#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pg8 n HIS 2 N 0.00 0.00 -1.42 2.03 -0.00 -1.26 -5.09 115.22 109.49 1pg8 n HIS 2 Ca 0.00 0.00 -0.48 0.00 0.46 0.00 0.00 57.72 57.70 1pg8 n HIS 2 Cb 0.00 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 29.84 1pg8 n HIS 2 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1pg8 n GLY 3 N 0.91 -1.62 0.45 1.57 0.00 -1.26 -4.77 105.19 100.47 1pg8 n GLY 3 Ca 0.00 0.34 0.27 0.00 0.00 0.00 0.00 46.02 46.63 1pg8 n GLY 3 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1pg8 h SER 4 N 1.09 0.30 -0.24 1.61 0.87 -2.08 -1.22 113.55 113.89 1pg8 h SER 4 Ca -0.29 0.07 -0.70 0.00 -1.23 0.00 0.00 61.79 59.63 1pg8 h SER 4 Cb 1.43 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 63.38 1pg8 h SER 4 CO 0.57 0.04 3.25 0.59 -0.53 0.00 0.00 176.83 180.75 1pg8 n ASN 5 N -4.51 6.28 -4.83 6.23 4.13 -1.26 -5.00 115.26 116.30 1pg8 n ASN 5 Ca 0.26 -2.79 -0.38 0.00 1.68 0.00 0.00 54.58 53.36 1pg8 n ASN 5 Cb 1.03 -1.58 -0.06 0.00 -1.54 0.00 0.00 39.78 37.63 1pg8 n ASN 5 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1pg8 s LYS 6 N 2.14 4.06 -0.29 3.52 2.36 -0.46 -5.08 119.74 125.98 1pg8 s LYS 6 Ca 0.56 0.58 -0.10 0.00 -2.55 0.00 0.00 55.97 54.46 1pg8 s LYS 6 Cb 0.16 -3.18 -0.02 0.00 -1.05 0.00 0.00 37.83 33.73 1pg8 s LYS 6 CO -0.07 0.63 0.16 -1.17 1.55 0.00 0.00 175.35 176.45 1pg8 s LEU 7 N -1.24 4.00 0.61 5.43 2.96 -1.26 -5.09 118.68 124.08 1pg8 s LEU 7 Ca 0.29 -0.30 -0.19 0.00 -0.22 0.00 0.00 54.13 53.70 1pg8 s LEU 7 Cb -0.18 -2.04 -0.03 0.00 0.50 0.00 0.00 46.19 44.45 1pg8 s LEU 7 CO 0.17 -0.13 1.27 -2.65 -1.32 0.00 0.00 176.35 173.69 1pg8 n PRO 8 N 5.01 1.27 -1.26 0.98 -0.02 -1.26 -4.99 135.00 134.73 1pg8 n PRO 8 Ca -0.14 0.49 -0.29 0.00 -2.02 0.00 0.00 63.50 61.54 1pg8 n PRO 8 Cb 0.50 -2.50 0.18 0.00 -0.02 0.00 0.00 33.50 31.67 1pg8 n PRO 8 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1pg8 s GLY 9 N -1.21 1.57 0.14 -1.23 0.00 -1.26 -4.74 107.32 100.60 1pg8 s GLY 9 Ca 0.78 -0.53 -0.23 0.00 0.00 0.00 0.00 44.72 44.74 1pg8 s GLY 9 CO 0.44 0.12 1.64 -2.75 0.00 0.00 0.00 173.10 172.55 1pg8 h PHE 10 N -1.92 -0.59 -0.91 1.90 3.57 -2.00 -2.39 116.94 114.59 1pg8 h PHE 10 Ca -0.52 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 60.99 1pg8 h PHE 10 Cb 1.33 0.28 -0.04 0.00 2.79 0.00 0.00 35.95 40.30 1pg8 h PHE 10 CO -0.12 -0.30 0.52 0.00 -2.23 0.00 0.00 178.31 176.18 1pg8 h ALA 11 N 0.70 1.20 0.33 2.41 0.00 -1.99 -1.41 119.26 120.50 1pg8 h ALA 11 Ca 0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1pg8 h ALA 11 Cb 0.43 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1pg8 h ALA 11 CO -0.30 0.66 -0.16 1.15 0.00 0.00 0.00 179.25 180.60 1pg8 h THR 12 N 1.27 0.66 -0.94 0.00 2.02 -1.80 -3.02 112.91 111.09 1pg8 h THR 12 Ca 0.32 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.52 1pg8 h THR 12 Cb -0.01 0.66 -0.05 0.00 -1.74 0.00 0.00 68.15 67.02 1pg8 h THR 12 CO -0.06 0.00 0.62 0.03 0.37 0.00 0.00 175.52 176.49 1pg8 h ARG 13 N -0.45 1.22 -0.11 6.66 3.08 -1.26 -0.76 114.38 122.75 1pg8 h ARG 13 Ca -0.04 -0.07 0.03 0.00 0.07 0.00 0.00 59.98 59.97 1pg8 h ARG 13 Cb 0.35 -0.27 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 1pg8 h ARG 13 CO 0.07 0.81 0.13 0.00 -1.07 0.00 0.00 179.97 179.91 1pg8 h ALA 14 N 1.36 1.69 0.00 0.04 0.00 -1.25 0.18 119.26 121.28 1pg8 h ALA 14 Ca 0.36 -0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.89 1pg8 h ALA 14 Cb -0.10 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.63 1pg8 h ALA 14 CO -0.09 -0.19 -2.38 -0.89 0.00 0.00 0.00 179.25 175.70 1pg8 n ILE 15 N -3.80 1.38 0.00 0.00 5.41 -0.89 -4.17 119.36 117.29 1pg8 n ILE 15 Ca -0.00 -0.79 0.00 0.00 1.00 0.00 0.00 62.75 62.96 1pg8 n ILE 15 Cb 0.24 -0.65 0.00 0.00 -0.71 0.00 0.00 39.64 38.52 1pg8 n ILE 15 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1pg8 n HIS 16 N -2.83 0.00 -1.66 1.39 8.25 -0.34 -5.04 115.22 114.98 1pg8 n HIS 16 Ca -0.35 0.00 -0.48 0.00 -0.26 0.00 0.00 57.72 56.63 1pg8 n HIS 16 Cb 1.12 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 32.18 1pg8 n HIS 16 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1pg8 n HIS 17 N -1.56 2.16 -0.70 4.41 -0.00 0.60 -2.41 115.22 117.72 1pg8 n HIS 17 Ca 0.00 0.27 0.00 0.00 -0.00 0.00 0.00 57.72 57.99 1pg8 n HIS 17 Cb 0.22 -2.54 0.00 0.00 -0.00 0.00 0.00 29.99 27.67 1pg8 n HIS 17 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1pg8 n GLY 18 N 3.61 0.77 2.91 1.57 0.00 -1.26 -4.60 105.19 108.18 1pg8 n GLY 18 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 1pg8 n GLY 18 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1pg8 s TYR 19 N -2.81 1.52 -0.26 1.61 5.04 -1.01 -5.00 117.35 116.44 1pg8 s TYR 19 Ca 0.00 -0.77 -0.08 0.00 -2.44 0.00 0.00 57.07 53.78 1pg8 s TYR 19 Cb 0.00 -1.25 -0.03 0.00 0.35 0.00 0.00 41.96 41.03 1pg8 s TYR 19 CO 0.00 -0.52 0.10 0.34 -1.34 0.00 0.00 175.55 174.13 1pg8 s ASP 20 N 1.70 5.37 0.46 4.32 -1.08 -1.26 -4.98 116.67 121.19 1pg8 s ASP 20 Ca 0.05 -0.17 0.21 0.00 -0.52 0.00 0.00 52.55 52.12 1pg8 s ASP 20 Cb -0.13 -1.97 1.20 0.00 -1.46 0.00 0.00 42.92 40.56 1pg8 s ASP 20 CO -0.08 -0.04 1.91 -0.65 0.52 0.00 0.00 175.17 176.82 1pg8 h PRO 21 N 8.27 0.25 0.00 4.34 0.11 -1.89 -1.53 132.00 141.56 1pg8 h PRO 21 Ca -0.37 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1pg8 h PRO 21 Cb 1.18 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1pg8 h PRO 21 CO 0.57 0.17 0.15 1.96 -0.21 0.00 0.00 178.00 180.64 1pg8 h GLN 22 N 0.26 0.00 -0.09 1.05 1.08 -1.89 -0.80 115.11 114.72 1pg8 h GLN 22 Ca 0.39 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.59 1pg8 h GLN 22 Cb 1.12 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.55 1pg8 h GLN 22 CO -0.09 0.00 0.00 -0.25 -0.95 0.00 0.00 178.83 177.54 1pg8 n ASP 23 N -2.89 1.07 -2.98 1.46 8.00 -0.57 -4.21 116.55 116.42 1pg8 n ASP 23 Ca -0.02 -1.55 -0.14 0.00 0.71 0.00 0.00 54.79 53.78 1pg8 n ASP 23 Cb 0.21 -0.05 0.02 0.00 -0.02 0.00 0.00 41.12 41.28 1pg8 n ASP 23 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1pg8 n HIS 24 N -0.09 -1.03 -1.38 1.24 8.25 -0.40 -4.97 115.22 116.85 1pg8 n HIS 24 Ca 0.16 -3.08 -0.13 0.00 -0.26 0.00 0.00 57.72 54.42 1pg8 n HIS 24 Cb 0.24 0.43 -0.06 0.00 1.12 0.00 0.00 29.99 31.73 1pg8 n HIS 24 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1pg8 n GLY 25 N 0.27 1.30 1.89 -1.41 0.00 -1.25 -1.44 105.19 104.56 1pg8 n GLY 25 Ca 0.16 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1pg8 n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pg8 n GLY 26 N -0.52 0.81 3.59 -0.02 0.00 -0.64 -5.01 105.19 103.39 1pg8 n GLY 26 Ca -0.13 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.44 1pg8 n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pg8 n ALA 27 N -0.05 1.57 -0.06 4.61 0.00 -0.52 -4.78 120.51 121.28 1pg8 n ALA 27 Ca 0.00 -0.12 -0.08 0.00 0.00 0.00 0.00 53.44 53.24 1pg8 n ALA 27 Cb 0.00 -2.80 -0.01 0.00 0.00 0.00 0.00 19.45 16.64 1pg8 n ALA 27 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1pg8 h LEU 28 N 13.60 -0.80 -9.51 0.00 6.46 -1.91 -3.39 115.31 119.76 1pg8 h LEU 28 Ca -0.40 0.15 -0.59 0.00 -0.12 0.00 0.00 57.88 56.92 1pg8 h LEU 28 Cb 1.26 0.38 -0.07 0.00 -0.73 0.00 0.00 40.66 41.50 1pg8 h LEU 28 CO 0.97 -0.28 -0.15 -0.69 -0.62 0.00 0.00 178.44 177.67 1pg8 s VAL 29 N -6.08 5.07 0.30 1.05 1.01 -1.26 -4.86 120.40 115.63 1pg8 s VAL 29 Ca -0.15 0.94 -0.29 0.00 0.00 0.00 0.00 61.98 62.48 1pg8 s VAL 29 Cb 0.12 -3.79 -0.11 0.00 0.00 0.00 0.00 36.38 32.61 1pg8 s VAL 29 CO 0.68 0.45 1.49 -2.16 0.00 0.00 0.00 175.10 175.56 1pg8 s PRO 30 N -0.25 4.20 0.55 2.72 0.04 -1.26 -4.98 135.00 136.02 1pg8 s PRO 30 Ca 0.25 2.44 -0.22 0.00 0.04 0.00 0.00 61.00 63.52 1pg8 s PRO 30 Cb -0.16 -3.05 -0.05 0.00 0.04 0.00 0.00 34.50 31.28 1pg8 s PRO 30 CO 0.13 -0.49 1.32 -2.30 0.04 0.00 0.00 177.00 175.70 1pg8 n PRO 31 N 1.75 1.62 -3.29 0.56 -0.02 -1.26 -4.98 135.00 129.38 1pg8 n PRO 31 Ca 0.05 0.60 -0.41 0.00 -2.02 0.00 0.00 63.50 61.72 1pg8 n PRO 31 Cb 0.39 -2.53 -0.08 0.00 -0.02 0.00 0.00 33.50 31.26 1pg8 n PRO 31 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1pg8 s VAL 32 N -1.30 5.06 -1.35 -1.45 1.01 -1.26 -4.80 120.40 116.31 1pg8 s VAL 32 Ca 0.72 0.19 -0.15 0.00 0.00 0.00 0.00 61.98 62.74 1pg8 s VAL 32 Cb -0.42 -3.94 0.08 0.00 0.00 0.00 0.00 36.38 32.10 1pg8 s VAL 32 CO 0.49 -0.21 1.90 -1.22 0.00 0.00 0.00 175.10 176.06 1pg8 n TYR 33 N 5.64 4.06 -2.08 5.22 4.02 -1.26 -4.84 117.16 127.93 1pg8 n TYR 33 Ca -0.06 -2.95 -0.42 0.00 -0.01 0.00 0.00 57.90 54.46 1pg8 n TYR 33 Cb 0.49 -2.46 0.00 0.00 -0.02 0.00 0.00 39.34 37.35 1pg8 n TYR 33 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 1pg8 n GLN 34 N 6.62 3.29 -3.85 -0.72 -0.06 -1.26 -4.76 117.38 116.64 1pg8 n GLN 34 Ca 0.47 -3.13 -0.12 0.00 -2.00 0.00 0.00 57.00 52.22 1pg8 n GLN 34 Cb 0.42 -3.09 -0.14 0.00 -4.06 0.00 0.00 30.24 23.37 1pg8 n GLN 34 CO 0.00 0.00 0.00 -0.08 -0.20 0.00 0.00 177.06 176.78 1pg8 s THR 35 N 1.63 -0.01 -0.03 1.69 -1.32 -1.26 -5.06 115.64 111.28 1pg8 s THR 35 Ca 0.43 0.02 -0.16 0.00 -1.21 0.00 0.00 61.69 60.77 1pg8 s THR 35 Cb 0.11 -0.07 -0.32 0.00 -1.51 0.00 0.00 72.50 70.71 1pg8 s THR 35 CO -0.04 0.01 0.82 0.00 -2.21 0.00 0.00 174.62 173.20 1pg8 h ALA 36 N 6.21 -0.02 -2.12 11.08 0.00 -1.98 -3.42 119.26 129.02 1pg8 h ALA 36 Ca -0.26 -0.92 -0.45 0.00 0.00 0.00 0.00 54.91 53.27 1pg8 h ALA 36 Cb 1.20 0.28 -0.14 0.00 0.00 0.00 0.00 17.79 19.12 1pg8 h ALA 36 CO 0.48 0.70 -0.67 -0.08 0.00 0.00 0.00 179.25 179.69 1pg8 s THR 37 N -2.53 1.41 0.10 0.00 -1.32 -1.26 -1.31 115.64 110.73 1pg8 s THR 37 Ca -0.14 -2.09 0.05 0.00 -1.21 0.00 0.00 61.69 58.30 1pg8 s THR 37 Cb 0.04 -2.42 -0.04 0.00 -1.51 0.00 0.00 72.50 68.57 1pg8 s THR 37 CO 0.86 -0.30 -0.12 -0.36 -2.21 0.00 0.00 174.62 172.49 1pg8 s PHE 38 N -3.17 1.20 0.20 9.09 0.40 -0.97 -4.97 117.98 119.76 1pg8 s PHE 38 Ca 0.29 -0.59 0.07 0.00 -0.60 0.00 0.00 56.93 56.11 1pg8 s PHE 38 Cb 0.05 -0.65 -0.04 0.00 0.51 0.00 0.00 43.02 42.89 1pg8 s PHE 38 CO 0.11 0.06 0.06 0.99 0.70 0.00 0.00 175.22 177.13 1pg8 s THR 39 N -2.13 3.95 -0.01 0.64 2.01 -1.26 -4.76 115.64 114.08 1pg8 s THR 39 Ca 0.05 -1.42 0.07 0.00 0.31 0.00 0.00 61.69 60.71 1pg8 s THR 39 Cb -0.05 -3.03 -0.02 0.00 0.01 0.00 0.00 72.50 69.41 1pg8 s THR 39 CO 0.01 -0.18 -0.23 -0.36 -0.69 0.00 0.00 174.62 173.17 1pg8 s PHE 40 N -1.87 2.06 0.22 4.92 0.40 -1.26 -4.98 117.98 117.47 1pg8 s PHE 40 Ca 0.29 -0.39 0.11 0.00 -0.60 0.00 0.00 56.93 56.35 1pg8 s PHE 40 Cb -0.09 -1.32 0.31 0.00 0.51 0.00 0.00 43.02 42.44 1pg8 s PHE 40 CO 0.21 -0.02 1.58 -1.00 0.70 0.00 0.00 175.22 176.69 1pg8 h PRO 41 N 5.47 0.00 -3.96 0.24 0.13 -2.00 -3.44 132.00 128.44 1pg8 h PRO 41 Ca -0.41 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.58 1pg8 h PRO 41 Cb 1.13 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.09 1pg8 h PRO 41 CO 0.47 0.63 -0.61 0.95 -0.23 0.00 0.00 178.00 179.22 1pg8 s THR 42 N -3.46 0.15 0.41 1.56 -4.23 -1.26 -5.04 115.64 103.77 1pg8 s THR 42 Ca -0.01 -1.24 0.25 0.00 -1.18 0.00 0.00 61.69 59.51 1pg8 s THR 42 Cb 0.12 -0.91 0.43 0.00 1.34 0.00 0.00 72.50 73.48 1pg8 s THR 42 CO 0.76 -0.68 1.66 0.58 -0.54 0.00 0.00 174.62 176.39 1pg8 h VAL 43 N 3.76 0.22 -0.13 2.29 2.07 -2.00 -2.04 116.25 120.42 1pg8 h VAL 43 Ca -0.33 -0.06 -0.19 0.00 0.82 0.00 0.00 66.70 66.94 1pg8 h VAL 43 Cb 1.18 0.03 0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1pg8 h VAL 43 CO 0.52 0.03 -0.67 -0.33 0.02 0.00 0.00 177.57 177.14 1pg8 h GLU 44 N 0.18 0.68 -1.01 1.57 3.07 -1.99 -1.90 114.58 115.18 1pg8 h GLU 44 Ca 0.76 -0.56 0.08 0.00 -0.50 0.00 0.00 59.36 59.14 1pg8 h GLU 44 Cb 2.19 0.12 -0.07 0.00 -0.84 0.00 0.00 28.75 30.15 1pg8 h GLU 44 CO -0.45 1.18 0.65 -0.92 -1.40 0.00 0.00 179.01 178.06 1pg8 h TYR 45 N 0.36 1.20 -0.11 4.33 3.20 -1.70 -0.87 116.97 123.37 1pg8 h TYR 45 Ca -0.05 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 61.68 1pg8 h TYR 45 Cb 1.31 -0.39 -0.01 0.00 1.54 0.00 0.00 36.73 39.18 1pg8 h TYR 45 CO 0.10 0.59 -0.65 0.78 -1.64 0.00 0.00 178.16 177.34 1pg8 h GLY 46 N 1.14 0.46 0.99 1.82 0.00 -1.45 -3.23 103.07 102.81 1pg8 h GLY 46 Ca 0.45 -0.60 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1pg8 h GLY 46 CO -0.19 0.54 0.06 0.00 0.00 0.00 0.00 176.54 176.94 1pg8 h ALA 47 N 0.99 0.12 -1.22 3.60 0.00 -0.82 -2.73 119.26 119.20 1pg8 h ALA 47 Ca -0.01 -0.01 -0.72 0.00 0.00 0.00 0.00 54.91 54.16 1pg8 h ALA 47 Cb 1.20 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.82 1pg8 h ALA 47 CO 0.11 -0.38 1.82 0.00 0.00 0.00 0.00 179.25 180.80 1pg8 n ALA 48 N -2.12 4.15 0.00 0.00 0.00 -0.38 -2.49 120.51 119.67 1pg8 n ALA 48 Ca -0.05 -4.13 0.00 0.00 0.00 0.00 0.00 53.44 49.26 1pg8 n ALA 48 Cb 0.03 -3.22 0.00 0.00 0.00 0.00 0.00 19.45 16.26 1pg8 n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pg8 h PHE 50 N 0.00 0.94 0.00 0.00 -1.00 -1.49 -3.16 116.94 112.23 1pg8 h PHE 50 Ca 0.00 -0.16 -0.03 0.00 2.81 0.00 0.00 57.97 60.59 1pg8 h PHE 50 Cb 0.00 -0.24 -0.00 0.00 3.61 0.00 0.00 35.95 39.31 1pg8 h PHE 50 CO 0.00 0.88 -0.15 0.00 -1.61 0.00 0.00 178.31 177.43 1pg8 h ALA 51 N 0.93 1.63 0.00 2.45 0.00 -1.76 -3.47 119.26 119.04 1pg8 h ALA 51 Ca 0.14 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1pg8 h ALA 51 Cb 0.51 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1pg8 h ALA 51 CO 0.02 0.19 0.00 0.41 0.00 0.00 0.00 179.25 179.88 1pg8 n GLY 52 N -1.00 1.18 3.79 0.00 0.00 -1.19 -5.09 105.19 102.87 1pg8 n GLY 52 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 1pg8 n GLY 52 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pg8 s GLU 53 N -0.70 3.61 0.35 1.61 2.02 -1.26 -4.80 118.70 119.53 1pg8 s GLU 53 Ca 0.00 1.40 0.00 0.00 0.02 0.00 0.00 54.97 56.39 1pg8 s GLU 53 Cb 0.00 -2.06 0.00 0.00 0.10 0.00 0.00 34.13 32.17 1pg8 s GLU 53 CO 0.00 -0.60 0.00 0.94 0.02 0.00 0.00 175.26 175.62 1pg8 n GLN 54 N -1.22 -4.99 -0.19 1.61 -0.06 -1.26 -2.60 117.38 108.67 1pg8 n GLN 54 Ca 0.10 3.60 0.02 0.00 -2.00 0.00 0.00 57.00 58.72 1pg8 n GLN 54 Cb 0.52 -3.95 0.10 0.00 -4.06 0.00 0.00 30.24 22.85 1pg8 n GLN 54 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1pg8 n ALA 55 N 0.56 2.72 -1.26 1.69 0.00 -1.26 -4.60 120.51 118.36 1pg8 n ALA 55 Ca 0.00 -0.44 -0.30 0.00 0.00 0.00 0.00 53.44 52.70 1pg8 n ALA 55 Cb 0.00 -1.02 0.24 0.00 0.00 0.00 0.00 19.45 18.67 1pg8 n ALA 55 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1pg8 s GLY 56 N -0.50 1.63 0.15 0.00 0.00 -1.26 -5.09 107.32 102.26 1pg8 s GLY 56 Ca 0.14 -1.07 0.11 0.00 0.00 0.00 0.00 44.72 43.89 1pg8 s GLY 56 CO 0.06 -0.18 -0.23 0.30 0.00 0.00 0.00 173.10 173.05 1pg8 s HIS 57 N -3.21 2.38 0.00 1.90 3.76 -1.26 -5.02 115.29 113.84 1pg8 s HIS 57 Ca 0.72 -0.34 0.00 0.00 -0.15 0.00 0.00 55.06 55.30 1pg8 s HIS 57 Cb -0.07 -1.23 0.00 0.00 1.11 0.00 0.00 32.58 32.38 1pg8 s HIS 57 CO 0.55 0.42 0.00 1.97 -0.85 0.00 0.00 174.74 176.84 1pg8 n PHE 58 N 0.57 0.00 -3.67 1.40 -1.74 -1.26 -4.60 117.46 108.16 1pg8 n PHE 58 Ca -0.15 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.64 1pg8 n PHE 58 Cb 0.54 0.00 -0.09 0.00 1.52 0.00 0.00 39.48 41.46 1pg8 n PHE 58 CO 0.00 0.00 0.00 -0.47 -0.56 0.00 0.00 176.76 175.73 1pg8 s TYR 59 N -1.46 -0.79 -0.01 2.97 6.14 -1.26 -2.29 117.35 120.65 1pg8 s TYR 59 Ca 0.00 1.70 0.31 0.00 0.64 0.00 0.00 57.07 59.72 1pg8 s TYR 59 Cb 0.00 0.39 1.12 0.00 0.42 0.00 0.00 41.96 43.89 1pg8 s TYR 59 CO 0.00 -0.40 1.89 0.77 0.64 0.00 0.00 175.55 178.45 1pg8 h SER 60 N 6.47 0.00 -0.48 4.32 0.02 -1.34 -1.88 113.55 120.66 1pg8 h SER 60 Ca -0.31 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.63 1pg8 h SER 60 Cb 1.20 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.71 1pg8 h SER 60 CO 0.19 0.02 0.28 -0.09 -1.14 0.00 0.00 176.83 176.09 1pg8 h ARG 61 N 0.00 0.67 0.50 3.45 2.43 -1.94 -3.23 114.38 116.25 1pg8 h ARG 61 Ca -0.00 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 1pg8 h ARG 61 Cb 0.63 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1pg8 h ARG 61 CO 0.00 0.51 -0.24 0.82 -1.51 0.00 0.00 179.97 179.55 1pg8 h ILE 62 N 0.64 0.32 -1.88 1.20 5.03 -1.74 -3.44 117.51 117.64 1pg8 h ILE 62 Ca 0.17 -0.46 -0.01 0.00 -0.12 0.00 0.00 64.86 64.44 1pg8 h ILE 62 Cb 0.03 0.46 -0.22 0.00 -3.03 0.00 0.00 36.82 34.05 1pg8 h ILE 62 CO -0.03 0.05 0.24 -0.55 -0.68 0.00 0.00 178.15 177.18 1pg8 s SER 63 N -4.78 -0.65 -0.06 1.72 0.15 -0.91 -4.97 113.70 104.19 1pg8 s SER 63 Ca -0.14 1.15 -0.05 0.00 0.70 0.00 0.00 55.95 57.62 1pg8 s SER 63 Cb 0.02 1.13 0.02 0.00 -1.71 0.00 0.00 66.02 65.48 1pg8 s SER 63 CO 0.46 -0.29 0.16 0.21 1.20 0.00 0.00 173.24 174.99 1pg8 s ASN 64 N 0.03 -0.15 0.28 5.45 3.84 -1.26 -4.03 114.94 119.09 1pg8 s ASN 64 Ca -0.01 0.32 -0.00 0.00 0.21 0.00 0.00 52.86 53.38 1pg8 s ASN 64 Cb -0.04 0.29 0.50 0.00 -0.55 0.00 0.00 41.25 41.45 1pg8 s ASN 64 CO 0.01 -0.08 1.86 -0.65 -2.79 0.00 0.00 177.10 175.45 1pg8 h PRO 65 N 6.31 1.04 0.27 0.43 0.11 -1.98 0.31 132.00 138.49 1pg8 h PRO 65 Ca -0.30 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.73 1pg8 h PRO 65 Cb 1.18 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1pg8 h PRO 65 CO 0.41 0.69 -0.13 1.15 -0.21 0.00 0.00 178.00 179.91 1pg8 h THR 66 N 1.07 0.75 -0.91 -1.15 2.02 -1.89 -1.94 112.91 110.86 1pg8 h THR 66 Ca 0.46 -0.09 0.10 0.00 0.77 0.00 0.00 66.41 67.66 1pg8 h THR 66 Cb 0.34 0.80 -0.08 0.00 -1.74 0.00 0.00 68.15 67.47 1pg8 h THR 66 CO -0.22 0.02 0.55 -0.07 0.37 0.00 0.00 175.52 176.17 1pg8 h LEU 67 N -0.41 0.80 -1.20 2.58 4.07 -1.68 -2.21 115.31 117.26 1pg8 h LEU 67 Ca -0.04 0.05 -0.08 0.00 0.08 0.00 0.00 57.88 57.89 1pg8 h LEU 67 Cb 0.31 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 41.93 1pg8 h LEU 67 CO 0.06 0.45 -0.38 0.78 -1.08 0.00 0.00 178.44 178.27 1pg8 h ASN 68 N 0.90 0.04 0.16 -0.43 -0.26 -0.24 -0.10 115.58 115.66 1pg8 h ASN 68 Ca 0.44 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 56.16 1pg8 h ASN 68 Cb 0.41 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.66 1pg8 h ASN 68 CO -0.25 0.42 -0.08 0.25 -1.06 0.00 0.00 177.43 176.71 1pg8 h LEU 69 N 0.04 -0.18 -0.98 1.61 5.85 -0.80 -0.43 115.31 120.41 1pg8 h LEU 69 Ca 0.00 -0.15 0.14 0.00 0.84 0.00 0.00 57.88 58.71 1pg8 h LEU 69 Cb 0.68 0.05 -0.09 0.00 0.37 0.00 0.00 40.66 41.67 1pg8 h LEU 69 CO 0.05 0.04 0.61 0.25 -0.34 0.00 0.00 178.44 179.05 1pg8 h LEU 70 N -0.41 0.86 -0.38 2.25 5.85 -0.95 -0.99 115.31 121.54 1pg8 h LEU 70 Ca -0.02 0.06 -0.11 0.00 0.84 0.00 0.00 57.88 58.65 1pg8 h LEU 70 Cb 0.32 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1pg8 h LEU 70 CO 0.04 0.42 -0.20 -0.33 -0.34 0.00 0.00 178.44 178.03 1pg8 h GLU 71 N 0.91 0.80 -0.38 1.25 5.08 -0.84 -0.58 114.58 120.83 1pg8 h GLU 71 Ca 0.51 -0.36 -0.10 0.00 -1.00 0.00 0.00 59.36 58.42 1pg8 h GLU 71 Cb 0.58 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 1pg8 h GLU 71 CO -0.30 0.98 -0.16 0.00 -1.00 0.00 0.00 179.01 178.53 1pg8 h ALA 72 N 0.80 1.01 -0.19 3.43 0.00 -0.60 -0.67 119.26 123.04 1pg8 h ALA 72 Ca 0.08 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 1pg8 h ALA 72 Cb 0.75 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1pg8 h ALA 72 CO 0.06 0.59 -0.13 -0.09 0.00 0.00 0.00 179.25 179.68 1pg8 h ARG 73 N 0.62 0.42 -0.27 0.00 2.43 -1.04 -1.58 114.38 114.96 1pg8 h ARG 73 Ca 0.10 -0.20 -0.07 0.00 -0.81 0.00 0.00 59.98 59.00 1pg8 h ARG 73 Cb 0.63 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.16 1pg8 h ARG 73 CO 0.04 0.75 -0.12 0.52 -1.51 0.00 0.00 179.97 179.65 1pg8 h MET 74 N 0.09 0.46 0.15 0.20 2.86 -1.04 -0.89 114.93 116.77 1pg8 h MET 74 Ca 0.04 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 1pg8 h MET 74 Cb 0.64 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.25 1pg8 h MET 74 CO 0.04 0.58 -0.07 0.00 1.06 0.00 0.00 176.91 178.51 1pg8 h ALA 75 N 1.45 -0.20 -0.09 6.32 0.00 -0.90 -1.64 119.26 124.20 1pg8 h ALA 75 Ca 0.08 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.96 1pg8 h ALA 75 Cb 0.46 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 1pg8 h ALA 75 CO 0.03 -0.58 -0.24 1.03 0.00 0.00 0.00 179.25 179.49 1pg8 h SER 76 N -0.27 -0.73 -0.93 0.00 0.87 -1.08 0.18 113.55 111.59 1pg8 h SER 76 Ca -0.02 0.11 0.12 0.00 -1.23 0.00 0.00 61.79 60.77 1pg8 h SER 76 Cb 0.21 0.32 -0.08 0.00 -0.44 0.00 0.00 62.40 62.41 1pg8 h SER 76 CO 0.03 -0.29 0.55 -0.07 -0.53 0.00 0.00 176.83 176.52 1pg8 h LEU 77 N -0.32 0.79 -0.06 2.23 4.07 -1.02 -1.82 115.31 119.17 1pg8 h LEU 77 Ca 0.09 0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.11 1pg8 h LEU 77 Cb 0.45 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.10 1pg8 h LEU 77 CO -0.28 0.41 -0.36 -0.62 -1.08 0.00 0.00 178.44 176.52 1pg8 n GLU 78 N -4.70 0.12 -2.71 1.13 -0.58 -0.63 -4.80 120.64 108.46 1pg8 n GLU 78 Ca 0.17 -0.06 -0.08 0.00 -0.42 0.00 0.00 57.16 56.78 1pg8 n GLU 78 Cb 0.36 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.76 1pg8 n GLU 78 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1pg8 n GLY 79 N 1.47 0.23 3.48 0.62 0.00 0.51 -4.57 105.19 106.94 1pg8 n GLY 79 Ca 0.07 -0.28 -0.23 0.00 0.00 0.00 0.00 46.02 45.58 1pg8 n GLY 79 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pg8 s GLY 80 N -3.36 2.08 0.09 -0.02 0.00 -0.55 -4.78 107.32 100.79 1pg8 s GLY 80 Ca 0.09 -2.06 -0.10 0.00 0.00 0.00 0.00 44.72 42.66 1pg8 s GLY 80 CO 0.28 -1.90 1.22 0.83 0.00 0.00 0.00 173.10 173.54 1pg8 h GLU 81 N 2.10 0.55 -2.78 2.90 5.08 -1.81 -3.39 114.58 117.23 1pg8 h GLU 81 Ca -0.41 -0.62 -0.09 0.00 -1.00 0.00 0.00 59.36 57.23 1pg8 h GLU 81 Cb 1.24 0.18 -0.19 0.00 0.50 0.00 0.00 28.75 30.49 1pg8 h GLU 81 CO 0.71 1.24 -0.12 0.00 -1.00 0.00 0.00 179.01 179.84 1pg8 s ALA 82 N -3.22 -1.08 0.23 3.43 0.00 -0.67 -4.80 121.76 115.65 1pg8 s ALA 82 Ca -0.08 0.56 0.10 0.00 0.00 0.00 0.00 51.96 52.55 1pg8 s ALA 82 Cb 0.08 0.13 -0.05 0.00 0.00 0.00 0.00 23.12 23.27 1pg8 s ALA 82 CO 0.90 -0.34 -0.19 0.20 0.00 0.00 0.00 175.76 176.33 1pg8 s GLY 83 N -1.47 1.69 -0.02 0.00 0.00 -1.25 -2.10 107.32 104.17 1pg8 s GLY 83 Ca -0.11 -1.74 -0.00 0.00 0.00 0.00 0.00 44.72 42.87 1pg8 s GLY 83 CO 0.04 -1.82 0.04 -2.27 0.00 0.00 0.00 173.10 169.09 1pg8 s LEU 84 N -3.23 1.20 -0.14 0.66 0.20 0.20 -4.83 118.68 112.74 1pg8 s LEU 84 Ca 0.25 0.06 -0.05 0.00 0.69 0.00 0.00 54.13 55.08 1pg8 s LEU 84 Cb -0.04 -0.00 -0.04 0.00 -0.43 0.00 0.00 46.19 45.67 1pg8 s LEU 84 CO 0.11 -0.11 0.03 0.00 -0.29 0.00 0.00 176.35 176.10 1pg8 s ALA 85 N 0.88 3.35 0.31 5.97 0.00 -1.26 -1.09 121.76 129.92 1pg8 s ALA 85 Ca -0.07 -0.76 0.03 0.00 0.00 0.00 0.00 51.96 51.15 1pg8 s ALA 85 Cb -0.10 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.25 1pg8 s ALA 85 CO -0.03 0.36 0.15 -0.51 0.00 0.00 0.00 175.76 175.74 1pg8 s LEU 86 N -0.18 1.69 0.42 0.00 1.02 -0.13 -4.41 118.68 117.10 1pg8 s LEU 86 Ca 0.06 -1.54 0.28 0.00 0.02 0.00 0.00 54.13 52.95 1pg8 s LEU 86 Cb -0.12 0.16 0.91 0.00 0.02 0.00 0.00 46.19 47.15 1pg8 s LEU 86 CO 0.02 -0.87 1.80 0.00 0.02 0.00 0.00 176.35 177.31 1pg8 h ALA 87 N 2.21 1.00 -2.49 4.21 0.00 -1.41 -0.11 119.26 122.67 1pg8 h ALA 87 Ca -0.34 0.00 0.09 0.00 0.00 0.00 0.00 54.91 54.66 1pg8 h ALA 87 Cb 1.25 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.91 1pg8 h ALA 87 CO 0.53 0.00 0.42 -1.54 0.00 0.00 0.00 179.25 178.66 1pg8 s SER 88 N -5.46 -0.37 0.30 0.00 1.04 -1.26 -3.32 113.70 104.63 1pg8 s SER 88 Ca 0.05 -0.10 0.06 0.00 0.48 0.00 0.00 55.95 56.44 1pg8 s SER 88 Cb 0.08 0.47 0.80 0.00 0.10 0.00 0.00 66.02 67.47 1pg8 s SER 88 CO 0.57 -0.78 1.69 1.23 0.98 0.00 0.00 173.24 176.92 1pg8 h GLY 89 N 2.00 1.65 1.65 7.32 0.00 -1.68 -0.88 103.07 113.14 1pg8 h GLY 89 Ca -0.25 -0.19 -0.12 0.00 0.00 0.00 0.00 47.33 46.78 1pg8 h GLY 89 CO 0.31 -0.30 -0.40 -0.33 0.00 0.00 0.00 176.54 175.82 1pg8 h MET 90 N 0.40 0.39 -0.82 4.80 2.86 -1.91 -1.10 114.93 119.55 1pg8 h MET 90 Ca 0.59 -0.19 0.08 0.00 -2.06 0.00 0.00 59.70 58.12 1pg8 h MET 90 Cb 1.17 -0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.76 1pg8 h MET 90 CO -0.54 0.73 0.48 0.78 1.06 0.00 0.00 176.91 179.42 1pg8 h GLY 91 N 1.15 1.25 1.01 8.32 0.00 -1.56 -0.77 103.07 112.46 1pg8 h GLY 91 Ca 0.03 -0.34 -0.17 0.00 0.00 0.00 0.00 47.33 46.85 1pg8 h GLY 91 CO 0.07 0.19 -0.57 0.00 0.00 0.00 0.00 176.54 176.23 1pg8 h ALA 92 N 1.42 0.29 0.45 3.60 0.00 -0.59 -1.67 119.26 122.75 1pg8 h ALA 92 Ca 0.37 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1pg8 h ALA 92 Cb 0.26 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1pg8 h ALA 92 CO -0.21 0.51 -0.22 0.82 0.00 0.00 0.00 179.25 180.16 1pg8 h ILE 93 N 0.35 0.49 -0.71 0.00 2.04 -1.03 -1.73 117.51 116.92 1pg8 h ILE 93 Ca -0.03 -0.40 -0.03 0.00 1.00 0.00 0.00 64.86 65.41 1pg8 h ILE 93 Cb 1.20 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 1pg8 h ILE 93 CO 0.12 0.06 0.33 0.71 0.00 0.00 0.00 178.15 179.37 1pg8 h THR 94 N -0.86 1.24 -0.35 -0.27 1.35 -1.24 -0.58 112.91 112.20 1pg8 h THR 94 Ca -0.06 -0.69 -0.06 0.00 -0.55 0.00 0.00 66.41 65.05 1pg8 h THR 94 Cb 0.57 0.37 -0.02 0.00 -1.73 0.00 0.00 68.15 67.34 1pg8 h THR 94 CO 0.10 0.28 -0.05 0.28 -0.25 0.00 0.00 175.52 175.88 1pg8 h SER 95 N 1.00 0.54 0.52 5.36 0.02 -1.26 -1.10 113.55 118.63 1pg8 h SER 95 Ca 0.24 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 61.05 1pg8 h SER 95 Cb 0.14 -0.14 0.01 0.00 0.14 0.00 0.00 62.40 62.54 1pg8 h SER 95 CO -0.03 0.65 -0.25 0.74 -1.14 0.00 0.00 176.83 176.80 1pg8 h THR 96 N 0.53 0.38 -0.10 -2.27 2.02 -0.91 -3.11 112.91 109.46 1pg8 h THR 96 Ca 0.11 -0.36 -0.11 0.00 0.77 0.00 0.00 66.41 66.82 1pg8 h THR 96 Cb 0.42 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1pg8 h THR 96 CO 0.02 0.05 -0.43 -0.07 0.37 0.00 0.00 175.52 175.46 1pg8 h LEU 97 N -0.95 0.23 -1.22 2.58 3.38 -0.89 -2.23 115.31 116.22 1pg8 h LEU 97 Ca -0.07 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.73 1pg8 h LEU 97 Cb 0.62 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1pg8 h LEU 97 CO 0.12 0.63 -0.34 -0.50 0.09 0.00 0.00 178.44 178.44 1pg8 h TRP 98 N 0.18 0.00 -0.09 1.13 -0.00 -1.33 -1.61 115.95 114.22 1pg8 h TRP 98 Ca 0.01 0.00 -0.12 0.00 -0.00 0.00 0.00 58.89 58.79 1pg8 h TRP 98 Cb 0.83 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.00 1pg8 h TRP 98 CO 0.01 0.34 -0.40 1.15 -0.00 0.00 0.00 178.44 179.54 1pg8 h THR 99 N 0.00 1.39 -0.00 1.49 2.02 -1.33 -3.37 112.91 113.10 1pg8 h THR 99 Ca -0.00 -1.75 0.00 0.00 0.77 0.00 0.00 66.41 65.42 1pg8 h THR 99 Cb 0.72 2.23 0.00 0.00 -1.74 0.00 0.00 68.15 69.36 1pg8 h THR 99 CO 0.04 0.52 -0.44 0.18 0.37 0.00 0.00 175.52 176.19 1pg8 n LEU 100 N -4.33 0.85 -4.38 2.58 4.77 -1.06 -4.93 117.00 110.51 1pg8 n LEU 100 Ca -0.08 -0.19 -0.29 0.00 -0.03 0.00 0.00 56.01 55.41 1pg8 n LEU 100 Cb 0.54 -0.16 -0.14 0.00 -2.33 0.00 0.00 43.42 41.34 1pg8 n LEU 100 CO 0.44 0.18 -0.57 -0.76 -1.33 0.00 0.00 177.39 175.35 1pg8 s LEU 101 N -2.77 2.27 0.14 2.23 1.43 -0.62 -4.94 118.68 116.43 1pg8 s LEU 101 Ca 0.17 -0.70 -0.05 0.00 -1.03 0.00 0.00 54.13 52.51 1pg8 s LEU 101 Cb 0.18 -1.24 -0.02 0.00 0.03 0.00 0.00 46.19 45.14 1pg8 s LEU 101 CO 0.63 0.20 0.17 -0.13 0.23 0.00 0.00 176.35 177.45 1pg8 s ARG 102 N -1.81 1.02 0.17 1.70 1.81 -1.26 -4.83 118.95 115.75 1pg8 s ARG 102 Ca 0.13 -1.27 -0.33 0.00 -1.72 0.00 0.00 55.73 52.54 1pg8 s ARG 102 Cb -0.10 0.31 -0.15 0.00 -0.45 0.00 0.00 34.95 34.56 1pg8 s ARG 102 CO 0.05 -0.33 1.30 -2.30 -0.68 0.00 0.00 175.30 173.34 1pg8 n PRO 103 N -0.14 1.50 0.00 3.54 -0.02 -1.26 -1.73 135.00 136.89 1pg8 n PRO 103 Ca -0.07 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1pg8 n PRO 103 Cb 0.63 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 1pg8 n PRO 103 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pg8 n GLY 104 N 2.29 2.83 3.62 -1.23 0.00 -0.05 -4.94 105.19 107.69 1pg8 n GLY 104 Ca 0.15 -0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 1pg8 n GLY 104 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1pg8 n ASP 105 N 0.38 0.69 -4.48 1.61 10.43 -0.70 -4.71 116.55 119.77 1pg8 n ASP 105 Ca 0.00 0.77 -0.33 0.00 2.57 0.00 0.00 54.79 57.80 1pg8 n ASP 105 Cb 0.00 -1.39 -0.13 0.00 1.84 0.00 0.00 41.12 41.44 1pg8 n ASP 105 CO 0.00 0.00 0.00 -0.70 -1.07 0.00 0.00 177.20 175.43 1pg8 s GLU 106 N -2.90 2.70 -0.13 -1.24 2.12 0.19 -1.35 118.70 118.09 1pg8 s GLU 106 Ca 0.76 -0.66 0.01 0.00 0.36 0.00 0.00 54.97 55.44 1pg8 s GLU 106 Cb -0.40 -2.47 -0.01 0.00 0.26 0.00 0.00 34.13 31.52 1pg8 s GLU 106 CO 0.47 0.57 -0.16 0.54 -0.54 0.00 0.00 175.26 176.13 1pg8 s VAL 107 N -0.57 2.72 -0.09 3.70 0.11 -0.76 -0.88 120.40 124.62 1pg8 s VAL 107 Ca 0.08 -0.78 -0.13 0.00 -2.93 0.00 0.00 61.98 58.22 1pg8 s VAL 107 Cb -0.11 -2.12 -0.05 0.00 -1.53 0.00 0.00 36.38 32.57 1pg8 s VAL 107 CO 0.01 0.53 0.33 -0.76 -3.33 0.00 0.00 175.10 171.88 1pg8 s LEU 108 N 0.44 4.35 -0.03 2.54 1.43 -0.26 -2.24 118.68 124.91 1pg8 s LEU 108 Ca -0.12 0.69 0.05 0.00 -1.03 0.00 0.00 54.13 53.73 1pg8 s LEU 108 Cb -0.16 -2.43 -0.01 0.00 0.03 0.00 0.00 46.19 43.61 1pg8 s LEU 108 CO 0.05 0.22 -0.19 -0.76 0.23 0.00 0.00 176.35 175.90 1pg8 s LEU 109 N -0.30 1.99 0.70 1.79 1.43 0.04 -0.34 118.68 123.99 1pg8 s LEU 109 Ca 0.20 -0.36 -0.16 0.00 -1.03 0.00 0.00 54.13 52.77 1pg8 s LEU 109 Cb -0.14 -1.02 -0.04 0.00 0.03 0.00 0.00 46.19 45.02 1pg8 s LEU 109 CO 0.08 0.20 0.63 0.61 0.23 0.00 0.00 176.35 178.10 1pg8 n GLY 110 N 2.86 -1.28 0.34 -3.19 0.00 -0.72 0.02 105.19 103.22 1pg8 n GLY 110 Ca -0.16 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1pg8 n GLY 110 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1pg8 h ASN 111 N -0.26 0.82 -4.12 1.61 2.35 -1.91 -3.41 115.58 110.66 1pg8 h ASN 111 Ca -0.46 -0.04 -0.63 0.00 -0.55 0.00 0.00 56.30 54.61 1pg8 h ASN 111 Cb 1.35 -0.21 -0.23 0.00 0.05 0.00 0.00 38.32 39.28 1pg8 h ASN 111 CO 0.44 0.63 -0.85 0.42 -1.65 0.00 0.00 177.43 176.42 1pg8 s THR 112 N -5.71 1.97 0.04 2.81 -4.23 -1.26 -4.95 115.64 104.31 1pg8 s THR 112 Ca -0.11 -1.54 -0.00 0.00 -1.18 0.00 0.00 61.69 58.86 1pg8 s THR 112 Cb 0.17 -1.74 -0.03 0.00 1.34 0.00 0.00 72.50 72.24 1pg8 s THR 112 CO 0.78 0.11 -0.03 -0.76 -0.54 0.00 0.00 174.62 174.18 1pg8 s LEU 113 N -1.73 2.36 -0.00 4.79 1.43 -1.26 -4.77 118.68 119.50 1pg8 s LEU 113 Ca 0.10 -0.75 -0.37 0.00 -1.03 0.00 0.00 54.13 52.08 1pg8 s LEU 113 Cb -0.10 0.12 -0.16 0.00 0.03 0.00 0.00 46.19 46.08 1pg8 s LEU 113 CO 0.04 -0.43 1.47 0.00 0.23 0.00 0.00 176.35 177.66 1pg8 n TYR 114 N 0.86 1.72 -0.34 0.29 9.36 -1.26 -4.73 117.16 123.06 1pg8 n TYR 114 Ca -0.19 0.57 0.27 0.00 3.32 0.00 0.00 57.90 61.86 1pg8 n TYR 114 Cb 0.58 -2.39 0.52 0.00 -0.63 0.00 0.00 39.34 37.42 1pg8 n TYR 114 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 1pg8 h GLY 115 N 5.44 2.02 1.85 2.98 0.00 -1.99 0.21 103.07 113.59 1pg8 h GLY 115 Ca -0.47 -0.21 -0.17 0.00 0.00 0.00 0.00 47.33 46.48 1pg8 h GLY 115 CO 0.83 -0.54 -0.78 0.00 0.00 0.00 0.00 176.54 176.05 1pg8 h THR 117 N 0.08 1.30 -0.79 0.00 2.02 -0.97 -1.45 112.91 113.11 1pg8 h THR 117 Ca -0.02 -1.13 0.06 0.00 0.77 0.00 0.00 66.41 66.09 1pg8 h THR 117 Cb 1.37 1.64 -0.05 0.00 -1.74 0.00 0.00 68.15 69.36 1pg8 h THR 117 CO 0.11 0.34 0.52 0.15 0.37 0.00 0.00 175.52 177.01 1pg8 h PHE 118 N 0.10 0.86 -0.02 3.16 3.57 -1.30 -0.91 116.94 122.41 1pg8 h PHE 118 Ca 0.04 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 1pg8 h PHE 118 Cb 0.57 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.02 1pg8 h PHE 118 CO 0.06 0.45 -0.02 0.00 -2.23 0.00 0.00 178.31 176.58 1pg8 h ALA 119 N 1.57 0.03 -0.63 2.41 0.00 -1.04 0.32 119.26 121.93 1pg8 h ALA 119 Ca 0.34 -0.26 0.13 0.00 0.00 0.00 0.00 54.91 55.12 1pg8 h ALA 119 Cb 0.24 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 17.91 1pg8 h ALA 119 CO -0.12 -0.20 -0.09 0.35 0.00 0.00 0.00 179.25 179.19 1pg8 h PHE 120 N -0.43 -0.21 -0.10 0.00 3.57 -1.02 0.24 116.94 119.00 1pg8 h PHE 120 Ca 0.00 0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.51 1pg8 h PHE 120 Cb 0.52 0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.45 1pg8 h PHE 120 CO 0.10 -0.23 -0.12 -0.07 -2.23 0.00 0.00 178.31 175.75 1pg8 h LEU 121 N 0.05 0.27 0.20 0.59 3.38 -1.02 0.22 115.31 119.00 1pg8 h LEU 121 Ca 0.32 -0.51 -0.34 0.00 0.09 0.00 0.00 57.88 57.43 1pg8 h LEU 121 Cb 0.50 -0.08 0.02 0.00 0.09 0.00 0.00 40.66 41.19 1pg8 h LEU 121 CO -0.60 0.73 -1.63 0.45 0.09 0.00 0.00 178.44 177.48 1pg8 h HIS 122 N -0.18 0.78 -0.17 1.13 3.86 -0.79 -0.25 115.15 119.54 1pg8 h HIS 122 Ca 0.01 -0.57 0.00 0.00 -1.16 0.00 0.00 60.37 58.65 1pg8 h HIS 122 Cb 0.67 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.10 1pg8 h HIS 122 CO 0.10 1.60 0.00 0.72 0.86 0.00 0.00 177.93 181.21 1pg8 n HIS 123 N -3.62 0.21 0.00 2.45 8.25 0.84 -4.10 115.22 119.25 1pg8 n HIS 123 Ca -0.21 -0.19 0.00 0.00 -0.26 0.00 0.00 57.72 57.06 1pg8 n HIS 123 Cb 1.08 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 32.18 1pg8 n HIS 123 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1pg8 n GLY 124 N 0.74 1.12 0.36 -1.41 0.00 -0.63 -4.77 105.19 100.59 1pg8 n GLY 124 Ca 0.10 -0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.21 1pg8 n GLY 124 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1pg8 h ILE 125 N 0.00 0.88 0.00 -0.61 2.10 -1.16 -0.14 117.51 118.58 1pg8 h ILE 125 Ca 0.00 -0.15 -0.03 0.00 1.08 0.00 0.00 64.86 65.76 1pg8 h ILE 125 Cb 0.00 0.42 -0.00 0.00 -1.09 0.00 0.00 36.82 36.14 1pg8 h ILE 125 CO 0.00 0.08 -0.14 1.23 -1.08 0.00 0.00 178.15 178.23 1pg8 h GLY 126 N 0.42 0.00 0.99 8.18 0.00 -1.18 -1.91 103.07 109.57 1pg8 h GLY 126 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.63 1pg8 h GLY 126 CO -0.09 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.63 1pg8 n GLU 127 N -4.25 0.97 -1.49 4.80 1.02 -0.07 -3.56 120.64 118.06 1pg8 n GLU 127 Ca -0.02 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.81 1pg8 n GLU 127 Cb 0.22 -1.49 0.07 0.00 -0.02 0.00 0.00 31.44 30.22 1pg8 n GLU 127 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1pg8 n PHE 128 N -0.99 3.00 -0.96 -0.32 3.01 -0.72 -4.94 117.46 115.54 1pg8 n PHE 128 Ca 0.23 -2.70 0.00 0.00 1.01 0.00 0.00 57.45 55.99 1pg8 n PHE 128 Cb 0.11 -1.08 0.00 0.00 -0.01 0.00 0.00 39.48 38.49 1pg8 n PHE 128 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1pg8 n GLY 129 N -0.88 0.76 3.70 1.37 0.00 -1.23 -4.38 105.19 104.51 1pg8 n GLY 129 Ca 0.56 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.19 1pg8 n GLY 129 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pg8 s VAL 130 N -3.14 5.06 0.30 1.61 1.01 -1.24 -0.87 120.40 123.13 1pg8 s VAL 130 Ca 0.00 1.26 -0.22 0.00 0.00 0.00 0.00 61.98 63.02 1pg8 s VAL 130 Cb 0.00 -3.96 -0.09 0.00 0.00 0.00 0.00 36.38 32.32 1pg8 s VAL 130 CO 0.00 0.21 0.85 -0.54 0.00 0.00 0.00 175.10 175.62 1pg8 s LYS 131 N 1.21 4.36 -0.06 2.72 1.02 -0.46 -4.43 119.74 124.11 1pg8 s LYS 131 Ca 0.32 1.08 0.04 0.00 0.02 0.00 0.00 55.97 57.42 1pg8 s LYS 131 Cb -0.16 -2.71 0.00 0.00 -0.52 0.00 0.00 37.83 34.44 1pg8 s LYS 131 CO 0.13 0.27 -0.17 -0.51 -0.92 0.00 0.00 175.35 174.15 1pg8 s LEU 132 N -2.27 1.88 -0.04 3.17 1.43 -1.26 -1.83 118.68 119.77 1pg8 s LEU 132 Ca 0.50 -0.37 0.01 0.00 -1.03 0.00 0.00 54.13 53.24 1pg8 s LEU 132 Cb -0.16 -1.01 0.01 0.00 0.03 0.00 0.00 46.19 45.06 1pg8 s LEU 132 CO 0.21 0.13 -0.06 -0.13 0.23 0.00 0.00 176.35 176.73 1pg8 s ARG 133 N 0.21 0.84 0.06 1.70 1.81 -0.95 -5.00 118.95 117.62 1pg8 s ARG 133 Ca -0.08 -0.17 -0.22 0.00 -1.72 0.00 0.00 55.73 53.54 1pg8 s ARG 133 Cb -0.13 -0.82 -0.06 0.00 -0.45 0.00 0.00 34.95 33.49 1pg8 s ARG 133 CO 0.04 -0.01 0.67 -1.01 -0.68 0.00 0.00 175.30 174.30 1pg8 s HIS 134 N 0.62 3.77 0.01 -0.53 3.76 -1.26 -0.78 115.29 120.87 1pg8 s HIS 134 Ca -0.09 1.37 -0.10 0.00 -0.15 0.00 0.00 55.06 56.10 1pg8 s HIS 134 Cb -0.12 -2.67 0.01 0.00 1.11 0.00 0.00 32.58 30.91 1pg8 s HIS 134 CO 0.00 0.41 0.19 0.08 -0.85 0.00 0.00 174.74 174.58 1pg8 s VAL 135 N -0.54 0.08 -0.32 -0.90 1.01 0.10 -4.88 120.40 114.96 1pg8 s VAL 135 Ca 0.33 -0.70 -0.29 0.00 0.00 0.00 0.00 61.98 61.33 1pg8 s VAL 135 Cb -0.20 -0.59 -0.00 0.00 0.00 0.00 0.00 36.38 35.58 1pg8 s VAL 135 CO 0.21 -0.38 1.47 -0.62 0.00 0.00 0.00 175.10 175.77 1pg8 s ASP 136 N -1.55 6.40 0.00 3.32 -1.08 -1.26 -3.11 116.67 119.39 1pg8 s ASP 136 Ca -0.12 1.19 0.12 0.00 -0.52 0.00 0.00 52.55 53.22 1pg8 s ASP 136 Cb -0.05 -2.54 0.55 0.00 -1.46 0.00 0.00 42.92 39.42 1pg8 s ASP 136 CO 0.01 -1.31 1.38 0.23 0.52 0.00 0.00 175.17 176.00 1pg8 n MET 137 N 7.78 1.35 -0.01 4.34 2.81 -1.26 -2.62 117.12 129.50 1pg8 n MET 137 Ca 0.17 -0.54 0.03 0.00 -1.81 0.00 0.00 57.70 55.56 1pg8 n MET 137 Cb 0.47 -1.23 -0.13 0.00 -0.71 0.00 0.00 33.22 31.61 1pg8 n MET 137 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1pg8 n ALA 138 N -0.16 2.24 -2.94 3.04 0.00 -1.26 -2.11 120.51 119.32 1pg8 n ALA 138 Ca 0.10 -0.72 -0.44 0.00 0.00 0.00 0.00 53.44 52.39 1pg8 n ALA 138 Cb 0.16 -0.67 -0.04 0.00 0.00 0.00 0.00 19.45 18.90 1pg8 n ALA 138 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1pg8 s ASP 139 N -5.13 6.28 0.17 0.00 3.68 -1.08 -4.76 116.67 115.84 1pg8 s ASP 139 Ca -0.07 -1.34 -0.01 0.00 2.13 0.00 0.00 52.55 53.27 1pg8 s ASP 139 Cb 0.10 -2.38 0.05 0.00 -1.45 0.00 0.00 42.92 39.23 1pg8 s ASP 139 CO 0.86 -1.28 1.42 -0.07 0.13 0.00 0.00 175.17 176.23 1pg8 h LEU 140 N 10.79 0.43 -0.10 -1.34 3.38 -1.87 -2.87 115.31 123.73 1pg8 h LEU 140 Ca -0.19 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.52 1pg8 h LEU 140 Cb 1.06 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.64 1pg8 h LEU 140 CO 1.14 1.05 -0.19 1.56 0.09 0.00 0.00 178.44 182.08 1pg8 h GLN 141 N 0.23 -0.25 -0.65 1.13 4.20 -1.96 -1.59 115.11 116.22 1pg8 h GLN 141 Ca -0.04 0.02 0.07 0.00 0.06 0.00 0.00 58.65 58.76 1pg8 h GLN 141 Cb 1.35 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 29.15 1pg8 h GLN 141 CO 0.13 -0.17 0.43 0.00 -0.67 0.00 0.00 178.83 178.55 1pg8 h ALA 142 N 0.72 1.79 -0.15 3.87 0.00 -1.90 -1.40 119.26 122.19 1pg8 h ALA 142 Ca 0.09 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.79 1pg8 h ALA 142 Cb 0.39 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.03 1pg8 h ALA 142 CO -0.25 0.10 -0.66 1.25 0.00 0.00 0.00 179.25 179.69 1pg8 h LEU 143 N 0.64 0.83 -0.79 0.00 5.85 -1.26 -1.18 115.31 119.40 1pg8 h LEU 143 Ca 0.28 -0.63 -0.06 0.00 0.84 0.00 0.00 57.88 58.32 1pg8 h LEU 143 Cb 0.29 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 1pg8 h LEU 143 CO -0.09 1.32 0.22 -0.08 -0.34 0.00 0.00 178.44 179.47 1pg8 h GLU 144 N 0.40 1.12 0.00 1.25 4.57 -0.89 -2.18 114.58 118.85 1pg8 h GLU 144 Ca -0.04 -0.24 -0.07 0.00 -1.18 0.00 0.00 59.36 57.83 1pg8 h GLU 144 Cb 1.30 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.71 1pg8 h GLU 144 CO 0.14 0.96 -0.33 0.00 -1.18 0.00 0.00 179.01 178.60 1pg8 h ALA 145 N 1.15 1.12 0.00 2.92 0.00 -1.18 -2.92 119.26 120.35 1pg8 h ALA 145 Ca 0.23 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1pg8 h ALA 145 Cb 0.31 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1pg8 h ALA 145 CO -0.01 0.42 -0.25 0.00 0.00 0.00 0.00 179.25 179.41 1pg8 h ALA 146 N 1.67 0.86 -2.86 0.00 0.00 -0.61 -3.46 119.26 114.86 1pg8 h ALA 146 Ca -0.00 -0.22 -0.53 0.00 0.00 0.00 0.00 54.91 54.15 1pg8 h ALA 146 Cb 0.76 -0.04 0.12 0.00 0.00 0.00 0.00 17.79 18.63 1pg8 h ALA 146 CO 0.04 0.31 0.48 -1.64 0.00 0.00 0.00 179.25 178.44 1pg8 s MET 147 N -3.19 2.92 0.18 0.00 1.00 -0.94 -5.03 119.30 114.24 1pg8 s MET 147 Ca 0.05 1.85 -0.08 0.00 0.00 0.00 0.00 55.69 57.50 1pg8 s MET 147 Cb 0.07 -1.92 -0.01 0.00 0.00 0.00 0.00 34.83 32.97 1pg8 s MET 147 CO 0.69 -1.25 0.29 0.95 0.00 0.00 0.00 175.02 175.69 1pg8 s THR 148 N -1.58 0.05 0.57 2.05 -4.23 -1.26 -5.03 115.64 106.22 1pg8 s THR 148 Ca 0.78 -1.48 0.26 0.00 -1.18 0.00 0.00 61.69 60.07 1pg8 s THR 148 Cb -0.31 -1.97 0.34 0.00 1.34 0.00 0.00 72.50 71.90 1pg8 s THR 148 CO 0.34 -0.23 2.15 -0.65 -0.54 0.00 0.00 174.62 175.69 1pg8 h PRO 149 N 2.52 0.00 0.00 3.99 0.11 -1.98 -1.42 132.00 135.23 1pg8 h PRO 149 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1pg8 h PRO 149 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1pg8 h PRO 149 CO 0.47 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.26 1pg8 h ALA 150 N 1.88 1.00 -1.81 -0.75 0.00 -1.95 -3.44 119.26 114.20 1pg8 h ALA 150 Ca 0.06 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.40 1pg8 h ALA 150 Cb 0.29 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 1pg8 h ALA 150 CO -0.00 0.00 1.23 0.99 0.00 0.00 0.00 179.25 181.46 1pg8 s THR 151 N -3.42 3.58 -0.06 0.00 2.01 -0.54 -0.63 115.64 116.59 1pg8 s THR 151 Ca 0.04 0.57 0.10 0.00 0.31 0.00 0.00 61.69 62.72 1pg8 s THR 151 Cb 0.09 -3.84 -0.15 0.00 0.01 0.00 0.00 72.50 68.61 1pg8 s THR 151 CO 0.52 -0.57 0.25 0.54 -0.69 0.00 0.00 174.62 174.67 1pg8 n ARG 152 N 8.41 0.65 -3.82 4.92 5.12 -0.06 -4.64 116.66 127.24 1pg8 n ARG 152 Ca 0.21 -0.08 -0.12 0.00 -1.93 0.00 0.00 57.85 55.92 1pg8 n ARG 152 Cb 0.48 -1.22 -0.13 0.00 -1.16 0.00 0.00 32.46 30.43 1pg8 n ARG 152 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1pg8 s VAL 153 N -2.64 -0.00 -0.23 1.55 1.01 -1.19 -1.87 120.40 117.03 1pg8 s VAL 153 Ca -0.03 0.01 0.02 0.00 0.00 0.00 0.00 61.98 61.99 1pg8 s VAL 153 Cb 0.07 -0.19 0.05 0.00 0.00 0.00 0.00 36.38 36.31 1pg8 s VAL 153 CO 0.43 0.01 -0.13 -0.63 0.00 0.00 0.00 175.10 174.77 1pg8 s ILE 154 N 0.15 2.08 -0.08 2.22 1.01 -0.45 -1.10 121.20 125.02 1pg8 s ILE 154 Ca -0.01 -1.39 0.05 0.00 0.00 0.00 0.00 60.65 59.30 1pg8 s ILE 154 Cb -0.02 -2.11 -0.00 0.00 0.01 0.00 0.00 42.46 40.34 1pg8 s ILE 154 CO -0.00 0.14 -0.24 -0.47 0.00 0.00 0.00 174.94 174.36 1pg8 s TYR 155 N 1.18 2.46 0.24 3.97 5.04 0.54 -1.20 117.35 129.59 1pg8 s TYR 155 Ca -0.05 -0.91 -0.22 0.00 -2.44 0.00 0.00 57.07 53.46 1pg8 s TYR 155 Cb -0.18 -1.64 0.04 0.00 0.35 0.00 0.00 41.96 40.53 1pg8 s TYR 155 CO -0.07 -0.34 0.67 -0.59 -1.34 0.00 0.00 175.55 173.88 1pg8 s PHE 156 N 0.17 -0.31 0.13 4.97 -0.71 -1.09 -1.76 117.98 119.38 1pg8 s PHE 156 Ca -0.13 -0.06 0.05 0.00 -1.04 0.00 0.00 56.93 55.75 1pg8 s PHE 156 Cb -0.16 0.65 -0.04 0.00 -1.21 0.00 0.00 43.02 42.26 1pg8 s PHE 156 CO 0.07 -1.10 0.08 -1.21 -1.34 0.00 0.00 175.22 171.72 1pg8 s GLU 157 N -3.86 2.77 -0.30 1.99 2.02 -1.26 -1.29 118.70 118.76 1pg8 s GLU 157 Ca 0.07 -0.85 -0.07 0.00 0.02 0.00 0.00 54.97 54.15 1pg8 s GLU 157 Cb -0.04 -2.61 0.16 0.00 0.10 0.00 0.00 34.13 31.74 1pg8 s GLU 157 CO -0.00 0.51 0.64 0.45 0.02 0.00 0.00 175.26 176.88 1pg8 s SER 158 N -2.77 -1.22 0.60 -0.19 0.15 -1.22 -3.91 113.70 105.13 1pg8 s SER 158 Ca 0.29 1.27 -0.18 0.00 0.70 0.00 0.00 55.95 58.03 1pg8 s SER 158 Cb -0.11 2.23 -0.03 0.00 -1.71 0.00 0.00 66.02 66.40 1pg8 s SER 158 CO 0.22 -0.23 1.15 -2.84 1.20 0.00 0.00 173.24 172.73 1pg8 s PRO 159 N 2.87 3.02 -0.12 5.44 0.02 -1.26 -4.82 135.00 140.16 1pg8 s PRO 159 Ca 0.05 1.60 -0.14 0.00 0.02 0.00 0.00 61.00 62.53 1pg8 s PRO 159 Cb -0.13 -1.96 -0.05 0.00 0.02 0.00 0.00 34.50 32.38 1pg8 s PRO 159 CO -0.20 -1.11 0.33 0.00 -0.33 0.00 0.00 177.00 175.69 1pg8 s ALA 160 N -1.92 3.61 0.00 -1.55 0.00 0.65 -4.91 121.76 117.65 1pg8 s ALA 160 Ca 0.72 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.30 1pg8 s ALA 160 Cb -0.25 -2.40 0.00 0.00 0.00 0.00 0.00 23.12 20.47 1pg8 s ALA 160 CO 0.34 0.19 0.00 -1.71 0.00 0.00 0.00 175.76 174.57 1pg8 n ASN 161 N 3.15 0.00 0.00 0.00 5.15 -1.26 -2.10 115.26 120.20 1pg8 n ASN 161 Ca -0.12 -0.12 0.00 0.00 -0.60 0.00 0.00 54.58 53.74 1pg8 n ASN 161 Cb 0.52 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.77 1pg8 n ASN 161 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 1pg8 n PRO 162 N 0.93 0.00 -0.32 1.20 -0.01 -1.26 -4.82 135.00 130.71 1pg8 n PRO 162 Ca 0.00 0.00 0.07 0.00 -0.01 0.00 0.00 63.50 63.56 1pg8 n PRO 162 Cb 0.00 0.00 0.18 0.00 -0.01 0.00 0.00 33.50 33.67 1pg8 n PRO 162 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 175.50 175.58 1pg8 n ASN 163 N -0.00 2.59 -1.63 2.55 4.13 -1.23 -4.92 115.26 116.75 1pg8 n ASN 163 Ca 0.00 -3.29 -0.20 0.00 1.68 0.00 0.00 54.58 52.77 1pg8 n ASN 163 Cb 0.00 -0.50 -0.08 0.00 -1.54 0.00 0.00 39.78 37.66 1pg8 n ASN 163 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 1pg8 n MET 164 N -1.15 -1.44 -1.62 3.52 2.81 -0.89 -4.88 117.12 113.47 1pg8 n MET 164 Ca 0.20 1.20 -0.53 0.00 -1.81 0.00 0.00 57.70 56.76 1pg8 n MET 164 Cb 0.75 -5.59 -0.06 0.00 -0.71 0.00 0.00 33.22 27.60 1pg8 n MET 164 CO 0.00 0.00 0.00 1.58 1.51 0.00 0.00 175.97 179.06 1pg8 n HIS 165 N -2.53 1.63 -3.70 2.03 -0.00 -1.25 -4.32 115.22 107.09 1pg8 n HIS 165 Ca -0.21 0.62 -0.26 0.00 -0.00 0.00 0.00 57.72 57.87 1pg8 n HIS 165 Cb 0.67 -2.36 -0.03 0.00 -0.00 0.00 0.00 29.99 28.28 1pg8 n HIS 165 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 1pg8 s MET 166 N 1.19 3.50 0.11 1.57 -1.94 -1.26 -0.25 119.30 122.22 1pg8 s MET 166 Ca 0.88 -0.41 0.07 0.00 -1.71 0.00 0.00 55.69 54.52 1pg8 s MET 166 Cb -0.98 -2.83 -0.04 0.00 2.01 0.00 0.00 34.83 32.99 1pg8 s MET 166 CO 0.51 0.38 -0.06 0.00 -0.01 0.00 0.00 175.02 175.83 1pg8 s ALA 167 N -1.94 3.07 -1.08 3.03 0.00 -1.26 -4.30 121.76 119.28 1pg8 s ALA 167 Ca 0.38 -1.23 -0.20 0.00 0.00 0.00 0.00 51.96 50.91 1pg8 s ALA 167 Cb -0.11 -0.98 0.09 0.00 0.00 0.00 0.00 23.12 22.13 1pg8 s ALA 167 CO 0.30 0.64 1.42 0.34 0.00 0.00 0.00 175.76 178.46 1pg8 s ASP 168 N -2.33 6.68 0.22 0.00 -1.08 -0.90 -4.88 116.67 114.38 1pg8 s ASP 168 Ca 0.23 -2.01 -0.09 0.00 -0.52 0.00 0.00 52.55 50.16 1pg8 s ASP 168 Cb -0.11 -2.50 0.18 0.00 -1.46 0.00 0.00 42.92 39.03 1pg8 s ASP 168 CO 0.15 -1.22 1.86 0.40 0.52 0.00 0.00 175.17 176.88 1pg8 h ILE 169 N 6.02 1.24 -0.22 4.11 2.04 -1.93 -0.59 117.51 128.17 1pg8 h ILE 169 Ca 0.25 -0.54 -0.19 0.00 1.00 0.00 0.00 64.86 65.39 1pg8 h ILE 169 Cb 0.97 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1pg8 h ILE 169 CO 1.33 0.25 -0.61 0.00 0.00 0.00 0.00 178.15 179.12 1pg8 h ALA 170 N 1.26 0.50 -0.13 1.87 0.00 -1.90 -2.33 119.26 118.53 1pg8 h ALA 170 Ca 0.30 -0.54 0.04 0.00 0.00 0.00 0.00 54.91 54.70 1pg8 h ALA 170 Cb -0.02 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1pg8 h ALA 170 CO -0.05 0.69 -0.12 0.78 0.00 0.00 0.00 179.25 180.55 1pg8 h GLY 171 N 0.79 -0.02 0.67 0.00 0.00 -1.78 -2.58 103.07 100.14 1pg8 h GLY 171 Ca -0.00 0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.51 1pg8 h GLY 171 CO 0.13 -0.13 0.15 -2.08 0.00 0.00 0.00 176.54 174.61 1pg8 h VAL 172 N -0.13 0.89 -0.50 4.60 2.07 -1.09 -2.46 116.25 119.64 1pg8 h VAL 172 Ca 0.09 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.52 1pg8 h VAL 172 Cb 0.26 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1pg8 h VAL 172 CO -0.21 0.06 0.33 0.00 0.02 0.00 0.00 177.57 177.76 1pg8 h ALA 173 N 1.25 1.70 -0.27 1.67 0.00 -1.21 -0.21 119.26 122.19 1pg8 h ALA 173 Ca 0.18 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1pg8 h ALA 173 Cb 0.16 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1pg8 h ALA 173 CO -0.18 0.26 -0.13 -0.22 0.00 0.00 0.00 179.25 178.98 1pg8 h LYS 174 N 0.62 0.56 -0.20 0.00 3.64 -1.05 -0.51 116.57 119.63 1pg8 h LYS 174 Ca 0.19 -0.24 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1pg8 h LYS 174 Cb 0.00 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 1pg8 h LYS 174 CO -0.05 0.81 0.08 0.82 -2.27 0.00 0.00 179.45 178.84 1pg8 h ILE 175 N 0.29 1.16 -0.55 2.00 2.04 -1.18 -2.93 117.51 118.34 1pg8 h ILE 175 Ca 0.06 -0.47 0.04 0.00 1.00 0.00 0.00 64.86 65.50 1pg8 h ILE 175 Cb 0.64 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 37.78 1pg8 h ILE 175 CO 0.04 0.15 0.37 0.00 0.00 0.00 0.00 178.15 178.71 1pg8 h ALA 176 N 0.93 1.78 -0.04 1.87 0.00 -0.95 -1.50 119.26 121.35 1pg8 h ALA 176 Ca 0.07 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1pg8 h ALA 176 Cb 0.16 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1pg8 h ALA 176 CO -0.01 0.15 -0.29 0.00 0.00 0.00 0.00 179.25 179.10 1pg8 h ARG 177 N 0.58 0.07 0.00 0.00 3.08 -0.99 -1.17 114.38 115.95 1pg8 h ARG 177 Ca 0.23 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.23 1pg8 h ARG 177 Cb 0.17 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 1pg8 h ARG 177 CO -0.06 0.36 -0.12 0.87 -1.07 0.00 0.00 179.97 179.94 1pg8 h LYS 178 N 0.06 0.00 0.00 0.04 1.57 -1.08 -3.23 116.57 113.93 1pg8 h LYS 178 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1pg8 h LYS 178 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1pg8 h LYS 178 CO 0.04 0.12 -0.06 0.72 -0.57 0.00 0.00 179.45 179.70 1pg8 n HIS 179 N -3.37 0.00 -0.72 -1.35 8.25 -0.86 -5.00 115.22 112.17 1pg8 n HIS 179 Ca -0.01 -0.68 0.00 0.00 -0.26 0.00 0.00 57.72 56.77 1pg8 n HIS 179 Cb 0.31 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.32 1pg8 n HIS 179 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1pg8 n GLY 180 N -0.92 0.32 3.79 -1.41 0.00 -0.54 -4.98 105.19 101.44 1pg8 n GLY 180 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1pg8 n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pg8 s ALA 181 N -1.93 2.74 -0.24 4.61 0.00 -0.64 -4.98 121.76 121.32 1pg8 s ALA 181 Ca 0.00 0.57 -0.12 0.00 0.00 0.00 0.00 51.96 52.40 1pg8 s ALA 181 Cb 0.00 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 19.80 1pg8 s ALA 181 CO 0.00 -0.70 0.25 0.99 0.00 0.00 0.00 175.76 176.30 1pg8 s THR 182 N -2.15 5.29 -0.27 0.00 2.01 -0.78 -4.59 115.64 115.14 1pg8 s THR 182 Ca 0.67 0.35 -0.11 0.00 0.31 0.00 0.00 61.69 62.92 1pg8 s THR 182 Cb -0.18 -3.59 -0.05 0.00 0.01 0.00 0.00 72.50 68.69 1pg8 s THR 182 CO 0.30 0.28 0.18 -0.69 -0.69 0.00 0.00 174.62 173.99 1pg8 s VAL 183 N 1.42 5.27 -0.10 3.82 1.01 -1.26 -1.34 120.40 129.22 1pg8 s VAL 183 Ca 0.11 0.16 0.04 0.00 0.00 0.00 0.00 61.98 62.29 1pg8 s VAL 183 Cb -0.15 -3.50 -0.00 0.00 0.00 0.00 0.00 36.38 32.73 1pg8 s VAL 183 CO 0.07 0.27 -0.23 0.54 0.00 0.00 0.00 175.10 175.76 1pg8 s VAL 184 N 1.62 2.17 -0.12 2.92 0.11 -0.34 -2.02 120.40 124.74 1pg8 s VAL 184 Ca 0.07 -0.99 0.02 0.00 -2.93 0.00 0.00 61.98 58.15 1pg8 s VAL 184 Cb -0.16 -1.83 -0.00 0.00 -1.53 0.00 0.00 36.38 32.86 1pg8 s VAL 184 CO 0.09 0.56 -0.20 -0.69 -3.33 0.00 0.00 175.10 171.54 1pg8 s VAL 185 N 0.25 2.38 -0.48 2.04 1.01 -0.12 -2.69 120.40 122.80 1pg8 s VAL 185 Ca -0.16 -0.89 -0.27 0.00 0.00 0.00 0.00 61.98 60.67 1pg8 s VAL 185 Cb -0.17 -1.96 0.03 0.00 0.00 0.00 0.00 36.38 34.28 1pg8 s VAL 185 CO 0.08 0.54 1.02 -0.62 0.00 0.00 0.00 175.10 176.12 1pg8 s ASP 186 N 0.51 6.54 -0.31 3.32 -1.08 -0.41 -0.74 116.67 124.49 1pg8 s ASP 186 Ca -0.13 0.22 0.08 0.00 -0.52 0.00 0.00 52.55 52.20 1pg8 s ASP 186 Cb -0.17 -2.49 0.49 0.00 -1.46 0.00 0.00 42.92 39.29 1pg8 s ASP 186 CO 0.05 -1.15 1.44 -3.20 0.52 0.00 0.00 175.17 172.82 1pg8 n ASN 187 N 7.49 3.11 0.19 -0.34 4.05 -0.46 -3.45 115.26 125.84 1pg8 n ASN 187 Ca 0.08 -3.81 -0.15 0.00 0.45 0.00 0.00 54.58 51.16 1pg8 n ASN 187 Cb 0.49 -0.60 -0.08 0.00 1.23 0.00 0.00 39.78 40.81 1pg8 n ASN 187 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 177.26 174.95 1pg8 h THR 188 N 1.18 0.70 -0.96 -0.44 2.02 -1.91 -2.01 112.91 111.49 1pg8 h THR 188 Ca 0.25 -0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.50 1pg8 h THR 188 Cb 1.51 0.70 -0.07 0.00 -1.74 0.00 0.00 68.15 68.56 1pg8 h THR 188 CO 0.49 0.00 0.62 1.88 0.37 0.00 0.00 175.52 178.88 1pg8 h TYR 189 N -0.41 1.13 0.11 3.16 -1.99 -1.91 -3.11 116.97 113.96 1pg8 h TYR 189 Ca -0.04 0.03 -0.34 0.00 2.00 0.00 0.00 58.73 60.37 1pg8 h TYR 189 Cb 0.31 -0.37 -0.02 0.00 2.00 0.00 0.00 36.73 38.65 1pg8 h TYR 189 CO -0.06 0.58 -1.86 0.00 -0.00 0.00 0.00 178.16 176.82 1pg8 n THR 191 N -3.43 -0.67 0.21 0.00 -2.24 -0.76 -3.42 114.28 103.97 1pg8 n THR 191 Ca -0.27 0.69 0.11 0.00 -2.27 0.00 0.00 64.05 62.32 1pg8 n THR 191 Cb 1.05 -1.05 0.68 0.00 -2.10 0.00 0.00 70.33 68.91 1pg8 n THR 191 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1pg8 h PRO 192 N -1.05 0.00 -0.74 -0.78 0.13 -1.83 -2.11 132.00 125.62 1pg8 h PRO 192 Ca -0.15 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 65.13 1pg8 h PRO 192 Cb 1.02 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.11 1pg8 h PRO 192 CO 0.06 0.00 0.49 -0.92 -0.23 0.00 0.00 178.00 177.40 1pg8 h TYR 193 N 0.00 0.47 0.00 1.56 -0.00 -1.87 -3.17 116.97 113.96 1pg8 h TYR 193 Ca 0.05 0.01 -0.04 0.00 -0.00 0.00 0.00 58.73 58.75 1pg8 h TYR 193 Cb 0.21 -0.15 -0.01 0.00 -0.00 0.00 0.00 36.73 36.78 1pg8 h TYR 193 CO 0.00 0.18 -1.78 1.28 -0.00 0.00 0.00 178.16 177.85 1pg8 n LEU 194 N -4.47 0.00 -3.65 2.82 4.77 -0.84 -4.87 117.00 110.76 1pg8 n LEU 194 Ca 0.14 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.97 1pg8 n LEU 194 Cb 0.51 0.05 -0.08 0.00 -2.33 0.00 0.00 43.42 41.58 1pg8 n LEU 194 CO 0.33 0.05 0.30 -1.58 -1.33 0.00 0.00 177.39 175.16 1pg8 s GLN 195 N -3.01 0.77 -0.45 3.23 0.74 -0.94 -1.41 119.66 118.59 1pg8 s GLN 195 Ca -0.06 0.65 0.04 0.00 0.05 0.00 0.00 55.36 56.04 1pg8 s GLN 195 Cb 0.09 0.37 0.18 0.00 1.10 0.00 0.00 33.01 34.75 1pg8 s GLN 195 CO 0.66 -0.14 0.38 0.54 -0.55 0.00 0.00 175.29 176.18 1pg8 n ARG 196 N 2.29 0.47 0.20 1.67 1.74 -1.26 -3.83 116.66 117.94 1pg8 n ARG 196 Ca -0.15 -3.37 0.16 0.00 -0.77 0.00 0.00 57.85 53.72 1pg8 n ARG 196 Cb 0.56 -1.72 0.80 0.00 -1.02 0.00 0.00 32.46 31.08 1pg8 n ARG 196 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 1pg8 h PRO 197 N 5.44 0.00 -0.28 5.56 0.11 -1.94 -0.65 132.00 140.24 1pg8 h PRO 197 Ca 0.24 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.26 1pg8 h PRO 197 Cb 0.88 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 1pg8 h PRO 197 CO 0.43 0.00 -0.20 -0.07 -0.21 0.00 0.00 178.00 177.95 1pg8 h LEU 198 N 0.00 0.50 -1.76 2.35 3.38 -1.81 -2.04 115.31 115.94 1pg8 h LEU 198 Ca 0.09 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1pg8 h LEU 198 Cb 0.45 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1pg8 h LEU 198 CO -0.00 0.72 -0.07 -0.33 0.09 0.00 0.00 178.44 178.84 1pg8 h GLU 199 N 0.46 0.00 -0.35 1.13 5.08 -1.36 -2.71 114.58 116.83 1pg8 h GLU 199 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1pg8 h GLU 199 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1pg8 h GLU 199 CO 0.04 0.07 0.00 1.28 -1.00 0.00 0.00 179.01 179.41 1pg8 n LEU 200 N -3.28 2.75 0.00 1.33 4.77 -0.95 -4.95 117.00 116.66 1pg8 n LEU 200 Ca -0.01 -1.22 0.00 0.00 -0.03 0.00 0.00 56.01 54.76 1pg8 n LEU 200 Cb 0.27 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1pg8 n LEU 200 CO 0.28 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.56 1pg8 n GLY 201 N 1.35 0.85 3.75 -0.72 0.00 -1.02 -3.85 105.19 105.55 1pg8 n GLY 201 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1pg8 n GLY 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pg8 s ALA 202 N -2.00 2.66 -0.06 4.61 0.00 -0.81 -4.83 121.76 121.33 1pg8 s ALA 202 Ca 0.00 1.17 -0.15 0.00 0.00 0.00 0.00 51.96 52.99 1pg8 s ALA 202 Cb 0.00 -3.51 -0.30 0.00 0.00 0.00 0.00 23.12 19.31 1pg8 s ALA 202 CO 0.00 -1.28 0.69 -0.44 0.00 0.00 0.00 175.76 174.73 1pg8 h ASP 203 N 1.17 0.55 -4.84 0.00 3.32 -1.73 -3.40 116.42 111.49 1pg8 h ASP 203 Ca -0.51 -0.91 -0.21 0.00 0.02 0.00 0.00 57.03 55.43 1pg8 h ASP 203 Cb 1.30 -0.18 -0.22 0.00 0.22 0.00 0.00 39.33 40.46 1pg8 h ASP 203 CO 0.56 1.67 -0.71 -0.76 -1.72 0.00 0.00 179.24 178.28 1pg8 s LEU 204 N -7.50 2.23 -0.07 1.55 1.43 -0.95 -3.77 118.68 111.61 1pg8 s LEU 204 Ca -0.16 -0.48 0.04 0.00 -1.03 0.00 0.00 54.13 52.49 1pg8 s LEU 204 Cb 0.04 0.01 0.00 0.00 0.03 0.00 0.00 46.19 46.27 1pg8 s LEU 204 CO 0.83 -0.25 -0.17 -0.69 0.23 0.00 0.00 176.35 176.30 1pg8 s VAL 205 N -1.34 1.50 0.13 -1.59 1.01 0.58 -0.95 120.40 119.73 1pg8 s VAL 205 Ca -0.13 -0.72 0.08 0.00 0.00 0.00 0.00 61.98 61.21 1pg8 s VAL 205 Cb -0.09 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 1pg8 s VAL 205 CO -0.01 0.43 -0.11 0.68 0.00 0.00 0.00 175.10 176.10 1pg8 s VAL 206 N 0.34 3.25 -0.02 2.92 -7.23 0.08 -1.07 120.40 118.67 1pg8 s VAL 206 Ca -0.12 -1.41 0.00 0.00 -1.81 0.00 0.00 61.98 58.64 1pg8 s VAL 206 Cb -0.15 -2.55 0.03 0.00 0.56 0.00 0.00 36.38 34.27 1pg8 s VAL 206 CO 0.05 0.04 0.02 -1.00 -0.31 0.00 0.00 175.10 173.90 1pg8 s HIS 207 N -1.35 0.09 -0.74 2.82 3.76 0.10 -1.35 115.29 118.61 1pg8 s HIS 207 Ca 0.22 0.10 -0.27 0.00 -0.15 0.00 0.00 55.06 54.96 1pg8 s HIS 207 Cb -0.10 -0.26 0.02 0.00 1.11 0.00 0.00 32.58 33.35 1pg8 s HIS 207 CO 0.14 -0.09 1.38 0.45 -0.85 0.00 0.00 174.74 175.76 1pg8 s SER 208 N 1.00 6.04 0.15 1.40 0.15 -1.26 -1.58 113.70 119.60 1pg8 s SER 208 Ca -0.09 -0.38 0.23 0.00 0.70 0.00 0.00 55.95 56.41 1pg8 s SER 208 Cb -0.12 -2.56 0.91 0.00 -1.71 0.00 0.00 66.02 62.54 1pg8 s SER 208 CO -0.03 -1.91 1.72 0.00 1.20 0.00 0.00 173.24 174.22 1pg8 n ALA 209 N 9.88 1.95 -0.34 5.45 0.00 0.94 -2.62 120.51 135.77 1pg8 n ALA 209 Ca 0.07 -0.00 0.33 0.00 0.00 0.00 0.00 53.44 53.84 1pg8 n ALA 209 Cb 0.50 -1.39 0.70 0.00 0.00 0.00 0.00 19.45 19.25 1pg8 n ALA 209 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1pg8 h THR 210 N 0.00 0.40 0.00 0.00 2.02 -1.70 -0.76 112.91 112.86 1pg8 h THR 210 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1pg8 h THR 210 Cb 0.47 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1pg8 h THR 210 CO 0.00 0.02 0.00 0.29 0.37 0.00 0.00 175.52 176.20 1pg8 n LYS 211 N -4.29 0.00 -0.20 6.66 4.01 -1.08 -4.57 118.16 118.70 1pg8 n LYS 211 Ca 0.27 0.00 -0.05 0.00 -0.51 0.00 0.00 58.31 58.02 1pg8 n LYS 211 Cb 1.21 0.00 0.12 0.00 -0.51 0.00 0.00 35.03 35.85 1pg8 n LYS 211 CO 0.00 0.00 0.00 1.88 -1.11 0.00 0.00 177.40 178.17 1pg8 h TYR 212 N 0.00 1.03 -0.09 2.13 -1.99 -1.76 0.13 116.97 116.42 1pg8 h TYR 212 Ca 0.00 -0.10 0.04 0.00 2.00 0.00 0.00 58.73 60.67 1pg8 h TYR 212 Cb 0.00 -0.30 -0.05 0.00 2.00 0.00 0.00 36.73 38.38 1pg8 h TYR 212 CO 0.00 0.83 -0.26 -0.07 -0.00 0.00 0.00 178.16 178.67 1pg8 h LEU 213 N 0.96 -0.79 -0.19 3.88 3.38 -1.85 -1.48 115.31 119.22 1pg8 h LEU 213 Ca 0.21 0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.28 1pg8 h LEU 213 Cb 0.30 0.34 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1pg8 h LEU 213 CO -0.00 -0.31 0.06 -1.28 0.09 0.00 0.00 178.44 176.99 1pg8 h SER 214 N -0.35 0.28 0.00 -0.43 0.87 -0.91 -3.28 113.55 109.74 1pg8 h SER 214 Ca 0.09 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 1pg8 h SER 214 Cb 0.48 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.37 1pg8 h SER 214 CO -0.29 0.41 0.00 0.61 -0.53 0.00 0.00 176.83 177.03 1pg8 n GLY 215 N -0.59 2.20 0.20 5.77 0.00 0.43 -4.52 105.19 108.68 1pg8 n GLY 215 Ca -0.04 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.03 1pg8 n GLY 215 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1pg8 n HIS 216 N -1.86 0.00 -1.64 1.61 8.25 -1.26 -1.74 115.22 118.58 1pg8 n HIS 216 Ca 0.00 -0.52 -0.18 0.00 -0.26 0.00 0.00 57.72 56.76 1pg8 n HIS 216 Cb 0.00 -0.09 -0.07 0.00 1.12 0.00 0.00 29.99 30.95 1pg8 n HIS 216 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1pg8 n GLY 217 N -0.73 1.37 0.37 -1.41 0.00 -1.26 -4.86 105.19 98.67 1pg8 n GLY 217 Ca 0.07 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.14 1pg8 n GLY 217 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1pg8 n ASP 218 N -1.14 1.83 -4.09 1.61 5.68 -1.26 -5.02 116.55 114.16 1pg8 n ASP 218 Ca -0.18 -1.43 -0.08 0.00 -0.50 0.00 0.00 54.79 52.60 1pg8 n ASP 218 Cb 0.59 -0.02 -0.10 0.00 -1.14 0.00 0.00 41.12 40.45 1pg8 n ASP 218 CO 0.00 0.00 0.00 0.27 -1.33 0.00 0.00 177.20 176.14 1pg8 s ILE 219 N -0.76 0.33 -0.21 2.12 -4.36 -1.26 -5.11 121.20 111.96 1pg8 s ILE 219 Ca 0.11 -1.69 -0.06 0.00 -0.26 0.00 0.00 60.65 58.75 1pg8 s ILE 219 Cb 0.08 -1.36 -0.03 0.00 1.25 0.00 0.00 42.46 42.40 1pg8 s ILE 219 CO 0.11 -0.88 0.02 -0.89 0.24 0.00 0.00 174.94 173.55 1pg8 s THR 220 N -3.42 4.16 0.06 8.37 2.01 -1.26 -4.44 115.64 121.12 1pg8 s THR 220 Ca 0.04 -0.24 -0.15 0.00 0.31 0.00 0.00 61.69 61.65 1pg8 s THR 220 Cb 0.04 -2.89 0.03 0.00 0.01 0.00 0.00 72.50 69.69 1pg8 s THR 220 CO -0.07 0.42 0.35 0.00 -0.69 0.00 0.00 174.62 174.62 1pg8 s ALA 221 N 1.00 -0.81 0.08 7.40 0.00 -1.21 -4.39 121.76 123.82 1pg8 s ALA 221 Ca 0.02 0.08 0.07 0.00 0.00 0.00 0.00 51.96 52.14 1pg8 s ALA 221 Cb -0.14 0.38 -0.03 0.00 0.00 0.00 0.00 23.12 23.33 1pg8 s ALA 221 CO 0.02 -0.46 -0.19 0.20 0.00 0.00 0.00 175.76 175.33 1pg8 s GLY 222 N -2.17 1.12 -0.01 0.00 0.00 -0.05 -0.04 107.32 106.17 1pg8 s GLY 222 Ca -0.04 -1.13 0.04 0.00 0.00 0.00 0.00 44.72 43.59 1pg8 s GLY 222 CO -0.04 -1.12 -0.13 -0.42 0.00 0.00 0.00 173.10 171.39 1pg8 s ILE 223 N -1.08 0.99 -0.07 0.90 -1.09 -0.61 -0.95 121.20 119.28 1pg8 s ILE 223 Ca 0.05 -0.55 0.05 0.00 -2.23 0.00 0.00 60.65 57.97 1pg8 s ILE 223 Cb -0.10 -0.83 -0.01 0.00 -1.58 0.00 0.00 42.46 39.95 1pg8 s ILE 223 CO 0.03 0.27 -0.24 -0.69 -1.23 0.00 0.00 174.94 173.08 1pg8 s VAL 224 N -0.31 2.02 0.01 2.92 1.01 -0.25 -0.72 120.40 125.07 1pg8 s VAL 224 Ca 0.05 -1.02 0.05 0.00 0.00 0.00 0.00 61.98 61.06 1pg8 s VAL 224 Cb -0.05 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 1pg8 s VAL 224 CO -0.00 0.56 -0.17 -0.69 0.00 0.00 0.00 175.10 174.80 1pg8 s VAL 225 N 0.06 1.32 -1.16 2.92 1.01 -0.23 -0.63 120.40 123.68 1pg8 s VAL 225 Ca -0.10 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.01 1pg8 s VAL 225 Cb -0.15 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.10 1pg8 s VAL 225 CO 0.06 0.24 0.00 0.61 0.00 0.00 0.00 175.10 176.01 1pg8 n GLY 226 N 2.31 -0.57 3.78 4.51 0.00 -0.89 -0.31 105.19 114.02 1pg8 n GLY 226 Ca -0.16 -0.67 -0.36 0.00 0.00 0.00 0.00 46.02 44.83 1pg8 n GLY 226 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pg8 s SER 227 N -4.00 6.47 0.35 1.61 1.04 -1.25 -1.68 113.70 116.25 1pg8 s SER 227 Ca 0.00 2.13 0.15 0.00 0.48 0.00 0.00 55.95 58.71 1pg8 s SER 227 Cb 0.00 -2.59 1.06 0.00 0.10 0.00 0.00 66.02 64.59 1pg8 s SER 227 CO 0.00 -0.70 1.70 -0.61 0.98 0.00 0.00 173.24 174.61 1pg8 h GLN 228 N 2.21 0.38 0.02 4.02 5.75 -1.90 -1.73 115.11 123.87 1pg8 h GLN 228 Ca -0.49 -0.02 -0.27 0.00 -0.15 0.00 0.00 58.65 57.72 1pg8 h GLN 228 Cb 1.23 -0.09 0.02 0.00 1.07 0.00 0.00 27.48 29.71 1pg8 h GLN 228 CO 0.61 0.25 -1.07 0.00 -2.65 0.00 0.00 178.83 175.97 1pg8 h ALA 229 N 1.75 0.14 -0.32 3.38 0.00 -1.99 -1.98 119.26 120.24 1pg8 h ALA 229 Ca 0.69 -0.72 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1pg8 h ALA 229 Cb 1.59 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 1pg8 h ALA 229 CO -0.49 0.71 0.02 -0.07 0.00 0.00 0.00 179.25 179.42 1pg8 h LEU 230 N 0.34 0.55 -0.23 0.00 3.38 -1.84 -3.01 115.31 114.50 1pg8 h LEU 230 Ca -0.13 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.51 1pg8 h LEU 230 Cb 1.72 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 42.32 1pg8 h LEU 230 CO 0.20 0.71 0.03 0.58 0.09 0.00 0.00 178.44 180.05 1pg8 h VAL 231 N 0.37 1.23 -0.68 1.22 2.07 -1.33 -0.91 116.25 118.21 1pg8 h VAL 231 Ca 0.09 -0.78 0.15 0.00 0.82 0.00 0.00 66.70 66.98 1pg8 h VAL 231 Cb 0.42 1.30 -0.11 0.00 -1.52 0.00 0.00 31.29 31.38 1pg8 h VAL 231 CO 0.01 0.25 0.06 0.44 0.02 0.00 0.00 177.57 178.35 1pg8 h ASP 232 N 0.19 -0.20 0.14 0.57 3.45 -1.45 0.13 116.42 119.24 1pg8 h ASP 232 Ca 0.07 0.16 -0.10 0.00 0.43 0.00 0.00 57.03 57.59 1pg8 h ASP 232 Cb 0.34 0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 39.36 1pg8 h ASP 232 CO 0.01 -0.10 -0.35 0.03 -1.57 0.00 0.00 179.24 177.25 1pg8 h ARG 233 N 0.16 0.30 -0.13 3.56 3.08 -1.26 -0.85 114.38 119.24 1pg8 h ARG 233 Ca 0.37 -0.13 -0.14 0.00 0.07 0.00 0.00 59.98 60.15 1pg8 h ARG 233 Cb 0.62 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.67 1pg8 h ARG 233 CO -0.55 0.62 -0.47 0.82 -1.07 0.00 0.00 179.97 179.31 1pg8 h ILE 234 N 0.26 1.35 -0.07 2.04 2.04 0.23 -0.52 117.51 122.85 1pg8 h ILE 234 Ca 0.03 -1.76 0.04 0.00 1.00 0.00 0.00 64.86 64.17 1pg8 h ILE 234 Cb 0.74 2.08 -0.06 0.00 -0.74 0.00 0.00 36.82 38.85 1pg8 h ILE 234 CO 0.06 0.54 -0.31 -0.09 0.00 0.00 0.00 178.15 178.35 1pg8 h ARG 235 N 0.19 -0.40 -0.00 2.37 2.43 -0.76 0.15 114.38 118.36 1pg8 h ARG 235 Ca -0.02 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1pg8 h ARG 235 Cb 1.10 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1pg8 h ARG 235 CO 0.10 -0.27 -0.22 1.28 -1.51 0.00 0.00 179.97 179.35 1pg8 n LEU 236 N -5.40 0.61 0.04 3.80 4.77 -0.33 -1.32 117.00 119.16 1pg8 n LEU 236 Ca -0.04 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1pg8 n LEU 236 Cb 0.32 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1pg8 n LEU 236 CO 0.18 0.12 0.00 0.00 -1.33 0.00 0.00 177.39 176.36 1pg8 n GLN 237 N -1.02 0.00 0.34 3.23 6.02 -0.21 -4.58 117.38 121.16 1pg8 n GLN 237 Ca 0.11 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.92 1pg8 n GLN 237 Cb 0.32 -0.26 -0.10 0.00 1.02 0.00 0.00 30.24 31.23 1pg8 n GLN 237 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1pg8 h GLY 238 N 0.00 -1.22 0.13 1.08 0.00 -1.26 -1.53 103.07 100.27 1pg8 h GLY 238 Ca 0.00 0.54 -0.01 0.00 0.00 0.00 0.00 47.33 47.86 1pg8 h GLY 238 CO 0.00 -0.39 -0.06 -2.00 0.00 0.00 0.00 176.54 174.08 1pg8 h LEU 239 N -1.05 -0.15 -0.60 3.11 6.46 -0.80 0.23 115.31 122.52 1pg8 h LEU 239 Ca -0.07 0.01 0.13 0.00 -0.12 0.00 0.00 57.88 57.82 1pg8 h LEU 239 Cb 0.88 0.04 -0.10 0.00 -0.73 0.00 0.00 40.66 40.74 1pg8 h LEU 239 CO 0.01 -0.07 -0.02 0.50 -0.62 0.00 0.00 178.44 178.24 1pg8 h LYS 240 N -0.24 0.10 0.00 1.25 3.64 -1.33 -1.11 116.57 118.89 1pg8 h LYS 240 Ca -0.02 -0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.21 1pg8 h LYS 240 Cb 0.13 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 1pg8 h LYS 240 CO 0.03 0.07 -1.60 -0.25 -2.27 0.00 0.00 179.45 175.43 1pg8 n ASP 241 N -5.29 2.79 -0.00 4.20 8.00 -0.68 -4.59 116.55 120.98 1pg8 n ASP 241 Ca 0.08 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.64 1pg8 n ASP 241 Cb 0.34 0.80 -0.08 0.00 -0.02 0.00 0.00 41.12 42.16 1pg8 n ASP 241 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1pg8 n MET 242 N -2.28 0.97 0.00 -1.24 2.81 -0.62 -4.79 117.12 111.97 1pg8 n MET 242 Ca -0.13 -0.08 0.00 0.00 -1.81 0.00 0.00 57.70 55.67 1pg8 n MET 242 Cb 0.73 -1.22 0.00 0.00 -0.71 0.00 0.00 33.22 32.02 1pg8 n MET 242 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1pg8 n THR 243 N -1.77 0.00 -2.35 2.03 -2.24 -0.03 -5.01 114.28 104.91 1pg8 n THR 243 Ca -0.01 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.56 1pg8 n THR 243 Cb 0.27 -0.37 -0.01 0.00 -2.10 0.00 0.00 70.33 68.13 1pg8 n THR 243 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pg8 n GLY 244 N 2.15 -0.37 2.83 3.38 0.00 -0.42 -4.88 105.19 107.89 1pg8 n GLY 244 Ca 0.00 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1pg8 n GLY 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pg8 n ALA 245 N -1.84 5.32 -2.66 4.61 0.00 -1.26 -4.96 120.51 119.72 1pg8 n ALA 245 Ca -0.24 -3.93 -0.42 0.00 0.00 0.00 0.00 53.44 48.85 1pg8 n ALA 245 Cb 0.68 -3.48 -0.04 0.00 0.00 0.00 0.00 19.45 16.61 1pg8 n ALA 245 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1pg8 s VAL 246 N 2.97 4.85 0.04 0.00 1.01 -1.26 -1.31 120.40 126.70 1pg8 s VAL 246 Ca 0.47 1.66 -0.30 0.00 0.00 0.00 0.00 61.98 63.80 1pg8 s VAL 246 Cb 0.12 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.30 1pg8 s VAL 246 CO -0.06 -0.01 1.24 -0.22 0.00 0.00 0.00 175.10 176.04 1pg8 s LEU 247 N 2.37 4.35 0.24 3.92 0.20 -1.26 -4.41 118.68 124.09 1pg8 s LEU 247 Ca 0.38 2.01 -0.31 0.00 0.69 0.00 0.00 54.13 56.90 1pg8 s LEU 247 Cb -0.16 -3.57 -0.12 0.00 -0.43 0.00 0.00 46.19 41.91 1pg8 s LEU 247 CO 0.11 -0.53 1.67 -0.55 -0.29 0.00 0.00 176.35 176.76 1pg8 s SER 248 N 1.23 6.38 0.45 3.68 0.15 -1.26 -4.90 113.70 119.43 1pg8 s SER 248 Ca 0.59 2.89 0.20 0.00 0.70 0.00 0.00 55.95 60.33 1pg8 s SER 248 Cb -0.29 -2.61 1.16 0.00 -1.71 0.00 0.00 66.02 62.56 1pg8 s SER 248 CO 0.28 -0.95 1.89 -0.65 1.20 0.00 0.00 173.24 175.01 1pg8 h PRO 249 N 6.09 0.31 -0.05 5.44 0.11 -1.95 -0.12 132.00 141.83 1pg8 h PRO 249 Ca -0.44 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 1pg8 h PRO 249 Cb 1.21 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1pg8 h PRO 249 CO 0.90 0.20 0.02 1.25 -0.21 0.00 0.00 178.00 180.16 1pg8 h HIS 250 N 0.32 0.07 -0.11 0.65 -0.00 -1.92 -1.19 115.15 112.97 1pg8 h HIS 250 Ca 0.42 -0.00 -0.08 0.00 -0.00 0.00 0.00 60.37 60.71 1pg8 h HIS 250 Cb 1.16 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 28.53 1pg8 h HIS 250 CO -0.00 0.17 -0.29 -0.44 -0.00 0.00 0.00 177.93 177.36 1pg8 h ASP 251 N -0.05 0.21 -0.54 3.26 3.45 -1.73 -1.74 116.42 119.28 1pg8 h ASP 251 Ca 0.02 -0.07 -0.04 0.00 0.43 0.00 0.00 57.03 57.37 1pg8 h ASP 251 Cb 0.12 -0.06 -0.02 0.00 -0.56 0.00 0.00 39.33 38.81 1pg8 h ASP 251 CO -0.00 0.51 0.18 0.00 -1.57 0.00 0.00 179.24 178.35 1pg8 h ALA 252 N 1.51 0.71 -0.55 3.45 0.00 -0.90 -1.13 119.26 122.35 1pg8 h ALA 252 Ca 0.03 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 1pg8 h ALA 252 Cb 0.62 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1pg8 h ALA 252 CO 0.05 0.36 0.01 0.00 0.00 0.00 0.00 179.25 179.67 1pg8 h ALA 253 N 1.04 0.98 -0.29 0.00 0.00 -0.81 -1.47 119.26 118.71 1pg8 h ALA 253 Ca 0.18 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1pg8 h ALA 253 Cb 0.27 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1pg8 h ALA 253 CO -0.01 0.62 -0.05 -0.07 0.00 0.00 0.00 179.25 179.75 1pg8 h LEU 254 N 0.86 0.42 -0.43 0.00 3.38 -1.02 -0.92 115.31 117.61 1pg8 h LEU 254 Ca 0.16 -0.08 -0.18 0.00 0.09 0.00 0.00 57.88 57.87 1pg8 h LEU 254 Cb 0.49 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1pg8 h LEU 254 CO 0.02 0.52 -0.62 0.25 0.09 0.00 0.00 178.44 178.71 1pg8 h LEU 255 N 0.43 0.65 -0.55 1.67 5.85 -0.85 -0.87 115.31 121.64 1pg8 h LEU 255 Ca 0.09 -0.38 -0.07 0.00 0.84 0.00 0.00 57.88 58.37 1pg8 h LEU 255 Cb 0.36 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 1pg8 h LEU 255 CO 0.02 1.11 0.07 0.24 -0.34 0.00 0.00 178.44 179.54 1pg8 h MET 256 N 0.42 0.92 -0.22 1.25 2.86 -1.06 -0.17 114.93 118.92 1pg8 h MET 256 Ca -0.01 -0.26 0.03 0.00 -2.06 0.00 0.00 59.70 57.41 1pg8 h MET 256 Cb 1.19 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 32.71 1pg8 h MET 256 CO 0.12 0.90 0.03 -0.09 1.06 0.00 0.00 176.91 178.92 1pg8 h ARG 257 N 0.81 0.11 -1.00 1.72 2.43 -0.95 -1.76 114.38 115.73 1pg8 h ARG 257 Ca 0.16 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.36 1pg8 h ARG 257 Cb 0.43 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.90 1pg8 h ARG 257 CO 0.01 0.07 0.65 0.78 -1.51 0.00 0.00 179.97 179.98 1pg8 h GLY 258 N 0.11 1.45 2.00 2.80 0.00 -0.92 -2.85 103.07 105.67 1pg8 h GLY 258 Ca 0.10 -0.50 -0.06 0.00 0.00 0.00 0.00 47.33 46.87 1pg8 h GLY 258 CO -0.15 0.44 -0.28 -2.22 0.00 0.00 0.00 176.54 174.33 1pg8 h ILE 259 N 1.28 0.95 0.00 2.60 2.04 -0.15 -2.03 117.51 122.19 1pg8 h ILE 259 Ca 0.39 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 65.19 1pg8 h ILE 259 Cb -0.02 1.62 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 1pg8 h ILE 259 CO -0.12 0.28 0.11 0.11 0.00 0.00 0.00 178.15 178.53 1pg8 h LYS 260 N 0.00 0.00 -0.04 2.37 1.57 -1.21 -0.13 116.57 119.13 1pg8 h LYS 260 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1pg8 h LYS 260 Cb 0.59 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 1pg8 h LYS 260 CO 0.04 0.00 -0.11 0.25 -0.57 0.00 0.00 179.45 179.05 1pg8 n THR 261 N -2.84 2.03 -0.03 -0.16 -2.24 -0.77 -4.88 114.28 105.40 1pg8 n THR 261 Ca -0.02 -2.47 -0.11 0.00 -2.27 0.00 0.00 64.05 59.18 1pg8 n THR 261 Cb 0.17 -0.25 -0.05 0.00 -2.10 0.00 0.00 70.33 68.10 1pg8 n THR 261 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1pg8 h LEU 262 N 0.45 0.18 -0.44 3.22 5.85 -1.03 -1.42 115.31 122.11 1pg8 h LEU 262 Ca 0.01 -0.13 0.05 0.00 0.84 0.00 0.00 57.88 58.65 1pg8 h LEU 262 Cb 1.08 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 42.02 1pg8 h LEU 262 CO 0.04 0.26 0.18 -0.55 -0.34 0.00 0.00 178.44 178.03 1pg8 h ASN 263 N 0.08 0.22 -0.43 1.25 -1.07 -1.90 -1.18 115.58 112.56 1pg8 h ASN 263 Ca 0.05 0.04 -0.07 0.00 0.07 0.00 0.00 56.30 56.38 1pg8 h ASN 263 Cb 0.13 0.01 -0.02 0.00 -2.07 0.00 0.00 38.32 36.37 1pg8 h ASN 263 CO -0.01 0.16 -0.01 -0.07 0.07 0.00 0.00 177.43 177.57 1pg8 h LEU 264 N 0.37 0.76 -0.17 6.14 4.07 -1.86 -0.47 115.31 124.15 1pg8 h LEU 264 Ca 0.20 -0.32 -0.14 0.00 0.08 0.00 0.00 57.88 57.70 1pg8 h LEU 264 Cb 0.16 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 41.70 1pg8 h LEU 264 CO -0.18 0.89 -0.44 0.03 -1.08 0.00 0.00 178.44 177.66 1pg8 h ARG 265 N 0.61 0.60 -0.88 1.13 3.08 -1.23 -2.96 114.38 114.73 1pg8 h ARG 265 Ca 0.12 -0.42 -0.02 0.00 0.07 0.00 0.00 59.98 59.74 1pg8 h ARG 265 Cb 0.51 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.58 1pg8 h ARG 265 CO 0.02 1.04 0.49 0.52 -1.07 0.00 0.00 179.97 180.97 1pg8 h MET 266 N 0.26 1.23 -0.54 0.04 2.86 -1.06 0.27 114.93 117.99 1pg8 h MET 266 Ca -0.01 -0.14 0.05 0.00 -2.06 0.00 0.00 59.70 57.55 1pg8 h MET 266 Cb 1.05 -0.24 -0.05 0.00 0.06 0.00 0.00 31.60 32.42 1pg8 h MET 266 CO 0.10 0.89 0.27 -0.44 1.06 0.00 0.00 176.91 178.79 1pg8 h ASP 267 N 1.23 0.38 0.20 1.22 3.45 -1.06 -1.09 116.42 120.77 1pg8 h ASP 267 Ca 0.31 0.03 -0.19 0.00 0.43 0.00 0.00 57.03 57.62 1pg8 h ASP 267 Cb 0.02 -0.04 -0.00 0.00 -0.56 0.00 0.00 39.33 38.75 1pg8 h ASP 267 CO -0.05 0.26 -0.72 -0.09 -1.57 0.00 0.00 179.24 177.07 1pg8 h ARG 268 N 0.52 0.45 -0.64 3.56 9.65 -1.22 -1.26 114.38 125.44 1pg8 h ARG 268 Ca 0.24 -0.36 -0.01 0.00 -1.10 0.00 0.00 59.98 58.75 1pg8 h ARG 268 Cb 0.17 0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.79 1pg8 h ARG 268 CO -0.18 1.00 0.36 0.45 2.80 0.00 0.00 179.97 184.39 1pg8 h HIS 269 N 0.31 0.87 -0.16 2.20 3.86 -0.18 -0.72 115.15 121.34 1pg8 h HIS 269 Ca -0.03 -0.02 -0.16 0.00 -1.16 0.00 0.00 60.37 59.00 1pg8 h HIS 269 Cb 1.30 -0.28 0.01 0.00 1.06 0.00 0.00 27.41 29.49 1pg8 h HIS 269 CO 0.05 0.62 -0.53 0.00 0.86 0.00 0.00 177.93 178.93 1pg8 h ALA 271 N 0.54 0.77 -0.89 0.00 0.00 -1.14 0.41 119.26 118.95 1pg8 h ALA 271 Ca -0.02 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1pg8 h ALA 271 Cb 1.16 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 1pg8 h ALA 271 CO 0.11 0.24 0.47 -0.91 0.00 0.00 0.00 179.25 179.16 1pg8 h ASN 272 N 0.81 1.13 0.01 0.00 2.35 -1.10 -2.79 115.58 116.00 1pg8 h ASN 272 Ca 0.22 -0.11 -0.00 0.00 -0.55 0.00 0.00 56.30 55.86 1pg8 h ASN 272 Cb -0.03 -0.29 0.00 0.00 0.05 0.00 0.00 38.32 38.05 1pg8 h ASN 272 CO -0.04 0.92 -0.01 0.00 -1.65 0.00 0.00 177.43 176.65 1pg8 h ALA 273 N 1.26 -0.02 -0.63 -0.83 0.00 -0.88 -1.62 119.26 116.54 1pg8 h ALA 273 Ca 0.31 -0.13 0.13 0.00 0.00 0.00 0.00 54.91 55.22 1pg8 h ALA 273 Cb 0.05 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.76 1pg8 h ALA 273 CO -0.05 -0.38 0.11 1.96 0.00 0.00 0.00 179.25 180.89 1pg8 h GLN 274 N -0.28 0.22 0.03 0.00 4.20 -0.91 -0.13 115.11 118.25 1pg8 h GLN 274 Ca -0.00 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 1pg8 h GLN 274 Cb 0.27 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.00 1pg8 h GLN 274 CO 0.00 0.15 -0.01 0.28 -0.67 0.00 0.00 178.83 178.58 1pg8 h VAL 275 N 0.23 0.98 -0.31 -0.54 2.07 -1.24 -1.47 116.25 115.96 1pg8 h VAL 275 Ca 0.34 -0.01 -0.07 0.00 0.82 0.00 0.00 66.70 67.78 1pg8 h VAL 275 Cb 0.53 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1pg8 h VAL 275 CO -0.45 0.00 -0.10 -0.07 0.02 0.00 0.00 177.57 176.97 1pg8 h LEU 276 N -0.04 0.50 -0.28 2.57 3.38 -0.98 -1.70 115.31 118.76 1pg8 h LEU 276 Ca -0.00 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1pg8 h LEU 276 Cb 0.03 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1pg8 h LEU 276 CO 0.01 0.64 0.07 0.00 0.09 0.00 0.00 178.44 179.24 1pg8 h ALA 277 N 1.41 0.37 -0.32 1.53 0.00 -0.89 0.24 119.26 121.60 1pg8 h ALA 277 Ca 0.09 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1pg8 h ALA 277 Cb 0.47 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1pg8 h ALA 277 CO 0.03 0.04 -0.22 0.93 0.00 0.00 0.00 179.25 180.02 1pg8 h GLU 278 N 0.29 0.62 0.27 0.00 4.39 -1.03 -0.04 114.58 119.08 1pg8 h GLU 278 Ca 0.09 -0.24 -0.01 0.00 0.34 0.00 0.00 59.36 59.54 1pg8 h GLU 278 Cb 0.29 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1pg8 h GLU 278 CO 0.00 0.80 -0.13 0.35 -1.16 0.00 0.00 179.01 178.87 1pg8 h PHE 279 N 0.55 -0.34 -0.73 4.33 3.57 -1.23 -3.23 116.94 119.86 1pg8 h PHE 279 Ca 0.08 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.58 1pg8 h PHE 279 Cb 0.68 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.49 1pg8 h PHE 279 CO 0.03 -0.07 0.49 -0.07 -2.23 0.00 0.00 178.31 176.46 1pg8 h LEU 280 N -0.57 0.83 0.00 0.59 -0.00 -0.27 -2.51 115.31 113.37 1pg8 h LEU 280 Ca -0.04 -0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.82 1pg8 h LEU 280 Cb 0.42 -0.21 0.00 0.00 -0.00 0.00 0.00 40.66 40.87 1pg8 h LEU 280 CO 0.06 0.60 0.00 0.00 -0.00 0.00 0.00 178.44 179.10 1pg8 n ALA 281 N -2.42 1.80 0.01 1.53 0.00 -0.05 -1.93 120.51 119.45 1pg8 n ALA 281 Ca 0.08 -0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.47 1pg8 n ALA 281 Cb 0.04 -1.22 0.03 0.00 0.00 0.00 0.00 19.45 18.31 1pg8 n ALA 281 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1pg8 n ARG 282 N -1.24 1.80 -3.58 0.00 1.74 -0.95 -5.04 116.66 109.39 1pg8 n ARG 282 Ca 0.07 -1.31 -0.35 0.00 -0.77 0.00 0.00 57.85 55.48 1pg8 n ARG 282 Cb 0.10 -1.06 -0.06 0.00 -1.02 0.00 0.00 32.46 30.42 1pg8 n ARG 282 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1pg8 s GLN 283 N -0.74 3.77 0.39 5.56 -1.52 -0.81 -4.98 119.66 121.33 1pg8 s GLN 283 Ca 0.05 0.20 0.21 0.00 -1.95 0.00 0.00 55.36 53.86 1pg8 s GLN 283 Cb 0.03 -3.05 0.43 0.00 -0.22 0.00 0.00 33.01 30.20 1pg8 s GLN 283 CO 0.03 0.60 1.62 -1.00 -0.25 0.00 0.00 175.29 176.30 1pg8 h PRO 284 N 3.98 0.00 0.00 2.91 0.13 -1.96 -2.84 132.00 134.21 1pg8 h PRO 284 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1pg8 h PRO 284 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1pg8 h PRO 284 CO 0.65 0.22 0.00 1.04 -0.23 0.00 0.00 178.00 179.68 1pg8 n GLN 285 N -3.20 0.28 -3.99 0.86 3.00 -1.26 -4.77 117.38 108.30 1pg8 n GLN 285 Ca 0.02 0.10 -0.34 0.00 -0.01 0.00 0.00 57.00 56.77 1pg8 n GLN 285 Cb 0.57 -1.50 -0.15 0.00 0.00 0.00 0.00 30.24 29.16 1pg8 n GLN 285 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1pg8 s VAL 286 N -2.57 2.74 -0.05 5.09 1.01 -1.07 -1.96 120.40 123.59 1pg8 s VAL 286 Ca 0.19 -0.96 -0.07 0.00 0.00 0.00 0.00 61.98 61.14 1pg8 s VAL 286 Cb 0.13 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 1pg8 s VAL 286 CO 0.30 0.29 0.33 -0.08 0.00 0.00 0.00 175.10 175.94 1pg8 h GLU 287 N 8.00 -0.23 -5.64 2.72 4.57 -0.87 -3.46 114.58 119.67 1pg8 h GLU 287 Ca -0.36 0.02 -0.46 0.00 -1.18 0.00 0.00 59.36 57.37 1pg8 h GLU 287 Cb 1.12 0.05 -0.17 0.00 -0.16 0.00 0.00 28.75 29.59 1pg8 h GLU 287 CO 0.59 -0.16 -0.76 -0.51 -1.18 0.00 0.00 179.01 176.99 1pg8 s LEU 288 N -7.74 2.45 -0.03 1.64 1.43 -1.23 -5.00 118.68 110.21 1pg8 s LEU 288 Ca -0.04 -0.88 -0.01 0.00 -1.03 0.00 0.00 54.13 52.18 1pg8 s LEU 288 Cb 0.00 -0.67 0.03 0.00 0.03 0.00 0.00 46.19 45.57 1pg8 s LEU 288 CO 0.11 -0.11 0.06 -0.51 0.23 0.00 0.00 176.35 176.12 1pg8 s ILE 289 N -2.30 -0.04 -0.44 -0.59 2.07 -1.26 -1.98 121.20 116.66 1pg8 s ILE 289 Ca 0.14 0.15 -0.06 0.00 -1.41 0.00 0.00 60.65 59.47 1pg8 s ILE 289 Cb -0.04 -0.12 0.11 0.00 0.13 0.00 0.00 42.46 42.55 1pg8 s ILE 289 CO 0.05 0.06 0.27 -1.00 -1.91 0.00 0.00 174.94 172.41 1pg8 s HIS 290 N 0.82 3.51 -0.06 3.50 3.76 0.27 -4.90 115.29 122.19 1pg8 s HIS 290 Ca -0.07 -2.15 -0.03 0.00 -0.15 0.00 0.00 55.06 52.67 1pg8 s HIS 290 Cb -0.09 -3.35 0.04 0.00 1.11 0.00 0.00 32.58 30.28 1pg8 s HIS 290 CO -0.03 -0.98 0.09 -0.47 -0.85 0.00 0.00 174.74 172.50 1pg8 s TYR 291 N 1.25 -0.01 0.57 1.40 6.14 -1.26 -1.93 117.35 123.50 1pg8 s TYR 291 Ca 0.07 0.35 0.34 0.00 0.64 0.00 0.00 57.07 58.47 1pg8 s TYR 291 Cb -0.24 -0.42 1.44 0.00 0.42 0.00 0.00 41.96 43.16 1pg8 s TYR 291 CO -0.02 -0.23 1.73 -1.35 0.64 0.00 0.00 175.55 176.31 1pg8 h PRO 292 N 8.41 0.00 -0.00 4.97 0.11 -1.88 -1.95 132.00 141.67 1pg8 h PRO 292 Ca -0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1pg8 h PRO 292 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1pg8 h PRO 292 CO 0.15 0.00 -0.43 0.41 -0.21 0.00 0.00 178.00 177.92 1pg8 n GLY 293 N -1.70 -1.17 3.76 -0.55 0.00 -1.26 -4.76 105.19 99.50 1pg8 n GLY 293 Ca 0.22 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 1pg8 n GLY 293 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pg8 s LEU 294 N -2.92 4.56 0.37 0.99 1.43 -0.73 -4.98 118.68 117.39 1pg8 s LEU 294 Ca 0.13 2.06 0.05 0.00 -1.03 0.00 0.00 54.13 55.34 1pg8 s LEU 294 Cb 0.18 -3.69 0.72 0.00 0.03 0.00 0.00 46.19 43.43 1pg8 s LEU 294 CO 0.66 -0.01 1.99 0.00 0.23 0.00 0.00 176.35 179.22 1pg8 h ALA 295 N 3.84 1.56 0.00 4.21 0.00 -1.88 -1.16 119.26 125.84 1pg8 h ALA 295 Ca -0.46 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1pg8 h ALA 295 Cb 1.20 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1pg8 h ALA 295 CO 0.67 0.36 0.00 -1.13 0.00 0.00 0.00 179.25 179.15 1pg8 n SER 296 N -4.41 0.00 -4.66 0.00 3.41 -1.26 -4.82 113.62 101.88 1pg8 n SER 296 Ca 0.03 -0.23 -0.43 0.00 -0.26 0.00 0.00 58.87 57.99 1pg8 n SER 296 Cb 0.11 -0.12 -0.02 0.00 -0.26 0.00 0.00 64.21 63.91 1pg8 n SER 296 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1pg8 s PHE 297 N -2.24 2.54 0.30 7.33 2.19 -0.44 -4.88 117.98 122.77 1pg8 s PHE 297 Ca 0.18 0.72 0.04 0.00 0.33 0.00 0.00 56.93 58.21 1pg8 s PHE 297 Cb 0.10 -3.65 0.79 0.00 -1.31 0.00 0.00 43.02 38.94 1pg8 s PHE 297 CO 0.19 -2.46 1.64 -1.35 1.83 0.00 0.00 175.22 175.07 1pg8 h PRO 298 N 8.68 0.21 -0.87 10.12 0.11 -1.89 0.11 132.00 148.46 1pg8 h PRO 298 Ca -0.31 -0.01 -0.58 0.00 0.11 0.00 0.00 66.00 65.21 1pg8 h PRO 298 Cb 1.13 -0.05 -0.30 0.00 0.11 0.00 0.00 31.00 31.89 1pg8 h PRO 298 CO 0.96 0.14 0.36 1.04 -0.21 0.00 0.00 178.00 180.29 1pg8 n GLN 299 N -5.21 2.75 -0.28 1.05 6.02 -1.26 -4.72 117.38 115.74 1pg8 n GLN 299 Ca 0.23 -3.45 0.09 0.00 -0.01 0.00 0.00 57.00 53.87 1pg8 n GLN 299 Cb 0.75 -2.22 0.23 0.00 1.02 0.00 0.00 30.24 30.01 1pg8 n GLN 299 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.06 175.13 1pg8 h TYR 300 N 1.81 0.21 -0.07 1.08 3.20 -1.08 -0.11 116.97 122.01 1pg8 h TYR 300 Ca 0.52 0.05 -0.09 0.00 3.14 0.00 0.00 58.73 62.35 1pg8 h TYR 300 Cb 1.33 0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.64 1pg8 h TYR 300 CO 1.28 -0.20 -0.30 1.15 -1.64 0.00 0.00 178.16 178.46 1pg8 h THR 301 N 0.19 1.43 -0.44 1.81 2.02 -1.84 -1.95 112.91 114.12 1pg8 h THR 301 Ca 0.48 -1.71 -0.03 0.00 0.77 0.00 0.00 66.41 65.93 1pg8 h THR 301 Cb 0.92 2.34 -0.02 0.00 -1.74 0.00 0.00 68.15 69.65 1pg8 h THR 301 CO -0.64 0.49 0.17 0.25 0.37 0.00 0.00 175.52 176.16 1pg8 h LEU 302 N -0.19 0.61 -0.38 2.58 6.46 -1.89 -2.01 115.31 120.49 1pg8 h LEU 302 Ca -0.02 -0.17 0.08 0.00 -0.12 0.00 0.00 57.88 57.65 1pg8 h LEU 302 Cb 0.94 -0.16 -0.09 0.00 -0.73 0.00 0.00 40.66 40.63 1pg8 h LEU 302 CO 0.06 0.62 -0.22 0.00 -0.62 0.00 0.00 178.44 178.28 1pg8 h ALA 303 N 1.02 0.04 0.00 1.25 0.00 -0.99 -1.04 119.26 119.53 1pg8 h ALA 303 Ca 0.15 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1pg8 h ALA 303 Cb 0.20 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1pg8 h ALA 303 CO -0.01 -0.59 0.00 0.00 0.00 0.00 0.00 179.25 178.64 1pg8 h ARG 304 N -0.16 0.00 0.05 0.00 3.08 -1.14 -0.86 114.38 115.36 1pg8 h ARG 304 Ca 0.19 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.99 1pg8 h ARG 304 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1pg8 h ARG 304 CO -0.47 0.00 -1.05 1.96 -1.07 0.00 0.00 179.97 179.33 1pg8 h GLN 305 N 0.00 0.35 0.00 0.04 4.20 -0.47 -3.36 115.11 115.88 1pg8 h GLN 305 Ca 0.00 -0.45 -0.26 0.00 0.06 0.00 0.00 58.65 58.00 1pg8 h GLN 305 Cb 0.55 0.14 -0.05 0.00 0.30 0.00 0.00 27.48 28.43 1pg8 h GLN 305 CO 0.00 1.14 -2.03 1.04 -0.67 0.00 0.00 178.83 178.32 1pg8 n GLN 306 N -3.67 0.66 -4.23 1.46 6.02 -0.75 -4.93 117.38 111.94 1pg8 n GLN 306 Ca -0.07 0.05 -0.33 0.00 -0.01 0.00 0.00 57.00 56.64 1pg8 n GLN 306 Cb 0.90 -1.62 -0.16 0.00 1.02 0.00 0.00 30.24 30.39 1pg8 n GLN 306 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1pg8 s MET 307 N -2.76 3.09 0.55 -1.09 -1.94 -0.35 -4.46 119.30 112.35 1pg8 s MET 307 Ca -0.07 -0.79 0.34 0.00 -1.71 0.00 0.00 55.69 53.45 1pg8 s MET 307 Cb 0.08 -2.63 1.50 0.00 2.01 0.00 0.00 34.83 35.79 1pg8 s MET 307 CO 0.84 -0.14 2.04 0.66 -0.01 0.00 0.00 175.02 178.40 1pg8 h SER 308 N 7.78 0.00 -5.05 3.03 4.64 -1.52 -3.41 113.55 119.03 1pg8 h SER 308 Ca -0.41 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.78 1pg8 h SER 308 Cb 1.16 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.07 1pg8 h SER 308 CO 0.61 0.04 -0.45 -1.10 -0.87 0.00 0.00 176.83 175.06 1pg8 s GLN 309 N -3.80 0.61 0.00 4.77 -0.21 -1.26 -5.06 119.66 114.70 1pg8 s GLN 309 Ca -0.00 -0.59 0.22 0.00 0.02 0.00 0.00 55.36 55.01 1pg8 s GLN 309 Cb 0.10 0.25 1.33 0.00 1.00 0.00 0.00 33.01 35.69 1pg8 s GLN 309 CO 0.54 -0.16 1.71 -0.35 -2.12 0.00 0.00 175.29 174.90 1pg8 n PRO 310 N 0.93 0.71 0.00 2.91 -0.04 -1.26 -5.00 135.00 133.25 1pg8 n PRO 310 Ca -0.20 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 1pg8 n PRO 310 Cb 0.58 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 1pg8 n PRO 310 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1pg8 n GLY 311 N 0.42 -0.47 0.91 0.55 0.00 -1.26 -4.45 105.19 100.89 1pg8 n GLY 311 Ca 0.17 -1.70 0.11 0.00 0.00 0.00 0.00 46.02 44.60 1pg8 n GLY 311 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pg8 n GLY 312 N -0.41 1.12 3.74 -0.02 0.00 -1.26 -4.45 105.19 103.90 1pg8 n GLY 312 Ca 0.00 -0.62 -0.36 0.00 0.00 0.00 0.00 46.02 45.05 1pg8 n GLY 312 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1pg8 s MET 313 N -1.66 3.45 0.00 1.61 -1.94 -1.26 -1.76 119.30 117.74 1pg8 s MET 313 Ca 0.35 -0.29 0.04 0.00 -1.71 0.00 0.00 55.69 54.08 1pg8 s MET 313 Cb 0.21 -3.06 -0.01 0.00 2.01 0.00 0.00 34.83 33.97 1pg8 s MET 313 CO 0.30 0.60 -0.13 0.42 -0.01 0.00 0.00 175.02 176.20 1pg8 s ILE 314 N -0.56 0.99 -0.04 2.53 1.01 -0.84 -4.81 121.20 119.48 1pg8 s ILE 314 Ca 0.11 -0.63 0.06 0.00 0.00 0.00 0.00 60.65 60.19 1pg8 s ILE 314 Cb -0.12 -0.85 -0.01 0.00 0.01 0.00 0.00 42.46 41.50 1pg8 s ILE 314 CO 0.02 0.21 -0.21 0.00 0.00 0.00 0.00 174.94 174.96 1pg8 s ALA 315 N -0.42 1.80 0.16 9.38 0.00 -0.81 -0.92 121.76 130.95 1pg8 s ALA 315 Ca 0.04 -0.87 -0.02 0.00 0.00 0.00 0.00 51.96 51.11 1pg8 s ALA 315 Cb -0.05 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 1pg8 s ALA 315 CO -0.00 0.37 0.10 -0.59 0.00 0.00 0.00 175.76 175.64 1pg8 s PHE 316 N -0.18 0.93 -0.13 0.00 -0.12 -0.37 -0.56 117.98 117.55 1pg8 s PHE 316 Ca -0.00 -1.25 0.02 0.00 -0.05 0.00 0.00 56.93 55.65 1pg8 s PHE 316 Cb -0.11 -0.47 0.01 0.00 -0.63 0.00 0.00 43.02 41.82 1pg8 s PHE 316 CO 0.02 -0.58 -0.20 -1.21 -0.05 0.00 0.00 175.22 173.20 1pg8 s GLU 317 N -4.08 2.73 0.04 1.99 2.02 -0.84 0.24 118.70 120.81 1pg8 s GLU 317 Ca 0.29 -0.75 -0.24 0.00 0.02 0.00 0.00 54.97 54.29 1pg8 s GLU 317 Cb 0.07 -2.23 -0.05 0.00 0.10 0.00 0.00 34.13 32.01 1pg8 s GLU 317 CO 0.05 -0.02 0.74 -0.51 0.02 0.00 0.00 175.26 175.54 1pg8 s LEU 318 N 0.86 4.45 0.38 1.80 1.43 -0.17 -0.18 118.68 127.24 1pg8 s LEU 318 Ca -0.07 1.40 0.13 0.00 -1.03 0.00 0.00 54.13 54.56 1pg8 s LEU 318 Cb -0.15 -3.18 0.95 0.00 0.03 0.00 0.00 46.19 43.84 1pg8 s LEU 318 CO -0.01 0.03 1.85 0.11 0.23 0.00 0.00 176.35 178.55 1pg8 h LYS 319 N 5.65 0.53 -0.11 1.70 1.57 -1.73 -3.07 116.57 121.11 1pg8 h LYS 319 Ca -0.44 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1pg8 h LYS 319 Cb 1.20 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1pg8 h LYS 319 CO 0.71 0.35 0.00 0.41 -0.57 0.00 0.00 179.45 180.34 1pg8 n GLY 320 N -1.46 -0.68 7.00 3.86 0.00 -1.26 -5.02 105.19 107.62 1pg8 n GLY 320 Ca 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1pg8 n GLY 320 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pg8 n GLY 321 N 0.49 0.59 0.35 -0.02 0.00 -1.16 -3.72 105.19 101.72 1pg8 n GLY 321 Ca 0.01 -0.79 0.11 0.00 0.00 0.00 0.00 46.02 45.34 1pg8 n GLY 321 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1pg8 h ILE 322 N 0.00 0.92 0.06 -0.61 2.10 -1.88 -2.71 117.51 115.38 1pg8 h ILE 322 Ca 0.00 -0.16 -0.13 0.00 1.08 0.00 0.00 64.86 65.65 1pg8 h ILE 322 Cb 0.00 0.41 0.01 0.00 -1.09 0.00 0.00 36.82 36.15 1pg8 h ILE 322 CO 0.00 0.09 -0.55 1.23 -1.08 0.00 0.00 178.15 177.84 1pg8 h GLY 323 N 0.47 0.30 -0.12 8.18 0.00 -1.87 -2.20 103.07 107.83 1pg8 h GLY 323 Ca 0.28 -0.65 0.04 0.00 0.00 0.00 0.00 47.33 47.00 1pg8 h GLY 323 CO -0.08 0.57 -0.51 0.00 0.00 0.00 0.00 176.54 176.51 1pg8 h ALA 324 N 0.17 -0.81 -0.97 3.60 0.00 -1.61 -1.20 119.26 118.44 1pg8 h ALA 324 Ca -0.09 -0.04 0.17 0.00 0.00 0.00 0.00 54.91 54.96 1pg8 h ALA 324 Cb 1.35 0.96 -0.09 0.00 0.00 0.00 0.00 17.79 20.02 1pg8 h ALA 324 CO 0.11 -1.05 0.61 0.78 0.00 0.00 0.00 179.25 179.70 1pg8 h GLY 325 N -0.55 1.50 1.06 0.00 0.00 -1.56 -0.36 103.07 103.16 1pg8 h GLY 325 Ca 0.05 -0.33 -0.09 0.00 0.00 0.00 0.00 47.33 46.96 1pg8 h GLY 325 CO -0.44 0.02 0.04 3.21 0.00 0.00 0.00 176.54 179.37 1pg8 h ARG 326 N 0.74 1.05 -0.01 4.80 3.08 -0.87 -2.35 114.38 120.81 1pg8 h ARG 326 Ca 0.52 -0.31 -0.23 0.00 0.07 0.00 0.00 59.98 60.03 1pg8 h ARG 326 Cb 0.84 -0.11 0.01 0.00 0.08 0.00 0.00 29.97 30.79 1pg8 h ARG 326 CO -0.29 1.01 -0.95 0.00 -1.07 0.00 0.00 179.97 178.67 1pg8 h ARG 327 N 0.95 0.49 0.23 0.04 3.08 -0.31 -2.37 114.38 116.49 1pg8 h ARG 327 Ca 0.18 -0.51 -0.01 0.00 0.07 0.00 0.00 59.98 59.71 1pg8 h ARG 327 Cb 0.51 0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 1pg8 h ARG 327 CO 0.02 1.15 -0.14 0.35 -1.07 0.00 0.00 179.97 180.28 1pg8 h PHE 328 N 0.28 -0.38 -0.17 3.04 3.57 -1.12 -2.00 116.94 120.17 1pg8 h PHE 328 Ca -0.09 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.41 1pg8 h PHE 328 Cb 1.58 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 40.45 1pg8 h PHE 328 CO 0.07 -0.23 0.11 0.52 -2.23 0.00 0.00 178.31 176.55 1pg8 h MET 329 N -0.37 0.22 0.00 1.11 2.86 -1.40 -2.32 114.93 115.04 1pg8 h MET 329 Ca -0.02 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1pg8 h MET 329 Cb 0.31 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.92 1pg8 h MET 329 CO 0.02 0.16 -0.00 -0.91 1.06 0.00 0.00 176.91 177.25 1pg8 h ASN 330 N 0.21 0.00 1.67 1.22 -0.26 -1.45 -2.30 115.58 114.66 1pg8 h ASN 330 Ca 0.06 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.80 1pg8 h ASN 330 Cb -0.00 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 1pg8 h ASN 330 CO -0.01 0.00 -0.08 0.00 -1.06 0.00 0.00 177.43 176.28 1pg8 h ALA 331 N 2.00 0.96 -2.77 -0.83 0.00 -0.80 -3.46 119.26 114.36 1pg8 h ALA 331 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 1pg8 h ALA 331 Cb 0.00 0.00 0.07 0.00 0.00 0.00 0.00 17.79 17.86 1pg8 h ALA 331 CO 0.00 0.00 0.81 -0.51 0.00 0.00 0.00 179.25 179.55 1pg8 s LEU 332 N -5.32 4.37 -0.00 0.00 1.43 -0.87 -4.73 118.68 113.55 1pg8 s LEU 332 Ca 0.08 2.78 0.01 0.00 -1.03 0.00 0.00 54.13 55.98 1pg8 s LEU 332 Cb 0.09 -3.63 -0.02 0.00 0.03 0.00 0.00 46.19 42.66 1pg8 s LEU 332 CO 0.65 -0.79 0.03 0.00 0.23 0.00 0.00 176.35 176.46 1pg8 n GLN 333 N 2.31 0.32 -0.05 1.70 6.02 -1.26 -4.87 117.38 121.54 1pg8 n GLN 333 Ca 0.07 -0.01 -0.06 0.00 -0.01 0.00 0.00 57.00 57.00 1pg8 n GLN 333 Cb 0.39 -1.03 -0.02 0.00 1.02 0.00 0.00 30.24 30.60 1pg8 n GLN 333 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1pg8 n LEU 334 N -1.59 1.37 -4.56 1.08 0.00 -1.26 -4.93 117.00 107.11 1pg8 n LEU 334 Ca -0.00 0.23 -0.52 0.00 0.00 0.00 0.00 56.01 55.71 1pg8 n LEU 334 Cb 0.07 -0.61 -0.05 0.00 0.00 0.00 0.00 43.42 42.83 1pg8 n LEU 334 CO 0.03 -0.39 0.73 0.49 0.00 0.00 0.00 177.39 178.25 1pg8 n PHE 335 N -3.86 1.16 -3.38 1.96 3.01 -1.26 -4.81 117.46 110.28 1pg8 n PHE 335 Ca -0.09 0.75 -0.35 0.00 1.01 0.00 0.00 57.45 58.78 1pg8 n PHE 335 Cb 0.33 -2.25 -0.06 0.00 -0.01 0.00 0.00 39.48 37.49 1pg8 n PHE 335 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1pg8 s SER 336 N 0.14 6.77 -0.67 4.37 0.01 -0.65 -4.87 113.70 118.80 1pg8 s SER 336 Ca 0.81 1.03 -0.26 0.00 1.31 0.00 0.00 55.95 58.83 1pg8 s SER 336 Cb -0.98 -2.27 0.04 0.00 0.21 0.00 0.00 66.02 63.02 1pg8 s SER 336 CO 0.51 0.07 1.16 -0.13 0.41 0.00 0.00 173.24 175.26 1pg8 s ARG 337 N -2.14 3.27 0.05 12.44 0.52 -1.26 -1.86 118.95 129.97 1pg8 s ARG 337 Ca 0.40 -0.23 -0.27 0.00 -0.52 0.00 0.00 55.73 55.11 1pg8 s ARG 337 Cb -0.14 -4.13 0.08 0.00 0.52 0.00 0.00 34.95 31.28 1pg8 s ARG 337 CO 0.19 -1.90 0.71 0.00 0.02 0.00 0.00 175.30 174.32 1pg8 s ALA 338 N 5.05 -1.71 0.73 2.13 0.00 -1.07 -4.98 121.76 121.91 1pg8 s ALA 338 Ca 0.34 0.90 -0.08 0.00 0.00 0.00 0.00 51.96 53.13 1pg8 s ALA 338 Cb -0.10 0.43 0.07 0.00 0.00 0.00 0.00 23.12 23.52 1pg8 s ALA 338 CO 0.17 -0.61 1.05 0.14 0.00 0.00 0.00 175.76 176.52 1pg8 s VAL 339 N -2.71 2.21 0.00 0.00 -7.23 -1.26 -4.15 120.40 107.26 1pg8 s VAL 339 Ca -0.02 -0.23 0.00 0.00 -1.81 0.00 0.00 61.98 59.92 1pg8 s VAL 339 Cb -0.01 -2.99 0.00 0.00 0.56 0.00 0.00 36.38 33.95 1pg8 s VAL 339 CO -0.05 0.00 0.00 -0.24 -0.31 0.00 0.00 175.10 174.50 1pg8 n SER 340 N -3.02 0.00 -3.63 4.85 2.88 -1.26 -5.02 113.62 108.42 1pg8 n SER 340 Ca 0.09 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.63 1pg8 n SER 340 Cb 0.60 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.06 1pg8 n SER 340 CO 0.00 0.00 0.00 -1.48 -1.23 0.00 0.00 175.04 172.33 1pg8 s LEU 341 N -0.40 -0.09 -0.07 2.46 0.05 -1.26 -4.83 118.68 114.54 1pg8 s LEU 341 Ca 0.00 -0.15 0.00 0.00 0.05 0.00 0.00 54.13 54.03 1pg8 s LEU 341 Cb 0.00 1.49 0.00 0.00 -2.05 0.00 0.00 46.19 45.63 1pg8 s LEU 341 CO 0.00 -0.37 0.00 0.61 -0.55 0.00 0.00 176.35 176.04 1pg8 n GLY 342 N -0.44 0.45 3.87 -3.48 0.00 -1.26 -4.32 105.19 100.01 1pg8 n GLY 342 Ca -0.07 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 1pg8 n GLY 342 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1pg8 s ASP 343 N -2.15 6.49 0.35 1.61 1.01 -1.26 -3.96 116.67 118.75 1pg8 s ASP 343 Ca 0.00 1.20 0.04 0.00 0.71 0.00 0.00 52.55 54.50 1pg8 s ASP 343 Cb 0.00 -2.36 0.67 0.00 1.01 0.00 0.00 42.92 42.24 1pg8 s ASP 343 CO 0.00 -0.48 1.98 0.00 0.21 0.00 0.00 175.17 176.87 1pg8 h ALA 344 N 0.97 1.61 -2.63 5.23 0.00 -1.68 -3.41 119.26 119.35 1pg8 h ALA 344 Ca -0.47 -0.03 -0.52 0.00 0.00 0.00 0.00 54.91 53.89 1pg8 h ALA 344 Cb 1.19 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1pg8 h ALA 344 CO 0.63 0.31 0.30 -1.83 0.00 0.00 0.00 179.25 178.66 1pg8 s GLU 345 N -5.73 4.67 0.20 0.00 1.03 -1.26 -1.24 118.70 116.38 1pg8 s GLU 345 Ca -0.10 1.35 -0.30 0.00 0.03 0.00 0.00 54.97 55.95 1pg8 s GLU 345 Cb 0.19 -3.35 -0.09 0.00 -0.80 0.00 0.00 34.13 30.08 1pg8 s GLU 345 CO 0.77 0.30 1.31 -1.12 -1.33 0.00 0.00 175.26 175.20 1pg8 s SER 346 N -0.28 6.89 0.21 0.83 0.01 -1.26 -4.65 113.70 115.44 1pg8 s SER 346 Ca 0.43 2.41 0.09 0.00 1.31 0.00 0.00 55.95 60.20 1pg8 s SER 346 Cb -0.23 -2.61 -0.05 0.00 0.21 0.00 0.00 66.02 63.34 1pg8 s SER 346 CO 0.28 -0.53 -0.18 -0.76 0.41 0.00 0.00 173.24 172.46 1pg8 s LEU 347 N -0.13 2.52 -0.06 2.44 1.43 -0.21 -1.63 118.68 123.04 1pg8 s LEU 347 Ca 0.57 -0.96 -0.08 0.00 -1.03 0.00 0.00 54.13 52.63 1pg8 s LEU 347 Cb -0.37 -0.86 0.02 0.00 0.03 0.00 0.00 46.19 45.01 1pg8 s LEU 347 CO 0.38 -0.06 0.21 0.00 0.23 0.00 0.00 176.35 177.12 1pg8 s ALA 348 N -2.47 -0.53 0.02 4.21 0.00 -0.78 -0.13 121.76 122.09 1pg8 s ALA 348 Ca 0.22 0.46 -0.06 0.00 0.00 0.00 0.00 51.96 52.58 1pg8 s ALA 348 Cb -0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 1pg8 s ALA 348 CO 0.09 -0.14 0.10 1.14 0.00 0.00 0.00 175.76 176.95 1pg8 s GLN 349 N -0.27 0.53 -0.47 0.00 -2.07 0.24 -2.60 119.66 115.02 1pg8 s GLN 349 Ca -0.04 -0.60 0.03 0.00 -1.82 0.00 0.00 55.36 52.92 1pg8 s GLN 349 Cb -0.03 0.21 0.14 0.00 -1.09 0.00 0.00 33.01 32.24 1pg8 s GLN 349 CO 0.01 -0.13 0.27 -1.58 -1.32 0.00 0.00 175.29 172.54 1pg8 s HIS 350 N -2.04 2.19 0.31 9.60 5.65 -1.26 -0.09 115.29 129.64 1pg8 s HIS 350 Ca -0.10 -2.58 0.07 0.00 0.25 0.00 0.00 55.06 52.71 1pg8 s HIS 350 Cb -0.04 -1.99 0.79 0.00 -1.18 0.00 0.00 32.58 30.15 1pg8 s HIS 350 CO -0.02 -0.76 1.76 -1.35 -0.65 0.00 0.00 174.74 173.72 1pg8 h PRO 351 N 6.52 0.69 -0.70 2.88 0.11 -1.93 -1.31 132.00 138.26 1pg8 h PRO 351 Ca 0.02 -0.04 0.11 0.00 0.11 0.00 0.00 66.00 66.20 1pg8 h PRO 351 Cb 0.91 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 31.82 1pg8 h PRO 351 CO 0.52 0.46 0.46 0.00 -0.21 0.00 0.00 178.00 179.22 1pg8 h ALA 352 N 1.67 1.98 -0.16 -0.75 0.00 -1.83 -0.54 119.26 119.63 1pg8 h ALA 352 Ca 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.50 1pg8 h ALA 352 Cb 1.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1pg8 h ALA 352 CO -0.41 -0.14 0.00 -1.13 0.00 0.00 0.00 179.25 177.57 1pg8 n SER 353 N -4.48 2.61 0.00 0.00 3.41 -0.55 -3.63 113.62 110.98 1pg8 n SER 353 Ca 0.12 -1.76 0.00 0.00 -0.26 0.00 0.00 58.87 56.97 1pg8 n SER 353 Cb 0.40 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 1pg8 n SER 353 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1pg8 n MET 354 N 0.91 0.00 -0.31 4.33 2.81 -0.87 -4.74 117.12 119.25 1pg8 n MET 354 Ca 0.11 0.00 0.02 0.00 -1.81 0.00 0.00 57.70 56.03 1pg8 n MET 354 Cb 0.43 0.00 0.08 0.00 -0.71 0.00 0.00 33.22 33.01 1pg8 n MET 354 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1pg8 n THR 355 N 0.00 -0.39 -1.39 2.03 -2.24 -1.24 -0.77 114.28 110.27 1pg8 n THR 355 Ca 0.00 1.92 -0.25 0.00 -2.27 0.00 0.00 64.05 63.45 1pg8 n THR 355 Cb 0.00 -2.60 0.13 0.00 -2.10 0.00 0.00 70.33 65.75 1pg8 n THR 355 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1pg8 n HIS 356 N -5.29 2.77 -0.02 4.78 8.25 -0.25 -4.67 115.22 120.78 1pg8 n HIS 356 Ca 0.11 -2.31 -0.17 0.00 -0.26 0.00 0.00 57.72 55.09 1pg8 n HIS 356 Cb 0.38 -1.00 -0.09 0.00 1.12 0.00 0.00 29.99 30.40 1pg8 n HIS 356 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1pg8 h SER 357 N 1.51 0.71 -0.04 0.41 4.64 -0.98 -3.09 113.55 116.72 1pg8 h SER 357 Ca 0.53 -0.66 0.01 0.00 -0.47 0.00 0.00 61.79 61.20 1pg8 h SER 357 Cb 1.73 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 63.60 1pg8 h SER 357 CO 1.14 1.26 0.03 -1.28 -0.87 0.00 0.00 176.83 177.11 1pg8 h SER 358 N 0.22 0.00 -3.31 4.97 0.87 -1.83 -3.45 113.55 111.02 1pg8 h SER 358 Ca -0.05 0.00 -0.41 0.00 -1.23 0.00 0.00 61.79 60.11 1pg8 h SER 358 Cb 1.26 0.00 0.20 0.00 -0.44 0.00 0.00 62.40 63.42 1pg8 h SER 358 CO 0.13 0.00 0.02 -0.31 -0.53 0.00 0.00 176.83 176.14 1pg8 s TYR 359 N -4.85 0.22 0.22 2.24 1.51 -1.17 -5.07 117.35 110.45 1pg8 s TYR 359 Ca -0.05 0.62 0.05 0.00 -1.01 0.00 0.00 57.07 56.68 1pg8 s TYR 359 Cb 0.16 -3.18 -0.03 0.00 -0.11 0.00 0.00 41.96 38.80 1pg8 s TYR 359 CO 0.61 -4.29 0.33 0.95 -1.11 0.00 0.00 175.55 172.04 1pg8 s THR 360 N -2.65 5.19 0.44 -0.71 -4.23 -1.26 -5.01 115.64 107.41 1pg8 s THR 360 Ca 0.69 -0.97 0.21 0.00 -1.18 0.00 0.00 61.69 60.45 1pg8 s THR 360 Cb -0.13 -3.79 0.41 0.00 1.34 0.00 0.00 72.50 70.33 1pg8 s THR 360 CO 0.58 -0.28 1.83 -0.65 -0.54 0.00 0.00 174.62 175.55 1pg8 h PRO 361 N 1.41 0.30 0.04 3.99 0.11 -1.97 -1.82 132.00 134.07 1pg8 h PRO 361 Ca -0.51 -0.02 -0.25 0.00 0.11 0.00 0.00 66.00 65.33 1pg8 h PRO 361 Cb 1.22 -0.07 0.01 0.00 0.11 0.00 0.00 31.00 32.27 1pg8 h PRO 361 CO 0.62 0.20 -1.05 0.93 -0.21 0.00 0.00 178.00 178.49 1pg8 h GLU 362 N 0.31 0.46 -0.11 1.05 3.07 -1.98 -2.78 114.58 114.60 1pg8 h GLU 362 Ca 0.51 -0.55 -0.13 0.00 -0.50 0.00 0.00 59.36 58.70 1pg8 h GLU 362 Cb 1.45 0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 29.52 1pg8 h GLU 362 CO -0.18 1.20 -0.48 0.93 -1.40 0.00 0.00 179.01 179.08 1pg8 h GLU 363 N 0.24 0.29 -0.22 2.33 5.08 -1.90 -2.43 114.58 117.97 1pg8 h GLU 363 Ca -0.11 -0.16 -0.06 0.00 -1.00 0.00 0.00 59.36 58.03 1pg8 h GLU 363 Cb 1.71 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.96 1pg8 h GLU 363 CO 0.19 0.71 -0.08 0.00 -1.00 0.00 0.00 179.01 178.83 1pg8 h ARG 364 N 0.23 0.44 0.00 2.33 3.08 -1.38 -2.96 114.38 116.13 1pg8 h ARG 364 Ca 0.01 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 59.86 1pg8 h ARG 364 Cb 0.94 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.97 1pg8 h ARG 364 CO 0.08 0.71 -0.07 0.00 -1.07 0.00 0.00 179.97 179.61 1pg8 h ALA 365 N 0.72 1.25 -0.45 0.04 0.00 -1.45 0.54 119.26 119.92 1pg8 h ALA 365 Ca 0.05 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 1pg8 h ALA 365 Cb 0.56 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1pg8 h ALA 365 CO 0.03 0.09 -0.16 1.25 0.00 0.00 0.00 179.25 180.45 1pg8 h HIS 366 N 0.00 0.96 -0.28 0.00 -0.00 -1.27 -2.96 115.15 111.60 1pg8 h HIS 366 Ca -0.00 -0.20 0.00 0.00 -0.00 0.00 0.00 60.37 60.16 1pg8 h HIS 366 Cb 0.25 -0.24 0.00 0.00 -0.00 0.00 0.00 27.41 27.43 1pg8 h HIS 366 CO 0.00 0.96 0.00 0.66 -0.00 0.00 0.00 177.93 179.55 1pg8 n TYR 367 N -4.13 0.37 -0.63 5.26 4.02 -1.03 -4.93 117.16 116.09 1pg8 n TYR 367 Ca 0.01 -0.19 0.00 0.00 -0.01 0.00 0.00 57.90 57.71 1pg8 n TYR 367 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.73 1pg8 n TYR 367 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1pg8 n GLY 368 N 1.14 0.65 3.41 2.72 0.00 -1.09 -4.97 105.19 107.05 1pg8 n GLY 368 Ca 0.15 -0.34 -0.44 0.00 0.00 0.00 0.00 46.02 45.39 1pg8 n GLY 368 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pg8 s ILE 369 N -2.00 5.20 0.73 -0.61 1.01 0.15 -4.89 121.20 120.79 1pg8 s ILE 369 Ca 0.00 -0.91 -0.14 0.00 0.00 0.00 0.00 60.65 59.60 1pg8 s ILE 369 Cb 0.00 -4.11 0.04 0.00 0.01 0.00 0.00 42.46 38.40 1pg8 s ILE 369 CO 0.00 -0.55 1.18 -0.55 0.00 0.00 0.00 174.94 175.02 1pg8 s SER 370 N 2.42 4.29 0.49 3.58 0.15 -1.26 -3.25 113.70 120.11 1pg8 s SER 370 Ca 0.06 2.26 0.32 0.00 0.70 0.00 0.00 55.95 59.28 1pg8 s SER 370 Cb -0.23 -2.58 1.38 0.00 -1.71 0.00 0.00 66.02 62.88 1pg8 s SER 370 CO 0.08 -2.20 1.95 -0.33 1.20 0.00 0.00 173.24 173.94 1pg8 h GLU 371 N -0.38 0.00 -0.09 5.44 4.39 -1.93 -3.06 114.58 118.95 1pg8 h GLU 371 Ca -0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1pg8 h GLU 371 Cb 1.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.93 1pg8 h GLU 371 CO 0.50 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.76 1pg8 n GLY 372 N -0.12 2.37 3.66 -3.84 0.00 -1.26 -2.78 105.19 103.21 1pg8 n GLY 372 Ca 0.01 -0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 1pg8 n GLY 372 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1pg8 s LEU 373 N -0.90 4.21 -0.09 0.99 2.96 -1.16 -1.00 118.68 123.70 1pg8 s LEU 373 Ca 0.07 1.96 0.02 0.00 -0.22 0.00 0.00 54.13 55.95 1pg8 s LEU 373 Cb 0.04 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 43.17 1pg8 s LEU 373 CO 0.05 -0.92 -0.13 -0.69 -1.32 0.00 0.00 176.35 173.35 1pg8 s VAL 374 N 4.01 3.16 -0.11 1.68 1.01 0.14 -3.98 120.40 126.31 1pg8 s VAL 374 Ca 0.67 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 62.00 1pg8 s VAL 374 Cb -0.28 -2.28 -0.01 0.00 0.00 0.00 0.00 36.38 33.80 1pg8 s VAL 374 CO 0.24 0.56 -0.15 -0.60 0.00 0.00 0.00 175.10 175.15 1pg8 s ARG 375 N -0.30 3.15 -0.15 2.72 3.52 0.86 -1.24 118.95 127.51 1pg8 s ARG 375 Ca 0.03 -0.72 0.00 0.00 -0.13 0.00 0.00 55.73 54.90 1pg8 s ARG 375 Cb -0.13 -2.52 -0.01 0.00 -1.56 0.00 0.00 34.95 30.74 1pg8 s ARG 375 CO 0.03 0.29 -0.14 -0.51 -0.81 0.00 0.00 175.30 174.15 1pg8 s LEU 376 N 0.14 2.55 -0.53 -0.88 1.43 -0.10 -0.59 118.68 120.70 1pg8 s LEU 376 Ca -0.08 -0.43 -0.19 0.00 -1.03 0.00 0.00 54.13 52.41 1pg8 s LEU 376 Cb -0.15 -1.58 0.07 0.00 0.03 0.00 0.00 46.19 44.57 1pg8 s LEU 376 CO 0.05 0.11 0.62 -0.55 0.23 0.00 0.00 176.35 176.81 1pg8 s SER 377 N 0.68 6.20 -0.05 2.29 0.15 0.81 -1.98 113.70 121.80 1pg8 s SER 377 Ca -0.07 -1.13 -0.30 0.00 0.70 0.00 0.00 55.95 55.15 1pg8 s SER 377 Cb -0.16 -2.28 -0.04 0.00 -1.71 0.00 0.00 66.02 61.84 1pg8 s SER 377 CO 0.02 -0.93 1.26 -0.69 1.20 0.00 0.00 173.24 174.10 1pg8 s VAL 378 N 2.52 4.11 0.07 4.45 1.01 -0.72 -1.04 120.40 130.80 1pg8 s VAL 378 Ca 0.13 1.44 0.00 0.00 0.00 0.00 0.00 61.98 63.55 1pg8 s VAL 378 Cb -0.21 -3.93 0.01 0.00 0.00 0.00 0.00 36.38 32.25 1pg8 s VAL 378 CO 0.09 -0.02 0.09 0.61 0.00 0.00 0.00 175.10 175.88 1pg8 n GLY 379 N 3.47 1.09 1.18 4.51 0.00 -1.26 -4.80 105.19 109.38 1pg8 n GLY 379 Ca 0.12 -2.01 0.07 0.00 0.00 0.00 0.00 46.02 44.20 1pg8 n GLY 379 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pg8 n LEU 380 N 0.00 3.45 -4.84 0.99 4.77 -0.37 -4.66 117.00 116.35 1pg8 n LEU 380 Ca 0.02 -1.74 -0.30 0.00 -0.03 0.00 0.00 56.01 53.95 1pg8 n LEU 380 Cb 0.06 -0.46 0.06 0.00 -2.33 0.00 0.00 43.42 40.75 1pg8 n LEU 380 CO 0.04 0.65 0.73 -1.61 -1.33 0.00 0.00 177.39 175.87 1pg8 s GLU 381 N -1.64 2.60 -0.11 3.23 8.01 -1.26 -4.96 118.70 124.58 1pg8 s GLU 381 Ca 0.37 0.64 -0.36 0.00 0.01 0.00 0.00 54.97 55.63 1pg8 s GLU 381 Cb 0.23 -1.98 -0.14 0.00 -4.31 0.00 0.00 34.13 27.94 1pg8 s GLU 381 CO 0.20 -1.26 1.76 -3.47 0.01 0.00 0.00 175.26 172.50 1pg8 n ASP 382 N -3.19 2.91 0.11 -0.19 4.64 -1.26 -4.87 116.55 114.71 1pg8 n ASP 382 Ca 0.07 1.03 0.12 0.00 -1.38 0.00 0.00 54.79 54.63 1pg8 n ASP 382 Cb 0.56 -1.29 0.62 0.00 -1.04 0.00 0.00 41.12 39.97 1pg8 n ASP 382 CO 0.00 0.00 0.00 -0.29 -0.82 0.00 0.00 177.20 176.09 1pg8 h ILE 383 N 4.99 0.92 -0.62 5.18 6.09 -1.96 -1.71 117.51 130.40 1pg8 h ILE 383 Ca -0.47 -0.04 -0.09 0.00 -1.37 0.00 0.00 64.86 62.89 1pg8 h ILE 383 Cb 1.29 0.80 -0.02 0.00 0.47 0.00 0.00 36.82 39.35 1pg8 h ILE 383 CO 0.93 0.02 0.05 0.44 -3.07 0.00 0.00 178.15 176.52 1pg8 h ASP 384 N 0.11 1.02 -0.25 2.19 3.45 -1.99 0.16 116.42 121.11 1pg8 h ASP 384 Ca 0.13 -0.28 -0.02 0.00 0.43 0.00 0.00 57.03 57.28 1pg8 h ASP 384 Cb 0.37 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.86 1pg8 h ASP 384 CO -0.01 1.05 0.08 0.44 -1.57 0.00 0.00 179.24 179.23 1pg8 h ASP 385 N 0.96 0.37 -0.72 6.45 3.32 -1.70 -1.97 116.42 123.13 1pg8 h ASP 385 Ca 0.18 -0.20 0.07 0.00 0.02 0.00 0.00 57.03 57.11 1pg8 h ASP 385 Cb 0.50 -0.10 -0.06 0.00 0.22 0.00 0.00 39.33 39.89 1pg8 h ASP 385 CO 0.02 0.47 0.39 -0.07 -1.72 0.00 0.00 179.24 178.33 1pg8 h LEU 386 N 0.25 0.56 -0.28 1.55 3.38 -1.47 -2.07 115.31 117.24 1pg8 h LEU 386 Ca 0.08 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1pg8 h LEU 386 Cb 0.23 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1pg8 h LEU 386 CO -0.00 0.34 0.15 -0.07 0.09 0.00 0.00 178.44 178.95 1pg8 h LEU 387 N 0.69 0.35 -0.70 1.67 3.38 -0.83 -1.33 115.31 118.56 1pg8 h LEU 387 Ca 0.33 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 1pg8 h LEU 387 Cb 0.27 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 1pg8 h LEU 387 CO -0.22 0.35 0.43 0.00 0.09 0.00 0.00 178.44 179.09 1pg8 h ALA 388 N 1.02 0.89 -0.24 1.53 0.00 -1.08 -0.24 119.26 121.13 1pg8 h ALA 388 Ca 0.10 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1pg8 h ALA 388 Cb 0.08 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1pg8 h ALA 388 CO -0.01 0.34 0.00 0.22 0.00 0.00 0.00 179.25 179.80 1pg8 h ASP 389 N 0.95 0.42 0.12 0.00 -0.00 -1.30 -2.01 116.42 114.60 1pg8 h ASP 389 Ca 0.25 -0.31 -0.01 0.00 -0.00 0.00 0.00 57.03 56.97 1pg8 h ASP 389 Cb -0.05 -0.11 0.00 0.00 -0.00 0.00 0.00 39.33 39.17 1pg8 h ASP 389 CO -0.05 0.63 -0.06 0.58 -0.00 0.00 0.00 179.24 180.34 1pg8 h VAL 390 N 0.20 0.91 -0.97 2.25 2.07 -0.96 -2.47 116.25 117.29 1pg8 h VAL 390 Ca 0.07 -0.11 0.17 0.00 0.82 0.00 0.00 66.70 67.65 1pg8 h VAL 390 Cb 0.41 0.99 -0.17 0.00 -1.52 0.00 0.00 31.29 31.00 1pg8 h VAL 390 CO 0.01 0.03 -0.31 -0.61 0.02 0.00 0.00 177.57 176.71 1pg8 h GLN 391 N -0.21 -0.01 -0.10 1.57 -0.00 -1.01 0.22 115.11 115.58 1pg8 h GLN 391 Ca -0.02 0.00 -0.22 0.00 -0.00 0.00 0.00 58.65 58.42 1pg8 h GLN 391 Cb 0.17 0.00 0.01 0.00 0.00 0.00 0.00 27.48 27.65 1pg8 h GLN 391 CO 0.03 -0.01 -0.82 0.37 0.00 0.00 0.00 178.83 178.41 1pg8 h GLN 392 N -0.01 0.62 0.00 1.69 -0.00 -1.19 -2.57 115.11 113.66 1pg8 h GLN 392 Ca 0.40 -0.54 -0.08 0.00 -0.00 0.00 0.00 58.65 58.42 1pg8 h GLN 392 Cb 0.65 0.12 -0.01 0.00 0.00 0.00 0.00 27.48 28.24 1pg8 h GLN 392 CO -0.98 1.16 -0.40 0.00 0.00 0.00 0.00 178.83 178.61 1pg8 h ALA 393 N 0.67 1.07 -0.39 3.38 0.00 -0.95 -2.20 119.26 120.83 1pg8 h ALA 393 Ca -0.06 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.42 1pg8 h ALA 393 Cb 1.43 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1pg8 h ALA 393 CO 0.16 0.50 -0.02 -0.07 0.00 0.00 0.00 179.25 179.82 1pg8 h LEU 394 N 0.00 0.69 -0.84 0.00 3.38 -0.64 -1.64 115.31 116.26 1pg8 h LEU 394 Ca -0.00 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.59 1pg8 h LEU 394 Cb 0.85 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 1pg8 h LEU 394 CO 0.05 0.84 0.18 0.11 0.09 0.00 0.00 178.44 179.72 1pg8 h LYS 395 N 0.53 1.04 0.00 1.13 1.57 -1.11 -2.17 116.57 117.56 1pg8 h LYS 395 Ca 0.11 -0.23 -0.03 0.00 -1.87 0.00 0.00 60.65 58.63 1pg8 h LYS 395 Cb 0.50 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 1pg8 h LYS 395 CO 0.02 0.91 -0.15 0.00 -0.57 0.00 0.00 179.45 179.66 1pg8 h ALA 396 N 1.19 1.00 0.00 3.86 0.00 -1.38 -3.14 119.26 120.80 1pg8 h ALA 396 Ca 0.21 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1pg8 h ALA 396 Cb 0.32 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1pg8 h ALA 396 CO -0.00 0.19 0.00 -1.13 0.00 0.00 0.00 179.25 178.31 1pg8 n SER 397 N -3.28 0.00 -0.22 0.00 3.41 -0.62 -4.69 113.62 108.21 1pg8 n SER 397 Ca 0.01 0.31 0.15 0.00 -0.26 0.00 0.00 58.87 59.08 1pg8 n SER 397 Cb 0.41 -0.33 0.75 0.00 -0.26 0.00 0.00 64.21 64.78 1pg8 n SER 397 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88