#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oa9 s LYS -1 N 0.00 4.29 0.08 2.12 1.02 -1.26 -5.08 119.74 120.91 2oa9 s LYS -1 Ca 0.00 0.82 0.04 0.00 0.02 0.00 0.00 55.97 56.85 2oa9 s LYS -1 Cb 0.00 -3.26 -0.03 0.00 -0.52 0.00 0.00 37.83 34.02 2oa9 s LYS -1 CO 0.00 0.58 -0.11 -1.54 -0.92 0.00 0.00 175.35 173.36 2oa9 s SER 0 N -0.94 1.36 0.23 2.83 1.04 -1.26 -5.17 113.70 111.79 2oa9 s SER 0 Ca 0.31 -0.69 -0.17 0.00 0.48 0.00 0.00 55.95 55.87 2oa9 s SER 0 Cb -0.20 -0.00 0.02 0.00 0.10 0.00 0.00 66.02 65.94 2oa9 s SER 0 CO 0.20 -0.20 0.56 0.00 0.98 0.00 0.00 173.24 174.78 2oa9 s MET 1 N -2.19 1.51 0.18 4.02 0.23 -1.26 -5.13 119.30 116.65 2oa9 s MET 1 Ca -0.01 -0.98 -0.33 0.00 -1.03 0.00 0.00 55.69 53.34 2oa9 s MET 1 Cb -0.07 0.53 -0.13 0.00 -1.53 0.00 0.00 34.83 33.63 2oa9 s MET 1 CO 0.01 -0.65 1.59 0.45 -2.03 0.00 0.00 175.02 174.38 2oa9 n SER 2 N -0.38 3.24 -0.24 -1.18 2.88 -1.26 -4.89 113.62 111.79 2oa9 n SER 2 Ca -0.07 1.09 -0.06 0.00 -1.33 0.00 0.00 58.87 58.50 2oa9 n SER 2 Cb 0.62 -1.46 0.04 0.00 -0.75 0.00 0.00 64.21 62.66 2oa9 n SER 2 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2oa9 h GLU 3 N 5.88 0.94 -0.21 -1.46 5.08 -2.00 -1.30 114.58 121.50 2oa9 h GLU 3 Ca -0.45 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 57.76 2oa9 h GLU 3 Cb 1.25 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 2oa9 h GLU 3 CO 0.89 0.73 0.01 -0.92 -1.00 0.00 0.00 179.01 178.72 2oa9 h TYR 4 N 0.91 0.40 -0.82 4.33 3.20 -2.00 -2.67 116.97 120.32 2oa9 h TYR 4 Ca 0.23 -0.07 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 2oa9 h TYR 4 Cb 0.09 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.21 2oa9 h TYR 4 CO -0.00 0.54 0.48 1.25 -1.64 0.00 0.00 178.16 178.79 2oa9 h LEU 5 N 0.15 0.99 -0.55 2.82 5.85 -1.93 -0.50 115.31 122.13 2oa9 h LEU 5 Ca 0.06 -0.07 0.07 0.00 0.84 0.00 0.00 57.88 58.79 2oa9 h LEU 5 Cb 0.37 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.10 2oa9 h LEU 5 CO 0.01 0.77 0.24 -1.13 -0.34 0.00 0.00 178.44 177.99 2oa9 h ASN 6 N 1.13 0.29 -0.37 1.25 -1.24 -1.01 0.34 115.58 115.98 2oa9 h ASN 6 Ca 0.29 0.05 -0.10 0.00 0.71 0.00 0.00 56.30 57.25 2oa9 h ASN 6 Cb -0.02 0.01 -0.01 0.00 0.73 0.00 0.00 38.32 39.03 2oa9 h ASN 6 CO -0.05 0.19 -0.17 -0.07 -1.29 0.00 0.00 177.43 176.04 2oa9 h LEU 7 N 0.45 0.78 -0.37 0.34 3.38 -1.06 -1.53 115.31 117.30 2oa9 h LEU 7 Ca 0.26 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2oa9 h LEU 7 Cb 0.25 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2oa9 h LEU 7 CO -0.23 1.01 0.17 0.25 0.09 0.00 0.00 178.44 179.72 2oa9 h LEU 8 N 0.55 0.49 -0.61 1.67 5.85 -0.87 -0.06 115.31 122.33 2oa9 h LEU 8 Ca 0.08 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 2oa9 h LEU 8 Cb 0.71 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 2oa9 h LEU 8 CO 0.05 0.50 0.33 0.11 -0.34 0.00 0.00 178.44 179.10 2oa9 h LYS 9 N 0.45 0.85 -0.67 1.25 1.57 -0.91 -0.84 116.57 118.28 2oa9 h LYS 9 Ca 0.13 -0.10 0.02 0.00 -1.87 0.00 0.00 60.65 58.82 2oa9 h LYS 9 Cb 0.15 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.25 2oa9 h LYS 9 CO -0.01 0.65 0.43 1.49 -0.57 0.00 0.00 179.45 181.44 2oa9 h GLU 10 N 0.83 0.83 -0.17 3.15 4.81 -1.01 0.27 114.58 123.30 2oa9 h GLU 10 Ca 0.22 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.39 2oa9 h GLU 10 Cb 0.05 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 2oa9 h GLU 10 CO -0.03 0.55 0.09 0.00 -0.73 0.00 0.00 179.01 178.88 2oa9 h ALA 11 N 1.27 0.22 -0.64 2.92 0.00 -0.59 -0.63 119.26 121.80 2oa9 h ALA 11 Ca 0.26 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 2oa9 h ALA 11 Cb -0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2oa9 h ALA 11 CO -0.08 -0.24 0.08 0.82 0.00 0.00 0.00 179.25 179.84 2oa9 h ILE 12 N 0.16 1.26 -0.85 0.00 2.04 -0.98 -1.78 117.51 117.36 2oa9 h ILE 12 Ca 0.06 -1.06 -0.01 0.00 1.00 0.00 0.00 64.86 64.86 2oa9 h ILE 12 Cb 0.09 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 36.82 2oa9 h ILE 12 CO -0.01 0.39 0.51 -0.61 0.00 0.00 0.00 178.15 178.43 2oa9 h GLN 13 N 1.00 1.15 -0.30 2.37 5.75 -0.75 -0.58 115.11 123.74 2oa9 h GLN 13 Ca 0.19 -0.10 -0.13 0.00 -0.15 0.00 0.00 58.65 58.46 2oa9 h GLN 13 Cb 0.46 -0.24 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 2oa9 h GLN 13 CO 0.02 0.80 -0.34 -0.91 -2.65 0.00 0.00 178.83 175.75 2oa9 h ASN 14 N 1.17 0.68 -0.14 -0.69 2.35 -0.79 -0.91 115.58 117.25 2oa9 h ASN 14 Ca 0.30 -0.28 -0.03 0.00 -0.55 0.00 0.00 56.30 55.74 2oa9 h ASN 14 Cb -0.04 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.13 2oa9 h ASN 14 CO -0.06 0.97 -0.04 0.58 -1.65 0.00 0.00 177.43 177.24 2oa9 h VAL 15 N 0.55 1.29 -0.45 2.81 2.07 -0.87 -2.60 116.25 119.05 2oa9 h VAL 15 Ca 0.06 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.59 2oa9 h VAL 15 Cb 0.85 1.67 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 2oa9 h VAL 15 CO 0.07 0.29 0.29 0.58 0.02 0.00 0.00 177.57 178.82 2oa9 h VAL 16 N -0.05 1.13 0.00 2.57 2.07 -1.03 -1.99 116.25 118.95 2oa9 h VAL 16 Ca 0.03 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.29 2oa9 h VAL 16 Cb 0.46 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2oa9 h VAL 16 CO 0.01 0.13 0.00 0.47 0.02 0.00 0.00 177.57 178.20 2oa9 n ASP 17 N -4.75 0.00 -0.35 0.57 8.00 -0.36 -3.67 116.55 115.99 2oa9 n ASP 17 Ca 0.01 -1.21 0.09 0.00 0.71 0.00 0.00 54.79 54.39 2oa9 n ASP 17 Cb 0.04 0.00 0.39 0.00 -0.02 0.00 0.00 41.12 41.52 2oa9 n ASP 17 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2oa9 n GLY 18 N 0.74 -0.17 7.00 0.44 0.00 -0.75 -5.02 105.19 107.43 2oa9 n GLY 18 Ca 0.16 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2oa9 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oa9 n GLY 19 N 0.98 1.56 3.71 -0.02 0.00 -1.24 -4.67 105.19 105.51 2oa9 n GLY 19 Ca 0.14 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 2oa9 n GLY 19 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2oa9 s TRP 20 N 0.00 3.41 -0.14 1.61 0.52 -1.26 -4.38 118.94 118.71 2oa9 s TRP 20 Ca 0.00 1.31 0.01 0.00 0.02 0.00 0.00 56.10 57.44 2oa9 s TRP 20 Cb 0.00 -3.40 -0.00 0.00 -1.15 0.00 0.00 33.47 28.91 2oa9 s TRP 20 CO 0.00 -1.22 -0.17 -1.01 0.02 0.00 0.00 176.95 174.57 2oa9 s HIS 21 N 1.21 2.73 0.45 -1.98 3.76 0.31 -4.94 115.29 116.84 2oa9 s HIS 21 Ca 0.58 -0.99 -0.24 0.00 -0.15 0.00 0.00 55.06 54.26 2oa9 s HIS 21 Cb -0.28 -1.84 -0.07 0.00 1.11 0.00 0.00 32.58 31.50 2oa9 s HIS 21 CO 0.28 -0.42 1.20 -2.00 -0.85 0.00 0.00 174.74 172.95 2oa9 s GLU 22 N 0.62 3.78 0.02 1.40 2.12 -1.26 -1.56 118.70 123.82 2oa9 s GLU 22 Ca -0.09 1.87 -0.17 0.00 0.36 0.00 0.00 54.97 56.94 2oa9 s GLU 22 Cb -0.16 -2.48 0.03 0.00 0.26 0.00 0.00 34.13 31.78 2oa9 s GLU 22 CO 0.03 -0.56 0.37 -0.08 -0.54 0.00 0.00 175.26 174.48 2oa9 s THR 23 N -1.47 0.06 -0.88 -1.70 -1.32 -0.62 -4.93 115.64 104.78 2oa9 s THR 23 Ca 0.62 -0.49 0.17 0.00 -1.21 0.00 0.00 61.69 60.78 2oa9 s THR 23 Cb -0.31 -0.86 0.72 0.00 -1.51 0.00 0.00 72.50 70.54 2oa9 s THR 23 CO 0.38 -0.27 1.63 0.29 -2.21 0.00 0.00 174.62 174.44 2oa9 n LYS 24 N 0.75 3.90 -0.01 7.08 5.02 -1.26 -4.23 118.16 129.41 2oa9 n LYS 24 Ca -0.19 -2.92 0.00 0.00 -2.02 0.00 0.00 58.31 53.18 2oa9 n LYS 24 Cb 0.58 -1.95 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 2oa9 n LYS 24 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 2oa9 n ARG 25 N 0.90 0.00 0.00 1.97 0.00 -1.26 -5.16 116.66 113.11 2oa9 n ARG 25 Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.11 2oa9 n ARG 25 Cb 0.94 -0.01 0.00 0.00 -0.00 0.00 0.00 32.46 33.39 2oa9 n ARG 25 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 2oa9 n THR 29 N -0.06 0.00 -0.28 8.89 -1.04 -1.26 -5.06 114.28 115.47 2oa9 n THR 29 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.00 2oa9 n THR 29 Cb 0.00 0.00 0.11 0.00 -1.82 0.00 0.00 70.33 68.63 2oa9 n THR 29 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2oa9 h GLY 30 N 0.00 1.16 0.90 3.41 0.00 -2.02 -1.54 103.07 104.99 2oa9 h GLY 30 Ca 0.00 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 2oa9 h GLY 30 CO 0.00 0.26 -0.04 -2.22 0.00 0.00 0.00 176.54 174.54 2oa9 h ILE 31 N 0.90 0.98 -0.33 2.60 2.04 -1.99 -1.30 117.51 120.41 2oa9 h ILE 31 Ca 0.34 -0.22 -0.06 0.00 1.00 0.00 0.00 64.86 65.92 2oa9 h ILE 31 Cb 0.12 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 2oa9 h ILE 31 CO -0.15 0.06 -0.02 1.23 0.00 0.00 0.00 178.15 179.26 2oa9 h GLY 32 N -0.22 0.65 1.38 5.37 0.00 -1.84 -2.44 103.07 105.97 2oa9 h GLY 32 Ca -0.01 -0.50 -0.11 0.00 0.00 0.00 0.00 47.33 46.72 2oa9 h GLY 32 CO 0.02 0.45 -0.20 1.70 0.00 0.00 0.00 176.54 178.51 2oa9 h LYS 33 N 0.39 0.72 -0.68 4.80 3.64 -1.24 -0.57 116.57 123.64 2oa9 h LYS 33 Ca 0.09 -0.28 -0.04 0.00 -1.27 0.00 0.00 60.65 59.16 2oa9 h LYS 33 Cb 0.49 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.24 2oa9 h LYS 33 CO 0.02 0.87 0.28 1.15 -2.27 0.00 0.00 179.45 179.50 2oa9 h THR 34 N 0.64 1.24 -0.66 1.00 2.02 -1.23 -0.51 112.91 115.41 2oa9 h THR 34 Ca 0.09 -0.75 0.01 0.00 0.77 0.00 0.00 66.41 66.54 2oa9 h THR 34 Cb 0.69 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 2oa9 h THR 34 CO 0.05 0.30 0.43 0.15 0.37 0.00 0.00 175.52 176.82 2oa9 h PHE 35 N 0.96 0.82 -0.72 3.16 3.57 -0.87 -1.58 116.94 122.28 2oa9 h PHE 35 Ca 0.23 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.78 2oa9 h PHE 35 Cb 0.20 -0.28 -0.05 0.00 2.79 0.00 0.00 35.95 38.61 2oa9 h PHE 35 CO 0.01 0.51 0.45 0.93 -2.23 0.00 0.00 178.31 177.98 2oa9 h GLU 36 N 0.88 0.84 -0.95 1.11 5.08 -0.73 -0.70 114.58 120.11 2oa9 h GLU 36 Ca 0.25 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2oa9 h GLU 36 Cb -0.09 -0.19 -0.05 0.00 0.50 0.00 0.00 28.75 28.93 2oa9 h GLU 36 CO -0.06 0.55 0.59 -0.44 -1.00 0.00 0.00 179.01 178.66 2oa9 h ASP 37 N 0.86 1.13 0.34 1.42 3.32 -0.59 -1.94 116.42 120.97 2oa9 h ASP 37 Ca 0.30 -0.06 -0.18 0.00 0.02 0.00 0.00 57.03 57.11 2oa9 h ASP 37 Cb 0.06 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 2oa9 h ASP 37 CO -0.13 0.85 -0.75 -0.07 -1.72 0.00 0.00 179.24 177.43 2oa9 h LEU 38 N 1.31 0.40 -0.65 1.55 3.38 -0.80 -2.60 115.31 117.91 2oa9 h LEU 38 Ca 0.34 -0.27 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 2oa9 h LEU 38 Cb -0.09 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2oa9 h LEU 38 CO -0.07 1.01 -0.19 0.25 0.09 0.00 0.00 178.44 179.54 2oa9 h LEU 39 N 0.22 0.87 -0.95 1.67 5.85 -1.00 -1.99 115.31 119.99 2oa9 h LEU 39 Ca -0.03 -0.31 0.04 0.00 0.84 0.00 0.00 57.88 58.42 2oa9 h LEU 39 Cb 1.32 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 42.06 2oa9 h LEU 39 CO 0.12 1.04 0.62 -0.08 -0.34 0.00 0.00 178.44 179.80 2oa9 h GLU 40 N 0.76 1.16 -0.25 1.25 4.57 -1.18 -2.25 114.58 118.64 2oa9 h GLU 40 Ca 0.11 -0.07 -0.07 0.00 -1.18 0.00 0.00 59.36 58.15 2oa9 h GLU 40 Cb 0.72 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 2oa9 h GLU 40 CO 0.06 0.77 -0.16 0.87 -1.18 0.00 0.00 179.01 179.37 2oa9 h LYS 41 N 1.20 0.43 0.00 1.92 1.57 -1.05 -2.84 116.57 117.79 2oa9 h LYS 41 Ca 0.38 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 59.01 2oa9 h LYS 41 Cb -0.00 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.26 2oa9 h LYS 41 CO -0.12 0.58 -0.11 0.93 -0.57 0.00 0.00 179.45 180.16 2oa9 h GLU 42 N 0.39 0.00 -0.43 3.15 4.39 -0.77 -2.96 114.58 118.36 2oa9 h GLU 42 Ca 0.07 0.00 0.09 0.00 0.34 0.00 0.00 59.36 59.86 2oa9 h GLU 42 Cb 0.51 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 29.08 2oa9 h GLU 42 CO 0.03 0.11 -0.10 0.93 -1.16 0.00 0.00 179.01 178.82 2oa9 h GLU 43 N 0.00 0.01 -0.25 2.33 5.08 -1.33 -1.04 114.58 119.36 2oa9 h GLU 43 Ca -0.00 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2oa9 h GLU 43 Cb 0.23 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2oa9 h GLU 43 CO 0.01 0.00 0.02 -0.44 -1.00 0.00 0.00 179.01 177.61 2oa9 h ASP 44 N 0.01 0.42 0.36 1.42 3.32 -1.69 0.14 116.42 120.41 2oa9 h ASP 44 Ca 0.21 -0.28 -0.02 0.00 0.02 0.00 0.00 57.03 56.95 2oa9 h ASP 44 Cb 0.31 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.75 2oa9 h ASP 44 CO -0.43 0.60 -0.11 0.78 -1.72 0.00 0.00 179.24 178.36 2oa9 h ASN 45 N 0.23 0.00 -0.01 6.45 2.35 -1.35 -2.45 115.58 120.80 2oa9 h ASN 45 Ca 0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 2oa9 h ASN 45 Cb 0.37 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.74 2oa9 h ASN 45 CO 0.01 0.11 -0.27 0.18 -1.65 0.00 0.00 177.43 175.81 2oa9 n LEU 46 N -3.62 1.59 -3.94 1.61 4.77 -0.41 -5.00 117.00 111.99 2oa9 n LEU 46 Ca -0.02 -0.79 -0.41 0.00 -0.03 0.00 0.00 56.01 54.76 2oa9 n LEU 46 Cb 0.23 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.34 2oa9 n LEU 46 CO 0.30 0.30 -0.14 0.47 -1.33 0.00 0.00 177.39 176.99 2oa9 n ASP 47 N -0.05 -4.57 -4.82 -1.43 8.00 0.34 -4.96 116.55 109.05 2oa9 n ASP 47 Ca 0.06 -1.19 -0.23 0.00 0.71 0.00 0.00 54.79 54.14 2oa9 n ASP 47 Cb 0.31 -2.17 -0.05 0.00 -0.02 0.00 0.00 41.12 39.19 2oa9 n ASP 47 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2oa9 s ALA 48 N -3.46 3.58 1.10 2.24 0.00 -0.21 -5.04 121.76 119.97 2oa9 s ALA 48 Ca 0.45 -1.36 -0.15 0.00 0.00 0.00 0.00 51.96 50.90 2oa9 s ALA 48 Cb -0.22 -1.32 0.24 0.00 0.00 0.00 0.00 23.12 21.82 2oa9 s ALA 48 CO 0.94 0.32 1.08 -1.25 0.00 0.00 0.00 175.76 176.85 2oa9 s PRO 49 N -3.64 -0.42 0.25 0.00 0.04 -1.26 -4.79 135.00 125.18 2oa9 s PRO 49 Ca 0.32 0.35 -0.30 0.00 0.04 0.00 0.00 61.00 61.42 2oa9 s PRO 49 Cb -0.08 -1.65 -0.09 0.00 0.04 0.00 0.00 34.50 32.71 2oa9 s PRO 49 CO 0.24 -3.27 1.27 -0.51 0.04 0.00 0.00 177.00 174.78 2oa9 s ASP 50 N -3.45 6.93 -1.09 6.66 1.01 -1.26 -4.91 116.67 120.57 2oa9 s ASP 50 Ca 0.67 2.46 -0.02 0.00 0.71 0.00 0.00 52.55 56.38 2oa9 s ASP 50 Cb -0.17 -2.62 0.29 0.00 1.01 0.00 0.00 42.92 41.42 2oa9 s ASP 50 CO 0.58 -0.46 1.87 0.49 0.21 0.00 0.00 175.17 177.86 2oa9 n PHE 51 N 1.82 2.67 -3.74 4.23 0.99 -1.26 -5.00 117.46 117.17 2oa9 n PHE 51 Ca 0.03 -2.60 -0.20 0.00 -0.00 0.00 0.00 57.45 54.67 2oa9 n PHE 51 Cb 0.43 -1.32 -0.01 0.00 -1.00 0.00 0.00 39.48 37.58 2oa9 n PHE 51 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.76 175.75 2oa9 s HIS 52 N -3.55 3.30 -1.54 1.38 3.76 -1.26 -4.47 115.29 112.91 2oa9 s HIS 52 Ca 0.40 -0.11 -0.05 0.00 -0.15 0.00 0.00 55.06 55.15 2oa9 s HIS 52 Cb 0.17 -1.76 0.01 0.00 1.11 0.00 0.00 32.58 32.11 2oa9 s HIS 52 CO -0.09 0.23 0.58 -0.25 -0.85 0.00 0.00 174.74 174.36 2oa9 n ASP 53 N -1.52 -5.90 -4.46 1.40 8.00 -1.26 -4.97 116.55 107.85 2oa9 n ASP 53 Ca -0.05 -0.29 -0.39 0.00 0.71 0.00 0.00 54.79 54.78 2oa9 n ASP 53 Cb 0.57 -4.78 -0.12 0.00 -0.02 0.00 0.00 41.12 36.78 2oa9 n ASP 53 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2oa9 s ILE 54 N -3.15 4.70 0.19 0.53 1.01 -1.26 -4.56 121.20 118.65 2oa9 s ILE 54 Ca 0.30 -0.35 -0.30 0.00 0.00 0.00 0.00 60.65 60.30 2oa9 s ILE 54 Cb -0.14 -3.38 -0.08 0.00 0.01 0.00 0.00 42.46 38.88 2oa9 s ILE 54 CO 0.37 0.08 1.10 -1.61 0.00 0.00 0.00 174.94 174.89 2oa9 s GLU 55 N 1.63 4.60 -0.16 2.79 2.02 -1.17 -4.90 118.70 123.52 2oa9 s GLU 55 Ca 0.05 1.72 0.01 0.00 0.02 0.00 0.00 54.97 56.78 2oa9 s GLU 55 Cb -0.17 -3.27 0.02 0.00 0.10 0.00 0.00 34.13 30.81 2oa9 s GLU 55 CO 0.07 0.09 -0.19 0.42 0.02 0.00 0.00 175.26 175.67 2oa9 s ILE 56 N -0.32 1.90 0.04 -1.63 -1.09 -1.26 -0.97 121.20 117.86 2oa9 s ILE 56 Ca 0.49 -0.85 -0.01 0.00 -2.23 0.00 0.00 60.65 58.04 2oa9 s ILE 56 Cb -0.30 -1.72 -0.03 0.00 -1.58 0.00 0.00 42.46 38.84 2oa9 s ILE 56 CO 0.35 0.52 -0.01 -0.54 -1.23 0.00 0.00 174.94 174.03 2oa9 s LYS 57 N 1.18 0.53 0.77 2.79 1.02 -0.83 -4.86 119.74 120.33 2oa9 s LYS 57 Ca 0.01 -1.00 -0.12 0.00 0.02 0.00 0.00 55.97 54.88 2oa9 s LYS 57 Cb -0.14 0.19 0.05 0.00 -0.52 0.00 0.00 37.83 37.41 2oa9 s LYS 57 CO -0.08 -0.10 1.13 0.95 -0.92 0.00 0.00 175.35 176.32 2oa9 s THR 58 N -3.10 2.80 0.30 2.17 -4.23 -1.26 -0.89 115.64 111.43 2oa9 s THR 58 Ca -0.01 0.26 -0.02 0.00 -1.18 0.00 0.00 61.69 60.75 2oa9 s THR 58 Cb 0.02 -3.21 0.24 0.00 1.34 0.00 0.00 72.50 70.89 2oa9 s THR 58 CO -0.07 -0.34 1.94 0.45 -0.54 0.00 0.00 174.62 176.06 2oa9 h HIS 59 N -0.91 0.99 -0.40 3.99 -0.00 -1.78 0.14 115.15 117.19 2oa9 h HIS 59 Ca -0.46 -0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 59.88 2oa9 h HIS 59 Cb 1.29 -0.33 -0.02 0.00 -0.00 0.00 0.00 27.41 28.35 2oa9 h HIS 59 CO 0.41 0.67 0.13 1.49 -0.00 0.00 0.00 177.93 180.63 2oa9 h GLU 60 N 1.04 0.61 -0.09 2.45 4.81 -1.93 -2.20 114.58 119.27 2oa9 h GLU 60 Ca 0.27 -0.13 -0.23 0.00 -0.13 0.00 0.00 59.36 59.14 2oa9 h GLU 60 Cb -0.03 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.27 2oa9 h GLU 60 CO -0.05 0.60 -0.87 1.15 -0.73 0.00 0.00 179.01 179.11 2oa9 h THR 61 N 0.50 1.29 -0.86 0.32 2.02 -1.85 -3.07 112.91 111.26 2oa9 h THR 61 Ca 0.13 -2.10 0.13 0.00 0.77 0.00 0.00 66.41 65.34 2oa9 h THR 61 Cb 0.24 2.14 -0.07 0.00 -1.74 0.00 0.00 68.15 68.73 2oa9 h THR 61 CO -0.01 0.66 0.56 0.00 0.37 0.00 0.00 175.52 177.10 2oa9 h ALA 62 N 0.55 1.82 0.00 6.16 0.00 -0.65 -1.49 119.26 125.65 2oa9 h ALA 62 Ca -0.08 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2oa9 h ALA 62 Cb 1.50 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 2oa9 h ALA 62 CO 0.17 -0.04 -0.16 0.00 0.00 0.00 0.00 179.25 179.22 2oa9 h ALA 63 N 1.60 1.21 -0.29 0.00 0.00 -1.30 -1.75 119.26 118.74 2oa9 h ALA 63 Ca 0.42 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2oa9 h ALA 63 Cb 0.64 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2oa9 h ALA 63 CO -0.18 0.20 0.00 1.63 0.00 0.00 0.00 179.25 180.90 2oa9 n LYS 64 N -3.59 2.23 -4.73 0.00 5.02 -0.58 -4.87 118.16 111.63 2oa9 n LYS 64 Ca -0.01 -1.85 -0.33 0.00 -2.02 0.00 0.00 58.31 54.10 2oa9 n LYS 64 Cb 0.30 -1.47 -0.13 0.00 -0.02 0.00 0.00 35.03 33.71 2oa9 n LYS 64 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2oa9 s SER 65 N -1.55 4.31 -0.22 4.39 0.01 -0.66 -5.06 113.70 114.91 2oa9 s SER 65 Ca 0.36 -0.16 -0.06 0.00 1.31 0.00 0.00 55.95 57.40 2oa9 s SER 65 Cb 0.21 -1.22 -0.02 0.00 0.21 0.00 0.00 66.02 65.19 2oa9 s SER 65 CO 0.30 0.29 0.03 -0.22 0.41 0.00 0.00 173.24 174.05 2oa9 s LEU 66 N -0.40 3.30 -0.18 2.44 2.96 -1.26 -1.33 118.68 124.22 2oa9 s LEU 66 Ca 0.05 -0.22 -0.10 0.00 -0.22 0.00 0.00 54.13 53.63 2oa9 s LEU 66 Cb -0.12 -1.86 -0.05 0.00 0.50 0.00 0.00 46.19 44.66 2oa9 s LEU 66 CO 0.02 0.01 0.17 -0.22 -1.32 0.00 0.00 176.35 175.01 2oa9 s LEU 67 N 1.33 4.24 -0.36 -0.68 2.96 0.29 -4.94 118.68 121.52 2oa9 s LEU 67 Ca 0.04 0.33 -0.21 0.00 -0.22 0.00 0.00 54.13 54.07 2oa9 s LEU 67 Cb -0.15 -2.15 0.01 0.00 0.50 0.00 0.00 46.19 44.40 2oa9 s LEU 67 CO 0.02 0.20 0.66 -0.89 -1.32 0.00 0.00 176.35 175.02 2oa9 s THR 68 N 0.17 4.86 0.06 3.68 2.01 -1.26 -1.07 115.64 124.08 2oa9 s THR 68 Ca 0.11 0.61 -0.19 0.00 0.31 0.00 0.00 61.69 62.52 2oa9 s THR 68 Cb -0.12 -4.11 -0.11 0.00 0.01 0.00 0.00 72.50 68.17 2oa9 s THR 68 CO 0.00 -0.36 1.42 -0.07 -0.69 0.00 0.00 174.62 174.92 2oa9 h LEU 69 N 9.47 0.45 -7.38 4.42 3.38 -1.22 -3.48 115.31 120.94 2oa9 h LEU 69 Ca -0.26 -0.42 0.25 0.00 0.09 0.00 0.00 57.88 57.54 2oa9 h LEU 69 Cb 1.11 -0.12 -0.11 0.00 0.09 0.00 0.00 40.66 41.62 2oa9 h LEU 69 CO 0.85 0.77 0.66 0.72 0.09 0.00 0.00 178.44 181.53 2oa9 s PHE 70 N -4.55 -0.10 0.02 1.13 -0.12 -1.25 -4.65 117.98 108.46 2oa9 s PHE 70 Ca -0.14 -0.08 0.08 0.00 -0.05 0.00 0.00 56.93 56.74 2oa9 s PHE 70 Cb 0.06 0.58 -0.03 0.00 -0.63 0.00 0.00 43.02 43.01 2oa9 s PHE 70 CO 0.76 -0.52 -0.25 0.95 -0.05 0.00 0.00 175.22 176.11 2oa9 s THR 71 N -2.84 2.24 -0.29 -4.49 -4.23 -1.26 -1.36 115.64 103.42 2oa9 s THR 71 Ca 0.12 -1.23 -0.15 0.00 -1.18 0.00 0.00 61.69 59.26 2oa9 s THR 71 Cb 0.01 -1.85 0.14 0.00 1.34 0.00 0.00 72.50 72.15 2oa9 s THR 71 CO -0.02 0.45 0.91 -0.75 -0.54 0.00 0.00 174.62 174.67 2oa9 s LYS 72 N -1.01 0.43 0.61 3.99 2.47 0.16 -4.86 119.74 121.53 2oa9 s LYS 72 Ca 0.11 0.83 -0.16 0.00 -1.56 0.00 0.00 55.97 55.20 2oa9 s LYS 72 Cb -0.10 0.25 -0.02 0.00 -1.46 0.00 0.00 37.83 36.49 2oa9 s LYS 72 CO 0.01 -0.11 1.09 -1.12 0.16 0.00 0.00 175.35 175.39 2oa9 s SER 73 N 1.80 5.48 0.41 1.43 0.01 -1.26 -3.55 113.70 118.01 2oa9 s SER 73 Ca -0.07 1.95 -0.25 0.00 1.31 0.00 0.00 55.95 58.89 2oa9 s SER 73 Cb -0.05 -2.55 -0.11 0.00 0.21 0.00 0.00 66.02 63.52 2oa9 s SER 73 CO -0.17 -1.38 0.99 -2.65 0.41 0.00 0.00 173.24 170.45 2oa9 n PRO 74 N -2.10 1.32 -0.27 12.44 -0.02 -1.26 -4.91 135.00 140.20 2oa9 n PRO 74 Ca 0.10 0.47 -0.06 0.00 -2.02 0.00 0.00 63.50 61.99 2oa9 n PRO 74 Cb 0.52 -2.00 0.06 0.00 -0.02 0.00 0.00 33.50 32.06 2oa9 n PRO 74 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2oa9 h THR 75 N 1.56 1.26 -3.48 3.45 2.02 -1.16 -3.47 112.91 113.09 2oa9 h THR 75 Ca -0.44 -0.86 -0.16 0.00 0.77 0.00 0.00 66.41 65.71 2oa9 h THR 75 Cb 1.34 0.41 -0.23 0.00 -1.74 0.00 0.00 68.15 67.93 2oa9 h THR 75 CO 0.57 0.34 -0.52 0.21 0.37 0.00 0.00 175.52 176.49 2oa9 s ASN 76 N -6.36 -0.04 1.08 4.18 2.47 -0.89 -4.49 114.94 110.90 2oa9 s ASN 76 Ca -0.12 -0.02 -0.17 0.00 0.42 0.00 0.00 52.86 52.97 2oa9 s ASN 76 Cb 0.15 0.24 0.24 0.00 -1.45 0.00 0.00 41.25 40.43 2oa9 s ASN 76 CO 0.84 -0.24 1.18 -2.16 -3.72 0.00 0.00 177.10 173.00 2oa9 s PRO 77 N -0.81 -0.30 0.37 0.43 0.04 -1.26 -1.62 135.00 131.85 2oa9 s PRO 77 Ca -0.09 -0.12 -0.28 0.00 0.04 0.00 0.00 61.00 60.55 2oa9 s PRO 77 Cb -0.05 -1.71 -0.11 0.00 0.04 0.00 0.00 34.50 32.67 2oa9 s PRO 77 CO 0.01 -3.09 1.45 -2.13 0.04 0.00 0.00 177.00 173.28 2oa9 n ARG 78 N -4.31 2.56 -1.61 4.56 0.63 -1.26 -2.14 116.66 115.09 2oa9 n ARG 78 Ca 0.13 0.90 -0.13 0.00 -0.92 0.00 0.00 57.85 57.83 2oa9 n ARG 78 Cb 0.59 -2.60 -0.04 0.00 0.45 0.00 0.00 32.46 30.86 2oa9 n ARG 78 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2oa9 n GLY 79 N 0.56 0.94 0.29 5.14 0.00 -1.26 -4.90 105.19 105.95 2oa9 n GLY 79 Ca 0.02 -0.41 0.05 0.00 0.00 0.00 0.00 46.02 45.68 2oa9 n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oa9 h ALA 80 N 0.17 1.13 -0.18 4.61 0.00 -1.76 -2.17 119.26 121.05 2oa9 h ALA 80 Ca -0.27 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 2oa9 h ALA 80 Cb 0.94 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2oa9 h ALA 80 CO 0.38 -0.12 -0.35 -0.91 0.00 0.00 0.00 179.25 178.25 2oa9 h ASN 81 N 0.56 0.38 -0.46 0.00 2.35 -1.90 -0.67 115.58 115.84 2oa9 h ASN 81 Ca 0.42 -0.15 -0.04 0.00 -0.55 0.00 0.00 56.30 55.97 2oa9 h ASN 81 Cb 0.57 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.82 2oa9 h ASN 81 CO -0.35 0.71 0.11 0.74 -1.65 0.00 0.00 177.43 176.99 2oa9 h THR 82 N 0.32 1.23 -0.63 2.81 2.02 -1.89 -1.94 112.91 114.83 2oa9 h THR 82 Ca 0.04 -0.81 0.00 0.00 0.77 0.00 0.00 66.41 66.41 2oa9 h THR 82 Cb 0.77 0.89 -0.03 0.00 -1.74 0.00 0.00 68.15 68.04 2oa9 h THR 82 CO 0.06 0.29 0.41 -0.03 0.37 0.00 0.00 175.52 176.62 2oa9 h MET 83 N 0.61 0.83 -0.50 6.66 1.85 -0.89 -2.11 114.93 121.39 2oa9 h MET 83 Ca 0.14 -0.06 -0.03 0.00 -0.61 0.00 0.00 59.70 59.15 2oa9 h MET 83 Cb 0.32 -0.18 -0.02 0.00 0.43 0.00 0.00 31.60 32.14 2oa9 h MET 83 CO 0.00 0.56 0.21 -0.07 -0.40 0.00 0.00 176.91 177.21 2oa9 h LEU 84 N 0.85 0.68 -0.26 3.39 3.38 -0.92 0.81 115.31 123.23 2oa9 h LEU 84 Ca 0.23 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 2oa9 h LEU 84 Cb -0.08 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 2oa9 h LEU 84 CO -0.05 0.65 -0.18 0.08 0.09 0.00 0.00 178.44 179.03 2oa9 h ARG 85 N 0.66 0.59 -0.25 1.13 0.11 -1.26 -0.90 114.38 114.46 2oa9 h ARG 85 Ca 0.17 -0.28 -0.16 0.00 0.10 0.00 0.00 59.98 59.81 2oa9 h ARG 85 Cb 0.18 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.26 2oa9 h ARG 85 CO -0.02 0.87 -0.45 -0.91 0.10 0.00 0.00 179.97 179.56 2oa9 h ASN 86 N 0.32 0.83 0.02 0.08 2.35 -1.24 -0.88 115.58 117.06 2oa9 h ASN 86 Ca 0.05 -0.53 -0.04 0.00 -0.55 0.00 0.00 56.30 55.23 2oa9 h ASN 86 Cb 0.72 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.86 2oa9 h ASN 86 CO 0.05 1.20 -0.15 -0.09 -1.65 0.00 0.00 177.43 176.79 2oa9 h ARG 87 N 0.48 0.06 -0.01 0.81 2.43 -0.88 -3.40 114.38 113.88 2oa9 h ARG 87 Ca 0.01 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 2oa9 h ARG 87 Cb 1.05 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 2oa9 h ARG 87 CO 0.10 1.00 -0.42 0.66 -1.51 0.00 0.00 179.97 179.80 2oa9 n TYR 88 N -4.54 0.00 -1.18 2.20 0.53 -0.36 -5.02 117.16 108.80 2oa9 n TYR 88 Ca -0.10 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.78 2oa9 n TYR 88 Cb 0.52 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.83 2oa9 n TYR 88 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2oa9 n GLY 89 N 1.16 -0.33 3.26 2.72 0.00 -0.34 -4.61 105.19 107.05 2oa9 n GLY 89 Ca 0.04 -1.76 -0.15 0.00 0.00 0.00 0.00 46.02 44.16 2oa9 n GLY 89 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oa9 s LYS 90 N -1.76 1.11 0.19 1.61 -2.85 0.01 -4.85 119.74 113.20 2oa9 s LYS 90 Ca 0.00 -1.48 -0.30 0.00 -1.00 0.00 0.00 55.97 53.19 2oa9 s LYS 90 Cb 0.00 -0.66 -0.08 0.00 -2.06 0.00 0.00 37.83 35.03 2oa9 s LYS 90 CO 0.00 0.07 1.10 0.15 0.10 0.00 0.00 175.35 176.77 2oa9 s LYS 91 N -3.75 4.60 0.11 1.78 1.02 -1.26 -0.72 119.74 121.52 2oa9 s LYS 91 Ca 0.18 1.73 -0.00 0.00 0.02 0.00 0.00 55.97 57.90 2oa9 s LYS 91 Cb 0.03 -3.27 0.02 0.00 -0.52 0.00 0.00 37.83 34.09 2oa9 s LYS 91 CO 0.02 0.09 0.15 -0.40 -0.92 0.00 0.00 175.35 174.29 2oa9 n ASP 92 N 2.25 0.18 -0.32 2.83 5.68 -0.18 -4.90 116.55 122.09 2oa9 n ASP 92 Ca 0.02 -1.16 0.18 0.00 -0.50 0.00 0.00 54.79 53.33 2oa9 n ASP 92 Cb 0.46 -0.10 0.36 0.00 -1.14 0.00 0.00 41.12 40.70 2oa9 n ASP 92 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2oa9 h GLU 93 N 0.00 0.16 -0.45 0.11 3.07 -1.97 -2.50 114.58 113.01 2oa9 h GLU 93 Ca -0.05 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 2oa9 h GLU 93 Cb 0.18 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.05 2oa9 h GLU 93 CO 0.05 0.11 0.00 0.66 -1.40 0.00 0.00 179.01 178.43 2oa9 n TYR 94 N -5.24 0.58 -0.63 4.33 4.02 -1.26 -4.94 117.16 114.01 2oa9 n TYR 94 Ca 0.26 -0.29 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 2oa9 n TYR 94 Cb 0.83 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.15 2oa9 n TYR 94 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2oa9 n GLY 95 N 1.42 0.72 3.79 2.72 0.00 -0.94 -5.04 105.19 107.85 2oa9 n GLY 95 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 2oa9 n GLY 95 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2oa9 s ASN 96 N -2.27 6.02 0.29 1.61 0.01 -1.26 -4.82 114.94 114.51 2oa9 s ASN 96 Ca 0.00 0.32 -0.29 0.00 -0.71 0.00 0.00 52.86 52.17 2oa9 s ASN 96 Cb 0.00 -1.93 -0.10 0.00 0.41 0.00 0.00 41.25 39.63 2oa9 s ASN 96 CO 0.00 0.34 1.18 0.20 -1.51 0.00 0.00 177.10 177.31 2oa9 s ASN 97 N -0.63 7.09 0.07 -1.22 -0.87 -1.26 -1.01 114.94 117.12 2oa9 s ASN 97 Ca 0.12 2.40 0.01 0.00 -1.57 0.00 0.00 52.86 53.83 2oa9 s ASN 97 Cb -0.12 -2.63 -0.04 0.00 -0.02 0.00 0.00 41.25 38.44 2oa9 s ASN 97 CO 0.02 -0.29 -0.06 0.27 -2.57 0.00 0.00 177.10 174.47 2oa9 s ILE 98 N -1.05 0.57 -0.18 0.60 -4.36 0.10 -4.48 121.20 112.40 2oa9 s ILE 98 Ca 0.47 -1.64 -0.05 0.00 -0.26 0.00 0.00 60.65 59.17 2oa9 s ILE 98 Cb -0.35 -1.31 0.06 0.00 1.25 0.00 0.00 42.46 42.12 2oa9 s ILE 98 CO 0.44 -0.74 0.08 -0.22 0.24 0.00 0.00 174.94 174.75 2oa9 s LEU 99 N -2.56 0.47 -0.24 0.37 2.96 -0.28 -0.81 118.68 118.59 2oa9 s LEU 99 Ca 0.04 -0.66 0.02 0.00 -0.22 0.00 0.00 54.13 53.30 2oa9 s LEU 99 Cb 0.01 -0.29 0.06 0.00 0.50 0.00 0.00 46.19 46.46 2oa9 s LEU 99 CO -0.04 -0.35 -0.07 -2.28 -1.32 0.00 0.00 176.35 172.29 2oa9 s HIS 100 N 2.10 2.70 -0.23 5.38 5.65 -1.26 -0.64 115.29 129.00 2oa9 s HIS 100 Ca 0.02 -1.95 -0.14 0.00 0.25 0.00 0.00 55.06 53.23 2oa9 s HIS 100 Cb -0.16 -1.70 0.07 0.00 -1.18 0.00 0.00 32.58 29.60 2oa9 s HIS 100 CO -0.10 -0.81 0.57 -1.14 -0.65 0.00 0.00 174.74 172.61 2oa9 s GLN 101 N 1.29 0.59 -0.13 2.88 2.00 0.13 -5.00 119.66 121.43 2oa9 s GLN 101 Ca -0.07 1.00 -0.25 0.00 -2.00 0.00 0.00 55.36 54.04 2oa9 s GLN 101 Cb -0.19 0.11 -0.02 0.00 0.80 0.00 0.00 33.01 33.71 2oa9 s GLN 101 CO -0.06 -0.14 0.78 0.99 -0.50 0.00 0.00 175.29 176.36 2oa9 s THR 102 N 1.33 4.95 0.00 -0.34 2.01 -1.26 -1.06 115.64 121.27 2oa9 s THR 102 Ca -0.08 1.56 0.08 0.00 0.31 0.00 0.00 61.69 63.56 2oa9 s THR 102 Cb -0.06 -4.10 -0.02 0.00 0.01 0.00 0.00 72.50 68.33 2oa9 s THR 102 CO -0.14 0.11 -0.25 -0.69 -0.69 0.00 0.00 174.62 172.96 2oa9 s VAL 103 N 1.62 1.99 0.45 3.82 1.01 0.33 -4.92 120.40 124.71 2oa9 s VAL 103 Ca 0.38 -1.16 0.02 0.00 0.00 0.00 0.00 61.98 61.21 2oa9 s VAL 103 Cb -0.17 -1.67 -0.01 0.00 0.00 0.00 0.00 36.38 34.53 2oa9 s VAL 103 CO 0.15 0.48 0.05 -1.54 0.00 0.00 0.00 175.10 174.25 2oa9 n SER 104 N 2.24 2.51 -0.86 3.32 3.41 -1.26 -0.97 113.62 122.01 2oa9 n SER 104 Ca -0.16 -3.10 0.10 0.00 -0.26 0.00 0.00 58.87 55.45 2oa9 n SER 104 Cb 0.52 0.59 0.12 0.00 -0.26 0.00 0.00 64.21 65.18 2oa9 n SER 104 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2oa9 n GLY 105 N -0.73 0.93 0.05 5.00 0.00 -0.95 -1.03 105.19 108.46 2oa9 n GLY 105 Ca -0.14 -0.59 -0.03 0.00 0.00 0.00 0.00 46.02 45.26 2oa9 n GLY 105 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2oa9 n ASN 106 N 1.15 1.42 -4.00 1.61 6.94 -1.25 -4.59 115.26 116.54 2oa9 n ASN 106 Ca 0.13 0.00 -0.09 0.00 -0.02 0.00 0.00 54.58 54.61 2oa9 n ASN 106 Cb 0.51 1.11 -0.10 0.00 -2.36 0.00 0.00 39.78 38.93 2oa9 n ASN 106 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2oa9 s ARG 107 N -2.56 0.48 0.61 -3.83 0.52 -1.26 -5.05 118.95 107.85 2oa9 s ARG 107 Ca -0.07 -0.83 -0.16 0.00 -0.52 0.00 0.00 55.73 54.15 2oa9 s ARG 107 Cb 0.06 0.17 -0.03 0.00 0.52 0.00 0.00 34.95 35.67 2oa9 s ARG 107 CO 0.61 -0.09 1.08 0.15 0.02 0.00 0.00 175.30 177.06 2oa9 s LYS 108 N -2.52 3.19 0.83 3.54 1.02 -1.26 -4.46 119.74 120.08 2oa9 s LYS 108 Ca -0.06 1.28 -0.11 0.00 0.02 0.00 0.00 55.97 57.10 2oa9 s LYS 108 Cb -0.02 -2.01 0.09 0.00 -0.52 0.00 0.00 37.83 35.37 2oa9 s LYS 108 CO -0.05 -0.93 1.09 0.95 -0.92 0.00 0.00 175.35 175.50 2oa9 s THR 109 N -2.37 3.01 -0.34 2.17 -4.23 -0.29 -4.93 115.64 108.66 2oa9 s THR 109 Ca 0.65 0.33 0.15 0.00 -1.18 0.00 0.00 61.69 61.64 2oa9 s THR 109 Cb -0.18 -2.94 0.43 0.00 1.34 0.00 0.00 72.50 71.16 2oa9 s THR 109 CO 0.37 -0.43 1.02 -3.20 -0.54 0.00 0.00 174.62 171.84 2oa9 n ASN 110 N -3.60 0.63 -4.74 3.99 5.15 -1.26 -4.50 115.26 110.94 2oa9 n ASN 110 Ca 0.07 -2.71 -0.41 0.00 -0.60 0.00 0.00 54.58 50.94 2oa9 n ASN 110 Cb 0.55 -0.17 -0.05 0.00 -0.53 0.00 0.00 39.78 39.59 2oa9 n ASN 110 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2oa9 s SER 111 N -2.64 7.45 0.00 1.20 0.15 -1.26 -4.94 113.70 113.65 2oa9 s SER 111 Ca 0.27 1.73 0.28 0.00 0.70 0.00 0.00 55.95 58.93 2oa9 s SER 111 Cb 0.44 -2.56 1.60 0.00 -1.71 0.00 0.00 66.02 63.79 2oa9 s SER 111 CO 0.00 -0.01 2.02 0.59 1.20 0.00 0.00 173.24 177.04 2oa9 n ASN 112 N 2.61 0.00 0.01 5.45 3.02 -1.26 -3.65 115.26 121.44 2oa9 n ASN 112 Ca 0.00 -0.61 0.11 0.00 -0.03 0.00 0.00 54.58 54.06 2oa9 n ASN 112 Cb 0.49 -0.10 0.08 0.00 -0.61 0.00 0.00 39.78 39.64 2oa9 n ASN 112 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2oa9 n SER 113 N -1.10 0.66 -4.37 6.41 3.41 -1.26 -4.90 113.62 112.47 2oa9 n SER 113 Ca 0.19 -0.39 -0.21 0.00 -0.26 0.00 0.00 58.87 58.20 2oa9 n SER 113 Cb 0.14 0.62 -0.10 0.00 -0.26 0.00 0.00 64.21 64.61 2oa9 n SER 113 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2oa9 s TYR 114 N -3.08 1.87 -2.12 7.33 2.02 -1.24 -4.88 117.35 117.25 2oa9 s TYR 114 Ca 0.07 -0.49 0.17 0.00 -0.37 0.00 0.00 57.07 56.46 2oa9 s TYR 114 Cb 0.16 -0.88 0.50 0.00 -0.40 0.00 0.00 41.96 41.34 2oa9 s TYR 114 CO 0.78 0.42 1.40 0.09 -1.57 0.00 0.00 175.55 176.67 2oa9 n ASN 115 N -0.18 2.37 -4.11 2.29 3.02 -1.26 -4.88 115.26 112.51 2oa9 n ASN 115 Ca -0.09 -1.93 -0.15 0.00 -0.03 0.00 0.00 54.58 52.38 2oa9 n ASN 115 Cb 0.59 -0.25 -0.11 0.00 -0.61 0.00 0.00 39.78 39.40 2oa9 n ASN 115 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2oa9 s TYR 116 N -1.50 0.88 0.26 3.10 2.02 -1.26 -3.98 117.35 116.87 2oa9 s TYR 116 Ca 0.32 -0.51 0.10 0.00 -0.37 0.00 0.00 57.07 56.62 2oa9 s TYR 116 Cb 0.17 -0.51 -0.04 0.00 -0.40 0.00 0.00 41.96 41.18 2oa9 s TYR 116 CO 0.24 -0.03 -0.07 -0.51 -1.57 0.00 0.00 175.55 173.61 2oa9 s ASP 117 N -1.73 4.25 0.03 2.29 1.01 0.27 -4.82 116.67 117.98 2oa9 s ASP 117 Ca -0.06 -0.75 0.02 0.00 0.71 0.00 0.00 52.55 52.47 2oa9 s ASP 117 Cb -0.09 -0.68 -0.02 0.00 1.01 0.00 0.00 42.92 43.14 2oa9 s ASP 117 CO 0.01 0.02 -0.06 -0.36 0.21 0.00 0.00 175.17 174.99 2oa9 s PHE 118 N -2.33 0.54 -0.01 4.23 0.08 -1.26 -0.75 117.98 118.48 2oa9 s PHE 118 Ca 0.30 -0.44 -0.13 0.00 0.12 0.00 0.00 56.93 56.79 2oa9 s PHE 118 Cb -0.06 -0.33 0.02 0.00 -0.57 0.00 0.00 43.02 42.07 2oa9 s PHE 118 CO 0.18 -0.09 0.27 0.21 -0.10 0.00 0.00 175.22 175.68 2oa9 s LYS 119 N -1.32 0.62 -0.08 0.44 2.20 -0.56 -1.14 119.74 119.90 2oa9 s LYS 119 Ca -0.09 -0.24 -0.14 0.00 -0.36 0.00 0.00 55.97 55.14 2oa9 s LYS 119 Cb -0.09 0.27 -0.05 0.00 -1.51 0.00 0.00 37.83 36.46 2oa9 s LYS 119 CO 0.00 -0.17 0.34 0.42 -0.36 0.00 0.00 175.35 175.59 2oa9 s ILE 120 N -1.33 5.21 -0.04 5.43 -1.09 -0.20 -0.46 121.20 128.72 2oa9 s ILE 120 Ca -0.14 0.67 0.05 0.00 -2.23 0.00 0.00 60.65 59.00 2oa9 s ILE 120 Cb -0.06 -3.66 -0.01 0.00 -1.58 0.00 0.00 42.46 37.16 2oa9 s ILE 120 CO 0.04 0.49 -0.17 -0.62 -1.23 0.00 0.00 174.94 173.44 2oa9 s ASP 121 N -0.34 2.17 -0.31 3.58 2.15 -0.18 -4.31 116.67 119.43 2oa9 s ASP 121 Ca 0.20 -0.35 -0.20 0.00 0.43 0.00 0.00 52.55 52.63 2oa9 s ASP 121 Cb -0.15 -0.53 -0.01 0.00 -0.30 0.00 0.00 42.92 41.94 2oa9 s ASP 121 CO 0.08 0.17 0.63 -0.63 -0.17 0.00 0.00 175.17 175.25 2oa9 s ILE 122 N -0.06 4.94 -1.13 4.11 -1.09 -1.26 -0.73 121.20 125.98 2oa9 s ILE 122 Ca -0.02 0.83 -0.14 0.00 -2.23 0.00 0.00 60.65 59.09 2oa9 s ILE 122 Cb -0.11 -4.00 0.19 0.00 -1.58 0.00 0.00 42.46 36.96 2oa9 s ILE 122 CO 0.02 -0.15 1.30 -0.62 -1.23 0.00 0.00 174.94 174.25 2oa9 s ASP 123 N 1.65 7.04 0.30 3.58 -1.08 -0.09 -4.88 116.67 123.19 2oa9 s ASP 123 Ca 0.25 -2.94 -0.01 0.00 -0.52 0.00 0.00 52.55 49.32 2oa9 s ASP 123 Cb -0.15 -2.36 0.44 0.00 -1.46 0.00 0.00 42.92 39.40 2oa9 s ASP 123 CO 0.12 -0.71 1.92 -0.50 0.52 0.00 0.00 175.17 176.52 2oa9 h TRP 124 N 7.35 0.95 -0.39 -5.34 4.06 -1.94 -0.47 115.95 120.17 2oa9 h TRP 124 Ca 0.26 -0.02 -0.13 0.00 2.06 0.00 0.00 58.89 61.06 2oa9 h TRP 124 Cb 0.90 -0.30 -0.01 0.00 -1.00 0.00 0.00 29.16 28.75 2oa9 h TRP 124 CO 1.05 0.67 -0.27 1.49 -3.56 0.00 0.00 178.44 177.81 2oa9 h GLU 125 N 0.97 0.82 -0.01 0.49 4.57 -1.94 -2.54 114.58 116.94 2oa9 h GLU 125 Ca 0.25 -0.36 0.00 0.00 -1.18 0.00 0.00 59.36 58.07 2oa9 h GLU 125 Cb 0.04 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 2oa9 h GLU 125 CO -0.04 0.99 -0.15 0.43 -1.18 0.00 0.00 179.01 179.07 2oa9 n SER 126 N -4.09 0.94 -3.73 1.04 7.64 -1.04 -4.95 113.62 109.42 2oa9 n SER 126 Ca -0.00 -0.95 -0.23 0.00 1.01 0.00 0.00 58.87 58.70 2oa9 n SER 126 Cb 0.47 0.04 0.03 0.00 -1.01 0.00 0.00 64.21 63.74 2oa9 n SER 126 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2oa9 n GLN 127 N -0.55 -5.05 -4.15 1.43 1.13 -0.22 -4.92 117.38 105.04 2oa9 n GLN 127 Ca 0.15 0.62 -0.13 0.00 -1.94 0.00 0.00 57.00 55.70 2oa9 n GLN 127 Cb 0.32 -5.23 -0.11 0.00 0.11 0.00 0.00 30.24 25.33 2oa9 n GLN 127 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 2oa9 s VAL 128 N -3.61 0.78 -0.29 5.09 -7.23 -0.97 -1.23 120.40 112.94 2oa9 s VAL 128 Ca 0.11 -1.64 -0.08 0.00 -1.81 0.00 0.00 61.98 58.56 2oa9 s VAL 128 Cb -0.05 -1.33 -0.00 0.00 0.56 0.00 0.00 36.38 35.55 2oa9 s VAL 128 CO 0.81 -0.63 0.10 -0.69 -0.31 0.00 0.00 175.10 174.37 2oa9 s VAL 129 N -2.65 4.19 -0.09 1.32 1.01 0.01 -0.91 120.40 123.28 2oa9 s VAL 129 Ca 0.05 -0.52 -0.05 0.00 0.00 0.00 0.00 61.98 61.46 2oa9 s VAL 129 Cb -0.01 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 2oa9 s VAL 129 CO -0.02 0.13 0.11 -0.13 0.00 0.00 0.00 175.10 175.19 2oa9 s ARG 130 N 1.55 3.29 -0.36 2.72 0.52 0.09 -0.90 118.95 125.86 2oa9 s ARG 130 Ca 0.04 -0.26 -0.21 0.00 -0.52 0.00 0.00 55.73 54.78 2oa9 s ARG 130 Cb -0.17 -3.05 0.01 0.00 0.52 0.00 0.00 34.95 32.26 2oa9 s ARG 130 CO 0.04 0.73 0.68 -1.17 0.02 0.00 0.00 175.30 175.60 2oa9 s LEU 131 N -1.19 4.22 -0.02 2.53 2.96 -0.07 -1.01 118.68 126.12 2oa9 s LEU 131 Ca 0.17 0.20 -0.19 0.00 -0.22 0.00 0.00 54.13 54.09 2oa9 s LEU 131 Cb -0.12 -2.86 -0.05 0.00 0.50 0.00 0.00 46.19 43.66 2oa9 s LEU 131 CO 0.06 -0.64 0.53 -1.61 -1.32 0.00 0.00 176.35 173.38 2oa9 s GLU 132 N 2.83 4.23 -0.09 1.98 2.02 0.39 -4.25 118.70 125.81 2oa9 s GLU 132 Ca 0.26 0.62 0.04 0.00 0.02 0.00 0.00 54.97 55.91 2oa9 s GLU 132 Cb -0.14 -3.32 -0.00 0.00 0.10 0.00 0.00 34.13 30.76 2oa9 s GLU 132 CO 0.16 0.42 -0.23 0.08 0.02 0.00 0.00 175.26 175.71 2oa9 s VAL 133 N -0.32 1.98 0.00 2.63 1.01 -0.03 -1.49 120.40 124.18 2oa9 s VAL 133 Ca 0.28 -0.98 0.07 0.00 0.00 0.00 0.00 61.98 61.35 2oa9 s VAL 133 Cb -0.17 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 2oa9 s VAL 133 CO 0.15 0.54 -0.23 -0.36 0.00 0.00 0.00 175.10 175.21 2oa9 s PHE 134 N 0.25 2.03 0.85 5.22 0.08 0.07 -0.64 117.98 125.84 2oa9 s PHE 134 Ca -0.15 -0.39 -0.11 0.00 0.12 0.00 0.00 56.93 56.40 2oa9 s PHE 134 Cb -0.17 -1.28 0.14 0.00 -0.57 0.00 0.00 43.02 41.15 2oa9 s PHE 134 CO 0.07 0.01 1.19 0.16 -0.10 0.00 0.00 175.22 176.55 2oa9 s ASP 135 N -0.76 3.84 0.00 1.36 1.47 -0.39 -0.56 116.67 121.63 2oa9 s ASP 135 Ca 0.09 0.25 0.21 0.00 1.18 0.00 0.00 52.55 54.28 2oa9 s ASP 135 Cb -0.09 -0.53 0.92 0.00 -0.34 0.00 0.00 42.92 42.88 2oa9 s ASP 135 CO 0.00 -2.25 1.67 0.29 0.68 0.00 0.00 175.17 175.56 2oa9 n LYS 136 N -3.38 0.04 -0.48 2.11 4.76 -1.26 -1.35 118.16 118.60 2oa9 n LYS 136 Ca 0.13 0.13 0.05 0.00 -2.87 0.00 0.00 58.31 55.75 2oa9 n LYS 136 Cb 0.60 -1.50 0.24 0.00 -1.84 0.00 0.00 35.03 32.53 2oa9 n LYS 136 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2oa9 n GLN 137 N -1.48 3.08 -1.49 1.97 3.00 -1.26 -4.93 117.38 116.27 2oa9 n GLN 137 Ca 0.06 -1.87 -0.16 0.00 -0.01 0.00 0.00 57.00 55.01 2oa9 n GLN 137 Cb 0.24 -1.82 -0.07 0.00 0.00 0.00 0.00 30.24 28.59 2oa9 n GLN 137 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2oa9 n ASP 138 N 0.50 -4.91 -4.68 1.08 8.00 -0.46 -4.99 116.55 111.10 2oa9 n ASP 138 Ca 0.17 0.38 -0.41 0.00 0.71 0.00 0.00 54.79 55.64 2oa9 n ASP 138 Cb 0.72 -3.81 -0.04 0.00 -0.02 0.00 0.00 41.12 37.97 2oa9 n ASP 138 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2oa9 s ILE 139 N -2.60 4.90 -0.64 0.53 -1.09 -1.26 -4.88 121.20 116.16 2oa9 s ILE 139 Ca 0.00 1.62 -0.28 0.00 -2.23 0.00 0.00 60.65 59.76 2oa9 s ILE 139 Cb 0.00 -4.13 0.03 0.00 -1.58 0.00 0.00 42.46 36.78 2oa9 s ILE 139 CO 0.00 0.06 1.23 -0.32 -1.23 0.00 0.00 174.94 174.69 2oa9 s MET 140 N 1.92 3.38 0.06 2.79 1.75 -1.26 -1.26 119.30 126.69 2oa9 s MET 140 Ca 0.39 0.06 0.23 0.00 -1.25 0.00 0.00 55.69 55.11 2oa9 s MET 140 Cb -0.17 -4.08 0.07 0.00 2.84 0.00 0.00 34.83 33.49 2oa9 s MET 140 CO 0.14 -1.88 1.05 0.44 -0.65 0.00 0.00 175.02 174.11 2oa9 n ILE 141 N 6.56 0.21 -3.64 10.11 -5.35 0.18 -4.91 119.36 122.53 2oa9 n ILE 141 Ca 0.06 -0.27 -0.04 0.00 -0.27 0.00 0.00 62.75 62.23 2oa9 n ILE 141 Cb 0.49 0.13 -0.07 0.00 -1.74 0.00 0.00 39.64 38.45 2oa9 n ILE 141 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2oa9 s ASP 142 N -4.06 -0.72 -0.05 7.28 2.15 -1.19 -5.01 116.67 115.06 2oa9 s ASP 142 Ca 0.03 1.15 0.20 0.00 0.43 0.00 0.00 52.55 54.37 2oa9 s ASP 142 Cb 0.14 1.33 0.39 0.00 -0.30 0.00 0.00 42.92 44.48 2oa9 s ASP 142 CO 0.79 -0.18 1.17 -0.46 -0.17 0.00 0.00 175.17 176.32 2oa9 n ASN 143 N 4.06 1.10 0.16 -0.34 6.94 -1.26 -0.85 115.26 125.08 2oa9 n ASN 143 Ca -0.19 -2.43 0.04 0.00 -0.02 0.00 0.00 54.58 51.98 2oa9 n ASN 143 Cb 0.58 -0.34 0.17 0.00 -2.36 0.00 0.00 39.78 37.83 2oa9 n ASN 143 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 2oa9 h SER 144 N 0.89 0.00 -3.38 0.53 4.64 -1.96 -3.43 113.55 110.84 2oa9 h SER 144 Ca -0.16 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.62 2oa9 h SER 144 Cb 1.64 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.70 2oa9 h SER 144 CO 0.07 0.43 0.31 -0.69 -0.87 0.00 0.00 176.83 176.09 2oa9 s VAL 145 N -3.24 4.91 0.15 0.95 1.01 -1.26 -4.34 120.40 118.57 2oa9 s VAL 145 Ca 0.02 1.88 -0.15 0.00 0.00 0.00 0.00 61.98 63.74 2oa9 s VAL 145 Cb 0.09 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 32.25 2oa9 s VAL 145 CO 0.71 0.17 0.40 -0.72 0.00 0.00 0.00 175.10 175.66 2oa9 s TYR 146 N 1.09 -0.06 -0.16 5.22 -0.85 -0.64 -0.89 117.35 121.06 2oa9 s TYR 146 Ca 0.47 -0.28 -0.01 0.00 -0.52 0.00 0.00 57.07 56.73 2oa9 s TYR 146 Cb -0.20 0.22 -0.01 0.00 0.38 0.00 0.00 41.96 42.36 2oa9 s TYR 146 CO 0.24 -0.75 -0.12 -1.58 -1.52 0.00 0.00 175.55 171.82 2oa9 s TRP 147 N -3.85 2.84 0.57 -3.49 0.51 -0.08 -0.52 118.94 114.92 2oa9 s TRP 147 Ca 0.07 -0.85 -0.18 0.00 -2.12 0.00 0.00 56.10 53.01 2oa9 s TRP 147 Cb 0.02 -1.92 -0.04 0.00 -0.81 0.00 0.00 33.47 30.71 2oa9 s TRP 147 CO -0.08 -0.38 1.12 -1.54 -0.51 0.00 0.00 176.95 175.57 2oa9 s SER 148 N 0.77 5.58 0.30 2.95 1.04 -1.26 -0.81 113.70 122.27 2oa9 s SER 148 Ca -0.05 2.13 -0.00 0.00 0.48 0.00 0.00 55.95 58.51 2oa9 s SER 148 Cb -0.15 -2.57 0.51 0.00 0.10 0.00 0.00 66.02 63.91 2oa9 s SER 148 CO 0.01 -1.31 1.94 -0.26 0.98 0.00 0.00 173.24 174.60 2oa9 h PHE 149 N 0.92 1.02 -0.51 5.02 0.05 -1.52 -2.45 116.94 119.47 2oa9 h PHE 149 Ca -0.49 0.03 -0.06 0.00 3.82 0.00 0.00 57.97 61.26 2oa9 h PHE 149 Cb 1.26 -0.34 -0.02 0.00 2.00 0.00 0.00 35.95 38.84 2oa9 h PHE 149 CO 0.52 0.58 0.07 -0.44 -0.18 0.00 0.00 178.31 178.86 2oa9 h ASP 150 N 1.05 0.76 -0.65 2.17 3.45 -1.92 0.60 116.42 121.88 2oa9 h ASP 150 Ca 0.35 -0.16 -0.07 0.00 0.43 0.00 0.00 57.03 57.59 2oa9 h ASP 150 Cb 0.07 -0.20 -0.03 0.00 -0.56 0.00 0.00 39.33 38.61 2oa9 h ASP 150 CO -0.11 0.79 0.15 0.77 -1.57 0.00 0.00 179.24 179.26 2oa9 h SER 151 N 0.76 1.00 -0.30 6.45 4.64 -1.83 -0.94 113.55 123.34 2oa9 h SER 151 Ca 0.16 -0.24 -0.17 0.00 -0.47 0.00 0.00 61.79 61.07 2oa9 h SER 151 Cb 0.37 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2oa9 h SER 151 CO 0.01 0.98 -0.48 -0.07 -0.87 0.00 0.00 176.83 176.40 2oa9 h LEU 152 N 0.97 0.95 -0.75 5.97 3.38 -1.01 -1.95 115.31 122.87 2oa9 h LEU 152 Ca 0.20 -0.48 0.04 0.00 0.09 0.00 0.00 57.88 57.73 2oa9 h LEU 152 Cb 0.38 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 2oa9 h LEU 152 CO 0.00 1.27 0.47 -0.61 0.09 0.00 0.00 178.44 179.66 2oa9 h GLN 153 N 0.69 0.87 -0.73 1.13 4.15 -0.72 -1.43 115.11 119.08 2oa9 h GLN 153 Ca 0.03 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.34 2oa9 h GLN 153 Cb 1.07 -0.20 -0.03 0.00 0.21 0.00 0.00 27.48 28.54 2oa9 h GLN 153 CO 0.11 0.57 0.23 -0.97 -1.93 0.00 0.00 178.83 176.84 2oa9 h ASN 154 N 0.90 1.06 -0.59 -0.69 -0.73 -0.97 -0.02 115.58 114.52 2oa9 h ASN 154 Ca 0.31 -0.21 -0.02 0.00 1.87 0.00 0.00 56.30 58.25 2oa9 h ASN 154 Cb 0.06 -0.28 -0.03 0.00 0.27 0.00 0.00 38.32 38.35 2oa9 h ASN 154 CO -0.13 0.98 0.28 1.56 -0.37 0.00 0.00 177.43 179.75 2oa9 h GLN 155 N 1.07 0.86 -0.18 6.67 1.08 -0.99 -1.00 115.11 122.63 2oa9 h GLN 155 Ca 0.23 -0.13 -0.01 0.00 -1.45 0.00 0.00 58.65 57.29 2oa9 h GLN 155 Cb 0.30 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 2oa9 h GLN 155 CO -0.01 0.70 0.06 -0.07 -0.95 0.00 0.00 178.83 178.57 2oa9 h LEU 156 N 0.81 0.25 -0.98 1.46 3.38 -0.92 0.19 115.31 119.50 2oa9 h LEU 156 Ca 0.20 -0.18 0.09 0.00 0.09 0.00 0.00 57.88 58.08 2oa9 h LEU 156 Cb 0.13 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 40.74 2oa9 h LEU 156 CO -0.02 0.37 0.62 0.44 0.09 0.00 0.00 178.44 179.93 2oa9 h ASP 157 N 0.13 0.95 0.69 -0.43 3.32 -0.86 -2.00 116.42 118.22 2oa9 h ASP 157 Ca 0.06 0.03 -0.26 0.00 0.02 0.00 0.00 57.03 56.88 2oa9 h ASP 157 Cb 0.20 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 2oa9 h ASP 157 CO -0.00 0.56 -1.39 0.11 -1.72 0.00 0.00 179.24 176.80 2oa9 h LYS 158 N 1.05 0.04 0.00 3.56 1.57 -0.88 -3.42 116.57 118.50 2oa9 h LYS 158 Ca 0.46 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 59.16 2oa9 h LYS 158 Cb 0.33 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.67 2oa9 h LYS 158 CO -0.22 0.81 -1.22 1.63 -0.57 0.00 0.00 179.45 179.88 2oa9 n LYS 159 N -3.24 0.17 -2.02 3.15 4.76 0.63 -5.01 118.16 116.61 2oa9 n LYS 159 Ca -0.10 -0.04 -0.40 0.00 -2.87 0.00 0.00 58.31 54.90 2oa9 n LYS 159 Cb 1.00 -1.11 -0.00 0.00 -1.84 0.00 0.00 35.03 33.08 2oa9 n LYS 159 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2oa9 s LEU 160 N -3.34 4.21 0.18 -0.35 1.43 -0.76 -4.99 118.68 115.06 2oa9 s LEU 160 Ca -0.02 2.70 0.08 0.00 -1.03 0.00 0.00 54.13 55.86 2oa9 s LEU 160 Cb 0.03 -3.89 -0.04 0.00 0.03 0.00 0.00 46.19 42.31 2oa9 s LEU 160 CO 0.20 -0.88 -0.16 -0.54 0.23 0.00 0.00 176.35 175.20 2oa9 s LYS 161 N -2.25 1.27 0.47 1.70 1.02 -1.26 -5.02 119.74 115.66 2oa9 s LYS 161 Ca 0.57 -1.48 -0.24 0.00 0.02 0.00 0.00 55.97 54.83 2oa9 s LYS 161 Cb -0.39 -1.16 -0.07 0.00 -0.52 0.00 0.00 37.83 35.69 2oa9 s LYS 161 CO 0.50 0.21 1.36 0.71 -0.92 0.00 0.00 175.35 177.22 2oa9 s TYR 162 N -2.56 2.52 0.01 3.18 1.51 -1.26 -4.90 117.35 115.85 2oa9 s TYR 162 Ca 0.18 1.34 0.03 0.00 -1.01 0.00 0.00 57.07 57.61 2oa9 s TYR 162 Cb -0.03 -3.79 -0.01 0.00 -0.11 0.00 0.00 41.96 38.01 2oa9 s TYR 162 CO 0.06 -2.64 -0.08 0.42 -1.11 0.00 0.00 175.55 172.20 2oa9 s ILE 163 N -1.27 0.62 -0.13 2.71 1.01 -1.18 -3.03 121.20 119.94 2oa9 s ILE 163 Ca 0.63 -0.59 0.03 0.00 0.00 0.00 0.00 60.65 60.72 2oa9 s ILE 163 Cb -0.40 -0.57 0.01 0.00 0.01 0.00 0.00 42.46 41.50 2oa9 s ILE 163 CO 0.51 -0.00 -0.21 0.00 0.00 0.00 0.00 174.94 175.23 2oa9 s ALA 164 N -0.56 2.16 -0.23 9.38 0.00 -0.15 -0.67 121.76 131.68 2oa9 s ALA 164 Ca -0.01 -1.03 -0.07 0.00 0.00 0.00 0.00 51.96 50.86 2oa9 s ALA 164 Cb -0.05 -0.95 -0.03 0.00 0.00 0.00 0.00 23.12 22.10 2oa9 s ALA 164 CO 0.00 0.01 0.05 0.08 0.00 0.00 0.00 175.76 175.89 2oa9 s VAL 165 N 0.77 4.18 0.30 0.00 1.01 -0.13 -1.97 120.40 124.57 2oa9 s VAL 165 Ca -0.09 -0.22 0.06 0.00 0.00 0.00 0.00 61.98 61.74 2oa9 s VAL 165 Cb -0.16 -2.94 -0.06 0.00 0.00 0.00 0.00 36.38 33.23 2oa9 s VAL 165 CO -0.00 0.37 -0.03 0.27 0.00 0.00 0.00 175.10 175.70 2oa9 s ILE 166 N 1.41 1.61 0.06 2.22 -4.36 -0.06 -0.50 121.20 121.58 2oa9 s ILE 166 Ca 0.05 -2.09 -0.04 0.00 -0.26 0.00 0.00 60.65 58.31 2oa9 s ILE 166 Cb -0.15 -2.57 -0.02 0.00 1.25 0.00 0.00 42.46 40.97 2oa9 s ILE 166 CO 0.02 -0.22 0.06 -0.94 0.24 0.00 0.00 174.94 174.10 2oa9 s SER 167 N -3.48 0.34 0.08 4.36 1.04 -1.16 -2.25 113.70 112.63 2oa9 s SER 167 Ca 0.31 -0.84 -0.14 0.00 0.48 0.00 0.00 55.95 55.76 2oa9 s SER 167 Cb 0.05 0.25 0.02 0.00 0.10 0.00 0.00 66.02 66.44 2oa9 s SER 167 CO 0.13 -0.64 0.33 0.00 0.98 0.00 0.00 173.24 174.04 2oa9 s ALA 168 N -3.80 -0.71 0.28 5.32 0.00 -1.26 -1.01 121.76 120.58 2oa9 s ALA 168 Ca 0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 51.96 51.89 2oa9 s ALA 168 Cb 0.06 0.50 -0.04 0.00 0.00 0.00 0.00 23.12 23.64 2oa9 s ALA 168 CO -0.10 -0.52 0.49 -1.21 0.00 0.00 0.00 175.76 174.41 2oa9 s GLU 169 N -3.30 3.52 0.12 0.00 2.02 -0.11 -4.94 118.70 116.02 2oa9 s GLU 169 Ca 0.00 -0.29 0.04 0.00 0.02 0.00 0.00 54.97 54.73 2oa9 s GLU 169 Cb 0.01 -2.73 -0.04 0.00 0.10 0.00 0.00 34.13 31.47 2oa9 s GLU 169 CO -0.08 0.26 -0.09 -1.54 0.02 0.00 0.00 175.26 173.83 2oa9 s SER 170 N -3.56 1.52 0.16 -0.19 1.04 -1.26 -1.34 113.70 110.07 2oa9 s SER 170 Ca 0.40 -0.94 -0.15 0.00 0.48 0.00 0.00 55.95 55.73 2oa9 s SER 170 Cb -0.10 0.02 0.02 0.00 0.10 0.00 0.00 66.02 66.06 2oa9 s SER 170 CO 0.32 -0.34 0.43 -1.59 0.98 0.00 0.00 173.24 173.04 2oa9 s LYS 171 N -3.44 1.22 -0.12 4.02 -2.85 -0.54 -5.01 119.74 113.02 2oa9 s LYS 171 Ca 0.12 -0.86 -0.01 0.00 -1.00 0.00 0.00 55.97 54.22 2oa9 s LYS 171 Cb 0.01 0.48 -0.02 0.00 -2.06 0.00 0.00 37.83 36.24 2oa9 s LYS 171 CO -0.01 -0.49 -0.09 0.42 0.10 0.00 0.00 175.35 175.28 2oa9 s ILE 172 N -3.86 3.48 -0.07 3.79 -1.09 -1.26 -1.44 121.20 120.74 2oa9 s ILE 172 Ca 0.08 -0.52 -0.03 0.00 -2.23 0.00 0.00 60.65 57.95 2oa9 s ILE 172 Cb 0.01 -2.47 0.04 0.00 -1.58 0.00 0.00 42.46 38.46 2oa9 s ILE 172 CO -0.06 0.53 0.14 -1.61 -1.23 0.00 0.00 174.94 172.71 2oa9 s GLU 173 N 0.10 0.03 -1.31 2.79 2.02 -0.46 -4.91 118.70 116.96 2oa9 s GLU 173 Ca -0.03 0.49 -0.03 0.00 0.02 0.00 0.00 54.97 55.42 2oa9 s GLU 173 Cb -0.14 -0.27 0.01 0.00 0.10 0.00 0.00 34.13 33.83 2oa9 s GLU 173 CO 0.04 -0.27 0.88 0.09 0.02 0.00 0.00 175.26 176.01 2oa9 n ASN 174 N 5.04 -2.44 0.00 -0.19 5.03 -1.26 -1.85 115.26 119.58 2oa9 n ASN 174 Ca -0.10 -0.72 0.00 0.00 0.87 0.00 0.00 54.58 54.63 2oa9 n ASN 174 Cb 0.50 -4.48 0.00 0.00 -1.02 0.00 0.00 39.78 34.79 2oa9 n ASN 174 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 2oa9 n GLU 175 N -4.36 -0.77 -4.58 3.52 2.13 -1.26 -4.98 120.64 110.34 2oa9 n GLU 175 Ca -0.22 0.19 -0.32 0.00 0.66 0.00 0.00 57.16 57.47 2oa9 n GLU 175 Cb 0.64 -4.23 -0.11 0.00 0.27 0.00 0.00 31.44 28.01 2oa9 n GLU 175 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2oa9 s LYS 176 N -1.12 2.40 -0.05 5.31 1.02 -0.77 -5.12 119.74 121.42 2oa9 s LYS 176 Ca 0.00 -0.80 -0.06 0.00 0.02 0.00 0.00 55.97 55.13 2oa9 s LYS 176 Cb 0.00 -2.39 -0.04 0.00 -0.52 0.00 0.00 37.83 34.88 2oa9 s LYS 176 CO 0.00 0.59 0.20 0.21 -0.92 0.00 0.00 175.35 175.43 2oa9 s LYS 177 N -1.32 3.50 0.01 1.68 2.20 -1.26 -1.35 119.74 123.20 2oa9 s LYS 177 Ca 0.15 -0.14 0.01 0.00 -0.36 0.00 0.00 55.97 55.63 2oa9 s LYS 177 Cb -0.11 -3.13 -0.01 0.00 -1.51 0.00 0.00 37.83 33.07 2oa9 s LYS 177 CO 0.06 0.71 -0.04 0.71 -0.36 0.00 0.00 175.35 176.42 2oa9 s TYR 178 N -1.19 0.38 0.06 4.03 1.51 -0.52 -1.59 117.35 120.02 2oa9 s TYR 178 Ca 0.23 -0.23 0.09 0.00 -1.01 0.00 0.00 57.07 56.14 2oa9 s TYR 178 Cb -0.13 -0.24 -0.03 0.00 -0.11 0.00 0.00 41.96 41.45 2oa9 s TYR 178 CO 0.12 -0.05 -0.24 0.71 -1.11 0.00 0.00 175.55 174.98 2oa9 s TYR 179 N -0.60 2.39 -0.13 2.71 4.12 -0.60 -1.46 117.35 123.78 2oa9 s TYR 179 Ca -0.04 -0.36 -0.01 0.00 0.02 0.00 0.00 57.07 56.68 2oa9 s TYR 179 Cb -0.05 -1.39 0.03 0.00 -1.52 0.00 0.00 41.96 39.04 2oa9 s TYR 179 CO -0.00 0.20 -0.04 0.21 0.02 0.00 0.00 175.55 175.93 2oa9 s LYS 180 N -1.43 1.22 -0.06 -0.62 2.20 -0.45 -0.53 119.74 120.07 2oa9 s LYS 180 Ca 0.13 -0.28 -0.27 0.00 -0.36 0.00 0.00 55.97 55.19 2oa9 s LYS 180 Cb -0.10 -1.64 -0.03 0.00 -1.51 0.00 0.00 37.83 34.55 2oa9 s LYS 180 CO 0.04 -0.36 0.86 0.71 -0.36 0.00 0.00 175.35 176.24 2oa9 s TYR 181 N 1.75 3.58 -0.04 4.03 1.51 -1.26 -0.93 117.35 126.00 2oa9 s TYR 181 Ca 0.03 1.47 -0.24 0.00 -1.01 0.00 0.00 57.07 57.32 2oa9 s TYR 181 Cb -0.14 -3.00 -0.22 0.00 -0.11 0.00 0.00 41.96 38.49 2oa9 s TYR 181 CO -0.07 -0.03 1.07 -0.91 -1.11 0.00 0.00 175.55 174.50 2oa9 h ASN 182 N 6.88 0.24 -5.40 2.29 2.35 -1.41 -3.45 115.58 117.08 2oa9 h ASN 182 Ca -0.38 -0.73 0.20 0.00 -0.55 0.00 0.00 56.30 54.83 2oa9 h ASN 182 Cb 1.19 -0.07 -0.09 0.00 0.05 0.00 0.00 38.32 39.40 2oa9 h ASN 182 CO 0.77 0.94 0.54 -0.94 -1.65 0.00 0.00 177.43 177.10 2oa9 s SER 183 N -6.29 -0.15 -0.02 5.81 1.04 -1.25 -4.74 113.70 108.09 2oa9 s SER 183 Ca -0.16 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 55.91 2oa9 s SER 183 Cb 0.01 0.44 0.02 0.00 0.10 0.00 0.00 66.02 66.59 2oa9 s SER 183 CO 0.74 -0.81 0.01 0.00 0.98 0.00 0.00 173.24 174.17 2oa9 s ALA 184 N -3.12 0.13 -0.41 5.32 0.00 -0.18 -3.00 121.76 120.50 2oa9 s ALA 184 Ca 0.13 0.19 -0.15 0.00 0.00 0.00 0.00 51.96 52.13 2oa9 s ALA 184 Cb -0.00 -0.21 0.02 0.00 0.00 0.00 0.00 23.12 22.93 2oa9 s ALA 184 CO 0.01 -0.07 0.30 -0.80 0.00 0.00 0.00 175.76 175.20 2oa9 s ASN 185 N 0.80 6.09 -0.40 0.00 -0.87 0.34 -0.85 114.94 120.06 2oa9 s ASN 185 Ca -0.07 -0.92 -0.15 0.00 -1.57 0.00 0.00 52.86 50.15 2oa9 s ASN 185 Cb -0.10 -2.15 0.02 0.00 -0.02 0.00 0.00 41.25 38.99 2oa9 s ASN 185 CO -0.02 -0.45 0.29 -0.22 -2.57 0.00 0.00 177.10 174.13 2oa9 s LEU 186 N 1.67 5.03 -0.01 0.60 2.96 0.20 -0.96 118.68 128.18 2oa9 s LEU 186 Ca 0.05 -0.84 -0.30 0.00 -0.22 0.00 0.00 54.13 52.82 2oa9 s LEU 186 Cb -0.19 -2.16 -0.03 0.00 0.50 0.00 0.00 46.19 44.31 2oa9 s LEU 186 CO 0.10 -0.42 1.07 0.12 -1.32 0.00 0.00 176.35 175.89 2oa9 s PHE 187 N 1.69 3.52 0.00 5.38 5.36 0.15 -0.51 117.98 133.57 2oa9 s PHE 187 Ca 0.05 1.52 0.00 0.00 -0.96 0.00 0.00 56.93 57.54 2oa9 s PHE 187 Cb -0.19 -3.25 0.00 0.00 -0.34 0.00 0.00 43.02 39.24 2oa9 s PHE 187 CO 0.10 -0.54 0.00 0.25 -1.46 0.00 0.00 175.22 173.57 2oa9 n THR 188 N 4.11 0.00 -3.57 0.12 -2.24 0.05 -3.10 114.28 109.65 2oa9 n THR 188 Ca 0.08 -0.27 -0.10 0.00 -2.27 0.00 0.00 64.05 61.49 2oa9 n THR 188 Cb 0.49 0.80 -0.04 0.00 -2.10 0.00 0.00 70.33 69.47 2oa9 n THR 188 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2oa9 s ASP 189 N -1.08 -0.34 -0.05 3.42 2.15 -1.24 -4.95 116.67 114.58 2oa9 s ASP 189 Ca 0.00 0.31 -0.02 0.00 0.43 0.00 0.00 52.55 53.27 2oa9 s ASP 189 Cb 0.00 0.29 0.03 0.00 -0.30 0.00 0.00 42.92 42.95 2oa9 s ASP 189 CO 0.00 -0.36 0.08 -0.22 -0.17 0.00 0.00 175.17 174.50 2oa9 s LEU 190 N -1.35 0.58 0.52 -1.34 2.96 -1.26 -0.60 118.68 118.19 2oa9 s LEU 190 Ca 0.00 0.15 -0.09 0.00 -0.22 0.00 0.00 54.13 53.97 2oa9 s LEU 190 Cb -0.01 0.06 -0.05 0.00 0.50 0.00 0.00 46.19 46.70 2oa9 s LEU 190 CO -0.01 -0.18 0.89 0.42 -1.32 0.00 0.00 176.35 176.15 2oa9 s THR 191 N 1.57 4.78 0.33 3.68 -4.23 -1.26 -4.94 115.64 115.56 2oa9 s THR 191 Ca -0.04 0.61 0.02 0.00 -1.18 0.00 0.00 61.69 61.11 2oa9 s THR 191 Cb -0.12 -3.83 0.20 0.00 1.34 0.00 0.00 72.50 70.09 2oa9 s THR 191 CO -0.04 -0.89 1.92 1.62 -0.54 0.00 0.00 174.62 176.69 2oa9 h VAL 192 N 0.24 1.19 -0.81 2.29 3.04 -1.95 -0.92 116.25 119.33 2oa9 h VAL 192 Ca -0.46 -0.57 -0.03 0.00 -1.01 0.00 0.00 66.70 64.62 2oa9 h VAL 192 Cb 1.19 0.58 -0.04 0.00 -2.01 0.00 0.00 31.29 31.02 2oa9 h VAL 192 CO 0.62 0.23 0.38 1.56 -1.01 0.00 0.00 177.57 179.34 2oa9 h GLN 193 N 0.72 1.18 -0.23 4.17 7.50 -1.99 -1.02 115.11 125.44 2oa9 h GLN 193 Ca 0.17 -0.18 -0.17 0.00 0.50 0.00 0.00 58.65 58.97 2oa9 h GLN 193 Cb 0.14 -0.21 -0.00 0.00 0.05 0.00 0.00 27.48 27.46 2oa9 h GLN 193 CO -0.02 0.92 -0.53 0.77 -1.50 0.00 0.00 178.83 178.48 2oa9 h SER 194 N 1.16 0.75 -0.25 1.46 0.02 -1.83 -0.82 113.55 114.04 2oa9 h SER 194 Ca 0.28 -0.39 0.04 0.00 -0.84 0.00 0.00 61.79 60.87 2oa9 h SER 194 Cb 0.14 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 2oa9 h SER 194 CO -0.03 1.13 0.04 0.25 -1.14 0.00 0.00 176.83 177.07 2oa9 h LEU 195 N 0.53 -0.02 -0.65 5.07 5.85 -0.87 0.05 115.31 125.27 2oa9 h LEU 195 Ca 0.02 0.04 -0.13 0.00 0.84 0.00 0.00 57.88 58.65 2oa9 h LEU 195 Cb 1.09 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 2oa9 h LEU 195 CO 0.11 0.02 -0.29 0.00 -0.34 0.00 0.00 178.44 177.94 2oa9 h ARG 197 N 0.63 1.26 -0.41 0.00 3.08 -0.87 -1.89 114.38 116.18 2oa9 h ARG 197 Ca 0.07 -0.09 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 2oa9 h ARG 197 Cb 0.81 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 2oa9 h ARG 197 CO 0.07 0.85 -0.03 0.78 -1.07 0.00 0.00 179.97 180.57 2oa9 h GLY 198 N 1.29 0.72 0.88 0.04 0.00 -0.60 0.26 103.07 105.67 2oa9 h GLY 198 Ca 0.34 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 2oa9 h GLY 198 CO -0.07 0.44 0.02 -2.22 0.00 0.00 0.00 176.54 174.71 2oa9 h ILE 199 N 0.63 1.11 -0.93 2.60 2.04 -1.05 -0.74 117.51 121.18 2oa9 h ILE 199 Ca 0.12 -0.34 0.09 0.00 1.00 0.00 0.00 64.86 65.74 2oa9 h ILE 199 Cb 0.44 1.25 -0.07 0.00 -0.74 0.00 0.00 36.82 37.71 2oa9 h ILE 199 CO 0.02 0.09 0.60 -0.33 0.00 0.00 0.00 178.15 178.53 2oa9 h GLU 200 N -0.05 0.95 0.00 2.37 5.08 -0.78 -1.96 114.58 120.18 2oa9 h GLU 200 Ca 0.02 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2oa9 h GLU 200 Cb 0.13 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.17 2oa9 h GLU 200 CO -0.00 0.63 0.00 0.09 -1.00 0.00 0.00 179.01 178.73 2oa9 n ASN 201 N -4.53 0.73 0.00 1.42 3.02 0.03 -3.76 115.26 112.18 2oa9 n ASN 201 Ca 0.15 0.63 0.00 0.00 -0.03 0.00 0.00 54.58 55.33 2oa9 n ASN 201 Cb 0.27 -0.80 0.00 0.00 -0.61 0.00 0.00 39.78 38.64 2oa9 n ASN 201 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2oa9 n GLY 202 N 0.60 0.72 0.11 7.41 0.00 -0.78 -4.87 105.19 108.37 2oa9 n GLY 202 Ca 0.04 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.17 2oa9 n GLY 202 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2oa9 n ASP 203 N 0.00 0.81 -4.21 1.61 8.00 -0.36 -4.83 116.55 117.57 2oa9 n ASP 203 Ca 0.00 0.29 -0.31 0.00 0.71 0.00 0.00 54.79 55.49 2oa9 n ASP 203 Cb 0.00 0.49 -0.17 0.00 -0.02 0.00 0.00 41.12 41.42 2oa9 n ASP 203 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2oa9 s ILE 204 N -3.36 1.93 0.17 0.53 1.01 -0.73 -4.44 121.20 116.31 2oa9 s ILE 204 Ca -0.00 -0.97 0.09 0.00 0.00 0.00 0.00 60.65 59.77 2oa9 s ILE 204 Cb 0.10 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.87 2oa9 s ILE 204 CO 0.79 0.53 -0.10 -0.54 0.00 0.00 0.00 174.94 175.63 2oa9 s LYS 205 N 0.18 2.06 -0.33 2.79 -0.14 0.04 -4.27 119.74 120.07 2oa9 s LYS 205 Ca -0.12 -1.22 -0.03 0.00 -1.36 0.00 0.00 55.97 53.23 2oa9 s LYS 205 Cb -0.16 -2.18 0.06 0.00 -1.68 0.00 0.00 37.83 33.87 2oa9 s LYS 205 CO 0.06 0.45 0.07 0.08 -0.76 0.00 0.00 175.35 175.25 2oa9 s VAL 206 N -1.60 3.21 -0.59 3.17 1.01 -0.14 -1.07 120.40 124.39 2oa9 s VAL 206 Ca 0.24 -1.48 -0.17 0.00 0.00 0.00 0.00 61.98 60.57 2oa9 s VAL 206 Cb -0.09 -2.92 0.12 0.00 0.00 0.00 0.00 36.38 33.49 2oa9 s VAL 206 CO 0.15 -0.25 0.63 -0.62 0.00 0.00 0.00 175.10 175.01 2oa9 s ASP 207 N 1.41 6.22 -0.16 3.32 -1.08 0.31 -0.51 116.67 126.18 2oa9 s ASP 207 Ca -0.02 -1.66 -0.26 0.00 -0.52 0.00 0.00 52.55 50.10 2oa9 s ASP 207 Cb -0.20 -2.26 -0.01 0.00 -1.46 0.00 0.00 42.92 38.98 2oa9 s ASP 207 CO -0.01 -0.98 0.87 -0.63 0.52 0.00 0.00 175.17 174.94 2oa9 s ILE 208 N 2.10 4.86 -0.41 4.11 1.01 -0.22 -1.68 121.20 130.97 2oa9 s ILE 208 Ca 0.08 1.72 0.04 0.00 0.00 0.00 0.00 60.65 62.49 2oa9 s ILE 208 Cb -0.26 -4.17 0.17 0.00 0.01 0.00 0.00 42.46 38.21 2oa9 s ILE 208 CO 0.04 0.01 0.35 -1.14 0.00 0.00 0.00 174.94 174.20 2oa9 n ARG 209 N 5.24 0.20 -3.72 2.79 0.63 -1.24 -0.69 116.66 119.86 2oa9 n ARG 209 Ca 0.05 -3.16 -0.38 0.00 -0.92 0.00 0.00 57.85 53.45 2oa9 n ARG 209 Cb 0.49 -1.66 -0.12 0.00 0.45 0.00 0.00 32.46 31.62 2oa9 n ARG 209 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 2oa9 s ILE 210 N 0.04 4.07 0.00 5.15 1.01 0.19 -4.47 121.20 127.19 2oa9 s ILE 210 Ca 0.33 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 60.16 2oa9 s ILE 210 Cb 0.04 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.33 2oa9 s ILE 210 CO -0.20 -0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.31 2oa9 n GLY 211 N 4.88 2.56 2.87 6.18 0.00 0.55 -1.12 105.19 121.12 2oa9 n GLY 211 Ca -0.13 -2.15 -0.13 0.00 0.00 0.00 0.00 46.02 43.61 2oa9 n GLY 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oa9 s ALA 212 N -2.00 0.07 0.31 4.61 0.00 -1.26 -0.62 121.76 122.87 2oa9 s ALA 212 Ca 0.00 -0.00 -0.29 0.00 0.00 0.00 0.00 51.96 51.67 2oa9 s ALA 212 Cb 0.00 -0.04 -0.11 0.00 0.00 0.00 0.00 23.12 22.97 2oa9 s ALA 212 CO 0.00 0.00 1.46 0.71 0.00 0.00 0.00 175.76 177.93 2oa9 s TYR 213 N 0.09 2.84 -0.27 0.00 2.02 -0.35 -4.81 117.35 116.86 2oa9 s TYR 213 Ca -0.01 1.10 0.22 0.00 -0.37 0.00 0.00 57.07 58.02 2oa9 s TYR 213 Cb -0.02 -3.90 -0.07 0.00 -0.40 0.00 0.00 41.96 37.57 2oa9 s TYR 213 CO -0.00 -2.78 0.90 -2.39 -1.57 0.00 0.00 175.55 169.71 2oa9 n HIS 214 N 1.40 0.56 -4.11 2.71 1.44 -1.26 -0.55 115.22 115.41 2oa9 n HIS 214 Ca 0.04 0.16 -0.11 0.00 -2.01 0.00 0.00 57.72 55.80 2oa9 n HIS 214 Cb 0.40 -0.73 -0.08 0.00 0.12 0.00 0.00 29.99 29.70 2oa9 n HIS 214 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 2oa9 s SER 215 N -4.81 0.12 0.00 4.39 1.04 -1.26 -4.69 113.70 108.49 2oa9 s SER 215 Ca -0.01 -1.21 0.00 0.00 0.48 0.00 0.00 55.95 55.20 2oa9 s SER 215 Cb 0.12 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.72 2oa9 s SER 215 CO 0.82 -0.99 0.00 0.61 0.98 0.00 0.00 173.24 174.66 2oa9 n GLY 216 N -0.34 -1.77 0.22 7.32 0.00 -1.26 -3.25 105.19 106.11 2oa9 n GLY 216 Ca 0.01 -1.59 0.08 0.00 0.00 0.00 0.00 46.02 44.52 2oa9 n GLY 216 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2oa9 h LYS 217 N 0.00 0.00 -0.16 1.61 1.57 -2.02 -2.65 116.57 114.92 2oa9 h LYS 217 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2oa9 h LYS 217 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2oa9 h LYS 217 CO 0.00 0.26 0.00 1.63 -0.57 0.00 0.00 179.45 180.77 2oa9 n LYS 218 N -3.64 1.59 -1.61 3.15 5.02 -1.26 -4.96 118.16 116.44 2oa9 n LYS 218 Ca -0.01 -0.89 -0.52 0.00 -2.02 0.00 0.00 58.31 54.88 2oa9 n LYS 218 Cb 0.39 -1.34 -0.06 0.00 -0.02 0.00 0.00 35.03 34.00 2oa9 n LYS 218 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2oa9 n LYS 219 N 0.13 1.32 -0.20 1.97 4.81 -1.00 -1.24 118.16 123.94 2oa9 n LYS 219 Ca 0.14 0.48 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 2oa9 n LYS 219 Cb 0.27 -2.15 0.00 0.00 0.02 0.00 0.00 35.03 33.17 2oa9 n LYS 219 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2oa9 n GLY 220 N 2.85 1.73 3.96 3.14 0.00 0.29 -4.96 105.19 112.19 2oa9 n GLY 220 Ca 0.19 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 2oa9 n GLY 220 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oa9 s LYS 221 N -0.30 3.16 0.21 1.61 1.02 -0.37 -4.77 119.74 120.30 2oa9 s LYS 221 Ca 0.00 -0.63 -0.31 0.00 0.02 0.00 0.00 55.97 55.04 2oa9 s LYS 221 Cb 0.00 -2.67 -0.11 0.00 -0.52 0.00 0.00 37.83 34.53 2oa9 s LYS 221 CO 0.00 -0.08 1.64 0.99 -0.92 0.00 0.00 175.35 176.98 2oa9 s THR 222 N -2.38 2.25 -0.29 2.17 2.01 -1.26 -1.21 115.64 116.93 2oa9 s THR 222 Ca 0.45 0.19 0.02 0.00 0.31 0.00 0.00 61.69 62.66 2oa9 s THR 222 Cb -0.10 -3.12 0.08 0.00 0.01 0.00 0.00 72.50 69.37 2oa9 s THR 222 CO 0.35 0.02 -0.02 -2.28 -0.69 0.00 0.00 174.62 172.00 2oa9 s HIS 223 N 0.91 3.08 -0.08 4.92 2.46 0.20 -4.74 115.29 122.04 2oa9 s HIS 223 Ca 0.71 -2.37 -0.03 0.00 0.47 0.00 0.00 55.06 53.83 2oa9 s HIS 223 Cb -0.47 -2.17 0.04 0.00 -0.13 0.00 0.00 32.58 29.85 2oa9 s HIS 223 CO 0.35 -0.88 0.17 0.34 -2.47 0.00 0.00 174.74 172.25 2oa9 s ASP 224 N 1.15 0.19 0.00 9.88 2.15 -1.26 -0.33 116.67 128.46 2oa9 s ASP 224 Ca 0.01 0.37 0.24 0.00 0.43 0.00 0.00 52.55 53.59 2oa9 s ASP 224 Cb -0.19 0.29 0.64 0.00 -0.30 0.00 0.00 42.92 43.36 2oa9 s ASP 224 CO -0.08 -0.19 1.51 1.41 -0.17 0.00 0.00 175.17 177.64 2oa9 n HIS 225 N 4.68 0.19 0.00 -5.34 8.25 -1.26 -5.02 115.22 116.72 2oa9 n HIS 225 Ca -0.17 -0.10 0.00 0.00 -0.26 0.00 0.00 57.72 57.19 2oa9 n HIS 225 Cb 0.51 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.62 2oa9 n HIS 225 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2oa9 n GLY 226 N 1.27 3.07 3.72 -1.41 0.00 -1.26 -4.78 105.19 105.80 2oa9 n GLY 226 Ca 0.17 -1.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.25 2oa9 n GLY 226 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oa9 s THR 227 N -0.87 2.55 -0.14 2.61 2.01 -1.23 -4.49 115.64 116.07 2oa9 s THR 227 Ca 0.00 0.40 -0.09 0.00 0.31 0.00 0.00 61.69 62.30 2oa9 s THR 227 Cb 0.00 -3.25 -0.05 0.00 0.01 0.00 0.00 72.50 69.21 2oa9 s THR 227 CO 0.00 0.03 0.18 0.00 -0.69 0.00 0.00 174.62 174.14 2oa9 s ALA 228 N 1.08 3.78 -0.34 7.40 0.00 -0.67 -0.67 121.76 132.33 2oa9 s ALA 228 Ca 0.70 -0.60 -0.11 0.00 0.00 0.00 0.00 51.96 51.95 2oa9 s ALA 228 Cb -0.44 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 20.57 2oa9 s ALA 228 CO 0.32 0.41 0.19 -0.06 0.00 0.00 0.00 175.76 176.62 2oa9 s PHE 229 N -0.45 3.21 0.07 0.00 0.40 -0.46 -0.53 117.98 120.22 2oa9 s PHE 229 Ca 0.14 -0.63 0.07 0.00 -0.60 0.00 0.00 56.93 55.91 2oa9 s PHE 229 Cb -0.12 -2.42 -0.03 0.00 0.51 0.00 0.00 43.02 40.96 2oa9 s PHE 229 CO 0.03 -0.51 -0.19 1.03 0.70 0.00 0.00 175.22 176.28 2oa9 s ARG 230 N 1.62 1.17 -0.11 0.44 0.52 -0.23 -0.57 118.95 121.79 2oa9 s ARG 230 Ca 0.04 -1.02 -0.13 0.00 -0.52 0.00 0.00 55.73 54.10 2oa9 s ARG 230 Cb -0.18 -1.33 0.03 0.00 0.52 0.00 0.00 34.95 34.00 2oa9 s ARG 230 CO 0.07 0.32 0.35 -1.50 0.02 0.00 0.00 175.30 174.57 2oa9 s ILE 231 N -1.01 0.01 0.34 1.52 2.07 -0.23 -0.78 121.20 123.12 2oa9 s ILE 231 Ca 0.05 -0.11 -0.29 0.00 -1.41 0.00 0.00 60.65 58.90 2oa9 s ILE 231 Cb -0.09 -0.54 -0.11 0.00 0.13 0.00 0.00 42.46 41.85 2oa9 s ILE 231 CO 0.03 -0.06 1.48 0.21 -1.91 0.00 0.00 174.94 174.69 2oa9 s ASN 232 N -0.17 6.44 0.19 4.50 3.84 -1.26 -0.55 114.94 127.93 2oa9 s ASN 232 Ca -0.03 2.93 -0.07 0.00 0.21 0.00 0.00 52.86 55.90 2oa9 s ASN 232 Cb -0.03 -2.65 0.10 0.00 -0.55 0.00 0.00 41.25 38.12 2oa9 s ASN 232 CO 0.01 -0.82 1.62 -0.03 -2.79 0.00 0.00 177.10 175.09 2oa9 h MET 233 N 3.72 0.94 -0.71 0.43 1.85 -1.24 -1.52 114.93 118.40 2oa9 h MET 233 Ca -0.49 -0.35 -0.01 0.00 -0.61 0.00 0.00 59.70 58.23 2oa9 h MET 233 Cb 1.23 -0.06 -0.03 0.00 0.43 0.00 0.00 31.60 33.17 2oa9 h MET 233 CO 0.69 1.01 0.39 0.93 -0.40 0.00 0.00 176.91 179.54 2oa9 h GLU 234 N 0.83 0.99 -0.12 0.39 4.39 -1.82 -2.86 114.58 116.38 2oa9 h GLU 234 Ca 0.13 -0.11 0.03 0.00 0.34 0.00 0.00 59.36 59.75 2oa9 h GLU 234 Cb 0.69 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 2oa9 h GLU 234 CO 0.05 0.73 0.09 -0.22 -1.16 0.00 0.00 179.01 178.50 2oa9 h LYS 235 N 0.98 0.01 -0.22 2.33 3.64 -1.64 -1.36 116.57 120.31 2oa9 h LYS 235 Ca 0.25 -0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.69 2oa9 h LYS 235 Cb 0.03 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2oa9 h LYS 235 CO -0.04 0.01 0.17 1.25 -2.27 0.00 0.00 179.45 178.57 2oa9 h LEU 236 N 0.02 0.00 -1.03 5.20 5.85 -1.12 -0.87 115.31 123.35 2oa9 h LEU 236 Ca 0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2oa9 h LEU 236 Cb 0.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 2oa9 h LEU 236 CO -0.00 0.00 0.00 -0.07 -0.34 0.00 0.00 178.44 178.03 2oa9 h LEU 237 N 0.00 0.00 -0.10 2.25 3.38 -1.37 -0.16 115.31 119.31 2oa9 h LEU 237 Ca 0.11 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.85 2oa9 h LEU 237 Cb 0.45 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2oa9 h LEU 237 CO -0.00 0.00 -1.01 -0.08 0.09 0.00 0.00 178.44 177.44 2oa9 h GLU 238 N 0.00 0.19 0.00 1.13 4.81 -1.30 -3.39 114.58 116.02 2oa9 h GLU 238 Ca 0.00 -0.25 -0.21 0.00 -0.13 0.00 0.00 59.36 58.77 2oa9 h GLU 238 Cb 0.25 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 2oa9 h GLU 238 CO 0.00 1.05 -2.09 0.66 -0.73 0.00 0.00 179.01 177.90 2oa9 n TYR 239 N -3.56 0.00 -2.64 0.92 4.01 -0.65 -5.03 117.16 110.20 2oa9 n TYR 239 Ca -0.04 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.45 2oa9 n TYR 239 Cb 0.90 -0.71 0.03 0.00 -0.31 0.00 0.00 39.34 39.24 2oa9 n TYR 239 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2oa9 s GLY 240 N -4.82 1.63 -0.01 2.72 0.00 -0.16 -4.77 107.32 101.90 2oa9 s GLY 240 Ca -0.08 -0.94 -0.30 0.00 0.00 0.00 0.00 44.72 43.40 2oa9 s GLY 240 CO 0.75 -0.69 1.20 1.85 0.00 0.00 0.00 173.10 176.20 2oa9 s GLU 241 N -4.81 4.39 -0.04 2.90 2.56 0.23 -4.93 118.70 119.00 2oa9 s GLU 241 Ca 0.53 1.70 0.01 0.00 0.00 0.00 0.00 54.97 57.20 2oa9 s GLU 241 Cb -0.10 -3.49 0.02 0.00 2.00 0.00 0.00 34.13 32.57 2oa9 s GLU 241 CO 0.41 -0.37 -0.02 0.08 -0.56 0.00 0.00 175.26 174.81 2oa9 s VAL 242 N 1.79 0.32 -0.21 3.70 1.01 -1.26 -0.77 120.40 124.98 2oa9 s VAL 242 Ca 0.57 0.00 -0.09 0.00 0.00 0.00 0.00 61.98 62.46 2oa9 s VAL 242 Cb -0.26 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.69 2oa9 s VAL 242 CO 0.25 0.18 0.10 -0.54 0.00 0.00 0.00 175.10 175.09 2oa9 s LYS 243 N 0.98 3.98 -0.25 2.72 3.01 0.33 -4.91 119.74 125.61 2oa9 s LYS 243 Ca -0.10 -0.33 -0.15 0.00 -1.01 0.00 0.00 55.97 54.38 2oa9 s LYS 243 Cb -0.14 -3.36 -0.04 0.00 -1.01 0.00 0.00 37.83 33.29 2oa9 s LYS 243 CO -0.01 0.14 0.37 0.08 0.51 0.00 0.00 175.35 176.44 2oa9 s VAL 244 N 0.77 5.19 -0.23 3.17 1.01 -1.26 -0.63 120.40 128.42 2oa9 s VAL 244 Ca 0.05 0.58 -0.03 0.00 0.00 0.00 0.00 61.98 62.58 2oa9 s VAL 244 Cb -0.13 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.56 2oa9 s VAL 244 CO 0.02 0.18 -0.05 -0.63 0.00 0.00 0.00 175.10 174.62 2oa9 s ILE 245 N 1.87 3.18 0.00 2.22 1.01 -0.03 -4.99 121.20 124.46 2oa9 s ILE 245 Ca 0.15 -0.65 0.00 0.00 0.00 0.00 0.00 60.65 60.16 2oa9 s ILE 245 Cb -0.15 -2.48 0.00 0.00 0.01 0.00 0.00 42.46 39.83 2oa9 s ILE 245 CO 0.09 0.37 0.26 0.55 0.00 0.00 0.00 174.94 176.22