#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bia s LYS 2 N 0.00 -0.35 0.39 7.34 0.00 -1.26 -4.98 119.74 120.88 2bia s LYS 2 Ca 0.00 0.39 -0.24 0.00 0.00 0.00 0.00 55.97 56.12 2bia s LYS 2 Cb 0.00 -1.66 -0.09 0.00 0.00 0.00 0.00 37.83 36.08 2bia s LYS 2 CO 0.00 -3.23 1.02 1.14 0.00 0.00 0.00 175.35 174.28 2bia s GLN 3 N -4.99 4.24 -0.07 1.78 -2.07 -1.26 -5.05 119.66 112.24 2bia s GLN 3 Ca 0.67 1.43 0.02 0.00 -1.82 0.00 0.00 55.36 55.66 2bia s GLN 3 Cb -0.17 -2.54 0.01 0.00 -1.09 0.00 0.00 33.01 29.22 2bia s GLN 3 CO 0.58 -0.05 -0.11 0.08 -1.32 0.00 0.00 175.29 174.47 2bia s VAL 4 N -1.72 1.09 -0.19 3.63 1.01 -1.26 -4.41 120.40 118.54 2bia s VAL 4 Ca 0.57 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 62.12 2bia s VAL 4 Cb -0.20 -1.01 0.03 0.00 0.00 0.00 0.00 36.38 35.21 2bia s VAL 4 CO 0.25 0.35 -0.17 -0.36 0.00 0.00 0.00 175.10 175.17 2bia s PHE 5 N 0.76 2.78 -0.74 5.22 0.40 0.72 -4.99 117.98 122.12 2bia s PHE 5 Ca -0.13 -1.73 -0.15 0.00 -0.60 0.00 0.00 56.93 54.32 2bia s PHE 5 Cb -0.15 -1.86 0.18 0.00 0.51 0.00 0.00 43.02 41.69 2bia s PHE 5 CO 0.03 -0.80 0.73 1.21 0.70 0.00 0.00 175.22 177.09 2bia s ASN 6 N 1.28 6.55 -0.40 1.36 3.84 -1.26 -0.49 114.94 125.82 2bia s ASN 6 Ca 0.02 -2.28 0.06 0.00 0.21 0.00 0.00 52.86 50.87 2bia s ASN 6 Cb -0.15 -2.24 0.70 0.00 -0.55 0.00 0.00 41.25 39.02 2bia s ASN 6 CO -0.11 -0.75 1.88 0.49 -2.79 0.00 0.00 177.10 175.82 2bia n PHE 7 N 4.79 2.85 -1.75 0.43 3.01 0.14 -4.57 117.46 122.36 2bia n PHE 7 Ca 0.06 -1.62 -0.39 0.00 1.01 0.00 0.00 57.45 56.51 2bia n PHE 7 Cb 0.45 -0.85 0.03 0.00 -0.01 0.00 0.00 39.48 39.10 2bia n PHE 7 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2bia n ASN 8 N -0.78 2.91 -0.10 4.37 3.02 -1.18 -3.46 115.26 120.03 2bia n ASN 8 Ca 0.53 1.04 0.13 0.00 -0.03 0.00 0.00 54.58 56.25 2bia n ASN 8 Cb 1.57 -1.58 0.39 0.00 -0.61 0.00 0.00 39.78 39.55 2bia n ASN 8 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bia n ALA 9 N -0.65 3.14 0.00 5.41 0.00 -1.26 -4.58 120.51 122.57 2bia n ALA 9 Ca 0.08 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2bia n ALA 9 Cb 0.43 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.68 2bia n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bia n GLY 10 N 1.41 2.08 3.46 0.00 0.00 -1.26 -4.86 105.19 106.02 2bia n GLY 10 Ca 0.09 0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.97 2bia n GLY 10 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bia n PRO 11 N 0.00 -1.80 -3.80 1.61 -0.02 -1.26 -5.04 135.00 124.68 2bia n PRO 11 Ca 0.00 -0.49 -0.14 0.00 -2.02 0.00 0.00 63.50 60.85 2bia n PRO 11 Cb 0.00 -2.09 -0.04 0.00 -0.02 0.00 0.00 33.50 31.35 2bia n PRO 11 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2bia n SER 12 N -3.94 -1.05 -4.68 2.55 3.41 -1.19 -4.76 113.62 103.95 2bia n SER 12 Ca 0.04 -2.77 -0.43 0.00 -0.26 0.00 0.00 58.87 55.46 2bia n SER 12 Cb 0.55 2.06 -0.01 0.00 -0.26 0.00 0.00 64.21 66.55 2bia n SER 12 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bia n ALA 13 N -0.95 1.07 -2.74 7.33 0.00 -1.26 -5.01 120.51 118.95 2bia n ALA 13 Ca -0.12 0.37 -0.24 0.00 0.00 0.00 0.00 53.44 53.45 2bia n ALA 13 Cb 0.53 -2.22 -0.06 0.00 0.00 0.00 0.00 19.45 17.70 2bia n ALA 13 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2bia s LEU 14 N -0.79 3.55 0.05 0.00 1.02 -1.26 -4.65 118.68 116.60 2bia s LEU 14 Ca 0.56 -0.36 -0.31 0.00 0.02 0.00 0.00 54.13 54.04 2bia s LEU 14 Cb -0.59 -2.12 -0.06 0.00 0.02 0.00 0.00 46.19 43.44 2bia s LEU 14 CO 0.62 0.02 1.31 -2.16 0.02 0.00 0.00 176.35 176.15 2bia s PRO 15 N -3.49 4.35 0.26 1.29 0.04 -1.26 -4.92 135.00 131.27 2bia s PRO 15 Ca 0.31 1.90 -0.08 0.00 0.04 0.00 0.00 61.00 63.17 2bia s PRO 15 Cb -0.08 -3.40 0.42 0.00 0.04 0.00 0.00 34.50 31.48 2bia s PRO 15 CO 0.22 -0.41 1.60 0.87 0.04 0.00 0.00 177.00 179.31 2bia h LYS 16 N 7.14 0.02 -0.21 4.56 1.79 -1.98 -0.57 116.57 127.31 2bia h LYS 16 Ca -0.40 -0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.08 2bia h LYS 16 Cb 1.20 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.83 2bia h LYS 16 CO 0.86 0.01 0.14 -1.35 -1.08 0.00 0.00 179.45 178.03 2bia h PRO 17 N 0.02 0.23 -0.58 3.15 0.11 -1.98 0.31 132.00 133.26 2bia h PRO 17 Ca 0.43 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 66.42 2bia h PRO 17 Cb 0.71 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 2bia h PRO 17 CO -0.83 0.15 -0.05 0.00 -0.21 0.00 0.00 178.00 177.06 2bia h ALA 18 N 1.87 0.82 -0.14 -0.75 0.00 -1.38 -0.20 119.26 119.48 2bia h ALA 18 Ca 0.08 -0.33 -0.16 0.00 0.00 0.00 0.00 54.91 54.50 2bia h ALA 18 Cb 0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2bia h ALA 18 CO -0.02 0.67 -0.59 -0.07 0.00 0.00 0.00 179.25 179.24 2bia h LEU 19 N 0.94 0.54 -0.47 0.00 3.38 -1.01 -1.20 115.31 117.49 2bia h LEU 19 Ca 0.16 -0.30 -0.16 0.00 0.09 0.00 0.00 57.88 57.67 2bia h LEU 19 Cb 0.61 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2bia h LEU 19 CO 0.04 1.01 -0.44 -0.33 0.09 0.00 0.00 178.44 178.80 2bia h GLU 20 N 0.36 0.77 -0.15 1.13 5.08 -0.30 -0.12 114.58 121.34 2bia h GLU 20 Ca -0.00 -0.43 -0.01 0.00 -1.00 0.00 0.00 59.36 57.92 2bia h GLU 20 Cb 1.13 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 2bia h GLU 20 CO 0.11 1.05 0.04 -0.09 -1.00 0.00 0.00 179.01 179.12 2bia h ARG 21 N 0.62 0.24 -0.99 2.33 2.43 -0.97 -1.33 114.38 116.71 2bia h ARG 21 Ca 0.04 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.19 2bia h ARG 21 Cb 1.01 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.47 2bia h ARG 21 CO 0.10 0.37 0.65 0.00 -1.51 0.00 0.00 179.97 179.58 2bia h ALA 22 N 0.85 1.31 -0.47 2.80 0.00 -0.98 -2.75 119.26 120.02 2bia h ALA 22 Ca 0.05 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2bia h ALA 22 Cb 0.24 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2bia h ALA 22 CO -0.00 0.56 0.13 0.37 0.00 0.00 0.00 179.25 180.31 2bia h GLN 23 N 1.27 0.75 -0.76 0.00 4.15 -0.74 -2.08 115.11 117.71 2bia h GLN 23 Ca 0.39 -0.17 -0.04 0.00 0.77 0.00 0.00 58.65 59.60 2bia h GLN 23 Cb -0.02 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 27.53 2bia h GLN 23 CO -0.12 0.72 0.33 -0.22 -1.93 0.00 0.00 178.83 177.62 2bia h LYS 24 N 0.64 1.10 -0.55 1.69 3.64 -0.99 -2.99 116.57 119.10 2bia h LYS 24 Ca 0.15 -0.17 -0.14 0.00 -1.27 0.00 0.00 60.65 59.21 2bia h LYS 24 Cb 0.30 -0.19 -0.09 0.00 -0.41 0.00 0.00 32.23 31.84 2bia h LYS 24 CO -0.00 0.87 0.14 -0.85 -2.27 0.00 0.00 179.45 177.34 2bia n GLU 25 N -4.30 3.31 0.13 1.90 0.28 -1.06 -4.64 120.64 116.26 2bia n GLU 25 Ca 0.07 -3.05 0.01 0.00 -0.16 0.00 0.00 57.16 54.03 2bia n GLU 25 Cb 0.16 -2.07 0.32 0.00 1.43 0.00 0.00 31.44 31.28 2bia n GLU 25 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 2bia h LEU 26 N 2.27 0.15 0.00 -1.84 5.85 -1.22 -2.74 115.31 117.78 2bia h LEU 26 Ca 0.18 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 2bia h LEU 26 Cb 1.99 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.98 2bia h LEU 26 CO 0.54 0.47 -1.74 0.18 -0.34 0.00 0.00 178.44 177.55 2bia n LEU 27 N -4.12 0.22 -3.42 2.25 4.77 -1.26 -4.05 117.00 111.39 2bia n LEU 27 Ca -0.01 0.09 -0.22 0.00 -0.03 0.00 0.00 56.01 55.83 2bia n LEU 27 Cb 0.39 -0.01 -0.10 0.00 -2.33 0.00 0.00 43.42 41.37 2bia n LEU 27 CO 0.40 -0.05 -0.23 0.21 -1.33 0.00 0.00 177.39 176.39 2bia s ASN 28 N -4.74 2.12 -0.16 -1.43 2.47 -1.04 -2.97 114.94 109.19 2bia s ASN 28 Ca -0.06 -1.58 -0.16 0.00 0.42 0.00 0.00 52.86 51.48 2bia s ASN 28 Cb 0.13 0.14 -0.04 0.00 -1.45 0.00 0.00 41.25 40.03 2bia s ASN 28 CO 0.88 -0.32 0.40 0.12 -3.72 0.00 0.00 177.10 174.46 2bia s PHE 29 N 1.57 3.45 -1.47 0.43 5.36 0.68 -4.27 117.98 123.74 2bia s PHE 29 Ca 0.15 0.72 -0.11 0.00 -0.96 0.00 0.00 56.93 56.73 2bia s PHE 29 Cb -0.18 -2.48 0.06 0.00 -0.34 0.00 0.00 43.02 40.09 2bia s PHE 29 CO -0.12 0.13 0.83 -1.71 -1.46 0.00 0.00 175.22 172.90 2bia n ASN 30 N 3.89 -4.97 -0.95 6.13 4.05 -1.26 -1.36 115.26 120.79 2bia n ASN 30 Ca -0.09 -0.59 -0.12 0.00 0.45 0.00 0.00 54.58 54.23 2bia n ASN 30 Cb 0.51 -3.99 -0.05 0.00 1.23 0.00 0.00 39.78 37.48 2bia n ASN 30 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 2bia n ASP 31 N -2.67 -5.63 -0.00 1.20 8.00 -1.26 -4.85 116.55 111.34 2bia n ASP 31 Ca 0.00 0.31 0.14 0.00 0.71 0.00 0.00 54.79 55.95 2bia n ASP 31 Cb 0.55 -4.22 0.59 0.00 -0.02 0.00 0.00 41.12 38.02 2bia n ASP 31 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2bia n THR 32 N -2.26 0.00 -1.16 -3.53 -2.24 -0.46 -4.90 114.28 99.73 2bia n THR 32 Ca -0.12 -0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.60 2bia n THR 32 Cb 0.60 -0.40 -0.02 0.00 -2.10 0.00 0.00 70.33 68.40 2bia n THR 32 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bia n GLN 33 N -1.47 -0.99 -4.27 -0.78 1.13 -1.26 -4.96 117.38 104.78 2bia n GLN 33 Ca 0.07 0.57 -0.22 0.00 -1.94 0.00 0.00 57.00 55.48 2bia n GLN 33 Cb 0.33 -4.48 -0.12 0.00 0.11 0.00 0.00 30.24 26.08 2bia n GLN 33 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 2bia s MET 34 N -1.97 1.08 0.65 -1.09 -1.94 -1.23 -4.78 119.30 110.01 2bia s MET 34 Ca 0.00 -1.16 -0.17 0.00 -1.71 0.00 0.00 55.69 52.65 2bia s MET 34 Cb 0.00 -1.24 -0.01 0.00 2.01 0.00 0.00 34.83 35.59 2bia s MET 34 CO 0.00 0.28 1.19 0.45 -0.01 0.00 0.00 175.02 176.93 2bia s SER 35 N -2.01 4.86 0.49 3.03 0.15 -1.16 -0.23 113.70 118.84 2bia s SER 35 Ca 0.06 2.32 0.18 0.00 0.70 0.00 0.00 55.95 59.21 2bia s SER 35 Cb -0.09 -2.59 1.22 0.00 -1.71 0.00 0.00 66.02 62.85 2bia s SER 35 CO 0.04 -1.81 2.08 1.62 1.20 0.00 0.00 173.24 176.36 2bia h VAL 36 N 0.38 0.96 0.00 4.45 3.04 -1.84 0.60 116.25 123.84 2bia h VAL 36 Ca -0.49 -0.36 0.00 0.00 -1.01 0.00 0.00 66.70 64.84 2bia h VAL 36 Cb 1.29 1.20 0.00 0.00 -2.01 0.00 0.00 31.29 31.77 2bia h VAL 36 CO 0.53 0.10 0.00 0.23 -1.01 0.00 0.00 177.57 177.42 2bia n MET 37 N -4.26 0.10 -0.07 4.17 2.81 -1.26 -2.94 117.12 115.66 2bia n MET 37 Ca -0.03 0.46 0.07 0.00 -1.81 0.00 0.00 57.70 56.39 2bia n MET 37 Cb 0.18 -1.74 0.10 0.00 -0.71 0.00 0.00 33.22 31.05 2bia n MET 37 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2bia n GLU 38 N -1.93 1.58 -3.30 0.03 1.02 0.20 -5.00 120.64 113.23 2bia n GLU 38 Ca 0.01 -1.62 -0.29 0.00 -0.02 0.00 0.00 57.16 55.24 2bia n GLU 38 Cb 0.12 -1.29 -0.03 0.00 -0.02 0.00 0.00 31.44 30.21 2bia n GLU 38 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2bia s LEU 39 N -1.11 4.04 0.33 -4.62 1.43 -1.15 -4.94 118.68 112.66 2bia s LEU 39 Ca 0.21 0.74 -0.28 0.00 -1.03 0.00 0.00 54.13 53.77 2bia s LEU 39 Cb 0.13 -3.56 -0.10 0.00 0.03 0.00 0.00 46.19 42.69 2bia s LEU 39 CO 0.18 -0.21 1.19 -0.55 0.23 0.00 0.00 176.35 177.20 2bia s SER 40 N -3.17 6.90 0.00 2.29 0.15 -1.26 -4.92 113.70 113.69 2bia s SER 40 Ca 0.44 2.45 0.25 0.00 0.70 0.00 0.00 55.95 59.79 2bia s SER 40 Cb -0.11 -2.63 1.39 0.00 -1.71 0.00 0.00 66.02 62.96 2bia s SER 40 CO 0.30 -0.42 1.83 0.00 1.20 0.00 0.00 173.24 176.15 2bia n HIS 41 N 0.77 0.00 1.08 3.44 1.44 -1.26 -1.55 115.22 119.14 2bia n HIS 41 Ca 0.01 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.83 2bia n HIS 41 Cb 0.44 -0.10 0.12 0.00 0.12 0.00 0.00 29.99 30.57 2bia n HIS 41 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2bia n ARG 42 N -1.10 1.20 -1.90 -1.40 5.12 -1.26 -4.43 116.66 112.89 2bia n ARG 42 Ca 0.16 -0.92 -0.34 0.00 -1.93 0.00 0.00 57.85 54.82 2bia n ARG 42 Cb 0.12 -1.48 0.04 0.00 -1.16 0.00 0.00 32.46 29.98 2bia n ARG 42 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2bia s SER 43 N -2.44 5.19 0.35 0.55 1.04 -0.59 -4.88 113.70 112.92 2bia s SER 43 Ca 0.21 2.14 0.13 0.00 0.48 0.00 0.00 55.95 58.92 2bia s SER 43 Cb 0.19 -2.57 0.63 0.00 0.10 0.00 0.00 66.02 64.37 2bia s SER 43 CO 0.53 -1.58 1.76 -0.61 0.98 0.00 0.00 173.24 174.32 2bia h GLN 44 N 0.45 0.00 -0.46 4.02 4.15 -1.93 -0.48 115.11 120.86 2bia h GLN 44 Ca -0.48 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 58.90 2bia h GLN 44 Cb 1.26 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.93 2bia h GLN 44 CO 0.54 0.44 0.15 0.77 -1.93 0.00 0.00 178.83 178.81 2bia h SER 45 N 0.00 0.66 -0.31 -0.69 0.02 -1.91 -1.69 113.55 109.62 2bia h SER 45 Ca -0.00 -0.20 -0.14 0.00 -0.84 0.00 0.00 61.79 60.61 2bia h SER 45 Cb 0.82 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.18 2bia h SER 45 CO 0.06 0.68 -0.36 0.22 -1.14 0.00 0.00 176.83 176.28 2bia h TYR 46 N 0.60 0.97 -0.56 3.45 3.20 -1.71 -3.13 116.97 119.78 2bia h TYR 46 Ca 0.15 -0.30 -0.01 0.00 3.14 0.00 0.00 58.73 61.71 2bia h TYR 46 Cb 0.25 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 2bia h TYR 46 CO 0.01 1.09 0.32 0.93 -1.64 0.00 0.00 178.16 178.87 2bia h GLU 47 N 0.57 0.76 -0.56 1.82 5.08 -0.95 -0.65 114.58 120.65 2bia h GLU 47 Ca 0.04 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 2bia h GLU 47 Cb 0.95 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 30.00 2bia h GLU 47 CO 0.09 0.55 0.31 1.49 -1.00 0.00 0.00 179.01 180.45 2bia h GLU 48 N 0.77 0.59 -0.41 2.33 4.81 -1.29 0.52 114.58 121.91 2bia h GLU 48 Ca 0.20 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.36 2bia h GLU 48 Cb -0.01 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 2bia h GLU 48 CO -0.04 0.39 0.13 0.28 -0.73 0.00 0.00 179.01 179.05 2bia h VAL 49 N 0.61 1.21 -0.15 0.32 2.07 -1.17 0.69 116.25 119.84 2bia h VAL 49 Ca 0.24 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 2bia h VAL 49 Cb 0.09 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2bia h VAL 49 CO -0.13 0.25 0.06 -0.74 0.02 0.00 0.00 177.57 177.02 2bia h HIS 50 N 0.51 0.24 -0.43 1.57 -0.00 -0.84 0.71 115.15 116.92 2bia h HIS 50 Ca 0.13 -0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.43 2bia h HIS 50 Cb 0.25 -0.07 -0.02 0.00 -0.00 0.00 0.00 27.41 27.57 2bia h HIS 50 CO 0.01 0.32 0.08 1.49 -0.00 0.00 0.00 177.93 179.83 2bia h GLU 51 N 0.08 0.71 -0.76 5.26 4.57 -0.87 -2.72 114.58 120.85 2bia h GLU 51 Ca 0.05 -0.19 -0.01 0.00 -1.18 0.00 0.00 59.36 58.03 2bia h GLU 51 Cb 0.19 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.66 2bia h GLU 51 CO -0.00 0.73 0.43 0.37 -1.18 0.00 0.00 179.01 179.36 2bia h GLN 52 N 0.57 1.05 -0.78 1.92 4.15 -0.56 0.36 115.11 121.82 2bia h GLN 52 Ca 0.13 -0.12 0.03 0.00 0.77 0.00 0.00 58.65 59.47 2bia h GLN 52 Cb 0.36 -0.21 -0.05 0.00 0.21 0.00 0.00 27.48 27.79 2bia h GLN 52 CO 0.01 0.77 0.50 0.00 -1.93 0.00 0.00 178.83 178.17 2bia h ALA 53 N 1.22 1.02 -0.39 3.38 0.00 -0.71 0.10 119.26 123.89 2bia h ALA 53 Ca 0.27 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 2bia h ALA 53 Cb 0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2bia h ALA 53 CO -0.04 0.30 0.20 1.96 0.00 0.00 0.00 179.25 181.66 2bia h GLN 54 N 0.96 0.55 -0.38 0.00 4.20 -1.11 -2.24 115.11 117.09 2bia h GLN 54 Ca 0.31 -0.07 -0.12 0.00 0.06 0.00 0.00 58.65 58.83 2bia h GLN 54 Cb 0.02 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 2bia h GLN 54 CO -0.11 0.47 -0.25 -0.91 -0.67 0.00 0.00 178.83 177.35 2bia h ASN 55 N 0.49 0.80 -0.49 1.46 2.35 -0.14 -1.41 115.58 118.64 2bia h ASN 55 Ca 0.13 -0.30 -0.02 0.00 -0.55 0.00 0.00 56.30 55.56 2bia h ASN 55 Cb 0.09 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 2bia h ASN 55 CO -0.02 1.02 0.24 -0.07 -1.65 0.00 0.00 177.43 176.95 2bia h LEU 56 N 0.68 0.64 -0.39 1.61 3.38 -0.79 -0.92 115.31 119.51 2bia h LEU 56 Ca 0.09 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2bia h LEU 56 Cb 0.78 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 2bia h LEU 56 CO 0.06 0.58 0.24 -0.07 0.09 0.00 0.00 178.44 179.34 2bia h LEU 57 N 0.65 0.47 -0.36 1.67 3.38 -1.04 0.50 115.31 120.57 2bia h LEU 57 Ca 0.17 -0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.15 2bia h LEU 57 Cb 0.11 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 2bia h LEU 57 CO -0.02 0.38 0.03 -0.09 0.09 0.00 0.00 178.44 178.83 2bia h ARG 58 N 0.51 0.14 -0.22 1.13 2.43 -1.13 -0.69 114.38 116.54 2bia h ARG 58 Ca 0.14 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.21 2bia h ARG 58 Cb 0.00 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.52 2bia h ARG 58 CO -0.03 0.09 -0.22 1.49 -1.51 0.00 0.00 179.97 179.80 2bia h GLU 59 N 0.14 0.54 -0.50 0.20 4.81 -0.97 0.13 114.58 118.94 2bia h GLU 59 Ca 0.18 -0.29 -0.09 0.00 -0.13 0.00 0.00 59.36 59.03 2bia h GLU 59 Cb 0.23 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 2bia h GLU 59 CO -0.27 0.87 -0.05 -0.07 -0.73 0.00 0.00 179.01 178.76 2bia h LEU 60 N 0.24 0.91 -1.40 1.64 3.38 -0.65 -2.98 115.31 116.44 2bia h LEU 60 Ca 0.04 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2bia h LEU 60 Cb 0.77 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2bia h LEU 60 CO 0.05 1.03 -0.09 0.18 0.09 0.00 0.00 178.44 179.70 2bia n LEU 61 N -4.27 2.28 -3.59 1.67 4.77 -0.29 -4.46 117.00 113.11 2bia n LEU 61 Ca 0.01 -0.77 -0.26 0.00 -0.03 0.00 0.00 56.01 54.96 2bia n LEU 61 Cb 0.35 -0.01 0.05 0.00 -2.33 0.00 0.00 43.42 41.48 2bia n LEU 61 CO 0.43 0.39 -0.05 0.00 -1.33 0.00 0.00 177.39 176.83 2bia n GLN 62 N 0.65 -1.92 -2.54 3.23 6.02 -0.23 -4.64 117.38 117.95 2bia n GLN 62 Ca 0.14 0.57 -0.42 0.00 -0.01 0.00 0.00 57.00 57.28 2bia n GLN 62 Cb 0.49 -4.64 -0.03 0.00 1.02 0.00 0.00 30.24 27.08 2bia n GLN 62 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2bia s ILE 63 N -3.48 4.32 0.71 5.09 1.01 0.30 -4.78 121.20 124.36 2bia s ILE 63 Ca 0.41 1.70 -0.16 0.00 0.00 0.00 0.00 60.65 62.60 2bia s ILE 63 Cb -0.12 -4.09 0.03 0.00 0.01 0.00 0.00 42.46 38.29 2bia s ILE 63 CO 0.83 0.15 1.24 -2.84 0.00 0.00 0.00 174.94 174.32 2bia s PRO 64 N 0.88 2.23 0.24 2.79 0.02 -1.26 -4.90 135.00 135.00 2bia s PRO 64 Ca 0.55 1.87 0.18 0.00 0.02 0.00 0.00 61.00 63.62 2bia s PRO 64 Cb -0.26 -1.83 0.91 0.00 0.02 0.00 0.00 34.50 33.34 2bia s PRO 64 CO 0.29 -1.79 1.55 0.09 -0.33 0.00 0.00 177.00 176.82 2bia n ASN 65 N -2.48 0.46 -1.42 2.53 3.02 -1.26 -1.16 115.26 114.95 2bia n ASN 65 Ca 0.14 0.69 0.10 0.00 -0.03 0.00 0.00 54.58 55.48 2bia n ASN 65 Cb 0.49 -0.76 0.33 0.00 -0.61 0.00 0.00 39.78 39.23 2bia n ASN 65 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2bia n ASP 66 N -2.09 4.15 -4.64 6.41 5.75 -1.26 -4.84 116.55 120.03 2bia n ASP 66 Ca -0.00 -2.20 -0.31 0.00 -0.01 0.00 0.00 54.79 52.26 2bia n ASP 66 Cb 0.08 -0.52 -0.09 0.00 -1.03 0.00 0.00 41.12 39.56 2bia n ASP 66 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 2bia s TYR 67 N -1.43 2.95 0.11 2.11 1.51 -0.31 -1.70 117.35 120.59 2bia s TYR 67 Ca 0.48 -0.02 0.09 0.00 -1.01 0.00 0.00 57.07 56.61 2bia s TYR 67 Cb 0.28 -1.59 -0.04 0.00 -0.11 0.00 0.00 41.96 40.50 2bia s TYR 67 CO 0.28 0.43 -0.16 -1.14 -1.11 0.00 0.00 175.55 173.85 2bia s GLN 68 N -1.78 1.85 -0.26 -0.62 0.74 -0.08 -4.90 119.66 114.62 2bia s GLN 68 Ca 0.20 -1.15 -0.09 0.00 0.05 0.00 0.00 55.36 54.38 2bia s GLN 68 Cb -0.11 -2.15 -0.04 0.00 1.10 0.00 0.00 33.01 31.81 2bia s GLN 68 CO 0.12 0.49 0.13 0.42 -0.55 0.00 0.00 175.29 175.89 2bia s ILE 69 N -1.15 4.78 0.01 -2.34 1.01 -1.26 -0.56 121.20 121.68 2bia s ILE 69 Ca 0.19 -0.01 0.01 0.00 0.00 0.00 0.00 60.65 60.83 2bia s ILE 69 Cb -0.11 -3.26 -0.04 0.00 0.01 0.00 0.00 42.46 39.07 2bia s ILE 69 CO 0.11 0.30 0.06 -0.76 0.00 0.00 0.00 174.94 174.64 2bia s LEU 70 N 1.68 3.79 -0.27 2.97 1.43 0.58 -4.91 118.68 123.95 2bia s LEU 70 Ca 0.07 0.09 0.02 0.00 -1.03 0.00 0.00 54.13 53.28 2bia s LEU 70 Cb -0.16 -2.24 0.06 0.00 0.03 0.00 0.00 46.19 43.89 2bia s LEU 70 CO 0.07 0.26 -0.09 -0.36 0.23 0.00 0.00 176.35 176.46 2bia s PHE 71 N -1.20 3.29 0.30 0.29 2.99 -1.26 -1.48 117.98 120.91 2bia s PHE 71 Ca 0.23 -2.30 0.11 0.00 0.00 0.00 0.00 56.93 54.97 2bia s PHE 71 Cb -0.12 -1.99 -0.05 0.00 0.00 0.00 0.00 43.02 40.86 2bia s PHE 71 CO 0.14 -0.87 -0.13 -0.51 -0.00 0.00 0.00 175.22 173.84 2bia s LEU 72 N 1.11 2.73 0.43 -0.37 1.43 -0.37 -4.85 118.68 118.78 2bia s LEU 72 Ca -0.08 -1.03 0.05 0.00 -1.03 0.00 0.00 54.13 52.04 2bia s LEU 72 Cb -0.20 -1.16 0.01 0.00 0.03 0.00 0.00 46.19 44.87 2bia s LEU 72 CO -0.05 -0.05 0.60 -1.10 0.23 0.00 0.00 176.35 175.98 2bia s GLN 73 N -3.57 2.90 0.00 1.70 -0.21 -1.26 -0.85 119.66 118.37 2bia s GLN 73 Ca 0.31 -0.95 0.00 0.00 0.02 0.00 0.00 55.36 54.74 2bia s GLN 73 Cb -0.03 -2.69 0.00 0.00 1.00 0.00 0.00 33.01 31.29 2bia s GLN 73 CO 0.16 -0.26 0.00 0.41 -2.12 0.00 0.00 175.29 173.48 2bia n GLY 74 N -1.93 0.83 0.15 3.09 0.00 -1.26 -4.88 105.19 101.19 2bia n GLY 74 Ca 0.04 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.08 2bia n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bia n GLY 75 N -0.92 -1.73 0.27 -0.02 0.00 -1.26 -2.70 105.19 98.83 2bia n GLY 75 Ca 0.00 -1.48 0.04 0.00 0.00 0.00 0.00 46.02 44.58 2bia n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bia h ALA 76 N -0.14 1.65 -0.93 4.61 0.00 -1.94 -2.53 119.26 119.98 2bia h ALA 76 Ca -0.00 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.85 2bia h ALA 76 Cb 0.14 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 2bia h ALA 76 CO 0.00 0.27 0.61 0.77 0.00 0.00 0.00 179.25 180.90 2bia h SER 77 N 0.31 0.96 0.21 0.00 0.02 -2.01 0.11 113.55 113.15 2bia h SER 77 Ca 0.07 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.94 2bia h SER 77 Cb 0.16 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 2bia h SER 77 CO -0.00 0.63 -0.33 0.25 -1.14 0.00 0.00 176.83 176.24 2bia h LEU 78 N 1.10 0.19 -1.40 5.07 5.85 -1.24 -2.56 115.31 122.32 2bia h LEU 78 Ca 0.39 -0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.98 2bia h LEU 78 Cb 0.14 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2bia h LEU 78 CO -0.14 0.51 -0.30 1.56 -0.34 0.00 0.00 178.44 179.73 2bia h GLN 79 N 0.16 0.00 -0.84 1.25 1.08 -0.74 -0.02 115.11 116.00 2bia h GLN 79 Ca 0.02 0.00 0.18 0.00 -1.45 0.00 0.00 58.65 57.40 2bia h GLN 79 Cb 0.67 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 28.04 2bia h GLN 79 CO 0.05 0.30 0.56 0.74 -0.95 0.00 0.00 178.83 179.53 2bia h PHE 80 N 0.00 0.50 0.00 2.96 0.05 -0.89 -1.22 116.94 118.34 2bia h PHE 80 Ca -0.00 0.01 -0.37 0.00 3.82 0.00 0.00 57.97 61.43 2bia h PHE 80 Cb 0.54 -0.15 -0.07 0.00 2.00 0.00 0.00 35.95 38.27 2bia h PHE 80 CO 0.00 0.16 -2.37 -2.37 -0.18 0.00 0.00 178.31 173.54 2bia n THR 81 N -4.49 1.45 -0.03 -1.55 5.66 -0.75 -4.34 114.28 110.25 2bia n THR 81 Ca 0.17 -0.75 0.03 0.00 -3.05 0.00 0.00 64.05 60.45 2bia n THR 81 Cb 0.64 -0.88 0.38 0.00 -1.55 0.00 0.00 70.33 68.92 2bia n THR 81 CO 0.00 0.00 0.00 0.24 -3.05 0.00 0.00 175.07 172.26 2bia h MET 82 N 0.00 0.59 0.35 1.09 2.86 -0.73 -0.81 114.93 118.28 2bia h MET 82 Ca -0.54 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.03 2bia h MET 82 Cb 2.10 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 33.64 2bia h MET 82 CO -0.01 0.43 -0.17 1.25 1.06 0.00 0.00 176.91 179.47 2bia h LEU 83 N 0.60 -0.40 -1.26 1.22 5.85 -1.43 -1.65 115.31 118.24 2bia h LEU 83 Ca 0.16 -0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.67 2bia h LEU 83 Cb 0.00 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 2bia h LEU 83 CO -0.03 -0.07 -0.33 1.55 -0.34 0.00 0.00 178.44 179.22 2bia h PRO 84 N -0.75 0.00 -0.10 5.25 0.13 -1.73 -0.61 132.00 134.19 2bia h PRO 84 Ca -0.05 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2bia h PRO 84 Cb 0.51 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.63 2bia h PRO 84 CO 0.08 0.33 0.05 1.98 -0.23 0.00 0.00 178.00 180.20 2bia h MET 85 N 0.00 0.14 0.02 0.86 4.05 -0.84 -0.79 114.93 118.37 2bia h MET 85 Ca -0.00 -0.01 -0.33 0.00 -0.28 0.00 0.00 59.70 59.08 2bia h MET 85 Cb 0.69 -0.03 -0.05 0.00 -0.80 0.00 0.00 31.60 31.41 2bia h MET 85 CO 0.04 0.11 -1.98 0.09 0.23 0.00 0.00 176.91 175.41 2bia n ASN 86 N -4.50 0.96 -0.00 1.39 3.02 -0.65 -4.65 115.26 110.83 2bia n ASN 86 Ca -0.01 0.24 0.03 0.00 -0.03 0.00 0.00 54.58 54.81 2bia n ASN 86 Cb 0.10 0.03 -0.05 0.00 -0.61 0.00 0.00 39.78 39.24 2bia n ASN 86 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2bia n LEU 87 N -3.07 0.00 -4.56 3.41 4.77 -0.30 -4.82 117.00 112.43 2bia n LEU 87 Ca -0.25 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.30 2bia n LEU 87 Cb 1.07 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 42.16 2bia n LEU 87 CO 0.43 0.00 1.81 -0.22 -1.33 0.00 0.00 177.39 178.09 2bia s LEU 88 N -3.51 4.01 0.62 2.23 2.96 -0.31 -4.84 118.68 119.83 2bia s LEU 88 Ca -0.03 -2.41 -0.03 0.00 -0.22 0.00 0.00 54.13 51.45 2bia s LEU 88 Cb 0.04 -2.55 0.04 0.00 0.50 0.00 0.00 46.19 44.23 2bia s LEU 88 CO 0.29 -1.14 0.88 0.42 -1.32 0.00 0.00 176.35 175.48 2bia s THR 89 N 3.89 2.59 0.32 3.68 -4.23 -1.26 -4.88 115.64 115.74 2bia s THR 89 Ca 0.51 -0.46 -0.29 0.00 -1.18 0.00 0.00 61.69 60.27 2bia s THR 89 Cb 0.02 -3.04 -0.12 0.00 1.34 0.00 0.00 72.50 70.71 2bia s THR 89 CO 0.04 -0.03 1.55 2.29 -0.54 0.00 0.00 174.62 177.93 2bia n LYS 90 N -2.60 2.66 -0.64 3.99 0.00 -1.26 -1.35 118.16 118.97 2bia n LYS 90 Ca 0.08 0.94 0.00 0.00 -0.00 0.00 0.00 58.31 59.33 2bia n LYS 90 Cb 0.60 -2.70 0.00 0.00 -0.00 0.00 0.00 35.03 32.93 2bia n LYS 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2bia n GLY 91 N 1.59 0.94 3.67 2.58 0.00 -1.26 -5.04 105.19 107.68 2bia n GLY 91 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 2bia n GLY 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bia s THR 92 N -3.33 2.36 -0.05 2.61 -4.23 -0.46 -4.89 115.64 107.65 2bia s THR 92 Ca 0.00 -1.87 0.04 0.00 -1.18 0.00 0.00 61.69 58.68 2bia s THR 92 Cb 0.00 -2.92 0.00 0.00 1.34 0.00 0.00 72.50 70.92 2bia s THR 92 CO 0.00 -0.08 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.21 2bia s ILE 93 N -2.59 1.35 -0.49 2.99 1.01 -0.09 -4.08 121.20 119.30 2bia s ILE 93 Ca 0.37 -0.66 -0.22 0.00 0.00 0.00 0.00 60.65 60.15 2bia s ILE 93 Cb 0.04 -1.18 0.04 0.00 0.01 0.00 0.00 42.46 41.37 2bia s ILE 93 CO 0.20 0.40 0.74 -0.83 0.00 0.00 0.00 174.94 175.45 2bia s GLY 94 N 0.17 1.63 -0.23 6.18 0.00 0.13 0.92 107.32 116.12 2bia s GLY 94 Ca -0.06 -1.36 -0.13 0.00 0.00 0.00 0.00 44.72 43.17 2bia s GLY 94 CO 0.03 1.70 0.27 0.21 0.00 0.00 0.00 173.10 175.31 2bia s ASN 95 N 2.48 6.23 -0.03 1.64 3.84 -1.07 -0.99 114.94 127.05 2bia s ASN 95 Ca 0.23 0.26 0.07 0.00 0.21 0.00 0.00 52.86 53.63 2bia s ASN 95 Cb -0.15 -2.16 -0.02 0.00 -0.55 0.00 0.00 41.25 38.37 2bia s ASN 95 CO 0.17 -0.02 -0.23 -0.31 -2.79 0.00 0.00 177.10 173.92 2bia s TYR 96 N 1.32 2.43 -0.29 0.43 1.51 -0.48 0.12 117.35 122.39 2bia s TYR 96 Ca 0.12 -0.43 -0.11 0.00 -1.01 0.00 0.00 57.07 55.65 2bia s TYR 96 Cb -0.14 -1.55 -0.04 0.00 -0.11 0.00 0.00 41.96 40.12 2bia s TYR 96 CO 0.07 -0.02 0.18 0.08 -1.11 0.00 0.00 175.55 174.75 2bia s VAL 97 N -0.55 5.13 -0.36 0.71 1.01 0.29 -0.99 120.40 125.63 2bia s VAL 97 Ca 0.08 0.01 -0.21 0.00 0.00 0.00 0.00 61.98 61.86 2bia s VAL 97 Cb -0.11 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.79 2bia s VAL 97 CO 0.00 0.20 0.65 -0.76 0.00 0.00 0.00 175.10 175.19 2bia s LEU 98 N 1.72 4.26 -0.00 3.92 1.43 -0.68 -4.45 118.68 124.88 2bia s LEU 98 Ca 0.07 0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.32 2bia s LEU 98 Cb -0.16 -2.80 0.01 0.00 0.03 0.00 0.00 46.19 43.27 2bia s LEU 98 CO 0.10 -0.61 0.78 0.35 0.23 0.00 0.00 176.35 177.20 2bia n THR 99 N 5.61 0.55 -3.23 5.49 -2.24 -1.26 -2.56 114.28 116.64 2bia n THR 99 Ca -0.01 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 2bia n THR 99 Cb 0.48 0.70 0.00 0.00 -2.10 0.00 0.00 70.33 69.41 2bia n THR 99 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bia n GLY 100 N -0.29 -1.18 0.28 3.38 0.00 -1.26 -4.84 105.19 101.27 2bia n GLY 100 Ca 0.01 -0.87 -0.10 0.00 0.00 0.00 0.00 46.02 45.06 2bia n GLY 100 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2bia h SER 101 N 0.00 0.97 -0.17 1.61 0.87 -1.99 -2.56 113.55 112.28 2bia h SER 101 Ca 0.00 -0.31 -0.06 0.00 -1.23 0.00 0.00 61.79 60.19 2bia h SER 101 Cb 0.00 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.68 2bia h SER 101 CO 0.00 1.04 -0.07 -0.50 -0.53 0.00 0.00 176.83 176.77 2bia h TRP 102 N 0.86 0.52 -0.72 2.24 4.06 -1.97 -0.68 115.95 120.25 2bia h TRP 102 Ca 0.15 -0.06 -0.03 0.00 2.06 0.00 0.00 58.89 61.01 2bia h TRP 102 Cb 0.56 -0.14 -0.03 0.00 -1.00 0.00 0.00 29.16 28.54 2bia h TRP 102 CO 0.04 0.56 0.34 0.77 -3.56 0.00 0.00 178.44 176.58 2bia h SER 103 N 0.46 0.96 -0.74 -3.49 0.02 -1.83 -1.92 113.55 107.01 2bia h SER 103 Ca 0.09 -0.14 -0.03 0.00 -0.84 0.00 0.00 61.79 60.87 2bia h SER 103 Cb 0.41 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.67 2bia h SER 103 CO 0.02 0.83 0.34 -0.33 -1.14 0.00 0.00 176.83 176.55 2bia h GLU 104 N 1.01 1.09 -0.73 3.45 5.08 -0.96 -2.01 114.58 121.51 2bia h GLU 104 Ca 0.25 -0.16 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 2bia h GLU 104 Cb 0.14 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 2bia h GLU 104 CO -0.03 0.85 0.26 0.87 -1.00 0.00 0.00 179.01 179.97 2bia h LYS 105 N 1.08 1.11 -0.20 2.33 1.79 -0.78 -1.25 116.57 120.64 2bia h LYS 105 Ca 0.26 -0.21 -0.00 0.00 -2.18 0.00 0.00 60.65 58.52 2bia h LYS 105 Cb 0.14 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 30.60 2bia h LYS 105 CO -0.03 0.92 0.13 0.00 -1.08 0.00 0.00 179.45 179.39 2bia h ALA 106 N 1.21 0.26 -0.42 3.86 0.00 -1.05 -2.81 119.26 120.31 2bia h ALA 106 Ca 0.24 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.14 2bia h ALA 106 Cb 0.25 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2bia h ALA 106 CO -0.01 -0.24 0.24 1.25 0.00 0.00 0.00 179.25 180.48 2bia h LEU 107 N 0.25 0.38 -0.74 0.00 5.85 -1.11 -1.80 115.31 118.14 2bia h LEU 107 Ca 0.07 0.01 0.12 0.00 0.84 0.00 0.00 57.88 58.92 2bia h LEU 107 Cb 0.01 -0.07 -0.09 0.00 0.37 0.00 0.00 40.66 40.88 2bia h LEU 107 CO -0.01 0.27 0.32 0.50 -0.34 0.00 0.00 178.44 179.18 2bia h LYS 108 N 0.48 0.49 -0.11 1.25 3.64 -1.13 -0.60 116.57 120.58 2bia h LYS 108 Ca 0.17 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.41 2bia h LYS 108 Cb 0.02 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 2bia h LYS 108 CO -0.09 0.32 -0.43 0.93 -2.27 0.00 0.00 179.45 177.92 2bia h GLU 109 N 0.50 0.27 -0.05 1.90 4.39 -1.08 -2.38 114.58 118.13 2bia h GLU 109 Ca 0.39 -0.13 -0.10 0.00 0.34 0.00 0.00 59.36 59.86 2bia h GLU 109 Cb 0.54 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 2bia h GLU 109 CO -0.35 0.65 -0.44 0.00 -1.16 0.00 0.00 179.01 177.71 2bia h ALA 110 N 1.33 1.17 0.00 3.43 0.00 -0.75 -2.50 119.26 121.94 2bia h ALA 110 Ca 0.02 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2bia h ALA 110 Cb 0.86 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 2bia h ALA 110 CO 0.07 0.58 -0.03 0.87 0.00 0.00 0.00 179.25 180.74 2bia h LYS 111 N 0.10 0.00 0.00 0.00 1.57 -0.64 0.12 116.57 117.72 2bia h LYS 111 Ca 0.01 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2bia h LYS 111 Cb 0.82 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 2bia h LYS 111 CO 0.06 0.03 -0.20 -0.07 -0.57 0.00 0.00 179.45 178.70 2bia h LEU 112 N 0.00 0.00 0.00 2.94 3.38 -1.37 -3.34 115.31 116.92 2bia h LEU 112 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2bia h LEU 112 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2bia h LEU 112 CO 0.00 0.20 -0.66 0.18 0.09 0.00 0.00 178.44 178.25 2bia n LEU 113 N -3.35 0.06 0.00 1.67 4.77 0.23 -5.11 117.00 115.27 2bia n LEU 113 Ca 0.00 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 2bia n LEU 113 Cb 0.42 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 2bia n LEU 113 CO 0.33 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 2bia n GLY 114 N 1.74 0.85 3.71 -0.72 0.00 -0.15 -5.01 105.19 105.61 2bia n GLY 114 Ca -0.00 -0.84 -0.42 0.00 0.00 0.00 0.00 46.02 44.76 2bia n GLY 114 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bia s GLU 115 N -1.78 4.35 0.29 1.61 0.41 -1.26 -4.47 118.70 117.85 2bia s GLU 115 Ca 0.00 2.00 0.08 0.00 -0.41 0.00 0.00 54.97 56.65 2bia s GLU 115 Cb 0.00 -3.27 -0.06 0.00 -1.78 0.00 0.00 34.13 29.02 2bia s GLU 115 CO 0.00 -0.40 -0.10 0.95 -0.49 0.00 0.00 175.26 175.22 2bia s THR 116 N 1.09 1.96 0.06 3.63 -4.23 -1.26 0.17 115.64 117.07 2bia s THR 116 Ca 0.63 -2.21 -0.03 0.00 -1.18 0.00 0.00 61.69 58.90 2bia s THR 116 Cb -0.35 -2.43 -0.03 0.00 1.34 0.00 0.00 72.50 71.03 2bia s THR 116 CO 0.30 -0.33 0.04 -2.28 -0.54 0.00 0.00 174.62 171.81 2bia s HIS 117 N -2.81 0.39 -0.26 3.99 2.46 -0.16 -4.81 115.29 114.10 2bia s HIS 117 Ca 0.29 -0.89 -0.01 0.00 0.47 0.00 0.00 55.06 54.92 2bia s HIS 117 Cb 0.01 -0.28 0.03 0.00 -0.13 0.00 0.00 32.58 32.22 2bia s HIS 117 CO 0.13 -0.42 -0.06 0.42 -2.47 0.00 0.00 174.74 172.34 2bia s ILE 118 N -3.78 2.85 0.17 0.89 1.01 -1.26 -1.38 121.20 119.69 2bia s ILE 118 Ca 0.05 -1.11 -0.02 0.00 0.00 0.00 0.00 60.65 59.57 2bia s ILE 118 Cb 0.06 -2.48 -0.11 0.00 0.01 0.00 0.00 42.46 39.94 2bia s ILE 118 CO -0.10 0.15 1.43 0.00 0.00 0.00 0.00 174.94 176.42 2bia h ALA 119 N 8.00 0.58 -1.98 9.38 0.00 -1.27 -3.45 119.26 130.53 2bia h ALA 119 Ca -0.30 -0.60 0.15 0.00 0.00 0.00 0.00 54.91 54.16 2bia h ALA 119 Cb 1.10 -0.06 -0.17 0.00 0.00 0.00 0.00 17.79 18.66 2bia h ALA 119 CO 0.56 0.75 0.60 0.00 0.00 0.00 0.00 179.25 181.17 2bia s ALA 120 N -3.64 -1.91 -0.22 0.00 0.00 -1.26 -0.34 121.76 114.39 2bia s ALA 120 Ca -0.06 1.24 -0.26 0.00 0.00 0.00 0.00 51.96 52.88 2bia s ALA 120 Cb 0.10 0.17 0.08 0.00 0.00 0.00 0.00 23.12 23.47 2bia s ALA 120 CO 0.84 -0.63 0.77 0.45 0.00 0.00 0.00 175.76 177.19 2bia s SER 121 N -2.29 -0.67 -0.16 0.00 0.15 -1.26 -1.69 113.70 107.78 2bia s SER 121 Ca 0.06 1.17 0.16 0.00 0.70 0.00 0.00 55.95 58.04 2bia s SER 121 Cb -0.01 1.14 0.49 0.00 -1.71 0.00 0.00 66.02 65.93 2bia s SER 121 CO -0.07 -0.31 1.39 0.35 1.20 0.00 0.00 173.24 175.80 2bia n THR 122 N 2.18 2.13 0.15 6.45 -2.24 -1.06 -4.72 114.28 117.16 2bia n THR 122 Ca -0.15 -1.81 0.05 0.00 -2.27 0.00 0.00 64.05 59.88 2bia n THR 122 Cb 0.56 -0.17 0.51 0.00 -2.10 0.00 0.00 70.33 69.12 2bia n THR 122 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2bia h LYS 123 N 1.71 0.21 -0.49 -0.78 3.64 -1.95 -0.16 116.57 118.75 2bia h LYS 123 Ca 0.00 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 2bia h LYS 123 Cb 1.34 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.10 2bia h LYS 123 CO 0.19 0.21 0.18 0.00 -2.27 0.00 0.00 179.45 177.75 2bia h ALA 124 N 1.83 1.39 -0.76 5.00 0.00 -1.99 -1.57 119.26 123.17 2bia h ALA 124 Ca 0.05 -0.15 -0.32 0.00 0.00 0.00 0.00 54.91 54.50 2bia h ALA 124 Cb 0.10 -0.20 -0.19 0.00 0.00 0.00 0.00 17.79 17.50 2bia h ALA 124 CO -0.00 0.45 0.35 0.09 0.00 0.00 0.00 179.25 180.15 2bia n ASN 125 N -4.34 4.01 -2.26 0.00 4.13 -1.01 -4.92 115.26 110.88 2bia n ASN 125 Ca 0.04 -3.45 -0.17 0.00 1.68 0.00 0.00 54.58 52.68 2bia n ASN 125 Cb 0.17 -0.75 0.02 0.00 -1.54 0.00 0.00 39.78 37.68 2bia n ASN 125 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2bia n SER 126 N -0.71 -4.93 -3.55 6.41 7.64 -0.59 -3.64 113.62 114.26 2bia n SER 126 Ca 0.46 -0.20 -0.20 0.00 1.01 0.00 0.00 58.87 59.94 2bia n SER 126 Cb 1.42 -3.81 0.06 0.00 -1.01 0.00 0.00 64.21 60.87 2bia n SER 126 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2bia n TYR 127 N -4.18 -2.08 1.07 1.43 0.53 -0.11 -4.88 117.16 108.94 2bia n TYR 127 Ca -0.09 0.83 0.12 0.00 -1.02 0.00 0.00 57.90 57.74 2bia n TYR 127 Cb 0.59 -4.45 0.13 0.00 -1.03 0.00 0.00 39.34 34.59 2bia n TYR 127 CO 0.00 0.00 0.00 1.04 -1.02 0.00 0.00 176.86 176.88 2bia n GLN 128 N -4.04 0.63 -3.91 -0.72 6.02 -1.24 -4.83 117.38 109.28 2bia n GLN 128 Ca -0.24 -0.46 -0.09 0.00 -0.01 0.00 0.00 57.00 56.20 2bia n GLN 128 Cb 0.66 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 30.37 2bia n GLN 128 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2bia s SER 129 N -2.69 -0.07 -0.11 1.08 1.04 -1.26 0.05 113.70 111.74 2bia s SER 129 Ca 0.17 -0.78 -0.22 0.00 0.48 0.00 0.00 55.95 55.60 2bia s SER 129 Cb 0.18 0.50 -0.03 0.00 0.10 0.00 0.00 66.02 66.77 2bia s SER 129 CO 0.64 -0.98 0.66 -0.63 0.98 0.00 0.00 173.24 173.91 2bia s ILE 130 N -3.95 5.05 0.72 -1.02 -1.09 -1.26 -4.75 121.20 114.90 2bia s ILE 130 Ca 0.16 1.32 -0.14 0.00 -2.23 0.00 0.00 60.65 59.76 2bia s ILE 130 Cb 0.01 -3.99 0.03 0.00 -1.58 0.00 0.00 42.46 36.94 2bia s ILE 130 CO 0.01 0.21 1.14 -2.16 -1.23 0.00 0.00 174.94 172.92 2bia s PRO 131 N 1.13 2.33 0.27 2.79 0.04 -1.26 -4.96 135.00 135.34 2bia s PRO 131 Ca 0.34 1.51 -0.30 0.00 0.04 0.00 0.00 61.00 62.58 2bia s PRO 131 Cb -0.17 -1.88 -0.11 0.00 0.04 0.00 0.00 34.50 32.39 2bia s PRO 131 CO 0.15 -1.63 1.50 -0.51 0.04 0.00 0.00 177.00 176.54 2bia s ASP 132 N -2.50 6.55 0.53 6.66 -0.00 -1.26 -4.90 116.67 121.75 2bia s ASP 132 Ca 0.69 2.77 0.30 0.00 -0.00 0.00 0.00 52.55 56.31 2bia s ASP 132 Cb -0.23 -2.63 1.45 0.00 -0.00 0.00 0.00 42.92 41.51 2bia s ASP 132 CO 0.46 -0.78 2.05 -0.26 -0.00 0.00 0.00 175.17 176.64 2bia h PHE 133 N 4.97 0.00 0.00 4.23 0.05 -2.01 0.17 116.94 124.36 2bia h PHE 133 Ca -0.46 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.33 2bia h PHE 133 Cb 1.22 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.17 2bia h PHE 133 CO 0.60 0.11 0.00 0.66 -0.18 0.00 0.00 178.31 179.49 2bia h SER 134 N 0.00 0.00 -0.10 2.17 4.64 -2.03 -2.07 113.55 116.16 2bia h SER 134 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2bia h SER 134 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2bia h SER 134 CO 0.01 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.35 2bia n GLU 135 N -3.02 1.73 -2.06 4.77 1.02 0.61 -4.87 120.64 118.83 2bia n GLU 135 Ca -0.02 -1.08 -0.43 0.00 -0.02 0.00 0.00 57.16 55.61 2bia n GLU 135 Cb 0.12 -1.44 -0.03 0.00 -0.02 0.00 0.00 31.44 30.08 2bia n GLU 135 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2bia s PHE 136 N -1.88 2.00 -0.59 -0.32 0.40 -0.78 -4.64 117.98 112.17 2bia s PHE 136 Ca 0.35 0.51 -0.28 0.00 -0.60 0.00 0.00 56.93 56.91 2bia s PHE 136 Cb 0.19 -4.01 0.03 0.00 0.51 0.00 0.00 43.02 39.74 2bia s PHE 136 CO 0.30 -3.09 1.19 -0.65 0.70 0.00 0.00 175.22 173.66 2bia s GLN 137 N 4.84 3.47 0.13 0.44 -0.21 0.53 -5.01 119.66 123.85 2bia s GLN 137 Ca 0.74 0.17 0.03 0.00 0.02 0.00 0.00 55.36 56.31 2bia s GLN 137 Cb -0.26 -4.03 -0.04 0.00 1.00 0.00 0.00 33.01 29.68 2bia s GLN 137 CO 0.30 -1.72 0.21 -0.51 -2.12 0.00 0.00 175.29 171.46 2bia s LEU 138 N 4.97 4.14 0.01 2.90 1.43 -1.26 -4.39 118.68 126.48 2bia s LEU 138 Ca 0.41 0.09 0.08 0.00 -1.03 0.00 0.00 54.13 53.69 2bia s LEU 138 Cb -0.08 -2.74 -0.02 0.00 0.03 0.00 0.00 46.19 43.38 2bia s LEU 138 CO 0.24 0.09 -0.25 0.20 0.23 0.00 0.00 176.35 176.86 2bia s ASN 139 N -2.96 2.96 0.48 2.29 0.01 -1.26 -5.03 114.94 111.43 2bia s ASN 139 Ca 0.33 -0.51 0.17 0.00 -0.71 0.00 0.00 52.86 52.14 2bia s ASN 139 Cb -0.11 -0.30 1.15 0.00 0.41 0.00 0.00 41.25 42.40 2bia s ASN 139 CO 0.26 0.28 2.05 1.05 -1.51 0.00 0.00 177.10 179.23 2bia h GLU 140 N 5.20 0.00 -0.94 -0.60 4.11 -2.00 -2.35 114.58 118.00 2bia h GLU 140 Ca -0.44 0.00 -0.40 0.00 0.07 0.00 0.00 59.36 58.59 2bia h GLU 140 Cb 1.13 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 30.14 2bia h GLU 140 CO 0.46 0.13 0.51 0.27 0.07 0.00 0.00 179.01 180.44 2bia n ASN 141 N -4.28 3.94 -4.72 3.06 6.94 -1.26 -4.96 115.26 113.98 2bia n ASN 141 Ca -0.03 -3.37 -0.42 0.00 -0.02 0.00 0.00 54.58 50.74 2bia n ASN 141 Cb 0.20 -0.79 -0.03 0.00 -2.36 0.00 0.00 39.78 36.80 2bia n ASN 141 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 2bia s ASP 142 N -1.04 6.66 0.23 0.53 1.01 -0.89 -0.91 116.67 122.27 2bia s ASP 142 Ca 0.52 2.53 0.11 0.00 0.71 0.00 0.00 52.55 56.41 2bia s ASP 142 Cb 0.43 -2.59 0.16 0.00 1.01 0.00 0.00 42.92 41.93 2bia s ASP 142 CO 0.11 -0.77 1.49 0.00 0.21 0.00 0.00 175.17 176.21 2bia h ALA 143 N 6.74 0.73 -2.15 5.23 0.00 0.22 -3.44 119.26 126.58 2bia h ALA 143 Ca -0.43 -0.66 0.18 0.00 0.00 0.00 0.00 54.91 54.01 2bia h ALA 143 Cb 1.21 -0.12 -0.12 0.00 0.00 0.00 0.00 17.79 18.76 2bia h ALA 143 CO 0.89 0.90 0.55 1.52 0.00 0.00 0.00 179.25 183.12 2bia s TYR 144 N -3.23 -0.19 -0.15 0.00 1.13 -1.25 -4.18 117.35 109.49 2bia s TYR 144 Ca 0.00 -0.02 -0.01 0.00 -1.41 0.00 0.00 57.07 55.64 2bia s TYR 144 Cb 0.11 0.59 -0.01 0.00 -1.10 0.00 0.00 41.96 41.54 2bia s TYR 144 CO 0.77 -0.62 -0.11 -1.17 -2.51 0.00 0.00 175.55 171.91 2bia s LEU 145 N -2.74 2.75 -0.14 -3.49 2.96 0.58 -2.60 118.68 116.00 2bia s LEU 145 Ca 0.10 -0.34 -0.03 0.00 -0.22 0.00 0.00 54.13 53.64 2bia s LEU 145 Cb -0.00 -1.64 -0.03 0.00 0.50 0.00 0.00 46.19 45.02 2bia s LEU 145 CO -0.03 0.12 -0.06 -2.28 -1.32 0.00 0.00 176.35 172.79 2bia s HIS 146 N 0.60 2.98 0.23 5.38 5.65 0.12 -0.28 115.29 129.97 2bia s HIS 146 Ca -0.07 -0.30 0.06 0.00 0.25 0.00 0.00 55.06 55.00 2bia s HIS 146 Cb -0.15 -1.91 -0.05 0.00 -1.18 0.00 0.00 32.58 29.29 2bia s HIS 146 CO 0.03 -0.01 -0.07 0.96 -0.65 0.00 0.00 174.74 175.00 2bia s ILE 147 N 0.19 1.46 -0.35 0.89 -4.36 -0.12 -0.55 121.20 118.37 2bia s ILE 147 Ca -0.03 -2.12 -0.03 0.00 -0.26 0.00 0.00 60.65 58.21 2bia s ILE 147 Cb -0.14 -2.26 0.07 0.00 1.25 0.00 0.00 42.46 41.38 2bia s ILE 147 CO 0.03 -0.43 0.10 -0.89 0.24 0.00 0.00 174.94 173.99 2bia s THR 148 N -3.14 3.23 0.18 8.37 2.01 -1.26 -0.99 115.64 124.04 2bia s THR 148 Ca 0.26 -1.60 -0.11 0.00 0.31 0.00 0.00 61.69 60.55 2bia s THR 148 Cb 0.03 -2.99 0.09 0.00 0.01 0.00 0.00 72.50 69.64 2bia s THR 148 CO 0.09 -0.34 1.75 0.77 -0.69 0.00 0.00 174.62 176.20 2bia h SER 149 N 8.05 0.86 -3.19 3.53 4.64 -1.80 -3.40 113.55 122.24 2bia h SER 149 Ca -0.18 -0.15 -0.57 0.00 -0.47 0.00 0.00 61.79 60.42 2bia h SER 149 Cb 1.06 -0.22 -0.36 0.00 -0.31 0.00 0.00 62.40 62.57 2bia h SER 149 CO 0.61 0.77 -0.82 0.21 -0.87 0.00 0.00 176.83 176.73 2bia s ASN 150 N -6.10 2.41 -0.86 4.97 3.84 -1.26 -1.20 114.94 116.75 2bia s ASN 150 Ca -0.13 -0.40 -0.17 0.00 0.21 0.00 0.00 52.86 52.37 2bia s ASN 150 Cb 0.13 -1.03 0.16 0.00 -0.55 0.00 0.00 41.25 39.97 2bia s ASN 150 CO 0.80 -0.06 0.95 0.20 -2.79 0.00 0.00 177.10 176.20 2bia s ASN 151 N 1.41 6.64 0.44 -4.21 0.01 0.18 -4.64 114.94 114.77 2bia s ASN 151 Ca 0.01 -2.22 0.17 0.00 -0.71 0.00 0.00 52.86 50.10 2bia s ASN 151 Cb -0.13 -2.32 1.09 0.00 0.41 0.00 0.00 41.25 40.30 2bia s ASN 151 CO -0.07 -0.89 1.94 0.74 -1.51 0.00 0.00 177.10 177.32 2bia h THR 152 N 5.44 0.81 0.00 1.60 2.02 -1.96 0.22 112.91 121.05 2bia h THR 152 Ca 0.09 -0.12 -0.28 0.00 0.77 0.00 0.00 66.41 66.87 2bia h THR 152 Cb 1.04 0.42 -0.05 0.00 -1.74 0.00 0.00 68.15 67.82 2bia h THR 152 CO 0.97 0.07 -1.59 0.40 0.37 0.00 0.00 175.52 175.74 2bia h ILE 153 N 0.36 1.00 0.00 3.11 2.04 -1.96 -3.37 117.51 118.69 2bia h ILE 153 Ca 0.33 -2.82 0.00 0.00 1.00 0.00 0.00 64.86 63.37 2bia h ILE 153 Cb 0.80 2.50 0.00 0.00 -0.74 0.00 0.00 36.82 39.38 2bia h ILE 153 CO -0.09 0.58 -1.59 -1.22 0.00 0.00 0.00 178.15 175.83 2bia n TYR 154 N -3.11 0.10 -1.29 1.37 4.02 -0.70 -4.79 117.16 112.76 2bia n TYR 154 Ca -0.14 0.03 0.00 0.00 -0.01 0.00 0.00 57.90 57.78 2bia n TYR 154 Cb 1.03 -0.42 0.00 0.00 -0.02 0.00 0.00 39.34 39.93 2bia n TYR 154 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2bia n GLY 155 N 1.32 0.67 3.54 2.72 0.00 0.71 -4.47 105.19 109.68 2bia n GLY 155 Ca -0.01 -0.74 -0.24 0.00 0.00 0.00 0.00 46.02 45.02 2bia n GLY 155 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bia s THR 156 N -2.00 2.92 -0.16 2.61 -4.23 -1.22 -1.09 115.64 112.47 2bia s THR 156 Ca 0.00 -2.10 -0.13 0.00 -1.18 0.00 0.00 61.69 58.28 2bia s THR 156 Cb 0.00 -2.52 0.05 0.00 1.34 0.00 0.00 72.50 71.36 2bia s THR 156 CO 0.00 -0.33 0.42 -1.58 -0.54 0.00 0.00 174.62 172.59 2bia s GLN 157 N -3.41 0.47 0.16 3.99 0.74 0.24 -0.65 119.66 121.19 2bia s GLN 157 Ca 0.29 0.64 -0.34 0.00 0.05 0.00 0.00 55.36 56.01 2bia s GLN 157 Cb -0.06 0.17 -0.13 0.00 1.10 0.00 0.00 33.01 34.08 2bia s GLN 157 CO 0.16 -0.09 1.61 0.66 -0.55 0.00 0.00 175.29 177.09 2bia n TYR 158 N 3.24 2.35 0.08 1.67 4.02 -0.34 -4.70 117.16 123.48 2bia n TYR 158 Ca -0.16 0.22 -0.01 0.00 -0.01 0.00 0.00 57.90 57.94 2bia n TYR 158 Cb 0.57 -2.57 -0.05 0.00 -0.02 0.00 0.00 39.34 37.27 2bia n TYR 158 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 2bia h GLN 159 N 6.20 0.00 -3.15 -0.72 1.08 -1.90 -3.48 115.11 113.13 2bia h GLN 159 Ca -0.45 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 56.78 2bia h GLN 159 Cb 1.25 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.62 2bia h GLN 159 CO 0.90 0.52 0.16 0.54 -0.95 0.00 0.00 178.83 180.01 2bia s ASN 160 N -6.26 -0.17 0.07 1.46 4.22 -1.26 -5.19 114.94 107.81 2bia s ASN 160 Ca 0.01 -0.76 0.10 0.00 -2.14 0.00 0.00 52.86 50.06 2bia s ASN 160 Cb 0.08 0.72 -0.03 0.00 1.28 0.00 0.00 41.25 43.30 2bia s ASN 160 CO 0.79 -1.35 -0.27 -0.36 -2.04 0.00 0.00 177.10 173.87 2bia s PHE 161 N -3.71 2.31 0.53 1.54 0.40 -1.26 -5.11 117.98 112.68 2bia s PHE 161 Ca 0.14 -0.40 -0.20 0.00 -0.60 0.00 0.00 56.93 55.87 2bia s PHE 161 Cb -0.05 -1.35 -0.07 0.00 0.51 0.00 0.00 43.02 42.07 2bia s PHE 161 CO 0.08 0.18 1.10 -1.25 0.70 0.00 0.00 175.22 176.03 2bia s PRO 162 N -1.46 3.49 -0.35 0.24 0.04 -1.26 -5.00 135.00 130.70 2bia s PRO 162 Ca 0.12 1.51 -0.24 0.00 0.04 0.00 0.00 61.00 62.44 2bia s PRO 162 Cb -0.10 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.41 2bia s PRO 162 CO 0.03 -0.72 0.81 -1.21 0.04 0.00 0.00 177.00 175.95 2bia s GLU 163 N -3.31 3.83 -0.10 4.56 0.41 -1.26 -5.03 118.70 117.81 2bia s GLU 163 Ca 0.71 0.44 0.02 0.00 -0.41 0.00 0.00 54.97 55.73 2bia s GLU 163 Cb -0.21 -3.78 0.01 0.00 -1.78 0.00 0.00 34.13 28.37 2bia s GLU 163 CO 0.25 -0.81 -0.15 0.42 -0.49 0.00 0.00 175.26 174.48 2bia s ILE 164 N 3.12 1.42 0.00 -1.63 -1.09 -1.26 -5.00 121.20 116.75 2bia s ILE 164 Ca 0.33 -0.61 0.00 0.00 -2.23 0.00 0.00 60.65 58.14 2bia s ILE 164 Cb -0.13 -1.30 0.00 0.00 -1.58 0.00 0.00 42.46 39.45 2bia s ILE 164 CO 0.16 0.42 0.04 0.59 -1.23 0.00 0.00 174.94 174.92 2bia n ASN 165 N 4.10 0.08 0.10 3.58 3.02 -1.26 -4.74 115.26 120.13 2bia n ASN 165 Ca -0.20 -0.41 0.12 0.00 -0.03 0.00 0.00 54.58 54.07 2bia n ASN 165 Cb 0.51 0.58 0.14 0.00 -0.61 0.00 0.00 39.78 40.41 2bia n ASN 165 CO 0.00 0.00 0.00 1.12 -2.62 0.00 0.00 177.26 175.76 2bia h HIS 166 N 0.00 0.00 -2.96 3.10 2.07 -1.98 -3.48 115.15 111.91 2bia h HIS 166 Ca 0.00 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.51 2bia h HIS 166 Cb 0.02 0.00 -0.12 0.00 2.57 0.00 0.00 27.41 29.88 2bia h HIS 166 CO 0.00 0.00 0.23 0.00 -3.07 0.00 0.00 177.93 175.09 2bia s ALA 167 N -3.22 -1.59 0.25 6.11 0.00 -1.26 -4.87 121.76 117.18 2bia s ALA 167 Ca 0.05 0.46 -0.30 0.00 0.00 0.00 0.00 51.96 52.18 2bia s ALA 167 Cb 0.11 0.86 -0.09 0.00 0.00 0.00 0.00 23.12 24.00 2bia s ALA 167 CO 0.72 -0.78 1.14 -1.25 0.00 0.00 0.00 175.76 175.59 2bia s PRO 168 N -3.73 4.58 -0.08 0.00 0.04 -1.26 -4.73 135.00 129.82 2bia s PRO 168 Ca 0.02 1.85 -0.26 0.00 0.04 0.00 0.00 61.00 62.65 2bia s PRO 168 Cb -0.01 -3.20 -0.03 0.00 0.04 0.00 0.00 34.50 31.30 2bia s PRO 168 CO -0.11 0.09 0.83 -1.17 0.04 0.00 0.00 177.00 176.68 2bia s LEU 169 N -1.08 4.28 -0.08 -3.56 2.96 -1.26 -0.31 118.68 119.63 2bia s LEU 169 Ca 0.47 1.33 0.03 0.00 -0.22 0.00 0.00 54.13 55.74 2bia s LEU 169 Cb -0.33 -3.28 -0.02 0.00 0.50 0.00 0.00 46.19 43.06 2bia s LEU 169 CO 0.40 -0.26 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.38 2bia s ILE 170 N 1.33 2.76 -0.04 6.68 -1.09 0.61 -1.15 121.20 130.29 2bia s ILE 170 Ca 0.42 -0.80 0.02 0.00 -2.23 0.00 0.00 60.65 58.06 2bia s ILE 170 Cb -0.18 -2.09 0.01 0.00 -1.58 0.00 0.00 42.46 38.62 2bia s ILE 170 CO 0.19 0.56 -0.08 0.00 -1.23 0.00 0.00 174.94 174.38 2bia s ALA 171 N -0.12 0.90 -0.67 9.38 0.00 -0.64 -0.94 121.76 129.67 2bia s ALA 171 Ca -0.02 -0.25 -0.27 0.00 0.00 0.00 0.00 51.96 51.41 2bia s ALA 171 Cb -0.14 -0.42 0.02 0.00 0.00 0.00 0.00 23.12 22.59 2bia s ALA 171 CO 0.04 0.08 1.31 0.34 0.00 0.00 0.00 175.76 177.53 2bia s ASP 172 N 0.57 6.17 -0.34 0.00 -1.08 -0.16 -1.52 116.67 120.31 2bia s ASP 172 Ca -0.09 -0.16 0.08 0.00 -0.52 0.00 0.00 52.55 51.85 2bia s ASP 172 Cb -0.13 -2.55 0.59 0.00 -1.46 0.00 0.00 42.92 39.37 2bia s ASP 172 CO 0.01 -1.77 1.66 0.23 0.52 0.00 0.00 175.17 175.83 2bia n MET 173 N 9.04 2.30 -0.28 4.34 2.81 0.62 -2.16 117.12 133.79 2bia n MET 173 Ca 0.07 -3.09 0.10 0.00 -1.81 0.00 0.00 57.70 52.97 2bia n MET 173 Cb 0.49 -1.99 0.24 0.00 -0.71 0.00 0.00 33.22 31.25 2bia n MET 173 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 2bia h SER 174 N 1.27 -0.06 -0.65 7.83 0.02 -1.87 0.29 113.55 120.38 2bia h SER 174 Ca 0.35 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 61.49 2bia h SER 174 Cb 2.15 0.26 0.00 0.00 0.14 0.00 0.00 62.40 64.95 2bia h SER 174 CO 0.67 -0.13 0.00 -1.54 -1.14 0.00 0.00 176.83 174.69 2bia n SER 175 N -5.23 3.81 0.00 3.07 3.41 -1.26 -4.30 113.62 113.12 2bia n SER 175 Ca 0.19 -2.03 0.00 0.00 -0.26 0.00 0.00 58.87 56.76 2bia n SER 175 Cb 0.60 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 2bia n SER 175 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2bia n ASP 176 N 1.39 0.00 -4.68 4.04 5.75 -0.80 -4.86 116.55 117.40 2bia n ASP 176 Ca 0.22 -1.00 -0.45 0.00 -0.01 0.00 0.00 54.79 53.55 2bia n ASP 176 Cb 0.60 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.66 2bia n ASP 176 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bia n ILE 177 N 0.00 0.62 -2.60 2.12 0.13 0.02 -1.97 119.36 117.69 2bia n ILE 177 Ca 0.00 -0.15 -0.21 0.00 -1.10 0.00 0.00 62.75 61.29 2bia n ILE 177 Cb 0.48 -1.55 0.01 0.00 -0.84 0.00 0.00 39.64 37.73 2bia n ILE 177 CO 0.00 0.00 0.00 -0.11 2.80 0.00 0.00 176.55 179.24 2bia n LEU 178 N 2.62 -2.19 -0.56 9.51 7.94 -1.26 -4.82 117.00 128.24 2bia n LEU 178 Ca 0.13 -0.11 0.12 0.00 -1.11 0.00 0.00 56.01 55.04 2bia n LEU 178 Cb 0.31 -2.92 0.12 0.00 0.53 0.00 0.00 43.42 41.46 2bia n LEU 178 CO 0.63 -0.07 0.47 -1.54 -1.11 0.00 0.00 177.39 175.77 2bia n SER 179 N -2.10 2.04 -3.65 1.96 3.41 -0.83 -4.91 113.62 109.54 2bia n SER 179 Ca -0.20 -1.52 -0.04 0.00 -0.26 0.00 0.00 58.87 56.85 2bia n SER 179 Cb 0.66 0.29 -0.01 0.00 -0.26 0.00 0.00 64.21 64.89 2bia n SER 179 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bia s ARG 180 N -2.35 0.86 0.66 4.33 1.70 -1.26 -3.40 118.95 119.49 2bia s ARG 180 Ca 0.23 -0.43 -0.16 0.00 -0.47 0.00 0.00 55.73 54.89 2bia s ARG 180 Cb 0.19 0.32 0.00 0.00 -0.57 0.00 0.00 34.95 34.89 2bia s ARG 180 CO 0.49 -0.39 1.18 -2.14 -1.08 0.00 0.00 175.30 173.36 2bia s PRO 181 N -2.99 2.61 -0.01 3.89 0.02 -1.26 -4.91 135.00 132.35 2bia s PRO 181 Ca 0.11 1.70 -0.00 0.00 0.02 0.00 0.00 61.00 62.82 2bia s PRO 181 Cb 0.00 -1.90 0.01 0.00 0.02 0.00 0.00 34.50 32.64 2bia s PRO 181 CO -0.02 -1.45 0.03 -1.17 -0.33 0.00 0.00 177.00 174.05 2bia s LEU 182 N -4.66 1.56 -0.83 -5.54 2.96 -1.26 -5.07 118.68 105.83 2bia s LEU 182 Ca 0.74 0.04 -0.18 0.00 -0.22 0.00 0.00 54.13 54.52 2bia s LEU 182 Cb -0.28 0.02 0.15 0.00 0.50 0.00 0.00 46.19 46.58 2bia s LEU 182 CO 0.39 -0.06 0.95 -0.75 -1.32 0.00 0.00 176.35 175.56 2bia s LYS 183 N 0.47 3.49 0.55 1.98 2.20 -1.26 -4.84 119.74 122.32 2bia s LYS 183 Ca -0.04 -1.85 0.22 0.00 -0.36 0.00 0.00 55.97 53.95 2bia s LYS 183 Cb -0.06 -4.64 1.46 0.00 -1.51 0.00 0.00 37.83 33.08 2bia s LYS 183 CO -0.01 -1.60 2.14 0.28 -0.36 0.00 0.00 175.35 175.79 2bia h VAL 184 N 5.55 0.78 0.00 4.02 2.07 -1.86 -0.67 116.25 126.14 2bia h VAL 184 Ca 0.05 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.57 2bia h VAL 184 Cb 1.04 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 2bia h VAL 184 CO 1.01 0.00 0.00 -0.46 0.02 0.00 0.00 177.57 178.14 2bia n ASN 185 N -4.27 0.00 0.19 0.57 0.23 -1.26 -1.20 115.26 109.52 2bia n ASN 185 Ca -0.00 -0.97 0.14 0.00 -0.53 0.00 0.00 54.58 53.22 2bia n ASN 185 Cb 0.22 0.00 0.54 0.00 -2.08 0.00 0.00 39.78 38.45 2bia n ASN 185 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 2bia h GLN 186 N 0.00 0.00 -6.57 -3.83 4.20 -1.52 -3.45 115.11 103.93 2bia h GLN 186 Ca 0.00 0.00 -0.65 0.00 0.06 0.00 0.00 58.65 58.06 2bia h GLN 186 Cb 0.00 0.00 -0.17 0.00 0.30 0.00 0.00 27.48 27.61 2bia h GLN 186 CO 0.00 0.00 -0.78 -0.06 -0.67 0.00 0.00 178.83 177.32 2bia s PHE 187 N -3.42 2.46 0.00 2.96 0.40 -0.34 -4.52 117.98 115.53 2bia s PHE 187 Ca 0.04 -0.29 -0.03 0.00 -0.60 0.00 0.00 56.93 56.04 2bia s PHE 187 Cb 0.09 -1.22 -0.28 0.00 0.51 0.00 0.00 43.02 42.12 2bia s PHE 187 CO 0.48 0.49 0.86 0.78 0.70 0.00 0.00 175.22 178.53 2bia h GLY 188 N 3.17 0.28 -5.01 4.36 0.00 -1.42 -3.45 103.07 101.01 2bia h GLY 188 Ca -0.47 -0.72 -0.04 0.00 0.00 0.00 0.00 47.33 46.09 2bia h GLY 188 CO 0.50 0.63 0.11 -0.29 0.00 0.00 0.00 176.54 177.50 2bia s MET 189 N -2.62 0.83 -0.05 4.80 -2.45 -1.21 -0.38 119.30 118.21 2bia s MET 189 Ca -0.09 0.98 0.05 0.00 -1.25 0.00 0.00 55.69 55.38 2bia s MET 189 Cb 0.07 0.40 -0.01 0.00 1.25 0.00 0.00 34.83 36.54 2bia s MET 189 CO 0.85 -0.10 -0.21 0.42 1.05 0.00 0.00 175.02 177.04 2bia s ILE 190 N 0.38 1.71 0.09 10.11 1.01 -0.38 -1.62 121.20 132.50 2bia s ILE 190 Ca -0.00 -0.87 0.04 0.00 0.00 0.00 0.00 60.65 59.82 2bia s ILE 190 Cb -0.05 -1.46 -0.03 0.00 0.01 0.00 0.00 42.46 40.93 2bia s ILE 190 CO 0.01 0.48 -0.11 -0.72 0.00 0.00 0.00 174.94 174.60 2bia s TYR 191 N -0.02 1.08 -0.24 3.97 -0.85 -0.57 -0.15 117.35 120.57 2bia s TYR 191 Ca -0.05 -0.61 -0.10 0.00 -0.52 0.00 0.00 57.07 55.80 2bia s TYR 191 Cb -0.13 -0.59 0.10 0.00 0.38 0.00 0.00 41.96 41.72 2bia s TYR 191 CO 0.03 0.01 0.54 0.00 -1.52 0.00 0.00 175.55 174.61 2bia s ALA 192 N -2.19 -1.55 0.38 9.51 0.00 -0.12 -0.27 121.76 127.52 2bia s ALA 192 Ca 0.04 1.93 -0.28 0.00 0.00 0.00 0.00 51.96 53.65 2bia s ALA 192 Cb -0.04 -1.43 -0.10 0.00 0.00 0.00 0.00 23.12 21.54 2bia s ALA 192 CO 0.01 -0.68 1.44 0.20 0.00 0.00 0.00 175.76 176.72 2bia s GLY 193 N 2.38 2.95 0.52 0.00 0.00 -1.26 -0.47 107.32 111.43 2bia s GLY 193 Ca -0.06 1.49 0.31 0.00 0.00 0.00 0.00 44.72 46.46 2bia s GLY 193 CO -0.16 2.15 1.92 0.00 0.00 0.00 0.00 173.10 177.01 2bia h ALA 194 N 2.94 1.00 0.00 3.20 0.00 -1.35 -3.33 119.26 121.71 2bia h ALA 194 Ca -0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2bia h ALA 194 Cb 1.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2bia h ALA 194 CO 0.64 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.92 2bia n GLN 195 N -3.13 0.59 -0.13 0.00 0.00 -1.20 -1.04 117.38 112.47 2bia n GLN 195 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 57.00 56.78 2bia n GLN 195 Cb 0.35 -1.42 -0.11 0.00 0.00 0.00 0.00 30.24 29.06 2bia n GLN 195 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2bia n LYS 196 N -0.92 0.60 0.00 2.61 5.02 -1.25 -3.14 118.16 121.07 2bia n LYS 196 Ca 0.12 0.20 0.00 0.00 -2.02 0.00 0.00 58.31 56.61 2bia n LYS 196 Cb 0.05 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.58 2bia n LYS 196 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2bia n ASN 197 N -3.73 0.56 0.00 4.39 5.15 -1.19 -4.75 115.26 115.69 2bia n ASN 197 Ca -0.49 -1.17 0.00 0.00 -0.60 0.00 0.00 54.58 52.32 2bia n ASN 197 Cb 0.93 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 40.18 2bia n ASN 197 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2bia n LEU 198 N -0.09 0.69 0.00 1.20 4.77 -0.21 -4.81 117.00 118.55 2bia n LEU 198 Ca 0.00 -0.69 0.00 0.00 -0.03 0.00 0.00 56.01 55.29 2bia n LEU 198 Cb 0.26 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 2bia n LEU 198 CO 0.00 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 2bia n GLY 199 N -0.05 0.37 3.96 -0.72 0.00 -0.57 -4.50 105.19 103.69 2bia n GLY 199 Ca 0.00 -1.15 -0.22 0.00 0.00 0.00 0.00 46.02 44.65 2bia n GLY 199 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bia s PRO 200 N -1.76 2.76 0.80 1.61 0.04 -1.26 -4.10 135.00 133.10 2bia s PRO 200 Ca 0.00 -0.65 -0.11 0.00 0.04 0.00 0.00 61.00 60.28 2bia s PRO 200 Cb 0.00 -2.51 0.08 0.00 0.04 0.00 0.00 34.50 32.10 2bia s PRO 200 CO 0.00 -0.53 1.09 -1.54 0.04 0.00 0.00 177.00 176.05 2bia s SER 201 N -4.34 4.26 0.00 6.66 1.04 -1.26 -3.20 113.70 116.85 2bia s SER 201 Ca 0.54 1.69 0.00 0.00 0.48 0.00 0.00 55.95 58.66 2bia s SER 201 Cb -0.10 -2.40 0.00 0.00 0.10 0.00 0.00 66.02 63.62 2bia s SER 201 CO 0.38 -2.17 0.00 0.61 0.98 0.00 0.00 173.24 173.04 2bia n GLY 202 N -1.27 1.32 3.04 7.32 0.00 -1.26 -4.85 105.19 109.49 2bia n GLY 202 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 2bia n GLY 202 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bia s VAL 203 N -2.23 0.48 -0.13 1.61 0.11 -1.26 -4.65 120.40 114.33 2bia s VAL 203 Ca 0.00 -0.92 0.02 0.00 -2.93 0.00 0.00 61.98 58.16 2bia s VAL 203 Cb 0.00 -0.53 0.01 0.00 -1.53 0.00 0.00 36.38 34.33 2bia s VAL 203 CO 0.00 -0.31 -0.19 -0.89 -3.33 0.00 0.00 175.10 170.38 2bia s THR 204 N -1.17 1.85 -0.12 5.04 2.01 -0.03 -1.17 115.64 122.06 2bia s THR 204 Ca -0.08 -0.85 -0.19 0.00 0.31 0.00 0.00 61.69 60.87 2bia s THR 204 Cb -0.09 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.73 2bia s THR 204 CO 0.00 0.51 0.51 -0.69 -0.69 0.00 0.00 174.62 174.26 2bia s VAL 205 N 0.91 5.17 -0.17 3.82 1.01 0.38 -1.24 120.40 130.27 2bia s VAL 205 Ca -0.06 1.01 0.00 0.00 0.00 0.00 0.00 61.98 62.93 2bia s VAL 205 Cb -0.15 -3.85 0.04 0.00 0.00 0.00 0.00 36.38 32.42 2bia s VAL 205 CO -0.02 0.30 -0.09 -0.69 0.00 0.00 0.00 175.10 174.60 2bia s VAL 206 N 0.73 1.37 -0.26 2.92 1.01 -0.55 -0.94 120.40 124.67 2bia s VAL 206 Ca 0.27 -0.72 -0.09 0.00 0.00 0.00 0.00 61.98 61.44 2bia s VAL 206 Cb -0.15 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 2bia s VAL 206 CO 0.11 0.23 0.13 -0.63 0.00 0.00 0.00 175.10 174.94 2bia s ILE 207 N 1.53 4.80 -0.00 2.22 1.01 0.79 -0.31 121.20 131.24 2bia s ILE 207 Ca 0.01 -0.01 0.05 0.00 0.00 0.00 0.00 60.65 60.70 2bia s ILE 207 Cb -0.15 -3.26 -0.01 0.00 0.01 0.00 0.00 42.46 39.05 2bia s ILE 207 CO -0.08 0.30 -0.15 0.68 0.00 0.00 0.00 174.94 175.69 2bia s VAL 208 N 1.66 1.15 -0.24 2.92 -7.23 0.28 -1.24 120.40 117.70 2bia s VAL 208 Ca 0.07 -0.68 -0.29 0.00 -1.81 0.00 0.00 61.98 59.27 2bia s VAL 208 Cb -0.15 -0.97 -0.02 0.00 0.56 0.00 0.00 36.38 35.80 2bia s VAL 208 CO 0.07 0.28 1.55 -0.75 -0.31 0.00 0.00 175.10 175.94 2bia s LYS 209 N -0.45 3.82 0.23 4.82 2.20 0.48 -0.90 119.74 129.94 2bia s LYS 209 Ca 0.05 1.57 -0.06 0.00 -0.36 0.00 0.00 55.97 57.18 2bia s LYS 209 Cb -0.06 -4.00 0.36 0.00 -1.51 0.00 0.00 37.83 32.62 2bia s LYS 209 CO -0.00 -1.25 1.80 0.87 -0.36 0.00 0.00 175.35 176.40 2bia h LYS 210 N 10.41 0.67 0.00 4.03 1.57 -1.67 -1.52 116.57 130.07 2bia h LYS 210 Ca -0.32 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 2bia h LYS 210 Cb 1.14 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.30 2bia h LYS 210 CO 1.01 0.45 0.00 0.38 -0.57 0.00 0.00 179.45 180.71 2bia h ASP 211 N 0.70 0.00 0.74 0.86 3.04 -1.90 0.93 116.42 120.78 2bia h ASP 211 Ca 0.37 0.00 -0.06 0.00 -3.24 0.00 0.00 57.03 54.09 2bia h ASP 211 Cb 0.35 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.63 2bia h ASP 211 CO -0.25 0.00 -0.30 0.25 -2.04 0.00 0.00 179.24 176.90 2bia h LEU 212 N 0.00 0.00 -1.28 0.15 5.85 -1.65 -3.39 115.31 114.99 2bia h LEU 212 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2bia h LEU 212 Cb 0.66 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.69 2bia h LEU 212 CO 0.00 0.30 -0.19 0.18 -0.34 0.00 0.00 178.44 178.39 2bia n LEU 213 N -3.57 0.00 -1.09 2.25 4.77 -1.01 -4.82 117.00 113.52 2bia n LEU 213 Ca -0.01 -0.56 0.04 0.00 -0.03 0.00 0.00 56.01 55.45 2bia n LEU 213 Cb 0.44 0.00 0.19 0.00 -2.33 0.00 0.00 43.42 41.72 2bia n LEU 213 CO 0.35 0.27 0.58 -0.46 -1.33 0.00 0.00 177.39 176.80 2bia n ASN 214 N 0.00 3.08 -4.47 -1.43 0.23 0.29 -3.35 115.26 109.60 2bia n ASN 214 Ca 0.00 -2.37 -0.33 0.00 -0.53 0.00 0.00 54.58 51.35 2bia n ASN 214 Cb 0.58 -0.52 -0.13 0.00 -2.08 0.00 0.00 39.78 37.62 2bia n ASN 214 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2bia s THR 215 N -1.80 3.04 0.21 5.53 2.01 -1.26 -4.83 115.64 118.54 2bia s THR 215 Ca 0.27 -0.73 -0.32 0.00 0.31 0.00 0.00 61.69 61.22 2bia s THR 215 Cb 0.19 -2.19 -0.12 0.00 0.01 0.00 0.00 72.50 70.39 2bia s THR 215 CO 0.10 0.59 1.70 0.29 -0.69 0.00 0.00 174.62 176.60 2bia n LYS 216 N 2.35 2.70 -3.65 4.92 4.01 -1.26 -4.69 118.16 122.54 2bia n LYS 216 Ca -0.17 0.97 -0.39 0.00 -0.51 0.00 0.00 58.31 58.21 2bia n LYS 216 Cb 0.52 -2.81 -0.12 0.00 -0.51 0.00 0.00 35.03 32.12 2bia n LYS 216 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2bia s VAL 217 N 1.06 4.59 0.24 -0.18 1.01 -1.26 -5.05 120.40 120.81 2bia s VAL 217 Ca 0.75 -0.46 -0.31 0.00 0.00 0.00 0.00 61.98 61.95 2bia s VAL 217 Cb -0.53 -3.36 -0.13 0.00 0.00 0.00 0.00 36.38 32.36 2bia s VAL 217 CO 0.34 0.04 1.51 -1.84 0.00 0.00 0.00 175.10 175.14 2bia n GLU 218 N 4.98 2.26 -0.81 2.72 0.00 -1.26 -2.08 120.64 126.46 2bia n GLU 218 Ca -0.14 0.81 0.00 0.00 0.00 0.00 0.00 57.16 57.83 2bia n GLU 218 Cb 0.49 -2.53 0.00 0.00 0.00 0.00 0.00 31.44 29.40 2bia n GLU 218 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 2bia n GLN 219 N 2.45 0.00 -4.02 3.44 7.27 -1.26 -5.03 117.38 120.22 2bia n GLN 219 Ca 0.12 0.00 -0.35 0.00 0.07 0.00 0.00 57.00 56.84 2bia n GLN 219 Cb 0.32 -2.18 -0.09 0.00 2.41 0.00 0.00 30.24 30.70 2bia n GLN 219 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 2bia s VAL 220 N -2.94 4.83 0.27 1.69 1.01 -0.89 -5.04 120.40 119.33 2bia s VAL 220 Ca 0.00 -0.02 -0.29 0.00 0.00 0.00 0.00 61.98 61.67 2bia s VAL 220 Cb 0.00 -3.15 -0.14 0.00 0.00 0.00 0.00 36.38 33.08 2bia s VAL 220 CO 0.00 0.49 1.05 -2.65 0.00 0.00 0.00 175.10 173.99 2bia n PRO 221 N 3.21 1.34 -0.25 2.72 -0.02 -1.26 -4.74 135.00 135.98 2bia n PRO 221 Ca -0.17 0.47 0.05 0.00 -2.02 0.00 0.00 63.50 61.83 2bia n PRO 221 Cb 0.53 -1.87 0.15 0.00 -0.02 0.00 0.00 33.50 32.29 2bia n PRO 221 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2bia h THR 222 N 2.14 0.34 0.00 3.45 2.02 -1.96 0.26 112.91 119.16 2bia h THR 222 Ca -0.40 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 2bia h THR 222 Cb 1.34 0.23 -0.00 0.00 -1.74 0.00 0.00 68.15 67.98 2bia h THR 222 CO 0.63 0.02 -0.05 0.24 0.37 0.00 0.00 175.52 176.72 2bia h MET 223 N 0.10 0.00 -0.36 6.66 2.86 -2.02 -2.93 114.93 119.24 2bia h MET 223 Ca 0.41 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.05 2bia h MET 223 Cb 0.71 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.37 2bia h MET 223 CO -0.66 0.05 0.00 1.28 1.06 0.00 0.00 176.91 178.64 2bia n LEU 224 N -3.23 3.28 -4.71 1.22 4.77 0.87 -4.88 117.00 114.32 2bia n LEU 224 Ca -0.00 -1.40 -0.38 0.00 -0.03 0.00 0.00 56.01 54.19 2bia n LEU 224 Cb 0.27 -0.23 -0.06 0.00 -2.33 0.00 0.00 43.42 41.07 2bia n LEU 224 CO 0.27 0.70 0.20 -1.10 -1.33 0.00 0.00 177.39 176.13 2bia s GLN 225 N -1.54 4.33 0.40 3.23 -0.21 -0.95 -4.81 119.66 120.11 2bia s GLN 225 Ca 0.38 0.48 0.08 0.00 0.02 0.00 0.00 55.36 56.32 2bia s GLN 225 Cb 0.22 -3.46 0.87 0.00 1.00 0.00 0.00 33.01 31.64 2bia s GLN 225 CO 0.31 0.10 2.02 1.88 -2.12 0.00 0.00 175.29 177.49 2bia h TYR 226 N 6.83 0.56 -0.97 0.91 -1.99 -1.90 -2.38 116.97 118.03 2bia h TYR 226 Ca -0.40 0.01 0.12 0.00 2.00 0.00 0.00 58.73 60.47 2bia h TYR 226 Cb 1.18 -0.19 -0.08 0.00 2.00 0.00 0.00 36.73 39.64 2bia h TYR 226 CO 0.63 0.32 0.61 0.00 -0.00 0.00 0.00 178.16 179.73 2bia h ALA 227 N 1.70 1.60 -0.13 3.88 0.00 -1.83 0.12 119.26 124.60 2bia h ALA 227 Ca 0.21 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.18 2bia h ALA 227 Cb 0.14 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2bia h ALA 227 CO -0.06 0.16 -0.10 1.15 0.00 0.00 0.00 179.25 180.41 2bia h THR 228 N 0.92 0.72 -0.00 0.00 2.02 -1.68 0.05 112.91 114.92 2bia h THR 228 Ca 0.48 0.00 -0.18 0.00 0.77 0.00 0.00 66.41 67.48 2bia h THR 228 Cb 0.53 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 2bia h THR 228 CO -0.24 0.00 -0.82 0.45 0.37 0.00 0.00 175.52 175.27 2bia h HIS 229 N -0.10 0.21 0.04 3.16 3.86 -1.39 -2.20 115.15 118.72 2bia h HIS 229 Ca 0.08 -0.11 -0.00 0.00 -1.16 0.00 0.00 60.37 59.18 2bia h HIS 229 Cb 0.22 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.67 2bia h HIS 229 CO -0.22 0.90 -0.02 0.82 0.86 0.00 0.00 177.93 180.27 2bia h ILE 230 N 0.08 1.13 -0.73 2.45 2.04 -0.59 -0.71 117.51 121.18 2bia h ILE 230 Ca -0.03 -0.54 0.04 0.00 1.00 0.00 0.00 64.86 65.33 2bia h ILE 230 Cb 1.43 1.48 -0.04 0.00 -0.74 0.00 0.00 36.82 38.96 2bia h ILE 230 CO 0.12 0.14 0.48 0.11 0.00 0.00 0.00 178.15 179.00 2bia h LYS 231 N -0.29 0.85 -0.67 2.37 1.57 -0.95 -2.54 116.57 116.91 2bia h LYS 231 Ca -0.01 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2bia h LYS 231 Cb 0.27 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.39 2bia h LYS 231 CO 0.01 0.56 0.00 -1.13 -0.57 0.00 0.00 179.45 178.32 2bia n SER 232 N -4.46 3.62 -4.04 0.86 3.41 -0.83 -4.95 113.62 107.23 2bia n SER 232 Ca 0.09 -2.01 -0.30 0.00 -0.26 0.00 0.00 58.87 56.38 2bia n SER 232 Cb 0.13 -0.45 -0.01 0.00 -0.26 0.00 0.00 64.21 63.61 2bia n SER 232 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2bia n ASP 233 N 1.45 -2.35 -1.64 4.04 2.03 -0.78 -1.34 116.55 117.97 2bia n ASP 233 Ca 0.22 -0.96 -0.17 0.00 0.52 0.00 0.00 54.79 54.41 2bia n ASP 233 Cb 0.57 -3.13 -0.03 0.00 -0.72 0.00 0.00 41.12 37.81 2bia n ASP 233 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2bia n SER 234 N -2.83 -4.93 -0.49 1.67 7.64 -0.34 -4.86 113.62 109.47 2bia n SER 234 Ca -0.09 0.15 0.07 0.00 1.01 0.00 0.00 58.87 60.01 2bia n SER 234 Cb 0.58 -3.98 0.17 0.00 -1.01 0.00 0.00 64.21 59.97 2bia n SER 234 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2bia n LEU 235 N -2.17 2.39 0.02 -3.43 4.77 -0.45 -4.67 117.00 113.46 2bia n LEU 235 Ca -0.18 -3.42 -0.12 0.00 -0.03 0.00 0.00 56.01 52.26 2bia n LEU 235 Cb 0.61 -0.44 -0.08 0.00 -2.33 0.00 0.00 43.42 41.17 2bia n LEU 235 CO 0.24 1.08 0.80 0.22 -1.33 0.00 0.00 177.39 178.40 2bia h TYR 236 N 0.64 0.01 -3.46 -1.77 3.20 -1.88 -3.45 116.97 110.27 2bia h TYR 236 Ca -0.02 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.85 2bia h TYR 236 Cb 1.07 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.34 2bia h TYR 236 CO 0.45 0.15 0.00 0.27 -1.64 0.00 0.00 178.16 177.40 2bia n ASN 237 N -5.01 1.66 -4.67 -2.11 6.94 -1.26 -5.07 115.26 105.73 2bia n ASN 237 Ca -0.07 -0.80 -0.42 0.00 -0.02 0.00 0.00 54.58 53.26 2bia n ASN 237 Cb 0.10 0.00 -0.03 0.00 -2.36 0.00 0.00 39.78 37.49 2bia n ASN 237 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2bia s THR 238 N -0.80 4.02 0.78 5.53 2.01 -1.26 -4.99 115.64 120.93 2bia s THR 238 Ca 0.00 1.31 -0.12 0.00 0.31 0.00 0.00 61.69 63.19 2bia s THR 238 Cb 0.00 -3.84 0.06 0.00 0.01 0.00 0.00 72.50 68.73 2bia s THR 238 CO 0.00 -0.06 1.11 -2.16 -0.69 0.00 0.00 174.62 172.81 2bia s PRO 239 N 3.01 2.20 -1.16 4.92 0.04 -1.26 -4.93 135.00 137.82 2bia s PRO 239 Ca 0.60 0.53 -0.21 0.00 0.04 0.00 0.00 61.00 61.96 2bia s PRO 239 Cb -0.27 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.36 2bia s PRO 239 CO 0.22 -1.51 1.72 -1.25 0.04 0.00 0.00 177.00 176.21 2bia s PRO 240 N -5.25 3.46 0.18 0.56 0.04 -1.26 -4.82 135.00 127.91 2bia s PRO 240 Ca 0.60 -1.44 -0.11 0.00 0.04 0.00 0.00 61.00 60.09 2bia s PRO 240 Cb -0.13 -5.39 0.09 0.00 0.04 0.00 0.00 34.50 29.11 2bia s PRO 240 CO 0.53 -2.68 1.74 1.79 0.04 0.00 0.00 177.00 178.42 2bia h THR 241 N 6.18 1.24 -0.32 1.26 1.35 -1.95 -0.99 112.91 119.68 2bia h THR 241 Ca 0.31 -0.74 -0.12 0.00 -0.55 0.00 0.00 66.41 65.30 2bia h THR 241 Cb 0.93 0.54 -0.01 0.00 -1.73 0.00 0.00 68.15 67.88 2bia h THR 241 CO 1.38 0.29 -0.31 0.15 -0.25 0.00 0.00 175.52 176.78 2bia h PHE 242 N 0.89 0.79 -0.83 4.73 3.57 -1.87 -0.94 116.94 123.28 2bia h PHE 242 Ca 0.21 -0.20 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 2bia h PHE 242 Cb 0.21 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.73 2bia h PHE 242 CO 0.01 0.91 0.44 0.77 -2.23 0.00 0.00 178.31 178.21 2bia h SER 243 N 0.58 1.05 -0.13 0.41 0.02 -1.79 0.52 113.55 114.20 2bia h SER 243 Ca 0.07 -0.11 -0.15 0.00 -0.84 0.00 0.00 61.79 60.76 2bia h SER 243 Cb 0.82 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 2bia h SER 243 CO 0.07 0.86 -0.44 0.40 -1.14 0.00 0.00 176.83 176.58 2bia h ILE 244 N 1.16 1.30 0.01 3.27 2.04 -0.94 -0.30 117.51 124.04 2bia h ILE 244 Ca 0.29 -1.62 0.00 0.00 1.00 0.00 0.00 64.86 64.53 2bia h ILE 244 Cb 0.05 1.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 2bia h ILE 244 CO -0.04 0.52 -0.01 0.22 0.00 0.00 0.00 178.15 178.84 2bia h TYR 245 N 0.55 -0.01 -0.63 1.37 3.20 -0.89 0.74 116.97 121.29 2bia h TYR 245 Ca 0.04 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 2bia h TYR 245 Cb 0.98 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 39.22 2bia h TYR 245 CO 0.05 -0.01 0.29 0.52 -1.64 0.00 0.00 178.16 177.36 2bia h MET 246 N -0.01 0.90 -0.78 1.82 2.86 -0.75 -1.04 114.93 117.92 2bia h MET 246 Ca 0.00 -0.12 0.02 0.00 -2.06 0.00 0.00 59.70 57.54 2bia h MET 246 Cb 0.01 -0.17 -0.04 0.00 0.06 0.00 0.00 31.60 31.46 2bia h MET 246 CO -0.00 0.71 0.51 1.25 1.06 0.00 0.00 176.91 180.43 2bia h LEU 247 N 0.89 0.86 -0.33 1.22 5.85 -0.61 0.66 115.31 123.85 2bia h LEU 247 Ca 0.22 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.97 2bia h LEU 247 Cb 0.12 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 2bia h LEU 247 CO -0.03 0.61 0.09 -0.09 -0.34 0.00 0.00 178.44 178.68 2bia h ARG 248 N 1.01 0.21 -0.60 1.25 1.12 0.07 0.37 114.38 117.81 2bia h ARG 248 Ca 0.30 -0.01 -0.03 0.00 -1.11 0.00 0.00 59.98 59.12 2bia h ARG 248 Cb -0.06 -0.05 -0.03 0.00 -0.01 0.00 0.00 29.97 29.83 2bia h ARG 248 CO -0.09 0.14 0.23 -0.91 -3.11 0.00 0.00 179.97 176.23 2bia h ASN 249 N 0.21 0.79 -0.13 -3.80 4.21 -0.54 0.39 115.58 116.72 2bia h ASN 249 Ca 0.15 -0.10 -0.09 0.00 1.21 0.00 0.00 56.30 57.47 2bia h ASN 249 Cb 0.15 -0.20 0.00 0.00 -1.12 0.00 0.00 38.32 37.15 2bia h ASN 249 CO -0.18 0.71 -0.25 0.58 -1.29 0.00 0.00 177.43 177.00 2bia h VAL 250 N 0.86 1.37 -0.97 2.81 2.07 -0.36 -2.53 116.25 119.50 2bia h VAL 250 Ca 0.20 -1.52 0.11 0.00 0.82 0.00 0.00 66.70 66.31 2bia h VAL 250 Cb 0.17 2.03 -0.08 0.00 -1.52 0.00 0.00 31.29 31.90 2bia h VAL 250 CO -0.02 0.45 0.62 -0.07 0.02 0.00 0.00 177.57 178.57 2bia h LEU 251 N -0.00 0.91 -1.12 2.57 3.38 -0.57 -1.07 115.31 119.41 2bia h LEU 251 Ca 0.01 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2bia h LEU 251 Cb 0.84 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 2bia h LEU 251 CO 0.06 0.51 0.52 0.44 0.09 0.00 0.00 178.44 180.06 2bia h ASP 252 N 0.99 0.98 -0.48 -0.43 3.32 -0.79 -0.61 116.42 119.40 2bia h ASP 252 Ca 0.46 -0.04 -0.12 0.00 0.02 0.00 0.00 57.03 57.35 2bia h ASP 252 Cb 0.42 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 2bia h ASP 252 CO -0.22 0.74 -0.14 -0.25 -1.72 0.00 0.00 179.24 177.65 2bia h TRP 253 N 1.14 1.09 -0.58 4.55 7.01 -0.80 0.33 115.95 128.70 2bia h TRP 253 Ca 0.30 -0.23 -0.07 0.00 2.11 0.00 0.00 58.89 61.00 2bia h TRP 253 Cb -0.08 -0.27 -0.02 0.00 -2.10 0.00 0.00 29.16 26.69 2bia h TRP 253 CO 0.00 1.04 0.10 0.82 -2.79 0.00 0.00 178.44 177.61 2bia h ILE 254 N 0.86 1.26 -0.53 2.65 2.04 -0.77 -1.91 117.51 121.11 2bia h ILE 254 Ca 0.13 -0.97 -0.04 0.00 1.00 0.00 0.00 64.86 64.98 2bia h ILE 254 Cb 0.70 0.77 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 2bia h ILE 254 CO 0.05 0.36 0.19 0.50 0.00 0.00 0.00 178.15 179.25 2bia h LYS 255 N 0.85 0.81 -0.11 2.37 3.64 -0.91 0.36 116.57 123.57 2bia h LYS 255 Ca 0.18 -0.16 0.02 0.00 -1.27 0.00 0.00 60.65 59.41 2bia h LYS 255 Cb 0.41 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.10 2bia h LYS 255 CO 0.01 0.72 0.07 -0.44 -2.27 0.00 0.00 179.45 177.55 2bia h ASP 256 N 0.72 0.06 -0.08 4.20 3.32 -0.51 -1.96 116.42 122.17 2bia h ASP 256 Ca 0.17 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2bia h ASP 256 Cb 0.23 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.77 2bia h ASP 256 CO -0.01 0.04 0.00 0.18 -1.72 0.00 0.00 179.24 177.73 2bia n LEU 257 N -4.52 1.30 0.00 1.55 4.32 -0.76 -4.88 117.00 114.01 2bia n LEU 257 Ca -0.01 -0.49 0.00 0.00 -0.02 0.00 0.00 56.01 55.49 2bia n LEU 257 Cb 0.14 -0.05 0.00 0.00 -1.62 0.00 0.00 43.42 41.90 2bia n LEU 257 CO 0.34 0.25 0.00 0.61 -1.22 0.00 0.00 177.39 177.37 2bia n GLY 258 N 1.10 1.27 6.94 -0.72 0.00 -0.74 -4.73 105.19 108.31 2bia n GLY 258 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2bia n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bia n GLY 259 N -0.80 -1.76 0.22 -0.02 0.00 0.09 -3.58 105.19 99.35 2bia n GLY 259 Ca 0.00 -1.37 0.02 0.00 0.00 0.00 0.00 46.02 44.67 2bia n GLY 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bia h ALA 260 N 0.00 1.41 -0.08 4.61 0.00 -1.85 -0.14 119.26 123.22 2bia h ALA 260 Ca 0.00 -0.26 -0.24 0.00 0.00 0.00 0.00 54.91 54.41 2bia h ALA 260 Cb 0.00 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.72 2bia h ALA 260 CO 0.00 0.41 -0.90 0.93 0.00 0.00 0.00 179.25 179.69 2bia h GLU 261 N 0.19 0.72 -0.28 0.00 3.07 -1.92 -0.98 114.58 115.38 2bia h GLU 261 Ca 0.03 -0.68 -0.14 0.00 -0.50 0.00 0.00 59.36 58.07 2bia h GLU 261 Cb 0.50 0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.57 2bia h GLU 261 CO 0.03 1.27 -0.40 0.00 -1.40 0.00 0.00 179.01 178.52 2bia h ALA 262 N 0.51 0.77 -0.07 3.43 0.00 -1.55 -2.86 119.26 119.49 2bia h ALA 262 Ca -0.09 -0.45 -0.14 0.00 0.00 0.00 0.00 54.91 54.24 2bia h ALA 262 Cb 1.54 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 2bia h ALA 262 CO 0.18 0.66 -0.58 0.97 0.00 0.00 0.00 179.25 180.48 2bia h ILE 263 N 0.56 1.38 -0.98 0.00 6.09 -0.88 -2.48 117.51 121.20 2bia h ILE 263 Ca 0.05 -1.93 0.05 0.00 -1.37 0.00 0.00 64.86 61.65 2bia h ILE 263 Cb 0.93 1.97 -0.06 0.00 0.47 0.00 0.00 36.82 40.13 2bia h ILE 263 CO 0.08 0.57 0.64 0.00 -3.07 0.00 0.00 178.15 176.37 2bia h ALA 264 N 1.22 1.39 -0.18 0.18 0.00 -1.09 0.95 119.26 121.72 2bia h ALA 264 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2bia h ALA 264 Cb 1.07 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2bia h ALA 264 CO 0.09 0.50 0.12 -0.22 0.00 0.00 0.00 179.25 179.74 2bia h LYS 265 N 1.21 0.24 -0.52 0.00 3.64 -1.22 0.30 116.57 120.21 2bia h LYS 265 Ca 0.40 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.78 2bia h LYS 265 Cb 0.06 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.80 2bia h LYS 265 CO -0.14 0.18 0.33 0.37 -2.27 0.00 0.00 179.45 177.92 2bia h GLN 266 N 0.24 0.64 -0.55 1.90 5.75 -1.03 -2.19 115.11 119.88 2bia h GLN 266 Ca 0.07 -0.04 -0.11 0.00 -0.15 0.00 0.00 58.65 58.42 2bia h GLN 266 Cb -0.01 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.37 2bia h GLN 266 CO -0.01 0.43 -0.08 -0.91 -2.65 0.00 0.00 178.83 175.61 2bia h ASN 267 N 0.66 1.00 -0.69 -0.69 2.35 -0.56 -1.24 115.58 116.41 2bia h ASN 267 Ca 0.20 -0.31 -0.06 0.00 -0.55 0.00 0.00 56.30 55.58 2bia h ASN 267 Cb -0.03 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.04 2bia h ASN 267 CO -0.07 1.09 0.19 -0.33 -1.65 0.00 0.00 177.43 176.66 2bia h GLU 268 N 0.90 1.11 -0.38 0.81 5.08 -0.81 -1.91 114.58 119.38 2bia h GLU 268 Ca 0.15 -0.25 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 2bia h GLU 268 Cb 0.63 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2bia h GLU 268 CO 0.04 0.97 0.06 0.93 -1.00 0.00 0.00 179.01 180.01 2bia h GLU 269 N 1.06 0.63 -0.28 2.33 5.08 -0.98 -0.46 114.58 121.97 2bia h GLU 269 Ca 0.22 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2bia h GLU 269 Cb 0.34 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2bia h GLU 269 CO -0.00 0.69 0.18 0.87 -1.00 0.00 0.00 179.01 179.74 2bia h LYS 270 N 0.47 0.37 -0.76 2.33 1.57 -1.16 -2.50 116.57 116.89 2bia h LYS 270 Ca 0.12 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2bia h LYS 270 Cb 0.36 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.56 2bia h LYS 270 CO 0.01 0.26 0.46 0.00 -0.57 0.00 0.00 179.45 179.61 2bia h ALA 271 N 1.09 0.97 -0.86 3.86 0.00 -1.25 -2.30 119.26 120.77 2bia h ALA 271 Ca 0.10 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.00 2bia h ALA 271 Cb -0.02 -0.31 -0.06 0.00 0.00 0.00 0.00 17.79 17.40 2bia h ALA 271 CO -0.02 0.44 0.56 -0.22 0.00 0.00 0.00 179.25 180.01 2bia h LYS 272 N 1.04 0.89 -0.75 0.00 3.64 -0.75 0.94 116.57 121.58 2bia h LYS 272 Ca 0.27 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 2bia h LYS 272 Cb -0.04 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 31.55 2bia h LYS 272 CO -0.05 0.59 0.45 0.82 -2.27 0.00 0.00 179.45 178.99 2bia h ILE 273 N 0.92 1.22 0.03 2.00 2.04 -0.98 -0.16 117.51 122.58 2bia h ILE 273 Ca 0.38 -0.49 -0.11 0.00 1.00 0.00 0.00 64.86 65.64 2bia h ILE 273 Cb 0.27 0.17 0.01 0.00 -0.74 0.00 0.00 36.82 36.53 2bia h ILE 273 CO -0.14 0.23 -0.46 0.40 0.00 0.00 0.00 178.15 178.18 2bia h ILE 274 N 1.03 1.53 -0.36 -0.67 2.04 -1.20 -2.81 117.51 117.07 2bia h ILE 274 Ca 0.27 -2.15 -0.06 0.00 1.00 0.00 0.00 64.86 63.92 2bia h ILE 274 Cb -0.03 2.87 -0.02 0.00 -0.74 0.00 0.00 36.82 38.90 2bia h ILE 274 CO -0.05 0.60 -0.04 1.88 0.00 0.00 0.00 178.15 180.55 2bia h TYR 275 N -0.40 0.60 -0.38 1.37 -1.99 -0.80 -1.21 116.97 114.17 2bia h TYR 275 Ca -0.07 -0.07 -0.07 0.00 2.00 0.00 0.00 58.73 60.52 2bia h TYR 275 Cb 1.24 -0.17 -0.02 0.00 2.00 0.00 0.00 36.73 39.78 2bia h TYR 275 CO 0.18 0.61 -0.06 -0.44 -0.00 0.00 0.00 178.16 178.46 2bia h ASP 276 N 0.54 0.60 -0.53 3.88 3.32 -1.10 0.17 116.42 123.30 2bia h ASP 276 Ca 0.11 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 2bia h ASP 276 Cb 0.40 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.77 2bia h ASP 276 CO 0.02 0.71 0.32 0.74 -1.72 0.00 0.00 179.24 179.31 2bia h THR 277 N 0.58 1.16 -0.44 0.35 2.02 -1.05 0.15 112.91 115.69 2bia h THR 277 Ca 0.11 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.93 2bia h THR 277 Cb 0.45 0.44 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 2bia h THR 277 CO 0.02 0.16 0.28 0.40 0.37 0.00 0.00 175.52 176.75 2bia h ILE 278 N 0.71 1.13 0.00 3.11 2.04 -0.80 -2.83 117.51 120.87 2bia h ILE 278 Ca 0.19 -0.28 -0.05 0.00 1.00 0.00 0.00 64.86 65.72 2bia h ILE 278 Cb -0.01 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 2bia h ILE 278 CO -0.04 0.13 -0.25 0.44 0.00 0.00 0.00 178.15 178.43 2bia h ASP 279 N 0.59 0.00 -0.27 1.72 3.32 -0.05 -1.75 116.42 119.99 2bia h ASP 279 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 2bia h ASP 279 Cb -0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.52 2bia h ASP 279 CO -0.03 0.25 0.00 -0.62 -1.72 0.00 0.00 179.24 177.12 2bia n GLU 280 N -3.31 1.98 -0.04 3.56 -0.58 0.48 -4.28 120.64 118.44 2bia n GLU 280 Ca 0.01 -1.48 0.08 0.00 -0.42 0.00 0.00 57.16 55.35 2bia n GLU 280 Cb 0.50 -1.42 0.40 0.00 -0.57 0.00 0.00 31.44 30.35 2bia n GLU 280 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2bia n SER 281 N 0.70 0.74 -4.05 1.62 3.41 -0.66 -4.92 113.62 110.46 2bia n SER 281 Ca 0.17 -1.63 -0.32 0.00 -0.26 0.00 0.00 58.87 56.83 2bia n SER 281 Cb 0.41 -0.06 -0.01 0.00 -0.26 0.00 0.00 64.21 64.30 2bia n SER 281 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2bia n ASN 282 N -0.26 -3.17 0.00 4.04 5.15 -1.26 -1.32 115.26 118.44 2bia n ASN 282 Ca 0.13 -0.92 0.00 0.00 -0.60 0.00 0.00 54.58 53.19 2bia n ASN 282 Cb 0.17 -3.25 0.00 0.00 -0.53 0.00 0.00 39.78 36.17 2bia n ASN 282 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2bia n GLY 283 N -1.61 1.07 0.34 8.20 0.00 -1.26 -4.90 105.19 107.03 2bia n GLY 283 Ca -0.02 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.96 2bia n GLY 283 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2bia h PHE 284 N 0.00 1.14 -3.86 1.61 3.57 -1.53 -3.40 116.94 114.45 2bia h PHE 284 Ca 0.00 -0.06 -0.68 0.00 3.53 0.00 0.00 57.97 60.76 2bia h PHE 284 Cb 0.00 -0.35 -0.25 0.00 2.79 0.00 0.00 35.95 38.14 2bia h PHE 284 CO 0.00 0.84 -0.78 0.71 -2.23 0.00 0.00 178.31 176.84 2bia s TYR 285 N -5.60 2.70 -0.18 0.41 1.51 -1.26 -3.68 117.35 111.25 2bia s TYR 285 Ca -0.12 -0.33 -0.00 0.00 -1.01 0.00 0.00 57.07 55.61 2bia s TYR 285 Cb 0.16 -1.68 0.04 0.00 -0.11 0.00 0.00 41.96 40.37 2bia s TYR 285 CO 0.82 0.05 -0.07 0.08 -1.11 0.00 0.00 175.55 175.32 2bia s VAL 286 N -0.40 1.29 0.34 0.71 1.01 -0.20 -4.85 120.40 118.30 2bia s VAL 286 Ca 0.04 -0.75 -0.27 0.00 0.00 0.00 0.00 61.98 61.00 2bia s VAL 286 Cb -0.12 -1.43 -0.09 0.00 0.00 0.00 0.00 36.38 34.74 2bia s VAL 286 CO 0.02 0.15 1.13 -0.83 0.00 0.00 0.00 175.10 175.57 2bia s GLY 287 N 1.55 2.95 0.09 4.51 0.00 -1.26 -1.59 107.32 113.57 2bia s GLY 287 Ca 0.00 0.92 -0.17 0.00 0.00 0.00 0.00 44.72 45.47 2bia s GLY 287 CO -0.08 1.47 1.47 0.84 0.00 0.00 0.00 173.10 176.81 2bia h HIS 288 N 3.20 0.62 -4.00 1.90 2.76 -1.65 -3.46 115.15 114.53 2bia h HIS 288 Ca -0.48 -0.14 -0.48 0.00 -2.20 0.00 0.00 60.37 57.07 2bia h HIS 288 Cb 1.22 -0.15 0.03 0.00 1.55 0.00 0.00 27.41 30.06 2bia h HIS 288 CO 0.57 0.77 0.42 0.00 -1.30 0.00 0.00 177.93 178.38 2bia s ALA 289 N -4.71 3.01 0.57 5.26 0.00 -1.26 -4.76 121.76 119.87 2bia s ALA 289 Ca -0.13 0.71 -0.19 0.00 0.00 0.00 0.00 51.96 52.35 2bia s ALA 289 Cb 0.08 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 19.87 2bia s ALA 289 CO 0.78 -0.30 1.17 -1.21 0.00 0.00 0.00 175.76 176.19 2bia s GLU 290 N -2.71 3.16 0.23 0.00 2.02 0.11 -4.85 118.70 116.65 2bia s GLU 290 Ca 0.61 1.72 -0.08 0.00 0.02 0.00 0.00 54.97 57.24 2bia s GLU 290 Cb -0.21 -1.97 0.24 0.00 0.10 0.00 0.00 34.13 32.29 2bia s GLU 290 CO 0.27 -1.03 1.88 0.87 0.02 0.00 0.00 175.26 177.26 2bia h LYS 291 N 1.04 1.02 0.00 1.61 1.57 -1.95 0.09 116.57 119.94 2bia h LYS 291 Ca -0.50 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.22 2bia h LYS 291 Cb 1.28 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 33.36 2bia h LYS 291 CO 0.56 0.67 0.00 0.41 -0.57 0.00 0.00 179.45 180.52 2bia n GLY 292 N -1.33 -0.71 0.00 3.86 0.00 -1.26 -2.82 105.19 102.94 2bia n GLY 292 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2bia n GLY 292 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2bia n SER 293 N -1.31 1.47 -4.68 1.61 7.64 -0.01 -4.87 113.62 113.47 2bia n SER 293 Ca 0.05 -1.57 -0.45 0.00 1.01 0.00 0.00 58.87 57.91 2bia n SER 293 Cb 0.10 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.26 2bia n SER 293 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2bia n ARG 294 N -0.29 2.33 -2.36 1.43 1.74 -1.03 -0.60 116.66 117.89 2bia n ARG 294 Ca 0.00 0.84 -0.37 0.00 -0.77 0.00 0.00 57.85 57.55 2bia n ARG 294 Cb 0.19 -2.65 -0.02 0.00 -1.02 0.00 0.00 32.46 28.95 2bia n ARG 294 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2bia s SER 295 N 1.64 6.47 0.00 0.55 0.15 -0.25 -4.55 113.70 117.71 2bia s SER 295 Ca 0.81 2.24 0.26 0.00 0.70 0.00 0.00 55.95 59.95 2bia s SER 295 Cb -0.63 -2.60 0.74 0.00 -1.71 0.00 0.00 66.02 61.81 2bia s SER 295 CO 0.39 -0.70 1.56 0.18 1.20 0.00 0.00 173.24 175.87 2bia n LEU 296 N -0.17 0.64 -0.08 3.45 4.77 -1.26 -4.34 117.00 120.02 2bia n LEU 296 Ca 0.06 -0.06 -0.08 0.00 -0.03 0.00 0.00 56.01 55.90 2bia n LEU 296 Cb 0.48 -0.21 -0.11 0.00 -2.33 0.00 0.00 43.42 41.25 2bia n LEU 296 CO 0.48 0.14 -1.01 0.23 -1.33 0.00 0.00 177.39 175.90 2bia n MET 297 N -1.13 1.37 -3.61 3.23 2.81 -1.26 -4.74 117.12 113.78 2bia n MET 297 Ca 0.09 0.02 -0.25 0.00 -1.81 0.00 0.00 57.70 55.75 2bia n MET 297 Cb 0.33 -1.38 -0.17 0.00 -0.71 0.00 0.00 33.22 31.30 2bia n MET 297 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 2bia s ASN 298 N -5.01 2.20 -0.40 7.83 -0.87 -1.26 -0.03 114.94 117.39 2bia s ASN 298 Ca -0.11 -0.53 -0.16 0.00 -1.57 0.00 0.00 52.86 50.49 2bia s ASN 298 Cb 0.05 -0.21 0.01 0.00 -0.02 0.00 0.00 41.25 41.08 2bia s ASN 298 CO 0.57 -0.34 0.36 -0.69 -2.57 0.00 0.00 177.10 174.43 2bia s VAL 299 N 2.15 5.18 -0.13 1.60 1.01 0.03 -4.34 120.40 125.90 2bia s VAL 299 Ca 0.02 -0.41 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 2bia s VAL 299 Cb -0.16 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 2bia s VAL 299 CO -0.09 -0.31 0.07 0.42 0.00 0.00 0.00 175.10 175.19 2bia s THR 300 N 1.92 4.86 0.20 3.92 -4.23 -1.26 -0.38 115.64 120.67 2bia s THR 300 Ca 0.09 -0.03 -0.20 0.00 -1.18 0.00 0.00 61.69 60.37 2bia s THR 300 Cb -0.18 -3.11 0.04 0.00 1.34 0.00 0.00 72.50 70.59 2bia s THR 300 CO 0.12 0.57 0.59 0.72 -0.54 0.00 0.00 174.62 176.07 2bia s PHE 301 N -0.56 -0.26 0.10 3.99 -0.12 -0.84 -1.68 117.98 118.63 2bia s PHE 301 Ca 0.11 -0.07 0.05 0.00 -0.05 0.00 0.00 56.93 56.97 2bia s PHE 301 Cb -0.12 0.51 -0.03 0.00 -0.63 0.00 0.00 43.02 42.75 2bia s PHE 301 CO 0.02 -0.97 -0.14 -0.80 -0.05 0.00 0.00 175.22 173.29 2bia s ASN 302 N -2.85 1.82 0.67 1.98 0.01 -0.62 -0.06 114.94 115.90 2bia s ASN 302 Ca 0.07 -0.75 -0.02 0.00 -0.71 0.00 0.00 52.86 51.46 2bia s ASN 302 Cb -0.02 -0.05 0.06 0.00 0.41 0.00 0.00 41.25 41.64 2bia s ASN 302 CO -0.04 -0.14 0.37 0.18 -1.51 0.00 0.00 177.10 175.96 2bia n LEU 303 N 0.78 0.00 0.25 0.60 4.32 -1.26 -1.04 117.00 120.65 2bia n LEU 303 Ca -0.17 -0.63 0.15 0.00 -0.02 0.00 0.00 56.01 55.34 2bia n LEU 303 Cb 0.56 -0.26 0.51 0.00 -1.62 0.00 0.00 43.42 42.62 2bia n LEU 303 CO 0.25 -0.71 0.93 0.03 -1.22 0.00 0.00 177.39 176.66 2bia h ARG 304 N 0.00 0.00 -3.44 3.23 3.08 -1.84 -3.46 114.38 111.94 2bia h ARG 304 Ca -0.12 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 2bia h ARG 304 Cb 0.40 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.37 2bia h ARG 304 CO 0.11 0.00 -0.01 0.54 -1.07 0.00 0.00 179.97 179.55 2bia s ASN 305 N -5.72 -0.14 0.32 7.04 2.20 -1.26 -5.05 114.94 112.34 2bia s ASN 305 Ca 0.03 -0.83 0.03 0.00 -0.94 0.00 0.00 52.86 51.16 2bia s ASN 305 Cb 0.08 0.63 0.55 0.00 -2.00 0.00 0.00 41.25 40.51 2bia s ASN 305 CO 0.57 -1.21 1.86 -0.08 -2.94 0.00 0.00 177.10 175.30 2bia h GLU 306 N 2.17 0.59 -0.10 3.55 4.57 -1.99 -1.41 114.58 121.96 2bia h GLU 306 Ca -0.24 -0.13 0.01 0.00 -1.18 0.00 0.00 59.36 57.83 2bia h GLU 306 Cb 1.25 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.74 2bia h GLU 306 CO 0.31 0.60 0.03 1.49 -1.18 0.00 0.00 179.01 180.26 2bia h GLU 307 N 0.57 0.08 -0.50 1.92 4.57 -1.99 0.06 114.58 119.29 2bia h GLU 307 Ca 0.12 -0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.24 2bia h GLU 307 Cb 0.33 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.88 2bia h GLU 307 CO 0.01 0.05 0.06 -0.07 -1.18 0.00 0.00 179.01 177.88 2bia h LEU 308 N 0.08 0.74 -0.46 1.64 3.38 -1.86 -0.85 115.31 117.98 2bia h LEU 308 Ca 0.04 -0.15 0.09 0.00 0.09 0.00 0.00 57.88 57.94 2bia h LEU 308 Cb 0.02 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.51 2bia h LEU 308 CO -0.05 0.77 0.02 0.78 0.09 0.00 0.00 178.44 180.06 2bia h ASN 309 N 0.75 -0.15 -0.40 -0.43 2.35 -0.88 0.11 115.58 116.94 2bia h ASN 309 Ca 0.16 0.10 -0.15 0.00 -0.55 0.00 0.00 56.30 55.86 2bia h ASN 309 Cb 0.37 0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.90 2bia h ASN 309 CO 0.01 -0.04 -0.33 1.56 -1.65 0.00 0.00 177.43 176.98 2bia h GLN 310 N 0.14 0.93 -0.54 0.81 4.20 -0.44 -1.07 115.11 119.13 2bia h GLN 310 Ca 0.23 -0.46 -0.09 0.00 0.06 0.00 0.00 58.65 58.39 2bia h GLN 310 Cb 0.34 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 2bia h GLN 310 CO -0.37 1.12 -0.02 1.96 -0.67 0.00 0.00 178.83 180.85 2bia h GLN 311 N 0.75 0.95 -0.02 1.46 4.20 -0.91 -0.18 115.11 121.35 2bia h GLN 311 Ca 0.07 -0.29 -0.00 0.00 0.06 0.00 0.00 58.65 58.49 2bia h GLN 311 Cb 0.91 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.60 2bia h GLN 311 CO 0.08 0.95 0.01 0.35 -0.67 0.00 0.00 178.83 179.55 2bia h PHE 312 N 0.87 0.03 -0.19 2.96 3.57 -0.53 -1.22 116.94 122.43 2bia h PHE 312 Ca 0.16 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 2bia h PHE 312 Cb 0.54 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 2bia h PHE 312 CO 0.03 0.19 -0.10 -0.07 -2.23 0.00 0.00 178.31 176.13 2bia h LEU 313 N -0.13 0.28 -0.35 0.59 3.38 -1.05 -0.40 115.31 117.62 2bia h LEU 313 Ca 0.01 -0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.77 2bia h LEU 313 Cb 0.17 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2bia h LEU 313 CO -0.00 0.41 -0.39 0.00 0.09 0.00 0.00 178.44 178.55 2bia h ALA 314 N 1.62 0.52 -0.66 1.53 0.00 -0.82 -1.89 119.26 119.56 2bia h ALA 314 Ca 0.06 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.45 2bia h ALA 314 Cb 0.36 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2bia h ALA 314 CO 0.02 0.63 0.15 -0.22 0.00 0.00 0.00 179.25 179.82 2bia h LYS 315 N 0.69 1.07 -0.33 0.00 1.63 -0.74 -1.75 116.57 117.13 2bia h LYS 315 Ca 0.05 -0.26 0.01 0.00 -0.85 0.00 0.00 60.65 59.59 2bia h LYS 315 Cb 0.98 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.46 2bia h LYS 315 CO 0.09 0.96 0.21 0.00 -3.45 0.00 0.00 179.45 177.27 2bia h ALA 316 N 1.06 0.42 -0.63 5.00 0.00 -0.97 -0.89 119.26 123.24 2bia h ALA 316 Ca 0.21 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2bia h ALA 316 Cb 0.38 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2bia h ALA 316 CO 0.00 -0.13 0.35 -0.22 0.00 0.00 0.00 179.25 179.26 2bia h LYS 317 N 0.44 0.87 -0.17 0.00 3.64 -1.14 -0.35 116.57 119.86 2bia h LYS 317 Ca 0.12 -0.10 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 2bia h LYS 317 Cb -0.04 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 2bia h LYS 317 CO -0.03 0.65 0.11 1.49 -2.27 0.00 0.00 179.45 179.40 2bia h GLU 318 N 0.86 0.14 -0.31 1.90 4.81 -0.98 -2.01 114.58 118.99 2bia h GLU 318 Ca 0.22 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 2bia h GLU 318 Cb 0.03 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2bia h GLU 318 CO -0.04 0.09 0.00 1.04 -0.73 0.00 0.00 179.01 179.38 2bia n GLN 319 N -4.51 1.87 0.00 1.92 1.13 -0.37 -4.92 117.38 112.50 2bia n GLN 319 Ca 0.00 -1.33 0.00 0.00 -1.94 0.00 0.00 57.00 53.73 2bia n GLN 319 Cb 0.14 -1.35 0.00 0.00 0.11 0.00 0.00 30.24 29.14 2bia n GLN 319 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2bia n GLY 320 N 1.14 0.53 3.72 1.08 0.00 -0.75 -4.82 105.19 106.08 2bia n GLY 320 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2bia n GLY 320 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bia s PHE 321 N -2.00 3.67 -0.09 1.61 0.40 -0.26 -0.20 117.98 121.11 2bia s PHE 321 Ca 0.00 1.58 0.03 0.00 -0.60 0.00 0.00 56.93 57.94 2bia s PHE 321 Cb 0.00 -3.00 -0.01 0.00 0.51 0.00 0.00 43.02 40.52 2bia s PHE 321 CO 0.00 0.08 -0.20 0.08 0.70 0.00 0.00 175.22 175.89 2bia s VAL 322 N 0.67 2.51 0.00 -0.44 1.01 0.35 -4.06 120.40 120.44 2bia s VAL 322 Ca 0.46 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.56 2bia s VAL 322 Cb -0.20 -1.98 0.00 0.00 0.00 0.00 0.00 36.38 34.20 2bia s VAL 322 CO 0.25 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.52 2bia n GLY 323 N 3.14 0.63 0.13 4.51 0.00 -1.26 0.24 105.19 112.57 2bia n GLY 323 Ca -0.18 -0.28 0.13 0.00 0.00 0.00 0.00 46.02 45.68 2bia n GLY 323 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2bia h LEU 324 N 0.00 0.00 -9.78 0.99 3.38 -1.80 -3.42 115.31 104.69 2bia h LEU 324 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 2bia h LEU 324 Cb 0.00 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.82 2bia h LEU 324 CO 0.00 0.00 0.83 0.20 0.09 0.00 0.00 178.44 179.56 2bia s ASN 325 N -4.56 6.50 1.02 -0.43 -0.87 -1.26 -0.49 114.94 114.85 2bia s ASN 325 Ca 0.07 2.82 -0.11 0.00 -1.57 0.00 0.00 52.86 54.07 2bia s ASN 325 Cb 0.11 -2.63 0.19 0.00 -0.02 0.00 0.00 41.25 38.90 2bia s ASN 325 CO 0.51 -0.82 1.01 0.61 -2.57 0.00 0.00 177.10 175.84 2bia n GLY 326 N 2.21 -1.14 3.62 0.66 0.00 0.36 -4.44 105.19 106.45 2bia n GLY 326 Ca 0.08 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 2bia n GLY 326 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2bia n HIS 327 N -4.48 1.26 0.20 1.61 -0.00 -1.26 -4.54 115.22 108.00 2bia n HIS 327 Ca 0.08 0.56 0.07 0.00 0.46 0.00 0.00 57.72 58.89 2bia n HIS 327 Cb 0.53 -2.24 0.59 0.00 -0.12 0.00 0.00 29.99 28.75 2bia n HIS 327 CO 0.00 0.00 0.00 0.07 0.46 0.00 0.00 176.34 176.87 2bia h ARG 328 N 1.59 0.12 0.00 1.57 -0.00 -1.92 0.12 114.38 115.86 2bia h ARG 328 Ca -0.45 -0.01 0.00 0.00 -0.00 0.00 0.00 59.98 59.53 2bia h ARG 328 Cb 1.33 -0.03 0.00 0.00 -0.00 0.00 0.00 29.97 31.28 2bia h ARG 328 CO 0.57 0.08 0.00 -1.13 -0.00 0.00 0.00 179.97 179.49 2bia n SER 329 N -4.52 0.63 0.00 0.08 3.41 -1.26 -3.94 113.62 108.01 2bia n SER 329 Ca -0.01 0.66 0.00 0.00 -0.26 0.00 0.00 58.87 59.26 2bia n SER 329 Cb 0.09 -0.79 0.00 0.00 -0.26 0.00 0.00 64.21 63.25 2bia n SER 329 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2bia n VAL 330 N -2.20 0.00 -4.27 -3.33 0.24 0.18 -5.13 118.33 103.81 2bia n VAL 330 Ca 0.02 -0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.21 2bia n VAL 330 Cb 0.22 0.59 0.00 0.00 -1.47 0.00 0.00 33.84 33.18 2bia n VAL 330 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2bia n GLY 331 N 0.85 -0.70 7.00 7.63 0.00 0.18 -4.98 105.19 115.17 2bia n GLY 331 Ca 0.00 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 44.87 2bia n GLY 331 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bia n GLY 332 N 0.00 1.02 3.41 -0.02 0.00 -1.26 -3.95 105.19 104.39 2bia n GLY 332 Ca 0.00 -0.62 -0.23 0.00 0.00 0.00 0.00 46.02 45.17 2bia n GLY 332 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bia s ARG 334 N -3.29 0.32 -0.49 0.00 3.52 0.35 -1.98 118.95 117.39 2bia s ARG 334 Ca 0.24 0.62 -0.20 0.00 -0.13 0.00 0.00 55.73 56.27 2bia s ARG 334 Cb -0.05 -0.34 0.05 0.00 -1.56 0.00 0.00 34.95 33.05 2bia s ARG 334 CO 0.11 -0.55 0.63 0.00 -0.81 0.00 0.00 175.30 174.68 2bia s ALA 335 N 2.54 3.37 -0.16 6.12 0.00 0.49 -4.27 121.76 129.84 2bia s ALA 335 Ca 0.09 -1.58 -0.22 0.00 0.00 0.00 0.00 51.96 50.25 2bia s ALA 335 Cb -0.15 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.61 2bia s ALA 335 CO -0.15 -1.95 0.67 -1.12 0.00 0.00 0.00 175.76 173.22 2bia s SER 336 N 2.47 6.79 -0.41 0.00 0.01 -1.22 -0.79 113.70 120.55 2bia s SER 336 Ca 0.17 0.96 0.09 0.00 1.31 0.00 0.00 55.95 58.48 2bia s SER 336 Cb -0.18 -2.37 0.43 0.00 0.21 0.00 0.00 66.02 64.11 2bia s SER 336 CO 0.14 -0.25 1.04 2.30 0.41 0.00 0.00 173.24 176.88 2bia n ILE 337 N 4.47 1.90 -0.45 1.44 -5.35 0.96 -4.62 119.36 117.70 2bia n ILE 337 Ca -0.01 -4.36 -0.29 0.00 -0.27 0.00 0.00 62.75 57.82 2bia n ILE 337 Cb 0.50 -0.63 0.26 0.00 -1.74 0.00 0.00 39.64 38.03 2bia n ILE 337 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2bia n TYR 338 N -0.31 -1.86 -0.35 4.28 4.02 -1.25 -4.70 117.16 116.98 2bia n TYR 338 Ca 0.29 -0.25 0.11 0.00 -0.01 0.00 0.00 57.90 58.03 2bia n TYR 338 Cb 0.70 -1.59 0.23 0.00 -0.02 0.00 0.00 39.34 38.65 2bia n TYR 338 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 2bia h ASN 339 N -2.82 -0.68 0.30 7.72 2.35 -1.87 -1.49 115.58 119.09 2bia h ASN 339 Ca -0.58 0.29 0.00 0.00 -0.55 0.00 0.00 56.30 55.46 2bia h ASN 339 Cb 1.33 0.55 0.00 0.00 0.05 0.00 0.00 38.32 40.24 2bia h ASN 339 CO 0.43 -0.35 -0.18 0.00 -1.65 0.00 0.00 177.43 175.69 2bia n ALA 340 N -3.35 2.90 -2.13 -0.83 0.00 -1.26 -4.77 120.51 111.07 2bia n ALA 340 Ca 0.20 -0.33 -0.42 0.00 0.00 0.00 0.00 53.44 52.89 2bia n ALA 340 Cb 0.65 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.83 2bia n ALA 340 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2bia s VAL 341 N -2.48 3.54 0.53 0.00 1.01 -0.56 -4.70 120.40 117.74 2bia s VAL 341 Ca 0.27 0.90 -0.19 0.00 0.00 0.00 0.00 61.98 62.97 2bia s VAL 341 Cb 0.20 -3.58 -0.07 0.00 0.00 0.00 0.00 36.38 32.93 2bia s VAL 341 CO 0.49 -0.02 1.05 -2.16 0.00 0.00 0.00 175.10 174.47 2bia s PRO 342 N 2.72 3.61 0.45 2.72 0.04 -1.26 -4.92 135.00 138.35 2bia s PRO 342 Ca 0.67 1.31 0.19 0.00 0.04 0.00 0.00 61.00 63.21 2bia s PRO 342 Cb -0.33 -2.07 1.08 0.00 0.04 0.00 0.00 34.50 33.22 2bia s PRO 342 CO 0.28 -0.59 1.97 0.97 0.04 0.00 0.00 177.00 179.67 2bia h ILE 343 N 1.13 0.94 0.00 0.56 2.10 -1.96 -1.85 117.51 118.43 2bia h ILE 343 Ca -0.49 -0.80 -0.00 0.00 1.08 0.00 0.00 64.86 64.65 2bia h ILE 343 Cb 1.22 1.46 -0.00 0.00 -1.09 0.00 0.00 36.82 38.41 2bia h ILE 343 CO 0.58 0.21 -0.02 -2.24 -1.08 0.00 0.00 178.15 175.61 2bia h ASP 344 N 0.00 0.00 -0.57 2.19 3.04 -1.99 -0.73 116.42 118.35 2bia h ASP 344 Ca -0.00 0.00 -0.09 0.00 -3.24 0.00 0.00 57.03 53.69 2bia h ASP 344 Cb 0.44 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 38.71 2bia h ASP 344 CO 0.03 0.02 -0.00 0.00 -2.04 0.00 0.00 179.24 177.25 2bia h ALA 345 N 1.98 0.88 -0.42 4.15 0.00 -1.70 -0.24 119.26 123.91 2bia h ALA 345 Ca -0.00 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.50 2bia h ALA 345 Cb 0.50 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2bia h ALA 345 CO 0.00 0.66 -0.13 0.00 0.00 0.00 0.00 179.25 179.78 2bia h ILE 347 N 0.66 1.18 -0.81 0.00 2.04 -1.08 -0.84 117.51 118.67 2bia h ILE 347 Ca 0.10 -0.40 0.07 0.00 1.00 0.00 0.00 64.86 65.64 2bia h ILE 347 Cb 0.68 0.33 -0.06 0.00 -0.74 0.00 0.00 36.82 37.03 2bia h ILE 347 CO 0.05 0.18 0.48 0.00 0.00 0.00 0.00 178.15 178.86 2bia h ALA 348 N 1.19 1.11 -0.68 1.87 0.00 -0.80 -0.73 119.26 121.22 2bia h ALA 348 Ca 0.22 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 2bia h ALA 348 Cb -0.03 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2bia h ALA 348 CO -0.04 0.18 0.13 1.25 0.00 0.00 0.00 179.25 180.76 2bia h LEU 349 N 0.86 1.07 -0.47 0.00 5.85 -0.69 -0.86 115.31 121.07 2bia h LEU 349 Ca 0.36 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.83 2bia h LEU 349 Cb 0.22 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 2bia h LEU 349 CO -0.19 1.05 0.31 -0.09 -0.34 0.00 0.00 178.44 179.18 2bia h ARG 350 N 1.05 0.62 -0.58 1.25 2.43 -0.29 0.13 114.38 118.99 2bia h ARG 350 Ca 0.21 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.38 2bia h ARG 350 Cb 0.42 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.79 2bia h ARG 350 CO 0.01 0.42 0.33 0.93 -1.51 0.00 0.00 179.97 180.14 2bia h GLU 351 N 0.64 0.61 -0.45 0.20 5.08 -0.79 0.15 114.58 120.01 2bia h GLU 351 Ca 0.17 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2bia h GLU 351 Cb -0.07 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.02 2bia h GLU 351 CO -0.04 0.40 0.28 1.25 -1.00 0.00 0.00 179.01 179.91 2bia h LEU 352 N 0.63 0.47 -0.81 1.33 5.85 -0.55 -1.21 115.31 121.01 2bia h LEU 352 Ca 0.25 -0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.89 2bia h LEU 352 Cb 0.10 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 2bia h LEU 352 CO -0.14 0.34 0.03 0.24 -0.34 0.00 0.00 178.44 178.57 2bia h MET 353 N 0.57 0.92 -0.07 1.25 2.86 0.13 0.06 114.93 120.66 2bia h MET 353 Ca 0.17 -0.25 -0.24 0.00 -2.06 0.00 0.00 59.70 57.31 2bia h MET 353 Cb -0.03 -0.11 0.02 0.00 0.06 0.00 0.00 31.60 31.55 2bia h MET 353 CO -0.06 0.90 -0.91 0.82 1.06 0.00 0.00 176.91 178.72 2bia h ILE 354 N 0.86 1.28 -0.16 -1.22 2.04 -0.49 -1.90 117.51 117.92 2bia h ILE 354 Ca 0.17 -2.11 -0.17 0.00 1.00 0.00 0.00 64.86 63.74 2bia h ILE 354 Cb 0.46 2.21 -0.00 0.00 -0.74 0.00 0.00 36.82 38.75 2bia h ILE 354 CO 0.02 0.66 -0.60 1.56 0.00 0.00 0.00 178.15 179.78 2bia h GLN 355 N 0.44 0.55 -0.49 2.37 1.08 -1.04 -0.12 115.11 117.89 2bia h GLN 355 Ca -0.09 -0.38 0.05 0.00 -1.45 0.00 0.00 58.65 56.78 2bia h GLN 355 Cb 1.55 0.05 -0.05 0.00 -0.05 0.00 0.00 27.48 28.99 2bia h GLN 355 CO 0.18 0.99 0.22 0.35 -0.95 0.00 0.00 178.83 179.63 2bia h PHE 356 N 0.41 0.41 -0.11 2.96 3.57 -0.99 -0.86 116.94 122.33 2bia h PHE 356 Ca -0.00 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 2bia h PHE 356 Cb 1.16 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.79 2bia h PHE 356 CO 0.05 0.18 0.05 -0.22 -2.23 0.00 0.00 178.31 176.14 2bia h LYS 357 N 0.44 0.15 0.00 1.11 3.64 -1.13 -1.00 116.57 119.79 2bia h LYS 357 Ca 0.22 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.54 2bia h LYS 357 Cb 0.17 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 2bia h LYS 357 CO -0.18 0.24 -0.21 0.93 -2.27 0.00 0.00 179.45 177.97 2bia h GLU 358 N 0.03 0.00 -0.02 1.90 5.08 -0.75 -2.19 114.58 118.63 2bia h GLU 358 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2bia h GLU 358 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2bia h GLU 358 CO -0.00 0.21 -0.15 0.09 -1.00 0.00 0.00 179.01 178.15 2bia n ASN 359 N -4.26 2.00 -0.43 1.42 3.02 -0.35 -5.10 115.26 111.56 2bia n ASN 359 Ca -0.02 -1.55 0.14 0.00 -0.03 0.00 0.00 54.58 53.12 2bia n ASN 359 Cb 0.27 0.13 0.57 0.00 -0.61 0.00 0.00 39.78 40.13 2bia n ASN 359 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64