#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oa1 s PHE 2 N 0.00 -0.84 -0.08 3.17 5.36 -1.24 -4.17 117.98 120.19 1oa1 s PHE 2 Ca 0.00 1.45 -0.06 0.00 -0.96 0.00 0.00 56.93 57.37 1oa1 s PHE 2 Cb 0.00 0.28 0.03 0.00 -0.34 0.00 0.00 43.02 42.99 1oa1 s PHE 2 CO 0.00 -0.53 0.19 0.00 -1.46 0.00 0.00 175.22 173.42 1oa1 n PHE 4 N 3.49 0.00 1.00 0.00 -1.74 -1.26 -0.42 117.46 118.53 1oa1 n PHE 4 Ca -0.18 -0.18 0.13 0.00 -0.56 0.00 0.00 57.45 56.66 1oa1 n PHE 4 Cb 0.56 -0.07 0.47 0.00 1.52 0.00 0.00 39.48 41.96 1oa1 n PHE 4 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1oa1 n GLN 5 N 0.17 0.00 -4.47 3.97 10.64 -1.26 -4.41 117.38 122.03 1oa1 n GLN 5 Ca 0.02 0.00 -0.26 0.00 -1.83 0.00 0.00 57.00 54.93 1oa1 n GLN 5 Cb 0.85 -1.50 -0.10 0.00 -0.86 0.00 0.00 30.24 28.63 1oa1 n GLN 5 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1oa1 h GLN 7 N 1.85 0.00 -0.20 0.00 -0.00 -1.46 -2.55 115.11 112.74 1oa1 h GLN 7 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.22 1oa1 h GLN 7 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.73 1oa1 h GLN 7 CO 0.72 0.10 0.00 0.39 0.00 0.00 0.00 178.83 180.04 1oa1 n GLU 8 N -4.32 1.58 -1.63 1.69 1.02 -1.26 -4.89 120.64 112.82 1oa1 n GLU 8 Ca -0.03 -0.89 -0.41 0.00 -0.02 0.00 0.00 57.16 55.81 1oa1 n GLU 8 Cb 0.18 -1.28 0.01 0.00 -0.02 0.00 0.00 31.44 30.33 1oa1 n GLU 8 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 1oa1 n THR 9 N 0.17 2.49 -1.68 2.62 5.66 -0.96 -4.75 114.28 117.82 1oa1 n THR 9 Ca 0.12 -0.50 -0.45 0.00 -3.05 0.00 0.00 64.05 60.17 1oa1 n THR 9 Cb 0.24 -1.26 -0.04 0.00 -1.55 0.00 0.00 70.33 67.72 1oa1 n THR 9 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1oa1 n ALA 10 N -0.40 1.73 -1.82 1.79 0.00 -1.26 -1.51 120.51 119.04 1oa1 n ALA 10 Ca 0.09 0.43 -0.19 0.00 0.00 0.00 0.00 53.44 53.77 1oa1 n ALA 10 Cb 0.39 -2.39 -0.06 0.00 0.00 0.00 0.00 19.45 17.39 1oa1 n ALA 10 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1oa1 n LYS 11 N 3.44 -1.54 -4.43 0.00 5.02 -1.26 -0.97 118.16 118.42 1oa1 n LYS 11 Ca 0.16 1.07 -0.40 0.00 -2.02 0.00 0.00 58.31 57.12 1oa1 n LYS 11 Cb 0.30 -5.52 -0.07 0.00 -0.02 0.00 0.00 35.03 29.73 1oa1 n LYS 11 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1oa1 n ASN 12 N -1.43 -1.84 0.00 4.39 5.15 -0.57 -4.78 115.26 116.19 1oa1 n ASN 12 Ca -0.20 -1.19 0.00 0.00 -0.60 0.00 0.00 54.58 52.59 1oa1 n ASN 12 Cb 0.64 -1.91 0.00 0.00 -0.53 0.00 0.00 39.78 37.99 1oa1 n ASN 12 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 1oa1 n THR 13 N -4.20 0.00 0.00 -0.44 -1.04 -0.14 -4.44 114.28 104.02 1oa1 n THR 13 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 1oa1 n THR 13 Cb 0.49 -0.58 0.00 0.00 -1.82 0.00 0.00 70.33 68.42 1oa1 n THR 13 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1oa1 n GLY 14 N 1.93 3.62 3.65 3.41 0.00 -0.50 -4.84 105.19 112.46 1oa1 n GLY 14 Ca 0.00 -0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 1oa1 n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa1 n THR 16 N 5.05 0.00 0.04 0.00 -2.24 -1.26 -1.91 114.28 113.96 1oa1 n THR 16 Ca 0.04 -0.23 -0.01 0.00 -2.27 0.00 0.00 64.05 61.58 1oa1 n THR 16 Cb 0.48 0.59 -0.00 0.00 -2.10 0.00 0.00 70.33 69.30 1oa1 n THR 16 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1oa1 n VAL 17 N -1.53 1.16 -3.83 2.28 0.31 -1.26 -1.98 118.33 113.47 1oa1 n VAL 17 Ca -0.00 0.36 -0.12 0.00 -0.01 0.00 0.00 64.34 64.56 1oa1 n VAL 17 Cb 0.16 -1.63 -0.12 0.00 -0.91 0.00 0.00 33.84 31.34 1oa1 n VAL 17 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1oa1 s LYS 18 N -2.06 0.23 0.49 5.55 2.20 -1.26 -4.03 119.74 120.86 1oa1 s LYS 18 Ca -0.02 0.07 -0.23 0.00 -0.36 0.00 0.00 55.97 55.44 1oa1 s LYS 18 Cb 0.00 0.11 -0.06 0.00 -1.51 0.00 0.00 37.83 36.36 1oa1 s LYS 18 CO 0.03 -0.04 1.29 0.20 -0.36 0.00 0.00 175.35 176.47 1oa1 s GLY 19 N -0.23 2.86 0.58 5.54 0.00 0.13 -4.88 107.32 111.33 1oa1 s GLY 19 Ca -0.03 1.19 0.29 0.00 0.00 0.00 0.00 44.72 46.17 1oa1 s GLY 19 CO 0.00 1.71 2.24 -0.33 0.00 0.00 0.00 173.10 176.72 1oa1 h MET 20 N 1.86 0.00 0.00 2.90 0.00 -1.90 -0.67 114.93 117.13 1oa1 h MET 20 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.20 1oa1 h MET 20 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.87 1oa1 h MET 20 CO 0.59 0.01 0.00 0.00 0.00 0.00 0.00 176.91 177.51 1oa1 n GLY 22 N 0.71 0.64 3.64 0.00 0.00 -0.26 -4.58 105.19 105.33 1oa1 n GLY 22 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 1oa1 n GLY 22 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1oa1 s LYS 23 N -0.62 3.89 0.72 1.61 2.20 -1.25 -4.68 119.74 121.61 1oa1 s LYS 23 Ca 0.00 1.79 -0.11 0.00 -0.36 0.00 0.00 55.97 57.28 1oa1 s LYS 23 Cb 0.00 -4.02 0.03 0.00 -1.51 0.00 0.00 37.83 32.33 1oa1 s LYS 23 CO 0.00 -1.18 1.08 -2.14 -0.36 0.00 0.00 175.35 172.75 1oa1 s PRO 24 N 4.51 2.64 0.26 4.03 0.02 -1.26 -0.69 135.00 144.49 1oa1 s PRO 24 Ca 0.72 1.11 -0.04 0.00 0.02 0.00 0.00 61.00 62.81 1oa1 s PRO 24 Cb -0.27 -1.95 0.52 0.00 0.02 0.00 0.00 34.50 32.82 1oa1 s PRO 24 CO 0.29 -1.35 1.67 1.49 -0.33 0.00 0.00 177.00 178.77 1oa1 h GLU 25 N -0.76 0.21 -0.73 5.54 4.81 -1.94 -0.44 114.58 121.26 1oa1 h GLU 25 Ca -0.44 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 58.73 1oa1 h GLU 25 Cb 1.22 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.52 1oa1 h GLU 25 CO 0.54 0.14 0.26 0.93 -0.73 0.00 0.00 179.01 180.15 1oa1 h GLU 26 N 0.22 1.12 -0.14 1.92 3.07 -1.94 0.01 114.58 118.85 1oa1 h GLU 26 Ca 0.45 -0.22 -0.04 0.00 -0.50 0.00 0.00 59.36 59.05 1oa1 h GLU 26 Cb 0.81 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 28.54 1oa1 h GLU 26 CO -0.58 0.94 -0.06 1.15 -1.40 0.00 0.00 179.01 179.07 1oa1 h THR 27 N 1.07 1.31 -0.48 1.13 2.02 -1.72 -1.71 112.91 114.53 1oa1 h THR 27 Ca 0.24 -1.07 0.06 0.00 0.77 0.00 0.00 66.41 66.41 1oa1 h THR 27 Cb 0.26 1.73 -0.05 0.00 -1.74 0.00 0.00 68.15 68.35 1oa1 h THR 27 CO -0.01 0.31 0.19 0.00 0.37 0.00 0.00 175.52 176.38 1oa1 h ALA 28 N 0.67 0.59 -0.59 6.16 0.00 -0.84 -0.93 119.26 124.32 1oa1 h ALA 28 Ca 0.03 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1oa1 h ALA 28 Cb 0.51 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1oa1 h ALA 28 CO 0.02 -0.20 0.02 -0.91 0.00 0.00 0.00 179.25 178.18 1oa1 h ASN 29 N 0.37 1.01 -0.55 0.00 2.35 -0.95 -2.11 115.58 115.71 1oa1 h ASN 29 Ca 0.23 -0.30 -0.03 0.00 -0.55 0.00 0.00 56.30 55.65 1oa1 h ASN 29 Cb 0.21 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.29 1oa1 h ASN 29 CO -0.22 1.06 0.25 -0.07 -1.65 0.00 0.00 177.43 176.80 1oa1 h LEU 30 N 0.93 0.76 -0.74 1.61 3.38 -0.92 -1.05 115.31 119.28 1oa1 h LEU 30 Ca 0.17 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1oa1 h LEU 30 Cb 0.53 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1oa1 h LEU 30 CO 0.03 0.68 0.30 1.56 0.09 0.00 0.00 178.44 181.10 1oa1 h GLN 31 N 0.83 1.10 -0.96 1.13 4.20 -0.83 -0.99 115.11 119.59 1oa1 h GLN 31 Ca 0.20 -0.19 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1oa1 h GLN 31 Cb 0.14 -0.18 -0.05 0.00 0.30 0.00 0.00 27.48 27.70 1oa1 h GLN 31 CO -0.02 0.90 0.61 -0.44 -0.67 0.00 0.00 178.83 179.21 1oa1 h ASP 32 N 1.06 1.13 -0.14 1.46 3.32 -0.69 -1.78 116.42 120.78 1oa1 h ASP 32 Ca 0.25 -0.05 -0.12 0.00 0.02 0.00 0.00 57.03 57.13 1oa1 h ASP 32 Cb 0.20 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1oa1 h ASP 32 CO -0.02 0.84 -0.33 0.25 -1.72 0.00 0.00 179.24 178.26 1oa1 h LEU 33 N 1.31 0.66 -0.33 1.55 5.85 -0.79 -1.23 115.31 122.33 1oa1 h LEU 33 Ca 0.35 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1oa1 h LEU 33 Cb -0.11 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 1oa1 h LEU 33 CO -0.07 0.94 0.18 0.25 -0.34 0.00 0.00 178.44 179.40 1oa1 h LEU 34 N 0.54 0.41 -1.08 2.25 5.85 -0.83 -1.04 115.31 121.41 1oa1 h LEU 34 Ca 0.06 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1oa1 h LEU 34 Cb 0.83 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.72 1oa1 h LEU 34 CO 0.07 0.38 0.34 0.40 -0.34 0.00 0.00 178.44 179.28 1oa1 h ILE 35 N 0.41 1.22 -0.26 4.05 2.04 -1.02 -0.22 117.51 123.73 1oa1 h ILE 35 Ca 0.12 -0.62 0.04 0.00 1.00 0.00 0.00 64.86 65.40 1oa1 h ILE 35 Cb 0.05 0.33 -0.04 0.00 -0.74 0.00 0.00 36.82 36.42 1oa1 h ILE 35 CO -0.02 0.26 0.01 0.15 0.00 0.00 0.00 178.15 178.55 1oa1 h PHE 36 N 0.98 0.01 -0.55 1.37 3.57 -0.90 -0.56 116.94 120.86 1oa1 h PHE 36 Ca 0.24 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.69 1oa1 h PHE 36 Cb 0.09 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.85 1oa1 h PHE 36 CO 0.01 -0.03 0.04 0.28 -2.23 0.00 0.00 178.31 176.38 1oa1 h VAL 37 N 0.09 1.25 -0.49 1.41 2.07 -0.52 -2.19 116.25 117.87 1oa1 h VAL 37 Ca 0.12 -1.01 -0.04 0.00 0.82 0.00 0.00 66.70 66.59 1oa1 h VAL 37 Cb 0.16 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1oa1 h VAL 37 CO -0.20 0.37 0.16 -0.07 0.02 0.00 0.00 177.57 177.85 1oa1 h LEU 38 N 0.85 0.66 -1.12 2.57 3.38 -0.61 -1.31 115.31 119.72 1oa1 h LEU 38 Ca 0.17 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1oa1 h LEU 38 Cb 0.45 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 1oa1 h LEU 38 CO 0.02 0.63 0.51 0.03 0.09 0.00 0.00 178.44 179.72 1oa1 h ARG 39 N 0.71 1.11 -0.21 1.13 3.08 -0.51 -0.88 114.38 118.81 1oa1 h ARG 39 Ca 0.17 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1oa1 h ARG 39 Cb 0.20 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1oa1 h ARG 39 CO -0.01 0.77 0.09 0.78 -1.07 0.00 0.00 179.97 180.53 1oa1 h GLY 40 N 1.15 0.33 0.47 0.04 0.00 -0.82 -1.07 103.07 103.17 1oa1 h GLY 40 Ca 0.30 -0.17 0.09 0.00 0.00 0.00 0.00 47.33 47.55 1oa1 h GLY 40 CO -0.06 0.16 0.35 -2.22 0.00 0.00 0.00 176.54 174.77 1oa1 h ILE 41 N 0.20 0.85 -0.67 2.60 2.04 -1.04 -2.86 117.51 118.62 1oa1 h ILE 41 Ca 0.07 -0.20 -0.07 0.00 1.00 0.00 0.00 64.86 65.66 1oa1 h ILE 41 Cb 0.15 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 36.40 1oa1 h ILE 41 CO -0.01 0.11 0.15 0.00 0.00 0.00 0.00 178.15 178.40 1oa1 h ALA 42 N 1.43 0.89 -0.19 1.87 0.00 -0.79 0.19 119.26 122.66 1oa1 h ALA 42 Ca 0.35 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1oa1 h ALA 42 Cb 0.37 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1oa1 h ALA 42 CO -0.27 0.62 -0.01 0.82 0.00 0.00 0.00 179.25 180.41 1oa1 h ILE 43 N 1.01 0.85 -0.12 0.00 2.04 -0.98 0.09 117.51 120.41 1oa1 h ILE 43 Ca 0.21 -0.01 -0.21 0.00 1.00 0.00 0.00 64.86 65.84 1oa1 h ILE 43 Cb 0.39 0.80 0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1oa1 h ILE 43 CO 0.01 0.01 -0.77 1.88 0.00 0.00 0.00 178.15 179.27 1oa1 h TYR 44 N 0.04 0.89 -0.74 1.37 0.05 -1.40 -2.53 116.97 114.65 1oa1 h TYR 44 Ca 0.09 -0.40 -0.04 0.00 0.05 0.00 0.00 58.73 58.43 1oa1 h TYR 44 Cb 0.12 -0.14 -0.03 0.00 1.01 0.00 0.00 36.73 37.69 1oa1 h TYR 44 CO -0.18 1.20 0.29 0.78 -1.05 0.00 0.00 178.16 179.20 1oa1 h GLY 45 N 0.81 1.19 0.89 3.88 0.00 -0.75 -0.71 103.07 108.39 1oa1 h GLY 45 Ca -0.05 -0.64 -0.04 0.00 0.00 0.00 0.00 47.33 46.60 1oa1 h GLY 45 CO 0.15 0.61 0.05 -2.09 0.00 0.00 0.00 176.54 175.26 1oa1 h GLU 46 N 1.08 0.52 -0.98 4.80 4.81 -0.99 -2.48 114.58 121.35 1oa1 h GLU 46 Ca 0.25 -0.14 0.02 0.00 -0.13 0.00 0.00 59.36 59.36 1oa1 h GLU 46 Cb 0.21 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.48 1oa1 h GLU 46 CO -0.02 0.61 0.64 0.87 -0.73 0.00 0.00 179.01 180.39 1oa1 h LYS 47 N 0.34 1.27 -0.66 1.92 1.57 -1.04 -1.20 116.57 118.76 1oa1 h LYS 47 Ca 0.10 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 1oa1 h LYS 47 Cb 0.34 -0.29 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1oa1 h LYS 47 CO 0.01 0.84 0.09 -0.07 -0.57 0.00 0.00 179.45 179.75 1oa1 h LEU 48 N 1.30 1.05 -0.49 2.94 3.38 -1.10 -1.12 115.31 121.28 1oa1 h LEU 48 Ca 0.36 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1oa1 h LEU 48 Cb -0.12 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.33 1oa1 h LEU 48 CO -0.09 1.05 0.23 0.50 0.09 0.00 0.00 178.44 180.22 1oa1 h LYS 49 N 1.02 0.71 0.00 1.13 3.64 -0.98 -0.35 116.57 121.74 1oa1 h LYS 49 Ca 0.20 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.44 1oa1 h LYS 49 Cb 0.46 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1oa1 h LYS 49 CO 0.02 0.60 -0.16 0.93 -2.27 0.00 0.00 179.45 178.57 1oa1 h GLU 50 N 0.64 0.00 -0.00 1.90 5.08 -0.78 -0.69 114.58 120.73 1oa1 h GLU 50 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1oa1 h GLU 50 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1oa1 h GLU 50 CO -0.02 0.16 -0.06 1.28 -1.00 0.00 0.00 179.01 179.37 1oa1 n LEU 51 N -4.35 0.26 0.00 1.33 4.77 -0.46 -4.91 117.00 113.63 1oa1 n LEU 51 Ca -0.03 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1oa1 n LEU 51 Cb 0.22 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1oa1 n LEU 51 CO 0.36 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 1oa1 n GLY 52 N 1.25 0.50 2.57 -0.72 0.00 -0.26 -4.98 105.19 103.54 1oa1 n GLY 52 Ca 0.16 -0.72 -0.23 0.00 0.00 0.00 0.00 46.02 45.23 1oa1 n GLY 52 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1oa1 n GLN 53 N -2.85 2.13 -1.84 1.61 1.13 -0.17 -5.02 117.38 112.38 1oa1 n GLN 53 Ca 0.00 -4.15 -0.39 0.00 -1.94 0.00 0.00 57.00 50.52 1oa1 n GLN 53 Cb 0.00 -1.97 0.02 0.00 0.11 0.00 0.00 30.24 28.39 1oa1 n GLN 53 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 1oa1 s PRO 54 N -2.92 3.61 -0.18 -1.09 0.04 -1.20 -4.42 135.00 128.84 1oa1 s PRO 54 Ca 0.44 2.33 0.01 0.00 0.04 0.00 0.00 61.00 63.82 1oa1 s PRO 54 Cb 0.31 -2.58 0.02 0.00 0.04 0.00 0.00 34.50 32.28 1oa1 s PRO 54 CO -0.11 -0.84 -0.19 0.34 0.04 0.00 0.00 177.00 176.24 1oa1 s ASP 55 N -0.65 3.20 -0.06 6.66 -1.08 -1.26 -4.95 116.67 118.53 1oa1 s ASP 55 Ca 0.63 -0.64 0.15 0.00 -0.52 0.00 0.00 52.55 52.16 1oa1 s ASP 55 Cb -0.42 -1.49 0.47 0.00 -1.46 0.00 0.00 42.92 40.02 1oa1 s ASP 55 CO 0.53 -0.00 1.39 0.54 0.52 0.00 0.00 175.17 178.15 1oa1 n ARG 56 N 4.63 3.05 0.15 4.34 5.12 -1.26 -4.66 116.66 128.02 1oa1 n ARG 56 Ca -0.21 -2.45 0.12 0.00 -1.93 0.00 0.00 57.85 53.39 1oa1 n ARG 56 Cb 0.50 -1.55 0.53 0.00 -1.16 0.00 0.00 32.46 30.78 1oa1 n ARG 56 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1oa1 h SER 57 N 2.60 0.00 -0.57 0.55 4.64 -2.04 -2.57 113.55 116.16 1oa1 h SER 57 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1oa1 h SER 57 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1oa1 h SER 57 CO 0.09 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.64 1oa1 n ASN 58 N -2.29 3.54 0.02 4.97 3.02 -1.26 -4.70 115.26 118.54 1oa1 n ASN 58 Ca 0.01 -2.00 -0.10 0.00 -0.03 0.00 0.00 54.58 52.47 1oa1 n ASN 58 Cb 0.19 -0.38 -0.04 0.00 -0.61 0.00 0.00 39.78 38.94 1oa1 n ASN 58 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1oa1 h ASP 59 N 3.40 -0.34 -0.33 6.41 3.32 -1.81 -0.91 116.42 126.15 1oa1 h ASP 59 Ca 0.00 0.06 -0.14 0.00 0.02 0.00 0.00 57.03 56.97 1oa1 h ASP 59 Cb 0.89 0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.59 1oa1 h ASP 59 CO 0.00 -0.15 -0.33 0.44 -1.72 0.00 0.00 179.24 177.48 1oa1 h ASP 60 N -0.15 0.90 -0.68 6.45 3.45 -1.85 -2.34 116.42 122.20 1oa1 h ASP 60 Ca 0.07 -0.38 0.04 0.00 0.43 0.00 0.00 57.03 57.19 1oa1 h ASP 60 Cb 0.25 -0.25 -0.05 0.00 -0.56 0.00 0.00 39.33 38.72 1oa1 h ASP 60 CO -0.17 1.15 0.41 0.15 -1.57 0.00 0.00 179.24 179.20 1oa1 h PHE 61 N 0.72 0.76 -0.23 4.55 3.57 -1.77 -0.26 116.94 124.29 1oa1 h PHE 61 Ca 0.07 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 1oa1 h PHE 61 Cb 0.89 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.38 1oa1 h PHE 61 CO 0.05 0.41 0.06 0.28 -2.23 0.00 0.00 178.31 176.88 1oa1 h VAL 62 N 0.78 1.21 -0.39 1.41 2.07 -1.02 -0.43 116.25 119.87 1oa1 h VAL 62 Ca 0.28 -0.66 0.01 0.00 0.82 0.00 0.00 66.70 67.16 1oa1 h VAL 62 Cb 0.08 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 1oa1 h VAL 62 CO -0.13 0.21 0.24 -0.07 0.02 0.00 0.00 177.57 177.84 1oa1 h LEU 63 N 0.19 0.41 -0.78 2.57 3.38 -1.07 -1.87 115.31 118.14 1oa1 h LEU 63 Ca 0.07 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1oa1 h LEU 63 Cb 0.27 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1oa1 h LEU 63 CO 0.00 0.29 -0.24 1.56 0.09 0.00 0.00 178.44 180.15 1oa1 h GLN 64 N 0.50 0.66 -0.25 1.13 4.20 -0.96 -1.38 115.11 119.00 1oa1 h GLN 64 Ca 0.15 -0.26 -0.03 0.00 0.06 0.00 0.00 58.65 58.57 1oa1 h GLN 64 Cb -0.02 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 1oa1 h GLN 64 CO -0.06 0.84 0.03 0.78 -0.67 0.00 0.00 178.83 179.76 1oa1 h GLY 65 N 0.99 0.45 0.97 3.46 0.00 -0.86 0.04 103.07 108.13 1oa1 h GLY 65 Ca 0.08 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1oa1 h GLY 65 CO 0.05 0.28 0.21 1.41 0.00 0.00 0.00 176.54 178.50 1oa1 h LEU 66 N 0.22 0.49 -0.94 3.11 3.38 -1.25 -2.97 115.31 117.35 1oa1 h LEU 66 Ca 0.08 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1oa1 h LEU 66 Cb 0.34 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 1oa1 h LEU 66 CO 0.01 0.45 0.38 0.15 0.09 0.00 0.00 178.44 179.51 1oa1 h PHE 67 N 0.50 1.13 0.00 1.13 3.04 -1.08 -1.80 116.94 119.87 1oa1 h PHE 67 Ca 0.14 -0.05 0.00 0.00 3.98 0.00 0.00 57.97 62.03 1oa1 h PHE 67 Cb 0.07 -0.35 0.00 0.00 2.56 0.00 0.00 35.95 38.22 1oa1 h PHE 67 CO -0.02 0.82 0.00 0.00 -2.02 0.00 0.00 178.31 177.09 1oa1 h ALA 68 N 1.29 1.00 -0.25 2.41 0.00 -0.82 -1.57 119.26 121.32 1oa1 h ALA 68 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1oa1 h ALA 68 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1oa1 h ALA 68 CO -0.03 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.47 1oa1 n THR 69 N -2.99 0.31 -2.03 0.00 -2.24 -0.68 -3.67 114.28 102.99 1oa1 n THR 69 Ca -0.02 -0.57 -0.37 0.00 -2.27 0.00 0.00 64.05 60.81 1oa1 n THR 69 Cb 0.10 0.90 0.02 0.00 -2.10 0.00 0.00 70.33 69.25 1oa1 n THR 69 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1oa1 s ILE 70 N -1.69 2.62 0.19 2.28 1.01 -0.59 -4.93 121.20 120.08 1oa1 s ILE 70 Ca 0.35 0.44 -0.33 0.00 0.00 0.00 0.00 60.65 61.11 1oa1 s ILE 70 Cb 0.21 -3.21 -0.15 0.00 0.01 0.00 0.00 42.46 39.33 1oa1 s ILE 70 CO 0.30 -0.03 1.34 0.41 0.00 0.00 0.00 174.94 176.96 1oa1 n THR 71 N -1.03 0.67 -2.14 2.92 -1.04 -1.26 -1.84 114.28 110.56 1oa1 n THR 71 Ca 0.10 -0.17 -0.19 0.00 -2.04 0.00 0.00 64.05 61.76 1oa1 n THR 71 Cb 0.48 -1.20 -0.03 0.00 -1.82 0.00 0.00 70.33 67.76 1oa1 n THR 71 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1oa1 n ASN 72 N 2.34 -5.37 -0.11 8.00 3.02 -1.26 -4.79 115.26 117.09 1oa1 n ASN 72 Ca 0.14 0.11 -0.20 0.00 -0.03 0.00 0.00 54.58 54.60 1oa1 n ASN 72 Cb 0.27 -4.45 -0.08 0.00 -0.61 0.00 0.00 39.78 34.91 1oa1 n ASN 72 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1oa1 n ALA 73 N -1.06 0.92 -3.72 5.41 0.00 -0.77 -0.66 120.51 120.64 1oa1 n ALA 73 Ca -0.21 -0.78 -0.15 0.00 0.00 0.00 0.00 53.44 52.30 1oa1 n ALA 73 Cb 0.65 -0.11 -0.15 0.00 0.00 0.00 0.00 19.45 19.85 1oa1 n ALA 73 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1oa1 s ASN 74 N -6.80 0.26 0.00 0.00 3.84 -1.24 -3.03 114.94 107.97 1oa1 s ASN 74 Ca -0.31 0.28 0.08 0.00 0.21 0.00 0.00 52.86 53.12 1oa1 s ASN 74 Cb 0.09 0.18 0.06 0.00 -0.55 0.00 0.00 41.25 41.02 1oa1 s ASN 74 CO 0.47 -0.18 0.74 0.79 -2.79 0.00 0.00 177.10 176.13 1oa1 n TRP 75 N 4.64 0.00 -3.26 0.43 7.02 -0.08 -4.90 117.44 121.29 1oa1 n TRP 75 Ca -0.18 0.00 -0.44 0.00 -1.02 0.00 0.00 57.50 55.85 1oa1 n TRP 75 Cb 0.51 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.34 1oa1 n TRP 75 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 1oa1 s ASP 76 N -0.77 6.18 0.46 -0.99 -1.08 -1.25 -4.60 116.67 114.63 1oa1 s ASP 76 Ca 0.09 -1.29 0.11 0.00 -0.52 0.00 0.00 52.55 50.95 1oa1 s ASP 76 Cb 0.07 -2.24 1.04 0.00 -1.46 0.00 0.00 42.92 40.33 1oa1 s ASP 76 CO 0.12 -0.84 2.09 0.44 0.52 0.00 0.00 175.17 177.51 1oa1 h ASP 77 N 8.93 0.24 -0.71 -0.34 3.32 -1.96 -0.64 116.42 125.26 1oa1 h ASP 77 Ca -0.29 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 56.77 1oa1 h ASP 77 Cb 1.10 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 40.55 1oa1 h ASP 77 CO 0.97 0.19 0.47 0.00 -1.72 0.00 0.00 179.24 179.15 1oa1 h ALA 78 N 1.86 1.52 -0.43 3.45 0.00 -1.99 -0.40 119.26 123.26 1oa1 h ALA 78 Ca 0.08 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1oa1 h ALA 78 Cb -0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1oa1 h ALA 78 CO -0.02 0.43 -0.04 0.00 0.00 0.00 0.00 179.25 179.62 1oa1 h ARG 79 N 0.93 0.79 -0.58 0.00 2.47 -1.54 -1.95 114.38 114.50 1oa1 h ARG 79 Ca 0.27 -0.27 -0.07 0.00 -1.26 0.00 0.00 59.98 58.65 1oa1 h ARG 79 Cb -0.06 -0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 28.18 1oa1 h ARG 79 CO -0.06 0.88 0.11 0.74 0.56 0.00 0.00 179.97 182.20 1oa1 h PHE 80 N 0.63 1.01 -0.69 3.04 0.04 -1.17 -0.88 116.94 118.92 1oa1 h PHE 80 Ca 0.12 -0.14 0.00 0.00 2.80 0.00 0.00 57.97 60.76 1oa1 h PHE 80 Cb 0.55 -0.28 -0.03 0.00 2.20 0.00 0.00 35.95 38.39 1oa1 h PHE 80 CO 0.04 0.88 0.45 0.93 -0.60 0.00 0.00 178.31 180.01 1oa1 h GLU 81 N 0.86 0.92 -0.63 1.51 5.08 -1.00 0.09 114.58 121.41 1oa1 h GLU 81 Ca 0.18 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.43 1oa1 h GLU 81 Cb 0.40 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 1oa1 h GLU 81 CO 0.01 0.62 0.22 0.00 -1.00 0.00 0.00 179.01 178.86 1oa1 h ALA 82 N 1.25 0.82 -0.58 3.43 0.00 -1.17 -1.61 119.26 121.39 1oa1 h ALA 82 Ca 0.25 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1oa1 h ALA 82 Cb -0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 1oa1 h ALA 82 CO -0.05 0.46 0.00 0.52 0.00 0.00 0.00 179.25 180.18 1oa1 h MET 83 N 0.89 1.02 -0.31 0.00 2.86 -0.67 -0.95 114.93 117.77 1oa1 h MET 83 Ca 0.21 -0.32 -0.02 0.00 -2.06 0.00 0.00 59.70 57.50 1oa1 h MET 83 Cb 0.25 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1oa1 h MET 83 CO -0.01 1.01 0.10 0.82 1.06 0.00 0.00 176.91 179.89 1oa1 h ILE 84 N 0.91 1.20 -0.58 -1.22 2.04 -0.84 0.21 117.51 119.24 1oa1 h ILE 84 Ca 0.16 -0.64 -0.02 0.00 1.00 0.00 0.00 64.86 65.37 1oa1 h ILE 84 Cb 0.55 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 1oa1 h ILE 84 CO 0.03 0.22 0.28 0.28 0.00 0.00 0.00 178.15 178.96 1oa1 h SER 85 N 0.34 0.75 -0.83 1.72 0.02 -1.16 -0.63 113.55 113.75 1oa1 h SER 85 Ca 0.10 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 60.89 1oa1 h SER 85 Cb 0.24 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.55 1oa1 h SER 85 CO -0.00 0.66 0.38 -0.08 -1.14 0.00 0.00 176.83 176.65 1oa1 h GLU 86 N 0.78 1.20 -0.84 3.45 4.81 -1.05 -2.31 114.58 120.62 1oa1 h GLU 86 Ca 0.20 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1oa1 h GLU 86 Cb 0.11 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.24 1oa1 h GLU 86 CO -0.03 0.94 0.47 0.78 -0.73 0.00 0.00 179.01 180.44 1oa1 h GLY 87 N 1.18 1.25 1.04 1.92 0.00 -0.02 -0.86 103.07 107.58 1oa1 h GLY 87 Ca 0.28 -0.56 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 1oa1 h GLY 87 CO -0.03 0.54 0.10 1.41 0.00 0.00 0.00 176.54 178.56 1oa1 h LEU 88 N 1.17 0.97 -0.55 3.11 3.38 -0.86 0.36 115.31 122.88 1oa1 h LEU 88 Ca 0.30 -0.26 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1oa1 h LEU 88 Cb 0.02 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1oa1 h LEU 88 CO -0.05 0.98 0.11 0.00 0.09 0.00 0.00 178.44 179.57 1oa1 h ALA 89 N 1.02 0.72 -0.67 1.53 0.00 -1.04 -0.90 119.26 119.92 1oa1 h ALA 89 Ca 0.19 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1oa1 h ALA 89 Cb 0.42 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1oa1 h ALA 89 CO 0.01 0.45 0.16 0.00 0.00 0.00 0.00 179.25 179.87 1oa1 h ARG 90 N 0.79 1.07 -0.42 0.00 3.08 -0.98 -1.94 114.38 115.98 1oa1 h ARG 90 Ca 0.17 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 1oa1 h ARG 90 Cb 0.38 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 1oa1 h ARG 90 CO 0.01 0.94 0.12 -0.09 -1.07 0.00 0.00 179.97 179.88 1oa1 h ARG 91 N 1.02 0.66 -0.40 0.04 2.43 -0.65 -2.13 114.38 115.35 1oa1 h ARG 91 Ca 0.21 -0.15 -0.08 0.00 -0.81 0.00 0.00 59.98 59.15 1oa1 h ARG 91 Cb 0.36 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 1oa1 h ARG 91 CO 0.00 0.66 -0.09 -0.44 -1.51 0.00 0.00 179.97 178.59 1oa1 h ASP 92 N 0.53 0.67 -0.54 -3.80 3.32 -0.93 0.10 116.42 115.79 1oa1 h ASP 92 Ca 0.13 -0.18 0.02 0.00 0.02 0.00 0.00 57.03 57.02 1oa1 h ASP 92 Cb 0.28 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 1oa1 h ASP 92 CO -0.00 0.80 0.34 0.11 -1.72 0.00 0.00 179.24 178.76 1oa1 h LYS 93 N 0.64 0.65 -0.55 3.56 1.57 -1.16 -0.99 116.57 120.30 1oa1 h LYS 93 Ca 0.12 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.77 1oa1 h LYS 93 Cb 0.52 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 1oa1 h LYS 93 CO 0.03 0.43 0.01 -0.07 -0.57 0.00 0.00 179.45 179.28 1oa1 h LEU 94 N 0.67 0.94 -0.21 2.94 3.38 -0.69 -2.10 115.31 120.24 1oa1 h LEU 94 Ca 0.21 -0.30 0.05 0.00 0.09 0.00 0.00 57.88 57.92 1oa1 h LEU 94 Cb -0.02 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.43 1oa1 h LEU 94 CO -0.07 1.01 -0.10 -0.09 0.09 0.00 0.00 178.44 179.28 1oa1 h ARG 95 N 0.84 -0.06 -0.56 1.13 2.43 -0.57 0.55 114.38 118.12 1oa1 h ARG 95 Ca 0.16 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.27 1oa1 h ARG 95 Cb 0.52 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.06 1oa1 h ARG 95 CO 0.03 -0.04 0.12 -0.91 -1.51 0.00 0.00 179.97 177.66 1oa1 h ASN 96 N -0.07 0.82 -0.34 -3.80 2.35 -0.98 -0.58 115.58 112.99 1oa1 h ASN 96 Ca 0.11 -0.16 -0.05 0.00 -0.55 0.00 0.00 56.30 55.66 1oa1 h ASN 96 Cb 0.24 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1oa1 h ASN 96 CO -0.26 0.81 0.04 0.00 -1.65 0.00 0.00 177.43 176.37 1oa1 h ALA 97 N 1.29 0.46 -0.31 -0.83 0.00 -1.09 -2.85 119.26 115.93 1oa1 h ALA 97 Ca 0.18 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1oa1 h ALA 97 Cb 0.32 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1oa1 h ALA 97 CO 0.00 0.18 0.20 0.35 0.00 0.00 0.00 179.25 179.97 1oa1 h PHE 98 N 0.40 0.37 -0.90 0.00 3.57 -0.43 -1.85 116.94 118.11 1oa1 h PHE 98 Ca 0.10 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.66 1oa1 h PHE 98 Cb 0.39 -0.12 -0.06 0.00 2.79 0.00 0.00 35.95 38.95 1oa1 h PHE 98 CO 0.03 0.23 0.57 -0.07 -2.23 0.00 0.00 178.31 176.84 1oa1 h LEU 99 N 0.40 0.93 -0.32 0.59 3.38 -1.04 0.23 115.31 119.48 1oa1 h LEU 99 Ca 0.12 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 1oa1 h LEU 99 Cb -0.03 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 1oa1 h LEU 99 CO -0.03 0.62 -0.39 0.00 0.09 0.00 0.00 178.44 178.72 1oa1 h ALA 100 N 1.39 0.48 -0.32 1.53 0.00 -1.26 -1.73 119.26 119.34 1oa1 h ALA 100 Ca 0.37 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1oa1 h ALA 100 Cb 0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1oa1 h ALA 100 CO -0.14 0.58 -0.15 0.28 0.00 0.00 0.00 179.25 179.81 1oa1 h VAL 101 N 0.60 1.29 -0.56 0.00 2.07 -0.90 -1.97 116.25 116.78 1oa1 h VAL 101 Ca 0.04 -1.25 0.05 0.00 0.82 0.00 0.00 66.70 66.35 1oa1 h VAL 101 Cb 0.98 1.42 -0.05 0.00 -1.52 0.00 0.00 31.29 32.13 1oa1 h VAL 101 CO 0.09 0.40 0.30 0.22 0.02 0.00 0.00 177.57 178.61 1oa1 h TYR 102 N 0.44 0.56 -0.58 1.57 3.20 -0.53 -0.77 116.97 120.85 1oa1 h TYR 102 Ca 0.07 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.87 1oa1 h TYR 102 Cb 0.68 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.76 1oa1 h TYR 102 CO 0.06 0.28 0.01 -0.22 -1.64 0.00 0.00 178.16 176.65 1oa1 h LYS 103 N 0.58 1.01 -0.60 1.82 3.64 -1.17 -0.23 116.57 121.62 1oa1 h LYS 103 Ca 0.25 -0.30 -0.07 0.00 -1.27 0.00 0.00 60.65 59.26 1oa1 h LYS 103 Cb 0.13 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 1oa1 h LYS 103 CO -0.15 0.98 0.11 0.00 -2.27 0.00 0.00 179.45 178.11 1oa1 h ALA 104 N 1.08 1.05 0.00 5.00 0.00 -0.92 0.80 119.26 126.26 1oa1 h ALA 104 Ca 0.17 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1oa1 h ALA 104 Cb 0.52 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1oa1 h ALA 104 CO 0.03 0.61 -0.68 0.87 0.00 0.00 0.00 179.25 180.08 1oa1 h LYS 105 N 0.92 0.00 0.00 0.00 1.79 -0.75 -3.37 116.57 115.15 1oa1 h LYS 105 Ca 0.19 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.66 1oa1 h LYS 105 Cb 0.38 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.03 1oa1 h LYS 105 CO 0.01 0.31 -0.60 0.09 -1.08 0.00 0.00 179.45 178.18 1oa1 n ASN 106 N -3.06 1.16 -1.24 0.86 3.02 -0.13 -5.01 115.26 110.86 1oa1 n ASN 106 Ca -0.01 -0.48 -0.13 0.00 -0.03 0.00 0.00 54.58 53.93 1oa1 n ASN 106 Cb 0.70 1.09 -0.03 0.00 -0.61 0.00 0.00 39.78 40.93 1oa1 n ASN 106 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1oa1 n GLY 107 N 1.42 0.69 3.46 7.41 0.00 0.27 -4.99 105.19 113.45 1oa1 n GLY 107 Ca 0.01 -0.37 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 1oa1 n GLY 107 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1oa1 s LYS 108 N -3.81 1.30 0.41 1.61 -2.85 -1.24 -5.07 119.74 110.09 1oa1 s LYS 108 Ca 0.00 -0.50 -0.25 0.00 -1.00 0.00 0.00 55.97 54.21 1oa1 s LYS 108 Cb 0.00 0.58 -0.08 0.00 -2.06 0.00 0.00 37.83 36.27 1oa1 s LYS 108 CO 0.00 -0.57 1.22 -0.51 0.10 0.00 0.00 175.35 175.59 1oa1 s ASP 109 N -2.75 6.38 0.23 0.03 1.11 -1.26 -3.97 116.67 116.43 1oa1 s ASP 109 Ca 0.02 2.47 -0.32 0.00 0.18 0.00 0.00 52.55 54.90 1oa1 s ASP 109 Cb -0.01 -2.62 -0.12 0.00 1.07 0.00 0.00 42.92 41.23 1oa1 s ASP 109 CO -0.11 -0.79 1.64 0.33 1.18 0.00 0.00 175.17 177.42 1oa1 n PHE 110 N 0.02 2.66 -0.53 4.23 7.35 -1.26 -4.90 117.46 125.04 1oa1 n PHE 110 Ca 0.04 0.16 0.00 0.00 -0.76 0.00 0.00 57.45 56.90 1oa1 n PHE 110 Cb 0.45 -2.62 0.00 0.00 0.35 0.00 0.00 39.48 37.67 1oa1 n PHE 110 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 1oa1 n SER 111 N 3.24 0.31 -4.73 -2.13 3.41 -1.26 -5.08 113.62 107.37 1oa1 n SER 111 Ca 0.14 -0.87 -0.41 0.00 -0.26 0.00 0.00 58.87 57.47 1oa1 n SER 111 Cb 0.34 0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 64.31 1oa1 n SER 111 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1oa1 s GLU 112 N -0.06 4.66 0.46 4.33 0.41 -1.26 -5.00 118.70 122.24 1oa1 s GLU 112 Ca 0.00 1.59 -0.25 0.00 -0.41 0.00 0.00 54.97 55.90 1oa1 s GLU 112 Cb 0.00 -3.32 -0.08 0.00 -1.78 0.00 0.00 34.13 28.95 1oa1 s GLU 112 CO 0.00 0.17 1.39 -2.30 -0.49 0.00 0.00 175.26 174.02 1oa1 n PRO 113 N 2.49 2.10 -4.45 0.39 -0.02 -1.26 -5.02 135.00 129.23 1oa1 n PRO 113 Ca 0.02 0.75 -0.25 0.00 -2.02 0.00 0.00 63.50 62.01 1oa1 n PRO 113 Cb 0.47 -2.57 -0.11 0.00 -0.02 0.00 0.00 33.50 31.28 1oa1 n PRO 113 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1oa1 s LEU 114 N -2.55 2.53 0.68 2.45 1.43 -1.26 -5.11 118.68 116.85 1oa1 s LEU 114 Ca 0.63 -0.97 -0.17 0.00 -1.03 0.00 0.00 54.13 52.59 1oa1 s LEU 114 Cb -0.46 -1.10 -0.01 0.00 0.03 0.00 0.00 46.19 44.65 1oa1 s LEU 114 CO 0.56 0.06 0.99 -2.65 0.23 0.00 0.00 176.35 175.54 1oa1 n PRO 115 N -0.30 0.66 0.17 1.29 -0.02 -1.26 -4.87 135.00 130.67 1oa1 n PRO 115 Ca -0.08 0.28 0.13 0.00 -2.02 0.00 0.00 63.50 61.81 1oa1 n PRO 115 Cb 0.59 -2.23 0.68 0.00 -0.02 0.00 0.00 33.50 32.52 1oa1 n PRO 115 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1oa1 h GLU 116 N 0.01 0.00 -0.57 -0.52 4.81 -1.99 -0.70 114.58 115.61 1oa1 h GLU 116 Ca -0.48 0.00 0.17 0.00 -0.13 0.00 0.00 59.36 58.92 1oa1 h GLU 116 Cb 1.34 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.70 1oa1 h GLU 116 CO 0.48 0.00 0.42 0.00 -0.73 0.00 0.00 179.01 179.18 1oa1 h ALA 117 N 1.90 2.53 0.00 2.92 0.00 -1.89 -0.33 119.26 124.38 1oa1 h ALA 117 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1oa1 h ALA 117 Cb 0.37 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1oa1 h ALA 117 CO -0.00 -0.71 -0.19 0.00 0.00 0.00 0.00 179.25 178.34 1oa1 h ALA 118 N 1.70 0.88 0.00 0.00 0.00 -1.41 -3.31 119.26 117.13 1oa1 h ALA 118 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1oa1 h ALA 118 Cb 1.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1oa1 h ALA 118 CO -0.00 0.00 -0.64 0.25 0.00 0.00 0.00 179.25 178.85 1oa1 n THR 119 N -2.52 0.00 -1.73 0.00 -2.24 -0.55 -4.99 114.28 102.26 1oa1 n THR 119 Ca 0.04 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.40 1oa1 n THR 119 Cb 0.47 -0.62 -0.01 0.00 -2.10 0.00 0.00 70.33 68.07 1oa1 n THR 119 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 1oa1 n TRP 120 N -1.51 2.59 -3.94 4.78 -0.00 -0.24 -5.01 117.44 114.11 1oa1 n TRP 120 Ca 0.00 0.43 -0.08 0.00 -0.00 0.00 0.00 57.50 57.84 1oa1 n TRP 120 Cb 0.32 -2.50 -0.08 0.00 -0.00 0.00 0.00 31.31 29.05 1oa1 n TRP 120 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 177.69 177.61 1oa1 s THR 121 N -0.64 0.17 0.00 5.87 -1.32 -1.26 -5.01 115.64 113.45 1oa1 s THR 121 Ca 0.59 -1.36 -0.29 0.00 -1.21 0.00 0.00 61.69 59.42 1oa1 s THR 121 Cb -0.54 -1.34 0.10 0.00 -1.51 0.00 0.00 72.50 69.21 1oa1 s THR 121 CO 0.57 -0.75 1.09 -0.83 -2.21 0.00 0.00 174.62 172.49 1oa1 s GLY 122 N -2.79 -0.35 0.82 6.08 0.00 -1.26 -5.13 107.32 104.69 1oa1 s GLY 122 Ca 0.04 0.78 -0.09 0.00 0.00 0.00 0.00 44.72 45.45 1oa1 s GLY 122 CO -0.10 0.22 1.14 0.51 0.00 0.00 0.00 173.10 174.87 1oa1 s ASP 123 N -2.70 3.99 0.52 1.64 1.47 -1.26 -4.93 116.67 115.40 1oa1 s ASP 123 Ca 0.11 0.18 0.23 0.00 1.18 0.00 0.00 52.55 54.24 1oa1 s ASP 123 Cb 0.01 -0.50 1.43 0.00 -0.34 0.00 0.00 42.92 43.51 1oa1 s ASP 123 CO -0.03 -2.14 2.12 0.77 0.68 0.00 0.00 175.17 176.57 1oa1 h SER 124 N -1.03 0.00 0.94 2.11 4.64 -2.02 -0.50 113.55 117.70 1oa1 h SER 124 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1oa1 h SER 124 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1oa1 h SER 124 CO 0.46 0.08 0.00 0.71 -0.87 0.00 0.00 176.83 177.21 1oa1 h THR 125 N 0.00 0.00 0.00 2.95 1.35 -2.02 -2.65 112.91 112.53 1oa1 h THR 125 Ca -0.00 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 1oa1 h THR 125 Cb 0.17 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 67.77 1oa1 h THR 125 CO 0.01 0.00 -0.39 0.00 -0.25 0.00 0.00 175.52 174.89 1oa1 n ALA 126 N -1.85 3.11 -0.09 6.62 0.00 -0.20 -4.49 120.51 123.61 1oa1 n ALA 126 Ca 0.02 -0.26 -0.11 0.00 0.00 0.00 0.00 53.44 53.09 1oa1 n ALA 126 Cb 0.28 -1.22 -0.04 0.00 0.00 0.00 0.00 19.45 18.47 1oa1 n ALA 126 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1oa1 h PHE 127 N 0.00 0.53 -0.53 0.00 0.04 -1.50 -2.64 116.94 112.84 1oa1 h PHE 127 Ca 0.00 -0.09 -0.01 0.00 2.80 0.00 0.00 57.97 60.67 1oa1 h PHE 127 Cb 0.55 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 38.54 1oa1 h PHE 127 CO 0.00 0.64 0.30 0.00 -0.60 0.00 0.00 178.31 178.65 1oa1 h ALA 128 N 0.82 0.67 -0.18 2.45 0.00 -1.79 0.09 119.26 121.33 1oa1 h ALA 128 Ca 0.08 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1oa1 h ALA 128 Cb 0.43 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1oa1 h ALA 128 CO 0.02 0.18 -0.23 1.49 0.00 0.00 0.00 179.25 180.71 1oa1 h GLU 129 N 0.71 0.48 -0.87 0.00 4.57 -1.85 -3.19 114.58 114.43 1oa1 h GLU 129 Ca 0.19 -0.27 -0.02 0.00 -1.18 0.00 0.00 59.36 58.08 1oa1 h GLU 129 Cb 0.02 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.59 1oa1 h GLU 129 CO -0.03 0.85 0.47 -0.22 -1.18 0.00 0.00 179.01 178.90 1oa1 h LYS 130 N 0.13 1.21 -0.47 1.92 1.63 -1.23 -2.86 116.57 116.90 1oa1 h LYS 130 Ca 0.02 -0.14 0.10 0.00 -0.85 0.00 0.00 60.65 59.78 1oa1 h LYS 130 Cb 0.79 -0.24 -0.03 0.00 -0.60 0.00 0.00 32.23 32.16 1oa1 h LYS 130 CO 0.05 0.89 0.32 0.00 -3.45 0.00 0.00 179.45 177.27 1oa1 h ALA 131 N 1.30 2.15 0.00 5.00 0.00 -0.96 -2.08 119.26 124.67 1oa1 h ALA 131 Ca 0.30 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1oa1 h ALA 131 Cb 0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1oa1 h ALA 131 CO -0.05 -0.26 -0.06 0.87 0.00 0.00 0.00 179.25 179.75 1oa1 h LYS 132 N 0.22 0.00 -0.09 0.00 1.57 -1.54 -2.99 116.57 113.74 1oa1 h LYS 132 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1oa1 h LYS 132 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1oa1 h LYS 132 CO -0.04 0.06 0.00 -1.13 -0.57 0.00 0.00 179.45 177.77 1oa1 n SER 133 N -3.87 2.41 -0.52 0.86 3.41 -0.78 -4.54 113.62 110.60 1oa1 n SER 133 Ca -0.03 -1.68 0.08 0.00 -0.26 0.00 0.00 58.87 56.98 1oa1 n SER 133 Cb 0.15 -0.05 0.18 0.00 -0.26 0.00 0.00 64.21 64.24 1oa1 n SER 133 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1oa1 n VAL 134 N 0.85 1.87 -1.48 -3.33 0.24 -1.13 -4.71 118.33 110.64 1oa1 n VAL 134 Ca 0.10 -1.80 0.00 0.00 -2.04 0.00 0.00 64.34 60.59 1oa1 n VAL 134 Cb 0.39 -0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.68 1oa1 n VAL 134 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1oa1 n GLY 135 N -0.67 0.79 0.36 7.63 0.00 -1.26 -4.80 105.19 107.25 1oa1 n GLY 135 Ca 0.16 -1.89 0.02 0.00 0.00 0.00 0.00 46.02 44.31 1oa1 n GLY 135 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1oa1 h ILE 136 N -0.12 1.14 0.00 -0.61 2.04 -1.96 -1.67 117.51 116.34 1oa1 h ILE 136 Ca 0.00 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.49 1oa1 h ILE 136 Cb 0.00 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.04 1oa1 h ILE 136 CO 0.00 0.20 0.00 0.18 0.00 0.00 0.00 178.15 178.53 1oa1 n LEU 137 N -4.45 0.00 0.27 1.44 4.77 -1.26 -2.43 117.00 115.35 1oa1 n LEU 137 Ca 0.12 0.27 0.15 0.00 -0.03 0.00 0.00 56.01 56.51 1oa1 n LEU 137 Cb 0.11 -0.27 0.77 0.00 -2.33 0.00 0.00 43.42 41.71 1oa1 n LEU 137 CO 0.35 -0.08 1.00 0.00 -1.33 0.00 0.00 177.39 177.32 1oa1 h ALA 138 N 3.02 1.18 -2.25 -1.18 0.00 -1.58 -3.38 119.26 115.07 1oa1 h ALA 138 Ca 0.00 -0.08 -0.61 0.00 0.00 0.00 0.00 54.91 54.22 1oa1 h ALA 138 Cb 0.19 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 17.86 1oa1 h ALA 138 CO 0.00 0.11 0.35 0.99 0.00 0.00 0.00 179.25 180.70 1oa1 s THR 139 N -4.07 4.80 -0.05 0.00 2.01 -1.02 -4.97 115.64 112.35 1oa1 s THR 139 Ca -0.02 1.04 -0.20 0.00 0.31 0.00 0.00 61.69 62.82 1oa1 s THR 139 Cb 0.12 -4.14 -0.31 0.00 0.01 0.00 0.00 72.50 68.18 1oa1 s THR 139 CO 0.56 -0.28 0.85 -0.08 -0.69 0.00 0.00 174.62 174.98 1oa1 h GLU 140 N 8.23 0.33 -6.52 4.92 4.57 -1.88 -3.45 114.58 120.78 1oa1 h GLU 140 Ca -0.25 -0.56 -0.53 0.00 -1.18 0.00 0.00 59.36 56.84 1oa1 h GLU 140 Cb 1.10 0.21 -0.00 0.00 -0.16 0.00 0.00 28.75 29.90 1oa1 h GLU 140 CO 0.88 1.27 0.50 1.21 -1.18 0.00 0.00 179.01 181.69 1oa1 s ASN 141 N -7.08 7.18 0.36 1.04 3.84 -1.26 -4.92 114.94 114.11 1oa1 s ASN 141 Ca -0.14 1.98 0.17 0.00 0.21 0.00 0.00 52.86 55.08 1oa1 s ASN 141 Cb 0.02 -2.59 0.67 0.00 -0.55 0.00 0.00 41.25 38.80 1oa1 s ASN 141 CO 0.84 -0.36 1.74 1.05 -2.79 0.00 0.00 177.10 177.58 1oa1 h GLU 142 N 6.28 0.00 0.01 0.43 4.11 -1.99 -0.10 114.58 123.32 1oa1 h GLU 142 Ca -0.42 0.00 -0.22 0.00 0.07 0.00 0.00 59.36 58.79 1oa1 h GLU 142 Cb 1.21 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.48 1oa1 h GLU 142 CO 0.77 0.40 -0.86 -0.44 0.07 0.00 0.00 179.01 178.96 1oa1 h ASP 143 N 0.00 0.74 -0.51 3.06 3.32 -1.98 -0.75 116.42 120.30 1oa1 h ASP 143 Ca -0.00 -0.76 -0.02 0.00 0.02 0.00 0.00 57.03 56.27 1oa1 h ASP 143 Cb 0.88 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 1oa1 h ASP 143 CO 0.05 1.40 0.24 0.58 -1.72 0.00 0.00 179.24 179.79 1oa1 h VAL 144 N 0.16 1.20 -0.31 -1.35 2.07 -1.93 -0.92 116.25 115.18 1oa1 h VAL 144 Ca -0.11 -0.58 0.01 0.00 0.82 0.00 0.00 66.70 66.84 1oa1 h VAL 144 Cb 1.54 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 1oa1 h VAL 144 CO 0.17 0.23 0.19 -0.09 0.02 0.00 0.00 177.57 178.09 1oa1 h ARG 145 N 0.68 0.38 -0.27 1.57 2.43 -1.03 -0.61 114.38 117.54 1oa1 h ARG 145 Ca 0.17 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.31 1oa1 h ARG 145 Cb 0.14 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1oa1 h ARG 145 CO -0.02 0.25 0.14 1.03 -1.51 0.00 0.00 179.97 179.86 1oa1 h SER 146 N 0.40 0.34 0.06 -3.80 0.87 -0.94 -0.13 113.55 110.35 1oa1 h SER 146 Ca 0.12 -0.10 -0.16 0.00 -1.23 0.00 0.00 61.79 60.41 1oa1 h SER 146 Cb -0.02 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 1oa1 h SER 146 CO -0.04 0.35 -0.58 -0.07 -0.53 0.00 0.00 176.83 175.96 1oa1 h LEU 147 N 0.31 0.59 -0.48 2.23 3.38 -1.06 0.70 115.31 120.97 1oa1 h LEU 147 Ca 0.09 -0.33 -0.09 0.00 0.09 0.00 0.00 57.88 57.64 1oa1 h LEU 147 Cb 0.09 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1oa1 h LEU 147 CO -0.01 1.04 -0.07 0.03 0.09 0.00 0.00 178.44 179.52 1oa1 h ARG 148 N 0.40 0.90 0.08 1.13 3.08 -1.05 -2.30 114.38 116.62 1oa1 h ARG 148 Ca 0.00 -0.32 -0.25 0.00 0.07 0.00 0.00 59.98 59.48 1oa1 h ARG 148 Cb 1.12 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.11 1oa1 h ARG 148 CO 0.11 0.97 -1.13 0.93 -1.07 0.00 0.00 179.97 179.78 1oa1 h GLU 149 N 0.75 0.31 -0.80 0.04 4.39 -0.92 -1.95 114.58 116.41 1oa1 h GLU 149 Ca 0.13 -0.45 0.08 0.00 0.34 0.00 0.00 59.36 59.46 1oa1 h GLU 149 Cb 0.61 0.15 -0.07 0.00 -0.10 0.00 0.00 28.75 29.34 1oa1 h GLU 149 CO 0.04 1.17 0.46 1.25 -1.16 0.00 0.00 179.01 180.77 1oa1 h LEU 150 N 0.13 0.69 -0.08 1.33 5.85 -0.91 0.17 115.31 122.48 1oa1 h LEU 150 Ca -0.11 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1oa1 h LEU 150 Cb 1.82 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.75 1oa1 h LEU 150 CO 0.19 0.42 0.03 0.25 -0.34 0.00 0.00 178.44 178.98 1oa1 h LEU 151 N 0.81 0.11 -0.66 2.25 5.85 -1.28 -1.07 115.31 121.33 1oa1 h LEU 151 Ca 0.37 -0.18 -0.12 0.00 0.84 0.00 0.00 57.88 58.79 1oa1 h LEU 151 Cb 0.28 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1oa1 h LEU 151 CO -0.22 0.26 -0.26 0.40 -0.34 0.00 0.00 178.44 178.29 1oa1 h ILE 152 N -0.05 1.27 -0.09 4.05 2.04 -0.99 0.10 117.51 123.84 1oa1 h ILE 152 Ca 0.03 -1.39 -0.01 0.00 1.00 0.00 0.00 64.86 64.49 1oa1 h ILE 152 Cb 0.19 1.27 -0.00 0.00 -0.74 0.00 0.00 36.82 37.53 1oa1 h ILE 152 CO -0.00 0.46 0.02 0.40 0.00 0.00 0.00 178.15 179.03 1oa1 h ILE 153 N 0.66 1.19 -0.94 -0.67 2.04 -0.61 -0.24 117.51 118.94 1oa1 h ILE 153 Ca 0.08 -0.59 0.02 0.00 1.00 0.00 0.00 64.86 65.38 1oa1 h ILE 153 Cb 0.78 1.41 -0.05 0.00 -0.74 0.00 0.00 36.82 38.22 1oa1 h ILE 153 CO 0.06 0.17 0.62 1.23 0.00 0.00 0.00 178.15 180.23 1oa1 h GLY 154 N -0.06 1.34 1.13 5.37 0.00 -1.07 -2.84 103.07 106.94 1oa1 h GLY 154 Ca 0.03 -0.48 -0.03 0.00 0.00 0.00 0.00 47.33 46.85 1oa1 h GLY 154 CO 0.00 0.45 0.37 -2.00 0.00 0.00 0.00 176.54 175.36 1oa1 h LEU 155 N 1.24 1.02 -0.66 3.11 5.85 -0.44 -1.43 115.31 124.01 1oa1 h LEU 155 Ca 0.36 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 1oa1 h LEU 155 Cb -0.09 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.65 1oa1 h LEU 155 CO -0.09 0.87 0.31 0.11 -0.34 0.00 0.00 178.44 179.30 1oa1 h LYS 156 N 1.11 0.95 -0.37 1.25 1.57 -0.82 0.12 116.57 120.38 1oa1 h LYS 156 Ca 0.27 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1oa1 h LYS 156 Cb 0.12 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 1oa1 h LYS 156 CO -0.03 0.76 0.22 0.78 -0.57 0.00 0.00 179.45 180.61 1oa1 h GLY 157 N 0.91 0.54 1.02 3.86 0.00 -1.22 -1.61 103.07 106.57 1oa1 h GLY 157 Ca 0.23 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1oa1 h GLY 157 CO -0.03 0.22 0.57 -2.08 0.00 0.00 0.00 176.54 175.22 1oa1 h VAL 158 N 0.48 1.25 -0.68 4.60 2.07 -0.91 -2.61 116.25 120.46 1oa1 h VAL 158 Ca 0.13 -0.54 -0.04 0.00 0.82 0.00 0.00 66.70 67.08 1oa1 h VAL 158 Cb 0.01 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 29.68 1oa1 h VAL 158 CO -0.02 0.26 0.27 0.00 0.02 0.00 0.00 177.57 178.10 1oa1 h ALA 159 N 1.31 1.20 -0.07 1.67 0.00 -0.39 -0.33 119.26 122.65 1oa1 h ALA 159 Ca 0.33 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1oa1 h ALA 159 Cb -0.07 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 1oa1 h ALA 159 CO -0.06 0.58 0.04 0.00 0.00 0.00 0.00 179.25 179.81 1oa1 h ALA 160 N 1.32 0.09 -0.75 0.00 0.00 -0.93 0.11 119.26 119.09 1oa1 h ALA 160 Ca 0.23 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 1oa1 h ALA 160 Cb 0.19 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1oa1 h ALA 160 CO -0.02 -0.40 0.24 1.88 0.00 0.00 0.00 179.25 180.95 1oa1 h TYR 161 N 0.06 1.20 -0.36 0.00 0.05 -1.20 -2.31 116.97 114.41 1oa1 h TYR 161 Ca 0.02 -0.12 -0.05 0.00 0.05 0.00 0.00 58.73 58.63 1oa1 h TYR 161 Cb 0.03 -0.35 -0.02 0.00 1.01 0.00 0.00 36.73 37.41 1oa1 h TYR 161 CO -0.06 0.94 0.00 0.00 -1.05 0.00 0.00 178.16 178.00 1oa1 h ALA 162 N 1.14 1.34 -0.39 3.88 0.00 -0.78 -1.70 119.26 122.75 1oa1 h ALA 162 Ca 0.24 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1oa1 h ALA 162 Cb 0.30 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1oa1 h ALA 162 CO -0.01 0.46 0.11 1.49 0.00 0.00 0.00 179.25 181.30 1oa1 h GLU 163 N 0.54 0.61 -0.70 0.00 4.57 -0.27 -0.23 114.58 119.09 1oa1 h GLU 163 Ca 0.11 -0.14 -0.06 0.00 -1.18 0.00 0.00 59.36 58.10 1oa1 h GLU 163 Cb 0.34 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.81 1oa1 h GLU 163 CO 0.01 0.63 0.20 0.45 -1.18 0.00 0.00 179.01 179.12 1oa1 h HIS 164 N 0.48 1.13 -0.59 0.92 3.86 -1.07 -0.50 115.15 119.38 1oa1 h HIS 164 Ca 0.12 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 59.19 1oa1 h HIS 164 Cb 0.28 -0.33 -0.03 0.00 1.06 0.00 0.00 27.41 28.40 1oa1 h HIS 164 CO 0.01 0.90 0.24 0.00 0.86 0.00 0.00 177.93 179.94 1oa1 h ALA 165 N 1.17 0.76 -0.67 2.45 0.00 -1.10 -2.83 119.26 119.05 1oa1 h ALA 165 Ca 0.23 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1oa1 h ALA 165 Cb 0.31 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1oa1 h ALA 165 CO -0.01 0.37 0.20 0.00 0.00 0.00 0.00 179.25 179.81 1oa1 h ALA 166 N 1.09 1.09 -0.87 0.00 0.00 -0.59 -0.67 119.26 119.30 1oa1 h ALA 166 Ca 0.20 -0.21 0.10 0.00 0.00 0.00 0.00 54.91 54.99 1oa1 h ALA 166 Cb 0.19 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 1oa1 h ALA 166 CO -0.02 0.62 0.56 0.28 0.00 0.00 0.00 179.25 180.69 1oa1 h VAL 167 N 0.99 0.95 -0.02 0.00 2.07 -0.92 -1.06 116.25 118.26 1oa1 h VAL 167 Ca 0.22 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1oa1 h VAL 167 Cb 0.29 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.11 1oa1 h VAL 167 CO -0.01 0.15 0.00 0.18 0.02 0.00 0.00 177.57 177.92 1oa1 n LEU 168 N -4.53 1.16 0.00 2.57 4.77 -0.64 -4.93 117.00 115.41 1oa1 n LEU 168 Ca 0.15 -0.40 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 1oa1 n LEU 168 Cb 0.32 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1oa1 n LEU 168 CO 0.31 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1oa1 n GLY 169 N 1.12 0.82 3.28 -0.72 0.00 -0.40 -5.06 105.19 104.23 1oa1 n GLY 169 Ca 0.20 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 1oa1 n GLY 169 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1oa1 s PHE 170 N -2.00 2.91 0.02 1.61 0.08 -0.35 -4.97 117.98 115.27 1oa1 s PHE 170 Ca 0.00 -1.06 -0.06 0.00 0.12 0.00 0.00 56.93 55.93 1oa1 s PHE 170 Cb 0.00 -2.04 -0.01 0.00 -0.57 0.00 0.00 43.02 40.40 1oa1 s PHE 170 CO 0.00 -0.57 0.10 0.50 -0.10 0.00 0.00 175.22 175.15 1oa1 s ARG 171 N 1.33 0.50 -0.04 0.44 6.06 -1.26 -2.46 118.95 123.51 1oa1 s ARG 171 Ca 0.04 -0.54 0.01 0.00 -2.50 0.00 0.00 55.73 52.75 1oa1 s ARG 171 Cb -0.14 0.20 0.02 0.00 0.06 0.00 0.00 34.95 35.09 1oa1 s ARG 171 CO -0.04 -0.12 -0.06 0.15 -2.50 0.00 0.00 175.30 172.73 1oa1 s LYS 172 N -1.78 0.86 0.39 5.12 1.02 -1.26 -5.04 119.74 119.04 1oa1 s LYS 172 Ca -0.12 -0.15 0.08 0.00 0.02 0.00 0.00 55.97 55.80 1oa1 s LYS 172 Cb -0.06 -0.83 0.84 0.00 -0.52 0.00 0.00 37.83 37.25 1oa1 s LYS 172 CO -0.01 -0.03 1.97 0.00 -0.92 0.00 0.00 175.35 176.36 1oa1 h THR 173 N 5.96 0.99 -0.49 2.17 1.03 -2.01 -1.61 112.91 118.95 1oa1 h THR 173 Ca -0.37 -0.22 0.00 0.00 -0.01 0.00 0.00 66.41 65.82 1oa1 h THR 173 Cb 1.16 0.30 -0.02 0.00 -1.07 0.00 0.00 68.15 68.51 1oa1 h THR 173 CO 0.48 0.12 0.31 -0.33 -0.01 0.00 0.00 175.52 176.08 1oa1 h GLU 174 N 0.64 0.65 0.14 0.00 3.07 -1.98 -0.22 114.58 116.87 1oa1 h GLU 174 Ca 0.29 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.10 1oa1 h GLU 174 Cb 0.32 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.09 1oa1 h GLU 174 CO -0.09 0.44 -0.07 0.82 -1.40 0.00 0.00 179.01 178.71 1oa1 h ILE 175 N 0.66 0.99 -0.24 3.13 2.04 -1.70 -1.04 117.51 121.36 1oa1 h ILE 175 Ca 0.18 -0.61 -0.10 0.00 1.00 0.00 0.00 64.86 65.33 1oa1 h ILE 175 Cb -0.05 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1oa1 h ILE 175 CO -0.04 0.14 -0.26 0.44 0.00 0.00 0.00 178.15 178.43 1oa1 h ASP 176 N -0.48 0.46 -0.68 1.72 3.32 -1.47 -1.59 116.42 117.70 1oa1 h ASP 176 Ca -0.02 -0.16 -0.04 0.00 0.02 0.00 0.00 57.03 56.84 1oa1 h ASP 176 Cb 0.38 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.77 1oa1 h ASP 176 CO 0.03 0.72 0.29 -0.33 -1.72 0.00 0.00 179.24 178.23 1oa1 h GLU 177 N 0.40 1.01 -0.09 3.56 5.08 -1.05 -2.92 114.58 120.57 1oa1 h GLU 177 Ca 0.06 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.14 1oa1 h GLU 177 Cb 0.68 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1oa1 h GLU 177 CO 0.05 0.83 -0.40 0.35 -1.00 0.00 0.00 179.01 178.84 1oa1 h PHE 178 N 0.96 0.22 -0.54 4.33 3.57 -0.53 -1.13 116.94 123.82 1oa1 h PHE 178 Ca 0.23 -0.06 0.09 0.00 3.53 0.00 0.00 57.97 61.76 1oa1 h PHE 178 Cb 0.19 -0.05 -0.07 0.00 2.79 0.00 0.00 35.95 38.80 1oa1 h PHE 178 CO 0.01 0.56 0.13 0.52 -2.23 0.00 0.00 178.31 177.31 1oa1 h MET 179 N 0.16 0.26 -0.06 1.11 2.86 -1.12 0.50 114.93 118.65 1oa1 h MET 179 Ca 0.02 -0.02 -0.25 0.00 -2.06 0.00 0.00 59.70 57.39 1oa1 h MET 179 Cb 0.78 -0.06 0.02 0.00 0.06 0.00 0.00 31.60 32.39 1oa1 h MET 179 CO 0.06 0.17 -0.93 -0.07 1.06 0.00 0.00 176.91 177.20 1oa1 h LEU 180 N 0.27 0.90 -0.28 1.22 3.38 -1.40 -1.53 115.31 117.88 1oa1 h LEU 180 Ca 0.27 -0.66 0.05 0.00 0.09 0.00 0.00 57.88 57.63 1oa1 h LEU 180 Cb 0.37 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 1oa1 h LEU 180 CO -0.34 1.46 -0.05 -0.08 0.09 0.00 0.00 178.44 179.52 1oa1 h GLU 181 N 0.44 0.02 0.09 1.13 4.81 -0.87 0.45 114.58 120.65 1oa1 h GLU 181 Ca -0.10 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1oa1 h GLU 181 Cb 1.57 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.95 1oa1 h GLU 181 CO 0.18 0.01 -0.04 0.00 -0.73 0.00 0.00 179.01 178.43 1oa1 h ALA 182 N 1.27 -0.12 -0.49 2.92 0.00 -0.90 -1.12 119.26 120.81 1oa1 h ALA 182 Ca 0.13 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1oa1 h ALA 182 Cb 0.20 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1oa1 h ALA 182 CO -0.27 -0.48 0.32 -0.07 0.00 0.00 0.00 179.25 178.75 1oa1 h LEU 183 N -0.29 0.54 -1.27 0.00 3.38 -1.18 -2.48 115.31 114.01 1oa1 h LEU 183 Ca -0.01 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 1oa1 h LEU 183 Cb 0.25 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1oa1 h LEU 183 CO 0.02 0.39 -0.14 0.00 0.09 0.00 0.00 178.44 178.80 1oa1 h ALA 184 N 1.19 1.39 0.00 1.53 0.00 -0.82 -2.57 119.26 119.99 1oa1 h ALA 184 Ca 0.19 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1oa1 h ALA 184 Cb -0.05 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1oa1 h ALA 184 CO -0.06 0.42 -0.02 0.66 0.00 0.00 0.00 179.25 180.25 1oa1 h SER 185 N 0.31 0.00 0.02 0.00 4.64 -0.72 -1.52 113.55 116.27 1oa1 h SER 185 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1oa1 h SER 185 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1oa1 h SER 185 CO 0.03 0.02 0.00 0.35 -0.87 0.00 0.00 176.83 176.35 1oa1 n THR 186 N -4.29 0.00 0.84 2.95 -2.24 -0.97 -1.74 114.28 108.84 1oa1 n THR 186 Ca -0.03 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.85 1oa1 n THR 186 Cb 0.10 -0.54 0.07 0.00 -2.10 0.00 0.00 70.33 67.86 1oa1 n THR 186 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1oa1 n THR 187 N -1.01 0.00 -4.10 4.28 -2.24 -0.57 -5.01 114.28 105.62 1oa1 n THR 187 Ca 0.22 -0.47 -0.28 0.00 -2.27 0.00 0.00 64.05 61.25 1oa1 n THR 187 Cb 0.10 1.39 -0.06 0.00 -2.10 0.00 0.00 70.33 69.66 1oa1 n THR 187 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1oa1 s LYS 188 N -1.76 2.76 -0.72 -0.78 1.02 -0.71 -4.92 119.74 114.63 1oa1 s LYS 188 Ca 0.22 -0.87 -0.19 0.00 0.02 0.00 0.00 55.97 55.15 1oa1 s LYS 188 Cb 0.17 -2.59 0.12 0.00 -0.52 0.00 0.00 37.83 35.00 1oa1 s LYS 188 CO 0.29 0.50 0.87 0.34 -0.92 0.00 0.00 175.35 176.43 1oa1 s ASP 189 N -2.83 6.36 0.16 2.83 2.15 -1.26 -5.02 116.67 119.06 1oa1 s ASP 189 Ca 0.29 -1.66 0.08 0.00 0.43 0.00 0.00 52.55 51.69 1oa1 s ASP 189 Cb -0.11 -2.34 -0.04 0.00 -0.30 0.00 0.00 42.92 40.14 1oa1 s ASP 189 CO 0.22 -1.10 -0.07 -0.76 -0.17 0.00 0.00 175.17 173.29 1oa1 s LEU 190 N 2.65 3.09 0.84 -1.34 1.43 -1.26 -5.12 118.68 118.97 1oa1 s LEU 190 Ca 0.20 -0.47 -0.11 0.00 -1.03 0.00 0.00 54.13 52.71 1oa1 s LEU 190 Cb -0.16 -1.80 0.10 0.00 0.03 0.00 0.00 46.19 44.36 1oa1 s LEU 190 CO 0.01 0.12 1.09 -0.94 0.23 0.00 0.00 176.35 176.86 1oa1 s SER 191 N -2.69 3.93 0.19 2.29 1.04 -1.26 -4.81 113.70 112.39 1oa1 s SER 191 Ca 0.25 1.61 -0.12 0.00 0.48 0.00 0.00 55.95 58.16 1oa1 s SER 191 Cb -0.10 -2.30 0.11 0.00 0.10 0.00 0.00 66.02 63.83 1oa1 s SER 191 CO 0.16 -2.37 1.85 0.58 0.98 0.00 0.00 173.24 174.44 1oa1 h VAL 192 N -1.36 1.15 -0.59 5.02 2.07 -2.00 -0.39 116.25 120.15 1oa1 h VAL 192 Ca -0.47 -0.28 0.05 0.00 0.82 0.00 0.00 66.70 66.82 1oa1 h VAL 192 Cb 1.26 0.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 1oa1 h VAL 192 CO 0.54 0.15 0.31 0.44 0.02 0.00 0.00 177.57 179.02 1oa1 h ASP 193 N 0.83 0.45 -0.45 0.57 3.32 -1.99 0.11 116.42 119.25 1oa1 h ASP 193 Ca 0.23 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.28 1oa1 h ASP 193 Cb -0.08 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1oa1 h ASP 193 CO -0.06 0.30 0.15 -0.33 -1.72 0.00 0.00 179.24 177.58 1oa1 h GLU 194 N 0.58 0.70 -0.60 3.56 5.08 -1.79 -1.13 114.58 120.98 1oa1 h GLU 194 Ca 0.26 -0.15 -0.09 0.00 -1.00 0.00 0.00 59.36 58.38 1oa1 h GLU 194 Cb 0.17 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 1oa1 h GLU 194 CO -0.18 0.67 0.01 0.52 -1.00 0.00 0.00 179.01 179.03 1oa1 h MET 195 N 0.59 1.06 -0.46 2.33 2.86 -0.65 -1.69 114.93 118.97 1oa1 h MET 195 Ca 0.15 -0.33 -0.13 0.00 -2.06 0.00 0.00 59.70 57.33 1oa1 h MET 195 Cb 0.25 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1oa1 h MET 195 CO -0.01 1.03 -0.22 0.28 1.06 0.00 0.00 176.91 179.06 1oa1 h VAL 196 N 0.96 1.27 -0.65 -2.22 2.07 -0.71 -2.67 116.25 114.30 1oa1 h VAL 196 Ca 0.17 -1.37 -0.02 0.00 0.82 0.00 0.00 66.70 66.30 1oa1 h VAL 196 Cb 0.55 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 1oa1 h VAL 196 CO 0.03 0.47 0.32 0.00 0.02 0.00 0.00 177.57 178.41 1oa1 h ALA 197 N 0.93 1.34 -0.76 1.67 0.00 -0.96 -0.96 119.26 120.50 1oa1 h ALA 197 Ca 0.11 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1oa1 h ALA 197 Cb 0.78 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1oa1 h ALA 197 CO 0.06 0.52 0.26 -0.07 0.00 0.00 0.00 179.25 180.03 1oa1 h LEU 198 N 0.92 1.09 -0.74 0.00 3.38 -1.14 0.45 115.31 119.27 1oa1 h LEU 198 Ca 0.23 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1oa1 h LEU 198 Cb 0.09 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 1oa1 h LEU 198 CO -0.03 1.00 0.24 0.58 0.09 0.00 0.00 178.44 180.32 1oa1 h VAL 199 N 1.13 1.26 -0.37 1.22 2.07 -1.02 -0.40 116.25 120.14 1oa1 h VAL 199 Ca 0.25 -0.89 -0.13 0.00 0.82 0.00 0.00 66.70 66.75 1oa1 h VAL 199 Cb 0.28 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1oa1 h VAL 199 CO -0.01 0.35 -0.30 0.24 0.02 0.00 0.00 177.57 177.87 1oa1 h MET 200 N 1.09 0.80 -0.76 1.57 2.86 -0.82 -1.49 114.93 118.17 1oa1 h MET 200 Ca 0.24 -0.36 -0.03 0.00 -2.06 0.00 0.00 59.70 57.49 1oa1 h MET 200 Cb 0.29 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.90 1oa1 h MET 200 CO -0.01 0.99 0.37 -0.22 1.06 0.00 0.00 176.91 179.10 1oa1 h LYS 201 N 0.68 1.09 -0.84 1.72 3.64 -0.73 -1.39 116.57 120.74 1oa1 h LYS 201 Ca 0.08 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.28 1oa1 h LYS 201 Cb 0.84 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 32.42 1oa1 h LYS 201 CO 0.07 0.84 0.45 0.00 -2.27 0.00 0.00 179.45 178.54 1oa1 h ALA 202 N 1.32 1.08 -0.76 5.00 0.00 -0.50 0.87 119.26 126.26 1oa1 h ALA 202 Ca 0.26 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.07 1oa1 h ALA 202 Cb 0.11 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 1oa1 h ALA 202 CO -0.03 0.61 0.48 0.78 0.00 0.00 0.00 179.25 181.09 1oa1 h GLY 203 N 1.18 1.10 1.41 0.00 0.00 -0.59 0.16 103.07 106.33 1oa1 h GLY 203 Ca 0.30 -0.36 -0.05 0.00 0.00 0.00 0.00 47.33 47.21 1oa1 h GLY 203 CO -0.04 0.31 0.07 -1.33 0.00 0.00 0.00 176.54 175.54 1oa1 h GLY 204 N 0.94 0.79 2.00 4.60 0.00 -0.48 -1.43 103.07 109.49 1oa1 h GLY 204 Ca 0.30 -0.47 -0.11 0.00 0.00 0.00 0.00 47.33 47.06 1oa1 h GLY 204 CO -0.11 0.44 -0.51 -0.33 0.00 0.00 0.00 176.54 176.03 1oa1 h MET 205 N 0.71 0.00 -0.63 4.80 2.86 -0.37 -1.49 114.93 120.80 1oa1 h MET 205 Ca 0.15 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.71 1oa1 h MET 205 Cb 0.33 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 1oa1 h MET 205 CO 0.01 0.51 0.06 0.00 1.06 0.00 0.00 176.91 178.54 1oa1 h ALA 206 N 1.49 0.90 0.04 6.32 0.00 -0.13 0.32 119.26 128.21 1oa1 h ALA 206 Ca -0.01 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1oa1 h ALA 206 Cb 0.99 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1oa1 h ALA 206 CO 0.07 0.66 -0.02 0.28 0.00 0.00 0.00 179.25 180.24 1oa1 h VAL 207 N 0.99 0.97 -0.51 0.00 2.07 -0.84 0.69 116.25 119.64 1oa1 h VAL 207 Ca 0.19 -0.03 0.08 0.00 0.82 0.00 0.00 66.70 67.76 1oa1 h VAL 207 Cb 0.49 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 31.19 1oa1 h VAL 207 CO 0.02 0.01 0.14 0.74 0.02 0.00 0.00 177.57 178.50 1oa1 h THR 208 N -0.06 0.77 -0.06 2.57 2.02 -1.06 -0.31 112.91 116.78 1oa1 h THR 208 Ca -0.00 -0.10 -0.24 0.00 0.77 0.00 0.00 66.41 66.83 1oa1 h THR 208 Cb 0.05 0.45 0.01 0.00 -1.74 0.00 0.00 68.15 66.92 1oa1 h THR 208 CO 0.01 0.05 -0.91 0.74 0.37 0.00 0.00 175.52 175.78 1oa1 h THR 209 N 0.30 1.30 -0.72 3.16 2.02 -0.69 -0.97 112.91 117.31 1oa1 h THR 209 Ca 0.25 -2.17 -0.07 0.00 0.77 0.00 0.00 66.41 65.19 1oa1 h THR 209 Cb 0.31 2.22 -0.03 0.00 -1.74 0.00 0.00 68.15 68.91 1oa1 h THR 209 CO -0.29 0.67 0.17 0.24 0.37 0.00 0.00 175.52 176.68 1oa1 h MET 210 N 0.41 1.15 -0.77 6.66 2.86 -0.72 0.31 114.93 124.83 1oa1 h MET 210 Ca -0.09 -0.28 -0.02 0.00 -2.06 0.00 0.00 59.70 57.25 1oa1 h MET 210 Cb 1.55 -0.15 -0.04 0.00 0.06 0.00 0.00 31.60 33.02 1oa1 h MET 210 CO 0.18 1.01 0.41 0.00 1.06 0.00 0.00 176.91 179.57 1oa1 h ALA 211 N 1.09 0.99 -0.52 6.32 0.00 -0.88 -0.99 119.26 125.27 1oa1 h ALA 211 Ca 0.22 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1oa1 h ALA 211 Cb 0.38 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1oa1 h ALA 211 CO 0.00 0.52 0.14 1.25 0.00 0.00 0.00 179.25 181.16 1oa1 h LEU 212 N 1.08 0.77 -0.56 0.00 5.85 -0.66 -0.70 115.31 121.09 1oa1 h LEU 212 Ca 0.27 -0.22 -0.13 0.00 0.84 0.00 0.00 57.88 58.64 1oa1 h LEU 212 Cb 0.06 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1oa1 h LEU 212 CO -0.04 0.79 -0.21 0.25 -0.34 0.00 0.00 178.44 178.89 1oa1 h LEU 213 N 0.72 0.95 -0.61 2.25 5.85 -0.77 0.41 115.31 124.12 1oa1 h LEU 213 Ca 0.16 -0.35 0.01 0.00 0.84 0.00 0.00 57.88 58.54 1oa1 h LEU 213 Cb 0.31 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 1oa1 h LEU 213 CO -0.00 1.13 0.40 -0.78 -0.34 0.00 0.00 178.44 178.85 1oa1 h ASP 214 N 0.81 0.69 -0.38 1.25 3.58 -1.02 0.10 116.42 121.44 1oa1 h ASP 214 Ca 0.11 -0.02 0.01 0.00 0.42 0.00 0.00 57.03 57.55 1oa1 h ASP 214 Cb 0.77 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 41.63 1oa1 h ASP 214 CO 0.06 0.50 0.24 -0.08 -2.88 0.00 0.00 179.24 177.08 1oa1 h GLU 215 N 0.81 0.48 -0.03 0.28 4.81 -0.78 -1.58 114.58 118.58 1oa1 h GLU 215 Ca 0.22 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1oa1 h GLU 215 Cb -0.09 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.18 1oa1 h GLU 215 CO -0.05 0.32 0.01 0.00 -0.73 0.00 0.00 179.01 178.56 1oa1 h ALA 216 N 1.15 0.04 -0.40 2.92 0.00 -0.42 0.44 119.26 122.99 1oa1 h ALA 216 Ca 0.14 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1oa1 h ALA 216 Cb -0.04 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1oa1 h ALA 216 CO -0.04 -0.37 0.08 -0.91 0.00 0.00 0.00 179.25 178.01 1oa1 h ASN 217 N -0.13 0.61 0.50 0.00 2.35 -0.78 -2.27 115.58 115.86 1oa1 h ASN 217 Ca 0.01 -0.24 -0.24 0.00 -0.55 0.00 0.00 56.30 55.27 1oa1 h ASN 217 Cb 0.18 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.40 1oa1 h ASN 217 CO -0.00 0.70 -1.07 0.71 -1.65 0.00 0.00 177.43 176.11 1oa1 h THR 218 N 0.50 1.46 -0.84 2.81 1.35 -1.24 -0.41 112.91 116.54 1oa1 h THR 218 Ca 0.12 -2.74 -0.03 0.00 -0.55 0.00 0.00 66.41 63.21 1oa1 h THR 218 Cb 0.33 2.66 -0.04 0.00 -1.73 0.00 0.00 68.15 69.37 1oa1 h THR 218 CO 0.00 0.81 0.40 0.74 -0.25 0.00 0.00 175.52 177.22 1oa1 h THR 219 N 0.15 1.26 0.20 6.82 2.02 -0.92 -0.45 112.91 121.98 1oa1 h THR 219 Ca -0.10 -0.73 -0.29 0.00 0.77 0.00 0.00 66.41 66.06 1oa1 h THR 219 Cb 1.75 0.19 0.03 0.00 -1.74 0.00 0.00 68.15 68.37 1oa1 h THR 219 CO 0.18 0.31 -1.31 0.74 0.37 0.00 0.00 175.52 175.81 1oa1 h THR 220 N 1.20 1.28 -0.02 3.16 2.02 -1.34 -3.40 112.91 115.81 1oa1 h THR 220 Ca 0.29 -2.59 0.00 0.00 0.77 0.00 0.00 66.41 64.87 1oa1 h THR 220 Cb 0.12 3.03 0.00 0.00 -1.74 0.00 0.00 68.15 69.56 1oa1 h THR 220 CO -0.04 0.78 0.00 -1.22 0.37 0.00 0.00 175.52 175.41 1oa1 n TYR 221 N -3.85 0.02 0.00 3.16 4.01 -0.17 -4.96 117.16 115.37 1oa1 n TYR 221 Ca -0.18 -0.19 0.00 0.00 -0.16 0.00 0.00 57.90 57.37 1oa1 n TYR 221 Cb 1.00 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 40.01 1oa1 n TYR 221 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1oa1 n GLY 222 N -0.09 -0.14 3.73 2.72 0.00 -0.18 -2.11 105.19 109.13 1oa1 n GLY 222 Ca 0.01 -1.74 -0.41 0.00 0.00 0.00 0.00 46.02 43.88 1oa1 n GLY 222 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1oa1 s ASN 223 N -2.17 7.12 0.46 1.61 -0.87 -1.26 -4.27 114.94 115.56 1oa1 s ASN 223 Ca 0.00 2.17 -0.23 0.00 -1.57 0.00 0.00 52.86 53.23 1oa1 s ASN 223 Cb 0.00 -2.60 -0.09 0.00 -0.02 0.00 0.00 41.25 38.53 1oa1 s ASN 223 CO 0.00 -0.35 0.99 -2.65 -2.57 0.00 0.00 177.10 172.52 1oa1 n PRO 224 N 2.67 1.26 -4.18 -0.60 -0.02 -1.26 -4.40 135.00 128.47 1oa1 n PRO 224 Ca 0.05 0.46 -0.11 0.00 -2.02 0.00 0.00 63.50 61.87 1oa1 n PRO 224 Cb 0.45 -2.06 -0.10 0.00 -0.02 0.00 0.00 33.50 31.77 1oa1 n PRO 224 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1oa1 s GLU 225 N -2.14 0.93 0.11 -0.52 -1.05 -0.58 -4.46 118.70 111.00 1oa1 s GLU 225 Ca 0.65 -1.42 -0.31 0.00 -0.15 0.00 0.00 54.97 53.75 1oa1 s GLU 225 Cb -0.53 -0.09 -0.10 0.00 -0.44 0.00 0.00 34.13 32.97 1oa1 s GLU 225 CO 0.55 -0.12 1.79 0.42 0.95 0.00 0.00 175.26 178.85 1oa1 s ILE 226 N -3.76 2.62 -0.02 1.83 1.01 -1.25 -4.18 121.20 117.46 1oa1 s ILE 226 Ca 0.18 0.14 -0.01 0.00 0.00 0.00 0.00 60.65 60.96 1oa1 s ILE 226 Cb 0.06 -3.09 0.01 0.00 0.01 0.00 0.00 42.46 39.46 1oa1 s ILE 226 CO -0.01 0.00 0.04 -0.89 0.00 0.00 0.00 174.94 174.08 1oa1 s THR 227 N 2.68 -0.02 -0.33 2.92 2.01 0.16 -5.00 115.64 118.06 1oa1 s THR 227 Ca 0.79 0.07 -0.13 0.00 0.31 0.00 0.00 61.69 62.73 1oa1 s THR 227 Cb -0.45 -0.07 -0.02 0.00 0.01 0.00 0.00 72.50 71.97 1oa1 s THR 227 CO 0.35 0.03 0.25 -1.58 -0.69 0.00 0.00 174.62 172.98 1oa1 s GLN 228 N 0.37 3.55 -0.22 4.92 0.74 -1.26 -1.48 119.66 126.28 1oa1 s GLN 228 Ca -0.03 -0.59 -0.08 0.00 0.05 0.00 0.00 55.36 54.72 1oa1 s GLN 228 Cb -0.04 -3.79 -0.04 0.00 1.10 0.00 0.00 33.01 30.24 1oa1 s GLN 228 CO -0.01 -0.43 0.08 0.08 -0.55 0.00 0.00 175.29 174.46 1oa1 s VAL 229 N 1.76 4.70 0.19 1.34 1.01 0.55 -4.94 120.40 125.00 1oa1 s VAL 229 Ca 0.07 -0.06 -0.30 0.00 0.00 0.00 0.00 61.98 61.69 1oa1 s VAL 229 Cb -0.17 -3.16 -0.08 0.00 0.00 0.00 0.00 36.38 32.97 1oa1 s VAL 229 CO 0.11 0.39 1.24 0.21 0.00 0.00 0.00 175.10 177.05 1oa1 s ASN 230 N 0.94 7.01 0.00 3.32 2.47 -1.26 -1.18 114.94 126.24 1oa1 s ASN 230 Ca 0.04 2.30 0.08 0.00 0.42 0.00 0.00 52.86 55.70 1oa1 s ASN 230 Cb -0.14 -2.61 0.15 0.00 -1.45 0.00 0.00 41.25 37.20 1oa1 s ASN 230 CO 0.03 -0.44 0.98 2.30 -3.72 0.00 0.00 177.10 176.25 1oa1 n ILE 231 N 2.56 0.51 -1.63 -5.21 -5.35 -0.76 -1.86 119.36 107.62 1oa1 n ILE 231 Ca 0.05 -0.75 -0.04 0.00 -0.27 0.00 0.00 62.75 61.73 1oa1 n ILE 231 Cb 0.44 0.83 0.03 0.00 -1.74 0.00 0.00 39.64 39.20 1oa1 n ILE 231 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1oa1 n GLY 232 N 0.35 -0.38 3.42 3.28 0.00 -1.25 -4.53 105.19 106.08 1oa1 n GLY 232 Ca 0.07 -1.80 -0.21 0.00 0.00 0.00 0.00 46.02 44.08 1oa1 n GLY 232 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1oa1 s VAL 233 N -0.99 1.83 0.00 1.61 -7.23 -1.26 -4.84 120.40 109.52 1oa1 s VAL 233 Ca 0.12 -2.19 0.00 0.00 -1.81 0.00 0.00 61.98 58.09 1oa1 s VAL 233 Cb -0.00 -2.33 0.00 0.00 0.56 0.00 0.00 36.38 34.61 1oa1 s VAL 233 CO 0.08 -0.39 0.00 0.61 -0.31 0.00 0.00 175.10 175.09 1oa1 n GLY 234 N -0.55 2.57 0.50 2.32 0.00 -1.26 -5.06 105.19 103.71 1oa1 n GLY 234 Ca -0.06 -2.13 0.04 0.00 0.00 0.00 0.00 46.02 43.87 1oa1 n GLY 234 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1oa1 n LYS 235 N -0.66 2.77 -3.45 1.61 5.02 -1.26 -4.57 118.16 117.62 1oa1 n LYS 235 Ca 0.00 -1.89 -0.29 0.00 -2.02 0.00 0.00 58.31 54.12 1oa1 n LYS 235 Cb 0.00 -1.21 -0.03 0.00 -0.02 0.00 0.00 35.03 33.77 1oa1 n LYS 235 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1oa1 s ASN 236 N -0.99 6.44 0.69 4.39 0.01 -1.26 -4.72 114.94 119.51 1oa1 s ASN 236 Ca 0.18 0.64 -0.16 0.00 -0.71 0.00 0.00 52.86 52.80 1oa1 s ASN 236 Cb 0.09 -2.11 0.02 0.00 0.41 0.00 0.00 41.25 39.66 1oa1 s ASN 236 CO 0.12 -0.14 1.23 -2.16 -1.51 0.00 0.00 177.10 174.65 1oa1 s PRO 237 N -3.40 2.34 0.18 -0.60 0.04 -1.26 -4.41 135.00 127.88 1oa1 s PRO 237 Ca 0.42 1.86 0.01 0.00 0.04 0.00 0.00 61.00 63.33 1oa1 s PRO 237 Cb -0.11 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 1oa1 s PRO 237 CO 0.29 -1.71 0.04 0.20 0.04 0.00 0.00 177.00 175.86 1oa1 s GLY 238 N -1.79 1.25 -0.08 0.56 0.00 -1.26 -1.33 107.32 104.67 1oa1 s GLY 238 Ca 0.77 -1.61 0.04 0.00 0.00 0.00 0.00 44.72 43.93 1oa1 s GLY 238 CO 0.42 -1.48 -0.21 -0.42 0.00 0.00 0.00 173.10 171.41 1oa1 s ILE 239 N -3.82 2.41 -0.26 0.90 1.01 -0.33 -3.63 121.20 117.49 1oa1 s ILE 239 Ca 0.27 -0.92 -0.08 0.00 0.00 0.00 0.00 60.65 59.92 1oa1 s ILE 239 Cb 0.07 -1.93 -0.03 0.00 0.01 0.00 0.00 42.46 40.58 1oa1 s ILE 239 CO 0.05 0.56 0.10 -0.22 0.00 0.00 0.00 174.94 175.43 1oa1 s LEU 240 N -0.04 3.61 -0.15 2.97 2.96 -0.27 -1.12 118.68 126.64 1oa1 s LEU 240 Ca -0.06 -0.20 -0.04 0.00 -0.22 0.00 0.00 54.13 53.61 1oa1 s LEU 240 Cb -0.15 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.55 1oa1 s LEU 240 CO 0.05 -0.05 -0.01 -0.51 -1.32 0.00 0.00 176.35 174.50 1oa1 s ILE 241 N 1.64 4.16 0.35 6.68 2.07 -0.16 -0.60 121.20 135.34 1oa1 s ILE 241 Ca 0.06 -0.27 0.04 0.00 -1.41 0.00 0.00 60.65 59.07 1oa1 s ILE 241 Cb -0.15 -2.82 -0.05 0.00 0.13 0.00 0.00 42.46 39.56 1oa1 s ILE 241 CO 0.05 0.50 0.07 -0.55 -1.91 0.00 0.00 174.94 173.10 1oa1 s SER 242 N 0.18 2.58 0.00 4.50 0.15 -0.04 -0.94 113.70 120.13 1oa1 s SER 242 Ca -0.00 -1.45 0.00 0.00 0.70 0.00 0.00 55.95 55.20 1oa1 s SER 242 Cb -0.13 0.06 0.00 0.00 -1.71 0.00 0.00 66.02 64.23 1oa1 s SER 242 CO 0.02 -0.68 0.00 0.61 1.20 0.00 0.00 173.24 174.39 1oa1 n GLY 243 N -0.77 0.57 0.00 9.45 0.00 -1.26 -1.78 105.19 111.40 1oa1 n GLY 243 Ca -0.04 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.56 1oa1 n GLY 243 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1oa1 n HIS 244 N 3.32 0.00 -2.63 1.61 8.25 -1.26 -1.96 115.22 122.55 1oa1 n HIS 244 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.03 1oa1 n HIS 244 Cb 0.00 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.09 1oa1 n HIS 244 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1oa1 s ASP 245 N -0.53 6.76 0.35 0.41 -1.08 -1.26 -4.90 116.67 116.42 1oa1 s ASP 245 Ca 0.00 0.70 0.19 0.00 -0.52 0.00 0.00 52.55 52.92 1oa1 s ASP 245 Cb 0.00 -2.54 0.45 0.00 -1.46 0.00 0.00 42.92 39.37 1oa1 s ASP 245 CO 0.00 -1.08 1.62 -0.07 0.52 0.00 0.00 175.17 176.16 1oa1 h LEU 246 N 10.69 0.00 -0.53 -1.34 3.38 -1.97 -2.96 115.31 122.57 1oa1 h LEU 246 Ca -0.22 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.61 1oa1 h LEU 246 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1oa1 h LEU 246 CO 1.08 0.38 -0.32 0.50 0.09 0.00 0.00 178.44 180.17 1oa1 h LYS 247 N 0.00 0.85 -0.84 1.13 3.64 -1.95 -0.92 116.57 118.48 1oa1 h LYS 247 Ca -0.00 -0.40 0.03 0.00 -1.27 0.00 0.00 60.65 59.00 1oa1 h LYS 247 Cb 1.09 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.85 1oa1 h LYS 247 CO 0.05 1.05 0.54 -0.44 -2.27 0.00 0.00 179.45 178.38 1oa1 h ASP 248 N 0.72 0.91 -0.33 4.20 3.32 -1.96 -1.61 116.42 121.66 1oa1 h ASP 248 Ca 0.08 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.13 1oa1 h ASP 248 Cb 0.87 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.20 1oa1 h ASP 248 CO 0.08 0.63 0.21 -0.03 -1.72 0.00 0.00 179.24 178.41 1oa1 h MET 249 N 1.07 0.41 -0.51 3.56 4.05 -1.32 0.56 114.93 122.74 1oa1 h MET 249 Ca 0.33 -0.02 0.05 0.00 -0.28 0.00 0.00 59.70 59.77 1oa1 h MET 249 Cb -0.02 -0.09 -0.05 0.00 -0.80 0.00 0.00 31.60 30.64 1oa1 h MET 249 CO -0.10 0.27 0.24 0.00 0.23 0.00 0.00 176.91 177.55 1oa1 h ALA 250 N 1.14 0.65 -0.30 0.39 0.00 -0.73 -0.31 119.26 120.10 1oa1 h ALA 250 Ca 0.13 0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.89 1oa1 h ALA 250 Cb -0.02 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1oa1 h ALA 250 CO -0.05 -0.12 -0.50 0.93 0.00 0.00 0.00 179.25 179.51 1oa1 h GLU 251 N 0.47 0.85 -0.72 0.00 5.08 -1.10 -2.19 114.58 116.97 1oa1 h GLU 251 Ca 0.23 -0.51 -0.03 0.00 -1.00 0.00 0.00 59.36 58.05 1oa1 h GLU 251 Cb 0.17 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1oa1 h GLU 251 CO -0.18 1.15 0.33 1.25 -1.00 0.00 0.00 179.01 180.56 1oa1 h LEU 252 N 0.67 0.95 -0.42 1.33 5.85 -0.42 -1.32 115.31 121.95 1oa1 h LEU 252 Ca 0.03 -0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.57 1oa1 h LEU 252 Cb 1.10 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 1oa1 h LEU 252 CO 0.11 0.82 0.12 -0.07 -0.34 0.00 0.00 178.44 179.08 1oa1 h LEU 253 N 1.01 0.63 -0.74 2.25 3.38 -1.00 -1.11 115.31 119.72 1oa1 h LEU 253 Ca 0.24 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1oa1 h LEU 253 Cb 0.13 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 1oa1 h LEU 253 CO -0.03 0.68 0.42 0.11 0.09 0.00 0.00 178.44 179.71 1oa1 h LYS 254 N 0.54 1.03 0.00 1.13 1.57 -1.16 -2.03 116.57 117.65 1oa1 h LYS 254 Ca 0.13 -0.11 -0.06 0.00 -1.87 0.00 0.00 60.65 58.74 1oa1 h LYS 254 Cb 0.29 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1oa1 h LYS 254 CO -0.00 0.75 -0.29 1.96 -0.57 0.00 0.00 179.45 181.30 1oa1 h GLN 255 N 1.02 0.00 0.00 3.15 4.20 -1.04 -3.15 115.11 119.30 1oa1 h GLN 255 Ca 0.26 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.97 1oa1 h GLN 255 Cb 0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.79 1oa1 h GLN 255 CO -0.04 0.29 -0.82 0.25 -0.67 0.00 0.00 178.83 177.83 1oa1 n THR 256 N -3.22 0.11 -1.69 -0.54 -2.24 -0.44 -4.86 114.28 101.39 1oa1 n THR 256 Ca 0.02 -0.14 -0.44 0.00 -2.27 0.00 0.00 64.05 61.23 1oa1 n THR 256 Cb 0.60 0.30 -0.04 0.00 -2.10 0.00 0.00 70.33 69.10 1oa1 n THR 256 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1oa1 n GLU 257 N -1.77 2.55 -1.00 -0.78 2.13 -0.78 -2.17 120.64 118.82 1oa1 n GLU 257 Ca 0.03 0.92 -0.00 0.00 0.66 0.00 0.00 57.16 58.78 1oa1 n GLU 257 Cb 0.39 -2.76 -0.00 0.00 0.27 0.00 0.00 31.44 29.34 1oa1 n GLU 257 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1oa1 n GLY 258 N 3.90 0.48 0.01 8.31 0.00 -1.26 -4.90 105.19 111.73 1oa1 n GLY 258 Ca 0.17 -0.17 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1oa1 n GLY 258 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1oa1 n THR 259 N -2.98 0.03 -0.84 2.61 -2.24 -0.92 -4.96 114.28 104.97 1oa1 n THR 259 Ca -0.00 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1oa1 n THR 259 Cb 0.01 0.61 0.00 0.00 -2.10 0.00 0.00 70.33 68.85 1oa1 n THR 259 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oa1 n GLY 260 N 1.42 0.73 3.52 3.38 0.00 -1.26 -5.04 105.19 107.95 1oa1 n GLY 260 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1oa1 n GLY 260 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oa1 s VAL 261 N -2.76 4.43 0.55 1.61 1.01 -1.26 -4.37 120.40 119.62 1oa1 s VAL 261 Ca 0.00 -0.15 -0.10 0.00 0.00 0.00 0.00 61.98 61.73 1oa1 s VAL 261 Cb 0.00 -3.03 -0.05 0.00 0.00 0.00 0.00 36.38 33.30 1oa1 s VAL 261 CO 0.00 0.40 0.94 -1.81 0.00 0.00 0.00 175.10 174.63 1oa1 s ASP 262 N 1.03 6.31 -0.09 3.32 1.01 -0.44 -4.82 116.67 122.99 1oa1 s ASP 262 Ca 0.04 1.29 0.03 0.00 0.71 0.00 0.00 52.55 54.61 1oa1 s ASP 262 Cb -0.14 -2.41 -0.01 0.00 1.01 0.00 0.00 42.92 41.37 1oa1 s ASP 262 CO 0.03 -0.72 -0.18 -0.69 0.21 0.00 0.00 175.17 173.82 1oa1 s VAL 263 N -2.94 2.69 0.07 -1.27 1.01 -0.25 -1.19 120.40 118.53 1oa1 s VAL 263 Ca 0.53 -0.82 0.08 0.00 0.00 0.00 0.00 61.98 61.78 1oa1 s VAL 263 Cb -0.11 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 1oa1 s VAL 263 CO 0.47 0.55 -0.22 -0.31 0.00 0.00 0.00 175.10 175.59 1oa1 s TYR 264 N -0.00 1.92 0.32 5.22 2.02 -0.27 -1.28 117.35 125.28 1oa1 s TYR 264 Ca -0.06 -0.39 0.02 0.00 -0.37 0.00 0.00 57.07 56.27 1oa1 s TYR 264 Cb -0.15 -1.11 -0.03 0.00 -0.40 0.00 0.00 41.96 40.28 1oa1 s TYR 264 CO 0.05 0.16 0.50 0.95 -1.57 0.00 0.00 175.55 175.63 1oa1 s THR 265 N -0.94 5.02 0.00 -0.71 -4.23 -0.21 -0.99 115.64 113.59 1oa1 s THR 265 Ca 0.08 -0.64 -0.00 0.00 -1.18 0.00 0.00 61.69 59.95 1oa1 s THR 265 Cb -0.09 -3.81 -0.00 0.00 1.34 0.00 0.00 72.50 69.93 1oa1 s THR 265 CO 0.03 -0.46 0.00 -2.28 -0.54 0.00 0.00 174.62 171.37 1oa1 s HIS 266 N -2.23 0.04 0.00 3.99 2.46 -0.11 -0.34 115.29 119.09 1oa1 s HIS 266 Ca 0.39 -0.07 0.00 0.00 0.47 0.00 0.00 55.06 55.85 1oa1 s HIS 266 Cb -0.09 -0.03 0.00 0.00 -0.13 0.00 0.00 32.58 32.32 1oa1 s HIS 266 CO 0.34 -0.04 0.00 0.41 -2.47 0.00 0.00 174.74 172.98 1oa1 n GLY 267 N 2.80 3.66 0.01 1.59 0.00 -1.24 -1.23 105.19 110.77 1oa1 n GLY 267 Ca -0.14 -0.05 0.10 0.00 0.00 0.00 0.00 46.02 45.93 1oa1 n GLY 267 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1oa1 n GLU 268 N 13.43 1.01 0.00 1.61 -0.58 -1.24 -2.41 120.64 132.46 1oa1 n GLU 268 Ca 0.00 -0.01 0.13 0.00 -0.42 0.00 0.00 57.16 56.85 1oa1 n GLU 268 Cb 0.00 -1.32 0.38 0.00 -0.57 0.00 0.00 31.44 29.93 1oa1 n GLU 268 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1oa1 n MET 269 N -0.81 0.30 -0.28 3.49 2.81 -0.37 -4.33 117.12 117.94 1oa1 n MET 269 Ca 0.15 -0.15 0.09 0.00 -1.81 0.00 0.00 57.70 55.99 1oa1 n MET 269 Cb 0.07 -1.50 0.23 0.00 -0.71 0.00 0.00 33.22 31.31 1oa1 n MET 269 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1oa1 h LEU 270 N 0.37 -0.15 -0.81 4.03 5.85 -1.62 -0.31 115.31 122.67 1oa1 h LEU 270 Ca 0.00 0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.92 1oa1 h LEU 270 Cb 0.48 0.30 0.00 0.00 0.37 0.00 0.00 40.66 41.81 1oa1 h LEU 270 CO 0.00 -0.16 0.00 -2.65 -0.34 0.00 0.00 178.44 175.29 1oa1 n PRO 271 N -5.28 0.11 0.27 5.25 -0.02 -1.26 -1.49 135.00 132.58 1oa1 n PRO 271 Ca 0.18 0.52 0.12 0.00 -2.02 0.00 0.00 63.50 62.29 1oa1 n PRO 271 Cb 0.58 -1.80 0.77 0.00 -0.02 0.00 0.00 33.50 33.04 1oa1 n PRO 271 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oa1 h ALA 272 N 2.12 1.80 0.00 3.55 0.00 -1.35 -0.58 119.26 124.80 1oa1 h ALA 272 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1oa1 h ALA 272 Cb 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1oa1 h ALA 272 CO 0.00 -0.04 -0.00 -0.91 0.00 0.00 0.00 179.25 178.30 1oa1 h ASN 273 N 0.00 0.00 0.58 0.00 2.35 -1.43 -2.93 115.58 114.15 1oa1 h ASN 273 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1oa1 h ASN 273 Cb 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 1oa1 h ASN 273 CO -0.00 0.00 -0.59 -1.22 -1.65 0.00 0.00 177.43 173.97 1oa1 n TYR 274 N -3.21 0.16 -3.36 1.19 4.01 -0.23 -4.72 117.16 111.01 1oa1 n TYR 274 Ca -0.03 0.05 -0.38 0.00 -0.16 0.00 0.00 57.90 57.38 1oa1 n TYR 274 Cb 0.07 -0.37 -0.06 0.00 -0.31 0.00 0.00 39.34 38.67 1oa1 n TYR 274 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1oa1 s TYR 275 N -3.06 3.52 0.42 -0.72 2.02 -1.11 -1.52 117.35 116.90 1oa1 s TYR 275 Ca 0.09 0.85 0.10 0.00 -0.37 0.00 0.00 57.07 57.73 1oa1 s TYR 275 Cb 0.16 -2.50 0.92 0.00 -0.40 0.00 0.00 41.96 40.15 1oa1 s TYR 275 CO 0.72 0.21 2.03 -1.00 -1.57 0.00 0.00 175.55 175.94 1oa1 h PRO 276 N 6.57 0.49 -0.22 -1.71 0.13 -1.76 -1.13 132.00 134.37 1oa1 h PRO 276 Ca -0.42 -0.03 0.06 0.00 -0.87 0.00 0.00 66.00 64.75 1oa1 h PRO 276 Cb 1.18 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 1oa1 h PRO 276 CO 0.75 0.32 0.16 0.00 -0.23 0.00 0.00 178.00 179.00 1oa1 h ALA 277 N 1.72 2.20 0.00 -0.56 0.00 -1.80 -2.88 119.26 117.95 1oa1 h ALA 277 Ca 0.21 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.82 1oa1 h ALA 277 Cb 0.18 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 1oa1 h ALA 277 CO -0.05 -0.28 -2.14 1.19 0.00 0.00 0.00 179.25 177.97 1oa1 n PHE 278 N -4.46 0.25 0.31 0.00 3.72 -0.50 -4.31 117.46 112.47 1oa1 n PHE 278 Ca 0.02 0.09 0.20 0.00 -0.05 0.00 0.00 57.45 57.71 1oa1 n PHE 278 Cb 0.31 -0.97 0.93 0.00 -0.94 0.00 0.00 39.48 38.81 1oa1 n PHE 278 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1oa1 h LYS 279 N 0.00 0.00 0.00 -1.08 1.57 -1.13 -2.56 116.57 113.37 1oa1 h LYS 279 Ca -0.40 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1oa1 h LYS 279 Cb 1.99 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.30 1oa1 h LYS 279 CO 0.04 0.00 0.00 0.36 -0.57 0.00 0.00 179.45 179.28 1oa1 n LYS 280 N -3.04 0.11 -3.30 3.15 2.85 -1.20 -4.69 118.16 112.03 1oa1 n LYS 280 Ca -0.01 0.34 -0.40 0.00 -1.05 0.00 0.00 58.31 57.19 1oa1 n LYS 280 Cb 0.19 -1.70 -0.08 0.00 -0.65 0.00 0.00 35.03 32.78 1oa1 n LYS 280 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1oa1 s TYR 281 N -3.17 3.22 0.17 5.58 2.02 -0.97 -4.96 117.35 119.25 1oa1 s TYR 281 Ca 0.05 0.32 0.35 0.00 -0.37 0.00 0.00 57.07 57.42 1oa1 s TYR 281 Cb 0.09 -2.76 1.51 0.00 -0.40 0.00 0.00 41.96 40.41 1oa1 s TYR 281 CO 0.33 -0.39 2.04 -1.00 -1.57 0.00 0.00 175.55 174.96 1oa1 h PRO 282 N 8.29 0.00 -0.08 -1.71 0.13 -1.90 -2.76 132.00 133.97 1oa1 h PRO 282 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1oa1 h PRO 282 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1oa1 h PRO 282 CO 0.72 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 176.10 1oa1 n HIS 283 N -3.08 0.09 -2.82 1.56 1.44 -1.26 -4.58 115.22 106.56 1oa1 n HIS 283 Ca 0.00 -0.05 -0.43 0.00 -2.01 0.00 0.00 57.72 55.24 1oa1 n HIS 283 Cb 0.27 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.35 1oa1 n HIS 283 CO 0.00 0.00 0.00 0.12 -2.81 0.00 0.00 176.34 173.65 1oa1 s PHE 284 N -1.91 2.66 -0.00 -1.40 5.36 -1.04 -1.09 117.98 120.55 1oa1 s PHE 284 Ca 0.36 -0.56 -0.20 0.00 -0.96 0.00 0.00 56.93 55.56 1oa1 s PHE 284 Cb 0.19 -4.34 -0.26 0.00 -0.34 0.00 0.00 43.02 38.27 1oa1 s PHE 284 CO 0.30 -1.69 1.04 0.28 -1.46 0.00 0.00 175.22 173.69 1oa1 h VAL 285 N 5.99 1.43 0.00 3.12 2.07 -1.44 -3.48 116.25 123.94 1oa1 h VAL 285 Ca -0.25 -2.26 0.00 0.00 0.82 0.00 0.00 66.70 65.02 1oa1 h VAL 285 Cb 1.06 2.78 0.00 0.00 -1.52 0.00 0.00 31.29 33.61 1oa1 h VAL 285 CO 1.19 0.66 0.00 0.61 0.02 0.00 0.00 177.57 180.05 1oa1 n GLY 286 N 1.27 -0.11 3.33 2.17 0.00 -1.26 -4.40 105.19 106.20 1oa1 n GLY 286 Ca -0.12 -1.07 -0.32 0.00 0.00 0.00 0.00 46.02 44.51 1oa1 n GLY 286 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1oa1 s ASN 287 N -4.00 3.47 -0.19 1.61 3.84 -0.78 -1.05 114.94 117.85 1oa1 s ASN 287 Ca 0.00 -0.41 -0.03 0.00 0.21 0.00 0.00 52.86 52.64 1oa1 s ASN 287 Cb 0.00 -1.01 -0.01 0.00 -0.55 0.00 0.00 41.25 39.68 1oa1 s ASN 287 CO 0.00 0.25 -0.07 -0.47 -2.79 0.00 0.00 177.10 174.02 1oa1 s TYR 288 N -0.17 2.92 0.00 0.43 5.04 0.53 -4.26 117.35 121.84 1oa1 s TYR 288 Ca -0.02 -0.86 0.00 0.00 -2.44 0.00 0.00 57.07 53.75 1oa1 s TYR 288 Cb -0.14 -2.02 0.00 0.00 0.35 0.00 0.00 41.96 40.15 1oa1 s TYR 288 CO 0.04 -0.44 0.00 0.41 -1.34 0.00 0.00 175.55 174.21 1oa1 n GLY 289 N 4.40 -0.60 0.00 8.97 0.00 -1.26 -4.56 105.19 112.13 1oa1 n GLY 289 Ca -0.18 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1oa1 n GLY 289 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oa1 n GLY 290 N 0.00 5.14 3.87 -0.02 0.00 -1.26 -4.91 105.19 108.00 1oa1 n GLY 290 Ca 0.00 -1.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.07 1oa1 n GLY 290 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1oa1 s SER 291 N 1.00 3.51 0.38 1.61 1.04 -1.26 -3.72 113.70 116.25 1oa1 s SER 291 Ca 0.00 0.61 0.15 0.00 0.48 0.00 0.00 55.95 57.19 1oa1 s SER 291 Cb 0.00 -0.93 1.01 0.00 0.10 0.00 0.00 66.02 66.20 1oa1 s SER 291 CO 0.00 -2.52 1.78 4.11 0.98 0.00 0.00 173.24 177.60 1oa1 h TRP 292 N -1.48 0.75 0.00 5.02 5.08 -1.94 -2.19 115.95 121.19 1oa1 h TRP 292 Ca -0.46 0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.53 1oa1 h TRP 292 Cb 1.29 -0.22 0.00 0.00 -3.00 0.00 0.00 29.16 27.23 1oa1 h TRP 292 CO -0.44 0.11 0.00 -2.67 -1.28 0.00 0.00 178.44 174.16 1oa1 n TRP 293 N -4.65 0.86 0.40 0.12 4.27 -1.26 -1.95 117.44 115.22 1oa1 n TRP 293 Ca 0.24 0.30 0.07 0.00 -3.89 0.00 0.00 57.50 54.21 1oa1 n TRP 293 Cb 0.77 -0.98 0.21 0.00 -1.36 0.00 0.00 31.31 29.95 1oa1 n TRP 293 CO 0.00 0.00 0.00 1.04 -2.29 0.00 0.00 177.69 176.44 1oa1 n GLN 294 N -2.24 2.34 0.22 -2.67 6.02 -0.82 -4.62 117.38 115.61 1oa1 n GLN 294 Ca 0.04 -1.69 0.11 0.00 -0.01 0.00 0.00 57.00 55.44 1oa1 n GLN 294 Cb 0.31 -1.49 0.41 0.00 1.02 0.00 0.00 30.24 30.49 1oa1 n GLN 294 CO 0.00 0.00 0.00 -0.56 -1.01 0.00 0.00 177.06 175.49 1oa1 h GLN 295 N 2.60 0.00 0.64 -1.09 3.07 -1.54 -3.09 115.11 115.70 1oa1 h GLN 295 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.71 1oa1 h GLN 295 Cb 0.78 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.35 1oa1 h GLN 295 CO 0.07 0.19 -0.31 -0.91 0.09 0.00 0.00 178.83 177.95 1oa1 h ASN 296 N 0.00 -0.74 0.15 0.06 4.21 -1.85 0.17 115.58 117.60 1oa1 h ASN 296 Ca -0.00 0.03 -0.07 0.00 1.21 0.00 0.00 56.30 57.46 1oa1 h ASN 296 Cb 0.82 0.19 -0.01 0.00 -1.12 0.00 0.00 38.32 38.20 1oa1 h ASN 296 CO 0.02 -0.53 -0.26 1.55 -1.29 0.00 0.00 177.43 176.92 1oa1 h PRO 297 N -0.87 0.19 0.04 0.81 0.13 -1.95 -2.67 132.00 127.69 1oa1 h PRO 297 Ca -0.09 -0.06 -0.20 0.00 -0.87 0.00 0.00 66.00 64.78 1oa1 h PRO 297 Cb 0.67 -0.02 0.02 0.00 0.13 0.00 0.00 31.00 31.80 1oa1 h PRO 297 CO 0.14 0.45 -0.80 0.93 -0.23 0.00 0.00 178.00 178.49 1oa1 h GLU 298 N 0.17 0.47 -0.65 0.86 5.08 -1.44 -0.44 114.58 118.63 1oa1 h GLU 298 Ca 0.03 -0.56 -0.03 0.00 -1.00 0.00 0.00 59.36 57.79 1oa1 h GLU 298 Cb 0.57 0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 1oa1 h GLU 298 CO 0.04 1.20 0.28 0.74 -1.00 0.00 0.00 179.01 180.27 1oa1 h PHE 299 N -0.02 0.94 0.39 4.33 0.04 -0.73 -0.93 116.94 120.96 1oa1 h PHE 299 Ca -0.11 -0.05 -0.02 0.00 2.80 0.00 0.00 57.97 60.59 1oa1 h PHE 299 Cb 1.52 -0.29 0.00 0.00 2.20 0.00 0.00 35.95 39.38 1oa1 h PHE 299 CO 0.14 0.71 -0.19 1.49 -0.60 0.00 0.00 178.31 179.87 1oa1 h GLU 300 N 0.93 -0.51 0.00 1.51 4.57 -1.36 -3.13 114.58 116.59 1oa1 h GLU 300 Ca 0.22 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.44 1oa1 h GLU 300 Cb 0.15 0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 1oa1 h GLU 300 CO -0.02 -0.33 0.00 0.66 -1.18 0.00 0.00 179.01 178.14 1oa1 h SER 301 N -0.54 0.00 0.17 1.04 4.64 -0.90 -2.81 113.55 115.15 1oa1 h SER 301 Ca -0.05 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.22 1oa1 h SER 301 Cb 0.41 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.50 1oa1 h SER 301 CO 0.09 0.00 -0.19 0.15 -0.87 0.00 0.00 176.83 176.01 1oa1 h PHE 302 N 0.00 0.03 0.00 4.77 3.57 -1.11 -1.45 116.94 122.75 1oa1 h PHE 302 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1oa1 h PHE 302 Cb 0.52 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.26 1oa1 h PHE 302 CO 0.00 0.22 0.00 0.09 -2.23 0.00 0.00 178.31 176.39 1oa1 n ASN 303 N -4.30 0.00 -4.78 0.41 3.02 -1.06 -3.43 115.26 105.12 1oa1 n ASN 303 Ca -0.02 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.30 1oa1 n ASN 303 Cb 0.26 0.00 0.10 0.00 -0.61 0.00 0.00 39.78 39.52 1oa1 n ASN 303 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1oa1 s GLY 304 N 0.00 1.74 0.60 7.41 0.00 -1.26 -4.59 107.32 111.22 1oa1 s GLY 304 Ca 0.00 -1.93 -0.19 0.00 0.00 0.00 0.00 44.72 42.60 1oa1 s GLY 304 CO 0.00 -1.37 1.20 -1.05 0.00 0.00 0.00 173.10 171.88 1oa1 n PRO 305 N -2.66 1.21 -5.21 2.90 -0.02 -1.24 -4.80 135.00 125.18 1oa1 n PRO 305 Ca 0.16 0.46 -0.32 0.00 -2.02 0.00 0.00 63.50 61.78 1oa1 n PRO 305 Cb 0.61 -2.42 -0.17 0.00 -0.02 0.00 0.00 33.50 31.51 1oa1 n PRO 305 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1oa1 s ILE 306 N -1.39 2.04 -0.24 4.25 1.09 -0.40 -1.11 121.20 125.44 1oa1 s ILE 306 Ca 0.77 -1.01 -0.03 0.00 -1.10 0.00 0.00 60.65 59.28 1oa1 s ILE 306 Cb -0.41 -1.76 0.01 0.00 -1.06 0.00 0.00 42.46 39.24 1oa1 s ILE 306 CO 0.45 0.56 -0.04 -0.22 -0.10 0.00 0.00 174.94 175.59 1oa1 s LEU 307 N 0.31 3.10 -0.35 2.97 2.96 0.23 -0.27 118.68 127.63 1oa1 s LEU 307 Ca -0.18 -0.65 -0.12 0.00 -0.22 0.00 0.00 54.13 52.96 1oa1 s LEU 307 Cb -0.18 -1.71 -0.01 0.00 0.50 0.00 0.00 46.19 44.80 1oa1 s LEU 307 CO 0.09 -0.09 0.23 -0.76 -1.32 0.00 0.00 176.35 174.50 1oa1 s LEU 308 N 1.41 4.56 0.14 -0.68 2.01 -0.25 -0.86 118.68 125.00 1oa1 s LEU 308 Ca 0.03 -0.56 0.19 0.00 0.01 0.00 0.00 54.13 53.80 1oa1 s LEU 308 Cb -0.16 -2.11 -0.06 0.00 0.01 0.00 0.00 46.19 43.88 1oa1 s LEU 308 CO -0.04 -0.27 0.97 0.71 1.01 0.00 0.00 176.35 178.73 1oa1 h THR 309 N 5.57 0.33 -2.30 5.49 1.35 -1.61 -2.31 112.91 119.43 1oa1 h THR 309 Ca -0.30 -1.63 -0.03 0.00 -0.55 0.00 0.00 66.41 63.89 1oa1 h THR 309 Cb 1.15 1.87 -0.01 0.00 -1.73 0.00 0.00 68.15 69.43 1oa1 h THR 309 CO 0.65 0.19 0.01 0.35 -0.25 0.00 0.00 175.52 176.46 1oa1 n THR 310 N -2.85 0.00 -0.82 6.82 -2.24 -1.26 -4.51 114.28 109.42 1oa1 n THR 310 Ca -0.05 -0.27 -0.32 0.00 -2.27 0.00 0.00 64.05 61.14 1oa1 n THR 310 Cb 0.72 0.20 0.15 0.00 -2.10 0.00 0.00 70.33 69.30 1oa1 n THR 310 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1oa1 s ASN 311 N -1.40 3.14 -0.24 3.42 4.22 -1.26 -4.42 114.94 118.40 1oa1 s ASN 311 Ca 0.04 2.22 -0.10 0.00 -2.14 0.00 0.00 52.86 52.89 1oa1 s ASN 311 Cb -0.00 -2.57 -0.05 0.00 1.28 0.00 0.00 41.25 39.91 1oa1 s ASN 311 CO 0.03 -2.96 0.14 0.00 -2.04 0.00 0.00 177.10 172.27 1oa1 s LEU 313 N 1.11 3.13 0.20 0.00 2.96 0.17 -4.91 118.68 121.33 1oa1 s LEU 313 Ca 0.06 -0.20 0.07 0.00 -0.22 0.00 0.00 54.13 53.84 1oa1 s LEU 313 Cb -0.14 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 1oa1 s LEU 313 CO 0.05 0.14 0.10 0.68 -1.32 0.00 0.00 176.35 175.99 1oa1 s VAL 314 N 0.54 4.17 0.42 1.68 -7.23 -1.26 -4.60 120.40 114.13 1oa1 s VAL 314 Ca -0.04 -1.32 -0.26 0.00 -1.81 0.00 0.00 61.98 58.55 1oa1 s VAL 314 Cb -0.15 -3.16 -0.10 0.00 0.56 0.00 0.00 36.38 33.54 1oa1 s VAL 314 CO 0.03 -0.19 1.32 -2.65 -0.31 0.00 0.00 175.10 173.30 1oa1 n PRO 315 N -0.51 2.05 -2.05 4.82 -0.02 -1.26 -4.94 135.00 133.08 1oa1 n PRO 315 Ca -0.08 0.73 -0.40 0.00 -2.02 0.00 0.00 63.50 61.72 1oa1 n PRO 315 Cb 0.56 -2.46 -0.01 0.00 -0.02 0.00 0.00 33.50 31.57 1oa1 n PRO 315 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1oa1 s LEU 316 N -1.93 4.32 0.65 2.45 1.02 -1.26 -4.98 118.68 118.95 1oa1 s LEU 316 Ca 0.60 2.71 -0.15 0.00 0.02 0.00 0.00 54.13 57.32 1oa1 s LEU 316 Cb -0.49 -3.77 -0.01 0.00 0.02 0.00 0.00 46.19 41.95 1oa1 s LEU 316 CO 0.58 -0.71 1.09 -0.54 0.02 0.00 0.00 176.35 176.79 1oa1 s LYS 317 N -2.03 2.91 0.47 1.70 -0.14 -1.26 -4.95 119.74 116.45 1oa1 s LYS 317 Ca 0.53 1.29 0.20 0.00 -1.36 0.00 0.00 55.97 56.63 1oa1 s LYS 317 Cb -0.40 -1.97 1.18 0.00 -1.68 0.00 0.00 37.83 34.96 1oa1 s LYS 317 CO 0.52 -1.15 2.01 0.87 -0.76 0.00 0.00 175.35 176.85 1oa1 h LYS 318 N 0.00 0.00 -0.00 1.68 1.79 -2.05 -1.54 116.57 116.45 1oa1 h LYS 318 Ca -0.46 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.01 1oa1 h LYS 318 Cb 1.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 1oa1 h LYS 318 CO 0.55 0.17 -0.06 -0.85 -1.08 0.00 0.00 179.45 178.18 1oa1 n GLU 319 N -3.99 0.01 -2.43 3.15 0.00 -1.26 -4.87 120.64 111.26 1oa1 n GLU 319 Ca -0.02 -0.00 -0.38 0.00 0.00 0.00 0.00 57.16 56.76 1oa1 n GLU 319 Cb 0.26 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.16 1oa1 n GLU 319 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.13 176.33 1oa1 s ASN 320 N -2.99 6.77 -0.00 -1.84 0.01 -0.58 -4.96 114.94 111.35 1oa1 s ASN 320 Ca 0.14 2.21 0.04 0.00 -0.71 0.00 0.00 52.86 54.54 1oa1 s ASN 320 Cb 0.19 -2.61 0.13 0.00 0.41 0.00 0.00 41.25 39.37 1oa1 s ASN 320 CO 0.55 -0.49 1.10 0.35 -1.51 0.00 0.00 177.10 177.10 1oa1 n THR 321 N 0.26 1.01 0.98 1.60 -2.24 -1.26 -4.75 114.28 109.87 1oa1 n THR 321 Ca 0.03 -1.01 0.10 0.00 -2.27 0.00 0.00 64.05 60.90 1oa1 n THR 321 Cb 0.47 0.49 0.32 0.00 -2.10 0.00 0.00 70.33 69.51 1oa1 n THR 321 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oa1 n TYR 322 N -0.11 0.31 -0.33 4.78 0.18 -1.26 -4.30 117.16 116.43 1oa1 n TYR 322 Ca 0.05 -0.15 0.07 0.00 1.88 0.00 0.00 57.90 59.74 1oa1 n TYR 322 Cb 0.33 0.00 0.26 0.00 -0.38 0.00 0.00 39.34 39.55 1oa1 n TYR 322 CO 0.00 0.00 0.00 1.25 -2.08 0.00 0.00 176.86 176.03 1oa1 h LEU 323 N 2.70 0.88 0.00 -3.48 5.85 -1.95 -0.98 115.31 118.33 1oa1 h LEU 323 Ca 0.00 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1oa1 h LEU 323 Cb 0.60 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.48 1oa1 h LEU 323 CO 0.00 0.49 0.00 -0.90 -0.34 0.00 0.00 178.44 177.69 1oa1 n ASP 324 N -4.57 0.00 -0.25 1.25 5.75 -1.26 -2.15 116.55 115.32 1oa1 n ASP 324 Ca 0.17 0.40 0.07 0.00 -0.01 0.00 0.00 54.79 55.42 1oa1 n ASP 324 Cb 0.33 -0.45 0.10 0.00 -1.03 0.00 0.00 41.12 40.06 1oa1 n ASP 324 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1oa1 n ARG 325 N -1.45 0.89 -3.58 0.11 1.85 -0.44 -4.98 116.66 109.05 1oa1 n ARG 325 Ca 0.05 -2.14 -0.37 0.00 -1.00 0.00 0.00 57.85 54.38 1oa1 n ARG 325 Cb 0.17 -1.18 -0.10 0.00 -1.05 0.00 0.00 32.46 30.30 1oa1 n ARG 325 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 1oa1 s LEU 326 N -1.99 4.07 -0.07 2.89 2.96 -0.78 -1.28 118.68 124.48 1oa1 s LEU 326 Ca 0.23 0.12 0.04 0.00 -0.22 0.00 0.00 54.13 54.30 1oa1 s LEU 326 Cb 0.21 -2.18 -0.01 0.00 0.50 0.00 0.00 46.19 44.70 1oa1 s LEU 326 CO 0.01 -0.02 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.51 1oa1 s TYR 327 N 1.46 2.58 0.23 5.38 2.02 0.62 -2.06 117.35 127.58 1oa1 s TYR 327 Ca 0.09 -0.61 0.08 0.00 -0.37 0.00 0.00 57.07 56.26 1oa1 s TYR 327 Cb -0.15 -1.67 -0.04 0.00 -0.40 0.00 0.00 41.96 39.71 1oa1 s TYR 327 CO 0.08 -0.15 0.06 0.95 -1.57 0.00 0.00 175.55 174.92 1oa1 s THR 328 N -0.13 3.89 0.26 -0.71 -4.23 0.06 -1.09 115.64 113.69 1oa1 s THR 328 Ca -0.03 -1.56 -0.14 0.00 -1.18 0.00 0.00 61.69 58.78 1oa1 s THR 328 Cb -0.14 -3.04 0.00 0.00 1.34 0.00 0.00 72.50 70.66 1oa1 s THR 328 CO 0.04 -0.27 0.53 0.28 -0.54 0.00 0.00 174.62 174.66 1oa1 s THR 329 N -2.05 0.00 0.00 3.99 -1.32 -0.87 -0.51 115.64 114.88 1oa1 s THR 329 Ca 0.31 -1.34 0.00 0.00 -1.21 0.00 0.00 61.69 59.45 1oa1 s THR 329 Cb -0.08 -2.23 0.00 0.00 -1.51 0.00 0.00 72.50 68.68 1oa1 s THR 329 CO 0.21 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.23 1oa1 n GLY 330 N -0.41 3.05 0.07 6.08 0.00 -1.26 -2.15 105.19 110.57 1oa1 n GLY 330 Ca -0.02 -0.25 0.15 0.00 0.00 0.00 0.00 46.02 45.89 1oa1 n GLY 330 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1oa1 n VAL 331 N 0.00 0.00 -2.58 1.61 0.24 -1.26 -4.86 118.33 111.48 1oa1 n VAL 331 Ca 0.00 -0.04 -0.38 0.00 -2.04 0.00 0.00 64.34 61.88 1oa1 n VAL 331 Cb 0.00 -0.25 -0.05 0.00 -1.47 0.00 0.00 33.84 32.07 1oa1 n VAL 331 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1oa1 s VAL 332 N -2.45 3.76 -0.02 3.34 1.01 -0.91 -4.50 120.40 120.63 1oa1 s VAL 332 Ca 0.31 1.52 -0.21 0.00 0.00 0.00 0.00 61.98 63.60 1oa1 s VAL 332 Cb 0.20 -3.88 0.04 0.00 0.00 0.00 0.00 36.38 32.75 1oa1 s VAL 332 CO 0.46 0.18 0.45 -0.83 0.00 0.00 0.00 175.10 175.36 1oa1 s GLY 333 N -1.33 -0.31 -0.25 4.51 0.00 -1.17 -4.25 107.32 104.51 1oa1 s GLY 333 Ca 0.51 0.69 -0.13 0.00 0.00 0.00 0.00 44.72 45.79 1oa1 s GLY 333 CO 0.31 0.42 0.61 -0.47 0.00 0.00 0.00 173.10 173.97 1oa1 s TYR 334 N -1.32 -1.00 0.09 1.90 5.04 -1.26 -0.90 117.35 119.90 1oa1 s TYR 334 Ca -0.12 1.95 -0.31 0.00 -2.44 0.00 0.00 57.07 56.15 1oa1 s TYR 334 Cb -0.03 0.57 -0.11 0.00 0.35 0.00 0.00 41.96 42.74 1oa1 s TYR 334 CO 0.06 -0.51 1.86 -0.85 -1.34 0.00 0.00 175.55 174.77 1oa1 n GLU 335 N 4.57 2.75 -0.14 4.97 0.00 -1.26 -1.64 120.64 129.89 1oa1 n GLU 335 Ca -0.19 1.00 0.00 0.00 0.00 0.00 0.00 57.16 57.97 1oa1 n GLU 335 Cb 0.56 -2.90 0.00 0.00 0.00 0.00 0.00 31.44 29.10 1oa1 n GLU 335 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1oa1 n GLY 336 N 4.28 1.34 3.91 -1.84 0.00 -1.26 -5.05 105.19 106.57 1oa1 n GLY 336 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 1oa1 n GLY 336 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa1 s ALA 337 N -2.66 3.14 -0.18 4.61 0.00 -0.65 -4.81 121.76 121.21 1oa1 s ALA 337 Ca 0.00 -0.65 -0.13 0.00 0.00 0.00 0.00 51.96 51.18 1oa1 s ALA 337 Cb 0.00 -2.73 -0.05 0.00 0.00 0.00 0.00 23.12 20.35 1oa1 s ALA 337 CO 0.00 -1.03 0.27 0.15 0.00 0.00 0.00 175.76 175.15 1oa1 s LYS 338 N -5.16 4.23 -0.16 0.00 1.02 -0.88 -4.94 119.74 113.85 1oa1 s LYS 338 Ca 0.57 0.03 -0.07 0.00 0.02 0.00 0.00 55.97 56.51 1oa1 s LYS 338 Cb -0.11 -3.44 -0.04 0.00 -0.52 0.00 0.00 37.83 33.72 1oa1 s LYS 338 CO 0.47 0.21 0.07 -1.58 -0.92 0.00 0.00 175.35 173.60 1oa1 s HIS 339 N 0.58 3.31 -0.32 3.18 5.65 -1.26 -0.76 115.29 125.67 1oa1 s HIS 339 Ca 0.15 0.19 -0.16 0.00 0.25 0.00 0.00 55.06 55.49 1oa1 s HIS 339 Cb -0.13 -2.02 -0.02 0.00 -1.18 0.00 0.00 32.58 29.23 1oa1 s HIS 339 CO 0.03 0.31 0.41 0.42 -0.65 0.00 0.00 174.74 175.27 1oa1 s ILE 340 N -0.04 5.12 0.77 0.89 -1.09 0.33 -4.94 121.20 122.24 1oa1 s ILE 340 Ca 0.07 0.28 -0.14 0.00 -2.23 0.00 0.00 60.65 58.64 1oa1 s ILE 340 Cb -0.12 -3.83 0.06 0.00 -1.58 0.00 0.00 42.46 36.99 1oa1 s ILE 340 CO 0.01 -0.06 1.20 0.00 -1.23 0.00 0.00 174.94 174.85 1oa1 s ALA 341 N 2.15 1.98 0.47 9.38 0.00 -1.26 -4.27 121.76 130.21 1oa1 s ALA 341 Ca 0.15 0.83 -0.23 0.00 0.00 0.00 0.00 51.96 52.71 1oa1 s ALA 341 Cb -0.16 -3.47 -0.08 0.00 0.00 0.00 0.00 23.12 19.40 1oa1 s ALA 341 CO 0.12 -2.08 1.09 -0.25 0.00 0.00 0.00 175.76 174.64 1oa1 n ASP 342 N -3.05 1.59 -4.77 0.00 8.00 -1.26 -4.74 116.55 112.31 1oa1 n ASP 342 Ca 0.13 0.99 -0.37 0.00 0.71 0.00 0.00 54.79 56.25 1oa1 n ASP 342 Cb 0.51 -1.42 -0.01 0.00 -0.02 0.00 0.00 41.12 40.18 1oa1 n ASP 342 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1oa1 s ARG 343 N -2.31 3.75 0.76 -1.24 1.70 -1.26 -4.88 118.95 115.47 1oa1 s ARG 343 Ca 0.66 1.82 -0.11 0.00 -0.47 0.00 0.00 55.73 57.63 1oa1 s ARG 343 Cb -0.50 -2.43 0.04 0.00 -0.57 0.00 0.00 34.95 31.50 1oa1 s ARG 343 CO 0.54 -0.57 1.08 -1.25 -1.08 0.00 0.00 175.30 174.02 1oa1 s PRO 344 N -2.66 2.42 0.11 3.89 0.04 -1.26 -4.92 135.00 132.62 1oa1 s PRO 344 Ca 0.63 0.83 -0.33 0.00 0.04 0.00 0.00 61.00 62.18 1oa1 s PRO 344 Cb -0.30 -1.94 -0.12 0.00 0.04 0.00 0.00 34.50 32.18 1oa1 s PRO 344 CO 0.36 -1.43 1.74 0.00 0.04 0.00 0.00 177.00 177.71 1oa1 n ALA 345 N -3.34 1.71 -0.99 8.56 0.00 -1.26 -1.08 120.51 124.12 1oa1 n ALA 345 Ca 0.07 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1oa1 n ALA 345 Cb 0.55 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.52 1oa1 n ALA 345 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oa1 n GLY 346 N 3.93 0.45 0.00 0.00 0.00 -1.26 -4.98 105.19 103.32 1oa1 n GLY 346 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1oa1 n GLY 346 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oa1 n GLY 347 N -2.13 6.80 3.06 -0.02 0.00 -0.24 -5.17 105.19 107.48 1oa1 n GLY 347 Ca 0.00 -1.88 -0.09 0.00 0.00 0.00 0.00 46.02 44.05 1oa1 n GLY 347 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa1 s ALA 348 N -2.00 0.08 0.79 4.61 0.00 -1.26 -4.73 121.76 119.25 1oa1 s ALA 348 Ca 0.00 -0.64 -0.12 0.00 0.00 0.00 0.00 51.96 51.20 1oa1 s ALA 348 Cb 0.00 0.20 0.07 0.00 0.00 0.00 0.00 23.12 23.39 1oa1 s ALA 348 CO 0.00 -0.25 1.13 0.15 0.00 0.00 0.00 175.76 176.79 1oa1 s LYS 349 N -2.25 1.98 -0.38 0.00 1.02 -1.26 -4.63 119.74 114.21 1oa1 s LYS 349 Ca -0.08 1.43 -0.07 0.00 0.02 0.00 0.00 55.97 57.27 1oa1 s LYS 349 Cb -0.04 -1.85 0.07 0.00 -0.52 0.00 0.00 37.83 35.50 1oa1 s LYS 349 CO -0.03 -1.89 0.18 0.34 -0.92 0.00 0.00 175.35 173.02 1oa1 s ASP 350 N -2.79 5.40 -0.07 2.83 2.15 -1.26 -4.94 116.67 117.99 1oa1 s ASP 350 Ca 0.66 -1.46 0.20 0.00 0.43 0.00 0.00 52.55 52.38 1oa1 s ASP 350 Cb -0.22 -1.90 0.71 0.00 -0.30 0.00 0.00 42.92 41.21 1oa1 s ASP 350 CO 0.52 -0.45 1.61 0.49 -0.17 0.00 0.00 175.17 177.17 1oa1 n PHE 351 N 4.80 1.32 0.04 -5.34 3.72 -1.26 -4.63 117.46 116.11 1oa1 n PHE 351 Ca -0.10 -0.57 0.05 0.00 -0.05 0.00 0.00 57.45 56.79 1oa1 n PHE 351 Cb 0.43 -0.15 0.47 0.00 -0.94 0.00 0.00 39.48 39.29 1oa1 n PHE 351 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1oa1 h SER 352 N 4.25 0.38 -0.03 4.37 4.64 -1.96 -1.73 113.55 123.47 1oa1 h SER 352 Ca 0.00 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.23 1oa1 h SER 352 Cb 1.29 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 1oa1 h SER 352 CO 0.14 0.28 -0.20 0.00 -0.87 0.00 0.00 176.83 176.18 1oa1 h ALA 353 N 1.79 1.25 -0.51 5.18 0.00 -2.00 -1.27 119.26 123.69 1oa1 h ALA 353 Ca 0.13 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 1oa1 h ALA 353 Cb -0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1oa1 h ALA 353 CO -0.03 0.49 -0.14 -0.07 0.00 0.00 0.00 179.25 179.50 1oa1 h LEU 354 N 0.36 1.01 -0.29 0.00 4.07 -1.68 -1.80 115.31 116.99 1oa1 h LEU 354 Ca 0.06 -0.37 -0.04 0.00 0.08 0.00 0.00 57.88 57.61 1oa1 h LEU 354 Cb 0.55 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 42.01 1oa1 h LEU 354 CO 0.04 1.14 0.01 0.40 -1.08 0.00 0.00 178.44 178.95 1oa1 h ILE 355 N 0.86 1.25 -0.49 1.22 2.04 -1.21 0.49 117.51 121.67 1oa1 h ILE 355 Ca 0.13 -0.90 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 1oa1 h ILE 355 Cb 0.71 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 1oa1 h ILE 355 CO 0.05 0.29 0.27 0.00 0.00 0.00 0.00 178.15 178.77 1oa1 h ALA 356 N 0.84 0.63 -0.54 1.87 0.00 -1.20 -2.42 119.26 118.44 1oa1 h ALA 356 Ca 0.08 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1oa1 h ALA 356 Cb 0.41 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1oa1 h ALA 356 CO 0.01 0.15 -0.09 0.37 0.00 0.00 0.00 179.25 179.69 1oa1 h GLN 357 N 0.65 1.02 -0.67 0.00 4.15 -1.21 -3.04 115.11 116.02 1oa1 h GLN 357 Ca 0.17 -0.37 0.05 0.00 0.77 0.00 0.00 58.65 59.27 1oa1 h GLN 357 Cb 0.05 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 27.63 1oa1 h GLN 357 CO -0.03 1.06 0.44 0.00 -1.93 0.00 0.00 178.83 178.37 1oa1 h ALA 358 N 0.93 1.69 0.00 3.38 0.00 -0.55 -1.24 119.26 123.47 1oa1 h ALA 358 Ca 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1oa1 h ALA 358 Cb 0.66 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1oa1 h ALA 358 CO 0.05 0.22 -0.03 0.87 0.00 0.00 0.00 179.25 180.35 1oa1 h LYS 359 N 0.74 0.00 -0.01 0.00 1.57 -1.32 -0.78 116.57 116.77 1oa1 h LYS 359 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1oa1 h LYS 359 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1oa1 h LYS 359 CO -0.08 0.03 -0.10 1.63 -0.57 0.00 0.00 179.45 180.36 1oa1 n LYS 360 N -3.53 1.34 -3.88 3.15 5.02 -0.47 -4.95 118.16 114.83 1oa1 n LYS 360 Ca -0.02 -0.79 -0.29 0.00 -2.02 0.00 0.00 58.31 55.19 1oa1 n LYS 360 Cb 0.14 -1.48 -0.04 0.00 -0.02 0.00 0.00 35.03 33.63 1oa1 n LYS 360 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1oa1 s PRO 362 N -2.92 1.49 0.91 0.00 0.04 -1.26 -4.60 135.00 128.67 1oa1 s PRO 362 Ca 0.36 0.85 -0.12 0.00 0.04 0.00 0.00 61.00 62.13 1oa1 s PRO 362 Cb -0.12 -1.83 0.14 0.00 0.04 0.00 0.00 34.50 32.73 1oa1 s PRO 362 CO 0.28 -2.09 1.10 -1.25 0.04 0.00 0.00 177.00 175.08 1oa1 s PRO 363 N -4.95 1.13 0.53 0.56 0.04 -1.26 -4.32 135.00 126.73 1oa1 s PRO 363 Ca 0.63 0.64 -0.21 0.00 0.04 0.00 0.00 61.00 62.09 1oa1 s PRO 363 Cb -0.17 -1.81 -0.05 0.00 0.04 0.00 0.00 34.50 32.50 1oa1 s PRO 363 CO 0.56 -2.28 1.25 -2.14 0.04 0.00 0.00 177.00 174.44 1oa1 s PRO 364 N -5.02 3.29 -0.01 0.56 0.02 -1.22 -4.75 135.00 127.87 1oa1 s PRO 364 Ca 0.64 1.97 -0.30 0.00 0.02 0.00 0.00 61.00 63.33 1oa1 s PRO 364 Cb -0.17 -2.21 -0.04 0.00 0.02 0.00 0.00 34.50 32.10 1oa1 s PRO 364 CO 0.56 -0.99 1.14 0.08 -0.33 0.00 0.00 177.00 177.47 1oa1 s VAL 365 N -1.46 4.34 0.04 3.83 1.01 -0.55 -4.92 120.40 122.69 1oa1 s VAL 365 Ca 0.71 1.66 -0.30 0.00 0.00 0.00 0.00 61.98 64.05 1oa1 s VAL 365 Cb -0.34 -4.07 -0.07 0.00 0.00 0.00 0.00 36.38 31.90 1oa1 s VAL 365 CO 0.39 0.06 1.52 -0.70 0.00 0.00 0.00 175.10 176.38 1oa1 s GLU 366 N 1.61 4.24 -0.01 2.72 2.12 -1.26 -4.80 118.70 123.32 1oa1 s GLU 366 Ca 0.55 2.15 0.07 0.00 0.36 0.00 0.00 54.97 58.11 1oa1 s GLU 366 Cb -0.25 -3.57 -0.10 0.00 0.26 0.00 0.00 34.13 30.47 1oa1 s GLU 366 CO 0.25 -0.65 0.24 0.44 -0.54 0.00 0.00 175.26 175.00 1oa1 n ILE 367 N 4.67 0.00 -3.84 -3.70 -5.35 -1.26 -5.05 119.36 104.83 1oa1 n ILE 367 Ca 0.14 -0.25 -0.07 0.00 -0.27 0.00 0.00 62.75 62.31 1oa1 n ILE 367 Cb 0.42 0.66 -0.01 0.00 -1.74 0.00 0.00 39.64 38.97 1oa1 n ILE 367 CO 0.00 0.00 0.00 -1.83 -1.76 0.00 0.00 176.55 172.96 1oa1 s GLU 368 N -2.11 1.80 0.23 6.28 -1.05 -1.26 -5.12 118.70 117.47 1oa1 s GLU 368 Ca -0.00 -1.02 0.03 0.00 -0.15 0.00 0.00 54.97 53.83 1oa1 s GLU 368 Cb 0.05 0.59 -0.05 0.00 -0.44 0.00 0.00 34.13 34.28 1oa1 s GLU 368 CO 0.31 -0.83 0.01 0.95 0.95 0.00 0.00 175.26 176.65 1oa1 s THR 369 N -3.61 0.96 0.00 1.83 -4.23 -1.26 -3.79 115.64 105.54 1oa1 s THR 369 Ca 0.12 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 58.61 1oa1 s THR 369 Cb -0.05 -2.38 0.00 0.00 1.34 0.00 0.00 72.50 71.41 1oa1 s THR 369 CO 0.07 -0.29 0.00 0.61 -0.54 0.00 0.00 174.62 174.47 1oa1 n GLY 370 N -0.42 0.23 3.47 3.99 0.00 -1.26 -4.83 105.19 106.36 1oa1 n GLY 370 Ca -0.05 -2.03 -0.10 0.00 0.00 0.00 0.00 46.02 43.85 1oa1 n GLY 370 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1oa1 s SER 371 N -4.00 -0.23 -0.05 1.61 1.04 -1.26 -1.83 113.70 108.98 1oa1 s SER 371 Ca 0.00 -0.49 0.05 0.00 0.48 0.00 0.00 55.95 55.99 1oa1 s SER 371 Cb 0.00 0.55 -0.00 0.00 0.10 0.00 0.00 66.02 66.66 1oa1 s SER 371 CO 0.00 -1.00 -0.18 -0.63 0.98 0.00 0.00 173.24 172.40 1oa1 s ILE 372 N -3.87 1.53 -0.15 -1.02 1.01 -0.32 -4.93 121.20 113.46 1oa1 s ILE 372 Ca 0.09 -0.77 -0.06 0.00 0.00 0.00 0.00 60.65 59.91 1oa1 s ILE 372 Cb -0.00 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 1oa1 s ILE 372 CO -0.04 0.44 0.06 -0.69 0.00 0.00 0.00 174.94 174.71 1oa1 s VAL 373 N 0.02 4.83 0.00 2.92 1.01 -1.26 -0.33 120.40 127.59 1oa1 s VAL 373 Ca -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.91 1oa1 s VAL 373 Cb -0.12 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.13 1oa1 s VAL 373 CO 0.03 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.27 1oa1 n GLY 374 N 2.86 2.22 0.00 4.51 0.00 -0.55 -4.65 105.19 109.58 1oa1 n GLY 374 Ca -0.18 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1oa1 n GLY 374 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oa1 n GLY 375 N 0.00 1.39 2.54 -0.02 0.00 -0.71 -0.66 105.19 107.72 1oa1 n GLY 375 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1oa1 n GLY 375 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1oa1 n PHE 376 N -1.24 2.64 -1.45 1.61 3.72 -0.50 -3.33 117.46 118.91 1oa1 n PHE 376 Ca 0.00 -2.70 -0.12 0.00 -0.05 0.00 0.00 57.45 54.58 1oa1 n PHE 376 Cb 0.00 -1.60 0.08 0.00 -0.94 0.00 0.00 39.48 37.02 1oa1 n PHE 376 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1oa1 n ALA 377 N 1.06 -0.59 -0.11 4.37 0.00 -1.26 -3.87 120.51 120.11 1oa1 n ALA 377 Ca 0.57 -0.73 -0.09 0.00 0.00 0.00 0.00 53.44 53.19 1oa1 n ALA 377 Cb 0.26 -0.03 0.05 0.00 0.00 0.00 0.00 19.45 19.74 1oa1 n ALA 377 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1oa1 h HIS 378 N -1.26 0.98 -0.29 0.00 2.07 -1.91 -1.13 115.15 113.62 1oa1 h HIS 378 Ca -0.18 -0.23 0.00 0.00 -2.85 0.00 0.00 60.37 57.11 1oa1 h HIS 378 Cb 0.49 -0.23 -0.01 0.00 2.57 0.00 0.00 27.41 30.23 1oa1 h HIS 378 CO 0.00 1.00 0.18 1.25 -3.07 0.00 0.00 177.93 177.29 1oa1 h HIS 379 N 0.75 0.37 -0.27 6.12 -0.00 -1.94 0.15 115.15 120.33 1oa1 h HIS 379 Ca 0.10 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.46 1oa1 h HIS 379 Cb 0.77 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 28.04 1oa1 h HIS 379 CO 0.04 0.25 0.11 0.37 -0.00 0.00 0.00 177.93 178.70 1oa1 h GLN 380 N 0.38 0.40 -0.24 5.26 5.75 -1.71 -1.24 115.11 123.71 1oa1 h GLN 380 Ca 0.10 -0.07 -0.19 0.00 -0.15 0.00 0.00 58.65 58.34 1oa1 h GLN 380 Cb -0.02 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 28.47 1oa1 h GLN 380 CO -0.02 0.42 -0.61 0.28 -2.65 0.00 0.00 178.83 176.26 1oa1 h VAL 381 N 0.28 1.28 0.00 2.39 2.07 -1.04 -2.90 116.25 118.34 1oa1 h VAL 381 Ca 0.09 -1.81 -0.04 0.00 0.82 0.00 0.00 66.70 65.76 1oa1 h VAL 381 Cb 0.17 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1oa1 h VAL 381 CO -0.01 0.58 -0.21 -0.07 0.02 0.00 0.00 177.57 177.88 1oa1 h LEU 382 N 0.60 0.00 -1.21 2.57 4.07 -0.93 -0.94 115.31 119.47 1oa1 h LEU 382 Ca -0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 1oa1 h LEU 382 Cb 1.21 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.92 1oa1 h LEU 382 CO 0.13 0.21 0.40 0.00 -1.08 0.00 0.00 178.44 178.10 1oa1 h ALA 383 N 1.79 1.41 -0.34 1.53 0.00 -1.02 -2.49 119.26 120.13 1oa1 h ALA 383 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1oa1 h ALA 383 Cb 0.41 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1oa1 h ALA 383 CO 0.03 0.50 0.00 1.28 0.00 0.00 0.00 179.25 181.06 1oa1 n LEU 384 N -4.39 2.41 -0.27 0.00 4.77 -0.40 -4.61 117.00 114.51 1oa1 n LEU 384 Ca 0.07 -1.21 -0.04 0.00 -0.03 0.00 0.00 56.01 54.80 1oa1 n LEU 384 Cb 0.08 -0.36 0.07 0.00 -2.33 0.00 0.00 43.42 40.89 1oa1 n LEU 384 CO 0.37 0.47 1.18 0.00 -1.33 0.00 0.00 177.39 178.08 1oa1 h ALA 385 N 3.44 0.97 -0.65 -1.18 0.00 -1.02 -1.53 119.26 119.29 1oa1 h ALA 385 Ca 0.00 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.91 1oa1 h ALA 385 Cb 0.73 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 1oa1 h ALA 385 CO 0.08 0.34 0.38 -0.44 0.00 0.00 0.00 179.25 179.61 1oa1 h ASP 386 N 0.99 0.59 -0.53 0.00 3.32 -1.84 0.32 116.42 119.27 1oa1 h ASP 386 Ca 0.29 0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.28 1oa1 h ASP 386 Cb -0.06 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 1oa1 h ASP 386 CO -0.08 0.40 0.04 0.50 -1.72 0.00 0.00 179.24 178.37 1oa1 h LYS 387 N 0.72 0.92 -0.28 3.56 3.64 -1.78 -1.02 116.57 122.33 1oa1 h LYS 387 Ca 0.28 -0.27 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 1oa1 h LYS 387 Cb 0.11 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1oa1 h LYS 387 CO -0.15 0.92 -0.05 0.28 -2.27 0.00 0.00 179.45 178.18 1oa1 h VAL 388 N 0.80 1.28 -0.69 2.00 2.07 -0.74 -1.79 116.25 119.17 1oa1 h VAL 388 Ca 0.16 -1.06 -0.05 0.00 0.82 0.00 0.00 66.70 66.57 1oa1 h VAL 388 Cb 0.48 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 1oa1 h VAL 388 CO 0.02 0.34 0.23 0.58 0.02 0.00 0.00 177.57 178.76 1oa1 h VAL 389 N 0.29 1.25 -0.33 2.57 2.07 -0.25 -1.21 116.25 120.65 1oa1 h VAL 389 Ca 0.07 -0.85 -0.10 0.00 0.82 0.00 0.00 66.70 66.64 1oa1 h VAL 389 Cb 0.52 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1oa1 h VAL 389 CO 0.02 0.33 -0.21 -0.33 0.02 0.00 0.00 177.57 177.41 1oa1 h GLU 390 N 1.01 0.62 -0.45 1.57 4.39 -1.11 -1.12 114.58 119.50 1oa1 h GLU 390 Ca 0.23 -0.23 -0.09 0.00 0.34 0.00 0.00 59.36 59.61 1oa1 h GLU 390 Cb 0.28 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.87 1oa1 h GLU 390 CO -0.01 0.79 -0.07 0.00 -1.16 0.00 0.00 179.01 178.56 1oa1 h ALA 391 N 1.22 1.04 -0.13 3.43 0.00 -0.84 -0.92 119.26 123.05 1oa1 h ALA 391 Ca 0.08 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 1oa1 h ALA 391 Cb 0.67 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1oa1 h ALA 391 CO 0.05 0.59 -0.24 0.28 0.00 0.00 0.00 179.25 179.93 1oa1 h VAL 392 N 0.72 1.37 0.00 0.00 2.07 -0.94 -0.24 116.25 119.23 1oa1 h VAL 392 Ca 0.13 -1.49 -0.06 0.00 0.82 0.00 0.00 66.70 66.10 1oa1 h VAL 392 Cb 0.54 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.32 1oa1 h VAL 392 CO 0.03 0.44 -0.29 0.11 0.02 0.00 0.00 177.57 177.88 1oa1 h LYS 393 N -0.02 0.00 0.00 1.57 1.57 -1.09 -2.51 116.57 116.10 1oa1 h LYS 393 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1oa1 h LYS 393 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.13 1oa1 h LYS 393 CO 0.05 0.29 -0.30 -1.13 -0.57 0.00 0.00 179.45 177.79 1oa1 n SER 394 N -4.05 0.45 0.00 0.86 3.41 -0.36 -4.95 113.62 108.98 1oa1 n SER 394 Ca -0.02 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 1oa1 n SER 394 Cb 0.35 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 1oa1 n SER 394 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oa1 n GLY 395 N 1.43 0.91 0.33 5.00 0.00 -0.93 -4.93 105.19 107.00 1oa1 n GLY 395 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.07 1oa1 n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa1 h ALA 396 N 0.00 1.40 -3.22 4.61 0.00 -1.34 -3.34 119.26 117.37 1oa1 h ALA 396 Ca 0.00 -0.10 -0.68 0.00 0.00 0.00 0.00 54.91 54.13 1oa1 h ALA 396 Cb 0.00 -0.27 -0.30 0.00 0.00 0.00 0.00 17.79 17.23 1oa1 h ALA 396 CO 0.00 0.50 -0.68 0.42 0.00 0.00 0.00 179.25 179.49 1oa1 s ILE 397 N -5.61 3.36 0.03 0.00 1.01 -0.72 -4.65 121.20 114.62 1oa1 s ILE 397 Ca -0.10 -1.00 -0.01 0.00 0.00 0.00 0.00 60.65 59.54 1oa1 s ILE 397 Cb 0.17 -2.78 -0.27 0.00 0.01 0.00 0.00 42.46 39.59 1oa1 s ILE 397 CO 0.78 0.06 0.97 0.50 0.00 0.00 0.00 174.94 177.25 1oa1 h LYS 398 N 8.11 0.21 -1.82 2.79 3.64 -0.80 -3.37 116.57 125.32 1oa1 h LYS 398 Ca -0.29 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 58.74 1oa1 h LYS 398 Cb 1.10 0.13 -0.22 0.00 -0.41 0.00 0.00 32.23 32.84 1oa1 h LYS 398 CO 0.58 1.08 0.31 0.50 -2.27 0.00 0.00 179.45 179.65 1oa1 s ARG 399 N -2.64 0.80 -0.08 1.90 3.52 -1.24 -4.90 118.95 116.30 1oa1 s ARG 399 Ca -0.06 0.45 -0.04 0.00 -0.13 0.00 0.00 55.73 55.96 1oa1 s ARG 399 Cb 0.07 0.38 -0.04 0.00 -1.56 0.00 0.00 34.95 33.81 1oa1 s ARG 399 CO 0.85 -0.20 0.07 -0.06 -0.81 0.00 0.00 175.30 175.16 1oa1 s PHE 400 N -0.57 3.37 -0.21 5.12 0.08 -0.31 -1.72 117.98 123.73 1oa1 s PHE 400 Ca -0.04 0.34 0.02 0.00 0.12 0.00 0.00 56.93 57.36 1oa1 s PHE 400 Cb -0.02 -1.84 0.04 0.00 -0.57 0.00 0.00 43.02 40.62 1oa1 s PHE 400 CO 0.03 0.60 -0.15 0.08 -0.10 0.00 0.00 175.22 175.68 1oa1 s VAL 401 N -1.00 1.98 -0.35 -0.44 1.01 0.15 -0.98 120.40 120.76 1oa1 s VAL 401 Ca 0.16 -1.17 -0.28 0.00 0.00 0.00 0.00 61.98 60.69 1oa1 s VAL 401 Cb -0.12 -1.95 0.02 0.00 0.00 0.00 0.00 36.38 34.33 1oa1 s VAL 401 CO 0.05 0.27 1.02 -0.69 0.00 0.00 0.00 175.10 175.75 1oa1 s VAL 402 N 1.26 4.52 -0.22 2.92 1.01 0.70 -1.19 120.40 129.41 1oa1 s VAL 402 Ca -0.01 1.50 0.11 0.00 0.00 0.00 0.00 61.98 63.58 1oa1 s VAL 402 Cb -0.16 -4.39 0.43 0.00 0.00 0.00 0.00 36.38 32.26 1oa1 s VAL 402 CO -0.09 -0.53 1.24 0.23 0.00 0.00 0.00 175.10 175.95 1oa1 n MET 403 N 6.88 1.69 -0.91 2.72 2.81 0.01 -0.19 117.12 130.14 1oa1 n MET 403 Ca 0.10 -3.34 -0.29 0.00 -1.81 0.00 0.00 57.70 52.36 1oa1 n MET 403 Cb 0.48 -1.66 0.19 0.00 -0.71 0.00 0.00 33.22 31.52 1oa1 n MET 403 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1oa1 s ALA 404 N -3.26 0.61 0.00 3.04 0.00 -1.24 -4.60 121.76 116.31 1oa1 s ALA 404 Ca 0.39 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.22 1oa1 s ALA 404 Cb 0.37 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 20.29 1oa1 s ALA 404 CO -0.06 -3.09 0.00 0.41 0.00 0.00 0.00 175.76 173.02 1oa1 n GLY 405 N -0.30 0.41 3.57 0.00 0.00 -0.05 -2.42 105.19 106.39 1oa1 n GLY 405 Ca 0.05 -1.79 -0.32 0.00 0.00 0.00 0.00 46.02 43.96 1oa1 n GLY 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa1 s ASP 407 N -1.33 4.45 0.01 0.00 2.15 -1.25 -3.79 116.67 116.90 1oa1 s ASP 407 Ca 0.16 0.29 -0.03 0.00 0.43 0.00 0.00 52.55 53.40 1oa1 s ASP 407 Cb -0.11 -0.79 0.01 0.00 -0.30 0.00 0.00 42.92 41.73 1oa1 s ASP 407 CO 0.06 -1.84 0.12 0.61 -0.17 0.00 0.00 175.17 173.96 1oa1 n GLY 408 N -3.05 1.04 0.07 2.66 0.00 -1.26 -4.69 105.19 99.96 1oa1 n GLY 408 Ca 0.10 -0.92 -0.09 0.00 0.00 0.00 0.00 46.02 45.11 1oa1 n GLY 408 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1oa1 h ARG 409 N 0.00 0.05 -6.79 1.61 3.08 -1.99 -3.47 114.38 106.86 1oa1 h ARG 409 Ca -0.03 -0.09 -0.53 0.00 0.07 0.00 0.00 59.98 59.41 1oa1 h ARG 409 Cb 0.13 0.03 0.07 0.00 0.08 0.00 0.00 29.97 30.28 1oa1 h ARG 409 CO 0.04 0.98 0.78 -0.65 -1.07 0.00 0.00 179.97 180.04 1oa1 s GLN 410 N -2.68 4.23 0.57 0.04 -0.21 -1.26 -4.87 119.66 115.48 1oa1 s GLN 410 Ca -0.01 2.38 0.35 0.00 0.02 0.00 0.00 55.36 58.10 1oa1 s GLN 410 Cb 0.09 -3.07 1.66 0.00 1.00 0.00 0.00 33.01 32.69 1oa1 s GLN 410 CO 0.83 -0.46 2.11 0.87 -2.12 0.00 0.00 175.29 176.52 1oa1 h LYS 411 N 4.62 0.00 -0.01 2.91 1.57 -2.05 -1.55 116.57 122.06 1oa1 h LYS 411 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1oa1 h LYS 411 Cb 1.22 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.53 1oa1 h LYS 411 CO 0.75 0.05 0.16 0.66 -0.57 0.00 0.00 179.45 180.50 1oa1 h SER 412 N 0.00 0.00 0.42 0.86 4.64 -1.99 -1.76 113.55 115.72 1oa1 h SER 412 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1oa1 h SER 412 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1oa1 h SER 412 CO 0.01 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.51 1oa1 n ARG 413 N -3.01 0.14 0.15 4.77 1.74 -0.58 -1.90 116.66 117.97 1oa1 n ARG 413 Ca -0.02 0.16 0.19 0.00 -0.77 0.00 0.00 57.85 57.41 1oa1 n ARG 413 Cb 0.22 -1.50 0.79 0.00 -1.02 0.00 0.00 32.46 30.95 1oa1 n ARG 413 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1oa1 h SER 414 N 0.00 0.00 -0.80 0.55 4.64 -1.55 -1.06 113.55 115.33 1oa1 h SER 414 Ca 0.00 0.00 0.19 0.00 -0.47 0.00 0.00 61.79 61.51 1oa1 h SER 414 Cb 0.21 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.17 1oa1 h SER 414 CO 0.00 0.00 0.07 0.22 -0.87 0.00 0.00 176.83 176.25 1oa1 h TYR 415 N 0.00 0.07 -0.52 4.77 3.20 -1.64 -0.57 116.97 122.28 1oa1 h TYR 415 Ca 0.14 0.05 -0.11 0.00 3.14 0.00 0.00 58.73 61.95 1oa1 h TYR 415 Cb 0.79 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.15 1oa1 h TYR 415 CO 0.00 -0.23 -0.12 1.88 -1.64 0.00 0.00 178.16 178.04 1oa1 h TYR 416 N 0.13 1.12 -0.53 -3.82 0.05 -1.44 0.62 116.97 113.11 1oa1 h TYR 416 Ca 0.46 -0.24 -0.01 0.00 0.05 0.00 0.00 58.73 58.99 1oa1 h TYR 416 Cb 0.85 -0.27 -0.03 0.00 1.01 0.00 0.00 36.73 38.29 1oa1 h TYR 416 CO -0.38 1.05 0.29 1.15 -1.05 0.00 0.00 178.16 179.23 1oa1 h THR 417 N 0.87 1.18 -0.24 -2.88 2.02 -1.52 -2.22 112.91 110.12 1oa1 h THR 417 Ca 0.13 -0.45 -0.14 0.00 0.77 0.00 0.00 66.41 66.72 1oa1 h THR 417 Cb 0.69 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 1oa1 h THR 417 CO 0.05 0.19 -0.43 -0.33 0.37 0.00 0.00 175.52 175.37 1oa1 h GLU 418 N 0.71 0.60 -0.12 6.66 5.08 -0.79 -1.40 114.58 125.32 1oa1 h GLU 418 Ca 0.19 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1oa1 h GLU 418 Cb 0.04 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1oa1 h GLU 418 CO -0.03 0.91 0.07 0.28 -1.00 0.00 0.00 179.01 179.25 1oa1 h VAL 419 N 0.49 1.07 -0.99 3.13 2.07 -0.82 -0.99 116.25 120.21 1oa1 h VAL 419 Ca 0.04 -0.18 0.05 0.00 0.82 0.00 0.00 66.70 67.42 1oa1 h VAL 419 Cb 0.94 0.97 -0.06 0.00 -1.52 0.00 0.00 31.29 31.63 1oa1 h VAL 419 CO 0.08 0.06 0.64 0.00 0.02 0.00 0.00 177.57 178.38 1oa1 h ALA 420 N 0.99 1.33 -0.05 1.67 0.00 -1.05 -0.78 119.26 121.38 1oa1 h ALA 420 Ca 0.04 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1oa1 h ALA 420 Cb 0.04 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1oa1 h ALA 420 CO -0.01 0.50 -0.61 0.93 0.00 0.00 0.00 179.25 180.07 1oa1 h GLU 421 N 1.22 0.16 -0.01 0.00 5.08 -1.07 -3.30 114.58 116.65 1oa1 h GLU 421 Ca 0.40 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 1oa1 h GLU 421 Cb 0.05 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1oa1 h GLU 421 CO -0.14 0.72 -0.47 0.09 -1.00 0.00 0.00 179.01 178.21 1oa1 n ASN 422 N -3.85 1.67 -4.76 1.42 3.02 -0.39 -4.96 115.26 107.40 1oa1 n ASN 422 Ca -0.02 -1.33 -0.38 0.00 -0.03 0.00 0.00 54.58 52.81 1oa1 n ASN 422 Cb 0.62 0.56 0.02 0.00 -0.61 0.00 0.00 39.78 40.37 1oa1 n ASN 422 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1oa1 s LEU 423 N -2.33 3.95 0.77 3.41 1.43 -0.34 -4.94 118.68 120.63 1oa1 s LEU 423 Ca 0.14 2.71 -0.15 0.00 -1.03 0.00 0.00 54.13 55.80 1oa1 s LEU 423 Cb 0.15 -4.18 0.03 0.00 0.03 0.00 0.00 46.19 42.22 1oa1 s LEU 423 CO 0.52 -1.33 0.97 -2.65 0.23 0.00 0.00 176.35 174.09 1oa1 n PRO 424 N -0.69 0.33 0.00 1.29 -0.02 -1.26 -4.87 135.00 129.77 1oa1 n PRO 424 Ca 0.08 0.17 0.09 0.00 -2.02 0.00 0.00 63.50 61.83 1oa1 n PRO 424 Cb 0.45 -2.24 0.45 0.00 -0.02 0.00 0.00 33.50 32.13 1oa1 n PRO 424 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1oa1 n LYS 425 N -2.24 0.18 -1.06 -0.52 5.02 -1.26 -2.31 118.16 115.97 1oa1 n LYS 425 Ca 0.13 0.13 -0.12 0.00 -2.02 0.00 0.00 58.31 56.43 1oa1 n LYS 425 Cb 0.50 -1.50 0.25 0.00 -0.02 0.00 0.00 35.03 34.26 1oa1 n LYS 425 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1oa1 n ASP 426 N -1.36 4.20 -4.51 4.39 5.68 -1.26 -4.91 116.55 118.78 1oa1 n ASP 426 Ca 0.07 -3.41 -0.25 0.00 -0.50 0.00 0.00 54.79 50.70 1oa1 n ASP 426 Cb 0.17 -0.76 -0.10 0.00 -1.14 0.00 0.00 41.12 39.29 1oa1 n ASP 426 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1oa1 s THR 427 N -3.13 2.76 -0.07 2.12 -4.23 -0.98 -0.31 115.64 111.81 1oa1 s THR 427 Ca 0.54 -2.08 0.03 0.00 -1.18 0.00 0.00 61.69 59.00 1oa1 s THR 427 Cb 0.45 -2.41 0.01 0.00 1.34 0.00 0.00 72.50 71.88 1oa1 s THR 427 CO 0.11 -0.27 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.06 1oa1 s VAL 428 N -2.12 1.47 -0.13 2.29 1.01 -0.70 -4.85 120.40 117.37 1oa1 s VAL 428 Ca 0.27 -0.69 -0.18 0.00 0.00 0.00 0.00 61.98 61.37 1oa1 s VAL 428 Cb -0.07 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 1oa1 s VAL 428 CO 0.15 0.43 0.48 -0.63 0.00 0.00 0.00 175.10 175.53 1oa1 s ILE 429 N 0.40 5.18 -0.15 2.22 1.01 0.65 -0.68 121.20 129.83 1oa1 s ILE 429 Ca -0.13 0.95 -0.05 0.00 0.00 0.00 0.00 60.65 61.42 1oa1 s ILE 429 Cb -0.15 -3.82 -0.03 0.00 0.01 0.00 0.00 42.46 38.46 1oa1 s ILE 429 CO 0.05 0.30 0.02 -0.76 0.00 0.00 0.00 174.94 174.55 1oa1 s LEU 430 N 0.80 3.60 0.14 2.97 1.43 -0.33 -0.64 118.68 126.65 1oa1 s LEU 430 Ca 0.25 0.04 -0.03 0.00 -1.03 0.00 0.00 54.13 53.36 1oa1 s LEU 430 Cb -0.15 -1.88 -0.03 0.00 0.03 0.00 0.00 46.19 44.16 1oa1 s LEU 430 CO 0.10 0.22 0.10 0.28 0.23 0.00 0.00 176.35 177.28 1oa1 s THR 431 N 0.09 0.10 -0.23 5.49 -1.32 -0.48 -0.81 115.64 118.48 1oa1 s THR 431 Ca 0.03 -1.80 -0.28 0.00 -1.21 0.00 0.00 61.69 58.43 1oa1 s THR 431 Cb -0.13 -1.99 0.15 0.00 -1.51 0.00 0.00 72.50 69.02 1oa1 s THR 431 CO 0.02 -0.44 1.14 0.00 -2.21 0.00 0.00 174.62 173.12 1oa1 s ALA 432 N -4.03 -2.02 0.00 11.08 0.00 -1.26 -0.98 121.76 124.55 1oa1 s ALA 432 Ca 0.22 1.73 0.00 0.00 0.00 0.00 0.00 51.96 53.91 1oa1 s ALA 432 Cb 0.07 -1.20 0.00 0.00 0.00 0.00 0.00 23.12 21.98 1oa1 s ALA 432 CO 0.01 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 175.93 1oa1 n GLY 433 N 1.18 -1.34 0.00 0.00 0.00 -0.65 -0.87 105.19 103.50 1oa1 n GLY 433 Ca -0.09 -1.59 0.14 0.00 0.00 0.00 0.00 46.02 44.49 1oa1 n GLY 433 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oa1 h ALA 435 N 3.52 2.80 -0.67 0.00 0.00 -1.31 -1.56 119.26 122.05 1oa1 h ALA 435 Ca 0.00 -0.03 0.19 0.00 0.00 0.00 0.00 54.91 55.07 1oa1 h ALA 435 Cb 0.19 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1oa1 h ALA 435 CO 0.00 -1.06 0.55 1.57 0.00 0.00 0.00 179.25 180.31 1oa1 h LYS 436 N 0.00 0.00 0.00 0.00 2.10 -1.68 -2.25 116.57 114.75 1oa1 h LYS 436 Ca 0.40 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.05 1oa1 h LYS 436 Cb 1.64 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.97 1oa1 h LYS 436 CO -0.00 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.11 1oa1 n TYR 437 N -4.03 0.08 0.48 0.07 4.01 -0.59 -1.04 117.16 116.16 1oa1 n TYR 437 Ca 0.13 0.03 0.12 0.00 -0.16 0.00 0.00 57.90 58.02 1oa1 n TYR 437 Cb 0.80 -0.55 0.46 0.00 -0.31 0.00 0.00 39.34 39.75 1oa1 n TYR 437 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1oa1 n ARG 438 N -1.57 0.19 0.00 -0.72 5.12 -0.85 -4.36 116.66 114.47 1oa1 n ARG 438 Ca 0.04 0.34 0.00 0.00 -1.93 0.00 0.00 57.85 56.30 1oa1 n ARG 438 Cb 0.21 -1.82 0.00 0.00 -1.16 0.00 0.00 32.46 29.70 1oa1 n ARG 438 CO 0.00 0.00 0.00 2.48 -1.93 0.00 0.00 177.63 178.18 1oa1 n TYR 439 N -2.17 0.00 1.63 -1.55 0.18 -0.56 -4.14 117.16 110.55 1oa1 n TYR 439 Ca 0.03 0.00 0.13 0.00 1.88 0.00 0.00 57.90 59.94 1oa1 n TYR 439 Cb 0.28 0.05 0.60 0.00 -0.38 0.00 0.00 39.34 39.89 1oa1 n TYR 439 CO 0.00 0.00 0.00 0.27 -2.08 0.00 0.00 176.86 175.05 1oa1 n ASN 440 N 0.00 0.99 -0.39 9.48 6.94 -0.20 -3.25 115.26 128.83 1oa1 n ASN 440 Ca 0.00 -1.41 0.09 0.00 -0.02 0.00 0.00 54.58 53.24 1oa1 n ASN 440 Cb 0.39 -0.02 0.18 0.00 -2.36 0.00 0.00 39.78 37.98 1oa1 n ASN 440 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1oa1 n LYS 441 N -0.20 1.86 -2.21 -3.83 5.02 -1.26 -4.79 118.16 112.76 1oa1 n LYS 441 Ca 0.19 -2.70 -0.27 0.00 -2.02 0.00 0.00 58.31 53.51 1oa1 n LYS 441 Cb 0.25 -1.63 0.14 0.00 -0.02 0.00 0.00 35.03 33.77 1oa1 n LYS 441 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1oa1 s LEU 442 N -2.88 2.82 -0.65 -0.35 1.43 -1.20 -5.05 118.68 112.79 1oa1 s LEU 442 Ca 0.36 0.09 0.05 0.00 -1.03 0.00 0.00 54.13 53.61 1oa1 s LEU 442 Cb 0.31 -2.36 0.20 0.00 0.03 0.00 0.00 46.19 44.37 1oa1 s LEU 442 CO 0.05 -2.20 0.58 -3.20 0.23 0.00 0.00 176.35 171.80 1oa1 n ASN 443 N -3.28 2.94 0.00 2.29 5.15 -1.26 -4.90 115.26 116.21 1oa1 n ASN 443 Ca 0.14 -3.22 0.11 0.00 -0.60 0.00 0.00 54.58 51.00 1oa1 n ASN 443 Cb 0.60 -0.71 0.06 0.00 -0.53 0.00 0.00 39.78 39.20 1oa1 n ASN 443 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1oa1 n LEU 444 N 1.57 0.72 0.00 1.20 4.77 -1.26 -5.06 117.00 118.94 1oa1 n LEU 444 Ca 0.24 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1oa1 n LEU 444 Cb 0.39 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1oa1 n LEU 444 CO 0.30 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1oa1 n GLY 445 N 1.48 -0.31 3.22 -0.72 0.00 -1.26 -4.73 105.19 102.87 1oa1 n GLY 445 Ca 0.04 -1.05 -0.13 0.00 0.00 0.00 0.00 46.02 44.88 1oa1 n GLY 445 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1oa1 s ASP 446 N -4.00 0.41 -0.29 1.61 -4.77 -1.26 -0.93 116.67 107.44 1oa1 s ASP 446 Ca 0.00 -1.42 0.02 0.00 -3.30 0.00 0.00 52.55 47.86 1oa1 s ASP 446 Cb 0.00 0.36 0.08 0.00 -1.09 0.00 0.00 42.92 42.27 1oa1 s ASP 446 CO 0.00 -0.84 -0.01 -0.63 0.70 0.00 0.00 175.17 174.39 1oa1 s ILE 447 N -4.05 1.86 -1.46 2.11 1.01 0.09 -4.77 121.20 115.98 1oa1 s ILE 447 Ca 0.39 -1.72 -0.10 0.00 0.00 0.00 0.00 60.65 59.21 1oa1 s ILE 447 Cb 0.07 -2.20 0.06 0.00 0.01 0.00 0.00 42.46 40.40 1oa1 s ILE 447 CO 0.13 -0.32 0.79 0.61 0.00 0.00 0.00 174.94 176.16 1oa1 n GLY 448 N 4.49 -0.50 1.60 6.18 0.00 -1.26 -1.59 105.19 114.11 1oa1 n GLY 448 Ca -0.06 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1oa1 n GLY 448 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oa1 n GLY 449 N -1.55 2.90 3.62 -0.02 0.00 -1.26 -5.03 105.19 103.86 1oa1 n GLY 449 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1oa1 n GLY 449 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oa1 s ILE 450 N -2.21 4.43 0.56 -0.61 1.01 -0.62 -5.01 121.20 118.75 1oa1 s ILE 450 Ca 0.00 1.51 -0.20 0.00 0.00 0.00 0.00 60.65 61.95 1oa1 s ILE 450 Cb 0.00 -4.46 -0.06 0.00 0.01 0.00 0.00 42.46 37.95 1oa1 s ILE 450 CO 0.00 -0.65 1.07 -2.65 0.00 0.00 0.00 174.94 172.71 1oa1 n PRO 451 N 7.15 1.16 0.00 2.79 -0.02 -1.26 -0.73 135.00 144.09 1oa1 n PRO 451 Ca 0.11 0.44 0.13 0.00 -2.02 0.00 0.00 63.50 62.16 1oa1 n PRO 451 Cb 0.48 -2.25 0.60 0.00 -0.02 0.00 0.00 33.50 32.31 1oa1 n PRO 451 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1oa1 n ARG 452 N -0.85 0.12 -4.00 -0.52 1.74 -0.11 -4.42 116.66 108.62 1oa1 n ARG 452 Ca 0.12 0.04 -0.30 0.00 -0.77 0.00 0.00 57.85 56.95 1oa1 n ARG 452 Cb 0.45 -1.50 -0.16 0.00 -1.02 0.00 0.00 32.46 30.23 1oa1 n ARG 452 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1oa1 s VAL 453 N -2.87 1.53 -0.34 1.55 1.01 -1.26 -0.25 120.40 119.78 1oa1 s VAL 453 Ca 0.17 -0.68 -0.03 0.00 0.00 0.00 0.00 61.98 61.43 1oa1 s VAL 453 Cb 0.18 -1.49 0.06 0.00 0.00 0.00 0.00 36.38 35.13 1oa1 s VAL 453 CO 0.46 0.38 0.08 -0.76 0.00 0.00 0.00 175.10 175.26 1oa1 s LEU 454 N 1.49 4.32 -0.47 3.92 1.43 0.18 -4.94 118.68 124.61 1oa1 s LEU 454 Ca 0.04 -1.40 -0.20 0.00 -1.03 0.00 0.00 54.13 51.54 1oa1 s LEU 454 Cb -0.14 -1.78 0.04 0.00 0.03 0.00 0.00 46.19 44.34 1oa1 s LEU 454 CO -0.10 -0.34 0.62 -0.62 0.23 0.00 0.00 176.35 176.14 1oa1 s ASP 455 N 1.43 6.26 0.38 2.29 2.15 -1.26 -1.38 116.67 126.55 1oa1 s ASP 455 Ca -0.01 -0.64 0.25 0.00 0.43 0.00 0.00 52.55 52.57 1oa1 s ASP 455 Cb -0.20 -2.30 0.57 0.00 -0.30 0.00 0.00 42.92 40.69 1oa1 s ASP 455 CO -0.01 -0.82 1.69 0.00 -0.17 0.00 0.00 175.17 175.86 1oa1 h ALA 456 N 8.93 1.00 0.00 3.66 0.00 -1.17 -1.10 119.26 130.59 1oa1 h ALA 456 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1oa1 h ALA 456 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1oa1 h ALA 456 CO 0.92 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.58 1oa1 n GLY 457 N 1.04 0.45 3.80 0.00 0.00 -1.26 -4.13 105.19 105.09 1oa1 n GLY 457 Ca 0.04 -1.22 -0.29 0.00 0.00 0.00 0.00 46.02 44.54 1oa1 n GLY 457 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1oa1 s GLN 458 N -0.76 0.68 0.32 1.61 -0.21 -1.26 -1.64 119.66 118.40 1oa1 s GLN 458 Ca 0.00 0.04 0.05 0.00 0.02 0.00 0.00 55.36 55.47 1oa1 s GLN 458 Cb 0.00 -1.81 0.68 0.00 1.00 0.00 0.00 33.01 32.89 1oa1 s GLN 458 CO 0.00 -2.46 1.86 0.00 -2.12 0.00 0.00 175.29 172.57 1oa1 h ASN 460 N 0.85 0.00 0.00 0.00 -1.07 -1.95 -0.81 115.58 112.59 1oa1 h ASN 460 Ca 0.47 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.84 1oa1 h ASN 460 Cb 0.58 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.83 1oa1 h ASN 460 CO -0.23 0.02 0.00 0.47 0.07 0.00 0.00 177.43 177.76 1oa1 n ASP 461 N -3.96 0.00 0.11 6.14 8.00 0.11 -1.73 116.55 125.22 1oa1 n ASP 461 Ca -0.03 -1.32 0.20 0.00 0.71 0.00 0.00 54.79 54.34 1oa1 n ASP 461 Cb 0.11 0.00 0.76 0.00 -0.02 0.00 0.00 41.12 41.97 1oa1 n ASP 461 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1oa1 h SER 462 N 0.00 0.00 -0.48 -2.24 0.02 -1.17 -0.45 113.55 109.24 1oa1 h SER 462 Ca 0.00 0.00 0.08 0.00 -0.84 0.00 0.00 61.79 61.03 1oa1 h SER 462 Cb 0.00 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.48 1oa1 h SER 462 CO 0.00 0.00 0.10 0.22 -1.14 0.00 0.00 176.83 176.01 1oa1 h TYR 463 N 0.00 0.17 -0.90 3.45 3.20 -1.57 -1.37 116.97 119.96 1oa1 h TYR 463 Ca 0.18 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.12 1oa1 h TYR 463 Cb 0.94 -0.00 -0.05 0.00 1.54 0.00 0.00 36.73 39.15 1oa1 h TYR 463 CO 0.00 0.01 0.59 0.77 -1.64 0.00 0.00 178.16 177.89 1oa1 h SER 464 N 0.24 0.95 -0.69 -2.11 0.02 -1.31 -0.48 113.55 110.17 1oa1 h SER 464 Ca 0.24 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.11 1oa1 h SER 464 Cb 0.30 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.60 1oa1 h SER 464 CO -0.30 0.64 0.16 -0.07 -1.14 0.00 0.00 176.83 176.12 1oa1 h LEU 465 N 1.09 1.05 -0.47 5.07 3.38 -1.22 -0.65 115.31 123.56 1oa1 h LEU 465 Ca 0.37 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 1oa1 h LEU 465 Cb 0.07 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1oa1 h LEU 465 CO -0.12 1.01 0.12 0.00 0.09 0.00 0.00 178.44 179.54 1oa1 h ALA 466 N 1.12 0.62 -0.93 1.53 0.00 -0.66 -1.31 119.26 119.62 1oa1 h ALA 466 Ca 0.22 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1oa1 h ALA 466 Cb 0.37 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 1oa1 h ALA 466 CO 0.00 0.30 0.58 0.28 0.00 0.00 0.00 179.25 180.41 1oa1 h VAL 467 N 0.63 1.25 -0.23 0.00 2.07 -0.76 -0.65 116.25 118.56 1oa1 h VAL 467 Ca 0.15 -0.53 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 1oa1 h VAL 467 Cb 0.31 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 1oa1 h VAL 467 CO -0.00 0.26 0.03 0.40 0.02 0.00 0.00 177.57 178.28 1oa1 h ILE 468 N 1.28 1.23 -0.74 4.57 2.04 -0.97 -0.97 117.51 123.95 1oa1 h ILE 468 Ca 0.34 -0.77 0.01 0.00 1.00 0.00 0.00 64.86 65.44 1oa1 h ILE 468 Cb -0.08 1.30 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 1oa1 h ILE 468 CO -0.07 0.24 0.49 0.00 0.00 0.00 0.00 178.15 178.82 1oa1 h ALA 469 N 0.84 0.94 -0.48 1.87 0.00 -0.87 -0.32 119.26 121.24 1oa1 h ALA 469 Ca 0.07 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1oa1 h ALA 469 Cb 0.33 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1oa1 h ALA 469 CO 0.01 0.35 -0.05 -0.07 0.00 0.00 0.00 179.25 179.49 1oa1 h LEU 470 N 1.00 0.80 -0.31 0.00 3.38 -0.95 -0.36 115.31 118.87 1oa1 h LEU 470 Ca 0.27 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 1oa1 h LEU 470 Cb -0.11 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.42 1oa1 h LEU 470 CO -0.06 0.89 -0.11 0.50 0.09 0.00 0.00 178.44 179.75 1oa1 h LYS 471 N 0.76 0.63 -0.44 1.13 1.63 -0.70 -2.64 116.57 116.92 1oa1 h LYS 471 Ca 0.14 -0.26 -0.07 0.00 -0.85 0.00 0.00 60.65 59.61 1oa1 h LYS 471 Cb 0.52 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.11 1oa1 h LYS 471 CO 0.03 0.83 -0.03 -0.07 -3.45 0.00 0.00 179.45 176.76 1oa1 h LEU 472 N 0.39 0.70 -0.53 5.20 3.38 -0.81 -0.80 115.31 122.85 1oa1 h LEU 472 Ca 0.07 -0.17 0.08 0.00 0.09 0.00 0.00 57.88 57.95 1oa1 h LEU 472 Cb 0.62 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 41.11 1oa1 h LEU 472 CO 0.04 0.79 0.17 0.50 0.09 0.00 0.00 178.44 180.03 1oa1 h LYS 473 N 0.68 0.32 -0.21 1.13 3.64 -0.94 -0.22 116.57 120.97 1oa1 h LYS 473 Ca 0.13 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 1oa1 h LYS 473 Cb 0.46 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 1oa1 h LYS 473 CO 0.02 0.21 0.00 1.49 -2.27 0.00 0.00 179.45 178.91 1oa1 h GLU 474 N 0.33 0.37 -0.74 1.90 4.81 -0.97 -1.60 114.58 118.69 1oa1 h GLU 474 Ca 0.26 -0.12 -0.05 0.00 -0.13 0.00 0.00 59.36 59.33 1oa1 h GLU 474 Cb 0.32 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.63 1oa1 h GLU 474 CO -0.29 0.56 0.27 0.28 -0.73 0.00 0.00 179.01 179.09 1oa1 h VAL 475 N 0.14 1.25 -0.00 0.32 2.07 -0.83 -2.07 116.25 117.12 1oa1 h VAL 475 Ca 0.06 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.75 1oa1 h VAL 475 Cb 0.39 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 1oa1 h VAL 475 CO 0.01 0.33 -0.07 0.49 0.02 0.00 0.00 177.57 178.36 1oa1 n PHE 476 N -4.27 0.00 -2.66 1.57 3.72 -0.12 -4.94 117.46 110.76 1oa1 n PHE 476 Ca 0.06 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.32 1oa1 n PHE 476 Cb 0.20 -0.18 0.02 0.00 -0.94 0.00 0.00 39.48 38.58 1oa1 n PHE 476 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1oa1 n GLY 477 N 1.25 -0.09 3.86 1.37 0.00 -0.78 -5.00 105.19 105.80 1oa1 n GLY 477 Ca 0.16 -0.23 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 1oa1 n GLY 477 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oa1 s LEU 478 N -4.28 4.25 0.20 0.99 1.43 -0.67 -4.99 118.68 115.62 1oa1 s LEU 478 Ca 0.16 0.96 0.12 0.00 -1.03 0.00 0.00 54.13 54.34 1oa1 s LEU 478 Cb -0.07 -3.44 -0.05 0.00 0.03 0.00 0.00 46.19 42.65 1oa1 s LEU 478 CO 0.20 0.02 1.34 0.44 0.23 0.00 0.00 176.35 178.58 1oa1 h ASP 479 N 3.06 0.00 -3.33 2.29 3.32 -1.94 -3.45 116.42 116.36 1oa1 h ASP 479 Ca -0.48 0.00 -0.46 0.00 0.02 0.00 0.00 57.03 56.11 1oa1 h ASP 479 Cb 1.18 0.00 -0.36 0.00 0.22 0.00 0.00 39.33 40.37 1oa1 h ASP 479 CO 0.68 0.71 -0.78 -0.62 -1.72 0.00 0.00 179.24 177.50 1oa1 s ASP 480 N -6.52 1.53 0.51 6.45 -1.08 -1.26 -5.02 116.67 111.28 1oa1 s ASP 480 Ca 0.02 -0.19 0.26 0.00 -0.52 0.00 0.00 52.55 52.13 1oa1 s ASP 480 Cb 0.09 -0.60 1.36 0.00 -1.46 0.00 0.00 42.92 42.30 1oa1 s ASP 480 CO 0.78 -0.09 1.93 -0.29 0.52 0.00 0.00 175.17 178.02 1oa1 h ILE 481 N 6.17 0.66 0.00 4.11 2.10 -1.92 -0.50 117.51 128.13 1oa1 h ILE 481 Ca -0.30 -0.03 0.00 0.00 1.08 0.00 0.00 64.86 65.61 1oa1 h ILE 481 Cb 1.15 0.56 0.00 0.00 -1.09 0.00 0.00 36.82 37.44 1oa1 h ILE 481 CO 0.40 0.02 0.00 0.59 -1.08 0.00 0.00 178.15 178.08 1oa1 n ASN 482 N -4.36 0.01 -0.54 2.19 3.02 -1.26 -2.74 115.26 111.58 1oa1 n ASN 482 Ca 0.15 0.50 0.14 0.00 -0.03 0.00 0.00 54.58 55.34 1oa1 n ASN 482 Cb 0.75 -0.51 0.47 0.00 -0.61 0.00 0.00 39.78 39.88 1oa1 n ASN 482 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1oa1 n ASP 483 N -1.52 1.67 -4.73 6.41 8.00 -0.20 -4.86 116.55 121.34 1oa1 n ASP 483 Ca 0.04 -1.57 -0.35 0.00 0.71 0.00 0.00 54.79 53.63 1oa1 n ASP 483 Cb 0.20 -0.01 0.08 0.00 -0.02 0.00 0.00 41.12 41.37 1oa1 n ASP 483 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1oa1 s LEU 484 N -1.96 3.38 -1.56 0.64 1.43 -1.11 -4.90 118.68 114.61 1oa1 s LEU 484 Ca 0.37 2.36 -0.11 0.00 -1.03 0.00 0.00 54.13 55.72 1oa1 s LEU 484 Cb 0.21 -4.59 -0.04 0.00 0.03 0.00 0.00 46.19 41.80 1oa1 s LEU 484 CO 0.33 -2.13 2.72 -0.81 0.23 0.00 0.00 176.35 176.69 1oa1 n PRO 485 N -2.51 3.58 -4.20 1.29 -0.04 -1.26 -4.82 135.00 127.04 1oa1 n PRO 485 Ca 0.13 -2.43 -0.18 0.00 -0.04 0.00 0.00 63.50 60.98 1oa1 n PRO 485 Cb 0.50 -2.90 -0.16 0.00 -0.04 0.00 0.00 33.50 30.90 1oa1 n PRO 485 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1oa1 s VAL 486 N 2.09 0.52 0.21 0.52 1.01 -1.26 -1.16 120.40 122.33 1oa1 s VAL 486 Ca 0.63 -0.19 0.11 0.00 0.00 0.00 0.00 61.98 62.52 1oa1 s VAL 486 Cb 0.17 -0.50 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 1oa1 s VAL 486 CO -0.07 0.19 -0.18 -0.44 0.00 0.00 0.00 175.10 174.60 1oa1 s SER 487 N 0.43 3.75 -0.16 3.32 0.01 -0.15 -4.97 113.70 115.92 1oa1 s SER 487 Ca -0.05 -0.80 0.01 0.00 1.31 0.00 0.00 55.95 56.41 1oa1 s SER 487 Cb -0.09 -0.42 0.02 0.00 0.21 0.00 0.00 66.02 65.73 1oa1 s SER 487 CO -0.00 0.10 -0.16 -0.31 0.41 0.00 0.00 173.24 173.28 1oa1 s TYR 488 N -1.84 2.37 -0.46 2.43 2.02 -1.26 -0.21 117.35 120.39 1oa1 s TYR 488 Ca 0.24 -1.36 0.04 0.00 -0.37 0.00 0.00 57.07 55.61 1oa1 s TYR 488 Cb -0.08 -1.70 0.16 0.00 -0.40 0.00 0.00 41.96 39.94 1oa1 s TYR 488 CO 0.13 -0.72 0.35 0.34 -1.57 0.00 0.00 175.55 174.08 1oa1 s ASP 489 N 1.42 2.37 -0.17 2.29 -1.08 0.74 -1.71 116.67 120.53 1oa1 s ASP 489 Ca 0.05 -3.09 -0.09 0.00 -0.52 0.00 0.00 52.55 48.90 1oa1 s ASP 489 Cb -0.13 -0.70 -0.05 0.00 -1.46 0.00 0.00 42.92 40.59 1oa1 s ASP 489 CO -0.11 -0.18 0.15 -0.63 0.52 0.00 0.00 175.17 174.92 1oa1 s ILE 490 N -0.09 5.43 -0.02 4.11 1.01 -0.16 -4.18 121.20 127.29 1oa1 s ILE 490 Ca 0.29 0.22 -0.04 0.00 0.00 0.00 0.00 60.65 61.12 1oa1 s ILE 490 Cb -0.03 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 1oa1 s ILE 490 CO -0.16 0.50 0.19 0.00 0.00 0.00 0.00 174.94 175.48 1oa1 s ALA 491 N -0.15 3.92 0.07 9.38 0.00 -1.02 -1.81 121.76 132.16 1oa1 s ALA 491 Ca 0.11 -0.70 0.02 0.00 0.00 0.00 0.00 51.96 51.39 1oa1 s ALA 491 Cb -0.12 -1.94 -0.03 0.00 0.00 0.00 0.00 23.12 21.03 1oa1 s ALA 491 CO 0.01 0.70 -0.07 1.67 0.00 0.00 0.00 175.76 178.07 1oa1 s TRP 492 N -1.27 0.75 0.24 0.00 1.48 -0.51 -0.94 118.94 118.69 1oa1 s TRP 492 Ca 0.25 -0.75 0.00 0.00 -1.06 0.00 0.00 56.10 54.54 1oa1 s TRP 492 Cb -0.13 -0.45 0.00 0.00 -1.16 0.00 0.00 33.47 31.73 1oa1 s TRP 492 CO 0.16 -0.14 0.00 0.98 -4.06 0.00 0.00 176.95 173.88 1oa1 n TYR 493 N 0.62 -2.17 -3.93 1.66 9.36 -1.26 -4.64 117.16 116.80 1oa1 n TYR 493 Ca -0.17 0.41 -0.05 0.00 3.32 0.00 0.00 57.90 61.41 1oa1 n TYR 493 Cb 0.58 0.70 -0.01 0.00 -0.63 0.00 0.00 39.34 39.98 1oa1 n TYR 493 CO 0.00 0.00 0.00 -0.85 0.22 0.00 0.00 176.86 176.23 1oa1 n GLU 494 N -3.28 1.65 0.19 2.98 -0.00 -1.26 -1.25 120.64 119.67 1oa1 n GLU 494 Ca 0.00 -0.59 0.09 0.00 -0.00 0.00 0.00 57.16 56.66 1oa1 n GLU 494 Cb 0.00 0.13 0.11 0.00 -0.00 0.00 0.00 31.44 31.68 1oa1 n GLU 494 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.13 179.09 1oa1 h GLN 495 N 0.00 0.00 -0.54 3.44 7.50 -1.87 -2.55 115.11 121.08 1oa1 h GLN 495 Ca -0.06 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.07 1oa1 h GLN 495 Cb 0.21 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 27.71 1oa1 h GLN 495 CO 0.11 0.15 0.28 0.87 -1.50 0.00 0.00 178.83 178.74 1oa1 h LYS 496 N 0.00 0.75 -0.32 1.46 1.57 -1.86 -1.74 116.57 116.43 1oa1 h LYS 496 Ca -0.00 -0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 58.65 1oa1 h LYS 496 Cb 1.12 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 33.26 1oa1 h LYS 496 CO 0.02 0.57 0.02 0.00 -0.57 0.00 0.00 179.45 179.48 1oa1 h ALA 497 N 1.56 1.43 -0.48 3.86 0.00 -1.86 -1.46 119.26 122.30 1oa1 h ALA 497 Ca 0.19 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1oa1 h ALA 497 Cb 0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1oa1 h ALA 497 CO -0.03 0.40 -0.04 0.28 0.00 0.00 0.00 179.25 179.87 1oa1 h VAL 498 N 0.48 1.27 -0.67 0.00 2.07 -1.45 0.36 116.25 118.31 1oa1 h VAL 498 Ca 0.11 -1.13 0.04 0.00 0.82 0.00 0.00 66.70 66.53 1oa1 h VAL 498 Cb 0.28 1.03 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 1oa1 h VAL 498 CO 0.01 0.39 0.40 0.00 0.02 0.00 0.00 177.57 178.39 1oa1 h ALA 499 N 0.91 0.88 -0.44 1.67 0.00 -0.88 -0.49 119.26 120.91 1oa1 h ALA 499 Ca 0.13 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1oa1 h ALA 499 Cb 0.56 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1oa1 h ALA 499 CO 0.03 0.13 0.19 0.28 0.00 0.00 0.00 179.25 179.89 1oa1 h VAL 500 N 0.77 1.19 -0.50 0.00 2.07 -0.99 -1.15 116.25 117.64 1oa1 h VAL 500 Ca 0.28 -0.56 0.02 0.00 0.82 0.00 0.00 66.70 67.26 1oa1 h VAL 500 Cb 0.07 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1oa1 h VAL 500 CO -0.13 0.21 0.31 0.25 0.02 0.00 0.00 177.57 178.23 1oa1 h LEU 501 N 0.56 0.50 -1.07 2.57 5.85 -0.49 -1.23 115.31 122.01 1oa1 h LEU 501 Ca 0.15 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 1oa1 h LEU 501 Cb 0.15 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 1oa1 h LEU 501 CO -0.02 0.36 0.14 -0.07 -0.34 0.00 0.00 178.44 178.51 1oa1 h LEU 502 N 0.61 0.75 -0.39 2.25 3.38 -0.80 -0.72 115.31 120.40 1oa1 h LEU 502 Ca 0.20 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1oa1 h LEU 502 Cb 0.00 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1oa1 h LEU 502 CO -0.08 0.73 0.24 0.00 0.09 0.00 0.00 178.44 179.42 1oa1 h ALA 503 N 1.37 0.49 -0.73 1.53 0.00 -0.64 -0.18 119.26 121.11 1oa1 h ALA 503 Ca 0.18 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1oa1 h ALA 503 Cb 0.27 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1oa1 h ALA 503 CO -0.00 -0.03 0.35 -0.07 0.00 0.00 0.00 179.25 179.50 1oa1 h LEU 504 N 0.51 0.95 -0.72 0.00 3.38 -0.56 -0.27 115.31 118.60 1oa1 h LEU 504 Ca 0.14 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1oa1 h LEU 504 Cb -0.02 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 1oa1 h LEU 504 CO -0.03 0.82 0.26 -0.07 0.09 0.00 0.00 178.44 179.52 1oa1 h LEU 505 N 1.02 1.02 -1.11 1.67 3.38 -0.91 -1.46 115.31 118.93 1oa1 h LEU 505 Ca 0.25 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1oa1 h LEU 505 Cb 0.12 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1oa1 h LEU 505 CO -0.03 0.93 0.34 0.15 0.09 0.00 0.00 178.44 179.92 1oa1 h PHE 506 N 1.05 0.95 0.00 1.13 3.57 -0.55 -1.23 116.94 121.85 1oa1 h PHE 506 Ca 0.24 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.71 1oa1 h PHE 506 Cb 0.25 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.69 1oa1 h PHE 506 CO 0.02 0.69 0.00 1.28 -2.23 0.00 0.00 178.31 178.07 1oa1 n LEU 507 N -4.34 0.00 0.00 0.59 4.77 -0.16 -4.89 117.00 112.97 1oa1 n LEU 507 Ca 0.06 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 1oa1 n LEU 507 Cb 0.13 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1oa1 n LEU 507 CO 0.38 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1oa1 n GLY 508 N 0.79 0.75 3.69 -0.72 0.00 -0.46 -4.96 105.19 104.28 1oa1 n GLY 508 Ca 0.19 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1oa1 n GLY 508 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oa1 s VAL 509 N -2.00 4.33 0.20 1.61 1.01 -0.61 -4.78 120.40 120.15 1oa1 s VAL 509 Ca 0.00 1.65 0.10 0.00 0.00 0.00 0.00 61.98 63.73 1oa1 s VAL 509 Cb 0.00 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 1oa1 s VAL 509 CO 0.00 -0.00 -0.14 -0.54 0.00 0.00 0.00 175.10 174.41 1oa1 s LYS 510 N 2.19 1.87 0.00 2.72 1.02 -1.26 -4.52 119.74 121.77 1oa1 s LYS 510 Ca 0.55 -1.40 0.00 0.00 0.02 0.00 0.00 55.97 55.13 1oa1 s LYS 510 Cb -0.24 -2.03 0.00 0.00 -0.52 0.00 0.00 37.83 35.05 1oa1 s LYS 510 CO 0.21 0.41 0.00 0.41 -0.92 0.00 0.00 175.35 175.46 1oa1 n GLY 511 N -0.01 0.59 3.72 -3.33 0.00 -0.36 -4.99 105.19 100.82 1oa1 n GLY 511 Ca -0.11 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 1oa1 n GLY 511 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oa1 s ILE 512 N -2.00 2.58 -0.12 -0.61 1.01 -1.25 -4.74 121.20 116.07 1oa1 s ILE 512 Ca 0.00 0.43 -0.22 0.00 0.00 0.00 0.00 60.65 60.86 1oa1 s ILE 512 Cb 0.00 -3.27 -0.03 0.00 0.01 0.00 0.00 42.46 39.16 1oa1 s ILE 512 CO 0.00 0.04 0.63 -0.13 0.00 0.00 0.00 174.94 175.48 1oa1 s ARG 513 N 0.89 4.35 -0.09 2.79 0.52 -0.69 -0.77 118.95 125.95 1oa1 s ARG 513 Ca 0.69 0.72 0.03 0.00 -0.52 0.00 0.00 55.73 56.64 1oa1 s ARG 513 Cb -0.44 -3.48 0.01 0.00 0.52 0.00 0.00 34.95 31.56 1oa1 s ARG 513 CO 0.33 -0.00 -0.19 -1.17 0.02 0.00 0.00 175.30 174.29 1oa1 s LEU 514 N 1.09 1.88 0.00 2.53 2.96 -0.17 -0.99 118.68 125.98 1oa1 s LEU 514 Ca 0.33 -0.45 -0.07 0.00 -0.22 0.00 0.00 54.13 53.72 1oa1 s LEU 514 Cb -0.17 -1.15 0.03 0.00 0.50 0.00 0.00 46.19 45.40 1oa1 s LEU 514 CO 0.14 0.09 0.40 0.61 -1.32 0.00 0.00 176.35 176.28 1oa1 n GLY 515 N 3.72 1.58 0.00 7.98 0.00 -0.75 -3.89 105.19 113.83 1oa1 n GLY 515 Ca -0.21 -1.18 0.14 0.00 0.00 0.00 0.00 46.02 44.77 1oa1 n GLY 515 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1oa1 n PRO 516 N -0.29 0.11 -4.37 1.61 -0.04 -1.26 -1.43 135.00 129.33 1oa1 n PRO 516 Ca -0.04 0.02 -0.19 0.00 -0.04 0.00 0.00 63.50 63.25 1oa1 n PRO 516 Cb 0.32 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.18 1oa1 n PRO 516 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1oa1 s THR 517 N -2.89 0.66 0.08 0.52 -4.23 -1.26 -4.76 115.64 103.77 1oa1 s THR 517 Ca 0.17 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.62 1oa1 s THR 517 Cb 0.19 -2.63 -0.05 0.00 1.34 0.00 0.00 72.50 71.34 1oa1 s THR 517 CO 0.49 0.00 0.33 -0.76 -0.54 0.00 0.00 174.62 174.15 1oa1 s LEU 518 N -3.39 4.32 0.31 4.79 1.43 -1.26 -4.96 118.68 119.93 1oa1 s LEU 518 Ca 0.36 0.59 -0.28 0.00 -1.03 0.00 0.00 54.13 53.77 1oa1 s LEU 518 Cb 0.07 -3.02 -0.13 0.00 0.03 0.00 0.00 46.19 43.14 1oa1 s LEU 518 CO 0.15 0.15 1.21 -2.65 0.23 0.00 0.00 176.35 175.43 1oa1 n PRO 519 N 0.57 1.85 0.28 1.29 -0.02 -1.26 -4.89 135.00 132.83 1oa1 n PRO 519 Ca -0.06 0.65 0.17 0.00 -2.02 0.00 0.00 63.50 62.23 1oa1 n PRO 519 Cb 0.52 -2.17 0.76 0.00 -0.02 0.00 0.00 33.50 32.59 1oa1 n PRO 519 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oa1 h ALA 520 N 2.56 1.04 -0.24 3.55 0.00 -1.81 -3.04 119.26 121.32 1oa1 h ALA 520 Ca -0.44 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1oa1 h ALA 520 Cb 1.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1oa1 h ALA 520 CO 0.63 0.06 0.00 1.97 0.00 0.00 0.00 179.25 181.91 1oa1 n PHE 521 N -3.20 0.32 -3.46 0.00 1.16 -1.26 -4.66 117.46 106.36 1oa1 n PHE 521 Ca -0.00 -0.16 -0.42 0.00 -1.87 0.00 0.00 57.45 55.00 1oa1 n PHE 521 Cb 0.27 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.04 1oa1 n PHE 521 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1oa1 s LEU 522 N -1.18 4.75 0.78 5.98 1.43 -1.15 -4.49 118.68 124.79 1oa1 s LEU 522 Ca 0.23 -0.59 -0.11 0.00 -1.03 0.00 0.00 54.13 52.64 1oa1 s LEU 522 Cb 0.12 -2.21 0.06 0.00 0.03 0.00 0.00 46.19 44.19 1oa1 s LEU 522 CO 0.17 -0.37 1.08 -0.94 0.23 0.00 0.00 176.35 176.53 1oa1 s SER 523 N 1.72 4.56 0.24 2.29 1.04 -1.26 -4.71 113.70 117.58 1oa1 s SER 523 Ca 0.07 1.65 -0.05 0.00 0.48 0.00 0.00 55.95 58.10 1oa1 s SER 523 Cb -0.18 -2.40 0.46 0.00 0.10 0.00 0.00 66.02 64.00 1oa1 s SER 523 CO 0.11 -1.97 1.68 -0.65 0.98 0.00 0.00 173.24 173.39 1oa1 h PRO 524 N -1.09 0.25 -0.24 4.02 0.11 -1.98 0.68 132.00 133.76 1oa1 h PRO 524 Ca -0.45 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 65.53 1oa1 h PRO 524 Cb 1.24 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1oa1 h PRO 524 CO 0.54 0.17 -0.35 -0.91 -0.21 0.00 0.00 178.00 177.24 1oa1 h ASN 525 N 0.26 0.55 -0.14 -2.05 2.35 -1.98 -1.55 115.58 113.02 1oa1 h ASN 525 Ca 0.41 -0.23 -0.23 0.00 -0.55 0.00 0.00 56.30 55.71 1oa1 h ASN 525 Cb 0.71 -0.15 0.01 0.00 0.05 0.00 0.00 38.32 38.94 1oa1 h ASN 525 CO -0.52 0.86 -0.80 0.58 -1.65 0.00 0.00 177.43 175.91 1oa1 h VAL 526 N 0.45 1.28 -1.00 2.81 2.07 -1.73 -2.20 116.25 117.92 1oa1 h VAL 526 Ca 0.05 -1.99 0.06 0.00 0.82 0.00 0.00 66.70 65.63 1oa1 h VAL 526 Cb 0.83 2.02 -0.06 0.00 -1.52 0.00 0.00 31.29 32.55 1oa1 h VAL 526 CO 0.07 0.63 0.65 0.00 0.02 0.00 0.00 177.57 178.94 1oa1 h ALA 527 N 0.53 1.37 -0.74 1.67 0.00 -0.83 -1.73 119.26 119.54 1oa1 h ALA 527 Ca -0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1oa1 h ALA 527 Cb 1.43 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1oa1 h ALA 527 CO 0.16 0.48 0.35 0.87 0.00 0.00 0.00 179.25 181.12 1oa1 h LYS 528 N 1.21 1.06 -0.56 0.00 1.57 -1.05 -0.05 116.57 118.74 1oa1 h LYS 528 Ca 0.42 -0.16 0.02 0.00 -1.87 0.00 0.00 60.65 59.07 1oa1 h LYS 528 Cb 0.11 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 1oa1 h LYS 528 CO -0.16 0.83 0.34 0.28 -0.57 0.00 0.00 179.45 180.18 1oa1 h VAL 529 N 1.03 1.07 -0.26 0.50 2.07 -0.99 0.11 116.25 119.77 1oa1 h VAL 529 Ca 0.25 -0.23 -0.13 0.00 0.82 0.00 0.00 66.70 67.41 1oa1 h VAL 529 Cb 0.12 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1oa1 h VAL 529 CO -0.03 0.12 -0.38 -0.07 0.02 0.00 0.00 177.57 177.23 1oa1 h LEU 530 N 0.68 0.64 -0.31 2.57 3.38 -0.82 -0.40 115.31 121.05 1oa1 h LEU 530 Ca 0.23 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1oa1 h LEU 530 Cb 0.02 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1oa1 h LEU 530 CO -0.10 0.95 -0.07 0.58 0.09 0.00 0.00 178.44 179.90 1oa1 h VAL 531 N 0.50 1.28 -0.47 1.22 2.07 -0.78 0.95 116.25 121.03 1oa1 h VAL 531 Ca 0.05 -1.11 -0.04 0.00 0.82 0.00 0.00 66.70 66.42 1oa1 h VAL 531 Cb 0.89 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 1oa1 h VAL 531 CO 0.08 0.36 0.12 -0.33 0.02 0.00 0.00 177.57 177.82 1oa1 h GLU 532 N 0.36 0.74 0.03 1.57 5.08 -0.65 0.29 114.58 122.01 1oa1 h GLU 532 Ca 0.08 -0.17 -0.26 0.00 -1.00 0.00 0.00 59.36 58.01 1oa1 h GLU 532 Cb 0.56 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 1oa1 h GLU 532 CO 0.03 0.72 -1.32 -0.91 -1.00 0.00 0.00 179.01 176.53 1oa1 h ASN 533 N 0.62 0.10 0.00 1.42 -0.26 -1.09 -3.41 115.58 112.96 1oa1 h ASN 533 Ca 0.15 -0.14 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 1oa1 h ASN 533 Cb 0.31 -0.03 0.00 0.00 -1.06 0.00 0.00 38.32 37.53 1oa1 h ASN 533 CO -0.00 1.11 0.00 0.49 -1.06 0.00 0.00 177.43 177.97 1oa1 n PHE 534 N -3.30 0.00 -3.90 1.19 3.72 0.31 -5.02 117.46 110.46 1oa1 n PHE 534 Ca -0.08 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.03 1oa1 n PHE 534 Cb 1.00 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.56 1oa1 n PHE 534 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1oa1 n ASN 535 N -0.17 -3.96 -4.77 4.37 5.15 0.09 -1.22 115.26 114.75 1oa1 n ASN 535 Ca 0.00 -0.81 -0.39 0.00 -0.60 0.00 0.00 54.58 52.78 1oa1 n ASN 535 Cb 0.09 -3.81 -0.02 0.00 -0.53 0.00 0.00 39.78 35.51 1oa1 n ASN 535 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1oa1 s ILE 536 N -3.39 3.04 0.07 -1.44 1.01 -1.25 -2.82 121.20 116.43 1oa1 s ILE 536 Ca 0.54 0.93 0.05 0.00 0.00 0.00 0.00 60.65 62.16 1oa1 s ILE 536 Cb -0.27 -3.54 -0.03 0.00 0.01 0.00 0.00 42.46 38.63 1oa1 s ILE 536 CO 0.84 0.13 -0.14 -0.54 0.00 0.00 0.00 174.94 175.22 1oa1 s LYS 537 N -2.13 0.82 0.79 2.79 1.02 0.05 -4.74 119.74 118.35 1oa1 s LYS 537 Ca 0.55 -0.94 -0.12 0.00 0.02 0.00 0.00 55.97 55.47 1oa1 s LYS 537 Cb -0.33 -0.83 0.07 0.00 -0.52 0.00 0.00 37.83 36.21 1oa1 s LYS 537 CO 0.42 0.19 1.15 -1.25 -0.92 0.00 0.00 175.35 174.94 1oa1 s PRO 538 N -1.70 2.14 0.51 -1.68 0.04 -1.26 -1.00 135.00 132.04 1oa1 s PRO 538 Ca -0.02 0.24 -0.18 0.00 0.04 0.00 0.00 61.00 61.08 1oa1 s PRO 538 Cb -0.10 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 32.41 1oa1 s PRO 538 CO 0.02 -1.50 1.01 0.96 0.04 0.00 0.00 177.00 177.53 1oa1 s ILE 539 N -3.48 4.14 0.00 0.56 -4.36 -1.25 -4.74 121.20 112.07 1oa1 s ILE 539 Ca 0.61 1.15 0.00 0.00 -0.26 0.00 0.00 60.65 62.15 1oa1 s ILE 539 Cb -0.11 -3.55 0.00 0.00 1.25 0.00 0.00 42.46 40.05 1oa1 s ILE 539 CO 0.50 -0.47 0.00 0.61 0.24 0.00 0.00 174.94 175.83 1oa1 n GLY 540 N -0.94 4.44 3.83 6.27 0.00 -1.26 -5.10 105.19 112.43 1oa1 n GLY 540 Ca 0.08 -1.81 -0.30 0.00 0.00 0.00 0.00 46.02 43.99 1oa1 n GLY 540 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1oa1 s THR 541 N 2.39 3.70 0.12 2.61 -4.23 -1.26 -4.86 115.64 114.10 1oa1 s THR 541 Ca 0.00 0.55 -0.20 0.00 -1.18 0.00 0.00 61.69 60.86 1oa1 s THR 541 Cb 0.00 -3.36 -0.08 0.00 1.34 0.00 0.00 72.50 70.41 1oa1 s THR 541 CO 0.00 -0.72 1.75 0.58 -0.54 0.00 0.00 174.62 175.69 1oa1 h VAL 542 N -0.80 0.98 -0.41 2.29 2.07 -1.98 -0.47 116.25 117.93 1oa1 h VAL 542 Ca -0.45 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.00 1oa1 h VAL 542 Cb 1.23 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 1oa1 h VAL 542 CO 0.59 0.03 0.20 -0.61 0.02 0.00 0.00 177.57 177.80 1oa1 h GLN 543 N 0.15 0.59 -0.50 1.57 4.15 -1.97 -1.31 115.11 117.78 1oa1 h GLN 543 Ca 0.07 -0.08 -0.11 0.00 0.77 0.00 0.00 58.65 59.29 1oa1 h GLN 543 Cb 0.02 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 27.59 1oa1 h GLN 543 CO -0.06 0.51 -0.12 -0.44 -1.93 0.00 0.00 178.83 176.79 1oa1 h ASP 544 N 0.53 0.97 -0.02 -0.69 3.32 -1.90 -2.30 116.42 116.34 1oa1 h ASP 544 Ca 0.14 -0.36 -0.17 0.00 0.02 0.00 0.00 57.03 56.66 1oa1 h ASP 544 Cb 0.11 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.39 1oa1 h ASP 544 CO -0.02 1.11 -0.58 0.44 -1.72 0.00 0.00 179.24 178.47 1oa1 h ASP 545 N 0.82 0.69 -0.26 6.45 5.19 -0.97 -1.62 116.42 126.72 1oa1 h ASP 545 Ca 0.13 -0.38 -0.01 0.00 -0.62 0.00 0.00 57.03 56.14 1oa1 h ASP 545 Cb 0.68 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.98 1oa1 h ASP 545 CO 0.05 1.12 0.11 0.40 -3.12 0.00 0.00 179.24 177.80 1oa1 h ILE 546 N 0.46 1.17 -0.77 0.35 2.04 -1.19 0.07 117.51 119.64 1oa1 h ILE 546 Ca 0.00 -0.51 0.01 0.00 1.00 0.00 0.00 64.86 65.37 1oa1 h ILE 546 Cb 1.14 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 38.19 1oa1 h ILE 546 CO 0.11 0.17 0.51 0.00 0.00 0.00 0.00 178.15 178.94 1oa1 h ALA 547 N 0.96 0.99 -0.37 1.87 0.00 -1.30 -0.62 119.26 120.79 1oa1 h ALA 547 Ca 0.09 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1oa1 h ALA 547 Cb 0.17 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1oa1 h ALA 547 CO -0.01 0.37 -0.18 0.00 0.00 0.00 0.00 179.25 179.43 1oa1 h ALA 548 N 1.30 0.52 -0.56 0.00 0.00 -1.12 -2.49 119.26 116.90 1oa1 h ALA 548 Ca 0.29 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1oa1 h ALA 548 Cb -0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1oa1 h ALA 548 CO -0.08 0.45 0.02 0.52 0.00 0.00 0.00 179.25 180.17 1oa1 h MET 549 N 0.57 0.94 0.00 0.00 2.07 -0.64 0.10 114.93 117.98 1oa1 h MET 549 Ca 0.08 -0.27 -0.02 0.00 -2.07 0.00 0.00 59.70 57.42 1oa1 h MET 549 Cb 0.72 -0.10 -0.00 0.00 -1.87 0.00 0.00 31.60 30.35 1oa1 h MET 549 CO 0.05 0.92 -0.11 0.52 1.07 0.00 0.00 176.91 179.37 1oa1 h MET 550 N 0.88 0.00 -0.08 1.72 2.86 -0.98 -0.46 114.93 118.87 1oa1 h MET 550 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1oa1 h MET 550 Cb 0.48 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.14 1oa1 h MET 550 CO 0.02 0.11 0.00 0.00 1.06 0.00 0.00 176.91 178.10 1oa1 n ALA 551 N -2.19 2.57 -1.45 6.32 0.00 -0.88 -4.92 120.51 119.96 1oa1 n ALA 551 Ca -0.01 -0.39 -0.08 0.00 0.00 0.00 0.00 53.44 52.96 1oa1 n ALA 551 Cb 0.30 -1.19 -0.03 0.00 0.00 0.00 0.00 19.45 18.53 1oa1 n ALA 551 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oa1 n GLY 552 N 1.06 0.75 0.00 0.00 0.00 -0.18 -5.07 105.19 101.76 1oa1 n GLY 552 Ca 0.17 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1oa1 n GLY 552 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90