#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ji8 s GLU 8 N 0.00 4.46 0.01 5.55 2.12 -1.26 -5.01 118.70 124.57 2ji8 s GLU 8 Ca 0.00 1.34 0.06 0.00 0.36 0.00 0.00 54.97 56.73 2ji8 s GLU 8 Cb 0.00 -2.67 -0.02 0.00 0.26 0.00 0.00 34.13 31.70 2ji8 s GLU 8 CO 0.00 0.16 -0.18 -0.51 -0.54 0.00 0.00 175.26 174.18 2ji8 s LEU 9 N -2.31 2.08 0.51 2.70 1.43 -1.26 -1.71 118.68 120.12 2ji8 s LEU 9 Ca 0.53 -0.39 0.03 0.00 -1.03 0.00 0.00 54.13 53.27 2ji8 s LEU 9 Cb -0.18 -0.92 -0.00 0.00 0.03 0.00 0.00 46.19 45.12 2ji8 s LEU 9 CO 0.23 0.19 0.15 0.28 0.23 0.00 0.00 176.35 177.43 2ji8 s THR 10 N -0.57 1.45 0.29 5.49 -1.32 -0.45 -4.80 115.64 115.73 2ji8 s THR 10 Ca 0.07 -1.80 0.02 0.00 -1.21 0.00 0.00 61.69 58.77 2ji8 s THR 10 Cb -0.08 -2.26 -0.04 0.00 -1.51 0.00 0.00 72.50 68.61 2ji8 s THR 10 CO 0.00 0.00 0.13 1.51 -2.21 0.00 0.00 174.62 174.05 2ji8 s ASP 11 N -4.01 1.38 0.39 8.08 1.47 -1.26 -2.40 116.67 120.32 2ji8 s ASP 11 Ca 0.19 -1.48 0.13 0.00 1.18 0.00 0.00 52.55 52.57 2ji8 s ASP 11 Cb 0.01 0.30 0.95 0.00 -0.34 0.00 0.00 42.92 43.83 2ji8 s ASP 11 CO 0.11 -0.82 1.88 1.23 0.68 0.00 0.00 175.17 178.25 2ji8 h GLY 12 N 2.28 0.99 0.69 2.12 0.00 -0.84 -1.22 103.07 107.10 2ji8 h GLY 12 Ca -0.36 -0.24 0.03 0.00 0.00 0.00 0.00 47.33 46.77 2ji8 h GLY 12 CO 0.56 0.06 -0.03 0.74 0.00 0.00 0.00 176.54 177.86 2ji8 h PHE 13 N 0.54 -0.06 0.01 5.60 0.04 -1.79 -2.00 116.94 119.28 2ji8 h PHE 13 Ca 0.43 0.01 -0.22 0.00 2.80 0.00 0.00 57.97 61.00 2ji8 h PHE 13 Cb 0.86 0.05 -0.03 0.00 2.20 0.00 0.00 35.95 39.04 2ji8 h PHE 13 CO -0.00 -0.06 -1.02 0.45 -0.60 0.00 0.00 178.31 177.08 2ji8 h HIS 14 N 0.02 0.05 -0.45 -0.55 3.86 -1.74 -1.42 115.15 114.93 2ji8 h HIS 14 Ca 0.08 -0.04 -0.13 0.00 -1.16 0.00 0.00 60.37 59.12 2ji8 h HIS 14 Cb 0.11 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.57 2ji8 h HIS 14 CO -0.18 1.03 -0.22 0.28 0.86 0.00 0.00 177.93 179.70 2ji8 h VAL 15 N 0.01 1.27 -0.29 2.45 2.07 -1.24 0.83 116.25 121.34 2ji8 h VAL 15 Ca -0.02 -1.37 -0.02 0.00 0.82 0.00 0.00 66.70 66.10 2ji8 h VAL 15 Cb 1.78 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 32.74 2ji8 h VAL 15 CO 0.14 0.47 0.10 0.25 0.02 0.00 0.00 177.57 178.54 2ji8 h LEU 16 N 0.78 0.42 -0.22 2.57 5.85 -1.34 0.71 115.31 124.08 2ji8 h LEU 16 Ca 0.10 -0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.67 2ji8 h LEU 16 Cb 0.79 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.67 2ji8 h LEU 16 CO 0.07 0.51 -0.06 0.40 -0.34 0.00 0.00 178.44 179.01 2ji8 h ILE 17 N 0.32 0.76 -0.57 4.05 2.04 -1.17 -0.18 117.51 122.76 2ji8 h ILE 17 Ca 0.10 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.90 2ji8 h ILE 17 Cb 0.23 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2ji8 h ILE 17 CO -0.00 0.00 0.14 0.44 0.00 0.00 0.00 178.15 178.72 2ji8 h ASP 18 N -0.01 0.87 -0.65 1.72 3.32 -0.76 -1.51 116.42 119.41 2ji8 h ASP 18 Ca 0.11 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 2ji8 h ASP 18 Cb 0.17 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 2ji8 h ASP 18 CO -0.23 0.87 0.36 0.00 -1.72 0.00 0.00 179.24 178.52 2ji8 h ALA 19 N 1.02 0.83 -0.51 3.45 0.00 -0.62 0.10 119.26 123.53 2ji8 h ALA 19 Ca 0.18 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2ji8 h ALA 19 Cb 0.35 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2ji8 h ALA 19 CO 0.00 0.33 0.18 -0.07 0.00 0.00 0.00 179.25 179.69 2ji8 h LEU 20 N 0.88 0.73 -1.17 0.00 3.38 -0.92 -2.60 115.31 115.61 2ji8 h LEU 20 Ca 0.23 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 2ji8 h LEU 20 Cb 0.03 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2ji8 h LEU 20 CO -0.04 0.72 -0.12 0.11 0.09 0.00 0.00 178.44 179.21 2ji8 h LYS 21 N 0.69 0.43 -0.08 1.13 1.57 -0.89 -1.72 116.57 117.69 2ji8 h LYS 21 Ca 0.17 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 58.73 2ji8 h LYS 21 Cb 0.25 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2ji8 h LYS 21 CO -0.01 0.55 -0.38 1.98 -0.57 0.00 0.00 179.45 181.02 2ji8 h MET 22 N 0.40 0.17 -0.72 3.15 4.05 -0.59 -1.54 114.93 119.85 2ji8 h MET 22 Ca 0.08 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2ji8 h MET 22 Cb 0.46 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.25 2ji8 h MET 22 CO 0.03 0.54 0.00 0.09 0.23 0.00 0.00 176.91 177.79 2ji8 n ASN 23 N -4.06 2.99 -0.82 1.39 3.02 -0.99 -4.77 115.26 112.03 2ji8 n ASN 23 Ca -0.01 -2.36 -0.10 0.00 -0.03 0.00 0.00 54.58 52.08 2ji8 n ASN 23 Cb 0.45 -0.52 -0.03 0.00 -0.61 0.00 0.00 39.78 39.06 2ji8 n ASN 23 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2ji8 n ASP 24 N 0.34 -4.01 -4.65 6.41 8.00 -0.58 -5.01 116.55 117.04 2ji8 n ASP 24 Ca 0.13 0.19 -0.41 0.00 0.71 0.00 0.00 54.79 55.41 2ji8 n ASP 24 Cb 0.62 -2.54 -0.05 0.00 -0.02 0.00 0.00 41.12 39.14 2ji8 n ASP 24 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2ji8 s ILE 25 N -2.39 4.91 0.00 0.53 -1.09 -0.68 -4.90 121.20 117.58 2ji8 s ILE 25 Ca 0.00 1.45 0.00 0.00 -2.23 0.00 0.00 60.65 59.87 2ji8 s ILE 25 Cb 0.00 -4.06 0.00 0.00 -1.58 0.00 0.00 42.46 36.82 2ji8 s ILE 25 CO 0.00 0.01 0.66 -0.90 -1.23 0.00 0.00 174.94 173.48 2ji8 n ASP 26 N 5.50 1.28 -3.84 3.58 5.68 -1.26 -3.91 116.55 123.58 2ji8 n ASP 26 Ca 0.03 -1.38 -0.13 0.00 -0.50 0.00 0.00 54.79 52.81 2ji8 n ASP 26 Cb 0.49 0.00 -0.14 0.00 -1.14 0.00 0.00 41.12 40.32 2ji8 n ASP 26 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2ji8 s THR 27 N -0.38 -0.02 0.12 2.12 2.01 -1.26 -1.54 115.64 116.70 2ji8 s THR 27 Ca 0.00 0.06 0.06 0.00 0.31 0.00 0.00 61.69 62.12 2ji8 s THR 27 Cb 0.00 -0.05 -0.04 0.00 0.01 0.00 0.00 72.50 72.42 2ji8 s THR 27 CO 0.00 0.02 -0.14 -0.04 -0.69 0.00 0.00 174.62 173.77 2ji8 s MET 28 N 0.29 1.04 -0.10 4.92 -1.94 -0.63 -4.46 119.30 118.42 2ji8 s MET 28 Ca -0.02 -1.24 0.04 0.00 -1.71 0.00 0.00 55.69 52.75 2ji8 s MET 28 Cb -0.03 -0.94 0.00 0.00 2.01 0.00 0.00 34.83 35.87 2ji8 s MET 28 CO -0.01 0.18 -0.22 0.71 -0.01 0.00 0.00 175.02 175.67 2ji8 s TYR 29 N -2.10 2.39 0.04 -0.03 2.02 -0.51 -1.69 117.35 117.47 2ji8 s TYR 29 Ca 0.09 -0.99 -0.03 0.00 -0.37 0.00 0.00 57.07 55.77 2ji8 s TYR 29 Cb -0.05 -1.61 0.01 0.00 -0.40 0.00 0.00 41.96 39.90 2ji8 s TYR 29 CO 0.03 -0.41 0.13 0.41 -1.57 0.00 0.00 175.55 174.14 2ji8 n GLY 30 N 3.62 1.45 2.83 0.71 0.00 0.12 -0.97 105.19 112.95 2ji8 n GLY 30 Ca -0.20 -0.98 -0.14 0.00 0.00 0.00 0.00 46.02 44.70 2ji8 n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ji8 s VAL 31 N -2.64 -0.05 0.00 1.61 1.01 -1.07 -0.29 120.40 118.97 2ji8 s VAL 31 Ca 0.03 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.18 2ji8 s VAL 31 Cb -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 36.38 36.25 2ji8 s VAL 31 CO 0.01 0.07 0.00 1.33 0.00 0.00 0.00 175.10 176.51 2ji8 n VAL 32 N 4.02 0.00 0.00 2.92 0.24 -1.26 -4.25 118.33 119.99 2ji8 n VAL 32 Ca -0.25 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.05 2ji8 n VAL 32 Cb 0.52 -1.56 0.00 0.00 -1.47 0.00 0.00 33.84 31.33 2ji8 n VAL 32 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ji8 n GLY 33 N 5.00 2.28 3.75 7.63 0.00 -1.26 -4.83 105.19 117.76 2ji8 n GLY 33 Ca 0.00 -2.15 -0.41 0.00 0.00 0.00 0.00 46.02 43.45 2ji8 n GLY 33 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ji8 s ILE 34 N -1.81 2.25 -0.29 -0.61 1.01 -1.26 -1.51 121.20 118.98 2ji8 s ILE 34 Ca 0.00 0.21 0.11 0.00 0.00 0.00 0.00 60.65 60.96 2ji8 s ILE 34 Cb 0.00 -3.13 0.61 0.00 0.01 0.00 0.00 42.46 39.94 2ji8 s ILE 34 CO 0.00 0.03 1.62 -0.81 0.00 0.00 0.00 174.94 175.78 2ji8 n PRO 35 N 2.21 2.74 -0.09 2.79 -0.04 -1.26 -4.14 135.00 137.22 2ji8 n PRO 35 Ca 0.08 -3.05 0.04 0.00 -0.04 0.00 0.00 63.50 60.53 2ji8 n PRO 35 Cb 0.38 -1.99 0.09 0.00 -0.04 0.00 0.00 33.50 31.94 2ji8 n PRO 35 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 2ji8 n ILE 36 N -0.68 0.67 -0.03 0.52 -6.64 -0.57 -4.71 119.36 107.92 2ji8 n ILE 36 Ca 0.36 -0.83 -0.10 0.00 -1.77 0.00 0.00 62.75 60.40 2ji8 n ILE 36 Cb 1.19 0.72 -0.04 0.00 -1.44 0.00 0.00 39.64 40.07 2ji8 n ILE 36 CO 0.00 0.00 0.00 0.74 -1.77 0.00 0.00 176.55 175.52 2ji8 h THR 37 N 1.51 1.08 0.00 7.28 2.02 -1.85 -2.32 112.91 120.62 2ji8 h THR 37 Ca 0.00 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 66.96 2ji8 h THR 37 Cb 0.56 0.90 -0.00 0.00 -1.74 0.00 0.00 68.15 67.86 2ji8 h THR 37 CO 0.00 0.07 -0.14 0.78 0.37 0.00 0.00 175.52 176.61 2ji8 h ASN 38 N 0.20 0.00 -0.24 4.18 2.35 -1.90 -0.25 115.58 119.92 2ji8 h ASN 38 Ca 0.06 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.79 2ji8 h ASN 38 Cb 0.03 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2ji8 h ASN 38 CO -0.01 0.14 0.09 0.25 -1.65 0.00 0.00 177.43 176.24 2ji8 h LEU 39 N 0.00 0.33 -0.30 1.61 5.85 -1.81 -1.94 115.31 119.05 2ji8 h LEU 39 Ca -0.00 -0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.56 2ji8 h LEU 39 Cb 0.68 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 2ji8 h LEU 39 CO 0.02 0.43 0.12 0.00 -0.34 0.00 0.00 178.44 178.66 2ji8 h ALA 40 N 0.92 0.35 -0.14 1.25 0.00 -0.74 -0.83 119.26 120.07 2ji8 h ALA 40 Ca 0.08 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.02 2ji8 h ALA 40 Cb 0.20 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2ji8 h ALA 40 CO -0.00 -0.28 0.05 0.00 0.00 0.00 0.00 179.25 179.02 2ji8 h ARG 41 N 0.26 0.12 -0.14 0.00 3.08 -1.10 -2.91 114.38 113.70 2ji8 h ARG 41 Ca 0.13 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 60.07 2ji8 h ARG 41 Cb 0.08 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 2ji8 h ARG 41 CO -0.12 0.08 -0.36 0.52 -1.07 0.00 0.00 179.97 179.03 2ji8 h MET 42 N 0.13 0.28 -0.58 0.04 2.86 -1.17 0.37 114.93 116.86 2ji8 h MET 42 Ca 0.06 -0.12 0.11 0.00 -2.06 0.00 0.00 59.70 57.68 2ji8 h MET 42 Cb 0.02 -0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.59 2ji8 h MET 42 CO -0.05 0.61 0.12 2.35 1.06 0.00 0.00 176.91 181.00 2ji8 h TRP 43 N 0.24 0.20 -0.09 -0.22 2.91 -1.01 -0.13 115.95 117.85 2ji8 h TRP 43 Ca 0.03 0.03 -0.16 0.00 1.13 0.00 0.00 58.89 59.93 2ji8 h TRP 43 Cb 0.75 0.00 0.01 0.00 -0.51 0.00 0.00 29.16 29.41 2ji8 h TRP 43 CO 0.01 -0.02 -0.55 1.96 -1.03 0.00 0.00 178.44 178.81 2ji8 h GLN 44 N 0.26 0.54 -0.66 2.65 4.20 -1.16 -2.00 115.11 118.94 2ji8 h GLN 44 Ca 0.30 -0.45 0.12 0.00 0.06 0.00 0.00 58.65 58.67 2ji8 h GLN 44 Cb 0.43 0.10 -0.09 0.00 0.30 0.00 0.00 27.48 28.23 2ji8 h GLN 44 CO -0.38 1.08 0.21 -0.44 -0.67 0.00 0.00 178.83 178.63 2ji8 h ASP 45 N 0.14 0.15 0.18 1.46 3.32 -0.81 -1.47 116.42 119.39 2ji8 h ASP 45 Ca -0.04 0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 2ji8 h ASP 45 Cb 1.20 0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.86 2ji8 h ASP 45 CO 0.11 0.07 -0.10 -0.78 -1.72 0.00 0.00 179.24 176.83 2ji8 h ASP 46 N 0.36 0.00 0.00 6.45 3.58 -0.97 -3.46 116.42 122.38 2ji8 h ASP 46 Ca 0.35 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.80 2ji8 h ASP 46 Cb 0.50 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.55 2ji8 h ASP 46 CO -0.38 0.10 0.00 0.61 -2.88 0.00 0.00 179.24 176.69 2ji8 n GLY 47 N -1.03 1.93 3.77 -0.78 0.00 -0.55 -5.11 105.19 103.41 2ji8 n GLY 47 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 2ji8 n GLY 47 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ji8 s GLN 48 N -0.01 2.58 0.00 1.61 -1.52 -0.77 -5.01 119.66 116.55 2ji8 s GLN 48 Ca 0.00 -1.35 -0.24 0.00 -1.95 0.00 0.00 55.36 51.83 2ji8 s GLN 48 Cb 0.00 -2.34 -0.05 0.00 -0.22 0.00 0.00 33.01 30.40 2ji8 s GLN 48 CO 0.00 0.21 0.71 1.03 -0.25 0.00 0.00 175.29 176.99 2ji8 s ARG 49 N -3.86 4.44 -0.11 2.91 0.52 -0.59 -4.00 118.95 118.26 2ji8 s ARG 49 Ca 0.37 0.95 0.02 0.00 -0.52 0.00 0.00 55.73 56.54 2ji8 s ARG 49 Cb -0.05 -3.38 0.01 0.00 0.52 0.00 0.00 34.95 32.05 2ji8 s ARG 49 CO 0.24 0.23 -0.16 0.12 0.02 0.00 0.00 175.30 175.75 2ji8 s PHE 50 N 0.18 2.02 -0.38 -0.53 5.36 -1.26 -1.60 117.98 121.76 2ji8 s PHE 50 Ca 0.37 -0.92 -0.11 0.00 -0.96 0.00 0.00 56.93 55.30 2ji8 s PHE 50 Cb -0.19 -1.44 0.03 0.00 -0.34 0.00 0.00 43.02 41.08 2ji8 s PHE 50 CO 0.20 -0.46 0.22 0.71 -1.46 0.00 0.00 175.22 174.43 2ji8 s TYR 51 N 0.88 3.25 0.14 10.12 2.02 -0.68 -5.00 117.35 128.08 2ji8 s TYR 51 Ca -0.09 -0.98 -0.28 0.00 -0.37 0.00 0.00 57.07 55.35 2ji8 s TYR 51 Cb -0.15 -2.49 -0.07 0.00 -0.40 0.00 0.00 41.96 38.84 2ji8 s TYR 51 CO -0.00 -0.66 0.88 -1.12 -1.57 0.00 0.00 175.55 173.08 2ji8 s SER 52 N 1.61 7.46 0.51 2.29 0.01 -1.26 -0.70 113.70 123.62 2ji8 s SER 52 Ca 0.02 1.74 0.03 0.00 1.31 0.00 0.00 55.95 59.04 2ji8 s SER 52 Cb -0.20 -2.55 0.03 0.00 0.21 0.00 0.00 66.02 63.51 2ji8 s SER 52 CO 0.07 0.05 0.21 0.49 0.41 0.00 0.00 173.24 174.47 2ji8 n PHE 53 N 2.26 0.19 0.64 2.43 3.01 0.61 -4.93 117.46 121.67 2ji8 n PHE 53 Ca -0.01 -2.32 0.11 0.00 1.01 0.00 0.00 57.45 56.24 2ji8 n PHE 53 Cb 0.49 -0.38 0.04 0.00 -0.01 0.00 0.00 39.48 39.61 2ji8 n PHE 53 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2ji8 n ARG 54 N -1.50 0.24 -3.61 -1.08 5.12 -1.26 -4.80 116.66 109.76 2ji8 n ARG 54 Ca -0.10 -0.00 -0.15 0.00 -1.93 0.00 0.00 57.85 55.66 2ji8 n ARG 54 Cb 0.61 -1.58 -0.07 0.00 -1.16 0.00 0.00 32.46 30.26 2ji8 n ARG 54 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 2ji8 s HIS 55 N -3.16 -0.67 0.04 -1.55 2.46 -1.26 -5.06 115.29 106.10 2ji8 s HIS 55 Ca 0.05 1.45 0.23 0.00 0.47 0.00 0.00 55.06 57.26 2ji8 s HIS 55 Cb 0.15 0.29 0.78 0.00 -0.13 0.00 0.00 32.58 33.67 2ji8 s HIS 55 CO 0.80 -0.44 1.76 0.93 -2.47 0.00 0.00 174.74 175.32 2ji8 h GLU 56 N 4.30 0.00 -0.74 2.88 3.07 -1.90 -2.96 114.58 119.23 2ji8 h GLU 56 Ca -0.28 0.00 0.08 0.00 -0.50 0.00 0.00 59.36 58.66 2ji8 h GLU 56 Cb 1.16 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 29.00 2ji8 h GLU 56 CO 0.21 0.23 0.41 0.37 -1.40 0.00 0.00 179.01 178.83 2ji8 h GLN 57 N 0.00 0.70 0.00 2.33 4.15 -1.90 -0.24 115.11 120.15 2ji8 h GLN 57 Ca -0.00 -0.04 -0.22 0.00 0.77 0.00 0.00 58.65 59.16 2ji8 h GLN 57 Cb 0.84 -0.16 -0.03 0.00 0.21 0.00 0.00 27.48 28.34 2ji8 h GLN 57 CO 0.03 0.46 -1.09 0.45 -1.93 0.00 0.00 178.83 176.76 2ji8 h HIS 58 N 0.72 0.00 -0.94 3.99 3.86 -1.87 0.15 115.15 121.07 2ji8 h HIS 58 Ca 0.35 -0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.61 2ji8 h HIS 58 Cb 0.28 -0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.69 2ji8 h HIS 58 CO -0.08 1.00 0.61 0.00 0.86 0.00 0.00 177.93 180.33 2ji8 h ALA 59 N 1.00 1.47 -0.03 2.45 0.00 -1.44 -1.91 119.26 120.80 2ji8 h ALA 59 Ca -0.04 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.66 2ji8 h ALA 59 Cb 1.80 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 19.32 2ji8 h ALA 59 CO 0.12 0.40 -0.69 0.78 0.00 0.00 0.00 179.25 179.86 2ji8 h GLY 60 N 1.09 0.58 1.13 0.00 0.00 -0.61 -2.40 103.07 102.86 2ji8 h GLY 60 Ca 0.40 -0.96 0.06 0.00 0.00 0.00 0.00 47.33 46.84 2ji8 h GLY 60 CO -0.15 0.85 0.43 -0.97 0.00 0.00 0.00 176.54 176.70 2ji8 h TYR 61 N 0.09 0.67 0.43 5.60 0.05 -0.93 -0.43 116.97 122.45 2ji8 h TYR 61 Ca -0.08 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.70 2ji8 h TYR 61 Cb 1.37 -0.22 0.00 0.00 1.01 0.00 0.00 36.73 38.90 2ji8 h TYR 61 CO 0.13 0.36 -0.21 0.00 -1.05 0.00 0.00 178.16 177.39 2ji8 h ALA 62 N 1.64 -0.58 -0.76 3.88 0.00 -1.33 -2.26 119.26 119.85 2ji8 h ALA 62 Ca 0.28 -0.15 0.13 0.00 0.00 0.00 0.00 54.91 55.17 2ji8 h ALA 62 Cb 0.26 0.23 -0.09 0.00 0.00 0.00 0.00 17.79 18.18 2ji8 h ALA 62 CO -0.09 -0.79 0.34 0.00 0.00 0.00 0.00 179.25 178.72 2ji8 h ALA 63 N -0.14 1.08 -0.40 0.00 0.00 -1.09 -0.94 119.26 117.78 2ji8 h ALA 63 Ca -0.06 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2ji8 h ALA 63 Cb 0.49 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2ji8 h ALA 63 CO 0.10 -0.15 0.26 0.66 0.00 0.00 0.00 179.25 180.12 2ji8 h SER 64 N 0.51 0.46 1.50 0.00 4.64 -0.87 -1.86 113.55 117.94 2ji8 h SER 64 Ca 0.41 -0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 61.62 2ji8 h SER 64 Cb 0.57 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.54 2ji8 h SER 64 CO -0.36 0.34 -0.44 -0.29 -0.87 0.00 0.00 176.83 175.21 2ji8 h ILE 65 N 0.54 0.76 -0.92 0.95 6.09 -1.02 -2.71 117.51 121.20 2ji8 h ILE 65 Ca 0.15 -2.03 -0.01 0.00 -1.37 0.00 0.00 64.86 61.59 2ji8 h ILE 65 Cb -0.05 2.34 -0.04 0.00 0.47 0.00 0.00 36.82 39.53 2ji8 h ILE 65 CO -0.03 0.43 0.53 0.00 -3.07 0.00 0.00 178.15 176.01 2ji8 h ALA 66 N 1.56 1.20 -0.05 0.18 0.00 -0.85 -1.32 119.26 119.98 2ji8 h ALA 66 Ca -0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2ji8 h ALA 66 Cb 1.31 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 2ji8 h ALA 66 CO 0.06 0.67 0.03 0.78 0.00 0.00 0.00 179.25 180.78 2ji8 h GLY 67 N 1.29 0.07 0.34 0.00 0.00 -1.26 -1.59 103.07 101.92 2ji8 h GLY 67 Ca 0.33 -0.03 0.05 0.00 0.00 0.00 0.00 47.33 47.67 2ji8 h GLY 67 CO -0.06 0.03 -0.22 -1.82 0.00 0.00 0.00 176.54 174.47 2ji8 h TYR 68 N 0.00 -0.58 -0.40 5.60 3.20 -1.34 0.87 116.97 124.32 2ji8 h TYR 68 Ca 0.02 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.86 2ji8 h TYR 68 Cb 0.07 0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 2ji8 h TYR 68 CO -0.05 -0.30 0.02 0.82 -1.64 0.00 0.00 178.16 177.01 2ji8 h ILE 69 N -0.28 1.25 0.00 1.81 2.04 -1.23 -3.30 117.51 117.81 2ji8 h ILE 69 Ca 0.10 -0.96 -0.23 0.00 1.00 0.00 0.00 64.86 64.77 2ji8 h ILE 69 Cb 0.43 1.10 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 2ji8 h ILE 69 CO -0.29 0.33 -1.72 -0.62 0.00 0.00 0.00 178.15 175.85 2ji8 n GLU 70 N -4.47 0.64 -1.31 2.37 1.02 -0.60 -4.98 120.64 113.31 2ji8 n GLU 70 Ca -0.01 0.17 -0.06 0.00 -0.02 0.00 0.00 57.16 57.24 2ji8 n GLU 70 Cb 0.27 -1.73 -0.02 0.00 -0.02 0.00 0.00 31.44 29.94 2ji8 n GLU 70 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ji8 n GLY 71 N 1.49 0.77 3.23 0.62 0.00 0.30 -5.04 105.19 106.55 2ji8 n GLY 71 Ca -0.16 -0.75 -0.19 0.00 0.00 0.00 0.00 46.02 44.93 2ji8 n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ji8 s LYS 72 N -2.77 0.98 0.08 1.61 -2.85 -1.25 -5.01 119.74 110.53 2ji8 s LYS 72 Ca 0.00 -1.16 -0.31 0.00 -1.00 0.00 0.00 55.97 53.50 2ji8 s LYS 72 Cb 0.00 -0.93 -0.09 0.00 -2.06 0.00 0.00 37.83 34.75 2ji8 s LYS 72 CO 0.00 0.19 1.69 -2.14 0.10 0.00 0.00 175.35 175.19 2ji8 s PRO 73 N -2.38 4.18 0.26 1.78 0.02 -1.26 -3.88 135.00 133.73 2ji8 s PRO 73 Ca 0.06 2.39 -0.30 0.00 0.02 0.00 0.00 61.00 63.17 2ji8 s PRO 73 Cb -0.07 -3.59 -0.11 0.00 0.02 0.00 0.00 34.50 30.75 2ji8 s PRO 73 CO 0.03 -0.76 1.51 0.20 -0.33 0.00 0.00 177.00 177.65 2ji8 s GLY 74 N 2.46 2.20 -0.23 0.52 0.00 -0.89 -4.76 107.32 106.62 2ji8 s GLY 74 Ca 0.75 1.43 -0.03 0.00 0.00 0.00 0.00 44.72 46.88 2ji8 s GLY 74 CO 0.33 2.41 -0.06 0.14 0.00 0.00 0.00 173.10 175.92 2ji8 s VAL 75 N 0.05 3.09 -0.10 1.40 1.01 -1.26 -0.95 120.40 123.64 2ji8 s VAL 75 Ca 0.61 -0.75 -0.01 0.00 0.00 0.00 0.00 61.98 61.84 2ji8 s VAL 75 Cb -0.44 -2.47 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 2ji8 s VAL 75 CO 0.45 0.33 -0.05 0.00 0.00 0.00 0.00 175.10 175.82 2ji8 s LEU 77 N -0.41 2.22 0.29 0.00 2.96 -0.14 -0.52 118.68 123.08 2ji8 s LEU 77 Ca 0.06 -0.53 0.03 0.00 -0.22 0.00 0.00 54.13 53.47 2ji8 s LEU 77 Cb -0.12 -1.46 -0.04 0.00 0.50 0.00 0.00 46.19 45.06 2ji8 s LEU 77 CO 0.02 0.13 0.15 0.42 -1.32 0.00 0.00 176.35 175.75 2ji8 s THR 78 N 0.53 0.30 0.50 3.68 -4.23 -0.54 -2.60 115.64 113.27 2ji8 s THR 78 Ca -0.13 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.31 2ji8 s THR 78 Cb -0.17 -2.53 0.11 0.00 1.34 0.00 0.00 72.50 71.26 2ji8 s THR 78 CO 0.04 0.00 0.68 1.33 -0.54 0.00 0.00 174.62 176.13 2ji8 n VAL 79 N -0.53 0.00 -0.61 2.29 0.24 -1.26 -2.08 118.33 116.39 2ji8 n VAL 79 Ca 0.01 -0.62 -0.05 0.00 -2.04 0.00 0.00 64.34 61.64 2ji8 n VAL 79 Cb 0.65 -1.57 0.05 0.00 -1.47 0.00 0.00 33.84 31.50 2ji8 n VAL 79 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2ji8 n SER 80 N -3.33 -1.18 0.00 -1.34 3.41 -1.13 -1.26 113.62 108.79 2ji8 n SER 80 Ca 0.09 -0.63 0.00 0.00 -0.26 0.00 0.00 58.87 58.07 2ji8 n SER 80 Cb 0.32 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 2ji8 n SER 80 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ji8 n ALA 81 N -3.33 0.00 -0.20 7.33 0.00 -1.24 -0.61 120.51 122.45 2ji8 n ALA 81 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2ji8 n ALA 81 Cb 0.11 0.00 0.24 0.00 0.00 0.00 0.00 19.45 19.80 2ji8 n ALA 81 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2ji8 h PRO 82 N 0.00 0.95 0.10 0.00 0.13 -1.90 -0.05 132.00 131.24 2ji8 h PRO 82 Ca 0.00 -0.07 -0.01 0.00 -0.87 0.00 0.00 66.00 65.05 2ji8 h PRO 82 Cb 0.00 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 30.92 2ji8 h PRO 82 CO 0.00 0.66 -0.05 0.78 -0.23 0.00 0.00 178.00 179.16 2ji8 h GLY 83 N 1.00 -0.15 -0.81 1.56 0.00 -1.06 -2.78 103.07 100.83 2ji8 h GLY 83 Ca 0.26 0.05 0.15 0.00 0.00 0.00 0.00 47.33 47.79 2ji8 h GLY 83 CO -0.05 -0.05 -0.35 -2.75 0.00 0.00 0.00 176.54 173.34 2ji8 h PHE 84 N -0.87 -0.94 -0.96 5.60 3.57 -0.85 -1.37 116.94 121.13 2ji8 h PHE 84 Ca -0.01 0.09 0.07 0.00 3.53 0.00 0.00 57.97 61.65 2ji8 h PHE 84 Cb 0.56 0.54 -0.07 0.00 2.79 0.00 0.00 35.95 39.77 2ji8 h PHE 84 CO 0.11 -0.40 0.61 1.25 -2.23 0.00 0.00 178.31 177.65 2ji8 h LEU 85 N -0.04 0.95 -0.32 0.59 5.85 -1.01 0.25 115.31 121.57 2ji8 h LEU 85 Ca 0.33 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 59.05 2ji8 h LEU 85 Cb 0.60 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 2ji8 h LEU 85 CO -0.90 0.59 0.10 0.78 -0.34 0.00 0.00 178.44 178.67 2ji8 h ASN 86 N 1.08 0.47 -0.50 1.25 2.35 -1.07 -3.03 115.58 116.13 2ji8 h ASN 86 Ca 0.42 -0.21 -0.04 0.00 -0.55 0.00 0.00 56.30 55.92 2ji8 h ASN 86 Cb 0.22 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 2ji8 h ASN 86 CO -0.19 0.56 0.16 1.23 -1.65 0.00 0.00 177.43 177.54 2ji8 h GLY 87 N 0.37 0.90 2.00 2.83 0.00 -0.20 -3.09 103.07 105.87 2ji8 h GLY 87 Ca 0.10 -0.49 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 2ji8 h GLY 87 CO -0.00 0.47 -0.15 -0.24 0.00 0.00 0.00 176.54 176.61 2ji8 h VAL 88 N 0.81 0.50 -0.26 4.60 3.04 -0.49 0.25 116.25 124.70 2ji8 h VAL 88 Ca 0.18 -0.75 -0.03 0.00 -1.01 0.00 0.00 66.70 65.09 2ji8 h VAL 88 Cb 0.25 1.51 -0.01 0.00 -2.01 0.00 0.00 31.29 31.03 2ji8 h VAL 88 CO -0.01 0.15 0.04 0.71 -1.01 0.00 0.00 177.57 177.45 2ji8 h THR 89 N 0.00 1.14 0.13 3.17 1.35 -1.44 -1.29 112.91 115.97 2ji8 h THR 89 Ca -0.00 -0.53 -0.21 0.00 -0.55 0.00 0.00 66.41 65.13 2ji8 h THR 89 Cb 0.50 0.91 0.01 0.00 -1.73 0.00 0.00 68.15 67.84 2ji8 h THR 89 CO 0.02 0.18 -0.96 0.28 -0.25 0.00 0.00 175.52 174.79 2ji8 h SER 90 N 0.37 0.42 -0.78 5.36 0.02 -1.10 -3.04 113.55 114.80 2ji8 h SER 90 Ca 0.09 -0.92 0.16 0.00 -0.84 0.00 0.00 61.79 60.28 2ji8 h SER 90 Cb 0.19 -0.14 -0.15 0.00 0.14 0.00 0.00 62.40 62.45 2ji8 h SER 90 CO 0.00 1.45 -0.15 0.25 -1.14 0.00 0.00 176.83 177.24 2ji8 h LEU 91 N -0.39 -0.65 -0.60 5.07 5.85 -1.25 0.37 115.31 123.71 2ji8 h LEU 91 Ca -0.19 0.23 0.11 0.00 0.84 0.00 0.00 57.88 58.87 2ji8 h LEU 91 Cb 1.65 0.46 -0.08 0.00 0.37 0.00 0.00 40.66 43.05 2ji8 h LEU 91 CO 0.11 -0.25 0.15 0.00 -0.34 0.00 0.00 178.44 178.12 2ji8 h ALA 92 N 1.77 0.74 -0.15 1.25 0.00 -1.23 0.11 119.26 121.76 2ji8 h ALA 92 Ca 0.39 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.42 2ji8 h ALA 92 Cb 0.63 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2ji8 h ALA 92 CO -0.78 -0.28 0.10 1.25 0.00 0.00 0.00 179.25 179.53 2ji8 h HIS 93 N 0.29 0.19 -0.10 0.00 -0.00 -0.97 -1.73 115.15 112.82 2ji8 h HIS 93 Ca 0.32 0.00 0.04 0.00 -0.00 0.00 0.00 60.37 60.73 2ji8 h HIS 93 Cb 0.46 -0.06 -0.06 0.00 -0.00 0.00 0.00 27.41 27.74 2ji8 h HIS 93 CO -0.23 0.12 -0.35 0.00 -0.00 0.00 0.00 177.93 177.47 2ji8 h ALA 94 N 1.05 -0.46 -0.43 5.26 0.00 0.91 -2.23 119.26 123.36 2ji8 h ALA 94 Ca 0.05 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.02 2ji8 h ALA 94 Cb -0.02 0.66 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2ji8 h ALA 94 CO -0.01 -0.85 0.17 1.15 0.00 0.00 0.00 179.25 179.71 2ji8 h THR 95 N -0.45 0.90 -0.48 0.00 2.02 -0.74 -0.12 112.91 114.05 2ji8 h THR 95 Ca 0.08 -0.12 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 2ji8 h THR 95 Cb 0.58 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 2ji8 h THR 95 CO -0.35 0.06 0.28 0.74 0.37 0.00 0.00 175.52 176.63 2ji8 h THR 96 N 0.35 1.14 -0.00 3.16 2.02 -1.14 -2.81 112.91 115.63 2ji8 h THR 96 Ca 0.19 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 67.06 2ji8 h THR 96 Cb 0.16 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.04 2ji8 h THR 96 CO -0.18 0.15 -0.48 0.59 0.37 0.00 0.00 175.52 175.96 2ji8 n ASN 97 N -4.43 0.70 -1.75 4.18 3.02 -0.63 -4.91 115.26 111.44 2ji8 n ASN 97 Ca 0.04 -0.50 -0.08 0.00 -0.03 0.00 0.00 54.58 54.01 2ji8 n ASN 97 Cb 0.08 0.29 0.03 0.00 -0.61 0.00 0.00 39.78 39.57 2ji8 n ASN 97 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ji8 s PHE 99 N -3.13 3.18 -0.04 0.00 0.08 -0.58 -4.45 117.98 113.05 2ji8 s PHE 99 Ca 0.16 -0.08 -0.30 0.00 0.12 0.00 0.00 56.93 56.83 2ji8 s PHE 99 Cb -0.07 -2.10 -0.06 0.00 -0.57 0.00 0.00 43.02 40.22 2ji8 s PHE 99 CO 0.28 0.02 1.68 -1.25 -0.10 0.00 0.00 175.22 175.85 2ji8 s PRO 100 N 0.64 4.18 -0.13 0.24 0.04 -1.26 -3.48 135.00 135.22 2ji8 s PRO 100 Ca 0.02 2.24 -0.16 0.00 0.04 0.00 0.00 61.00 63.14 2ji8 s PRO 100 Cb -0.13 -3.98 0.04 0.00 0.04 0.00 0.00 34.50 30.47 2ji8 s PRO 100 CO 0.02 -0.85 0.43 1.41 0.04 0.00 0.00 177.00 178.05 2ji8 s MET 101 N 3.99 0.57 -0.17 4.56 1.75 -0.99 -2.09 119.30 126.93 2ji8 s MET 101 Ca 0.75 0.46 0.01 0.00 -1.25 0.00 0.00 55.69 55.65 2ji8 s MET 101 Cb -0.35 0.27 0.01 0.00 2.84 0.00 0.00 34.83 37.61 2ji8 s MET 101 CO 0.31 -0.10 -0.18 0.42 -0.65 0.00 0.00 175.02 174.82 2ji8 s ILE 102 N -0.11 2.31 -0.36 10.11 1.01 -0.13 -0.27 121.20 133.76 2ji8 s ILE 102 Ca -0.03 -0.87 -0.15 0.00 0.00 0.00 0.00 60.65 59.60 2ji8 s ILE 102 Cb -0.03 -1.97 -0.01 0.00 0.01 0.00 0.00 42.46 40.47 2ji8 s ILE 102 CO 0.02 0.53 0.35 -0.22 0.00 0.00 0.00 174.94 175.61 2ji8 s LEU 103 N 1.09 4.57 -0.20 2.97 2.96 -0.01 -1.57 118.68 128.50 2ji8 s LEU 103 Ca -0.00 -0.38 -0.13 0.00 -0.22 0.00 0.00 54.13 53.40 2ji8 s LEU 103 Cb -0.14 -2.30 -0.05 0.00 0.50 0.00 0.00 46.19 44.20 2ji8 s LEU 103 CO -0.07 -0.37 0.24 -0.76 -1.32 0.00 0.00 176.35 174.08 2ji8 s LEU 104 N 1.96 4.19 -0.02 -0.68 1.43 0.32 -1.31 118.68 124.57 2ji8 s LEU 104 Ca 0.10 0.35 0.01 0.00 -1.03 0.00 0.00 54.13 53.56 2ji8 s LEU 104 Cb -0.17 -2.27 0.02 0.00 0.03 0.00 0.00 46.19 43.80 2ji8 s LEU 104 CO 0.12 0.08 -0.01 -0.44 0.23 0.00 0.00 176.35 176.32 2ji8 s SER 105 N 0.70 0.45 0.59 2.29 0.01 -1.05 -1.47 113.70 115.21 2ji8 s SER 105 Ca 0.13 -0.04 -0.20 0.00 1.31 0.00 0.00 55.95 57.15 2ji8 s SER 105 Cb -0.13 -0.20 -0.04 0.00 0.21 0.00 0.00 66.02 65.86 2ji8 s SER 105 CO 0.03 -0.06 1.23 0.61 0.41 0.00 0.00 173.24 175.46 2ji8 n GLY 106 N 3.87 0.41 3.26 3.44 0.00 -0.88 -1.16 105.19 114.14 2ji8 n GLY 106 Ca -0.24 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.57 2ji8 n GLY 106 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ji8 s SER 107 N -1.14 0.76 0.00 1.61 1.04 -0.88 -2.85 113.70 112.25 2ji8 s SER 107 Ca 0.76 -1.37 0.00 0.00 0.48 0.00 0.00 55.95 55.81 2ji8 s SER 107 Cb -0.41 0.25 0.00 0.00 0.10 0.00 0.00 66.02 65.96 2ji8 s SER 107 CO 0.46 -0.77 0.00 -1.20 0.98 0.00 0.00 173.24 172.71 2ji8 n SER 108 N -0.37 0.00 -4.61 7.02 7.64 -1.26 -0.47 113.62 121.56 2ji8 n SER 108 Ca 0.00 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.49 2ji8 n SER 108 Cb 0.66 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.78 2ji8 n SER 108 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2ji8 s GLU 109 N 1.91 4.05 0.24 1.43 2.12 -1.26 -4.10 118.70 123.09 2ji8 s GLU 109 Ca 0.00 0.24 -0.06 0.00 0.36 0.00 0.00 54.97 55.52 2ji8 s GLU 109 Cb 0.00 -3.65 0.43 0.00 0.26 0.00 0.00 34.13 31.17 2ji8 s GLU 109 CO 0.00 -0.33 1.69 -0.09 -0.54 0.00 0.00 175.26 175.99 2ji8 h ARG 110 N 8.06 0.28 -0.94 4.30 9.65 -1.99 -1.52 114.38 132.23 2ji8 h ARG 110 Ca -0.30 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.57 2ji8 h ARG 110 Cb 1.15 -0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 29.62 2ji8 h ARG 110 CO 0.70 0.19 0.59 0.93 2.80 0.00 0.00 179.97 185.17 2ji8 h GLU 111 N 0.29 1.26 0.09 0.20 5.08 -1.99 -0.40 114.58 119.12 2ji8 h GLU 111 Ca 0.40 -0.10 -0.20 0.00 -1.00 0.00 0.00 59.36 58.46 2ji8 h GLU 111 Cb 0.66 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2ji8 h GLU 111 CO -0.48 0.86 -1.02 0.82 -1.00 0.00 0.00 179.01 178.19 2ji8 h ILE 112 N 1.29 1.26 -0.38 3.13 2.04 -1.76 -3.16 117.51 119.92 2ji8 h ILE 112 Ca 0.34 -2.40 0.07 0.00 1.00 0.00 0.00 64.86 63.86 2ji8 h ILE 112 Cb -0.10 2.89 -0.06 0.00 -0.74 0.00 0.00 36.82 38.81 2ji8 h ILE 112 CO -0.07 0.64 0.03 0.58 0.00 0.00 0.00 178.15 179.34 2ji8 h VAL 113 N -0.51 0.75 0.00 1.67 2.07 -1.32 -0.62 116.25 118.28 2ji8 h VAL 113 Ca -0.22 -0.05 -0.05 0.00 0.82 0.00 0.00 66.70 67.20 2ji8 h VAL 113 Cb 1.56 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.91 2ji8 h VAL 113 CO 0.04 0.03 -0.23 0.44 0.02 0.00 0.00 177.57 177.86 2ji8 h ASP 114 N 0.14 0.00 -0.16 0.57 5.19 -1.18 -0.23 116.42 120.76 2ji8 h ASP 114 Ca 0.19 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.60 2ji8 h ASP 114 Cb 0.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.76 2ji8 h ASP 114 CO -0.28 0.23 0.00 0.18 -3.12 0.00 0.00 179.24 176.25 2ji8 n LEU 115 N -4.00 2.20 -3.85 1.55 4.77 -1.07 -4.98 117.00 111.63 2ji8 n LEU 115 Ca -0.02 -0.87 -0.26 0.00 -0.03 0.00 0.00 56.01 54.84 2ji8 n LEU 115 Cb 0.31 -0.10 0.01 0.00 -2.33 0.00 0.00 43.42 41.31 2ji8 n LEU 115 CO 0.35 0.43 -0.05 0.00 -1.33 0.00 0.00 177.39 176.79 2ji8 n GLN 116 N 0.69 -4.62 0.04 3.23 6.02 -0.10 -4.88 117.38 117.77 2ji8 n GLN 116 Ca 0.17 0.55 0.13 0.00 -0.01 0.00 0.00 57.00 57.84 2ji8 n GLN 116 Cb 0.43 -5.12 0.34 0.00 1.02 0.00 0.00 30.24 26.92 2ji8 n GLN 116 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2ji8 n GLN 117 N -4.42 0.15 0.00 -1.09 6.02 -0.85 -4.94 117.38 112.25 2ji8 n GLN 117 Ca -0.18 0.07 0.00 0.00 -0.01 0.00 0.00 57.00 56.88 2ji8 n GLN 117 Cb 0.62 -1.62 0.00 0.00 1.02 0.00 0.00 30.24 30.26 2ji8 n GLN 117 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ji8 n GLY 118 N 1.41 0.68 3.65 1.08 0.00 -1.26 -5.11 105.19 105.64 2ji8 n GLY 118 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 2ji8 n GLY 118 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ji8 s ASP 119 N -1.15 2.68 0.08 1.61 -1.08 -1.26 -4.93 116.67 112.61 2ji8 s ASP 119 Ca 0.00 1.55 -0.31 0.00 -0.52 0.00 0.00 52.55 53.26 2ji8 s ASP 119 Cb 0.00 -2.21 -0.10 0.00 -1.46 0.00 0.00 42.92 39.14 2ji8 s ASP 119 CO 0.00 -3.15 1.88 0.00 0.52 0.00 0.00 175.17 174.42 2ji8 n TYR 120 N -4.22 2.55 -3.73 -5.34 9.36 -1.26 -3.09 117.16 111.43 2ji8 n TYR 120 Ca 0.06 -0.19 -0.27 0.00 3.32 0.00 0.00 57.90 60.82 2ji8 n TYR 120 Cb 0.55 -2.74 0.01 0.00 -0.63 0.00 0.00 39.34 36.53 2ji8 n TYR 120 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 2ji8 n GLU 121 N 6.22 -1.16 -2.86 2.98 1.02 -1.26 -4.72 120.64 120.86 2ji8 n GLU 121 Ca 0.19 0.65 -0.41 0.00 -0.02 0.00 0.00 57.16 57.56 2ji8 n GLU 121 Cb 0.37 -3.17 -0.04 0.00 -0.02 0.00 0.00 31.44 28.58 2ji8 n GLU 121 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2ji8 s GLU 122 N -5.43 4.34 -0.19 3.49 2.12 -1.18 -3.72 118.70 118.13 2ji8 s GLU 122 Ca 0.20 1.09 -0.28 0.00 0.36 0.00 0.00 54.97 56.34 2ji8 s GLU 122 Cb -0.09 -3.55 0.11 0.00 0.26 0.00 0.00 34.13 30.85 2ji8 s GLU 122 CO 0.89 -0.29 0.92 1.41 -0.54 0.00 0.00 175.26 177.65 2ji8 s MET 123 N 1.98 0.68 -1.08 4.30 1.75 -1.26 -4.88 119.30 120.80 2ji8 s MET 123 Ca 0.40 0.38 -0.18 0.00 -1.25 0.00 0.00 55.69 55.04 2ji8 s MET 123 Cb -0.17 0.32 0.12 0.00 2.84 0.00 0.00 34.83 37.94 2ji8 s MET 123 CO 0.14 -0.17 1.36 0.34 -0.65 0.00 0.00 175.02 176.04 2ji8 s ASP 124 N -0.60 6.75 0.19 1.11 -1.08 -1.26 -4.82 116.67 116.96 2ji8 s ASP 124 Ca -0.02 -2.24 -0.06 0.00 -0.52 0.00 0.00 52.55 49.70 2ji8 s ASP 124 Cb -0.02 -2.46 0.09 0.00 -1.46 0.00 0.00 42.92 39.07 2ji8 s ASP 124 CO 0.01 -1.08 1.56 1.56 0.52 0.00 0.00 175.17 177.73 2ji8 h GLN 125 N 8.39 0.80 -0.37 4.34 4.20 -1.98 -0.68 115.11 129.81 2ji8 h GLN 125 Ca 0.25 -0.38 0.07 0.00 0.06 0.00 0.00 58.65 58.65 2ji8 h GLN 125 Cb 0.96 -0.01 -0.06 0.00 0.30 0.00 0.00 27.48 28.67 2ji8 h GLN 125 CO 1.26 1.01 -0.03 1.98 -0.67 0.00 0.00 178.83 182.38 2ji8 h MET 126 N 0.67 0.06 -0.08 1.46 4.05 -1.90 -1.69 114.93 117.51 2ji8 h MET 126 Ca 0.07 -0.00 -0.16 0.00 -0.28 0.00 0.00 59.70 59.32 2ji8 h MET 126 Cb 0.87 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.65 2ji8 h MET 126 CO 0.08 0.04 -0.66 -0.97 0.23 0.00 0.00 176.91 175.63 2ji8 h ASN 127 N 0.07 0.38 0.64 1.39 -0.73 -1.90 -3.18 115.58 112.25 2ji8 h ASN 127 Ca 0.18 -0.23 -0.08 0.00 1.87 0.00 0.00 56.30 58.04 2ji8 h ASN 127 Cb 0.26 -0.11 -0.01 0.00 0.27 0.00 0.00 38.32 38.73 2ji8 h ASN 127 CO -0.33 0.94 -0.39 0.58 -0.37 0.00 0.00 177.43 177.85 2ji8 h VAL 128 N 0.23 1.04 0.00 2.57 2.07 -0.87 -3.09 116.25 118.21 2ji8 h VAL 128 Ca -0.02 -1.47 0.00 0.00 0.82 0.00 0.00 66.70 66.03 2ji8 h VAL 128 Cb 1.21 1.85 0.00 0.00 -1.52 0.00 0.00 31.29 32.83 2ji8 h VAL 128 CO 0.11 0.38 0.00 0.00 0.02 0.00 0.00 177.57 178.08 2ji8 h ALA 129 N 1.61 1.00 -0.95 1.67 0.00 -1.29 -3.39 119.26 117.91 2ji8 h ALA 129 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2ji8 h ALA 129 Cb 0.82 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 2ji8 h ALA 129 CO 0.05 0.00 0.61 0.00 0.00 0.00 0.00 179.25 179.92 2ji8 h ARG 130 N 0.00 1.25 0.00 0.00 3.08 -1.64 0.12 114.38 117.19 2ji8 h ARG 130 Ca 0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2ji8 h ARG 130 Cb 0.56 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 30.33 2ji8 h ARG 130 CO 0.00 0.84 0.00 -2.30 -1.07 0.00 0.00 179.97 177.44 2ji8 n PRO 131 N -4.41 0.03 0.00 0.04 -0.02 -1.26 -3.58 135.00 125.80 2ji8 n PRO 131 Ca 0.11 0.27 0.03 0.00 -2.02 0.00 0.00 63.50 61.89 2ji8 n PRO 131 Cb 0.02 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 2ji8 n PRO 131 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2ji8 n HIS 132 N -1.46 0.00 -4.28 6.00 8.25 0.41 -5.01 115.22 119.13 2ji8 n HIS 132 Ca 0.03 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.35 2ji8 n HIS 132 Cb 0.13 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.14 2ji8 n HIS 132 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2ji8 h LYS 134 N 2.49 0.27 -3.95 0.00 1.57 -1.44 -3.47 116.57 112.03 2ji8 h LYS 134 Ca -0.37 -0.11 -0.17 0.00 -1.87 0.00 0.00 60.65 58.13 2ji8 h LYS 134 Cb 1.24 -0.01 -0.21 0.00 0.08 0.00 0.00 32.23 33.33 2ji8 h LYS 134 CO 0.59 0.58 -0.68 0.00 -0.57 0.00 0.00 179.45 179.37 2ji8 s ALA 135 N -4.66 0.10 -0.20 3.86 0.00 -1.26 -5.09 121.76 114.51 2ji8 s ALA 135 Ca -0.14 -0.58 0.00 0.00 0.00 0.00 0.00 51.96 51.24 2ji8 s ALA 135 Cb 0.05 0.15 0.05 0.00 0.00 0.00 0.00 23.12 23.37 2ji8 s ALA 135 CO 0.72 -0.17 -0.06 0.45 0.00 0.00 0.00 175.76 176.70 2ji8 s SER 136 N -1.50 3.34 0.47 0.00 0.15 -1.26 -1.99 113.70 112.91 2ji8 s SER 136 Ca -0.15 -0.91 0.05 0.00 0.70 0.00 0.00 55.95 55.64 2ji8 s SER 136 Cb -0.09 -1.08 -0.02 0.00 -1.71 0.00 0.00 66.02 63.12 2ji8 s SER 136 CO -0.01 -0.20 0.14 -0.36 1.20 0.00 0.00 173.24 174.01 2ji8 s PHE 137 N 1.50 2.12 -0.14 3.44 0.08 0.84 -4.98 117.98 120.84 2ji8 s PHE 137 Ca -0.02 -0.79 -0.07 0.00 0.12 0.00 0.00 56.93 56.18 2ji8 s PHE 137 Cb -0.17 -1.80 0.06 0.00 -0.57 0.00 0.00 43.02 40.54 2ji8 s PHE 137 CO -0.07 0.10 0.32 0.50 -0.10 0.00 0.00 175.22 175.97 2ji8 s ARG 138 N -3.94 0.27 -0.45 0.44 3.52 -1.26 -1.10 118.95 116.43 2ji8 s ARG 138 Ca 0.26 0.70 -0.18 0.00 -0.13 0.00 0.00 55.73 56.39 2ji8 s ARG 138 Cb 0.03 -0.03 0.04 0.00 -1.56 0.00 0.00 34.95 33.43 2ji8 s ARG 138 CO 0.15 -0.19 0.48 0.42 -0.81 0.00 0.00 175.30 175.35 2ji8 s ILE 139 N 1.61 5.05 -0.18 4.11 1.01 -0.98 -4.91 121.20 126.92 2ji8 s ILE 139 Ca -0.07 -0.50 0.18 0.00 0.00 0.00 0.00 60.65 60.27 2ji8 s ILE 139 Cb -0.10 -4.13 -0.03 0.00 0.01 0.00 0.00 42.46 38.21 2ji8 s ILE 139 CO -0.10 -0.55 1.05 0.78 0.00 0.00 0.00 174.94 176.11 2ji8 h ASN 140 N 8.81 0.00 -4.23 3.58 2.35 -1.96 -3.39 115.58 120.74 2ji8 h ASN 140 Ca -0.27 0.00 -0.50 0.00 -0.55 0.00 0.00 56.30 54.98 2ji8 h ASN 140 Cb 1.11 0.00 -0.29 0.00 0.05 0.00 0.00 38.32 39.18 2ji8 h ASN 140 CO 0.86 0.36 -0.82 -0.55 -1.65 0.00 0.00 177.43 175.63 2ji8 s SER 141 N -5.82 1.77 0.30 5.81 0.15 -1.26 -4.68 113.70 109.97 2ji8 s SER 141 Ca -0.00 -0.27 0.04 0.00 0.70 0.00 0.00 55.95 56.41 2ji8 s SER 141 Cb 0.08 -0.21 0.65 0.00 -1.71 0.00 0.00 66.02 64.84 2ji8 s SER 141 CO 0.78 0.18 1.81 -0.29 1.20 0.00 0.00 173.24 176.93 2ji8 h ILE 142 N 4.78 0.82 0.00 6.45 2.10 -1.92 -2.12 117.51 127.62 2ji8 h ILE 142 Ca -0.35 -0.30 -0.02 0.00 1.08 0.00 0.00 64.86 65.27 2ji8 h ILE 142 Cb 1.16 -0.13 -0.00 0.00 -1.09 0.00 0.00 36.82 36.76 2ji8 h ILE 142 CO 0.49 0.16 -0.09 0.07 -1.08 0.00 0.00 178.15 177.69 2ji8 h LYS 143 N 0.88 0.00 -0.31 2.19 2.10 -1.96 -2.90 116.57 116.57 2ji8 h LYS 143 Ca 0.53 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.18 2ji8 h LYS 143 Cb 0.68 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.01 2ji8 h LYS 143 CO -0.31 0.09 0.00 -0.25 -2.00 0.00 0.00 179.45 176.99 2ji8 n ASP 144 N -3.31 2.40 -0.02 7.07 8.00 -0.80 -4.49 116.55 125.40 2ji8 n ASP 144 Ca -0.01 -1.87 -0.11 0.00 0.71 0.00 0.00 54.79 53.52 2ji8 n ASP 144 Cb 0.30 -0.20 -0.05 0.00 -0.02 0.00 0.00 41.12 41.15 2ji8 n ASP 144 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2ji8 h ILE 145 N 3.02 1.08 -0.67 0.53 2.04 -1.60 0.23 117.51 122.14 2ji8 h ILE 145 Ca 0.00 -0.20 -0.07 0.00 1.00 0.00 0.00 64.86 65.59 2ji8 h ILE 145 Cb 0.67 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 2ji8 h ILE 145 CO 0.00 0.07 0.16 -0.65 0.00 0.00 0.00 178.15 177.73 2ji8 h PRO 146 N 0.12 1.07 -0.30 2.37 0.11 -1.84 -0.14 132.00 133.39 2ji8 h PRO 146 Ca 0.04 -0.25 -0.06 0.00 0.11 0.00 0.00 66.00 65.84 2ji8 h PRO 146 Cb 0.05 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.01 2ji8 h PRO 146 CO -0.01 0.95 -0.06 0.82 -0.21 0.00 0.00 178.00 179.49 2ji8 h ILE 147 N 1.02 1.28 -0.65 4.15 1.08 -1.82 -1.62 117.51 120.94 2ji8 h ILE 147 Ca 0.21 -1.07 0.09 0.00 -0.39 0.00 0.00 64.86 63.70 2ji8 h ILE 147 Cb 0.36 1.36 -0.07 0.00 -3.07 0.00 0.00 36.82 35.40 2ji8 h ILE 147 CO 0.00 0.34 0.29 1.23 -0.69 0.00 0.00 178.15 179.33 2ji8 h GLY 148 N 0.35 0.94 1.06 5.37 0.00 -0.29 0.54 103.07 111.04 2ji8 h GLY 148 Ca 0.08 -0.18 -0.17 0.00 0.00 0.00 0.00 47.33 47.06 2ji8 h GLY 148 CO 0.03 0.04 -0.54 -2.22 0.00 0.00 0.00 176.54 173.84 2ji8 h ILE 149 N 0.52 1.30 -0.35 2.60 1.08 -1.02 -2.21 117.51 119.43 2ji8 h ILE 149 Ca 0.32 -1.75 0.07 0.00 -0.39 0.00 0.00 64.86 63.10 2ji8 h ILE 149 Cb 0.34 1.83 -0.06 0.00 -3.07 0.00 0.00 36.82 35.87 2ji8 h ILE 149 CO -0.27 0.56 -0.02 0.00 -0.69 0.00 0.00 178.15 177.72 2ji8 h ALA 150 N 0.61 0.29 -0.96 1.87 0.00 -1.00 0.71 119.26 120.78 2ji8 h ALA 150 Ca -0.01 0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.06 2ji8 h ALA 150 Cb 1.16 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 19.09 2ji8 h ALA 150 CO 0.12 -0.42 0.63 0.00 0.00 0.00 0.00 179.25 179.58 2ji8 h ARG 151 N 0.07 1.16 -0.24 0.00 3.08 -0.86 -0.30 114.38 117.28 2ji8 h ARG 151 Ca 0.17 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.11 2ji8 h ARG 151 Cb 0.24 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 2ji8 h ARG 151 CO -0.31 0.77 0.00 0.00 -1.07 0.00 0.00 179.97 179.36 2ji8 h ALA 152 N 1.45 0.33 -0.28 0.04 0.00 -0.82 -1.59 119.26 118.39 2ji8 h ALA 152 Ca 0.39 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 2ji8 h ALA 152 Cb 0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2ji8 h ALA 152 CO -0.13 0.06 -0.14 0.28 0.00 0.00 0.00 179.25 179.32 2ji8 h VAL 153 N 0.21 1.30 -0.44 0.00 2.07 -0.57 -1.84 116.25 116.98 2ji8 h VAL 153 Ca 0.07 -1.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.33 2ji8 h VAL 153 Cb 0.41 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 2ji8 h VAL 153 CO 0.01 0.39 0.19 0.03 0.02 0.00 0.00 177.57 178.21 2ji8 h ARG 154 N 0.33 0.65 -0.81 1.57 3.08 -1.12 -1.24 114.38 116.85 2ji8 h ARG 154 Ca 0.06 -0.11 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 2ji8 h ARG 154 Cb 0.66 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.56 2ji8 h ARG 154 CO 0.04 0.59 0.37 1.15 -1.07 0.00 0.00 179.97 181.06 2ji8 h THR 155 N 0.57 1.26 -0.35 2.04 2.02 -1.24 0.14 112.91 117.33 2ji8 h THR 155 Ca 0.15 -0.74 -0.10 0.00 0.77 0.00 0.00 66.41 66.49 2ji8 h THR 155 Cb 0.17 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 2ji8 h THR 155 CO -0.01 0.31 -0.17 0.00 0.37 0.00 0.00 175.52 176.02 2ji8 h ALA 156 N 1.20 0.50 0.00 6.16 0.00 -1.20 -3.36 119.26 122.56 2ji8 h ALA 156 Ca 0.28 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 2ji8 h ALA 156 Cb 0.14 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2ji8 h ALA 156 CO -0.03 0.42 -1.48 1.33 0.00 0.00 0.00 179.25 179.49 2ji8 n VAL 157 N -4.32 0.65 -2.87 0.00 0.24 -0.48 -1.41 118.33 110.14 2ji8 n VAL 157 Ca -0.02 -0.59 -0.23 0.00 -2.04 0.00 0.00 64.34 61.46 2ji8 n VAL 157 Cb 0.40 -0.35 0.02 0.00 -1.47 0.00 0.00 33.84 32.43 2ji8 n VAL 157 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2ji8 s SER 158 N -5.25 5.68 0.83 -1.34 1.04 0.02 -4.55 113.70 110.13 2ji8 s SER 158 Ca -0.04 0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.62 2ji8 s SER 158 Cb 0.10 -1.37 0.00 0.00 0.10 0.00 0.00 66.02 64.85 2ji8 s SER 158 CO 0.83 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 174.83 2ji8 n GLY 159 N -2.17 2.68 3.65 7.32 0.00 -1.26 -3.90 105.19 111.51 2ji8 n GLY 159 Ca 0.03 -0.35 -0.43 0.00 0.00 0.00 0.00 46.02 45.27 2ji8 n GLY 159 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ji8 s ARG 160 N 0.00 4.09 0.81 1.61 3.52 -1.26 -4.92 118.95 122.80 2ji8 s ARG 160 Ca 0.00 1.76 -0.11 0.00 -0.13 0.00 0.00 55.73 57.25 2ji8 s ARG 160 Cb 0.00 -3.89 0.08 0.00 -1.56 0.00 0.00 34.95 29.58 2ji8 s ARG 160 CO 0.00 -0.91 1.12 -2.14 -0.81 0.00 0.00 175.30 172.55 2ji8 s PRO 161 N 3.97 1.88 0.00 5.12 0.02 -1.25 -4.94 135.00 139.79 2ji8 s PRO 161 Ca 0.63 1.35 0.00 0.00 0.02 0.00 0.00 61.00 63.00 2ji8 s PRO 161 Cb -0.25 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.43 2ji8 s PRO 161 CO 0.23 -1.96 0.00 0.41 -0.33 0.00 0.00 177.00 175.35 2ji8 n GLY 162 N -0.59 -1.31 3.80 0.52 0.00 -0.50 -3.90 105.19 103.21 2ji8 n GLY 162 Ca 0.10 -0.93 -0.37 0.00 0.00 0.00 0.00 46.02 44.83 2ji8 n GLY 162 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ji8 s GLY 163 N 0.00 2.71 -0.05 -0.02 0.00 -1.24 -2.36 107.32 106.37 2ji8 s GLY 163 Ca 0.00 0.32 0.03 0.00 0.00 0.00 0.00 44.72 45.07 2ji8 s GLY 163 CO 0.00 0.72 -0.11 0.14 0.00 0.00 0.00 173.10 173.85 2ji8 s VAL 164 N -1.54 1.01 -0.15 1.40 1.01 0.63 -1.15 120.40 121.61 2ji8 s VAL 164 Ca 0.45 -0.44 -0.12 0.00 0.00 0.00 0.00 61.98 61.87 2ji8 s VAL 164 Cb -0.18 -0.91 -0.05 0.00 0.00 0.00 0.00 36.38 35.25 2ji8 s VAL 164 CO 0.22 0.32 0.25 -0.47 0.00 0.00 0.00 175.10 175.42 2ji8 s TYR 165 N 0.43 3.48 -0.22 5.22 5.04 -0.84 -0.83 117.35 129.63 2ji8 s TYR 165 Ca -0.09 0.56 0.01 0.00 -2.44 0.00 0.00 57.07 55.12 2ji8 s TYR 165 Cb -0.13 -2.26 0.05 0.00 0.35 0.00 0.00 41.96 39.97 2ji8 s TYR 165 CO 0.02 0.32 -0.10 0.08 -1.34 0.00 0.00 175.55 174.53 2ji8 s VAL 166 N 0.19 1.82 0.02 3.14 1.01 -0.43 -0.11 120.40 126.05 2ji8 s VAL 166 Ca 0.15 -1.24 -0.27 0.00 0.00 0.00 0.00 61.98 60.63 2ji8 s VAL 166 Cb -0.13 -1.92 -0.05 0.00 0.00 0.00 0.00 36.38 34.29 2ji8 s VAL 166 CO 0.03 0.09 0.83 -0.62 0.00 0.00 0.00 175.10 175.43 2ji8 s ASP 167 N 1.30 7.24 -0.59 3.32 -1.08 -0.26 -2.54 116.67 124.07 2ji8 s ASP 167 Ca -0.04 1.49 0.04 0.00 -0.52 0.00 0.00 52.55 53.53 2ji8 s ASP 167 Cb -0.18 -2.50 0.15 0.00 -1.46 0.00 0.00 42.92 38.94 2ji8 s ASP 167 CO -0.07 -0.08 0.36 -0.76 0.52 0.00 0.00 175.17 175.14 2ji8 s LEU 168 N 0.36 4.25 0.25 -1.34 1.43 -0.31 -2.32 118.68 121.01 2ji8 s LEU 168 Ca 0.43 -3.34 -0.29 0.00 -1.03 0.00 0.00 54.13 49.90 2ji8 s LEU 168 Cb -0.20 -1.53 -0.15 0.00 0.03 0.00 0.00 46.19 44.34 2ji8 s LEU 168 CO 0.24 -0.17 0.87 -2.65 0.23 0.00 0.00 176.35 174.87 2ji8 n PRO 169 N 2.65 0.90 -0.32 1.29 -0.02 -1.26 -2.06 135.00 136.17 2ji8 n PRO 169 Ca 0.13 0.32 0.11 0.00 -2.02 0.00 0.00 63.50 62.03 2ji8 n PRO 169 Cb 0.34 -1.58 0.23 0.00 -0.02 0.00 0.00 33.50 32.47 2ji8 n PRO 169 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ji8 h ALA 170 N 1.81 0.99 0.00 3.55 0.00 -0.92 -0.20 119.26 124.48 2ji8 h ALA 170 Ca -0.36 0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2ji8 h ALA 170 Cb 1.37 0.56 0.00 0.00 0.00 0.00 0.00 17.79 19.72 2ji8 h ALA 170 CO 0.60 -0.50 0.00 1.63 0.00 0.00 0.00 179.25 180.98 2ji8 n LYS 171 N -5.46 0.01 -0.18 0.00 5.02 -1.26 -2.85 118.16 113.43 2ji8 n LYS 171 Ca 0.19 0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.70 2ji8 n LYS 171 Cb 0.64 -1.51 0.25 0.00 -0.02 0.00 0.00 35.03 34.39 2ji8 n LYS 171 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2ji8 h LEU 172 N 0.00 0.81 -0.19 -0.35 5.85 -1.30 -3.32 115.31 116.81 2ji8 h LEU 172 Ca 0.00 -0.04 -0.22 0.00 0.84 0.00 0.00 57.88 58.46 2ji8 h LEU 172 Cb 0.30 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 2ji8 h LEU 172 CO 0.00 0.62 -0.94 -0.26 -0.34 0.00 0.00 178.44 177.52 2ji8 h PHE 173 N 0.94 0.49 -0.01 1.25 0.04 -1.69 -3.17 116.94 114.78 2ji8 h PHE 173 Ca 0.25 -0.27 0.00 0.00 2.80 0.00 0.00 57.97 60.74 2ji8 h PHE 173 Cb -0.04 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.05 2ji8 h PHE 173 CO 0.00 1.10 -0.23 0.41 -0.60 0.00 0.00 178.31 179.00 2ji8 n GLY 174 N 0.97 -0.63 3.73 -1.45 0.00 -1.25 -2.20 105.19 104.35 2ji8 n GLY 174 Ca -0.06 -0.39 -0.38 0.00 0.00 0.00 0.00 46.02 45.19 2ji8 n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ji8 n GLN 175 N -0.65 1.51 -4.36 1.61 6.02 -1.20 -4.83 117.38 115.48 2ji8 n GLN 175 Ca 0.13 0.56 -0.20 0.00 -0.01 0.00 0.00 57.00 57.48 2ji8 n GLN 175 Cb 0.34 -2.52 -0.10 0.00 1.02 0.00 0.00 30.24 28.98 2ji8 n GLN 175 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2ji8 s THR 176 N -1.32 1.84 -0.08 5.09 -4.23 -1.26 -1.71 115.64 113.96 2ji8 s THR 176 Ca 0.74 -2.18 -0.28 0.00 -1.18 0.00 0.00 61.69 58.79 2ji8 s THR 176 Cb -0.41 -2.03 0.07 0.00 1.34 0.00 0.00 72.50 71.46 2ji8 s THR 176 CO 0.47 -0.51 0.65 -0.51 -0.54 0.00 0.00 174.62 174.18 2ji8 s ILE 177 N -2.72 0.00 0.66 2.99 2.07 -1.01 -5.01 121.20 118.17 2ji8 s ILE 177 Ca 0.22 -0.04 -0.18 0.00 -1.41 0.00 0.00 60.65 59.25 2ji8 s ILE 177 Cb -0.02 -0.96 -0.00 0.00 0.13 0.00 0.00 42.46 41.60 2ji8 s ILE 177 CO 0.08 -0.02 1.28 -0.94 -1.91 0.00 0.00 174.94 173.42 2ji8 s SER 178 N -0.92 4.56 0.34 4.50 1.04 -1.26 -1.34 113.70 120.63 2ji8 s SER 178 Ca -0.09 2.57 0.06 0.00 0.48 0.00 0.00 55.95 58.97 2ji8 s SER 178 Cb -0.01 -2.61 0.62 0.00 0.10 0.00 0.00 66.02 64.11 2ji8 s SER 178 CO 0.08 -2.03 1.84 0.58 0.98 0.00 0.00 173.24 174.69 2ji8 h VAL 179 N 0.43 1.22 0.45 5.02 2.07 -1.64 -2.11 116.25 121.69 2ji8 h VAL 179 Ca -0.50 -0.98 -0.02 0.00 0.82 0.00 0.00 66.70 66.02 2ji8 h VAL 179 Cb 1.33 1.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.34 2ji8 h VAL 179 CO 0.53 0.31 -0.22 -0.08 0.02 0.00 0.00 177.57 178.13 2ji8 h GLU 180 N 0.33 -0.58 -0.46 1.57 4.81 -1.91 -2.03 114.58 116.31 2ji8 h GLU 180 Ca 0.06 0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.38 2ji8 h GLU 180 Cb 0.48 0.13 -0.07 0.00 0.63 0.00 0.00 28.75 29.92 2ji8 h GLU 180 CO 0.03 -0.32 -0.45 0.93 -0.73 0.00 0.00 179.01 178.47 2ji8 h GLU 181 N -0.76 -0.22 -0.37 1.92 4.39 -1.91 -2.40 114.58 115.24 2ji8 h GLU 181 Ca -0.06 0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.74 2ji8 h GLU 181 Cb 0.54 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.22 2ji8 h GLU 181 CO 0.10 -0.14 0.26 0.00 -1.16 0.00 0.00 179.01 178.07 2ji8 h ALA 182 N -0.16 2.19 -0.00 3.43 0.00 -1.33 -0.75 119.26 122.64 2ji8 h ALA 182 Ca 0.08 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 2ji8 h ALA 182 Cb 0.43 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2ji8 h ALA 182 CO -0.55 -0.28 -0.68 -0.91 0.00 0.00 0.00 179.25 176.82 2ji8 h ASN 183 N 0.12 0.00 -0.03 0.00 2.35 -0.87 -0.94 115.58 116.21 2ji8 h ASN 183 Ca 0.17 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.90 2ji8 h ASN 183 Cb 0.53 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 2ji8 h ASN 183 CO -0.02 0.68 -0.06 0.11 -1.65 0.00 0.00 177.43 176.49 2ji8 h LYS 184 N 0.00 0.09 -0.72 0.81 1.57 -0.82 -3.33 116.57 114.17 2ji8 h LYS 184 Ca -0.01 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2ji8 h LYS 184 Cb 1.20 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.49 2ji8 h LYS 184 CO 0.09 0.65 0.34 -0.07 -0.57 0.00 0.00 179.45 179.89 2ji8 h LEU 185 N -0.45 0.93 -9.77 2.94 3.38 -1.35 -3.43 115.31 107.56 2ji8 h LEU 185 Ca 0.00 -0.11 -0.53 0.00 0.09 0.00 0.00 57.88 57.33 2ji8 h LEU 185 Cb 0.65 -0.24 0.08 0.00 0.09 0.00 0.00 40.66 41.24 2ji8 h LEU 185 CO 0.01 0.79 0.91 0.18 0.09 0.00 0.00 178.44 180.43 2ji8 n LEU 186 N -4.33 4.30 -3.46 1.67 4.77 -0.36 -4.79 117.00 114.81 2ji8 n LEU 186 Ca 0.07 1.13 -0.14 0.00 -0.03 0.00 0.00 56.01 57.04 2ji8 n LEU 186 Cb 0.14 -1.59 -0.03 0.00 -2.33 0.00 0.00 43.42 39.60 2ji8 n LEU 186 CO 0.39 0.16 0.41 0.72 -1.33 0.00 0.00 177.39 177.74 2ji8 s PHE 187 N 0.22 -0.57 -0.33 -1.77 -0.71 -1.26 -4.96 117.98 108.60 2ji8 s PHE 187 Ca 0.66 0.59 -0.09 0.00 -1.04 0.00 0.00 56.93 57.06 2ji8 s PHE 187 Cb -0.50 0.50 0.01 0.00 -1.21 0.00 0.00 43.02 41.83 2ji8 s PHE 187 CO 0.45 -0.76 0.15 0.21 -1.34 0.00 0.00 175.22 173.93 2ji8 s LYS 188 N -2.87 3.09 0.11 1.99 2.20 -1.26 -4.83 119.74 118.17 2ji8 s LYS 188 Ca -0.03 -0.88 -0.34 0.00 -0.36 0.00 0.00 55.97 54.35 2ji8 s LYS 188 Cb -0.01 -3.55 -0.18 0.00 -1.51 0.00 0.00 37.83 32.58 2ji8 s LYS 188 CO -0.05 -0.52 0.91 -2.30 -0.36 0.00 0.00 175.35 173.04 2ji8 n PRO 189 N 4.94 0.30 -2.91 4.03 -0.02 -1.26 -4.94 135.00 135.14 2ji8 n PRO 189 Ca -0.13 0.11 -0.41 0.00 -2.02 0.00 0.00 63.50 61.04 2ji8 n PRO 189 Cb 0.48 -1.44 -0.04 0.00 -0.02 0.00 0.00 33.50 32.47 2ji8 n PRO 189 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2ji8 s ILE 190 N -0.38 4.90 -0.80 4.25 -1.09 -1.26 -4.58 121.20 122.24 2ji8 s ILE 190 Ca 0.77 1.60 -0.01 0.00 -2.23 0.00 0.00 60.65 60.78 2ji8 s ILE 190 Cb -1.05 -4.12 -0.00 0.00 -1.58 0.00 0.00 42.46 35.71 2ji8 s ILE 190 CO 0.55 0.05 0.66 -0.67 -1.23 0.00 0.00 174.94 174.31 2ji8 n ASP 191 N 5.07 -6.36 0.24 3.58 2.03 -1.26 -4.89 116.55 114.96 2ji8 n ASP 191 Ca 0.04 -0.52 0.14 0.00 0.52 0.00 0.00 54.79 54.96 2ji8 n ASP 191 Cb 0.49 -3.61 0.38 0.00 -0.72 0.00 0.00 41.12 37.66 2ji8 n ASP 191 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2ji8 h PRO 192 N -0.02 0.00 -2.95 -0.67 0.13 -1.98 -3.35 132.00 123.15 2ji8 h PRO 192 Ca -0.32 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.19 2ji8 h PRO 192 Cb 1.20 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.92 2ji8 h PRO 192 CO 0.34 0.00 -0.67 0.00 -0.23 0.00 0.00 178.00 177.44 2ji8 s ALA 193 N -3.39 3.17 0.53 -0.56 0.00 -1.26 -4.06 121.76 116.19 2ji8 s ALA 193 Ca 0.05 -3.43 -0.16 0.00 0.00 0.00 0.00 51.96 48.42 2ji8 s ALA 193 Cb 0.07 -2.03 -0.07 0.00 0.00 0.00 0.00 23.12 21.09 2ji8 s ALA 193 CO 0.62 -2.06 1.00 -1.25 0.00 0.00 0.00 175.76 174.06 2ji8 s PRO 194 N -0.93 3.84 0.47 0.00 0.04 -1.26 -5.02 135.00 132.14 2ji8 s PRO 194 Ca 0.25 0.98 -0.24 0.00 0.04 0.00 0.00 61.00 62.03 2ji8 s PRO 194 Cb -0.06 -2.12 -0.07 0.00 0.04 0.00 0.00 34.50 32.29 2ji8 s PRO 194 CO -0.15 -0.36 1.38 0.00 0.04 0.00 0.00 177.00 177.91 2ji8 s ALA 195 N -2.62 3.11 -0.21 8.56 0.00 -1.26 -4.94 121.76 124.40 2ji8 s ALA 195 Ca 0.59 1.38 -0.02 0.00 0.00 0.00 0.00 51.96 53.91 2ji8 s ALA 195 Cb -0.11 -3.56 0.06 0.00 0.00 0.00 0.00 23.12 19.51 2ji8 s ALA 195 CO 0.33 -1.17 0.02 -0.65 0.00 0.00 0.00 175.76 174.29 2ji8 s GLN 196 N -2.56 0.84 -0.19 0.00 -1.52 -1.26 -4.99 119.66 109.98 2ji8 s GLN 196 Ca 0.63 -0.55 -0.13 0.00 -1.95 0.00 0.00 55.36 53.37 2ji8 s GLN 196 Cb -0.41 -2.20 -0.05 0.00 -0.22 0.00 0.00 33.01 30.13 2ji8 s GLN 196 CO 0.52 -0.65 0.24 0.42 -0.25 0.00 0.00 175.29 175.58 2ji8 s ILE 197 N 1.76 5.33 0.60 1.08 1.09 -1.26 -1.98 121.20 127.82 2ji8 s ILE 197 Ca -0.02 0.42 -0.16 0.00 -1.10 0.00 0.00 60.65 59.80 2ji8 s ILE 197 Cb -0.17 -3.58 -0.03 0.00 -1.06 0.00 0.00 42.46 37.61 2ji8 s ILE 197 CO -0.08 0.38 1.06 -2.16 -0.10 0.00 0.00 174.94 174.04 2ji8 s PRO 198 N 0.60 3.30 0.71 2.79 0.04 -1.25 -4.96 135.00 136.24 2ji8 s PRO 198 Ca 0.13 1.20 -0.14 0.00 0.04 0.00 0.00 61.00 62.23 2ji8 s PRO 198 Cb -0.13 -2.03 0.03 0.00 0.04 0.00 0.00 34.50 32.41 2ji8 s PRO 198 CO 0.03 -0.83 1.14 0.00 0.04 0.00 0.00 177.00 177.38 2ji8 s ALA 199 N -2.47 2.27 0.30 8.56 0.00 -1.26 -4.90 121.76 124.25 2ji8 s ALA 199 Ca 0.63 0.62 0.00 0.00 0.00 0.00 0.00 51.96 53.22 2ji8 s ALA 199 Cb -0.16 -3.37 0.51 0.00 0.00 0.00 0.00 23.12 20.11 2ji8 s ALA 199 CO 0.38 -1.62 1.93 1.49 0.00 0.00 0.00 175.76 177.94 2ji8 h GLU 200 N -0.33 1.01 0.00 0.00 4.81 -2.00 -2.29 114.58 115.78 2ji8 h GLU 200 Ca -0.46 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 58.60 2ji8 h GLU 200 Cb 1.26 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 2ji8 h GLU 200 CO 0.51 0.67 -0.48 0.38 -0.73 0.00 0.00 179.01 179.36 2ji8 h ASP 201 N 1.04 0.00 -0.46 1.04 2.03 -1.98 -0.63 116.42 117.46 2ji8 h ASP 201 Ca 0.36 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 56.63 2ji8 h ASP 201 Cb 0.10 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.58 2ji8 h ASP 201 CO -0.12 0.48 0.20 0.00 -1.03 0.00 0.00 179.24 178.77 2ji8 h ALA 202 N 1.52 0.60 -0.40 4.15 0.00 -1.75 -1.61 119.26 121.77 2ji8 h ALA 202 Ca -0.00 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.63 2ji8 h ALA 202 Cb 0.92 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2ji8 h ALA 202 CO 0.06 0.19 -0.29 0.82 0.00 0.00 0.00 179.25 180.03 2ji8 h ILE 203 N 0.60 1.27 -0.29 0.00 1.08 -1.37 -2.88 117.51 115.93 2ji8 h ILE 203 Ca 0.16 -1.44 -0.10 0.00 -0.39 0.00 0.00 64.86 63.08 2ji8 h ILE 203 Cb 0.17 1.27 -0.01 0.00 -3.07 0.00 0.00 36.82 35.17 2ji8 h ILE 203 CO -0.02 0.48 -0.25 0.00 -0.69 0.00 0.00 178.15 177.68 2ji8 h ALA 204 N 0.94 1.03 -0.55 1.87 0.00 -1.03 0.60 119.26 122.13 2ji8 h ALA 204 Ca 0.08 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 2ji8 h ALA 204 Cb 0.84 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2ji8 h ALA 204 CO 0.07 0.58 0.17 -0.09 0.00 0.00 0.00 179.25 179.98 2ji8 h ARG 205 N 0.49 0.86 -0.01 0.00 2.43 -1.26 -0.49 114.38 116.40 2ji8 h ARG 205 Ca 0.07 -0.19 -0.00 0.00 -0.81 0.00 0.00 59.98 59.05 2ji8 h ARG 205 Cb 0.70 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.12 2ji8 h ARG 205 CO 0.05 0.79 0.00 0.00 -1.51 0.00 0.00 179.97 179.30 2ji8 h ALA 206 N 1.03 0.01 -0.72 2.80 0.00 -1.29 -2.89 119.26 118.20 2ji8 h ALA 206 Ca 0.18 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.06 2ji8 h ALA 206 Cb 0.29 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 2ji8 h ALA 206 CO -0.00 -0.38 0.39 0.00 0.00 0.00 0.00 179.25 179.25 2ji8 h ALA 207 N 0.78 0.99 -0.45 0.00 0.00 -0.76 -1.21 119.26 118.61 2ji8 h ALA 207 Ca 0.00 0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.01 2ji8 h ALA 207 Cb 0.22 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 2ji8 h ALA 207 CO -0.00 0.02 0.15 0.22 0.00 0.00 0.00 179.25 179.64 2ji8 h ASP 208 N 0.67 0.15 -0.38 0.00 3.58 -1.09 -0.94 116.42 118.41 2ji8 h ASP 208 Ca 0.34 0.06 -0.07 0.00 0.42 0.00 0.00 57.03 57.78 2ji8 h ASP 208 Cb 0.30 0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.38 2ji8 h ASP 208 CO -0.23 0.12 -0.02 -0.07 -2.88 0.00 0.00 179.24 176.15 2ji8 h LEU 209 N 0.32 0.68 -0.35 2.28 3.38 -1.13 -2.65 115.31 117.84 2ji8 h LEU 209 Ca 0.21 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2ji8 h LEU 209 Cb 0.22 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2ji8 h LEU 209 CO -0.22 0.84 0.15 0.40 0.09 0.00 0.00 178.44 179.69 2ji8 h ILE 210 N 0.50 1.18 0.00 1.22 2.04 -1.12 -2.34 117.51 118.99 2ji8 h ILE 210 Ca 0.11 -0.53 -0.02 0.00 1.00 0.00 0.00 64.86 65.41 2ji8 h ILE 210 Cb 0.50 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 37.46 2ji8 h ILE 210 CO 0.02 0.19 -0.08 0.11 0.00 0.00 0.00 178.15 178.40 2ji8 h LYS 211 N 0.42 0.00 -0.02 2.37 1.57 -1.05 -2.51 116.57 117.35 2ji8 h LYS 211 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2ji8 h LYS 211 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 2ji8 h LYS 211 CO -0.01 0.08 -0.35 0.09 -0.57 0.00 0.00 179.45 178.69 2ji8 n ASN 212 N -4.15 2.26 -4.76 0.86 3.02 -1.01 -4.98 115.26 106.50 2ji8 n ASN 212 Ca -0.03 -1.63 -0.41 0.00 -0.03 0.00 0.00 54.58 52.48 2ji8 n ASN 212 Cb 0.16 0.35 -0.02 0.00 -0.61 0.00 0.00 39.78 39.67 2ji8 n ASN 212 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ji8 s ALA 213 N -2.31 3.58 -0.11 5.41 0.00 -0.89 -4.94 121.76 122.51 2ji8 s ALA 213 Ca 0.20 1.36 0.15 0.00 0.00 0.00 0.00 51.96 53.68 2ji8 s ALA 213 Cb 0.18 -3.55 -0.22 0.00 0.00 0.00 0.00 23.12 19.53 2ji8 s ALA 213 CO 0.49 -0.78 0.50 1.63 0.00 0.00 0.00 175.76 177.60 2ji8 n LYS 214 N 1.49 0.65 -3.04 0.00 4.76 -1.26 -4.74 118.16 116.03 2ji8 n LYS 214 Ca 0.04 0.17 -0.16 0.00 -2.87 0.00 0.00 58.31 55.49 2ji8 n LYS 214 Cb 0.40 -1.70 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 2ji8 n LYS 214 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2ji8 n ARG 215 N -2.89 0.95 -2.79 1.97 1.74 -1.26 -4.53 116.66 109.86 2ji8 n ARG 215 Ca -0.20 -2.88 -0.35 0.00 -0.77 0.00 0.00 57.85 53.66 2ji8 n ARG 215 Cb 1.03 -1.46 -0.07 0.00 -1.02 0.00 0.00 32.46 30.94 2ji8 n ARG 215 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2ji8 s PRO 216 N -1.40 4.34 0.00 5.56 0.04 -1.26 -2.11 135.00 140.17 2ji8 s PRO 216 Ca 0.34 1.22 0.01 0.00 0.04 0.00 0.00 61.00 62.61 2ji8 s PRO 216 Cb 0.31 -2.41 -0.00 0.00 0.04 0.00 0.00 34.50 32.43 2ji8 s PRO 216 CO -0.08 0.06 -0.04 0.54 0.04 0.00 0.00 177.00 177.52 2ji8 s VAL 217 N -1.95 0.29 -0.18 -0.36 0.11 -0.46 -4.17 120.40 113.69 2ji8 s VAL 217 Ca 0.58 -0.22 -0.08 0.00 -2.93 0.00 0.00 61.98 59.33 2ji8 s VAL 217 Cb -0.13 -0.26 -0.04 0.00 -1.53 0.00 0.00 36.38 34.41 2ji8 s VAL 217 CO 0.18 0.04 0.09 -0.63 -3.33 0.00 0.00 175.10 171.44 2ji8 s ILE 218 N -0.19 5.01 -0.24 7.04 1.01 -0.29 -0.79 121.20 132.76 2ji8 s ILE 218 Ca 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 60.65 60.67 2ji8 s ILE 218 Cb -0.02 -3.26 0.02 0.00 0.01 0.00 0.00 42.46 39.21 2ji8 s ILE 218 CO -0.00 0.48 -0.06 -0.04 0.00 0.00 0.00 174.94 175.32 2ji8 s MET 219 N 0.18 3.00 -0.16 2.79 -1.94 0.08 -0.79 119.30 122.46 2ji8 s MET 219 Ca 0.06 -0.87 -0.12 0.00 -1.71 0.00 0.00 55.69 53.05 2ji8 s MET 219 Cb -0.12 -2.99 -0.05 0.00 2.01 0.00 0.00 34.83 33.69 2ji8 s MET 219 CO -0.00 -0.34 0.23 -0.51 -0.01 0.00 0.00 175.02 174.39 2ji8 s LEU 220 N 1.37 4.26 0.55 -0.03 1.43 -0.55 -1.36 118.68 124.35 2ji8 s LEU 220 Ca 0.02 0.43 0.04 0.00 -1.03 0.00 0.00 54.13 53.60 2ji8 s LEU 220 Cb -0.16 -2.26 0.04 0.00 0.03 0.00 0.00 46.19 43.84 2ji8 s LEU 220 CO -0.04 0.17 0.32 -0.83 0.23 0.00 0.00 176.35 176.20 2ji8 s GLY 221 N 0.21 2.54 0.44 -3.19 0.00 -0.86 -0.28 107.32 106.19 2ji8 s GLY 221 Ca 0.14 -0.95 0.30 0.00 0.00 0.00 0.00 44.72 44.21 2ji8 s GLY 221 CO 0.02 -2.01 1.88 0.07 0.00 0.00 0.00 173.10 173.06 2ji8 h LYS 222 N 0.83 0.00 -0.70 2.90 2.10 -1.86 -1.84 116.57 118.01 2ji8 h LYS 222 Ca -0.38 0.00 0.01 0.00 -2.00 0.00 0.00 60.65 58.28 2ji8 h LYS 222 Cb 1.31 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.60 2ji8 h LYS 222 CO 0.60 0.00 0.46 0.78 -2.00 0.00 0.00 179.45 179.29 2ji8 h GLY 223 N 2.20 0.99 1.03 0.07 0.00 -1.70 0.23 103.07 105.88 2ji8 h GLY 223 Ca 0.00 -0.36 -0.08 0.00 0.00 0.00 0.00 47.33 46.90 2ji8 h GLY 223 CO 0.00 0.34 0.03 0.00 0.00 0.00 0.00 176.54 176.91 2ji8 h ALA 224 N 1.27 0.73 0.21 3.60 0.00 -1.41 -2.56 119.26 121.10 2ji8 h ALA 224 Ca 0.26 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2ji8 h ALA 224 Cb -0.07 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.52 2ji8 h ALA 224 CO -0.07 0.53 -0.10 0.00 0.00 0.00 0.00 179.25 179.61 2ji8 h ALA 225 N 0.97 -0.29 -0.98 0.00 0.00 -1.36 -2.86 119.26 114.74 2ji8 h ALA 225 Ca 0.16 -0.08 0.25 0.00 0.00 0.00 0.00 54.91 55.23 2ji8 h ALA 225 Cb 0.49 0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.32 2ji8 h ALA 225 CO 0.02 -0.63 0.66 -0.92 0.00 0.00 0.00 179.25 178.38 2ji8 h TYR 226 N -0.34 0.46 0.00 0.00 3.20 -0.47 -2.46 116.97 117.36 2ji8 h TYR 226 Ca -0.03 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.84 2ji8 h TYR 226 Cb 0.26 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.39 2ji8 h TYR 226 CO -0.05 0.08 -0.05 0.00 -1.64 0.00 0.00 178.16 176.50 2ji8 h ALA 227 N 1.59 1.10 -5.85 1.82 0.00 -1.21 -3.46 119.26 113.24 2ji8 h ALA 227 Ca 0.52 -0.05 -0.35 0.00 0.00 0.00 0.00 54.91 55.03 2ji8 h ALA 227 Cb 1.48 -0.01 0.13 0.00 0.00 0.00 0.00 17.79 19.39 2ji8 h ALA 227 CO -0.18 0.07 -0.86 1.04 0.00 0.00 0.00 179.25 179.32 2ji8 n GLN 228 N -3.30 -3.42 -2.88 0.00 6.02 -0.93 -4.90 117.38 107.98 2ji8 n GLN 228 Ca -0.01 0.70 -0.19 0.00 -0.01 0.00 0.00 57.00 57.48 2ji8 n GLN 228 Cb 0.22 -5.25 -0.01 0.00 1.02 0.00 0.00 30.24 26.23 2ji8 n GLN 228 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ji8 h ASP 230 N 2.92 0.81 -0.34 0.00 3.32 -1.91 -1.71 116.42 119.51 2ji8 h ASP 230 Ca 0.09 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 56.97 2ji8 h ASP 230 Cb 0.91 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 2ji8 h ASP 230 CO 0.63 0.58 -0.34 0.44 -1.72 0.00 0.00 179.24 178.83 2ji8 h ASP 231 N 0.95 0.93 -0.29 6.45 3.32 -1.93 -1.64 116.42 124.22 2ji8 h ASP 231 Ca 0.26 -0.40 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 2ji8 h ASP 231 Cb -0.10 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.17 2ji8 h ASP 231 CO -0.06 1.18 0.12 -0.33 -1.72 0.00 0.00 179.24 178.43 2ji8 h GLU 232 N 0.73 0.43 -0.50 3.56 4.39 -1.92 -1.37 114.58 119.89 2ji8 h GLU 232 Ca 0.07 -0.07 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 2ji8 h GLU 232 Cb 0.92 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.48 2ji8 h GLU 232 CO 0.08 0.44 0.04 0.82 -1.16 0.00 0.00 179.01 179.23 2ji8 h ILE 233 N 0.32 1.26 -0.62 3.13 2.04 -1.29 -1.87 117.51 120.48 2ji8 h ILE 233 Ca 0.10 -1.01 -0.07 0.00 1.00 0.00 0.00 64.86 64.88 2ji8 h ILE 233 Cb 0.16 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 2ji8 h ILE 233 CO -0.01 0.36 0.12 -0.09 0.00 0.00 0.00 178.15 178.53 2ji8 h ARG 234 N 0.72 1.00 -0.58 2.37 2.43 -1.28 -2.04 114.38 117.00 2ji8 h ARG 234 Ca 0.15 -0.24 -0.07 0.00 -0.81 0.00 0.00 59.98 59.00 2ji8 h ARG 234 Cb 0.46 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 2ji8 h ARG 234 CO 0.02 0.91 0.07 0.00 -1.51 0.00 0.00 179.97 179.45 2ji8 h ALA 235 N 1.18 1.04 -0.18 2.80 0.00 -1.07 -0.11 119.26 122.92 2ji8 h ALA 235 Ca 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2ji8 h ALA 235 Cb 0.38 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2ji8 h ALA 235 CO 0.01 0.61 0.08 1.25 0.00 0.00 0.00 179.25 181.19 2ji8 h LEU 236 N 0.88 0.24 -0.66 0.00 5.85 -1.05 0.28 115.31 120.86 2ji8 h LEU 236 Ca 0.18 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 2ji8 h LEU 236 Cb 0.42 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 2ji8 h LEU 236 CO 0.01 0.32 0.28 0.58 -0.34 0.00 0.00 178.44 179.29 2ji8 h VAL 237 N 0.14 1.23 -0.15 1.05 2.07 -1.19 -2.22 116.25 117.20 2ji8 h VAL 237 Ca 0.06 -0.72 -0.10 0.00 0.82 0.00 0.00 66.70 66.77 2ji8 h VAL 237 Cb 0.15 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 2ji8 h VAL 237 CO -0.01 0.29 -0.29 -0.33 0.02 0.00 0.00 177.57 177.25 2ji8 h GLU 238 N 0.92 0.45 -0.81 1.57 5.08 -0.96 -1.61 114.58 119.23 2ji8 h GLU 238 Ca 0.22 -0.29 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 2ji8 h GLU 238 Cb 0.18 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 2ji8 h GLU 238 CO -0.02 0.89 0.33 0.93 -1.00 0.00 0.00 179.01 180.14 2ji8 h GLU 239 N 0.07 1.21 0.00 2.33 5.08 -0.94 -2.99 114.58 119.34 2ji8 h GLU 239 Ca 0.01 -0.22 -0.07 0.00 -1.00 0.00 0.00 59.36 58.08 2ji8 h GLU 239 Cb 0.88 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 2ji8 h GLU 239 CO 0.06 0.97 -0.44 1.79 -1.00 0.00 0.00 179.01 180.40 2ji8 h THR 240 N 1.18 0.53 -0.07 1.13 1.35 -1.43 -3.44 112.91 112.15 2ji8 h THR 240 Ca 0.27 -1.77 -0.03 0.00 -0.55 0.00 0.00 66.41 64.33 2ji8 h THR 240 Cb 0.21 2.22 -0.01 0.00 -1.73 0.00 0.00 68.15 68.84 2ji8 h THR 240 CO -0.02 0.30 -0.03 0.61 -0.25 0.00 0.00 175.52 176.13 2ji8 n GLY 241 N 1.20 0.46 3.72 5.82 0.00 -0.61 -0.73 105.19 115.05 2ji8 n GLY 241 Ca 0.02 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 2ji8 n GLY 241 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ji8 s ILE 242 N -1.80 4.54 0.55 -0.61 1.01 -1.20 -4.33 121.20 119.36 2ji8 s ILE 242 Ca 0.00 1.88 -0.20 0.00 0.00 0.00 0.00 60.65 62.33 2ji8 s ILE 242 Cb 0.00 -4.20 -0.06 0.00 0.01 0.00 0.00 42.46 38.20 2ji8 s ILE 242 CO 0.00 0.18 1.01 -2.65 0.00 0.00 0.00 174.94 173.48 2ji8 n PRO 243 N 3.64 1.11 -4.09 2.79 -0.02 -1.26 -4.78 135.00 132.39 2ji8 n PRO 243 Ca 0.06 0.42 -0.12 0.00 -2.02 0.00 0.00 63.50 61.83 2ji8 n PRO 243 Cb 0.49 -2.18 -0.11 0.00 -0.02 0.00 0.00 33.50 31.69 2ji8 n PRO 243 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2ji8 s PHE 244 N -1.44 0.73 -0.07 6.00 -0.12 -0.62 -1.13 117.98 121.33 2ji8 s PHE 244 Ca 0.72 -0.60 0.02 0.00 -0.05 0.00 0.00 56.93 57.01 2ji8 s PHE 244 Cb -0.45 -0.43 0.02 0.00 -0.63 0.00 0.00 43.02 41.52 2ji8 s PHE 244 CO 0.50 -0.10 -0.11 -0.51 -0.05 0.00 0.00 175.22 174.96 2ji8 s LEU 245 N -1.93 1.53 0.08 -1.99 1.43 0.03 -0.69 118.68 117.14 2ji8 s LEU 245 Ca -0.05 -0.29 -0.13 0.00 -1.03 0.00 0.00 54.13 52.64 2ji8 s LEU 245 Cb -0.06 -0.80 -0.06 0.00 0.03 0.00 0.00 46.19 45.29 2ji8 s LEU 245 CO -0.01 -0.00 0.46 -2.16 0.23 0.00 0.00 176.35 174.87 2ji8 s PRO 246 N 0.89 3.89 0.89 1.29 0.04 -1.26 -1.49 135.00 139.24 2ji8 s PRO 246 Ca -0.10 0.36 -0.13 0.00 0.04 0.00 0.00 61.00 61.16 2ji8 s PRO 246 Cb -0.15 -3.04 0.13 0.00 0.04 0.00 0.00 34.50 31.48 2ji8 s PRO 246 CO 0.01 0.57 1.18 -1.64 0.04 0.00 0.00 177.00 177.16 2ji8 s MET 247 N -1.70 1.32 0.20 4.56 -1.94 0.62 -4.79 119.30 117.56 2ji8 s MET 247 Ca 0.32 0.08 -0.16 0.00 -1.71 0.00 0.00 55.69 54.23 2ji8 s MET 247 Cb -0.15 -1.88 0.18 0.00 2.01 0.00 0.00 34.83 34.99 2ji8 s MET 247 CO 0.17 -2.04 1.63 0.78 -0.01 0.00 0.00 175.02 175.55 2ji8 h GLY 248 N -1.38 0.29 -1.21 -0.03 0.00 -1.99 0.10 103.07 98.86 2ji8 h GLY 248 Ca -0.47 0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.10 2ji8 h GLY 248 CO 0.59 -0.22 0.00 1.03 0.00 0.00 0.00 176.54 177.93 2ji8 n MET 249 N -5.41 1.95 0.00 4.80 2.81 -1.26 -3.44 117.12 116.57 2ji8 n MET 249 Ca 0.06 -1.42 0.12 0.00 -1.81 0.00 0.00 57.70 54.64 2ji8 n MET 249 Cb 0.32 -1.44 0.16 0.00 -0.71 0.00 0.00 33.22 31.55 2ji8 n MET 249 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2ji8 n ALA 250 N 0.66 3.78 -1.64 3.04 0.00 0.30 -4.70 120.51 121.95 2ji8 n ALA 250 Ca 0.17 -0.44 -0.48 0.00 0.00 0.00 0.00 53.44 52.70 2ji8 n ALA 250 Cb 0.42 -1.02 -0.04 0.00 0.00 0.00 0.00 19.45 18.81 2ji8 n ALA 250 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2ji8 n LYS 251 N -1.29 1.77 0.00 0.00 5.02 -0.86 -1.58 118.16 121.22 2ji8 n LYS 251 Ca 0.06 0.64 0.00 0.00 -2.02 0.00 0.00 58.31 56.99 2ji8 n LYS 251 Cb 0.34 -2.32 0.00 0.00 -0.02 0.00 0.00 35.03 33.03 2ji8 n LYS 251 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ji8 n GLY 252 N 2.81 2.00 0.33 0.72 0.00 -1.19 -4.64 105.19 105.22 2ji8 n GLY 252 Ca 0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.04 2ji8 n GLY 252 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2ji8 h LEU 253 N 0.00 -0.84 -9.93 0.99 7.12 -1.51 -2.51 115.31 108.63 2ji8 h LEU 253 Ca 0.00 0.08 -0.60 0.00 0.13 0.00 0.00 57.88 57.49 2ji8 h LEU 253 Cb 0.00 0.29 -0.04 0.00 -0.53 0.00 0.00 40.66 40.39 2ji8 h LEU 253 CO 0.00 -0.43 -0.44 -0.76 -0.13 0.00 0.00 178.44 176.68 2ji8 s LEU 254 N -10.22 4.33 0.28 2.25 1.02 -1.26 -4.72 118.68 110.35 2ji8 s LEU 254 Ca -0.16 0.35 -0.29 0.00 0.02 0.00 0.00 54.13 54.04 2ji8 s LEU 254 Cb 0.07 -3.06 -0.13 0.00 0.02 0.00 0.00 46.19 43.09 2ji8 s LEU 254 CO 0.64 0.12 1.26 -2.65 0.02 0.00 0.00 176.35 175.74 2ji8 n PRO 255 N 0.15 1.85 0.28 1.29 -0.02 -1.26 -4.84 135.00 132.45 2ji8 n PRO 255 Ca -0.04 0.65 0.18 0.00 -2.02 0.00 0.00 63.50 62.27 2ji8 n PRO 255 Cb 0.51 -2.21 0.83 0.00 -0.02 0.00 0.00 33.50 32.61 2ji8 n PRO 255 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2ji8 h ASP 256 N 3.05 0.00 -0.47 2.55 3.32 -1.52 -1.03 116.42 122.32 2ji8 h ASP 256 Ca -0.44 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 2ji8 h ASP 256 Cb 1.30 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 2ji8 h ASP 256 CO 0.67 0.00 0.02 -0.46 -1.72 0.00 0.00 179.24 177.75 2ji8 n ASN 257 N -2.99 4.74 -4.75 6.45 6.94 -1.26 -4.88 115.26 119.50 2ji8 n ASN 257 Ca -0.00 -2.76 -0.41 0.00 -0.02 0.00 0.00 54.58 51.39 2ji8 n ASN 257 Cb 0.22 -0.65 -0.02 0.00 -2.36 0.00 0.00 39.78 36.97 2ji8 n ASN 257 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 2ji8 s HIS 258 N -2.41 2.95 -0.01 -2.53 2.46 -0.39 -4.90 115.29 110.46 2ji8 s HIS 258 Ca 0.43 1.10 0.29 0.00 0.47 0.00 0.00 55.06 57.35 2ji8 s HIS 258 Cb 0.33 -3.84 1.47 0.00 -0.13 0.00 0.00 32.58 30.41 2ji8 s HIS 258 CO 0.12 -2.62 1.87 -1.00 -2.47 0.00 0.00 174.74 170.64 2ji8 h PRO 259 N 4.43 0.00 -0.08 2.88 0.13 -1.93 -1.46 132.00 135.97 2ji8 h PRO 259 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2ji8 h PRO 259 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2ji8 h PRO 259 CO 0.74 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.55 2ji8 n GLN 260 N -2.52 1.82 -2.28 0.86 6.02 -1.26 -4.92 117.38 115.10 2ji8 n GLN 260 Ca -0.01 -1.21 -0.41 0.00 -0.01 0.00 0.00 57.00 55.36 2ji8 n GLN 260 Cb 0.10 -1.46 -0.03 0.00 1.02 0.00 0.00 30.24 29.87 2ji8 n GLN 260 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2ji8 s SER 261 N -1.86 6.96 -0.10 1.08 0.15 -0.55 -1.58 113.70 117.80 2ji8 s SER 261 Ca 0.35 2.32 0.13 0.00 0.70 0.00 0.00 55.95 59.45 2ji8 s SER 261 Cb 0.20 -2.61 0.36 0.00 -1.71 0.00 0.00 66.02 62.26 2ji8 s SER 261 CO 0.31 -0.48 1.27 0.00 1.20 0.00 0.00 173.24 175.54 2ji8 n ALA 262 N 2.77 2.51 -0.32 5.45 0.00 0.13 -4.74 120.51 126.32 2ji8 n ALA 262 Ca 0.06 -1.92 0.11 0.00 0.00 0.00 0.00 53.44 51.69 2ji8 n ALA 262 Cb 0.44 -0.48 0.28 0.00 0.00 0.00 0.00 19.45 19.68 2ji8 n ALA 262 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ji8 h ALA 263 N 1.26 1.47 0.00 0.00 0.00 -1.91 -0.66 119.26 119.41 2ji8 h ALA 263 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2ji8 h ALA 263 Cb 1.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2ji8 h ALA 263 CO 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.21 2ji8 n ALA 264 N -2.40 2.34 -2.75 0.00 0.00 -1.26 -3.19 120.51 113.25 2ji8 n ALA 264 Ca 0.21 -0.14 -0.05 0.00 0.00 0.00 0.00 53.44 53.46 2ji8 n ALA 264 Cb 0.54 -1.40 0.04 0.00 0.00 0.00 0.00 19.45 18.63 2ji8 n ALA 264 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2ji8 n THR 265 N -1.11 1.14 0.02 0.00 5.66 -0.28 -4.66 114.28 115.05 2ji8 n THR 265 Ca 0.16 -2.99 -0.12 0.00 -3.05 0.00 0.00 64.05 58.05 2ji8 n THR 265 Cb 0.13 0.99 -0.07 0.00 -1.55 0.00 0.00 70.33 69.83 2ji8 n THR 265 CO 0.00 0.00 0.00 -0.09 -3.05 0.00 0.00 175.07 171.93 2ji8 h ARG 266 N 2.80 0.04 -0.02 1.09 2.43 -1.46 -2.10 114.38 117.17 2ji8 h ARG 266 Ca -0.12 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.08 2ji8 h ARG 266 Cb 1.23 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.71 2ji8 h ARG 266 CO 0.34 0.08 -0.38 0.00 -1.51 0.00 0.00 179.97 178.50 2ji8 h ALA 267 N 0.96 -0.57 -0.71 2.80 0.00 -1.90 -1.26 119.26 118.58 2ji8 h ALA 267 Ca 0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2ji8 h ALA 267 Cb 0.05 0.68 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 2ji8 h ALA 267 CO -0.00 -0.90 0.31 0.35 0.00 0.00 0.00 179.25 179.01 2ji8 h PHE 268 N -0.52 1.03 0.10 0.00 3.57 -1.93 -1.26 116.94 117.93 2ji8 h PHE 268 Ca 0.06 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2ji8 h PHE 268 Cb 0.62 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.04 2ji8 h PHE 268 CO -0.40 0.77 -0.05 0.00 -2.23 0.00 0.00 178.31 176.40 2ji8 h ALA 269 N 1.32 -0.14 -0.25 2.41 0.00 -0.91 -1.77 119.26 119.93 2ji8 h ALA 269 Ca 0.24 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2ji8 h ALA 269 Cb 0.15 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2ji8 h ALA 269 CO -0.03 -0.46 0.05 -0.07 0.00 0.00 0.00 179.25 178.74 2ji8 h LEU 270 N -0.37 0.39 -1.59 0.00 3.38 -1.16 -1.42 115.31 114.53 2ji8 h LEU 270 Ca -0.01 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 2ji8 h LEU 270 Cb 0.31 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2ji8 h LEU 270 CO 0.02 0.54 0.24 0.00 0.09 0.00 0.00 178.44 179.33 2ji8 h ALA 271 N 0.86 1.70 0.00 1.53 0.00 -0.98 -3.26 119.26 119.10 2ji8 h ALA 271 Ca 0.08 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2ji8 h ALA 271 Cb 0.31 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2ji8 h ALA 271 CO 0.00 0.27 -0.79 1.04 0.00 0.00 0.00 179.25 179.78 2ji8 n GLN 272 N -4.46 2.05 -1.34 0.00 1.13 -0.67 -3.92 117.38 110.17 2ji8 n GLN 272 Ca 0.03 -0.01 -0.33 0.00 -1.94 0.00 0.00 57.00 54.74 2ji8 n GLN 272 Cb 0.07 -1.20 0.10 0.00 0.11 0.00 0.00 30.24 29.32 2ji8 n GLN 272 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2ji8 n ASP 274 N -3.01 1.78 -4.44 0.00 5.68 -0.90 -4.96 116.55 110.72 2ji8 n ASP 274 Ca 0.12 0.30 -0.34 0.00 -0.50 0.00 0.00 54.79 54.37 2ji8 n ASP 274 Cb 0.51 -0.73 -0.13 0.00 -1.14 0.00 0.00 41.12 39.63 2ji8 n ASP 274 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2ji8 s VAL 275 N -2.46 3.80 -0.21 2.12 1.01 -1.26 -1.48 120.40 121.92 2ji8 s VAL 275 Ca -0.35 -0.37 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 2ji8 s VAL 275 Cb 0.13 -2.70 0.01 0.00 0.00 0.00 0.00 36.38 33.83 2ji8 s VAL 275 CO 0.45 0.45 -0.12 0.00 0.00 0.00 0.00 175.10 175.88 2ji8 s VAL 277 N 1.36 5.08 -0.33 0.00 1.01 0.03 -1.14 120.40 126.42 2ji8 s VAL 277 Ca 0.04 -0.87 -0.20 0.00 0.00 0.00 0.00 61.98 60.95 2ji8 s VAL 277 Cb -0.14 -4.22 -0.01 0.00 0.00 0.00 0.00 36.38 32.01 2ji8 s VAL 277 CO -0.08 -0.71 0.61 -0.76 0.00 0.00 0.00 175.10 174.16 2ji8 s LEU 278 N 2.06 4.21 -0.34 3.92 1.43 0.10 -0.74 118.68 129.31 2ji8 s LEU 278 Ca 0.08 0.27 -0.02 0.00 -1.03 0.00 0.00 54.13 53.43 2ji8 s LEU 278 Cb -0.23 -2.76 0.07 0.00 0.03 0.00 0.00 46.19 43.30 2ji8 s LEU 278 CO 0.08 -0.51 0.07 -0.63 0.23 0.00 0.00 176.35 175.60 2ji8 s ILE 279 N 2.60 3.08 -1.44 -0.59 1.01 -0.47 -0.20 121.20 125.19 2ji8 s ILE 279 Ca 0.24 -1.63 -0.10 0.00 0.00 0.00 0.00 60.65 59.15 2ji8 s ILE 279 Cb -0.15 -2.91 0.05 0.00 0.01 0.00 0.00 42.46 39.46 2ji8 s ILE 279 CO 0.13 -0.32 1.03 0.61 0.00 0.00 0.00 174.94 176.39 2ji8 n GLY 280 N 4.60 -0.49 2.75 6.18 0.00 -0.83 -2.02 105.19 115.38 2ji8 n GLY 280 Ca -0.09 0.21 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 2ji8 n GLY 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ji8 s ALA 281 N -3.34 0.42 0.34 4.61 0.00 -1.26 -2.02 121.76 120.50 2ji8 s ALA 281 Ca 0.55 0.07 -0.20 0.00 0.00 0.00 0.00 51.96 52.38 2ji8 s ALA 281 Cb -0.26 -0.58 -0.10 0.00 0.00 0.00 0.00 23.12 22.18 2ji8 s ALA 281 CO 0.79 -0.37 0.84 1.03 0.00 0.00 0.00 175.76 178.05 2ji8 s ARG 282 N 1.79 4.22 -0.08 0.00 0.52 -1.26 -4.94 118.95 119.21 2ji8 s ARG 282 Ca 0.01 0.97 -0.03 0.00 -0.52 0.00 0.00 55.73 56.16 2ji8 s ARG 282 Cb -0.12 -2.50 -0.09 0.00 0.52 0.00 0.00 34.95 32.75 2ji8 s ARG 282 CO -0.03 0.16 2.80 1.28 0.02 0.00 0.00 175.30 179.53 2ji8 n LEU 283 N -0.08 5.52 0.00 2.53 4.32 -1.26 -4.68 117.00 123.35 2ji8 n LEU 283 Ca 0.03 -3.00 0.00 0.00 -0.02 0.00 0.00 56.01 53.02 2ji8 n LEU 283 Cb 0.52 -1.26 0.00 0.00 -1.62 0.00 0.00 43.42 41.06 2ji8 n LEU 283 CO 0.41 1.41 0.00 -0.46 -1.22 0.00 0.00 177.39 177.53 2ji8 n ASN 284 N 1.77 0.00 0.21 -1.43 0.23 -1.26 -3.36 115.26 111.42 2ji8 n ASN 284 Ca 0.27 0.00 0.04 0.00 -0.53 0.00 0.00 54.58 54.36 2ji8 n ASN 284 Cb 0.70 0.00 0.45 0.00 -2.08 0.00 0.00 39.78 38.85 2ji8 n ASN 284 CO 0.00 0.00 0.00 4.11 -0.93 0.00 0.00 177.26 180.44 2ji8 h TRP 285 N 0.00 0.00 0.00 -2.53 5.08 -1.94 -0.06 115.95 116.51 2ji8 h TRP 285 Ca 0.00 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.97 2ji8 h TRP 285 Cb 0.00 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.16 2ji8 h TRP 285 CO 0.00 0.25 -0.00 -0.07 -1.28 0.00 0.00 178.44 177.34 2ji8 h LEU 286 N 0.00 0.00 -3.05 0.11 3.38 -1.91 -0.78 115.31 113.05 2ji8 h LEU 286 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ji8 h LEU 286 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2ji8 h LEU 286 CO 0.03 0.00 0.00 0.23 0.09 0.00 0.00 178.44 178.80 2ji8 n MET 287 N -3.12 2.46 -3.17 1.13 2.81 -0.78 -4.97 117.12 111.46 2ji8 n MET 287 Ca -0.02 -2.32 -0.22 0.00 -1.81 0.00 0.00 57.70 53.32 2ji8 n MET 287 Cb 0.14 -1.45 0.01 0.00 -0.71 0.00 0.00 33.22 31.21 2ji8 n MET 287 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2ji8 n GLN 288 N -0.57 -3.83 -1.44 0.03 3.00 -0.30 -2.70 117.38 111.58 2ji8 n GLN 288 Ca 0.13 0.64 -0.15 0.00 -0.01 0.00 0.00 57.00 57.61 2ji8 n GLN 288 Cb 0.59 -5.39 -0.06 0.00 0.00 0.00 0.00 30.24 25.38 2ji8 n GLN 288 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 2ji8 n HIS 289 N -4.10 0.00 -1.20 1.08 8.25 -0.10 -2.23 115.22 116.91 2ji8 n HIS 289 Ca -0.06 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.33 2ji8 n HIS 289 Cb 0.57 -2.91 -0.03 0.00 1.12 0.00 0.00 29.99 28.75 2ji8 n HIS 289 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2ji8 n GLY 290 N -0.40 0.91 3.27 -1.41 0.00 -1.10 -4.38 105.19 102.08 2ji8 n GLY 290 Ca -0.15 -0.61 -0.15 0.00 0.00 0.00 0.00 46.02 45.12 2ji8 n GLY 290 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ji8 s LYS 291 N -2.45 1.21 1.41 1.61 -2.85 -0.95 -4.81 119.74 112.90 2ji8 s LYS 291 Ca 0.00 -1.60 0.00 0.00 -1.00 0.00 0.00 55.97 53.37 2ji8 s LYS 291 Cb 0.00 -0.32 0.00 0.00 -2.06 0.00 0.00 37.83 35.45 2ji8 s LYS 291 CO 0.00 -0.16 0.00 0.41 0.10 0.00 0.00 175.35 175.70 2ji8 n GLY 292 N -0.32 -1.85 0.29 0.59 0.00 -1.26 -4.42 105.19 98.22 2ji8 n GLY 292 Ca -0.05 -1.38 0.09 0.00 0.00 0.00 0.00 46.02 44.68 2ji8 n GLY 292 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ji8 h LYS 293 N 0.00 0.15 0.00 1.61 1.57 -1.97 -1.16 116.57 116.77 2ji8 h LYS 293 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2ji8 h LYS 293 Cb 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2ji8 h LYS 293 CO 0.00 0.10 0.00 0.00 -0.57 0.00 0.00 179.45 178.98 2ji8 h THR 294 N 0.15 0.00 -0.14 -0.16 1.03 -1.96 0.13 112.91 111.97 2ji8 h THR 294 Ca 0.47 -0.04 0.00 0.00 -0.01 0.00 0.00 66.41 66.84 2ji8 h THR 294 Cb 0.89 0.94 0.00 0.00 -1.07 0.00 0.00 68.15 68.92 2ji8 h THR 294 CO -0.66 0.00 0.00 0.79 -0.01 0.00 0.00 175.52 175.64 2ji8 n TRP 295 N -2.93 0.44 -1.78 0.00 7.02 -0.53 -2.64 117.44 117.01 2ji8 n TRP 295 Ca -0.02 -0.87 -0.10 0.00 -1.02 0.00 0.00 57.50 55.49 2ji8 n TRP 295 Cb 0.08 -0.20 -0.02 0.00 -2.42 0.00 0.00 31.31 28.75 2ji8 n TRP 295 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2ji8 n GLY 296 N -0.81 0.50 3.79 6.99 0.00 0.03 -3.39 105.19 112.30 2ji8 n GLY 296 Ca 0.17 -0.51 -0.26 0.00 0.00 0.00 0.00 46.02 45.41 2ji8 n GLY 296 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ji8 n ASP 297 N 0.19 -3.96 -3.68 1.61 8.00 -0.65 -4.97 116.55 113.09 2ji8 n ASP 297 Ca -0.11 -0.75 -0.12 0.00 0.71 0.00 0.00 54.79 54.52 2ji8 n ASP 297 Cb 0.47 -4.17 -0.06 0.00 -0.02 0.00 0.00 41.12 37.35 2ji8 n ASP 297 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 2ji8 s GLU 298 N -6.35 0.94 -0.44 -1.24 -1.05 -1.22 -4.96 118.70 104.39 2ji8 s GLU 298 Ca 0.45 -0.50 -0.27 0.00 -0.15 0.00 0.00 54.97 54.49 2ji8 s GLU 298 Cb -0.22 0.42 0.02 0.00 -0.44 0.00 0.00 34.13 33.91 2ji8 s GLU 298 CO 0.81 -0.33 1.02 -1.17 0.95 0.00 0.00 175.26 176.53 2ji8 s LEU 299 N -2.27 3.86 0.98 1.83 2.96 -1.26 -4.89 118.68 119.89 2ji8 s LEU 299 Ca -0.03 0.42 -0.12 0.00 -0.22 0.00 0.00 54.13 54.18 2ji8 s LEU 299 Cb 0.00 -3.37 0.18 0.00 0.50 0.00 0.00 46.19 43.50 2ji8 s LEU 299 CO -0.06 -1.07 1.08 -0.54 -1.32 0.00 0.00 176.35 174.44 2ji8 s LYS 300 N 3.95 0.55 -0.71 1.98 -0.14 -1.26 -4.96 119.74 119.15 2ji8 s LYS 300 Ca 0.42 0.72 -0.22 0.00 -1.36 0.00 0.00 55.97 55.53 2ji8 s LYS 300 Cb -0.09 -1.73 0.08 0.00 -1.68 0.00 0.00 37.83 34.40 2ji8 s LYS 300 CO 0.26 -2.70 1.01 0.15 -0.76 0.00 0.00 175.35 173.30 2ji8 s LYS 301 N -4.86 3.19 -0.10 1.68 1.02 -0.55 -4.90 119.74 115.23 2ji8 s LYS 301 Ca 0.65 -0.97 -0.27 0.00 0.02 0.00 0.00 55.97 55.40 2ji8 s LYS 301 Cb -0.19 -4.36 -0.02 0.00 -0.52 0.00 0.00 37.83 32.74 2ji8 s LYS 301 CO 0.58 -1.83 0.90 0.71 -0.92 0.00 0.00 175.35 174.79 2ji8 s TYR 302 N 3.91 3.52 -0.13 3.18 2.02 -1.26 -1.93 117.35 126.67 2ji8 s TYR 302 Ca 0.24 1.45 -0.09 0.00 -0.37 0.00 0.00 57.07 58.31 2ji8 s TYR 302 Cb -0.15 -3.06 -0.04 0.00 -0.40 0.00 0.00 41.96 38.31 2ji8 s TYR 302 CO 0.07 -0.14 0.17 0.08 -1.57 0.00 0.00 175.55 174.17 2ji8 s VAL 303 N 1.66 5.43 -0.03 0.71 1.01 -0.29 -1.70 120.40 127.18 2ji8 s VAL 303 Ca 0.44 0.29 -0.01 0.00 0.00 0.00 0.00 61.98 62.70 2ji8 s VAL 303 Cb -0.18 -3.46 0.03 0.00 0.00 0.00 0.00 36.38 32.77 2ji8 s VAL 303 CO 0.18 0.56 0.05 -1.58 0.00 0.00 0.00 175.10 174.31 2ji8 s GLN 304 N -0.59 -0.04 -0.27 2.72 0.74 -1.00 0.01 119.66 121.23 2ji8 s GLN 304 Ca 0.14 0.27 -0.07 0.00 0.05 0.00 0.00 55.36 55.76 2ji8 s GLN 304 Cb -0.12 -0.32 -0.01 0.00 1.10 0.00 0.00 33.01 33.65 2ji8 s GLN 304 CO 0.03 -0.22 0.06 0.42 -0.55 0.00 0.00 175.29 175.03 2ji8 s ILE 305 N 1.46 4.05 -0.12 -2.34 1.01 0.72 0.03 121.20 126.00 2ji8 s ILE 305 Ca -0.04 -0.43 -0.21 0.00 0.00 0.00 0.00 60.65 59.96 2ji8 s ILE 305 Cb -0.13 -2.97 0.05 0.00 0.01 0.00 0.00 42.46 39.42 2ji8 s ILE 305 CO -0.03 0.24 0.53 -0.62 0.00 0.00 0.00 174.94 175.06 2ji8 s ASP 306 N 1.55 -0.51 0.47 3.58 -1.08 -0.67 -1.96 116.67 118.06 2ji8 s ASP 306 Ca 0.05 0.77 0.27 0.00 -0.52 0.00 0.00 52.55 53.12 2ji8 s ASP 306 Cb -0.16 0.78 0.79 0.00 -1.46 0.00 0.00 42.92 42.87 2ji8 s ASP 306 CO 0.02 -0.36 1.77 -0.29 0.52 0.00 0.00 175.17 176.83 2ji8 h ILE 307 N 3.84 0.10 -3.24 4.11 2.10 -1.81 -2.41 117.51 120.19 2ji8 h ILE 307 Ca -0.28 -0.89 -0.67 0.00 1.08 0.00 0.00 64.86 64.10 2ji8 h ILE 307 Cb 1.16 1.81 -0.17 0.00 -1.09 0.00 0.00 36.82 38.54 2ji8 h ILE 307 CO 0.27 0.05 0.17 -1.58 -1.08 0.00 0.00 178.15 175.98 2ji8 s GLN 308 N -3.42 3.17 0.18 2.19 2.00 -1.26 -4.57 119.66 117.96 2ji8 s GLN 308 Ca 0.04 -0.74 -0.14 0.00 -2.00 0.00 0.00 55.36 52.52 2ji8 s GLN 308 Cb 0.07 -4.09 0.17 0.00 0.80 0.00 0.00 33.01 29.97 2ji8 s GLN 308 CO 0.62 -1.28 1.69 0.00 -0.50 0.00 0.00 175.29 175.82 2ji8 h ALA 309 N 9.07 0.46 -0.11 1.58 0.00 -1.99 -2.06 119.26 126.22 2ji8 h ALA 309 Ca -0.27 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2ji8 h ALA 309 Cb 1.09 0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2ji8 h ALA 309 CO 0.99 -0.38 0.00 0.27 0.00 0.00 0.00 179.25 180.14 2ji8 n ASN 310 N -5.20 0.75 0.19 0.00 6.94 -1.26 -2.30 115.26 114.38 2ji8 n ASN 310 Ca 0.05 -1.75 0.04 0.00 -0.02 0.00 0.00 54.58 52.90 2ji8 n ASN 310 Cb 0.25 -0.07 0.38 0.00 -2.36 0.00 0.00 39.78 37.99 2ji8 n ASN 310 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 2ji8 h GLU 311 N 0.91 0.00 -6.95 -3.83 4.57 -1.79 -3.42 114.58 104.07 2ji8 h GLU 311 Ca 0.00 0.00 -0.53 0.00 -1.18 0.00 0.00 59.36 57.65 2ji8 h GLU 311 Cb 0.20 0.00 0.10 0.00 -0.16 0.00 0.00 28.75 28.89 2ji8 h GLU 311 CO 0.00 0.36 0.69 -1.64 -1.18 0.00 0.00 179.01 177.25 2ji8 s MET 312 N -4.07 3.98 -1.68 1.92 -1.94 -0.97 -1.87 119.30 114.67 2ji8 s MET 312 Ca -0.02 2.37 0.00 0.00 -1.71 0.00 0.00 55.69 56.33 2ji8 s MET 312 Cb 0.14 -2.83 0.00 0.00 2.01 0.00 0.00 34.83 34.14 2ji8 s MET 312 CO 0.71 -0.56 0.00 -0.25 -0.01 0.00 0.00 175.02 174.90 2ji8 n ASP 313 N 0.22 -4.76 0.21 3.03 8.00 -1.26 -4.88 116.55 117.11 2ji8 n ASP 313 Ca 0.03 0.28 0.05 0.00 0.71 0.00 0.00 54.79 55.86 2ji8 n ASP 313 Cb 0.41 -4.16 0.46 0.00 -0.02 0.00 0.00 41.12 37.82 2ji8 n ASP 313 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 2ji8 h SER 314 N 0.00 0.00 0.00 -2.24 4.64 -1.62 -3.42 113.55 110.91 2ji8 h SER 314 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2ji8 h SER 314 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2ji8 h SER 314 CO 0.50 0.28 -0.27 0.59 -0.87 0.00 0.00 176.83 177.07 2ji8 n ASN 315 N -3.98 0.09 -4.24 4.97 3.02 -1.26 -5.11 115.26 108.76 2ji8 n ASN 315 Ca -0.02 0.11 -0.15 0.00 -0.03 0.00 0.00 54.58 54.49 2ji8 n ASN 315 Cb 0.35 0.04 -0.10 0.00 -0.61 0.00 0.00 39.78 39.46 2ji8 n ASN 315 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2ji8 s GLN 316 N -2.00 1.01 0.41 3.52 -1.52 -1.26 -4.99 119.66 114.83 2ji8 s GLN 316 Ca 0.00 -1.34 -0.27 0.00 -1.95 0.00 0.00 55.36 51.80 2ji8 s GLN 316 Cb 0.00 -0.69 -0.09 0.00 -0.22 0.00 0.00 33.01 32.01 2ji8 s GLN 316 CO 0.00 0.10 1.43 -2.14 -0.25 0.00 0.00 175.29 174.43 2ji8 s PRO 317 N -3.28 3.93 -0.30 2.91 0.02 -1.26 -4.11 135.00 132.90 2ji8 s PRO 317 Ca 0.13 2.43 -0.05 0.00 0.02 0.00 0.00 61.00 63.52 2ji8 s PRO 317 Cb -0.01 -2.81 0.03 0.00 0.02 0.00 0.00 34.50 31.73 2ji8 s PRO 317 CO 0.01 -0.63 0.05 0.42 -0.33 0.00 0.00 177.00 176.53 2ji8 s ILE 318 N -1.17 3.61 0.19 2.83 -1.09 -1.26 -4.62 121.20 119.68 2ji8 s ILE 318 Ca 0.57 -0.96 -0.10 0.00 -2.23 0.00 0.00 60.65 57.93 2ji8 s ILE 318 Cb -0.44 -2.93 0.11 0.00 -1.58 0.00 0.00 42.46 37.62 2ji8 s ILE 318 CO 0.58 0.00 1.74 0.00 -1.23 0.00 0.00 174.94 176.03 2ji8 h ALA 319 N 8.16 0.90 -2.61 9.38 0.00 -1.67 -3.36 119.26 130.05 2ji8 h ALA 319 Ca -0.28 -0.19 -0.60 0.00 0.00 0.00 0.00 54.91 53.83 2ji8 h ALA 319 Cb 1.10 -0.27 -0.41 0.00 0.00 0.00 0.00 17.79 18.22 2ji8 h ALA 319 CO 0.59 0.54 -0.74 0.00 0.00 0.00 0.00 179.25 179.64 2ji8 n ALA 320 N -2.41 3.29 -2.35 0.00 0.00 -0.70 -4.97 120.51 113.38 2ji8 n ALA 320 Ca 0.05 -4.08 -0.42 0.00 0.00 0.00 0.00 53.44 48.99 2ji8 n ALA 320 Cb 0.19 -0.91 -0.03 0.00 0.00 0.00 0.00 19.45 18.71 2ji8 n ALA 320 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2ji8 s PRO 321 N -1.23 4.35 -0.25 0.00 0.04 -1.26 -2.39 135.00 134.27 2ji8 s PRO 321 Ca 0.31 1.83 0.02 0.00 0.04 0.00 0.00 61.00 63.20 2ji8 s PRO 321 Cb 0.04 -3.46 0.05 0.00 0.04 0.00 0.00 34.50 31.17 2ji8 s PRO 321 CO -0.14 -0.42 -0.11 0.08 0.04 0.00 0.00 177.00 176.44 2ji8 s VAL 322 N 1.77 2.22 -0.22 -0.36 1.01 0.10 -4.86 120.40 120.06 2ji8 s VAL 322 Ca 0.60 -1.52 -0.07 0.00 0.00 0.00 0.00 61.98 60.99 2ji8 s VAL 322 Cb -0.29 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.80 2ji8 s VAL 322 CO 0.27 0.05 0.06 -0.69 0.00 0.00 0.00 175.10 174.78 2ji8 s VAL 323 N 1.14 4.42 0.00 2.92 1.01 -1.26 -1.67 120.40 126.96 2ji8 s VAL 323 Ca -0.07 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 61.77 2ji8 s VAL 323 Cb -0.19 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.15 2ji8 s VAL 323 CO -0.06 0.38 0.00 0.61 0.00 0.00 0.00 175.10 176.03 2ji8 n GLY 324 N 4.44 -0.72 3.77 4.51 0.00 -0.91 -3.77 105.19 112.51 2ji8 n GLY 324 Ca -0.16 -1.38 -0.39 0.00 0.00 0.00 0.00 46.02 44.08 2ji8 n GLY 324 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2ji8 s ASP 325 N 0.00 6.82 0.23 1.61 -4.77 -0.84 -2.73 116.67 116.99 2ji8 s ASP 325 Ca 0.00 2.37 -0.07 0.00 -3.30 0.00 0.00 52.55 51.55 2ji8 s ASP 325 Cb 0.00 -2.62 0.28 0.00 -1.09 0.00 0.00 42.92 39.49 2ji8 s ASP 325 CO 0.00 -0.47 1.86 0.40 0.70 0.00 0.00 175.17 177.66 2ji8 h ILE 326 N 2.69 1.07 -0.50 2.11 2.04 -1.93 -1.30 117.51 121.70 2ji8 h ILE 326 Ca -0.48 -0.33 0.01 0.00 1.00 0.00 0.00 64.86 65.06 2ji8 h ILE 326 Cb 1.22 0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 2ji8 h ILE 326 CO 0.64 0.18 0.32 0.50 0.00 0.00 0.00 178.15 179.79 2ji8 h LYS 327 N 0.97 0.63 -0.28 2.37 3.64 -1.92 0.16 116.57 122.13 2ji8 h LYS 327 Ca 0.35 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.65 2ji8 h LYS 327 Cb 0.10 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 2ji8 h LYS 327 CO -0.15 0.42 0.04 0.77 -2.27 0.00 0.00 179.45 178.26 2ji8 h SER 328 N 0.65 0.45 -0.32 4.20 0.02 -1.76 -2.08 113.55 114.70 2ji8 h SER 328 Ca 0.19 -0.27 -0.06 0.00 -0.84 0.00 0.00 61.79 60.81 2ji8 h SER 328 Cb -0.05 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 2ji8 h SER 328 CO -0.06 0.60 -0.04 0.00 -1.14 0.00 0.00 176.83 176.20 2ji8 h ALA 329 N 0.86 0.44 -0.47 3.77 0.00 -1.04 -2.82 119.26 120.00 2ji8 h ALA 329 Ca 0.08 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 2ji8 h ALA 329 Cb 0.35 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2ji8 h ALA 329 CO 0.01 0.23 -0.02 0.28 0.00 0.00 0.00 179.25 179.75 2ji8 h VAL 330 N 0.38 1.26 -0.92 0.00 2.07 -0.71 -0.75 116.25 117.59 2ji8 h VAL 330 Ca 0.09 -1.10 0.14 0.00 0.82 0.00 0.00 66.70 66.64 2ji8 h VAL 330 Cb 0.50 1.03 -0.09 0.00 -1.52 0.00 0.00 31.29 31.22 2ji8 h VAL 330 CO 0.02 0.38 0.53 -1.28 0.02 0.00 0.00 177.57 177.25 2ji8 h SER 331 N 0.70 0.73 -0.03 0.57 0.87 -1.37 -0.51 113.55 114.51 2ji8 h SER 331 Ca 0.13 0.07 -0.18 0.00 -1.23 0.00 0.00 61.79 60.58 2ji8 h SER 331 Cb 0.54 -0.06 0.01 0.00 -0.44 0.00 0.00 62.40 62.45 2ji8 h SER 331 CO 0.03 0.35 -0.67 -0.07 -0.53 0.00 0.00 176.83 175.94 2ji8 h LEU 332 N 0.80 0.65 -1.63 2.23 3.38 -1.23 -3.06 115.31 116.44 2ji8 h LEU 332 Ca 0.48 -0.72 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2ji8 h LEU 332 Cb 0.59 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 2ji8 h LEU 332 CO -0.31 1.28 0.25 0.25 0.09 0.00 0.00 178.44 179.99 2ji8 h LEU 333 N 0.08 0.43 -0.15 1.67 5.85 -0.78 -0.06 115.31 122.34 2ji8 h LEU 333 Ca -0.07 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 2ji8 h LEU 333 Cb 1.35 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.27 2ji8 h LEU 333 CO 0.13 0.31 -0.04 0.03 -0.34 0.00 0.00 178.44 178.54 2ji8 h ARG 334 N 0.51 0.30 -0.50 1.25 3.08 -1.15 -1.46 114.38 116.41 2ji8 h ARG 334 Ca 0.14 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 2ji8 h ARG 334 Cb -0.05 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 2ji8 h ARG 334 CO -0.03 0.58 0.12 0.87 -1.07 0.00 0.00 179.97 180.43 2ji8 h LYS 335 N -0.00 0.77 0.00 0.04 1.57 -1.35 -0.13 116.57 117.46 2ji8 h LYS 335 Ca 0.04 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.60 2ji8 h LYS 335 Cb 0.47 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 2ji8 h LYS 335 CO 0.02 0.70 -0.30 0.00 -0.57 0.00 0.00 179.45 179.29 2ji8 h ALA 336 N 1.38 1.33 -0.01 3.86 0.00 -0.88 -3.03 119.26 121.91 2ji8 h ALA 336 Ca 0.16 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2ji8 h ALA 336 Cb 0.29 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2ji8 h ALA 336 CO -0.00 0.38 -0.82 1.28 0.00 0.00 0.00 179.25 180.09 2ji8 n LEU 337 N -3.93 1.34 -4.67 0.00 4.77 -0.56 -4.99 117.00 108.95 2ji8 n LEU 337 Ca -0.02 -0.58 -0.46 0.00 -0.03 0.00 0.00 56.01 54.92 2ji8 n LEU 337 Cb 0.37 -0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.42 2ji8 n LEU 337 CO 0.36 0.29 1.26 1.17 -1.33 0.00 0.00 177.39 179.15 2ji8 n LYS 338 N -1.00 2.21 -0.03 3.23 3.00 -0.10 -1.61 118.16 123.85 2ji8 n LYS 338 Ca 0.06 0.80 0.00 0.00 -0.00 0.00 0.00 58.31 59.17 2ji8 n LYS 338 Cb 0.38 -2.59 0.00 0.00 0.00 0.00 0.00 35.03 32.82 2ji8 n LYS 338 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2ji8 n GLY 339 N 3.63 1.53 3.81 3.14 0.00 -1.26 -5.05 105.19 110.99 2ji8 n GLY 339 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 2ji8 n GLY 339 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ji8 s ALA 340 N -2.55 2.68 0.56 4.61 0.00 -0.63 -5.00 121.76 121.42 2ji8 s ALA 340 Ca 0.00 0.26 -0.20 0.00 0.00 0.00 0.00 51.96 52.01 2ji8 s ALA 340 Cb 0.00 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 19.85 2ji8 s ALA 340 CO 0.00 -1.05 1.13 -2.30 0.00 0.00 0.00 175.76 173.54 2ji8 n PRO 341 N -2.60 1.26 -1.44 0.00 -0.02 -1.26 -4.99 135.00 125.95 2ji8 n PRO 341 Ca 0.08 0.47 -0.29 0.00 -2.02 0.00 0.00 63.50 61.74 2ji8 n PRO 341 Cb 0.53 -2.32 0.14 0.00 -0.02 0.00 0.00 33.50 31.83 2ji8 n PRO 341 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2ji8 s LYS 342 N -2.74 1.13 0.70 -0.52 1.02 -1.26 -4.96 119.74 113.11 2ji8 s LYS 342 Ca 0.73 0.43 -0.16 0.00 0.02 0.00 0.00 55.97 56.98 2ji8 s LYS 342 Cb -0.43 -1.83 0.02 0.00 -0.52 0.00 0.00 37.83 35.07 2ji8 s LYS 342 CO 0.49 -2.23 1.27 0.00 -0.92 0.00 0.00 175.35 173.95 2ji8 s ALA 343 N -3.17 2.18 -0.25 5.17 0.00 0.10 -4.83 121.76 120.96 2ji8 s ALA 343 Ca 0.64 1.10 -0.41 0.00 0.00 0.00 0.00 51.96 53.29 2ji8 s ALA 343 Cb -0.16 -3.54 -0.17 0.00 0.00 0.00 0.00 23.12 19.26 2ji8 s ALA 343 CO 0.55 -1.86 1.64 -3.47 0.00 0.00 0.00 175.76 172.62 2ji8 n ASP 344 N -2.39 2.02 0.19 0.00 2.03 -1.26 -4.85 116.55 112.29 2ji8 n ASP 344 Ca 0.15 1.10 0.03 0.00 0.52 0.00 0.00 54.79 56.60 2ji8 n ASP 344 Cb 0.49 -1.10 0.39 0.00 -0.72 0.00 0.00 41.12 40.18 2ji8 n ASP 344 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ji8 h ALA 345 N 6.36 1.42 0.00 -1.67 0.00 -1.93 -1.92 119.26 121.53 2ji8 h ALA 345 Ca -0.46 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.13 2ji8 h ALA 345 Cb 1.33 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 2ji8 h ALA 345 CO 0.93 0.42 -0.05 1.05 0.00 0.00 0.00 179.25 181.60 2ji8 h GLU 346 N 0.00 0.00 0.02 0.00 4.11 -1.96 -0.44 114.58 116.31 2ji8 h GLU 346 Ca -0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.43 2ji8 h GLU 346 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 2ji8 h GLU 346 CO 0.04 0.05 -0.01 2.35 0.07 0.00 0.00 179.01 181.51 2ji8 h TRP 347 N 0.00 -0.02 -0.42 2.06 2.91 -1.73 -2.51 115.95 116.24 2ji8 h TRP 347 Ca -0.00 -0.00 -0.06 0.00 1.13 0.00 0.00 58.89 59.96 2ji8 h TRP 347 Cb 0.91 0.01 -0.02 0.00 -0.51 0.00 0.00 29.16 29.54 2ji8 h TRP 347 CO 0.00 0.71 0.03 1.79 -1.03 0.00 0.00 178.44 179.94 2ji8 h THR 348 N -0.94 1.22 -0.41 2.65 1.35 -1.39 -1.71 112.91 113.67 2ji8 h THR 348 Ca -0.00 -0.85 -0.06 0.00 -0.55 0.00 0.00 66.41 64.94 2ji8 h THR 348 Cb 0.74 0.86 -0.01 0.00 -1.73 0.00 0.00 68.15 68.01 2ji8 h THR 348 CO 0.00 0.30 0.00 1.23 -0.25 0.00 0.00 175.52 176.81 2ji8 h GLY 349 N 0.91 0.78 0.85 5.82 0.00 -1.21 -0.80 103.07 109.41 2ji8 h GLY 349 Ca 0.13 -0.57 0.03 0.00 0.00 0.00 0.00 47.33 46.93 2ji8 h GLY 349 CO 0.01 0.52 0.45 0.00 0.00 0.00 0.00 176.54 177.52 2ji8 h ALA 350 N 0.89 0.94 -0.22 3.60 0.00 -1.09 -1.17 119.26 122.21 2ji8 h ALA 350 Ca 0.12 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.84 2ji8 h ALA 350 Cb 0.48 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2ji8 h ALA 350 CO 0.02 0.22 -0.54 -0.07 0.00 0.00 0.00 179.25 178.87 2ji8 h LEU 351 N 0.87 0.74 -0.68 0.00 3.38 -1.28 -2.86 115.31 115.47 2ji8 h LEU 351 Ca 0.29 -0.39 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 2ji8 h LEU 351 Cb 0.04 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 2ji8 h LEU 351 CO -0.12 1.13 -0.01 0.50 0.09 0.00 0.00 178.44 180.04 2ji8 h LYS 352 N 0.51 1.02 -0.65 1.13 1.63 -0.82 -0.70 116.57 118.69 2ji8 h LYS 352 Ca 0.01 -0.32 -0.03 0.00 -0.85 0.00 0.00 60.65 59.47 2ji8 h LYS 352 Cb 1.11 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 32.61 2ji8 h LYS 352 CO 0.11 1.00 0.30 0.00 -3.45 0.00 0.00 179.45 177.42 2ji8 h ALA 353 N 1.05 0.84 -0.37 5.00 0.00 -1.24 -2.09 119.26 122.45 2ji8 h ALA 353 Ca 0.17 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2ji8 h ALA 353 Cb 0.55 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2ji8 h ALA 353 CO 0.03 0.42 0.10 0.87 0.00 0.00 0.00 179.25 180.66 2ji8 h LYS 354 N 0.91 0.60 -0.38 0.00 6.56 -1.25 -1.89 116.57 121.11 2ji8 h LYS 354 Ca 0.22 -0.14 0.06 0.00 -1.06 0.00 0.00 60.65 59.73 2ji8 h LYS 354 Cb 0.14 -0.08 -0.05 0.00 -0.57 0.00 0.00 32.23 31.67 2ji8 h LYS 354 CO -0.03 0.63 0.08 0.28 -2.06 0.00 0.00 179.45 178.35 2ji8 h VAL 355 N 0.46 0.82 -0.11 0.50 2.07 -1.03 -0.59 116.25 118.36 2ji8 h VAL 355 Ca 0.12 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 2ji8 h VAL 355 Cb 0.30 0.59 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 2ji8 h VAL 355 CO 0.00 0.04 0.04 0.44 0.02 0.00 0.00 177.57 178.11 2ji8 h ASP 356 N 0.21 0.15 -0.96 0.57 3.32 -1.33 -1.33 116.42 117.05 2ji8 h ASP 356 Ca 0.18 -0.17 0.03 0.00 0.02 0.00 0.00 57.03 57.08 2ji8 h ASP 356 Cb 0.20 -0.04 -0.05 0.00 0.22 0.00 0.00 39.33 39.66 2ji8 h ASP 356 CO -0.23 0.28 0.63 1.23 -1.72 0.00 0.00 179.24 179.43 2ji8 h GLY 357 N 0.01 1.38 1.39 2.75 0.00 -1.18 -1.64 103.07 105.78 2ji8 h GLY 357 Ca 0.04 -0.49 -0.22 0.00 0.00 0.00 0.00 47.33 46.67 2ji8 h GLY 357 CO -0.00 0.44 -0.82 3.43 0.00 0.00 0.00 176.54 179.58 2ji8 h ASN 358 N 1.24 0.71 -0.21 0.19 2.35 -1.05 -3.04 115.58 115.77 2ji8 h ASN 358 Ca 0.37 -0.49 -0.14 0.00 -0.55 0.00 0.00 56.30 55.49 2ji8 h ASN 358 Cb -0.05 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.10 2ji8 h ASN 358 CO -0.11 1.27 -0.35 0.11 -1.65 0.00 0.00 177.43 176.71 2ji8 h LYS 359 N 0.38 0.73 -0.79 0.81 1.57 -1.09 -2.42 116.57 115.76 2ji8 h LYS 359 Ca -0.06 -0.35 0.01 0.00 -1.87 0.00 0.00 60.65 58.38 2ji8 h LYS 359 Cb 1.43 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.70 2ji8 h LYS 359 CO 0.15 0.97 0.52 0.00 -0.57 0.00 0.00 179.45 180.52 2ji8 h ALA 360 N 1.00 1.44 -0.02 3.86 0.00 -1.36 -0.89 119.26 123.29 2ji8 h ALA 360 Ca 0.06 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 2ji8 h ALA 360 Cb 0.88 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2ji8 h ALA 360 CO 0.08 0.52 -0.62 -0.22 0.00 0.00 0.00 179.25 179.01 2ji8 h LYS 361 N 1.07 0.08 0.01 0.00 3.64 -1.39 -2.61 116.57 117.36 2ji8 h LYS 361 Ca 0.29 -0.06 -0.20 0.00 -1.27 0.00 0.00 60.65 59.41 2ji8 h LYS 361 Cb -0.12 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 2ji8 h LYS 361 CO -0.06 0.67 -0.89 1.25 -2.27 0.00 0.00 179.45 178.15 2ji8 h LEU 362 N 0.06 0.26 -1.01 5.20 5.85 -1.10 -3.08 115.31 121.49 2ji8 h LEU 362 Ca -0.01 -0.22 -0.05 0.00 0.84 0.00 0.00 57.88 58.45 2ji8 h LEU 362 Cb 1.10 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 2ji8 h LEU 362 CO 0.09 1.03 0.17 0.00 -0.34 0.00 0.00 178.44 179.39 2ji8 h ALA 363 N 0.95 1.21 0.00 1.25 0.00 -1.04 -1.79 119.26 119.85 2ji8 h ALA 363 Ca -0.05 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 2ji8 h ALA 363 Cb 1.53 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2ji8 h ALA 363 CO 0.14 0.55 -0.28 0.78 0.00 0.00 0.00 179.25 180.44 2ji8 h GLY 364 N 0.99 0.00 1.16 0.00 0.00 -1.46 -2.59 103.07 101.17 2ji8 h GLY 364 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.22 2ji8 h GLY 364 CO -0.01 0.00 -1.33 0.50 0.00 0.00 0.00 176.54 175.70 2ji8 h LYS 365 N 0.00 0.52 0.00 4.80 1.57 -1.37 -3.22 116.57 118.88 2ji8 h LYS 365 Ca -0.00 -0.85 0.00 0.00 -1.87 0.00 0.00 60.65 57.93 2ji8 h LYS 365 Cb 0.61 0.31 0.00 0.00 0.08 0.00 0.00 32.23 33.23 2ji8 h LYS 365 CO 0.04 1.40 0.00 0.52 -0.57 0.00 0.00 179.45 180.84 2ji8 h MET 366 N 0.09 0.00 0.00 3.15 2.86 -1.24 -2.81 114.93 116.98 2ji8 h MET 366 Ca -0.23 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.24 2ji8 h MET 366 Cb 2.04 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.67 2ji8 h MET 366 CO 0.25 0.00 -1.05 1.15 1.06 0.00 0.00 176.91 178.32 2ji8 h THR 367 N 0.00 0.99 -4.25 2.22 2.02 -1.55 -3.37 112.91 108.97 2ji8 h THR 367 Ca 0.00 -2.55 -0.52 0.00 0.77 0.00 0.00 66.41 64.10 2ji8 h THR 367 Cb 0.44 2.43 0.19 0.00 -1.74 0.00 0.00 68.15 69.47 2ji8 h THR 367 CO 0.00 0.57 0.27 0.00 0.37 0.00 0.00 175.52 176.73 2ji8 s ALA 368 N -2.83 1.66 -0.05 6.16 0.00 -1.06 -5.01 121.76 120.63 2ji8 s ALA 368 Ca 0.00 0.67 0.01 0.00 0.00 0.00 0.00 51.96 52.64 2ji8 s ALA 368 Cb 0.09 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.72 2ji8 s ALA 368 CO 0.79 -2.52 -0.06 -2.00 0.00 0.00 0.00 175.76 171.97 2ji8 s GLU 369 N -4.47 2.72 0.11 0.00 2.12 -1.26 -4.83 118.70 113.09 2ji8 s GLU 369 Ca 0.69 -0.58 0.03 0.00 0.36 0.00 0.00 54.97 55.47 2ji8 s GLU 369 Cb -0.25 -2.58 -0.04 0.00 0.26 0.00 0.00 34.13 31.52 2ji8 s GLU 369 CO 0.55 0.65 -0.09 0.95 -0.54 0.00 0.00 175.26 176.79 2ji8 s THR 370 N -0.86 0.89 0.75 -1.70 -4.23 -1.26 -5.10 115.64 104.12 2ji8 s THR 370 Ca 0.14 -1.86 -0.15 0.00 -1.18 0.00 0.00 61.69 58.63 2ji8 s THR 370 Cb -0.11 -1.61 0.04 0.00 1.34 0.00 0.00 72.50 72.16 2ji8 s THR 370 CO 0.03 -0.74 1.17 -2.65 -0.54 0.00 0.00 174.62 171.89 2ji8 n PRO 371 N 0.12 0.50 -1.72 3.99 -0.02 -1.26 -4.89 135.00 131.72 2ji8 n PRO 371 Ca -0.13 0.24 -0.42 0.00 -2.02 0.00 0.00 63.50 61.16 2ji8 n PRO 371 Cb 0.60 -2.41 -0.03 0.00 -0.02 0.00 0.00 33.50 31.63 2ji8 n PRO 371 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2ji8 n SER 372 N -2.56 3.92 0.00 2.55 2.88 -1.26 -1.48 113.62 117.67 2ji8 n SER 372 Ca 0.14 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.75 2ji8 n SER 372 Cb 0.50 -1.56 0.00 0.00 -0.75 0.00 0.00 64.21 62.39 2ji8 n SER 372 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ji8 n GLY 373 N 3.80 0.81 2.58 0.46 0.00 0.39 -4.91 105.19 108.33 2ji8 n GLY 373 Ca 0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.02 2ji8 n GLY 373 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2ji8 n MET 374 N -2.37 1.87 -1.48 1.61 2.00 -0.55 -4.27 117.12 113.94 2ji8 n MET 374 Ca 0.00 -3.68 -0.33 0.00 0.00 0.00 0.00 57.70 53.69 2ji8 n MET 374 Cb 0.00 -1.60 0.08 0.00 0.00 0.00 0.00 33.22 31.70 2ji8 n MET 374 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 2ji8 s MET 375 N -3.21 2.32 0.55 0.03 -1.94 -1.09 -4.26 119.30 111.70 2ji8 s MET 375 Ca 0.35 1.51 0.08 0.00 -1.71 0.00 0.00 55.69 55.92 2ji8 s MET 375 Cb 0.43 -1.88 0.08 0.00 2.01 0.00 0.00 34.83 35.47 2ji8 s MET 375 CO -0.04 -1.64 0.67 0.27 -0.01 0.00 0.00 175.02 174.26 2ji8 n ASN 376 N -2.83 2.21 0.23 3.03 0.23 -1.26 0.58 115.26 117.45 2ji8 n ASN 376 Ca 0.11 -2.57 0.12 0.00 -0.53 0.00 0.00 54.58 51.71 2ji8 n ASN 376 Cb 0.51 -0.31 0.37 0.00 -2.08 0.00 0.00 39.78 38.28 2ji8 n ASN 376 CO 0.00 0.00 0.00 1.88 -0.93 0.00 0.00 177.26 178.21 2ji8 h TYR 377 N 0.25 0.00 0.00 -2.53 0.05 -1.97 -2.95 116.97 109.82 2ji8 h TYR 377 Ca -0.28 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.49 2ji8 h TYR 377 Cb 1.21 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.95 2ji8 h TYR 377 CO 0.00 0.13 -0.02 0.77 -1.05 0.00 0.00 178.16 177.98 2ji8 h SER 378 N 0.00 0.00 0.25 3.88 0.02 -1.96 -2.74 113.55 113.00 2ji8 h SER 378 Ca -0.00 -0.94 -0.19 0.00 -0.84 0.00 0.00 61.79 59.82 2ji8 h SER 378 Cb 0.85 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.39 2ji8 h SER 378 CO 0.02 0.98 -0.75 -0.55 -1.14 0.00 0.00 176.83 175.39 2ji8 h ASN 379 N -1.00 0.51 0.46 3.07 7.08 -1.73 0.23 115.58 124.20 2ji8 h ASN 379 Ca -0.01 -0.34 -0.02 0.00 -3.08 0.00 0.00 56.30 52.85 2ji8 h ASN 379 Cb 0.95 -0.15 0.00 0.00 -2.08 0.00 0.00 38.32 37.05 2ji8 h ASN 379 CO -0.00 1.09 -0.22 0.77 -2.08 0.00 0.00 177.43 176.99 2ji8 h SER 380 N 0.28 -0.52 1.12 6.14 4.64 -1.68 -3.24 113.55 120.29 2ji8 h SER 380 Ca -0.04 -0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.18 2ji8 h SER 380 Cb 1.34 0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 63.56 2ji8 h SER 380 CO 0.13 -0.20 -0.09 -0.07 -0.87 0.00 0.00 176.83 175.74 2ji8 h LEU 381 N -0.87 0.00 -2.22 5.97 3.38 -1.54 -2.42 115.31 117.61 2ji8 h LEU 381 Ca -0.06 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.92 2ji8 h LEU 381 Cb 0.57 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 2ji8 h LEU 381 CO 0.10 0.09 0.04 1.23 0.09 0.00 0.00 178.44 179.99 2ji8 h GLY 382 N 2.32 0.00 0.81 0.83 0.00 -0.98 0.86 103.07 106.91 2ji8 h GLY 382 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 2ji8 h GLY 382 CO 0.01 0.00 -0.20 -2.08 0.00 0.00 0.00 176.54 174.27 2ji8 h VAL 383 N 0.00 1.34 -0.91 4.60 2.07 -1.45 -2.51 116.25 119.39 2ji8 h VAL 383 Ca 0.02 -1.38 -0.02 0.00 0.82 0.00 0.00 66.70 66.15 2ji8 h VAL 383 Cb 0.11 1.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 2ji8 h VAL 383 CO -0.00 0.42 0.50 0.58 0.02 0.00 0.00 177.57 179.08 2ji8 h VAL 384 N 0.11 1.26 0.33 2.57 2.07 -1.40 -1.48 116.25 119.72 2ji8 h VAL 384 Ca 0.03 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 2ji8 h VAL 384 Cb 0.75 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 2ji8 h VAL 384 CO 0.05 0.29 -0.50 -0.09 0.02 0.00 0.00 177.57 177.34 2ji8 h ARG 385 N 1.27 -0.85 -0.89 1.57 2.43 -0.83 0.17 114.38 117.24 2ji8 h ARG 385 Ca 0.32 0.06 0.12 0.00 -0.81 0.00 0.00 59.98 59.67 2ji8 h ARG 385 Cb 0.02 0.19 -0.08 0.00 -0.42 0.00 0.00 29.97 29.68 2ji8 h ARG 385 CO -0.05 -0.57 0.51 -0.44 -1.51 0.00 0.00 179.97 177.91 2ji8 h ASP 386 N -0.88 0.71 -0.50 -3.80 3.32 -1.24 -1.27 116.42 112.77 2ji8 h ASP 386 Ca -0.03 0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.00 2ji8 h ASP 386 Cb 0.81 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.27 2ji8 h ASP 386 CO -0.16 0.37 0.03 0.15 -1.72 0.00 0.00 179.24 177.91 2ji8 h PHE 387 N 0.80 0.93 0.00 4.55 3.04 -0.94 -2.76 116.94 122.56 2ji8 h PHE 387 Ca 0.45 -0.15 -0.06 0.00 3.98 0.00 0.00 57.97 62.19 2ji8 h PHE 387 Cb 0.49 -0.25 -0.01 0.00 2.56 0.00 0.00 35.95 38.75 2ji8 h PHE 387 CO -0.05 0.87 -0.27 0.52 -2.02 0.00 0.00 178.31 177.35 2ji8 h MET 388 N 0.73 0.00 -0.23 1.11 2.86 -0.20 0.29 114.93 119.49 2ji8 h MET 388 Ca 0.14 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.63 2ji8 h MET 388 Cb 0.48 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 2ji8 h MET 388 CO 0.02 0.27 -0.48 -0.07 1.06 0.00 0.00 176.91 177.71 2ji8 h LEU 389 N 0.00 0.66 0.12 1.22 3.38 -1.17 -2.89 115.31 116.63 2ji8 h LEU 389 Ca -0.00 -0.32 -0.28 0.00 0.09 0.00 0.00 57.88 57.36 2ji8 h LEU 389 Cb 0.82 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2ji8 h LEU 389 CO 0.04 1.03 -1.32 0.00 0.09 0.00 0.00 178.44 178.28 2ji8 h ALA 390 N 0.99 0.15 -2.79 1.53 0.00 -1.17 -3.40 119.26 114.58 2ji8 h ALA 390 Ca 0.02 -0.95 -0.61 0.00 0.00 0.00 0.00 54.91 53.37 2ji8 h ALA 390 Cb 1.02 0.08 -0.41 0.00 0.00 0.00 0.00 17.79 18.47 2ji8 h ALA 390 CO 0.09 1.03 -0.64 0.09 0.00 0.00 0.00 179.25 179.82 2ji8 n ASN 391 N -3.50 2.69 0.23 0.00 4.13 0.98 -4.98 115.26 114.82 2ji8 n ASN 391 Ca -0.10 -3.15 0.13 0.00 1.68 0.00 0.00 54.58 53.14 2ji8 n ASN 391 Cb 1.03 -0.71 0.32 0.00 -1.54 0.00 0.00 39.78 38.88 2ji8 n ASN 391 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2ji8 h PRO 392 N 5.12 0.00 -2.07 3.52 0.13 -1.72 -3.37 132.00 133.60 2ji8 h PRO 392 Ca 0.17 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.95 2ji8 h PRO 392 Cb 0.75 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.78 2ji8 h PRO 392 CO 0.69 0.03 0.21 -3.47 -0.23 0.00 0.00 178.00 175.24 2ji8 n ASP 393 N -3.12 5.99 -3.92 1.44 2.03 -1.26 -4.57 116.55 113.14 2ji8 n ASP 393 Ca 0.03 -2.79 -0.14 0.00 0.52 0.00 0.00 54.79 52.41 2ji8 n ASP 393 Cb 0.47 -1.35 -0.14 0.00 -0.72 0.00 0.00 41.12 39.38 2ji8 n ASP 393 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2ji8 s ILE 394 N -0.31 0.21 0.16 5.18 1.01 -1.26 -4.61 121.20 121.58 2ji8 s ILE 394 Ca 0.64 -0.16 -0.29 0.00 0.00 0.00 0.00 60.65 60.83 2ji8 s ILE 394 Cb 0.33 -0.19 -0.07 0.00 0.01 0.00 0.00 42.46 42.54 2ji8 s ILE 394 CO -0.09 0.03 0.93 -0.44 0.00 0.00 0.00 174.94 175.37 2ji8 s SER 395 N -0.14 7.53 -0.36 3.58 0.01 -1.00 -4.82 113.70 118.50 2ji8 s SER 395 Ca 0.00 1.82 0.01 0.00 1.31 0.00 0.00 55.95 59.09 2ji8 s SER 395 Cb -0.01 -2.58 0.10 0.00 0.21 0.00 0.00 66.02 63.73 2ji8 s SER 395 CO -0.00 0.03 0.11 -0.22 0.41 0.00 0.00 173.24 173.57 2ji8 s LEU 396 N -0.49 4.90 0.23 2.44 1.98 -0.06 -0.61 118.68 127.07 2ji8 s LEU 396 Ca 0.44 -2.06 -0.21 0.00 -2.89 0.00 0.00 54.13 49.41 2ji8 s LEU 396 Cb -0.24 -1.71 -0.08 0.00 0.66 0.00 0.00 46.19 44.81 2ji8 s LEU 396 CO 0.30 -0.44 0.75 -0.69 -1.89 0.00 0.00 176.35 174.39 2ji8 s VAL 397 N 1.02 4.51 -0.22 1.68 1.01 0.19 -0.91 120.40 127.68 2ji8 s VAL 397 Ca 0.09 1.38 -0.16 0.00 0.00 0.00 0.00 61.98 63.29 2ji8 s VAL 397 Cb -0.21 -3.90 0.06 0.00 0.00 0.00 0.00 36.38 32.34 2ji8 s VAL 397 CO -0.06 0.23 0.56 0.21 0.00 0.00 0.00 175.10 176.03 2ji8 s ASN 398 N -1.60 -0.66 0.03 3.32 3.04 -0.81 -1.09 114.94 117.17 2ji8 s ASN 398 Ca 0.43 1.17 -0.27 0.00 0.04 0.00 0.00 52.86 54.23 2ji8 s ASN 398 Cb -0.17 1.11 0.09 0.00 -1.54 0.00 0.00 41.25 40.74 2ji8 s ASN 398 CO 0.22 -0.21 0.82 -1.83 -3.04 0.00 0.00 177.10 173.06 2ji8 s GLU 399 N 0.94 0.93 0.00 0.43 -1.05 -1.18 -3.11 118.70 115.65 2ji8 s GLU 399 Ca -0.05 -0.32 0.00 0.00 -0.15 0.00 0.00 54.97 54.45 2ji8 s GLU 399 Cb -0.05 0.43 0.00 0.00 -0.44 0.00 0.00 34.13 34.06 2ji8 s GLU 399 CO -0.08 -0.40 0.00 0.41 0.95 0.00 0.00 175.26 176.14 2ji8 n GLY 400 N -0.22 0.89 0.00 -3.83 0.00 -1.26 -1.49 105.19 99.27 2ji8 n GLY 400 Ca -0.11 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 43.94 2ji8 n GLY 400 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ji8 n ALA 401 N -1.00 0.00 0.11 4.61 0.00 -1.26 -4.27 120.51 118.70 2ji8 n ALA 401 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ji8 n ALA 401 Cb 0.00 0.00 0.28 0.00 0.00 0.00 0.00 19.45 19.73 2ji8 n ALA 401 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2ji8 h ASN 402 N 0.00 0.20 0.56 0.00 2.35 -1.86 -1.77 115.58 115.07 2ji8 h ASN 402 Ca 0.00 -0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.65 2ji8 h ASN 402 Cb 0.00 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.31 2ji8 h ASN 402 CO 0.00 0.54 -0.15 0.00 -1.65 0.00 0.00 177.43 176.17 2ji8 h ALA 403 N 1.48 1.17 0.00 -0.83 0.00 -1.87 -2.02 119.26 117.20 2ji8 h ALA 403 Ca 0.02 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 2ji8 h ALA 403 Cb 0.70 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2ji8 h ALA 403 CO 0.05 0.19 -0.73 1.25 0.00 0.00 0.00 179.25 180.01 2ji8 h LEU 404 N 0.00 0.00 -0.66 0.00 5.85 -1.66 -3.29 115.31 115.56 2ji8 h LEU 404 Ca -0.00 -0.30 0.01 0.00 0.84 0.00 0.00 57.88 58.42 2ji8 h LEU 404 Cb 0.48 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 2ji8 h LEU 404 CO 0.02 1.06 0.43 0.44 -0.34 0.00 0.00 178.44 180.05 2ji8 h ASP 405 N -1.00 0.76 0.27 1.25 3.32 -1.38 -0.83 116.42 118.82 2ji8 h ASP 405 Ca -0.15 -0.02 -0.16 0.00 0.02 0.00 0.00 57.03 56.72 2ji8 h ASP 405 Cb 0.84 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 2ji8 h ASP 405 CO -0.09 0.56 -0.65 0.78 -1.72 0.00 0.00 179.24 178.12 2ji8 h ASN 406 N 0.90 0.41 -0.35 6.45 2.35 -1.59 -2.81 115.58 120.94 2ji8 h ASN 406 Ca 0.24 -0.25 -0.16 0.00 -0.55 0.00 0.00 56.30 55.58 2ji8 h ASN 406 Cb -0.10 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.15 2ji8 h ASN 406 CO -0.05 0.95 -0.42 0.74 -1.65 0.00 0.00 177.43 177.00 2ji8 h THR 407 N 0.25 1.28 -0.94 2.81 2.02 -1.56 -0.98 112.91 115.78 2ji8 h THR 407 Ca -0.01 -1.60 0.01 0.00 0.77 0.00 0.00 66.41 65.58 2ji8 h THR 407 Cb 1.19 1.47 -0.05 0.00 -1.74 0.00 0.00 68.15 69.03 2ji8 h THR 407 CO 0.11 0.53 0.62 -0.09 0.37 0.00 0.00 175.52 177.06 2ji8 h ARG 408 N 0.70 1.23 -0.13 6.66 2.43 -1.18 0.34 114.38 124.44 2ji8 h ARG 408 Ca 0.05 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.09 2ji8 h ARG 408 Cb 1.02 -0.28 -0.00 0.00 -0.42 0.00 0.00 29.97 30.29 2ji8 h ARG 408 CO 0.10 0.81 -0.11 1.98 -1.51 0.00 0.00 179.97 181.25 2ji8 h MET 409 N 1.27 0.30 0.04 0.20 4.05 -1.45 -3.39 114.93 115.94 2ji8 h MET 409 Ca 0.35 -0.15 -0.26 0.00 -0.28 0.00 0.00 59.70 59.37 2ji8 h MET 409 Cb -0.12 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.66 2ji8 h MET 409 CO -0.08 0.68 -1.38 0.82 0.23 0.00 0.00 176.91 177.18 2ji8 h ILE 410 N -0.08 0.91 -2.90 1.77 2.04 -1.11 -3.45 117.51 114.69 2ji8 h ILE 410 Ca 0.02 -2.25 -0.57 0.00 1.00 0.00 0.00 64.86 63.06 2ji8 h ILE 410 Cb 0.62 2.41 -0.09 0.00 -0.74 0.00 0.00 36.82 39.01 2ji8 h ILE 410 CO 0.03 0.51 0.89 -0.69 0.00 0.00 0.00 178.15 178.88 2ji8 s VAL 411 N -2.41 4.02 -0.01 1.67 1.01 0.10 -4.77 120.40 120.01 2ji8 s VAL 411 Ca -0.26 0.53 -0.30 0.00 0.00 0.00 0.00 61.98 61.96 2ji8 s VAL 411 Cb 0.05 -4.75 -0.03 0.00 0.00 0.00 0.00 36.38 31.66 2ji8 s VAL 411 CO 0.66 -1.46 1.04 -1.81 0.00 0.00 0.00 175.10 173.52 2ji8 s ASP 412 N 3.23 7.28 -0.25 3.32 1.01 -1.26 -4.78 116.67 125.22 2ji8 s ASP 412 Ca 0.36 1.72 -0.10 0.00 0.71 0.00 0.00 52.55 55.24 2ji8 s ASP 412 Cb -0.09 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.22 2ji8 s ASP 412 CO 0.20 -0.34 0.15 -0.04 0.21 0.00 0.00 175.17 175.34 2ji8 s MET 413 N 1.22 3.96 0.06 8.23 -1.94 -1.26 -4.56 119.30 125.01 2ji8 s MET 413 Ca 0.53 -0.32 0.23 0.00 -1.71 0.00 0.00 55.69 54.41 2ji8 s MET 413 Cb -0.22 -3.51 0.06 0.00 2.01 0.00 0.00 34.83 33.16 2ji8 s MET 413 CO 0.26 -0.03 1.03 1.28 -0.01 0.00 0.00 175.02 177.56 2ji8 n LEU 414 N 4.54 0.61 -4.25 -0.03 4.77 -1.26 -1.35 117.00 120.04 2ji8 n LEU 414 Ca -0.15 0.01 -0.21 0.00 -0.03 0.00 0.00 56.01 55.63 2ji8 n LEU 414 Cb 0.52 -0.10 -0.12 0.00 -2.33 0.00 0.00 43.42 41.39 2ji8 n LEU 414 CO 0.34 0.02 -0.48 -0.54 -1.33 0.00 0.00 177.39 175.40 2ji8 s LYS 415 N -3.21 1.03 0.36 3.23 1.02 -1.25 -4.24 119.74 116.68 2ji8 s LYS 415 Ca 0.03 -1.14 -0.17 0.00 0.02 0.00 0.00 55.97 54.72 2ji8 s LYS 415 Cb 0.14 -1.14 -0.09 0.00 -0.52 0.00 0.00 37.83 36.22 2ji8 s LYS 415 CO 0.80 0.25 0.81 -1.25 -0.92 0.00 0.00 175.35 175.04 2ji8 s PRO 416 N -2.07 4.06 -1.56 -1.68 0.04 -0.94 -4.12 135.00 128.73 2ji8 s PRO 416 Ca 0.05 0.80 -0.04 0.00 0.04 0.00 0.00 61.00 61.86 2ji8 s PRO 416 Cb -0.09 -2.35 0.01 0.00 0.04 0.00 0.00 34.50 32.12 2ji8 s PRO 416 CO 0.04 0.08 0.45 0.54 0.04 0.00 0.00 177.00 178.15 2ji8 n ARG 417 N -0.51 -4.00 -0.10 4.56 1.74 -1.26 -4.89 116.66 112.20 2ji8 n ARG 417 Ca 0.05 0.88 -0.17 0.00 -0.77 0.00 0.00 57.85 57.84 2ji8 n ARG 417 Cb 0.53 -5.68 -0.08 0.00 -1.02 0.00 0.00 32.46 26.21 2ji8 n ARG 417 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2ji8 n LYS 418 N -3.75 0.45 -2.55 5.56 4.76 -1.26 -4.94 118.16 116.43 2ji8 n LYS 418 Ca -0.13 0.14 -0.42 0.00 -2.87 0.00 0.00 58.31 55.02 2ji8 n LYS 418 Cb 0.63 -1.30 -0.03 0.00 -1.84 0.00 0.00 35.03 32.49 2ji8 n LYS 418 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2ji8 s ARG 419 N -2.37 4.36 -0.28 1.97 3.52 -1.26 -0.88 118.95 124.01 2ji8 s ARG 419 Ca -0.26 1.54 -0.01 0.00 -0.13 0.00 0.00 55.73 56.87 2ji8 s ARG 419 Cb 0.08 -3.58 0.09 0.00 -1.56 0.00 0.00 34.95 29.98 2ji8 s ARG 419 CO 0.40 -0.44 0.06 -0.51 -0.81 0.00 0.00 175.30 173.99 2ji8 s LEU 420 N 2.36 2.29 0.00 -0.88 1.43 -0.09 -4.71 118.68 119.08 2ji8 s LEU 420 Ca 0.52 -1.45 0.00 0.00 -1.03 0.00 0.00 54.13 52.17 2ji8 s LEU 420 Cb -0.21 -0.92 0.00 0.00 0.03 0.00 0.00 46.19 45.09 2ji8 s LEU 420 CO 0.18 -0.36 0.00 -0.90 0.23 0.00 0.00 176.35 175.50 2ji8 n ASP 421 N 4.81 1.80 0.28 2.29 5.68 -1.26 -1.93 116.55 128.23 2ji8 n ASP 421 Ca -0.04 -0.77 0.15 0.00 -0.50 0.00 0.00 54.79 53.62 2ji8 n ASP 421 Cb 0.43 0.00 0.81 0.00 -1.14 0.00 0.00 41.12 41.22 2ji8 n ASP 421 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2ji8 h SER 422 N 0.00 0.00 0.00 -1.12 0.02 -1.79 -3.48 113.55 107.19 2ji8 h SER 422 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ji8 h SER 422 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2ji8 h SER 422 CO 0.00 0.08 0.00 0.61 -1.14 0.00 0.00 176.83 176.38 2ji8 n GLY 423 N -0.78 -0.83 0.36 -3.77 0.00 -1.26 -2.25 105.19 96.67 2ji8 n GLY 423 Ca -0.02 -1.18 0.03 0.00 0.00 0.00 0.00 46.02 44.85 2ji8 n GLY 423 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2ji8 h THR 424 N 0.00 1.11 -0.01 2.61 2.02 -1.92 -1.43 112.91 115.29 2ji8 h THR 424 Ca 0.00 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.82 2ji8 h THR 424 Cb 0.00 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.38 2ji8 h THR 424 CO 0.00 0.19 -0.04 0.79 0.37 0.00 0.00 175.52 176.83 2ji8 n TRP 425 N -4.46 0.00 -3.58 3.16 8.01 -1.26 -4.96 117.44 114.34 2ji8 n TRP 425 Ca 0.12 0.00 -0.20 0.00 -1.31 0.00 0.00 57.50 56.11 2ji8 n TRP 425 Cb 0.15 -0.02 0.06 0.00 -2.01 0.00 0.00 31.31 29.49 2ji8 n TRP 425 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2ji8 n GLY 426 N 1.21 -0.35 3.67 6.99 0.00 -0.54 -4.91 105.19 111.26 2ji8 n GLY 426 Ca 0.18 0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.90 2ji8 n GLY 426 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ji8 s VAL 427 N -3.48 4.23 -0.20 1.61 1.01 -0.96 -4.98 120.40 117.62 2ji8 s VAL 427 Ca 0.08 1.52 -0.28 0.00 0.00 0.00 0.00 61.98 63.29 2ji8 s VAL 427 Cb -0.04 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.37 2ji8 s VAL 427 CO 0.77 -0.08 0.98 -0.04 0.00 0.00 0.00 175.10 176.73 2ji8 s MET 428 N 3.04 4.28 0.00 2.72 -1.94 -1.26 -4.34 119.30 121.81 2ji8 s MET 428 Ca 0.56 1.27 0.00 0.00 -1.71 0.00 0.00 55.69 55.81 2ji8 s MET 428 Cb -0.23 -3.61 0.00 0.00 2.01 0.00 0.00 34.83 32.99 2ji8 s MET 428 CO 0.18 -0.52 0.00 0.41 -0.01 0.00 0.00 175.02 175.08 2ji8 n GLY 429 N 3.35 0.78 0.03 -0.03 0.00 -1.26 -4.92 105.19 103.14 2ji8 n GLY 429 Ca 0.10 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.25 2ji8 n GLY 429 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2ji8 n ILE 430 N 0.00 0.15 0.00 -0.61 -6.64 -1.26 -4.50 119.36 106.50 2ji8 n ILE 430 Ca 0.00 -0.08 0.00 0.00 -1.77 0.00 0.00 62.75 60.90 2ji8 n ILE 430 Cb 0.00 -0.36 0.00 0.00 -1.44 0.00 0.00 39.64 37.84 2ji8 n ILE 430 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 2ji8 n GLY 431 N 1.45 -3.16 0.13 3.28 0.00 -1.26 -1.55 105.19 104.07 2ji8 n GLY 431 Ca 0.06 0.53 -0.04 0.00 0.00 0.00 0.00 46.02 46.57 2ji8 n GLY 431 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2ji8 h MET 432 N 0.00 0.07 -0.60 1.61 2.86 -1.82 -2.33 114.93 114.72 2ji8 h MET 432 Ca 0.00 -0.06 -0.08 0.00 -2.06 0.00 0.00 59.70 57.50 2ji8 h MET 432 Cb 0.00 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 2ji8 h MET 432 CO 0.00 0.75 0.06 0.78 1.06 0.00 0.00 176.91 179.56 2ji8 h GLY 433 N 1.95 1.09 1.02 8.32 0.00 -1.76 -2.01 103.07 111.68 2ji8 h GLY 433 Ca -0.01 -0.76 -0.01 0.00 0.00 0.00 0.00 47.33 46.55 2ji8 h GLY 433 CO 0.10 0.70 0.51 -0.97 0.00 0.00 0.00 176.54 176.88 2ji8 h TYR 434 N 0.91 1.22 0.03 5.60 -1.99 -1.10 -1.23 116.97 120.42 2ji8 h TYR 434 Ca 0.18 -0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.89 2ji8 h TYR 434 Cb 0.47 -0.39 0.00 0.00 2.00 0.00 0.00 36.73 38.81 2ji8 h TYR 434 CO 0.03 0.83 -0.01 0.00 -0.00 0.00 0.00 178.16 179.01 2ji8 h VAL 436 N -0.08 1.01 -0.17 0.00 2.07 -1.11 0.27 116.25 118.24 2ji8 h VAL 436 Ca -0.00 -0.11 -0.05 0.00 0.82 0.00 0.00 66.70 67.36 2ji8 h VAL 436 Cb 0.07 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2ji8 h VAL 436 CO 0.01 0.06 -0.08 0.00 0.02 0.00 0.00 177.57 177.58 2ji8 h ALA 437 N 1.14 0.24 -0.45 1.67 0.00 -1.17 0.11 119.26 120.80 2ji8 h ALA 437 Ca 0.12 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 54.81 2ji8 h ALA 437 Cb 0.02 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 2ji8 h ALA 437 CO -0.07 0.05 0.17 0.00 0.00 0.00 0.00 179.25 179.40 2ji8 h ALA 438 N 0.68 0.54 -0.09 0.00 0.00 -0.68 0.48 119.26 120.19 2ji8 h ALA 438 Ca 0.04 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.00 2ji8 h ALA 438 Cb 0.56 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2ji8 h ALA 438 CO 0.02 -0.21 0.04 0.00 0.00 0.00 0.00 179.25 179.10 2ji8 h ALA 439 N 1.28 0.11 -0.51 0.00 0.00 -0.86 -1.23 119.26 118.05 2ji8 h ALA 439 Ca 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2ji8 h ALA 439 Cb 0.19 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2ji8 h ALA 439 CO -0.20 -0.42 0.31 0.00 0.00 0.00 0.00 179.25 178.94 2ji8 h ALA 440 N 1.05 0.65 0.00 0.00 0.00 -0.34 -2.23 119.26 118.38 2ji8 h ALA 440 Ca 0.04 -0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 2ji8 h ALA 440 Cb 0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2ji8 h ALA 440 CO -0.03 0.13 -1.15 -0.39 0.00 0.00 0.00 179.25 177.81 2ji8 h VAL 441 N 0.68 0.95 0.00 0.00 -1.51 -0.87 -3.36 116.25 112.14 2ji8 h VAL 441 Ca 0.18 -2.54 -0.29 0.00 -1.23 0.00 0.00 66.70 62.82 2ji8 h VAL 441 Cb -0.01 2.41 -0.05 0.00 -2.13 0.00 0.00 31.29 31.51 2ji8 h VAL 441 CO -0.03 0.54 -1.72 0.35 -1.23 0.00 0.00 177.57 175.47 2ji8 n THR 442 N -3.12 1.61 -1.91 7.19 -2.24 -0.47 -4.99 114.28 110.36 2ji8 n THR 442 Ca -0.06 -0.79 -0.13 0.00 -2.27 0.00 0.00 64.05 60.79 2ji8 n THR 442 Cb 0.88 -1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.04 2ji8 n THR 442 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ji8 n GLY 443 N 1.57 0.46 3.20 3.38 0.00 -0.84 -5.00 105.19 107.95 2ji8 n GLY 443 Ca -0.17 -0.35 -0.12 0.00 0.00 0.00 0.00 46.02 45.38 2ji8 n GLY 443 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ji8 s LYS 444 N -4.06 1.14 0.83 1.61 1.02 -1.26 -5.13 119.74 113.89 2ji8 s LYS 444 Ca 0.00 -1.58 -0.11 0.00 0.02 0.00 0.00 55.97 54.29 2ji8 s LYS 444 Cb 0.00 0.19 0.09 0.00 -0.52 0.00 0.00 37.83 37.60 2ji8 s LYS 444 CO 0.00 -0.33 1.14 -2.14 -0.92 0.00 0.00 175.35 173.10 2ji8 s PRO 445 N -4.11 1.66 -0.03 -1.68 0.02 -1.26 -4.66 135.00 124.94 2ji8 s PRO 445 Ca 0.34 1.48 0.02 0.00 0.02 0.00 0.00 61.00 62.86 2ji8 s PRO 445 Cb 0.07 -1.80 0.01 0.00 0.02 0.00 0.00 34.50 32.80 2ji8 s PRO 445 CO 0.09 -2.14 -0.08 0.08 -0.33 0.00 0.00 177.00 174.61 2ji8 s VAL 446 N -2.57 0.74 -0.09 3.83 1.01 -0.45 -2.36 120.40 120.51 2ji8 s VAL 446 Ca 0.67 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 62.36 2ji8 s VAL 446 Cb -0.22 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.45 2ji8 s VAL 446 CO 0.54 0.25 -0.14 -0.63 0.00 0.00 0.00 175.10 175.12 2ji8 s ILE 447 N 0.43 3.07 -0.11 2.22 1.01 0.22 -0.66 121.20 127.38 2ji8 s ILE 447 Ca -0.07 -0.69 0.01 0.00 0.00 0.00 0.00 60.65 59.91 2ji8 s ILE 447 Cb -0.11 -2.24 -0.01 0.00 0.01 0.00 0.00 42.46 40.11 2ji8 s ILE 447 CO 0.01 0.56 -0.16 0.00 0.00 0.00 0.00 174.94 175.34 2ji8 s ALA 448 N -0.22 2.49 -0.46 9.38 0.00 -0.06 -0.63 121.76 132.25 2ji8 s ALA 448 Ca 0.01 -0.92 -0.10 0.00 0.00 0.00 0.00 51.96 50.95 2ji8 s ALA 448 Cb -0.13 -1.07 0.11 0.00 0.00 0.00 0.00 23.12 22.03 2ji8 s ALA 448 CO 0.03 0.28 0.34 0.08 0.00 0.00 0.00 175.76 176.49 2ji8 s VAL 449 N 0.27 4.31 -0.18 0.00 1.01 -0.25 0.06 120.40 125.62 2ji8 s VAL 449 Ca -0.12 -1.66 -0.05 0.00 0.00 0.00 0.00 61.98 60.16 2ji8 s VAL 449 Cb -0.16 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 2ji8 s VAL 449 CO 0.06 -0.71 -0.01 -1.61 0.00 0.00 0.00 175.10 172.83 2ji8 s GLU 450 N 1.40 3.69 0.73 2.72 0.41 0.25 -3.10 118.70 124.80 2ji8 s GLU 450 Ca 0.05 -0.50 -0.15 0.00 -0.41 0.00 0.00 54.97 53.96 2ji8 s GLU 450 Cb -0.26 -3.02 0.04 0.00 -1.78 0.00 0.00 34.13 29.11 2ji8 s GLU 450 CO 0.00 0.15 1.24 0.20 -0.49 0.00 0.00 175.26 176.37 2ji8 s GLY 451 N 0.62 2.47 0.08 -1.39 0.00 -0.56 -0.49 107.32 108.05 2ji8 s GLY 451 Ca -0.01 0.99 -0.13 0.00 0.00 0.00 0.00 44.72 45.58 2ji8 s GLY 451 CO 0.02 1.42 1.18 1.29 0.00 0.00 0.00 173.10 177.01 2ji8 h ASP 452 N -0.22 0.85 0.34 1.64 2.03 -1.85 0.96 116.42 120.18 2ji8 h ASP 452 Ca -0.48 -0.71 -0.00 0.00 -0.73 0.00 0.00 57.03 55.11 2ji8 h ASP 452 Cb 1.31 -0.26 -0.02 0.00 -0.83 0.00 0.00 39.33 39.53 2ji8 h ASP 452 CO 0.50 1.51 -0.34 -1.28 -1.03 0.00 0.00 179.24 178.60 2ji8 h SER 453 N 0.34 -0.92 -0.68 4.15 0.87 -1.92 -2.61 113.55 112.78 2ji8 h SER 453 Ca -0.14 0.08 0.13 0.00 -1.23 0.00 0.00 61.79 60.63 2ji8 h SER 453 Cb 1.74 0.31 -0.13 0.00 -0.44 0.00 0.00 62.40 63.89 2ji8 h SER 453 CO 0.21 -0.48 -0.25 0.00 -0.53 0.00 0.00 176.83 175.78 2ji8 h ALA 454 N -0.22 0.25 -0.77 6.23 0.00 -1.88 -1.23 119.26 121.64 2ji8 h ALA 454 Ca -0.02 0.23 0.10 0.00 0.00 0.00 0.00 54.91 55.22 2ji8 h ALA 454 Cb 0.64 0.67 -0.05 0.00 0.00 0.00 0.00 17.79 19.04 2ji8 h ALA 454 CO -0.06 -0.53 0.51 0.35 0.00 0.00 0.00 179.25 179.51 2ji8 h PHE 455 N -0.07 0.75 0.00 0.00 3.57 -0.69 -2.61 116.94 117.89 2ji8 h PHE 455 Ca 0.30 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.82 2ji8 h PHE 455 Cb 0.54 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.04 2ji8 h PHE 455 CO -0.62 0.35 0.00 0.78 -2.23 0.00 0.00 178.31 176.59 2ji8 h GLY 456 N 0.70 0.00 2.00 2.40 0.00 -0.83 0.06 103.07 107.40 2ji8 h GLY 456 Ca 0.36 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.62 2ji8 h GLY 456 CO -0.13 0.00 -0.34 0.74 0.00 0.00 0.00 176.54 176.81 2ji8 h PHE 457 N 0.00 0.00 0.00 5.60 -1.00 -1.56 -3.33 116.94 116.66 2ji8 h PHE 457 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2ji8 h PHE 457 Cb 0.08 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.64 2ji8 h PHE 457 CO 0.00 0.34 -0.12 -1.13 -1.61 0.00 0.00 178.31 175.78 2ji8 n SER 458 N -3.22 0.82 -0.24 2.17 3.41 -1.00 -4.84 113.62 110.72 2ji8 n SER 458 Ca 0.02 -1.79 0.07 0.00 -0.26 0.00 0.00 58.87 56.90 2ji8 n SER 458 Cb 0.63 -0.11 0.32 0.00 -0.26 0.00 0.00 64.21 64.79 2ji8 n SER 458 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2ji8 h GLY 459 N 0.00 1.12 1.84 5.00 0.00 -1.10 -1.98 103.07 107.95 2ji8 h GLY 459 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.99 2ji8 h GLY 459 CO 0.00 0.23 0.07 1.98 0.00 0.00 0.00 176.54 178.81 2ji8 h MET 460 N 0.83 0.00 0.00 4.80 -1.53 -1.87 -1.23 114.93 115.93 2ji8 h MET 460 Ca 0.36 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.62 2ji8 h MET 460 Cb 0.32 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.37 2ji8 h MET 460 CO -0.14 0.00 0.00 0.39 0.14 0.00 0.00 176.91 177.30 2ji8 n GLU 461 N -2.60 0.91 -0.27 0.39 -0.58 -0.74 -2.76 120.64 114.97 2ji8 n GLU 461 Ca -0.02 0.00 0.09 0.00 -0.42 0.00 0.00 57.16 56.81 2ji8 n GLU 461 Cb 0.12 -1.50 0.23 0.00 -0.57 0.00 0.00 31.44 29.72 2ji8 n GLU 461 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 2ji8 h LEU 462 N 0.00 0.10 -1.03 -4.62 3.38 -1.42 -1.45 115.31 110.27 2ji8 h LEU 462 Ca 0.00 0.16 0.04 0.00 0.09 0.00 0.00 57.88 58.17 2ji8 h LEU 462 Cb 0.03 0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.91 2ji8 h LEU 462 CO 0.00 -0.04 0.65 -0.08 0.09 0.00 0.00 178.44 179.06 2ji8 h GLU 463 N 0.30 1.20 -0.45 1.13 4.22 -1.77 -0.36 114.58 118.85 2ji8 h GLU 463 Ca 0.47 -0.07 -0.07 0.00 0.08 0.00 0.00 59.36 59.77 2ji8 h GLU 463 Cb 0.86 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 2ji8 h GLU 463 CO -0.54 0.80 0.01 1.15 -2.18 0.00 0.00 179.01 178.25 2ji8 h THR 464 N 1.24 1.26 -0.77 0.32 2.02 -1.60 0.21 112.91 115.60 2ji8 h THR 464 Ca 0.40 -1.03 0.00 0.00 0.77 0.00 0.00 66.41 66.55 2ji8 h THR 464 Cb 0.03 1.03 -0.04 0.00 -1.74 0.00 0.00 68.15 67.44 2ji8 h THR 464 CO -0.13 0.36 0.50 0.40 0.37 0.00 0.00 175.52 177.01 2ji8 h ILE 465 N 0.64 1.20 -0.29 3.11 2.04 -0.69 -2.55 117.51 120.99 2ji8 h ILE 465 Ca 0.13 -0.40 -0.06 0.00 1.00 0.00 0.00 64.86 65.53 2ji8 h ILE 465 Cb 0.49 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.65 2ji8 h ILE 465 CO 0.02 0.20 -0.07 0.00 0.00 0.00 0.00 178.15 178.30 2ji8 h ARG 467 N 0.31 0.00 -0.54 0.00 2.43 -0.19 -0.58 114.38 115.82 2ji8 h ARG 467 Ca 0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2ji8 h ARG 467 Cb 0.56 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 2ji8 h ARG 467 CO 0.03 0.00 0.00 0.66 -1.51 0.00 0.00 179.97 179.15 2ji8 n TYR 468 N -4.19 0.71 -3.94 2.20 4.01 -0.99 -5.00 117.16 109.96 2ji8 n TYR 468 Ca 0.01 -0.48 -0.26 0.00 -0.16 0.00 0.00 57.90 57.01 2ji8 n TYR 468 Cb 0.28 -0.01 -0.02 0.00 -0.31 0.00 0.00 39.34 39.28 2ji8 n TYR 468 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2ji8 n ASN 469 N 1.11 -0.65 -4.84 7.72 5.03 -0.23 -4.93 115.26 118.48 2ji8 n ASN 469 Ca 0.18 -1.01 -0.36 0.00 0.87 0.00 0.00 54.58 54.26 2ji8 n ASN 469 Cb 0.53 -3.05 -0.06 0.00 -1.02 0.00 0.00 39.78 36.18 2ji8 n ASN 469 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2ji8 s LEU 470 N -6.94 4.35 -1.32 3.41 1.43 -0.96 -4.76 118.68 113.89 2ji8 s LEU 470 Ca 0.04 1.10 -0.15 0.00 -1.03 0.00 0.00 54.13 54.09 2ji8 s LEU 470 Cb -0.01 -3.25 -0.02 0.00 0.03 0.00 0.00 46.19 42.93 2ji8 s LEU 470 CO 0.89 0.11 2.27 -0.81 0.23 0.00 0.00 176.35 179.04 2ji8 n PRO 471 N 0.87 2.67 -5.05 1.29 -0.04 -1.26 -2.39 135.00 131.10 2ji8 n PRO 471 Ca -0.06 -2.33 -0.32 0.00 -0.04 0.00 0.00 63.50 60.75 2ji8 n PRO 471 Cb 0.52 -3.10 -0.15 0.00 -0.04 0.00 0.00 33.50 30.72 2ji8 n PRO 471 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2ji8 s VAL 472 N 3.41 2.54 -0.29 0.52 1.01 -1.25 -1.34 120.40 125.01 2ji8 s VAL 472 Ca 0.52 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.64 2ji8 s VAL 472 Cb 0.14 -1.99 0.07 0.00 0.00 0.00 0.00 36.38 34.60 2ji8 s VAL 472 CO -0.04 0.56 -0.05 -0.89 0.00 0.00 0.00 175.10 174.68 2ji8 s THR 473 N -0.05 2.41 -0.19 3.92 2.01 0.17 -0.72 115.64 123.19 2ji8 s THR 473 Ca -0.05 -1.71 -0.21 0.00 0.31 0.00 0.00 61.69 60.02 2ji8 s THR 473 Cb -0.14 -2.48 -0.02 0.00 0.01 0.00 0.00 72.50 69.86 2ji8 s THR 473 CO 0.04 -0.16 0.65 -0.69 -0.69 0.00 0.00 174.62 173.77 2ji8 s VAL 474 N 1.10 5.01 -0.30 3.82 1.01 -0.49 -0.88 120.40 129.67 2ji8 s VAL 474 Ca -0.04 1.23 -0.07 0.00 0.00 0.00 0.00 61.98 63.09 2ji8 s VAL 474 Cb -0.20 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.23 2ji8 s VAL 474 CO -0.05 0.11 0.09 -0.63 0.00 0.00 0.00 175.10 174.62 2ji8 s ILE 475 N 1.90 3.94 -0.33 2.22 1.01 0.11 0.91 121.20 130.96 2ji8 s ILE 475 Ca 0.30 -0.78 -0.18 0.00 0.00 0.00 0.00 60.65 59.98 2ji8 s ILE 475 Cb -0.16 -3.07 -0.01 0.00 0.01 0.00 0.00 42.46 39.23 2ji8 s ILE 475 CO 0.11 0.02 0.51 -0.63 0.00 0.00 0.00 174.94 174.95 2ji8 s ILE 476 N 1.48 5.03 -1.30 2.92 -1.09 -0.14 -0.58 121.20 127.52 2ji8 s ILE 476 Ca 0.02 0.47 -0.18 0.00 -2.23 0.00 0.00 60.65 58.73 2ji8 s ILE 476 Cb -0.18 -3.93 0.07 0.00 -1.58 0.00 0.00 42.46 36.85 2ji8 s ILE 476 CO 0.03 -0.15 1.74 0.23 -1.23 0.00 0.00 174.94 175.56 2ji8 n MET 477 N 5.70 3.20 -2.71 2.79 2.81 0.36 -1.21 117.12 128.06 2ji8 n MET 477 Ca -0.05 -3.29 -0.42 0.00 -1.81 0.00 0.00 57.70 52.13 2ji8 n MET 477 Cb 0.49 -3.47 -0.03 0.00 -0.71 0.00 0.00 33.22 29.50 2ji8 n MET 477 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 2ji8 s ASN 478 N 4.13 6.57 0.00 7.83 3.84 -0.24 -3.77 114.94 133.30 2ji8 s ASN 478 Ca 0.53 -1.74 0.18 0.00 0.21 0.00 0.00 52.86 52.04 2ji8 s ASN 478 Cb 0.04 -2.50 0.29 0.00 -0.55 0.00 0.00 41.25 38.53 2ji8 s ASN 478 CO 0.07 -1.31 1.21 -0.46 -2.79 0.00 0.00 177.10 173.82 2ji8 n ASN 479 N 7.89 2.92 -0.21 -4.21 6.94 -1.26 -1.81 115.26 125.51 2ji8 n ASN 479 Ca 0.30 -1.85 -0.01 0.00 -0.02 0.00 0.00 54.58 53.00 2ji8 n ASN 479 Cb 0.50 -0.15 0.00 0.00 -2.36 0.00 0.00 39.78 37.77 2ji8 n ASN 479 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2ji8 n GLY 480 N 1.07 0.52 0.00 4.83 0.00 -1.26 -2.94 105.19 107.42 2ji8 n GLY 480 Ca 0.14 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.35 2ji8 n GLY 480 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ji8 n GLY 481 N -0.86 -2.12 3.58 -0.02 0.00 -1.25 -1.96 105.19 102.55 2ji8 n GLY 481 Ca -0.00 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 2ji8 n GLY 481 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ji8 s ILE 482 N -2.53 4.69 0.00 -0.61 1.01 0.21 -4.38 121.20 119.59 2ji8 s ILE 482 Ca 0.00 0.86 0.00 0.00 0.00 0.00 0.00 60.65 61.51 2ji8 s ILE 482 Cb 0.00 -4.25 0.00 0.00 0.01 0.00 0.00 42.46 38.22 2ji8 s ILE 482 CO 0.00 -0.50 0.00 -1.22 0.00 0.00 0.00 174.94 173.22 2ji8 n TYR 483 N 6.54 0.00 -4.16 3.97 4.01 -1.26 -4.77 117.16 121.49 2ji8 n TYR 483 Ca 0.04 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.67 2ji8 n TYR 483 Cb 0.48 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.41 2ji8 n TYR 483 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 2ji8 s LYS 484 N 0.00 0.94 -0.16 -0.72 1.02 -1.26 -4.13 119.74 115.42 2ji8 s LYS 484 Ca 0.00 -1.44 0.16 0.00 0.02 0.00 0.00 55.97 54.71 2ji8 s LYS 484 Cb 0.00 0.15 0.35 0.00 -0.52 0.00 0.00 37.83 37.81 2ji8 s LYS 484 CO 0.00 -0.23 1.20 0.41 -0.92 0.00 0.00 175.35 175.81 2ji8 n GLY 485 N -0.11 4.91 0.30 -3.33 0.00 -0.71 -3.93 105.19 102.32 2ji8 n GLY 485 Ca -0.06 -1.19 0.05 0.00 0.00 0.00 0.00 46.02 44.82 2ji8 n GLY 485 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ji8 n ASN 486 N -1.27 1.27 -4.71 1.61 6.94 -1.26 -4.84 115.26 113.00 2ji8 n ASN 486 Ca 0.18 -2.60 -0.42 0.00 -0.02 0.00 0.00 54.58 51.72 2ji8 n ASN 486 Cb 0.69 -0.33 -0.03 0.00 -2.36 0.00 0.00 39.78 37.75 2ji8 n ASN 486 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 2ji8 s GLU 487 N -1.56 4.28 0.69 -3.83 2.12 -1.26 -4.94 118.70 114.20 2ji8 s GLU 487 Ca 0.18 2.13 -0.17 0.00 0.36 0.00 0.00 54.97 57.47 2ji8 s GLU 487 Cb 0.16 -3.33 0.01 0.00 0.26 0.00 0.00 34.13 31.23 2ji8 s GLU 487 CO 0.01 -0.52 1.26 0.00 -0.54 0.00 0.00 175.26 175.47 2ji8 s ALA 488 N 1.50 2.24 0.09 6.30 0.00 -1.26 -4.57 121.76 126.05 2ji8 s ALA 488 Ca 0.66 1.08 -0.31 0.00 0.00 0.00 0.00 51.96 53.39 2ji8 s ALA 488 Cb -0.37 -3.52 -0.11 0.00 0.00 0.00 0.00 23.12 19.12 2ji8 s ALA 488 CO 0.30 -1.75 1.86 -0.25 0.00 0.00 0.00 175.76 175.92 2ji8 n ASP 489 N -2.29 3.97 0.03 0.00 9.92 -1.26 -4.44 116.55 122.48 2ji8 n ASP 489 Ca 0.15 0.97 0.07 0.00 -0.53 0.00 0.00 54.79 55.45 2ji8 n ASP 489 Cb 0.49 -1.52 0.49 0.00 -0.64 0.00 0.00 41.12 39.94 2ji8 n ASP 489 CO 0.00 0.00 0.00 -0.65 0.13 0.00 0.00 177.20 176.68 2ji8 h PRO 490 N 8.94 0.39 -4.08 -0.24 0.11 -1.86 -3.45 132.00 131.81 2ji8 h PRO 490 Ca -0.47 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.48 2ji8 h PRO 490 Cb 1.23 -0.09 -0.13 0.00 0.11 0.00 0.00 31.00 32.12 2ji8 h PRO 490 CO 0.94 0.26 -0.42 -0.65 -0.21 0.00 0.00 178.00 177.92 2ji8 s GLN 491 N -5.38 1.13 0.05 1.05 -1.52 -1.26 -5.08 119.66 108.65 2ji8 s GLN 491 Ca -0.07 -1.29 -0.30 0.00 -1.95 0.00 0.00 55.36 51.74 2ji8 s GLN 491 Cb 0.18 0.34 -0.09 0.00 -0.22 0.00 0.00 33.01 33.21 2ji8 s GLN 491 CO 0.72 -0.39 1.95 -2.30 -0.25 0.00 0.00 175.29 175.02 2ji8 n PRO 492 N -0.20 2.84 -1.07 2.91 -0.02 -1.26 -1.97 135.00 136.23 2ji8 n PRO 492 Ca -0.06 1.04 -0.02 0.00 -2.02 0.00 0.00 63.50 62.44 2ji8 n PRO 492 Cb 0.63 -2.98 -0.01 0.00 -0.02 0.00 0.00 33.50 31.12 2ji8 n PRO 492 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ji8 n GLY 493 N 4.49 0.55 3.36 -1.23 0.00 -1.26 -5.01 105.19 106.09 2ji8 n GLY 493 Ca 0.20 -0.34 -0.36 0.00 0.00 0.00 0.00 46.02 45.52 2ji8 n GLY 493 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ji8 s VAL 494 N -1.93 3.74 0.33 1.61 1.01 -0.83 -5.10 120.40 119.22 2ji8 s VAL 494 Ca 0.00 -0.40 -0.28 0.00 0.00 0.00 0.00 61.98 61.30 2ji8 s VAL 494 Cb 0.00 -2.74 -0.10 0.00 0.00 0.00 0.00 36.38 33.54 2ji8 s VAL 494 CO 0.00 0.36 1.18 -0.51 0.00 0.00 0.00 175.10 176.13 2ji8 s ILE 495 N 1.53 3.18 0.70 2.22 2.07 -1.26 -3.57 121.20 126.06 2ji8 s ILE 495 Ca 0.06 1.13 -0.16 0.00 -1.41 0.00 0.00 60.65 60.27 2ji8 s ILE 495 Cb -0.15 -3.70 0.02 0.00 0.13 0.00 0.00 42.46 38.76 2ji8 s ILE 495 CO -0.00 0.23 1.20 -0.55 -1.91 0.00 0.00 174.94 173.90 2ji8 s SER 496 N -0.84 4.47 0.47 4.50 0.15 -1.26 -4.78 113.70 116.41 2ji8 s SER 496 Ca 0.49 2.32 0.30 0.00 0.70 0.00 0.00 55.95 59.77 2ji8 s SER 496 Cb -0.34 -2.59 1.17 0.00 -1.71 0.00 0.00 66.02 62.55 2ji8 s SER 496 CO 0.44 -2.07 1.88 0.00 1.20 0.00 0.00 173.24 174.69 2ji8 n THR 498 N -2.88 0.13 -2.82 0.00 -2.24 -1.26 -4.95 114.28 100.25 2ji8 n THR 498 Ca 0.01 -0.43 -0.39 0.00 -2.27 0.00 0.00 64.05 60.97 2ji8 n THR 498 Cb 0.32 0.85 -0.06 0.00 -2.10 0.00 0.00 70.33 69.34 2ji8 n THR 498 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2ji8 s ARG 499 N -1.87 4.74 0.17 -0.78 1.81 -1.08 -0.62 118.95 121.32 2ji8 s ARG 499 Ca 0.34 1.37 0.09 0.00 -1.72 0.00 0.00 55.73 55.81 2ji8 s ARG 499 Cb 0.20 -3.21 -0.04 0.00 -0.45 0.00 0.00 34.95 31.45 2ji8 s ARG 499 CO 0.31 0.50 -0.20 -0.51 -0.68 0.00 0.00 175.30 174.72 2ji8 s LEU 500 N -1.29 2.44 0.27 2.53 1.43 -0.83 -4.88 118.68 118.35 2ji8 s LEU 500 Ca 0.41 -0.86 -0.31 0.00 -1.03 0.00 0.00 54.13 52.34 2ji8 s LEU 500 Cb -0.24 -0.94 -0.12 0.00 0.03 0.00 0.00 46.19 44.92 2ji8 s LEU 500 CO 0.29 0.02 1.63 0.41 0.23 0.00 0.00 176.35 178.93 2ji8 n THR 501 N 0.29 0.77 -1.28 5.49 -1.04 -1.26 -4.43 114.28 112.81 2ji8 n THR 501 Ca -0.13 -0.19 -0.37 0.00 -2.04 0.00 0.00 64.05 61.32 2ji8 n THR 501 Cb 0.57 -1.97 -0.02 0.00 -1.82 0.00 0.00 70.33 67.08 2ji8 n THR 501 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 2ji8 n ARG 502 N 2.60 3.18 -1.37 -2.82 3.00 -1.26 -4.81 116.66 115.18 2ji8 n ARG 502 Ca 0.10 -2.13 -0.29 0.00 -0.00 0.00 0.00 57.85 55.53 2ji8 n ARG 502 Cb 0.36 -2.84 0.13 0.00 0.00 0.00 0.00 32.46 30.12 2ji8 n ARG 502 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 2ji8 s GLY 503 N 2.69 1.60 -1.20 5.14 0.00 -1.26 -4.94 107.32 109.35 2ji8 s GLY 503 Ca 0.60 -0.29 -0.09 0.00 0.00 0.00 0.00 44.72 44.94 2ji8 s GLY 503 CO -0.05 0.23 1.60 0.54 0.00 0.00 0.00 173.10 175.41 2ji8 n ARG 504 N -3.81 3.76 0.28 2.90 5.12 -1.26 -4.79 116.66 118.86 2ji8 n ARG 504 Ca 0.06 -3.95 0.14 0.00 -1.93 0.00 0.00 57.85 52.17 2ji8 n ARG 504 Cb 0.57 -2.81 0.83 0.00 -1.16 0.00 0.00 32.46 29.89 2ji8 n ARG 504 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 2ji8 h TYR 505 N 6.09 0.00 -0.87 -1.55 0.05 -1.96 -0.47 116.97 118.27 2ji8 h TYR 505 Ca 0.31 0.00 0.01 0.00 0.05 0.00 0.00 58.73 59.09 2ji8 h TYR 505 Cb 0.71 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.41 2ji8 h TYR 505 CO 1.10 0.06 0.58 0.38 -1.05 0.00 0.00 178.16 179.23 2ji8 h ASP 506 N 0.00 1.00 -0.25 3.88 2.03 -1.86 -1.98 116.42 119.23 2ji8 h ASP 506 Ca -0.00 -0.03 -0.15 0.00 -0.73 0.00 0.00 57.03 56.12 2ji8 h ASP 506 Cb 0.16 -0.25 -0.01 0.00 -0.83 0.00 0.00 39.33 38.40 2ji8 h ASP 506 CO 0.01 0.73 -0.39 0.24 -1.03 0.00 0.00 179.24 178.80 2ji8 h MET 507 N 1.18 0.80 -0.39 4.15 2.86 -1.47 -1.72 114.93 120.34 2ji8 h MET 507 Ca 0.32 -0.41 0.02 0.00 -2.06 0.00 0.00 59.70 57.57 2ji8 h MET 507 Cb -0.14 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.51 2ji8 h MET 507 CO -0.07 1.04 0.22 1.98 1.06 0.00 0.00 176.91 181.14 2ji8 h MET 508 N 0.65 0.43 -0.54 1.72 -1.53 -1.26 0.17 114.93 114.58 2ji8 h MET 508 Ca 0.06 -0.03 -0.01 0.00 -3.44 0.00 0.00 59.70 56.28 2ji8 h MET 508 Cb 0.95 -0.10 -0.03 0.00 -0.55 0.00 0.00 31.60 31.87 2ji8 h MET 508 CO 0.09 0.29 0.29 1.98 0.14 0.00 0.00 176.91 179.69 2ji8 h MET 509 N 0.45 0.75 -0.11 0.39 -1.53 -1.28 -2.36 114.93 111.23 2ji8 h MET 509 Ca 0.16 -0.09 -0.01 0.00 -3.44 0.00 0.00 59.70 56.31 2ji8 h MET 509 Cb 0.02 -0.15 -0.01 0.00 -0.55 0.00 0.00 31.60 30.92 2ji8 h MET 509 CO -0.08 0.59 0.02 0.93 0.14 0.00 0.00 176.91 178.50 2ji8 h GLU 510 N 0.72 0.15 -0.03 0.39 5.08 -0.93 -0.84 114.58 119.13 2ji8 h GLU 510 Ca 0.19 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.54 2ji8 h GLU 510 Cb 0.06 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 2ji8 h GLU 510 CO -0.03 0.16 0.10 0.00 -1.00 0.00 0.00 179.01 178.24 2ji8 h ALA 511 N 1.87 1.26 -0.10 3.43 0.00 -0.41 -2.37 119.26 122.94 2ji8 h ALA 511 Ca 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2ji8 h ALA 511 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2ji8 h ALA 511 CO -0.00 -0.12 0.00 1.19 0.00 0.00 0.00 179.25 180.32 2ji8 n PHE 512 N -3.24 0.23 -0.23 0.00 3.72 -0.95 -4.97 117.46 112.02 2ji8 n PHE 512 Ca -0.02 -0.70 0.00 0.00 -0.05 0.00 0.00 57.45 56.68 2ji8 n PHE 512 Cb 0.18 -0.11 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 2ji8 n PHE 512 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ji8 n GLY 513 N -0.58 0.77 3.92 1.37 0.00 -0.89 -4.75 105.19 105.03 2ji8 n GLY 513 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.85 2ji8 n GLY 513 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ji8 s GLY 514 N -1.66 1.65 -0.03 -0.02 0.00 -0.36 -4.97 107.32 101.93 2ji8 s GLY 514 Ca 0.00 -0.78 -0.16 0.00 0.00 0.00 0.00 44.72 43.78 2ji8 s GLY 514 CO 0.00 -0.38 0.43 0.54 0.00 0.00 0.00 173.10 173.69 2ji8 s LYS 515 N -5.28 4.06 0.07 2.90 1.02 -0.54 -3.77 119.74 118.20 2ji8 s LYS 515 Ca 0.59 0.44 0.09 0.00 0.02 0.00 0.00 55.97 57.11 2ji8 s LYS 515 Cb -0.11 -3.28 -0.03 0.00 -0.52 0.00 0.00 37.83 33.89 2ji8 s LYS 515 CO 0.46 0.54 -0.24 0.20 -0.92 0.00 0.00 175.35 175.39 2ji8 s GLY 516 N -0.61 1.51 0.02 -3.33 0.00 -1.26 -1.19 107.32 102.45 2ji8 s GLY 516 Ca 0.24 -1.30 0.00 0.00 0.00 0.00 0.00 44.72 43.66 2ji8 s GLY 516 CO 0.13 -1.22 -0.03 -0.19 0.00 0.00 0.00 173.10 171.79 2ji8 s TYR 517 N -0.92 0.29 -0.18 1.90 1.51 -0.31 -4.96 117.35 114.68 2ji8 s TYR 517 Ca 0.13 -0.42 -0.04 0.00 -1.01 0.00 0.00 57.07 55.74 2ji8 s TYR 517 Cb -0.10 -0.20 -0.02 0.00 -0.11 0.00 0.00 41.96 41.53 2ji8 s TYR 517 CO 0.04 -0.13 -0.03 0.08 -1.11 0.00 0.00 175.55 174.40 2ji8 s VAL 518 N -1.15 3.74 -0.29 0.71 1.01 -1.26 0.10 120.40 123.27 2ji8 s VAL 518 Ca -0.12 -0.40 -0.04 0.00 0.00 0.00 0.00 61.98 61.43 2ji8 s VAL 518 Cb -0.08 -2.66 0.03 0.00 0.00 0.00 0.00 36.38 33.67 2ji8 s VAL 518 CO -0.01 0.46 0.02 0.00 0.00 0.00 0.00 175.10 175.58 2ji8 s ALA 519 N 0.78 2.89 -0.61 5.51 0.00 -0.46 -4.91 121.76 124.96 2ji8 s ALA 519 Ca -0.01 -1.58 0.21 0.00 0.00 0.00 0.00 51.96 50.58 2ji8 s ALA 519 Cb -0.14 -1.98 -0.27 0.00 0.00 0.00 0.00 23.12 20.73 2ji8 s ALA 519 CO 0.02 -1.04 0.73 0.09 0.00 0.00 0.00 175.76 175.56 2ji8 n ASN 520 N 4.74 0.59 -4.05 0.00 5.03 -1.26 -0.92 115.26 119.39 2ji8 n ASN 520 Ca -0.14 -0.59 -0.07 0.00 0.87 0.00 0.00 54.58 54.64 2ji8 n ASN 520 Cb 0.46 1.40 -0.10 0.00 -1.02 0.00 0.00 39.78 40.52 2ji8 n ASN 520 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2ji8 s THR 521 N -3.21 0.20 0.31 3.41 -4.23 -1.26 -0.46 115.64 110.40 2ji8 s THR 521 Ca 0.02 -1.64 0.05 0.00 -1.18 0.00 0.00 61.69 58.93 2ji8 s THR 521 Cb 0.15 -1.38 0.30 0.00 1.34 0.00 0.00 72.50 72.91 2ji8 s THR 521 CO 0.89 -0.91 1.83 -0.65 -0.54 0.00 0.00 174.62 175.24 2ji8 h PRO 522 N 3.24 0.83 -0.69 3.99 0.11 -1.94 -1.08 132.00 136.48 2ji8 h PRO 522 Ca -0.34 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.64 2ji8 h PRO 522 Cb 1.15 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.05 2ji8 h PRO 522 CO 0.62 0.55 0.12 0.00 -0.21 0.00 0.00 178.00 179.09 2ji8 h ALA 523 N 1.58 0.91 -0.49 -0.75 0.00 -1.96 -1.51 119.26 117.05 2ji8 h ALA 523 Ca 0.51 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 2ji8 h ALA 523 Cb 0.67 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2ji8 h ALA 523 CO -0.28 0.67 -0.02 0.93 0.00 0.00 0.00 179.25 180.55 2ji8 h GLU 524 N 1.06 0.87 -0.84 0.00 5.08 -1.80 -2.81 114.58 116.14 2ji8 h GLU 524 Ca 0.21 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 2ji8 h GLU 524 Cb 0.44 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 2ji8 h GLU 524 CO 0.01 0.92 0.40 1.25 -1.00 0.00 0.00 179.01 180.59 2ji8 h LEU 525 N 0.73 1.10 0.51 1.33 5.85 -1.08 -2.19 115.31 121.56 2ji8 h LEU 525 Ca 0.14 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2ji8 h LEU 525 Cb 0.54 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.29 2ji8 h LEU 525 CO 0.03 0.93 -0.27 0.50 -0.34 0.00 0.00 178.44 179.29 2ji8 h LYS 526 N 1.20 -0.69 -0.46 1.25 3.64 -1.20 -0.46 116.57 119.84 2ji8 h LYS 526 Ca 0.29 0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.76 2ji8 h LYS 526 Cb 0.12 0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 2ji8 h LYS 526 CO -0.04 -0.46 0.21 0.00 -2.27 0.00 0.00 179.45 176.89 2ji8 h ALA 527 N -0.23 0.57 -0.21 5.00 0.00 -1.49 -1.12 119.26 121.77 2ji8 h ALA 527 Ca -0.07 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2ji8 h ALA 527 Cb 0.56 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2ji8 h ALA 527 CO 0.10 -0.16 0.14 0.00 0.00 0.00 0.00 179.25 179.33 2ji8 h ALA 528 N 1.26 0.27 -0.25 0.00 0.00 -1.31 -0.10 119.26 119.12 2ji8 h ALA 528 Ca 0.20 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2ji8 h ALA 528 Cb 0.14 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2ji8 h ALA 528 CO -0.16 -0.25 0.06 1.25 0.00 0.00 0.00 179.25 180.15 2ji8 h LEU 529 N 0.28 0.38 -0.51 0.00 5.85 -0.92 0.24 115.31 120.63 2ji8 h LEU 529 Ca 0.08 -0.23 0.05 0.00 0.84 0.00 0.00 57.88 58.62 2ji8 h LEU 529 Cb -0.02 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 40.86 2ji8 h LEU 529 CO -0.02 0.51 0.26 -0.33 -0.34 0.00 0.00 178.44 178.52 2ji8 h GLU 530 N 0.24 0.48 -0.29 1.25 5.08 -1.14 -1.44 114.58 118.76 2ji8 h GLU 530 Ca 0.08 -0.03 -0.14 0.00 -1.00 0.00 0.00 59.36 58.27 2ji8 h GLU 530 Cb 0.27 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 2ji8 h GLU 530 CO 0.00 0.32 -0.37 0.93 -1.00 0.00 0.00 179.01 178.89 2ji8 h GLU 531 N 0.50 0.77 -0.14 2.33 5.08 -0.89 -2.65 114.58 119.57 2ji8 h GLU 531 Ca 0.23 -0.43 -0.00 0.00 -1.00 0.00 0.00 59.36 58.15 2ji8 h GLU 531 Cb 0.14 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2ji8 h GLU 531 CO -0.16 1.06 0.07 0.00 -1.00 0.00 0.00 179.01 178.98 2ji8 h ALA 532 N 0.69 0.18 -0.33 3.43 0.00 -0.43 -0.76 119.26 122.05 2ji8 h ALA 532 Ca 0.04 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2ji8 h ALA 532 Cb 0.96 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2ji8 h ALA 532 CO 0.09 -0.26 0.01 0.28 0.00 0.00 0.00 179.25 179.36 2ji8 h VAL 533 N 0.11 1.26 0.00 0.00 2.07 -1.33 -2.92 116.25 115.44 2ji8 h VAL 533 Ca 0.05 -0.94 -0.07 0.00 0.82 0.00 0.00 66.70 66.56 2ji8 h VAL 533 Cb 0.11 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 2ji8 h VAL 533 CO -0.01 0.31 -0.33 0.00 0.02 0.00 0.00 177.57 177.56 2ji8 h ALA 534 N 0.86 1.36 -0.82 1.67 0.00 -1.46 -2.86 119.26 118.01 2ji8 h ALA 534 Ca 0.09 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.74 2ji8 h ALA 534 Cb 0.43 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 2ji8 h ALA 534 CO 0.02 0.42 0.54 0.66 0.00 0.00 0.00 179.25 180.88 2ji8 h SER 535 N 0.00 0.86 -0.04 0.00 4.64 -0.93 -3.47 113.55 114.62 2ji8 h SER 535 Ca -0.00 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 2ji8 h SER 535 Cb 0.62 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.51 2ji8 h SER 535 CO 0.04 0.58 -0.01 0.61 -0.87 0.00 0.00 176.83 177.19 2ji8 n GLY 536 N -1.41 0.40 3.32 -0.77 0.00 -1.08 -5.04 105.19 100.61 2ji8 n GLY 536 Ca 0.11 -1.01 -0.17 0.00 0.00 0.00 0.00 46.02 44.95 2ji8 n GLY 536 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ji8 s LYS 537 N -2.62 1.27 -0.00 1.61 1.02 -1.26 -4.13 119.74 115.62 2ji8 s LYS 537 Ca 0.00 -1.59 -0.30 0.00 0.02 0.00 0.00 55.97 54.10 2ji8 s LYS 537 Cb 0.00 -0.83 -0.07 0.00 -0.52 0.00 0.00 37.83 36.41 2ji8 s LYS 537 CO 0.00 0.06 1.70 -1.25 -0.92 0.00 0.00 175.35 174.94 2ji8 s PRO 538 N -3.75 4.18 0.14 -1.68 0.04 -1.01 -3.89 135.00 129.04 2ji8 s PRO 538 Ca 0.23 2.29 0.05 0.00 0.04 0.00 0.00 61.00 63.61 2ji8 s PRO 538 Cb 0.03 -3.90 -0.04 0.00 0.04 0.00 0.00 34.50 30.63 2ji8 s PRO 538 CO 0.06 -0.83 -0.11 0.00 0.04 0.00 0.00 177.00 176.17 2ji8 s LEU 540 N -3.00 0.98 -0.24 0.00 0.20 -0.33 -1.39 118.68 114.89 2ji8 s LEU 540 Ca 0.15 0.01 -0.07 0.00 0.69 0.00 0.00 54.13 54.91 2ji8 s LEU 540 Cb 0.01 -0.17 -0.02 0.00 -0.43 0.00 0.00 46.19 45.58 2ji8 s LEU 540 CO 0.01 -0.13 0.05 -0.63 -0.29 0.00 0.00 176.35 175.35 2ji8 s ILE 541 N 1.23 4.13 -0.88 6.68 1.01 0.26 -1.16 121.20 132.46 2ji8 s ILE 541 Ca -0.07 -0.23 -0.18 0.00 0.00 0.00 0.00 60.65 60.16 2ji8 s ILE 541 Cb -0.13 -2.92 0.14 0.00 0.01 0.00 0.00 42.46 39.56 2ji8 s ILE 541 CO -0.02 0.36 1.05 0.21 0.00 0.00 0.00 174.94 176.54 2ji8 s ASN 542 N 1.53 6.60 -0.25 3.58 2.47 0.12 -0.96 114.94 128.02 2ji8 s ASN 542 Ca 0.06 -2.03 -0.26 0.00 0.42 0.00 0.00 52.86 51.05 2ji8 s ASN 542 Cb -0.15 -2.37 -0.00 0.00 -1.45 0.00 0.00 41.25 37.28 2ji8 s ASN 542 CO 0.02 -1.03 0.88 0.00 -3.72 0.00 0.00 177.10 173.25 2ji8 s ALA 543 N 2.46 3.65 -0.52 1.71 0.00 -0.35 -1.36 121.76 127.35 2ji8 s ALA 543 Ca 0.29 -0.08 -0.24 0.00 0.00 0.00 0.00 51.96 51.93 2ji8 s ALA 543 Cb -0.07 -3.35 0.04 0.00 0.00 0.00 0.00 23.12 19.73 2ji8 s ALA 543 CO -0.07 -0.98 0.89 -1.64 0.00 0.00 0.00 175.76 173.95 2ji8 s MET 544 N 2.95 3.35 -0.03 0.00 1.00 -0.10 -1.08 119.30 125.40 2ji8 s MET 544 Ca 0.37 -0.23 -0.02 0.00 0.00 0.00 0.00 55.69 55.81 2ji8 s MET 544 Cb -0.15 -4.02 -0.04 0.00 0.00 0.00 0.00 34.83 30.62 2ji8 s MET 544 CO 0.08 -1.37 0.11 0.42 0.00 0.00 0.00 175.02 174.25 2ji8 s ILE 545 N 3.72 4.96 -0.00 2.53 -1.09 -0.75 -2.66 121.20 127.91 2ji8 s ILE 545 Ca 0.30 -0.26 -0.34 0.00 -2.23 0.00 0.00 60.65 58.12 2ji8 s ILE 545 Cb -0.13 -3.25 -0.13 0.00 -1.58 0.00 0.00 42.46 37.38 2ji8 s ILE 545 CO 0.20 0.40 1.77 -0.67 -1.23 0.00 0.00 174.94 175.41 2ji8 n ASP 546 N 1.31 3.30 0.06 3.58 -0.08 0.20 -4.23 116.55 120.69 2ji8 n ASP 546 Ca -0.14 1.01 0.21 0.00 -1.51 0.00 0.00 54.79 54.37 2ji8 n ASP 546 Cb 0.53 -1.39 0.73 0.00 2.34 0.00 0.00 41.12 43.34 2ji8 n ASP 546 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2ji8 h PRO 547 N 8.04 0.00 -0.14 -0.67 0.11 -1.91 -1.95 132.00 135.48 2ji8 h PRO 547 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2ji8 h PRO 547 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2ji8 h PRO 547 CO 0.93 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 175.25 2ji8 n ASP 548 N -3.75 2.78 -0.14 -2.05 2.03 -1.26 -1.73 116.55 112.42 2ji8 n ASP 548 Ca 0.09 -1.90 -0.12 0.00 0.52 0.00 0.00 54.79 53.38 2ji8 n ASP 548 Cb 0.67 -0.08 -0.00 0.00 -0.72 0.00 0.00 41.12 40.99 2ji8 n ASP 548 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ji8 h ALA 549 N 4.54 0.66 -2.17 -1.67 0.00 -1.69 -3.46 119.26 115.47 2ji8 h ALA 549 Ca 0.00 -0.41 -0.46 0.00 0.00 0.00 0.00 54.91 54.04 2ji8 h ALA 549 Cb 0.87 -0.15 0.06 0.00 0.00 0.00 0.00 17.79 18.57 2ji8 h ALA 549 CO 0.00 0.68 0.10 0.20 0.00 0.00 0.00 179.25 180.23 2ji8 s GLY 550 N -3.78 1.66 0.26 0.00 0.00 -1.26 -4.92 107.32 99.30 2ji8 s GLY 550 Ca -0.11 -0.94 0.08 0.00 0.00 0.00 0.00 44.72 43.75 2ji8 s GLY 550 CO 0.87 -0.64 0.16 -1.34 0.00 0.00 0.00 173.10 172.15 2ji8 s VAL 551 N -2.94 4.11 -0.30 1.40 -7.23 -1.26 -4.78 120.40 109.40 2ji8 s VAL 551 Ca 0.55 -1.53 -0.28 0.00 -1.81 0.00 0.00 61.98 58.92 2ji8 s VAL 551 Cb -0.10 -3.25 -0.04 0.00 0.56 0.00 0.00 36.38 33.55 2ji8 s VAL 551 CO 0.43 -0.34 2.10 -0.70 -0.31 0.00 0.00 175.10 176.28 2ji8 s GLU 552 N -3.82 3.06 0.00 4.82 2.56 -1.26 -2.62 118.70 121.44 2ji8 s GLU 552 Ca 0.33 1.73 0.00 0.00 0.00 0.00 0.00 54.97 57.03 2ji8 s GLU 552 Cb -0.07 -4.34 0.00 0.00 2.00 0.00 0.00 34.13 31.71 2ji8 s GLU 552 CO 0.24 -2.19 0.00 0.43 -0.56 0.00 0.00 175.26 173.18 2ji8 n SER 553 N 11.78 -2.41 0.00 -1.70 7.64 -1.26 -3.86 113.62 123.81 2ji8 n SER 553 Ca 0.28 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.16 2ji8 n SER 553 Cb 0.47 -0.81 0.00 0.00 -1.01 0.00 0.00 64.21 62.86 2ji8 n SER 553 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ji8 n GLY 554 N -2.24 2.89 0.30 0.23 0.00 -1.08 -3.06 105.19 102.24 2ji8 n GLY 554 Ca 0.00 -0.31 0.13 0.00 0.00 0.00 0.00 46.02 45.84 2ji8 n GLY 554 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2ji8 h ARG 555 N 0.00 0.00 -1.56 1.61 2.47 -1.88 -3.09 114.38 111.93 2ji8 h ARG 555 Ca 0.00 0.00 -0.72 0.00 -1.26 0.00 0.00 59.98 58.00 2ji8 h ARG 555 Cb 0.00 0.00 -0.29 0.00 -1.65 0.00 0.00 29.97 28.03 2ji8 h ARG 555 CO 0.00 0.00 0.81 0.44 0.56 0.00 0.00 179.97 181.78 2ji8 n ILE 556 N -4.26 3.49 0.20 2.04 -5.35 -1.17 -4.55 119.36 109.76 2ji8 n ILE 556 Ca 0.00 -3.85 0.07 0.00 -0.27 0.00 0.00 62.75 58.70 2ji8 n ILE 556 Cb 0.23 -1.21 0.34 0.00 -1.74 0.00 0.00 39.64 37.26 2ji8 n ILE 556 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 2ji8 h LYS 557 N 2.58 0.00 -0.59 6.28 2.10 -1.64 -3.17 116.57 122.12 2ji8 h LYS 557 Ca 0.56 0.00 0.07 0.00 -2.00 0.00 0.00 60.65 59.28 2ji8 h LYS 557 Cb 0.42 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.72 2ji8 h LYS 557 CO 1.43 0.33 0.39 0.77 -2.00 0.00 0.00 179.45 180.37 2ji8 h SER 558 N 0.00 0.47 1.05 7.07 0.02 -1.89 -2.87 113.55 117.40 2ji8 h SER 558 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ji8 h SER 558 Cb 0.90 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.34 2ji8 h SER 558 CO 0.04 0.30 0.00 0.18 -1.14 0.00 0.00 176.83 176.22 2ji8 n LEU 559 N -4.48 0.45 -4.75 5.07 4.77 -1.20 -4.83 117.00 112.04 2ji8 n LEU 559 Ca 0.09 0.57 -0.37 0.00 -0.03 0.00 0.00 56.01 56.26 2ji8 n LEU 559 Cb 0.27 -0.45 0.03 0.00 -2.33 0.00 0.00 43.42 40.94 2ji8 n LEU 559 CO 0.34 -0.23 0.90 0.20 -1.33 0.00 0.00 177.39 177.27 2ji8 s ASN 560 N -3.85 5.30 -0.33 -1.43 0.01 -1.09 -5.03 114.94 108.53 2ji8 s ASN 560 Ca 0.10 2.55 -0.09 0.00 -0.71 0.00 0.00 52.86 54.70 2ji8 s ASN 560 Cb 0.13 -2.62 0.01 0.00 0.41 0.00 0.00 41.25 39.18 2ji8 s ASN 560 CO 0.49 -1.53 0.16 -0.69 -1.51 0.00 0.00 177.10 174.01 2ji8 s VAL 561 N -1.45 4.47 0.12 1.60 1.01 -1.26 -5.10 120.40 119.79 2ji8 s VAL 561 Ca 0.74 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 62.15 2ji8 s VAL 561 Cb -0.35 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 2ji8 s VAL 561 CO 0.40 -0.04 -0.04 -0.69 0.00 0.00 0.00 175.10 174.74 2ji8 s VAL 562 N 1.57 3.71 0.32 2.92 1.01 -1.26 -5.13 120.40 123.54 2ji8 s VAL 562 Ca 0.03 -1.20 -0.18 0.00 0.00 0.00 0.00 61.98 60.63 2ji8 s VAL 562 Cb -0.18 -2.78 -0.09 0.00 0.00 0.00 0.00 36.38 33.33 2ji8 s VAL 562 CO 0.06 0.06 0.79 -0.55 0.00 0.00 0.00 175.10 175.46 2ji8 s SER 563 N -2.44 6.93 -0.01 3.32 0.15 -1.26 -4.99 113.70 115.41 2ji8 s SER 563 Ca 0.25 1.45 0.01 0.00 0.70 0.00 0.00 55.95 58.35 2ji8 s SER 563 Cb -0.11 -2.44 0.01 0.00 -1.71 0.00 0.00 66.02 61.78 2ji8 s SER 563 CO 0.17 -0.16 0.74 0.29 1.20 0.00 0.00 173.24 175.47 2ji8 n LYS 564 N -0.06 1.08 0.00 5.44 5.02 -1.26 -5.34 118.16 123.04 2ji8 n LYS 564 Ca 0.03 -0.98 0.00 0.00 -2.02 0.00 0.00 58.31 55.34 2ji8 n LYS 564 Cb 0.52 -0.72 0.00 0.00 -0.02 0.00 0.00 35.03 34.82 2ji8 n LYS 564 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16