0.00 0.00 41.12 40.11 1bia n ASP 77 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 1bia s GLY 78 N -1.45 0.79 0.00 6.12 0.00 -1.26 -5.09 107.32 106.43 1bia s GLY 78 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.71 1bia s GLY 78 CO 0.00 -1.06 0.00 0.61 0.00 0.00 0.00 173.10 172.65 1bia n GLY 79 N 1.09 3.20 3.78 0.20 0.00 -1.26 -5.04 105.19 107.16 1bia n GLY 79 Ca -0.20 -1.73 -0.36 0.00 0.00 0.00 0.00 46.02 43.73 1bia n GLY 79 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bia s SER 80 N 0.00 6.24 -0.19 1.61 0.01 -1.26 -4.98 113.70 115.13 1bia s SER 80 Ca 0.00 2.16 -0.06 0.00 1.31 0.00 0.00 55.95 59.36 1bia s SER 80 Cb 0.00 -2.59 0.09 0.00 0.21 0.00 0.00 66.02 63.73 1bia s SER 80 CO 0.00 -0.86 0.40 -0.69 0.41 0.00 0.00 173.24 172.50 1bia s VAL 81 N -1.68 -0.63 -0.35 3.43 1.01 -1.26 -1.90 120.40 119.03 1bia s VAL 81 Ca 0.65 0.17 -0.14 0.00 0.00 0.00 0.00 61.98 62.66 1bia s VAL 81 Cb -0.24 -0.65 -0.01 0.00 0.00 0.00 0.00 36.38 35.48 1bia s VAL 81 CO 0.29 0.07 0.27 0.00 0.00 0.00 0.00 175.10 175.73 1bia s ALA 82 N 2.59 3.50 -0.39 5.51 0.00 0.73 -4.94 121.76 128.75 1bia s ALA 82 Ca -0.01 -1.40 -0.13 0.00 0.00 0.00 0.00 51.96 50.42 1bia s ALA 82 Cb -0.12 -2.72 0.02 0.00 0.00 0.00 0.00 23.12 20.30 1bia s ALA 82 CO -0.12 -1.05 0.26 0.08 0.00 0.00 0.00 175.76 174.93 1bia s VAL 83 N 1.77 5.02 -0.45 0.00 1.01 -1.26 -0.81 120.40 125.68 1bia s VAL 83 Ca 0.07 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.38 1bia s VAL 83 Cb -0.17 -3.78 0.15 0.00 0.00 0.00 0.00 36.38 32.57 1bia s VAL 83 CO 0.11 -0.26 0.28 -0.76 0.00 0.00 0.00 175.10 174.47 1bia s LEU 84 N 1.64 2.33 0.50 3.92 1.43 -0.17 -4.91 118.68 123.41 1bia s LEU 84 Ca 0.04 -2.78 0.34 0.00 -1.03 0.00 0.00 54.13 50.71 1bia s LEU 84 Cb -0.19 -0.85 1.47 0.00 0.03 0.00 0.00 46.19 46.65 1bia s LEU 84 CO 0.09 -0.23 1.72 -0.65 0.23 0.00 0.00 176.35 177.50 1bia h PRO 85 N 6.40 0.09 -5.13 1.29 0.11 -1.94 -3.35 132.00 129.47 1bia h PRO 85 Ca 0.08 -0.01 -0.65 0.00 0.11 0.00 0.00 66.00 65.54 1bia h PRO 85 Cb 0.91 -0.02 -0.34 0.00 0.11 0.00 0.00 31.00 31.66 1bia h PRO 85 CO 0.44 0.06 -0.86 0.08 -0.21 0.00 0.00 178.00 177.51 1bia s VAL 86 N -5.11 1.88 0.30 3.15 1.01 -1.26 -2.52 120.40 117.84 1bia s VAL 86 Ca -0.06 -0.90 -0.19 0.00 0.00 0.00 0.00 61.98 60.83 1bia s VAL 86 Cb 0.26 -1.65 0.02 0.00 0.00 0.00 0.00 36.38 35.00 1bia s VAL 86 CO 0.82 0.52 0.70 -0.51 0.00 0.00 0.00 175.10 176.63 1bia s ILE 87 N 0.61 0.00 -0.06 2.22 2.07 -1.06 -5.05 121.20 119.93 1bia s ILE 87 Ca -0.13 -1.06 -0.09 0.00 -1.41 0.00 0.00 60.65 57.96 1bia s ILE 87 Cb -0.17 -2.18 -0.05 0.00 0.13 0.00 0.00 42.46 40.19 1bia s ILE 87 CO 0.04 0.00 0.38 0.44 -1.91 0.00 0.00 174.94 173.89 1bia h ASP 88 N 2.03 -0.27 -4.27 4.50 3.32 -1.93 0.27 116.42 120.07 1bia h ASP 88 Ca -0.22 0.01 -0.09 0.00 0.02 0.00 0.00 57.03 56.75 1bia h ASP 88 Cb 1.25 0.07 -0.22 0.00 0.22 0.00 0.00 39.33 40.65 1bia h ASP 88 CO 0.28 0.15 -0.06 -0.94 -1.72 0.00 0.00 179.24 176.95 1bia s SER 89 N -4.98 -0.53 0.24 6.45 1.04 -1.26 -1.41 113.70 113.25 1bia s SER 89 Ca -0.05 0.89 0.02 0.00 0.48 0.00 0.00 55.95 57.30 1bia s SER 89 Cb 0.00 0.90 0.26 0.00 0.10 0.00 0.00 66.02 67.29 1bia s SER 89 CO 0.14 -0.30 1.58 0.71 0.98 0.00 0.00 173.24 176.35 1bia h THR 90 N 4.00 1.34 -0.20 2.02 1.35 -1.93 -2.48 112.91 117.00 1bia h THR 90 Ca -0.28 -1.77 -0.06 0.00 -0.55 0.00 0.00 66.41 63.75 1bia h THR 90 Cb 1.17 1.81 -0.01 0.00 -1.73 0.00 0.00 68.15 69.39 1bia h THR 90 CO 0.23 0.54 -0.10 0.78 -0.25 0.00 0.00 175.52 176.72 1bia h ASN 91 N 0.28 0.43 -0.44 5.36 4.21 -1.93 -2.82 115.58 120.68 1bia h ASN 91 Ca 0.01 -0.41 -0.03 0.00 1.21 0.00 0.00 56.30 57.07 1bia h ASN 91 Cb 1.01 -0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 38.07 1bia h ASN 91 CO 0.09 0.75 0.14 1.56 -1.29 0.00 0.00 177.43 178.67 1bia h GLN 92 N 0.12 0.68 -0.71 0.81 1.08 -1.97 0.30 115.11 115.42 1bia h GLN 92 Ca 0.04 -0.15 0.16 0.00 -1.45 0.00 0.00 58.65 57.26 1bia h GLN 92 Cb 0.58 -0.10 -0.12 0.00 -0.05 0.00 0.00 27.48 27.79 1bia h GLN 92 CO 0.03 0.66 -0.00 -0.92 -0.95 0.00 0.00 178.83 177.65 1bia h TYR 93 N 0.57 -0.05 -0.22 2.96 3.20 -1.44 0.50 116.97 122.48 1bia h TYR 93 Ca 0.14 0.05 -0.12 0.00 3.14 0.00 0.00 58.73 61.94 1bia h TYR 93 Cb 0.26 0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.67 1bia h TYR 93 CO 0.01 -0.22 -0.34 -0.07 -1.64 0.00 0.00 178.16 175.90 1bia h LEU 94 N 0.11 0.69 -0.60 2.82 3.38 -1.09 -3.18 115.31 117.44 1bia h LEU 94 Ca 0.38 -0.52 0.12 0.00 0.09 0.00 0.00 57.88 57.96 1bia h LEU 94 Cb 0.66 -0.20 -0.10 0.00 0.09 0.00 0.00 40.66 41.12 1bia h LEU 94 CO -0.63 1.07 0.05 -0.07 0.09 0.00 0.00 178.44 178.96 1bia h LEU 95 N 0.32 -0.16 -0.27 1.67 3.38 0.22 0.15 115.31 120.61 1bia h LEU 95 Ca 0.02 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1bia h LEU 95 Cb 0.93 0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1bia h LEU 95 CO 0.08 -0.07 0.00 0.47 0.09 0.00 0.00 178.44 179.01 1bia n ASP 96 N -5.22 0.17 -0.06 -0.43 8.00 0.15 -2.46 116.55 116.69 1bia n ASP 96 Ca 0.09 0.56 0.07 0.00 0.71 0.00 0.00 54.79 56.22 1bia n ASP 96 Cb 0.34 -0.59 0.11 0.00 -0.02 0.00 0.00 41.12 40.96 1bia n ASP 96 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1bia n ARG 97 N -1.70 1.74 -0.52 -1.24 1.74 0.47 -4.79 116.66 112.35 1bia n ARG 97 Ca 0.02 -2.31 0.42 0.00 -0.77 0.00 0.00 57.85 55.21 1bia n ARG 97 Cb 0.11 -1.38 0.69 0.00 -1.02 0.00 0.00 32.46 30.86 1bia n ARG 97 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1bia n ILE 98 N -1.19 -0.17 0.23 0.55 5.41 -0.95 0.19 119.36 123.44 1bia n ILE 98 Ca 0.12 1.64 0.13 0.00 1.00 0.00 0.00 62.75 65.64 1bia n ILE 98 Cb 0.54 -2.69 0.35 0.00 -0.71 0.00 0.00 39.64 37.13 1bia n ILE 98 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1bia h GLY 99 N 0.00 0.00 -1.77 7.39 0.00 -1.88 -3.27 103.07 103.54 1bia h GLY 99 Ca 0.86 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.19 1bia h GLY 99 CO -0.32 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.40 1bia n GLU 100 N -3.13 2.01 -2.99 4.80 1.02 0.13 -5.00 120.64 117.49 1bia n GLU 100 Ca 0.02 -1.88 -0.19 0.00 -0.02 0.00 0.00 57.16 55.10 1bia n GLU 100 Cb 0.46 -1.41 0.04 0.00 -0.02 0.00 0.00 31.44 30.52 1bia n GLU 100 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1bia s LEU 101 N -1.51 3.33 0.03 -4.62 1.43 -1.18 -5.12 118.68 111.04 1bia s LEU 101 Ca 0.28 -0.62 -0.08 0.00 -1.03 0.00 0.00 54.13 52.69 1bia s LEU 101 Cb 0.18 -2.12 -0.00 0.00 0.03 0.00 0.00 46.19 44.28 1bia s LEU 101 CO 0.26 -1.12 0.15 -0.54 0.23 0.00 0.00 176.35 175.32 1bia s LYS 102 N -4.56 0.61 0.07 1.70 -0.14 -1.26 -5.06 119.74 111.09 1bia s LYS 102 Ca 0.59 -0.63 -0.37 0.00 -1.36 0.00 0.00 55.97 54.21 1bia s LYS 102 Cb -0.08 0.25 -0.17 0.00 -1.68 0.00 0.00 37.83 36.16 1bia s LYS 102 CO 0.37 -0.16 1.36 0.43 -0.76 0.00 0.00 175.35 176.59 1bia n SER 103 N 0.88 1.71 0.00 2.83 7.64 -1.26 -0.41 113.62 125.01 1bia n SER 103 Ca -0.20 1.12 0.00 0.00 1.01 0.00 0.00 58.87 60.80 1bia n SER 103 Cb 0.58 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.59 1bia n SER 103 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bia n GLY 104 N 2.62 3.04 3.74 0.23 0.00 0.18 -4.96 105.19 110.03 1bia n GLY 104 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 1bia n GLY 104 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bia s ASP 105 N -0.41 4.88 0.27 1.61 1.01 0.45 -4.75 116.67 119.73 1bia s ASP 105 Ca 0.00 2.69 -0.01 0.00 0.71 0.00 0.00 52.55 55.94 1bia s ASP 105 Cb 0.00 -2.63 -0.02 0.00 1.01 0.00 0.00 42.92 41.28 1bia s ASP 105 CO 0.00 -1.83 0.28 0.00 0.21 0.00 0.00 175.17 173.84 1bia s ALA 106 N -1.35 1.07 -0.18 5.23 0.00 -0.80 -1.94 121.76 123.79 1bia s ALA 106 Ca 0.78 -1.64 -0.09 0.00 0.00 0.00 0.00 51.96 51.00 1bia s ALA 106 Cb -0.39 1.32 0.06 0.00 0.00 0.00 0.00 23.12 24.12 1bia s ALA 106 CO 0.43 -0.69 0.43 0.00 0.00 0.00 0.00 175.76 175.94 1bia s ILE 108 N 1.56 1.40 0.20 0.00 1.01 0.01 -1.52 121.20 123.86 1bia s ILE 108 Ca -0.09 -0.86 -0.13 0.00 0.00 0.00 0.00 60.65 59.56 1bia s ILE 108 Cb -0.09 -1.18 0.01 0.00 0.01 0.00 0.00 42.46 41.21 1bia s ILE 108 CO -0.13 0.30 0.43 0.00 0.00 0.00 0.00 174.94 175.54 1bia s ALA 109 N -0.54 -0.43 -0.02 9.38 0.00 -0.63 -1.00 121.76 128.52 1bia s ALA 109 Ca 0.06 -0.63 0.03 0.00 0.00 0.00 0.00 51.96 51.42 1bia s ALA 109 Cb -0.07 0.92 0.05 0.00 0.00 0.00 0.00 23.12 24.01 1bia s ALA 109 CO 0.00 -0.77 0.85 -0.85 0.00 0.00 0.00 175.76 174.99 1bia n GLU 110 N -0.31 1.04 -3.62 0.00 0.28 -1.05 -1.00 120.64 115.98 1bia n GLU 110 Ca -0.07 -1.22 -0.04 0.00 -0.16 0.00 0.00 57.16 55.68 1bia n GLU 110 Cb 0.62 -0.80 -0.06 0.00 1.43 0.00 0.00 31.44 32.63 1bia n GLU 110 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 1bia s TYR 111 N -0.74 -0.98 -0.28 -1.84 5.04 -1.07 0.12 117.35 117.60 1bia s TYR 111 Ca 0.05 1.86 0.03 0.00 -2.44 0.00 0.00 57.07 56.58 1bia s TYR 111 Cb 0.05 0.59 0.07 0.00 0.35 0.00 0.00 41.96 43.01 1bia s TYR 111 CO 0.00 -0.49 -0.08 -0.65 -1.34 0.00 0.00 175.55 173.00 1bia s GLN 112 N 1.92 2.10 0.31 4.97 -0.21 -1.26 -2.57 119.66 124.91 1bia s GLN 112 Ca -0.08 -1.45 0.05 0.00 0.02 0.00 0.00 55.36 53.90 1bia s GLN 112 Cb -0.06 -2.96 0.68 0.00 1.00 0.00 0.00 33.01 31.66 1bia s GLN 112 CO -0.18 -0.64 1.82 1.96 -2.12 0.00 0.00 175.29 176.13 1bia h GLN 113 N 7.75 0.83 -0.02 2.91 1.08 -0.36 0.18 115.11 127.48 1bia h GLN 113 Ca -0.16 -0.05 -0.09 0.00 -1.45 0.00 0.00 58.65 56.90 1bia h GLN 113 Cb 1.04 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 28.27 1bia h GLN 113 CO 0.47 0.55 -0.41 0.00 -0.95 0.00 0.00 178.83 178.49 1bia h ALA 114 N 1.59 1.28 0.00 3.87 0.00 -1.43 -3.50 119.26 121.07 1bia h ALA 114 Ca 0.52 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1bia h ALA 114 Cb 0.68 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1bia h ALA 114 CO -0.29 0.53 0.00 0.41 0.00 0.00 0.00 179.25 179.90 1bia n GLY 115 N -0.31 2.55 0.18 0.00 0.00 0.64 -5.07 105.19 103.19 1bia n GLY 115 Ca -0.02 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.30 1bia n GLY 115 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1bia n SER 125 N 0.00 -0.24 -4.77 1.61 2.88 -1.26 -4.81 113.62 107.03 1bia n SER 125 Ca 0.00 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.19 1bia n SER 125 Cb 0.00 -0.12 0.01 0.00 -0.75 0.00 0.00 64.21 63.35 1bia n SER 125 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1bia s PRO 126 N -0.11 3.27 -0.32 -1.46 0.04 -1.26 -4.73 135.00 130.42 1bia s PRO 126 Ca 0.00 1.61 -0.43 0.00 0.04 0.00 0.00 61.00 62.22 1bia s PRO 126 Cb 0.00 -1.99 -0.18 0.00 0.04 0.00 0.00 34.50 32.36 1bia s PRO 126 CO 0.00 -0.92 1.57 0.34 0.04 0.00 0.00 177.00 178.03 1bia n PHE 127 N -1.43 1.72 0.00 0.56 -0.00 -0.45 -1.07 117.46 116.79 1bia n PHE 127 Ca 0.12 0.89 0.00 0.00 -0.00 0.00 0.00 57.45 58.45 1bia n PHE 127 Cb 0.51 -2.30 0.00 0.00 -0.00 0.00 0.00 39.48 37.69 1bia n PHE 127 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1bia n GLY 128 N 3.67 2.09 0.17 7.13 0.00 0.33 -4.82 105.19 113.76 1bia n GLY 128 Ca 0.27 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.31 1bia n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bia h ALA 129 N 0.00 1.17 -2.26 4.61 0.00 -1.27 -3.41 119.26 118.10 1bia h ALA 129 Ca 0.00 -0.41 -0.32 0.00 0.00 0.00 0.00 54.91 54.19 1bia h ALA 129 Cb 0.00 -0.07 -0.15 0.00 0.00 0.00 0.00 17.79 17.57 1bia h ALA 129 CO 0.00 0.56 -0.66 -0.80 0.00 0.00 0.00 179.25 178.35 1bia s ASN 130 N -6.78 1.39 -0.16 0.00 -0.87 -1.26 -0.73 114.94 106.53 1bia s ASN 130 Ca -0.02 -1.19 -0.01 0.00 -1.57 0.00 0.00 52.86 50.07 1bia s ASN 130 Cb 0.13 0.09 -0.01 0.00 -0.02 0.00 0.00 41.25 41.44 1bia s ASN 130 CO 0.73 -0.55 -0.11 -0.22 -2.57 0.00 0.00 177.10 174.37 1bia s LEU 131 N -3.21 2.73 -0.02 0.60 2.96 -0.38 -4.36 118.68 116.99 1bia s LEU 131 Ca 0.26 -0.36 0.05 0.00 -0.22 0.00 0.00 54.13 53.85 1bia s LEU 131 Cb 0.06 -1.64 -0.03 0.00 0.50 0.00 0.00 46.19 45.09 1bia s LEU 131 CO 0.06 0.11 -0.15 -0.31 -1.32 0.00 0.00 176.35 174.74 1bia s TYR 132 N 0.69 2.67 -0.13 5.38 2.02 -0.17 -0.83 117.35 126.98 1bia s TYR 132 Ca -0.06 -0.18 -0.16 0.00 -0.37 0.00 0.00 57.07 56.31 1bia s TYR 132 Cb -0.15 -1.58 0.04 0.00 -0.40 0.00 0.00 41.96 39.87 1bia s TYR 132 CO 0.02 0.21 0.42 -1.17 -1.57 0.00 0.00 175.55 173.47 1bia s LEU 133 N -0.97 0.38 0.02 -1.29 0.20 -0.37 -1.60 118.68 115.04 1bia s LEU 133 Ca 0.13 0.74 -0.02 0.00 0.69 0.00 0.00 54.13 55.67 1bia s LEU 133 Cb -0.11 1.50 -0.01 0.00 -0.43 0.00 0.00 46.19 47.14 1bia s LEU 133 CO 0.02 -0.22 0.01 -0.44 -0.29 0.00 0.00 176.35 175.44 1bia s SER 134 N -0.08 0.18 0.01 3.68 0.01 -0.58 0.18 113.70 117.11 1bia s SER 134 Ca -0.03 -0.42 -0.08 0.00 1.31 0.00 0.00 55.95 56.74 1bia s SER 134 Cb -0.03 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.32 1bia s SER 134 CO 0.02 -0.31 0.15 -0.32 0.41 0.00 0.00 173.24 173.18 1bia s MET 135 N -1.42 0.53 -0.01 12.44 0.00 0.65 -2.32 119.30 129.17 1bia s MET 135 Ca -0.15 -0.47 0.00 0.00 0.00 0.00 0.00 55.69 55.07 1bia s MET 135 Cb -0.09 0.22 -0.04 0.00 0.00 0.00 0.00 34.83 34.92 1bia s MET 135 CO -0.00 -0.13 0.06 0.12 0.00 0.00 0.00 175.02 175.06 1bia s PHE 136 N -1.70 3.22 -0.16 4.11 5.36 -0.82 0.46 117.98 128.46 1bia s PHE 136 Ca -0.12 0.17 -0.18 0.00 -0.96 0.00 0.00 56.93 55.84 1bia s PHE 136 Cb -0.06 -1.72 0.05 0.00 -0.34 0.00 0.00 43.02 40.95 1bia s PHE 136 CO 0.00 0.52 0.49 -0.46 -1.46 0.00 0.00 175.22 174.32 1bia s TRP 137 N -1.15 -0.52 -0.26 10.12 -0.11 -0.23 0.48 118.94 127.28 1bia s TRP 137 Ca 0.21 1.21 -0.01 0.00 1.22 0.00 0.00 56.10 58.73 1bia s TRP 137 Cb -0.12 0.19 0.04 0.00 -1.50 0.00 0.00 33.47 32.08 1bia s TRP 137 CO 0.12 -0.30 -0.06 0.50 -4.62 0.00 0.00 176.95 172.59 1bia s ARG 138 N -0.01 2.63 0.27 5.86 3.52 -1.26 -0.43 118.95 129.53 1bia s ARG 138 Ca -0.02 -1.11 -0.23 0.00 -0.13 0.00 0.00 55.73 54.24 1bia s ARG 138 Cb -0.03 -3.00 -0.09 0.00 -1.56 0.00 0.00 34.95 30.26 1bia s ARG 138 CO 0.02 -0.48 0.84 -0.51 -0.81 0.00 0.00 175.30 174.35 1bia s LEU 139 N 1.27 4.34 0.52 -0.88 1.43 -0.76 -4.93 118.68 119.67 1bia s LEU 139 Ca -0.03 1.63 0.18 0.00 -1.03 0.00 0.00 54.13 54.89 1bia s LEU 139 Cb -0.18 -3.80 1.30 0.00 0.03 0.00 0.00 46.19 43.53 1bia s LEU 139 CO -0.04 -0.02 2.11 1.05 0.23 0.00 0.00 176.35 179.68 1bia h GLU 140 N 3.30 0.01 0.00 1.70 -0.00 -1.92 -2.82 114.58 114.84 1bia h GLU 140 Ca -0.47 -0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.89 1bia h GLU 140 Cb 1.19 -0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.94 1bia h GLU 140 CO 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 179.01 179.66 1bia n GLN 141 N -4.50 0.00 0.00 1.06 -0.00 -1.26 -2.37 117.38 110.31 1bia n GLN 141 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 1bia n GLN 141 Cb 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 30.46 1bia n GLN 141 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 1bia n PRO 143 N 0.00 0.00 -2.96 2.61 -0.02 -1.26 -4.47 135.00 128.90 1bia n PRO 143 Ca 0.00 0.00 -0.44 0.00 -2.02 0.00 0.00 63.50 61.04 1bia n PRO 143 Cb 0.00 -1.18 -0.01 0.00 -0.02 0.00 0.00 33.50 32.29 1bia n PRO 143 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bia s ALA 144 N 0.86 3.69 0.00 3.55 0.00 -1.26 -4.54 121.76 124.06 1bia s ALA 144 Ca 0.00 -3.06 0.00 0.00 0.00 0.00 0.00 51.96 48.90 1bia s ALA 144 Cb 0.00 -4.05 0.00 0.00 0.00 0.00 0.00 23.12 19.07 1bia s ALA 144 CO 0.00 -2.85 0.00 0.00 0.00 0.00 0.00 175.76 172.91 1bia n ALA 145 N 5.98 0.00 0.00 0.00 0.00 -1.26 -4.99 120.51 120.24 1bia n ALA 145 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1bia n ALA 145 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1bia n ALA 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bia n ALA 146 N 0.00 0.00 -0.34 0.00 0.00 -1.26 0.22 120.51 119.13 1bia n ALA 146 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.51 1bia n ALA 146 Cb 0.00 0.00 0.17 0.00 0.00 0.00 0.00 19.45 19.62 1bia n ALA 146 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1bia h ILE 147 N 0.00 0.04 -0.44 0.00 2.10 -1.96 4.17 117.51 121.42 1bia h ILE 147 Ca 0.00 -0.00 0.06 0.00 1.08 0.00 0.00 64.86 66.00 1bia h ILE 147 Cb 0.00 0.04 -0.09 0.00 -1.09 0.00 0.00 36.82 35.68 1bia h ILE 147 CO 0.00 0.00 -0.49 1.23 -1.08 0.00 0.00 178.15 177.81 1bia h GLY 148 N 0.00 -0.75 -0.46 8.18 0.00 0.24 -2.06 103.07 108.23 1bia h GLY 148 Ca 0.49 0.63 0.10 0.00 0.00 0.00 0.00 47.33 48.55 1bia h GLY 148 CO -0.97 -0.15 -0.36 -2.00 0.00 0.00 0.00 176.54 173.07 1bia h LEU 149 N -0.34 -1.23 -1.75 3.11 5.85 0.79 -0.41 115.31 121.32 1bia h LEU 149 Ca 0.12 0.23 0.10 0.00 0.84 0.00 0.00 57.88 59.17 1bia h LEU 149 Cb 0.59 0.60 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 1bia h LEU 149 CO -0.61 -0.31 0.36 0.77 -0.34 0.00 0.00 178.44 178.31 1bia h SER 150 N -0.17 0.25 -0.11 1.25 4.64 -0.05 -1.46 113.55 117.90 1bia h SER 150 Ca 0.23 0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.51 1bia h SER 150 Cb 0.56 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1bia h SER 150 CO -0.69 0.15 -0.10 -0.07 -0.87 0.00 0.00 176.83 175.25 1bia h LEU 151 N 0.28 0.27 -0.34 5.97 3.38 -0.50 -2.55 115.31 121.82 1bia h LEU 151 Ca 0.24 -0.47 0.06 0.00 0.09 0.00 0.00 57.88 57.80 1bia h LEU 151 Cb 0.59 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.21 1bia h LEU 151 CO -0.05 0.69 0.02 0.58 0.09 0.00 0.00 178.44 179.77 1bia h VAL 152 N -0.14 0.77 -0.93 1.22 2.07 -0.91 -2.16 116.25 116.16 1bia h VAL 152 Ca 0.02 -0.04 0.10 0.00 0.82 0.00 0.00 66.70 67.60 1bia h VAL 152 Cb 0.61 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 30.95 1bia h VAL 152 CO 0.03 0.02 0.60 0.40 0.02 0.00 0.00 177.57 178.64 1bia h ILE 153 N 0.12 0.96 -0.54 4.57 1.08 -1.27 -1.66 117.51 120.77 1bia h ILE 153 Ca 0.17 -0.32 -0.12 0.00 -0.39 0.00 0.00 64.86 64.20 1bia h ILE 153 Cb 0.22 -0.06 -0.02 0.00 -3.07 0.00 0.00 36.82 33.90 1bia h ILE 153 CO -0.26 0.17 -0.11 1.23 -0.69 0.00 0.00 178.15 178.48 1bia h GLY 154 N 0.93 1.12 0.65 5.37 0.00 -0.97 -2.11 103.07 108.06 1bia h GLY 154 Ca 0.44 -0.91 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 1bia h GLY 154 CO -0.20 0.83 -0.45 -2.22 0.00 0.00 0.00 176.54 174.50 1bia h ILE 155 N 0.91 0.10 0.02 2.60 2.04 -0.82 0.57 117.51 122.93 1bia h ILE 155 Ca 0.14 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.03 1bia h ILE 155 Cb 0.69 0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 36.83 1bia h ILE 155 CO 0.05 0.00 -0.25 0.58 0.00 0.00 0.00 178.15 178.53 1bia h VAL 156 N -0.98 0.44 -0.96 1.67 2.07 -1.43 0.84 116.25 117.90 1bia h VAL 156 Ca -0.06 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.53 1bia h VAL 156 Cb 0.84 0.44 -0.07 0.00 -1.52 0.00 0.00 31.29 30.98 1bia h VAL 156 CO -0.01 0.00 0.62 0.24 0.02 0.00 0.00 177.57 178.44 1bia h MET 157 N -0.40 1.04 -0.52 1.57 2.86 -1.29 0.35 114.93 118.55 1bia h MET 157 Ca 0.06 -0.06 -0.12 0.00 -2.06 0.00 0.00 59.70 57.51 1bia h MET 157 Cb 0.47 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.88 1bia h MET 157 CO -0.20 0.69 -0.15 0.00 1.06 0.00 0.00 176.91 178.30 1bia h ALA 158 N 1.50 0.74 0.04 6.32 0.00 0.65 -1.35 119.26 127.16 1bia h ALA 158 Ca 0.43 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1bia h ALA 158 Cb 0.26 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1bia h ALA 158 CO -0.18 0.67 -0.02 0.93 0.00 0.00 0.00 179.25 180.66 1bia h GLU 159 N 0.89 -0.05 -0.41 0.00 5.08 0.20 -1.04 114.58 119.25 1bia h GLU 159 Ca 0.13 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.54 1bia h GLU 159 Cb 0.73 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.95 1bia h GLU 159 CO 0.06 0.05 0.16 0.28 -1.00 0.00 0.00 179.01 178.56 1bia h VAL 160 N -0.15 0.90 -0.12 3.13 2.07 -0.30 -1.68 116.25 120.09 1bia h VAL 160 Ca -0.01 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 1bia h VAL 160 Cb 0.13 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1bia h VAL 160 CO 0.01 0.06 -0.05 -0.07 0.02 0.00 0.00 177.57 177.54 1bia h LEU 161 N 0.33 0.16 -0.18 2.57 3.38 -0.96 -2.24 115.31 118.38 1bia h LEU 161 Ca 0.19 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 1bia h LEU 161 Cb 0.15 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1bia h LEU 161 CO -0.18 0.25 -0.04 0.03 0.09 0.00 0.00 178.44 178.59 1bia h ARG 162 N 0.18 0.35 -1.00 1.13 3.08 -0.31 -0.59 114.38 117.22 1bia h ARG 162 Ca 0.04 -0.13 0.24 0.00 0.07 0.00 0.00 59.98 60.20 1bia h ARG 162 Cb 0.21 -0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.15 1bia h ARG 162 CO 0.01 0.61 0.64 0.87 -1.07 0.00 0.00 179.97 181.03 1bia h LYS 163 N 0.07 0.43 -0.39 0.04 1.57 -0.77 0.87 116.57 118.39 1bia h LYS 163 Ca 0.05 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1bia h LYS 163 Cb 0.48 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1bia h LYS 163 CO 0.02 0.29 0.00 1.28 -0.57 0.00 0.00 179.45 180.46 1bia n LEU 164 N -4.60 1.92 0.00 2.94 4.77 -1.12 -4.92 117.00 116.00 1bia n LEU 164 Ca 0.23 -0.96 0.00 0.00 -0.03 0.00 0.00 56.01 55.25 1bia n LEU 164 Cb 0.78 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 1bia n LEU 164 CO 0.27 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 1bia n GLY 165 N 0.92 0.85 3.34 -0.72 0.00 0.30 -4.96 105.19 104.91 1bia n GLY 165 Ca 0.11 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.67 1bia n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bia s ALA 166 N -2.02 4.50 0.16 4.61 0.00 -0.24 -4.92 121.76 123.85 1bia s ALA 166 Ca 0.00 -3.65 -0.13 0.00 0.00 0.00 0.00 51.96 48.18 1bia s ALA 166 Cb 0.00 -3.55 0.06 0.00 0.00 0.00 0.00 23.12 19.63 1bia s ALA 166 CO 0.00 -2.23 1.72 0.38 0.00 0.00 0.00 175.76 175.63 1bia h ASP 167 N 7.08 0.75 -0.10 0.00 2.03 -1.82 -3.22 116.42 121.14 1bia h ASP 167 Ca 0.15 -0.17 -0.03 0.00 -0.73 0.00 0.00 57.03 56.25 1bia h ASP 167 Cb 0.94 -0.20 -0.02 0.00 -0.83 0.00 0.00 39.33 39.22 1bia h ASP 167 CO 0.91 0.71 0.04 0.29 -1.03 0.00 0.00 179.24 180.17 1bia n LYS 168 N -4.51 1.30 -2.52 4.15 5.02 -1.26 -4.89 118.16 115.44 1bia n LYS 168 Ca 0.03 -0.37 -0.41 0.00 -2.02 0.00 0.00 58.31 55.54 1bia n LYS 168 Cb 0.16 -1.35 -0.04 0.00 -0.02 0.00 0.00 35.03 33.78 1bia n LYS 168 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1bia s VAL 169 N -0.77 3.99 0.23 -0.18 1.01 -1.22 -4.47 120.40 118.99 1bia s VAL 169 Ca 0.07 1.64 0.02 0.00 0.00 0.00 0.00 61.98 63.71 1bia s VAL 169 Cb 0.05 -4.05 -0.05 0.00 0.00 0.00 0.00 36.38 32.33 1bia s VAL 169 CO 0.02 0.25 0.03 -0.13 0.00 0.00 0.00 175.10 175.26 1bia s ARG 170 N -0.04 1.31 0.15 2.72 0.52 0.61 -4.94 118.95 119.27 1bia s ARG 170 Ca 0.51 -1.67 0.04 0.00 -0.52 0.00 0.00 55.73 54.08 1bia s ARG 170 Cb -0.29 -0.42 -0.04 0.00 0.52 0.00 0.00 34.95 34.73 1bia s ARG 170 CO 0.33 -0.17 0.20 0.14 0.02 0.00 0.00 175.30 175.83 1bia s VAL 171 N -3.58 4.90 -0.18 3.52 -7.23 -0.15 0.14 120.40 117.82 1bia s VAL 171 Ca 0.30 -0.87 0.01 0.00 -1.81 0.00 0.00 61.98 59.61 1bia s VAL 171 Cb 0.07 -3.50 0.03 0.00 0.56 0.00 0.00 36.38 33.54 1bia s VAL 171 CO 0.09 -0.08 -0.12 -0.75 -0.31 0.00 0.00 175.10 173.93 1bia s LYS 172 N -3.11 2.19 0.16 4.82 2.20 -0.44 -0.06 119.74 125.49 1bia s LYS 172 Ca 0.33 -0.72 -0.33 0.00 -0.36 0.00 0.00 55.97 54.88 1bia s LYS 172 Cb -0.11 -2.29 -0.13 0.00 -1.51 0.00 0.00 37.83 33.79 1bia s LYS 172 CO 0.26 -0.34 1.68 1.87 -0.36 0.00 0.00 175.35 178.46 1bia n TRP 173 N 4.72 2.49 0.04 4.03 -0.00 -1.26 -1.43 117.44 126.03 1bia n TRP 173 Ca -0.16 0.12 0.04 0.00 -0.00 0.00 0.00 57.50 57.49 1bia n TRP 173 Cb 0.48 -2.62 0.07 0.00 -0.00 0.00 0.00 31.31 29.24 1bia n TRP 173 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 1bia n PRO 174 N 4.08 1.79 -1.13 5.87 -0.04 -1.26 -4.48 135.00 139.83 1bia n PRO 174 Ca 0.17 -1.49 0.00 0.00 -0.04 0.00 0.00 63.50 62.14 1bia n PRO 174 Cb 0.32 -1.16 -0.01 0.00 -0.04 0.00 0.00 33.50 32.61 1bia n PRO 174 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1bia n ASN 175 N 0.24 0.21 -4.29 3.54 6.94 -0.52 -3.91 115.26 117.47 1bia n ASN 175 Ca 0.06 -1.92 -0.16 0.00 -0.02 0.00 0.00 54.58 52.55 1bia n ASN 175 Cb 0.29 -0.09 -0.10 0.00 -2.36 0.00 0.00 39.78 37.52 1bia n ASN 175 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 1bia s ASP 176 N -1.40 1.49 0.05 0.53 1.01 -0.79 -2.14 116.67 115.42 1bia s ASP 176 Ca 0.17 -1.22 0.06 0.00 0.71 0.00 0.00 52.55 52.26 1bia s ASP 176 Cb 0.19 0.08 -0.04 0.00 1.01 0.00 0.00 42.92 44.16 1bia s ASP 176 CO -0.08 -0.56 -0.11 -0.76 0.21 0.00 0.00 175.17 173.86 1bia s LEU 177 N -3.25 2.96 0.21 1.23 1.43 -0.54 -1.33 118.68 119.39 1bia s LEU 177 Ca 0.28 -0.32 0.08 0.00 -1.03 0.00 0.00 54.13 53.13 1bia s LEU 177 Cb 0.06 -1.74 -0.05 0.00 0.03 0.00 0.00 46.19 44.49 1bia s LEU 177 CO 0.07 0.23 -0.13 -0.31 0.23 0.00 0.00 176.35 176.44 1bia s TYR 178 N -1.07 1.72 -0.20 0.29 1.51 0.36 -2.28 117.35 117.68 1bia s TYR 178 Ca 0.18 -0.59 -0.07 0.00 -1.01 0.00 0.00 57.07 55.58 1bia s TYR 178 Cb -0.11 -0.82 0.09 0.00 -0.11 0.00 0.00 41.96 41.01 1bia s TYR 178 CO 0.09 0.34 0.43 -1.17 -1.11 0.00 0.00 175.55 174.13 1bia s LEU 179 N -3.32 -0.62 -1.53 -1.29 2.96 -0.31 -0.28 118.68 114.29 1bia s LEU 179 Ca 0.23 1.00 -0.14 0.00 -0.22 0.00 0.00 54.13 55.01 1bia s LEU 179 Cb -0.00 1.38 0.08 0.00 0.50 0.00 0.00 46.19 48.15 1bia s LEU 179 CO 0.07 -0.23 0.98 0.00 -1.32 0.00 0.00 176.35 175.85 1bia n GLN 180 N 5.29 -5.51 -1.52 1.98 6.02 -1.26 -1.37 117.38 121.01 1bia n GLN 180 Ca -0.10 0.60 -0.17 0.00 -0.01 0.00 0.00 57.00 57.32 1bia n GLN 180 Cb 0.50 -5.48 -0.07 0.00 1.02 0.00 0.00 30.24 26.21 1bia n GLN 180 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1bia n ASP 181 N -2.84 -5.06 -4.30 1.08 8.00 -1.26 -5.00 116.55 107.17 1bia n ASP 181 Ca 0.03 0.41 -0.21 0.00 0.71 0.00 0.00 54.79 55.73 1bia n ASP 181 Cb 0.53 -4.07 -0.11 0.00 -0.02 0.00 0.00 41.12 37.45 1bia n ASP 181 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1bia s ARG 182 N -3.49 1.18 0.07 -1.24 0.52 -0.47 -4.99 118.95 110.54 1bia s ARG 182 Ca 0.00 -1.32 -0.30 0.00 -0.52 0.00 0.00 55.73 53.58 1bia s ARG 182 Cb 0.00 -1.23 -0.05 0.00 0.52 0.00 0.00 34.95 34.19 1bia s ARG 182 CO 0.00 0.25 1.14 0.21 0.02 0.00 0.00 175.30 176.92 1bia s LYS 183 N -2.62 4.49 -0.01 3.54 2.20 -1.26 -1.16 119.74 124.91 1bia s LYS 183 Ca 0.12 1.69 0.03 0.00 -0.36 0.00 0.00 55.97 57.45 1bia s LYS 183 Cb -0.06 -3.36 -0.05 0.00 -1.51 0.00 0.00 37.83 32.85 1bia s LYS 183 CO 0.05 -0.16 0.06 -0.11 -0.36 0.00 0.00 175.35 174.83 1bia n LEU 184 N 3.67 0.00 -3.48 5.43 7.94 -0.97 -0.87 117.00 128.72 1bia n LEU 184 Ca 0.07 0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 54.86 1bia n LEU 184 Cb 0.47 0.01 -0.03 0.00 0.53 0.00 0.00 43.42 44.41 1bia n LEU 184 CO 0.54 0.01 0.56 0.00 -1.11 0.00 0.00 177.39 177.40 1bia s ALA 185 N -2.19 -1.75 -0.03 1.96 0.00 -1.21 -0.60 121.76 117.93 1bia s ALA 185 Ca -0.01 0.94 -0.03 0.00 0.00 0.00 0.00 51.96 52.86 1bia s ALA 185 Cb 0.02 0.39 0.01 0.00 0.00 0.00 0.00 23.12 23.54 1bia s ALA 185 CO 0.13 -0.63 0.09 0.20 0.00 0.00 0.00 175.76 175.55 1bia s GLY 186 N -2.23 -0.06 0.07 0.00 0.00 -0.99 -1.46 107.32 102.65 1bia s GLY 186 Ca 0.00 0.22 0.10 0.00 0.00 0.00 0.00 44.72 45.04 1bia s GLY 186 CO -0.06 0.18 -0.26 -0.42 0.00 0.00 0.00 173.10 172.54 1bia s ILE 187 N -0.02 2.16 0.00 0.90 1.01 -0.91 -1.78 121.20 122.56 1bia s ILE 187 Ca -0.01 -1.49 0.01 0.00 0.00 0.00 0.00 60.65 59.16 1bia s ILE 187 Cb -0.01 -1.87 -0.01 0.00 0.01 0.00 0.00 42.46 40.59 1bia s ILE 187 CO 0.00 0.28 -0.04 -0.22 0.00 0.00 0.00 174.94 174.96 1bia s LEU 188 N -1.47 2.06 -0.06 2.97 2.96 0.57 -4.92 118.68 120.79 1bia s LEU 188 Ca 0.12 -0.16 0.04 0.00 -0.22 0.00 0.00 54.13 53.91 1bia s LEU 188 Cb -0.10 -0.17 0.00 0.00 0.50 0.00 0.00 46.19 46.42 1bia s LEU 188 CO 0.03 -0.01 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.20 1bia s VAL 189 N -0.35 1.37 -0.07 1.68 1.01 -1.26 -1.07 120.40 121.71 1bia s VAL 189 Ca -0.01 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.33 1bia s VAL 189 Cb -0.03 -1.20 0.01 0.00 0.00 0.00 0.00 36.38 35.16 1bia s VAL 189 CO -0.00 0.40 -0.12 -0.70 0.00 0.00 0.00 175.10 174.68 1bia s GLU 190 N 0.27 1.70 0.13 2.72 2.12 -1.05 -5.01 118.70 119.59 1bia s GLU 190 Ca -0.09 -0.40 0.02 0.00 0.36 0.00 0.00 54.97 54.86 1bia s GLU 190 Cb -0.13 -1.44 -0.04 0.00 0.26 0.00 0.00 34.13 32.78 1bia s GLU 190 CO 0.03 -0.00 0.26 -0.51 -0.54 0.00 0.00 175.26 174.51 1bia s LEU 191 N 0.76 4.32 -0.06 2.70 1.43 -1.26 -1.86 118.68 124.70 1bia s LEU 191 Ca -0.13 0.18 -0.00 0.00 -1.03 0.00 0.00 54.13 53.14 1bia s LEU 191 Cb -0.16 -2.90 0.03 0.00 0.03 0.00 0.00 46.19 43.19 1bia s LEU 191 CO 0.03 0.07 -0.02 -0.89 0.23 0.00 0.00 176.35 175.77 1bia s THR 192 N -1.70 0.49 -0.82 5.49 2.01 -0.59 -5.00 115.64 115.52 1bia s THR 192 Ca 0.34 -0.01 -0.08 0.00 0.31 0.00 0.00 61.69 62.25 1bia s THR 192 Cb -0.11 -0.59 -0.27 0.00 0.01 0.00 0.00 72.50 71.54 1bia s THR 192 CO 0.28 0.25 1.96 0.61 -0.69 0.00 0.00 174.62 177.03 1bia n GLY 193 N 4.68 -0.40 1.50 4.40 0.00 -1.26 -3.70 105.19 110.42 1bia n GLY 193 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1bia n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bia n ALA 198 N 5.82 -1.00 -3.12 4.61 0.00 -1.00 -5.05 120.51 120.77 1bia n ALA 198 Ca 0.55 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.62 1bia n ALA 198 Cb 0.21 -0.30 -0.13 0.00 0.00 0.00 0.00 19.45 19.24 1bia n ALA 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bia s ALA 199 N 0.00 3.11 -0.17 0.00 0.00 -1.06 -4.91 121.76 118.72 1bia s ALA 199 Ca 0.00 -1.32 -0.24 0.00 0.00 0.00 0.00 51.96 50.39 1bia s ALA 199 Cb 0.00 -2.13 -0.02 0.00 0.00 0.00 0.00 23.12 20.97 1bia s ALA 199 CO 0.00 -0.75 0.79 -0.65 0.00 0.00 0.00 175.76 175.15 1bia s GLN 200 N 1.55 4.28 0.11 0.00 -0.21 -1.24 -1.82 119.66 122.33 1bia s GLN 200 Ca 0.04 0.93 0.08 0.00 0.02 0.00 0.00 55.36 56.43 1bia s GLN 200 Cb -0.16 -3.57 -0.04 0.00 1.00 0.00 0.00 33.01 30.24 1bia s GLN 200 CO 0.03 -0.30 -0.19 0.42 -2.12 0.00 0.00 175.29 173.13 1bia s ILE 201 N 2.08 1.60 -0.17 1.08 1.01 0.42 -1.54 121.20 125.68 1bia s ILE 201 Ca 0.36 -1.57 -0.01 0.00 0.00 0.00 0.00 60.65 59.43 1bia s ILE 201 Cb -0.16 -1.52 0.04 0.00 0.01 0.00 0.00 42.46 40.83 1bia s ILE 201 CO 0.12 -0.15 -0.04 -0.69 0.00 0.00 0.00 174.94 174.18 1bia s VAL 202 N -1.39 1.03 0.10 2.92 1.01 -0.78 -1.07 120.40 122.23 1bia s VAL 202 Ca 0.07 -0.63 -0.07 0.00 0.00 0.00 0.00 61.98 61.34 1bia s VAL 202 Cb -0.09 -1.26 -0.06 0.00 0.00 0.00 0.00 36.38 34.97 1bia s VAL 202 CO 0.04 0.07 0.38 -0.63 0.00 0.00 0.00 175.10 174.96 1bia s ILE 203 N 1.66 5.14 -0.01 2.22 1.09 0.17 -2.54 121.20 128.94 1bia s ILE 203 Ca 0.00 0.24 -0.03 0.00 -1.10 0.00 0.00 60.65 59.76 1bia s ILE 203 Cb -0.16 -3.63 -0.00 0.00 -1.06 0.00 0.00 42.46 37.62 1bia s ILE 203 CO -0.07 0.18 0.07 -0.83 -0.10 0.00 0.00 174.94 174.18 1bia s GLY 204 N -2.05 0.06 0.04 6.18 0.00 -0.24 -0.25 107.32 111.07 1bia s GLY 204 Ca 0.36 -0.13 -0.10 0.00 0.00 0.00 0.00 44.72 44.85 1bia s GLY 204 CO 0.21 -0.21 0.22 0.00 0.00 0.00 0.00 173.10 173.32 1bia s ALA 205 N -0.85 -0.44 -0.04 3.20 0.00 0.13 -0.31 121.76 123.45 1bia s ALA 205 Ca -0.09 -0.23 -0.01 0.00 0.00 0.00 0.00 51.96 51.63 1bia s ALA 205 Cb -0.06 0.31 0.03 0.00 0.00 0.00 0.00 23.12 23.40 1bia s ALA 205 CO 0.00 -0.39 0.01 0.20 0.00 0.00 0.00 175.76 175.59 1bia s GLY 206 N -2.13 0.30 -0.08 0.00 0.00 -0.74 -1.24 107.32 103.44 1bia s GLY 206 Ca -0.04 0.09 0.02 0.00 0.00 0.00 0.00 44.72 44.78 1bia s GLY 206 CO -0.04 0.92 -0.12 -0.42 0.00 0.00 0.00 173.10 173.44 1bia s ILE 207 N 1.54 3.23 -0.74 0.90 1.01 -0.01 -2.35 121.20 124.79 1bia s ILE 207 Ca -0.02 -0.64 -0.26 0.00 0.00 0.00 0.00 60.65 59.73 1bia s ILE 207 Cb -0.13 -2.31 0.04 0.00 0.01 0.00 0.00 42.46 40.07 1bia s ILE 207 CO -0.03 0.57 1.21 0.20 0.00 0.00 0.00 174.94 176.90 1bia s ASN 208 N -0.43 6.18 -0.12 3.58 0.01 0.23 -1.25 114.94 123.14 1bia s ASN 208 Ca 0.05 -0.64 -0.13 0.00 -0.71 0.00 0.00 52.86 51.44 1bia s ASN 208 Cb -0.12 -2.53 -0.12 0.00 0.41 0.00 0.00 41.25 38.90 1bia s ASN 208 CO 0.02 -1.73 0.33 0.24 -1.51 0.00 0.00 177.10 174.45 1bia h MET 209 N 9.90 0.00 -3.75 -0.60 2.86 -1.26 -1.43 114.93 120.65 1bia h MET 209 Ca -0.26 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.30 1bia h MET 209 Cb 1.05 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 32.59 1bia h MET 209 CO 1.26 0.45 -0.25 0.00 1.06 0.00 0.00 176.91 179.43 1bia s ALA 210 N -2.41 -0.22 0.00 6.32 0.00 0.03 -2.04 121.76 123.44 1bia s ALA 210 Ca -0.09 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.16 1bia s ALA 210 Cb -0.01 0.82 0.00 0.00 0.00 0.00 0.00 23.12 23.93 1bia s ALA 210 CO 0.31 -0.66 0.00 -1.33 0.00 0.00 0.00 175.76 174.08 1bia n MET 211 N -0.22 0.00 -1.98 0.00 2.00 -1.26 -4.52 117.12 111.14 1bia n MET 211 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.61 1bia n MET 211 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.85 1bia n MET 211 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 175.97 177.84 1bia n TRP 223 N 0.00 -3.72 -4.08 2.03 -0.00 -1.26 -5.06 117.44 105.36 1bia n TRP 223 Ca 0.00 2.24 -0.08 0.00 -0.00 0.00 0.00 57.50 59.66 1bia n TRP 223 Cb 0.00 -2.86 -0.09 0.00 -0.00 0.00 0.00 31.31 28.36 1bia n TRP 223 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 177.69 176.19 1bia s ILE 224 N -0.39 0.16 0.15 5.87 2.07 -0.05 -4.84 121.20 124.18 1bia s ILE 224 Ca 0.00 -1.75 0.05 0.00 -1.41 0.00 0.00 60.65 57.54 1bia s ILE 224 Cb 0.00 -1.70 -0.04 0.00 0.13 0.00 0.00 42.46 40.85 1bia s ILE 224 CO 0.00 -0.73 -0.11 0.42 -1.91 0.00 0.00 174.94 172.61 1bia s THR 225 N -3.96 1.26 0.40 4.00 -4.23 -1.26 -4.26 115.64 107.59 1bia s THR 225 Ca 0.13 -2.04 0.07 0.00 -1.18 0.00 0.00 61.69 58.67 1bia s THR 225 Cb 0.07 -1.83 0.27 0.00 1.34 0.00 0.00 72.50 72.35 1bia s THR 225 CO -0.05 -0.69 2.03 -0.07 -0.54 0.00 0.00 174.62 175.30 1bia h LEU 226 N 2.83 0.52 -0.16 4.79 3.38 -1.18 -2.33 115.31 123.17 1bia h LEU 226 Ca -0.37 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.50 1bia h LEU 226 Cb 1.20 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 1bia h LEU 226 CO 0.62 0.37 -0.24 -0.61 0.09 0.00 0.00 178.44 178.67 1bia h GLN 227 N 0.61 0.44 -0.91 1.13 4.15 -1.41 0.46 115.11 119.57 1bia h GLN 227 Ca 0.19 -0.26 0.27 0.00 0.77 0.00 0.00 58.65 59.61 1bia h GLN 227 Cb 0.02 0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.70 1bia h GLN 227 CO -0.05 0.85 0.75 1.49 -1.93 0.00 0.00 178.83 179.95 1bia h GLU 228 N 0.06 0.00 -0.29 1.69 4.81 -1.71 0.36 114.58 119.51 1bia h GLU 228 Ca 0.01 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.09 1bia h GLU 228 Cb 0.81 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 30.10 1bia h GLU 228 CO 0.06 0.00 -0.16 0.00 -0.73 0.00 0.00 179.01 178.17 1bia n ALA 229 N -2.59 4.23 -0.99 2.92 0.00 -1.04 -4.94 120.51 118.11 1bia n ALA 229 Ca 0.19 -3.19 0.00 0.00 0.00 0.00 0.00 53.44 50.44 1bia n ALA 229 Cb 1.07 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 19.84 1bia n ALA 229 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bia n GLY 230 N -1.13 0.45 3.75 0.00 0.00 0.13 -4.99 105.19 103.40 1bia n GLY 230 Ca 0.31 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.97 1bia n GLY 230 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bia s ILE 231 N -2.00 5.26 -0.53 -0.61 1.09 0.16 -4.99 121.20 119.59 1bia s ILE 231 Ca 0.00 0.13 0.06 0.00 -1.10 0.00 0.00 60.65 59.74 1bia s ILE 231 Cb 0.00 -3.35 0.23 0.00 -1.06 0.00 0.00 42.46 38.27 1bia s ILE 231 CO 0.00 0.51 0.58 0.59 -0.10 0.00 0.00 174.94 176.51 1bia n ASN 232 N 2.98 1.79 -4.79 3.58 3.02 -1.26 -3.35 115.26 117.23 1bia n ASN 232 Ca -0.17 -3.00 -0.35 0.00 -0.03 0.00 0.00 54.58 51.03 1bia n ASN 232 Cb 0.53 -0.66 -0.02 0.00 -0.61 0.00 0.00 39.78 39.03 1bia n ASN 232 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1bia s LEU 233 N -1.53 3.81 -0.16 3.41 1.43 -1.26 -4.98 118.68 119.40 1bia s LEU 233 Ca 0.35 2.06 -0.29 0.00 -1.03 0.00 0.00 54.13 55.22 1bia s LEU 233 Cb 0.12 -4.55 -0.02 0.00 0.03 0.00 0.00 46.19 41.76 1bia s LEU 233 CO -0.09 -0.99 1.29 -0.62 0.23 0.00 0.00 176.35 176.17 1bia s ASP 234 N -1.85 6.93 0.44 2.29 2.15 -1.26 -4.89 116.67 120.48 1bia s ASP 234 Ca 0.70 1.73 0.17 0.00 0.43 0.00 0.00 52.55 55.58 1bia s ASP 234 Cb -0.20 -2.54 1.03 0.00 -0.30 0.00 0.00 42.92 40.91 1bia s ASP 234 CO 0.24 -0.77 1.96 0.08 -0.17 0.00 0.00 175.17 176.51 1bia h ARG 235 N 8.28 0.00 -0.17 4.34 0.11 -1.96 -1.96 114.38 123.02 1bia h ARG 235 Ca -0.27 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.62 1bia h ARG 235 Cb 1.11 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.19 1bia h ARG 235 CO 0.97 0.22 -0.66 -0.91 0.10 0.00 0.00 179.97 179.69 1bia h ASN 236 N 0.00 0.76 -0.07 0.08 2.35 -1.90 0.98 115.58 117.77 1bia h ASN 236 Ca -0.00 -0.45 -0.03 0.00 -0.55 0.00 0.00 56.30 55.27 1bia h ASN 236 Cb 0.44 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.58 1bia h ASN 236 CO 0.03 1.21 -0.06 0.74 -1.65 0.00 0.00 177.43 177.71 1bia h THR 237 N 0.48 1.35 -0.56 2.81 2.02 -1.92 -0.91 112.91 116.17 1bia h THR 237 Ca -0.02 -1.15 0.09 0.00 0.77 0.00 0.00 66.41 66.09 1bia h THR 237 Cb 1.25 1.96 -0.07 0.00 -1.74 0.00 0.00 68.15 69.55 1bia h THR 237 CO 0.13 0.32 0.19 0.25 0.37 0.00 0.00 175.52 176.78 1bia h LEU 238 N -0.24 0.18 -0.46 2.58 5.85 -1.31 0.14 115.31 122.05 1bia h LEU 238 Ca 0.01 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.83 1bia h LEU 238 Cb 0.54 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 1bia h LEU 238 CO 0.01 0.12 0.26 0.00 -0.34 0.00 0.00 178.44 178.49 1bia h ALA 239 N 1.39 0.58 0.32 1.25 0.00 -0.74 -2.47 119.26 119.59 1bia h ALA 239 Ca 0.28 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 1bia h ALA 239 Cb 0.34 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1bia h ALA 239 CO -0.29 -0.07 -0.29 0.00 0.00 0.00 0.00 179.25 178.60 1bia h ALA 240 N 1.22 -0.63 -0.08 0.00 0.00 0.64 -2.06 119.26 118.34 1bia h ALA 240 Ca 0.19 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1bia h ALA 240 Cb 0.04 0.41 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 1bia h ALA 240 CO -0.10 -0.89 -0.32 0.52 0.00 0.00 0.00 179.25 178.47 1bia h MET 241 N -0.63 -0.40 -0.69 0.00 2.07 -0.92 -1.59 114.93 112.76 1bia h MET 241 Ca -0.02 0.03 0.15 0.00 -2.07 0.00 0.00 59.70 57.78 1bia h MET 241 Cb 0.57 0.09 -0.11 0.00 -1.87 0.00 0.00 31.60 30.29 1bia h MET 241 CO -0.04 -0.27 0.12 -0.07 1.07 0.00 0.00 176.91 177.72 1bia h LEU 242 N -0.42 -0.08 -0.45 1.22 3.38 -1.37 0.48 115.31 118.07 1bia h LEU 242 Ca 0.08 0.15 -0.07 0.00 0.09 0.00 0.00 57.88 58.13 1bia h LEU 242 Cb 0.55 0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 1bia h LEU 242 CO -0.32 -0.06 0.01 0.40 0.09 0.00 0.00 178.44 178.57 1bia h ILE 243 N 0.22 1.26 0.61 1.22 2.04 -0.90 0.57 117.51 122.53 1bia h ILE 243 Ca 0.38 -1.02 -0.02 0.00 1.00 0.00 0.00 64.86 65.19 1bia h ILE 243 Cb 0.63 1.03 -0.00 0.00 -0.74 0.00 0.00 36.82 37.74 1bia h ILE 243 CO -0.51 0.35 -0.36 -0.09 0.00 0.00 0.00 178.15 177.54 1bia h ARG 244 N 0.64 -0.88 -0.17 2.37 2.43 -0.15 -1.35 114.38 117.27 1bia h ARG 244 Ca 0.13 0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.37 1bia h ARG 244 Cb 0.48 0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 1bia h ARG 244 CO 0.02 -0.59 0.07 0.93 -1.51 0.00 0.00 179.97 178.90 1bia h GLU 245 N -0.91 0.16 -0.58 0.20 4.39 -0.11 -1.21 114.58 116.52 1bia h GLU 245 Ca -0.08 -0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.66 1bia h GLU 245 Cb 0.74 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.30 1bia h GLU 245 CO 0.08 0.11 0.32 -0.07 -1.16 0.00 0.00 179.01 178.29 1bia h LEU 246 N 0.16 0.49 -1.01 1.33 3.38 0.20 -0.55 115.31 119.32 1bia h LEU 246 Ca 0.07 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.08 1bia h LEU 246 Cb 0.02 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 1bia h LEU 246 CO -0.06 0.34 0.66 0.03 0.09 0.00 0.00 178.44 179.50 1bia h ARG 247 N 0.62 1.28 -0.02 1.13 3.08 -0.90 -0.42 114.38 119.16 1bia h ARG 247 Ca 0.25 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.22 1bia h ARG 247 Cb 0.11 -0.29 -0.00 0.00 0.08 0.00 0.00 29.97 29.87 1bia h ARG 247 CO -0.14 0.85 -0.00 0.00 -1.07 0.00 0.00 179.97 179.60 1bia h ALA 248 N 1.39 0.02 -0.98 0.04 0.00 -0.57 -2.86 119.26 116.31 1bia h ALA 248 Ca 0.39 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1bia h ALA 248 Cb -0.08 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 1bia h ALA 248 CO -0.10 -0.30 0.65 0.00 0.00 0.00 0.00 179.25 179.50 1bia h ALA 249 N 0.66 1.32 -0.38 0.00 0.00 -0.83 -1.99 119.26 118.03 1bia h ALA 249 Ca 0.00 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1bia h ALA 249 Cb 0.36 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1bia h ALA 249 CO 0.00 0.61 -0.20 -0.07 0.00 0.00 0.00 179.25 179.59 1bia h LEU 250 N 1.30 0.75 -0.85 0.00 4.07 -1.09 0.33 115.31 119.82 1bia h LEU 250 Ca 0.37 -0.26 -0.07 0.00 0.08 0.00 0.00 57.88 58.00 1bia h LEU 250 Cb -0.11 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 41.42 1bia h LEU 250 CO -0.09 0.94 -0.33 1.05 -1.08 0.00 0.00 178.44 178.93 1bia h GLU 251 N 0.65 0.00 -0.36 1.13 4.11 -1.24 0.19 114.58 119.06 1bia h GLU 251 Ca 0.09 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.39 1bia h GLU 251 Cb 0.70 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 1bia h GLU 251 CO 0.05 0.33 -0.29 1.25 0.07 0.00 0.00 179.01 180.42 1bia h LEU 252 N 0.00 0.88 0.05 3.06 5.85 -0.60 -3.10 115.31 121.46 1bia h LEU 252 Ca -0.00 -0.45 0.01 0.00 0.84 0.00 0.00 57.88 58.28 1bia h LEU 252 Cb 0.91 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 1bia h LEU 252 CO 0.04 1.15 -0.09 0.15 -0.34 0.00 0.00 178.44 179.35 1bia h PHE 253 N 0.63 -0.22 0.00 1.25 3.57 0.22 -1.44 116.94 120.95 1bia h PHE 253 Ca 0.07 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1bia h PHE 253 Cb 0.87 0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.70 1bia h PHE 253 CO 0.06 -0.14 0.22 -1.91 -2.23 0.00 0.00 178.31 174.32 1bia n GLU 254 N -5.21 0.04 0.00 1.11 2.13 0.62 0.01 120.64 119.33 1bia n GLU 254 Ca -0.07 0.42 0.00 0.00 0.66 0.00 0.00 57.16 58.17 1bia n GLU 254 Cb 0.13 -1.84 0.00 0.00 0.27 0.00 0.00 31.44 30.00 1bia n GLU 254 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1bia n GLN 255 N -1.62 2.71 0.00 5.31 10.64 -0.75 -4.80 117.38 128.87 1bia n GLN 255 Ca -0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 1bia n GLN 255 Cb 0.23 -0.71 -0.00 0.00 -0.86 0.00 0.00 30.24 28.90 1bia n GLN 255 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1bia n GLU 256 N -0.86 3.02 0.00 2.61 1.02 -0.62 -5.10 120.64 120.71 1bia n GLU 256 Ca 0.00 -0.27 0.00 0.00 -0.02 0.00 0.00 57.16 56.87 1bia n GLU 256 Cb 0.00 -0.77 0.00 0.00 -0.02 0.00 0.00 31.44 30.65 1bia n GLU 256 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bia n GLY 257 N 0.55 0.66 0.14 0.62 0.00 0.10 -3.75 105.19 103.51 1bia n GLY 257 Ca 0.00 -0.74 -0.00 0.00 0.00 0.00 0.00 46.02 45.28 1bia n GLY 257 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1bia h LEU 258 N 0.00 0.00 -0.75 0.99 5.85 -1.88 -3.37 115.31 116.15 1bia h LEU 258 Ca 0.00 0.00 0.14 0.00 0.84 0.00 0.00 57.88 58.86 1bia h LEU 258 Cb 0.00 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 40.89 1bia h LEU 258 CO 0.00 0.59 -0.22 0.00 -0.34 0.00 0.00 178.44 178.47 1bia n ALA 259 N -2.39 0.10 0.70 1.25 0.00 -1.25 0.37 120.51 119.30 1bia n ALA 259 Ca -0.01 0.81 0.06 0.00 0.00 0.00 0.00 53.44 54.30 1bia n ALA 259 Cb 0.61 -0.45 0.34 0.00 0.00 0.00 0.00 19.45 19.95 1bia n ALA 259 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1bia n PRO 260 N -5.19 0.31 -0.00 0.00 -0.02 -1.26 -2.86 135.00 125.98 1bia n PRO 260 Ca 0.11 0.06 0.02 0.00 -2.02 0.00 0.00 63.50 61.67 1bia n PRO 260 Cb 0.35 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.30 1bia n PRO 260 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1bia n TYR 261 N -1.10 0.00 -0.32 6.00 4.01 0.16 -4.71 117.16 121.20 1bia n TYR 261 Ca 0.08 0.00 0.19 0.00 -0.16 0.00 0.00 57.90 58.01 1bia n TYR 261 Cb 0.06 -0.10 0.37 0.00 -0.31 0.00 0.00 39.34 39.36 1bia n TYR 261 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 1bia h LEU 262 N 0.00 -0.08 -0.36 7.72 3.38 -1.33 1.03 115.31 125.67 1bia h LEU 262 Ca -0.00 0.25 -0.19 0.00 0.09 0.00 0.00 57.88 58.03 1bia h LEU 262 Cb 0.21 0.35 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1bia h LEU 262 CO 0.00 -0.30 -0.81 0.28 0.09 0.00 0.00 178.44 177.69 1bia h SER 263 N 0.09 0.27 0.03 -0.43 0.02 -1.84 -2.96 113.55 108.72 1bia h SER 263 Ca 0.65 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 61.40 1bia h SER 263 Cb 1.47 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.93 1bia h SER 263 CO -0.79 0.97 -0.01 0.03 -1.14 0.00 0.00 176.83 175.89 1bia h ARG 264 N 0.13 -0.04 -0.86 3.45 3.08 0.42 -2.60 114.38 117.96 1bia h ARG 264 Ca -0.04 0.00 0.17 0.00 0.07 0.00 0.00 59.98 60.19 1bia h ARG 264 Cb 1.41 0.01 -0.16 0.00 0.08 0.00 0.00 29.97 31.31 1bia h ARG 264 CO 0.12 0.26 -0.21 2.35 -1.07 0.00 0.00 179.97 181.42 1bia h TRP 265 N -0.33 -0.45 -0.53 3.04 2.91 0.39 -1.07 115.95 119.91 1bia h TRP 265 Ca -0.00 0.08 0.11 0.00 1.13 0.00 0.00 58.89 60.20 1bia h TRP 265 Cb 0.31 0.33 -0.09 0.00 -0.51 0.00 0.00 29.16 29.21 1bia h TRP 265 CO 0.02 -0.37 -0.01 1.49 -1.03 0.00 0.00 178.44 178.55 1bia h GLU 266 N 0.00 0.11 0.00 2.65 4.81 -1.29 -1.60 114.58 119.26 1bia h GLU 266 Ca 0.41 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.63 1bia h GLU 266 Cb 0.63 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.99 1bia h GLU 266 CO -0.89 0.07 -0.06 0.87 -0.73 0.00 0.00 179.01 178.28 1bia h LYS 267 N 0.11 0.00 0.00 1.92 1.57 -1.02 -3.26 116.57 115.90 1bia h LYS 267 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1bia h LYS 267 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1bia h LYS 267 CO -0.45 0.06 -1.76 1.28 -0.57 0.00 0.00 179.45 178.00 1bia n LEU 268 N -3.29 0.22 -4.54 2.94 4.77 -0.68 -4.97 117.00 111.44 1bia n LEU 268 Ca -0.01 -0.06 -0.45 0.00 -0.03 0.00 0.00 56.01 55.46 1bia n LEU 268 Cb 0.23 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.27 1bia n LEU 268 CO 0.27 0.03 1.85 -0.67 -1.33 0.00 0.00 177.39 177.53 1bia n ASP 269 N -2.16 2.84 0.21 -1.43 -0.08 -0.73 -0.97 116.55 114.22 1bia n ASP 269 Ca -0.02 0.25 0.13 0.00 -1.51 0.00 0.00 54.79 53.63 1bia n ASP 269 Cb 0.53 -1.46 0.73 0.00 2.34 0.00 0.00 41.12 43.26 1bia n ASP 269 CO 0.00 0.00 0.00 -1.13 0.12 0.00 0.00 177.20 176.19 1bia h ASN 270 N 14.31 0.00 -0.01 1.67 -1.24 -0.80 -3.02 115.58 126.50 1bia h ASN 270 Ca -0.36 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.65 1bia h ASN 270 Cb 1.27 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.32 1bia h ASN 270 CO 0.99 0.00 -0.09 0.49 -1.29 0.00 0.00 177.43 177.53 1bia n PHE 271 N -4.28 0.00 -1.63 0.67 3.72 -1.26 -5.00 117.46 109.68 1bia n PHE 271 Ca 0.00 0.00 -0.47 0.00 -0.05 0.00 0.00 57.45 56.93 1bia n PHE 271 Cb 0.22 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.72 1bia n PHE 271 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 176.76 178.22 1bia n ILE 272 N 0.08 0.80 -2.33 4.37 3.06 -1.14 -1.23 119.36 122.97 1bia n ILE 272 Ca 0.04 -0.20 -0.17 0.00 -2.50 0.00 0.00 62.75 59.92 1bia n ILE 272 Cb 0.19 -1.20 -0.01 0.00 0.54 0.00 0.00 39.64 39.16 1bia n ILE 272 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64 1bia n ASN 273 N 2.22 -5.08 -4.32 9.51 3.02 0.14 -4.98 115.26 115.76 1bia n ASN 273 Ca 0.14 -0.02 -0.25 0.00 -0.03 0.00 0.00 54.58 54.42 1bia n ASN 273 Cb 0.28 -4.17 -0.12 0.00 -0.61 0.00 0.00 39.78 35.15 1bia n ASN 273 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1bia s ARG 274 N -4.87 1.23 -0.25 3.52 0.52 -0.36 -4.86 118.95 113.88 1bia s ARG 274 Ca 0.00 -1.27 -0.29 0.00 -0.52 0.00 0.00 55.73 53.65 1bia s ARG 274 Cb -0.00 -1.50 -0.01 0.00 0.52 0.00 0.00 34.95 33.95 1bia s ARG 274 CO 0.00 0.34 1.45 -1.25 0.02 0.00 0.00 175.30 175.86 1bia s PRO 275 N -2.15 3.88 0.41 3.54 0.04 -1.26 -0.20 135.00 139.25 1bia s PRO 275 Ca 0.10 1.48 0.05 0.00 0.04 0.00 0.00 61.00 62.68 1bia s PRO 275 Cb -0.09 -3.95 -0.06 0.00 0.04 0.00 0.00 34.50 30.44 1bia s PRO 275 CO 0.05 -1.17 0.02 0.14 0.04 0.00 0.00 177.00 176.08 1bia s VAL 276 N 4.70 1.67 -0.09 -0.36 -7.23 0.16 -3.07 120.40 116.18 1bia s VAL 276 Ca 0.64 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.82 1bia s VAL 276 Cb -0.21 -2.81 -0.02 0.00 0.56 0.00 0.00 36.38 33.90 1bia s VAL 276 CO 0.26 0.00 -0.15 -0.75 -0.31 0.00 0.00 175.10 174.15 1bia s LYS 277 N -3.77 3.00 -0.23 4.82 2.20 0.06 -1.71 119.74 124.11 1bia s LYS 277 Ca 0.30 -0.71 0.01 0.00 -0.36 0.00 0.00 55.97 55.22 1bia s LYS 277 Cb 0.08 -2.50 0.04 0.00 -1.51 0.00 0.00 37.83 33.94 1bia s LYS 277 CO 0.15 0.37 -0.13 -1.17 -0.36 0.00 0.00 175.35 174.21 1bia s LEU 278 N -0.08 2.93 -0.32 5.43 2.96 0.72 -0.54 118.68 129.79 1bia s LEU 278 Ca -0.03 -1.03 -0.16 0.00 -0.22 0.00 0.00 54.13 52.70 1bia s LEU 278 Cb -0.14 -1.55 -0.02 0.00 0.50 0.00 0.00 46.19 44.98 1bia s LEU 278 CO 0.04 -0.11 0.39 -0.63 -1.32 0.00 0.00 176.35 174.72 1bia s ILE 279 N 1.21 5.14 -0.37 6.68 1.01 -1.00 0.00 121.20 133.88 1bia s ILE 279 Ca -0.02 0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.94 1bia s ILE 279 Cb -0.17 -3.80 0.12 0.00 0.01 0.00 0.00 42.46 38.62 1bia s ILE 279 CO -0.08 -0.02 0.17 -0.51 0.00 0.00 0.00 174.94 174.50 1bia s ILE 280 N 2.11 1.15 0.00 2.92 2.07 0.34 -1.00 121.20 128.78 1bia s ILE 280 Ca 0.14 -2.00 0.00 0.00 -1.41 0.00 0.00 60.65 57.39 1bia s ILE 280 Cb -0.16 -1.84 0.00 0.00 0.13 0.00 0.00 42.46 40.59 1bia s ILE 280 CO 0.11 -0.79 0.00 0.61 -1.91 0.00 0.00 174.94 172.96 1bia n GLY 281 N 4.17 2.20 0.09 1.50 0.00 -1.26 -2.57 105.19 109.32 1bia n GLY 281 Ca 0.04 -0.46 -0.11 0.00 0.00 0.00 0.00 46.02 45.50 1bia n GLY 281 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1bia h ASP 282 N 0.00 0.11 -2.60 1.61 1.82 -2.01 -3.46 116.42 111.89 1bia h ASP 282 Ca 0.00 -0.18 -0.54 0.00 -0.39 0.00 0.00 57.03 55.93 1bia h ASP 282 Cb 0.00 -0.04 0.02 0.00 0.68 0.00 0.00 39.33 39.99 1bia h ASP 282 CO 0.00 1.15 1.07 -0.54 -1.61 0.00 0.00 179.24 179.31 1bia s LYS 283 N -2.63 4.18 -0.41 0.28 1.02 -1.06 -4.99 119.74 116.12 1bia s LYS 283 Ca -0.05 2.37 -0.11 0.00 0.02 0.00 0.00 55.97 58.19 1bia s LYS 283 Cb 0.08 -3.79 0.05 0.00 -0.52 0.00 0.00 37.83 33.65 1bia s LYS 283 CO 0.83 -0.81 0.26 -2.00 -0.92 0.00 0.00 175.35 172.71 1bia s GLU 284 N 3.30 2.79 -0.12 1.68 2.12 -1.26 0.13 118.70 127.33 1bia s GLU 284 Ca 0.77 -1.25 -0.00 0.00 0.36 0.00 0.00 54.97 54.85 1bia s GLU 284 Cb -0.39 -3.83 -0.02 0.00 0.26 0.00 0.00 34.13 30.14 1bia s GLU 284 CO 0.34 -0.85 -0.12 0.42 -0.54 0.00 0.00 175.26 174.51 1bia s ILE 285 N 1.53 3.20 0.03 -3.70 1.09 0.10 -4.96 121.20 118.49 1bia s ILE 285 Ca 0.03 -0.62 -0.02 0.00 -1.10 0.00 0.00 60.65 58.94 1bia s ILE 285 Cb -0.21 -2.34 -0.04 0.00 -1.06 0.00 0.00 42.46 38.81 1bia s ILE 285 CO 0.05 0.53 0.21 -0.36 -0.10 0.00 0.00 174.94 175.28 1bia s PHE 286 N 0.16 3.53 -0.24 3.97 0.40 -1.26 -0.20 117.98 124.34 1bia s PHE 286 Ca -0.06 0.34 0.00 0.00 -0.60 0.00 0.00 56.93 56.60 1bia s PHE 286 Cb -0.15 -1.82 0.00 0.00 0.51 0.00 0.00 43.02 41.56 1bia s PHE 286 CO 0.05 0.60 0.00 0.41 0.70 0.00 0.00 175.22 176.98 1bia n GLY 287 N 0.60 -1.23 3.27 4.36 0.00 -0.69 -4.80 105.19 106.70 1bia n GLY 287 Ca -0.08 -0.86 -0.33 0.00 0.00 0.00 0.00 46.02 44.75 1bia n GLY 287 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bia s ILE 288 N -2.79 2.69 0.35 -0.61 1.01 -0.88 0.37 121.20 121.34 1bia s ILE 288 Ca 0.00 -0.77 -0.28 0.00 0.00 0.00 0.00 60.65 59.60 1bia s ILE 288 Cb 0.00 -2.13 -0.10 0.00 0.01 0.00 0.00 42.46 40.24 1bia s ILE 288 CO 0.00 0.52 1.34 -0.55 0.00 0.00 0.00 174.94 176.24 1bia s SER 289 N 0.76 6.60 -0.02 3.58 0.15 0.71 -1.44 113.70 124.05 1bia s SER 289 Ca -0.06 2.74 0.03 0.00 0.70 0.00 0.00 55.95 59.36 1bia s SER 289 Cb -0.15 -2.65 0.05 0.00 -1.71 0.00 0.00 66.02 61.55 1bia s SER 289 CO 0.01 -0.66 0.90 0.54 1.20 0.00 0.00 173.24 175.23 1bia n ARG 290 N 0.60 1.79 0.00 5.44 5.12 0.03 -0.68 116.66 128.96 1bia n ARG 290 Ca 0.01 -1.40 0.00 0.00 -1.93 0.00 0.00 57.85 54.53 1bia n ARG 290 Cb 0.42 -0.92 0.00 0.00 -1.16 0.00 0.00 32.46 30.79 1bia n ARG 290 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1bia n GLY 291 N -0.49 0.21 3.46 -0.13 0.00 -1.26 -4.80 105.19 102.18 1bia n GLY 291 Ca 0.03 -1.65 -0.22 0.00 0.00 0.00 0.00 46.02 44.17 1bia n GLY 291 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1bia s ILE 292 N 0.00 1.72 0.51 -0.61 -4.36 -1.26 0.20 121.20 117.41 1bia s ILE 292 Ca 0.00 -2.12 0.07 0.00 -0.26 0.00 0.00 60.65 58.34 1bia s ILE 292 Cb 0.00 -2.54 0.05 0.00 1.25 0.00 0.00 42.46 41.22 1bia s ILE 292 CO 0.00 -0.24 0.70 1.51 0.24 0.00 0.00 174.94 177.15 1bia s ASP 293 N -3.49 5.32 0.00 4.36 1.47 0.05 -4.84 116.67 119.55 1bia s ASP 293 Ca 0.31 -0.49 0.00 0.00 1.18 0.00 0.00 52.55 53.55 1bia s ASP 293 Cb 0.04 -0.34 0.00 0.00 -0.34 0.00 0.00 42.92 42.28 1bia s ASP 293 CO 0.13 -1.09 0.61 0.29 0.68 0.00 0.00 175.17 175.79 1bia n LYS 294 N -2.13 0.00 -0.01 2.11 5.02 -1.26 0.48 118.16 122.38 1bia n LYS 294 Ca 0.11 0.14 0.03 0.00 -2.02 0.00 0.00 58.31 56.57 1bia n LYS 294 Cb 0.60 -1.51 0.03 0.00 -0.02 0.00 0.00 35.03 34.13 1bia n LYS 294 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1bia n GLN 295 N -1.11 0.13 -0.99 1.97 1.13 -1.26 -4.76 117.38 112.49 1bia n GLN 295 Ca 0.00 -0.96 0.00 0.00 -1.94 0.00 0.00 57.00 54.10 1bia n GLN 295 Cb 0.01 -1.13 0.00 0.00 0.11 0.00 0.00 30.24 29.23 1bia n GLN 295 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1bia n GLY 296 N 0.35 0.57 3.85 1.08 0.00 0.18 -4.59 105.19 106.63 1bia n GLY 296 Ca 0.04 -0.82 -0.35 0.00 0.00 0.00 0.00 46.02 44.90 1bia n GLY 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bia s ALA 297 N -2.00 3.63 0.04 4.61 0.00 -1.25 -4.78 121.76 122.01 1bia s ALA 297 Ca 0.00 -0.23 -0.30 0.00 0.00 0.00 0.00 51.96 51.42 1bia s ALA 297 Cb 0.00 -2.42 -0.06 0.00 0.00 0.00 0.00 23.12 20.64 1bia s ALA 297 CO 0.00 0.50 1.29 -1.17 0.00 0.00 0.00 175.76 176.38 1bia s LEU 298 N -2.00 4.34 -0.54 0.00 2.96 -0.28 -0.77 118.68 122.39 1bia s LEU 298 Ca 0.37 2.06 -0.20 0.00 -0.22 0.00 0.00 54.13 56.14 1bia s LEU 298 Cb -0.14 -3.57 0.07 0.00 0.50 0.00 0.00 46.19 43.04 1bia s LEU 298 CO 0.19 -0.59 0.72 -0.76 -1.32 0.00 0.00 176.35 174.59 1bia s LEU 299 N 1.61 4.89 -0.21 -0.68 1.43 0.13 -0.62 118.68 125.23 1bia s LEU 299 Ca 0.61 -0.96 -0.08 0.00 -1.03 0.00 0.00 54.13 52.67 1bia s LEU 299 Cb -0.30 -2.46 -0.04 0.00 0.03 0.00 0.00 46.19 43.41 1bia s LEU 299 CO 0.27 -1.04 0.09 -0.22 0.23 0.00 0.00 176.35 175.69 1bia s LEU 300 N 2.95 3.78 -0.29 1.79 2.96 0.85 -0.79 118.68 129.94 1bia s LEU 300 Ca 0.17 0.01 -0.11 0.00 -0.22 0.00 0.00 54.13 53.98 1bia s LEU 300 Cb -0.19 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.47 1bia s LEU 300 CO 0.11 0.09 0.19 -0.70 -1.32 0.00 0.00 176.35 174.73 1bia s GLU 301 N 0.86 3.83 -0.16 1.98 2.12 -0.52 -1.52 118.70 125.29 1bia s GLU 301 Ca 0.05 -0.40 0.00 0.00 0.36 0.00 0.00 54.97 54.98 1bia s GLU 301 Cb -0.13 -3.68 0.02 0.00 0.26 0.00 0.00 34.13 30.60 1bia s GLU 301 CO 0.03 -0.24 -0.16 1.14 -0.54 0.00 0.00 175.26 175.49 1bia s GLN 302 N 1.74 2.47 -0.79 4.30 -2.07 0.64 -2.07 119.66 123.87 1bia s GLN 302 Ca 0.07 -0.62 -0.01 0.00 -1.82 0.00 0.00 55.36 52.97 1bia s GLN 302 Cb -0.16 -2.22 0.00 0.00 -1.09 0.00 0.00 33.01 29.54 1bia s GLN 302 CO 0.10 -0.23 0.57 -0.25 -1.32 0.00 0.00 175.29 174.16 1bia n ASP 303 N 4.73 -4.48 0.00 12.60 8.00 -1.26 -0.36 116.55 135.79 1bia n ASP 303 Ca -0.18 -0.94 0.00 0.00 0.71 0.00 0.00 54.79 54.38 1bia n ASP 303 Cb 0.50 -1.50 0.00 0.00 -0.02 0.00 0.00 41.12 40.10 1bia n ASP 303 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bia n GLY 304 N -1.60 0.25 3.46 0.44 0.00 -1.26 -4.95 105.19 101.54 1bia n GLY 304 Ca -0.30 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 1bia n GLY 304 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bia s ILE 305 N -1.65 2.95 -0.12 -0.61 1.01 0.51 -5.10 121.20 118.19 1bia s ILE 305 Ca 0.00 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 59.81 1bia s ILE 305 Cb 0.00 -2.17 0.01 0.00 0.01 0.00 0.00 42.46 40.31 1bia s ILE 305 CO 0.00 0.53 -0.16 -0.63 0.00 0.00 0.00 174.94 174.67 1bia s ILE 306 N -0.78 1.61 0.10 2.92 1.01 -1.26 0.23 121.20 125.03 1bia s ILE 306 Ca 0.12 -0.70 0.02 0.00 0.00 0.00 0.00 60.65 60.10 1bia s ILE 306 Cb -0.11 -1.46 -0.04 0.00 0.01 0.00 0.00 42.46 40.86 1bia s ILE 306 CO 0.02 0.46 -0.07 -1.59 0.00 0.00 0.00 174.94 173.76 1bia s LYS 307 N 1.02 0.82 -0.02 2.79 -2.85 -0.57 -4.95 119.74 115.97 1bia s LYS 307 Ca -0.05 -1.25 -0.16 0.00 -1.00 0.00 0.00 55.97 53.51 1bia s LYS 307 Cb -0.15 -0.29 -0.05 0.00 -2.06 0.00 0.00 37.83 35.28 1bia s LYS 307 CO -0.03 0.01 0.43 -1.25 0.10 0.00 0.00 175.35 174.62 1bia s PRO 308 N -3.41 4.05 -0.10 1.78 0.04 -1.25 -0.10 135.00 136.01 1bia s PRO 308 Ca 0.09 0.44 0.03 0.00 0.04 0.00 0.00 61.00 61.59 1bia s PRO 308 Cb 0.02 -3.28 0.01 0.00 0.04 0.00 0.00 34.50 31.29 1bia s PRO 308 CO -0.03 0.55 -0.19 -1.58 0.04 0.00 0.00 177.00 175.79 1bia s TRP 309 N -0.65 2.18 -2.35 0.56 0.52 0.21 -4.92 118.94 114.49 1bia s TRP 309 Ca 0.24 -0.94 0.21 0.00 0.02 0.00 0.00 56.10 55.64 1bia s TRP 309 Cb -0.16 -1.51 0.62 0.00 -1.15 0.00 0.00 33.47 31.26 1bia s TRP 309 CO 0.13 -0.42 1.48 -1.33 0.02 0.00 0.00 176.95 176.83 1bia n MET 310 N 3.81 2.00 -3.79 4.98 2.81 -1.26 -1.13 117.12 124.55 1bia n MET 310 Ca -0.20 -1.51 -0.03 0.00 -1.81 0.00 0.00 57.70 54.15 1bia n MET 310 Cb 0.52 -1.43 -0.00 0.00 -0.71 0.00 0.00 33.22 31.60 1bia n MET 310 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1bia s GLY 311 N -1.53 -0.12 0.00 3.03 0.00 -1.26 -5.01 107.32 102.43 1bia s GLY 311 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 44.72 45.05 1bia s GLY 311 CO 0.28 0.73 0.00 0.61 0.00 0.00 0.00 173.10 174.71 1bia n GLY 312 N -0.54 2.00 3.13 0.20 0.00 -1.26 -4.92 105.19 103.80 1bia n GLY 312 Ca -0.05 -2.18 -0.33 0.00 0.00 0.00 0.00 46.02 43.45 1bia n GLY 312 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bia s GLU 313 N -1.65 2.82 0.29 1.61 2.56 -0.17 -4.89 118.70 119.28 1bia s GLU 313 Ca 0.00 -0.96 -0.26 0.00 0.00 0.00 0.00 54.97 53.75 1bia s GLU 313 Cb 0.00 -2.74 -0.09 0.00 2.00 0.00 0.00 34.13 33.30 1bia s GLU 313 CO 0.00 -0.32 0.92 -1.50 -0.56 0.00 0.00 175.26 173.80 1bia s ILE 314 N 1.26 4.21 0.08 -3.70 1.10 -1.26 -2.37 121.20 120.53 1bia s ILE 314 Ca 0.01 1.84 -0.04 0.00 -0.51 0.00 0.00 60.65 61.95 1bia s ILE 314 Cb -0.15 -4.08 -0.02 0.00 0.15 0.00 0.00 42.46 38.35 1bia s ILE 314 CO -0.09 0.25 0.08 -0.44 -2.11 0.00 0.00 174.94 172.63 1bia s SER 315 N -1.49 0.30 0.06 4.50 0.01 0.30 -4.98 113.70 112.40 1bia s SER 315 Ca 0.47 -0.87 -0.27 0.00 1.31 0.00 0.00 55.95 56.59 1bia s SER 315 Cb -0.20 0.28 -0.05 0.00 0.21 0.00 0.00 66.02 66.25 1bia s SER 315 CO 0.26 -0.68 0.83 -0.22 0.41 0.00 0.00 173.24 173.83 1bia s LEU 316 N -2.91 4.45 0.00 2.44 2.96 -1.26 -0.76 118.68 123.60 1bia s LEU 316 Ca 0.08 1.54 0.00 0.00 -0.22 0.00 0.00 54.13 55.53 1bia s LEU 316 Cb 0.06 -3.34 0.00 0.00 0.50 0.00 0.00 46.19 43.41 1bia s LEU 316 CO -0.09 -0.03 0.41 -2.11 -1.32 0.00 0.00 176.35 173.22