#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oe0 s LYS 13 N 0.00 2.31 0.44 -2.82 1.02 -1.26 -4.87 119.74 114.55 1oe0 s LYS 13 Ca 0.00 -0.89 -0.25 0.00 0.02 0.00 0.00 55.97 54.85 1oe0 s LYS 13 Cb 0.00 -2.37 -0.09 0.00 -0.52 0.00 0.00 37.83 34.85 1oe0 s LYS 13 CO 0.00 0.55 1.33 0.98 -0.92 0.00 0.00 175.35 177.30 1oe0 n TYR 14 N 1.21 2.34 -1.25 3.18 9.36 -0.59 -1.37 117.16 130.05 1oe0 n TYR 14 Ca -0.15 0.48 -0.09 0.00 3.32 0.00 0.00 57.90 61.46 1oe0 n TYR 14 Cb 0.52 -2.41 -0.04 0.00 -0.63 0.00 0.00 39.34 36.79 1oe0 n TYR 14 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1oe0 n ALA 15 N -0.23 -0.13 -1.82 2.98 0.00 -1.26 -1.59 120.51 118.46 1oe0 n ALA 15 Ca 0.06 0.14 -0.42 0.00 0.00 0.00 0.00 53.44 53.22 1oe0 n ALA 15 Cb 0.40 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.38 1oe0 n ALA 15 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1oe0 s GLU 16 N -2.50 4.16 -1.33 0.00 2.56 -0.47 -2.91 118.70 118.21 1oe0 s GLU 16 Ca 0.00 2.50 -0.01 0.00 0.00 0.00 0.00 54.97 57.46 1oe0 s GLU 16 Cb 0.00 -3.10 -0.00 0.00 2.00 0.00 0.00 34.13 33.03 1oe0 s GLU 16 CO 0.00 -0.68 0.61 0.41 -0.56 0.00 0.00 175.26 175.04 1oe0 n GLY 17 N 3.72 -0.31 0.00 -1.50 0.00 -1.26 -4.85 105.19 100.98 1oe0 n GLY 17 Ca 0.14 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.32 1oe0 n GLY 17 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1oe0 n THR 18 N -4.29 0.00 -4.42 2.61 -2.24 -1.14 -5.08 114.28 99.71 1oe0 n THR 18 Ca -0.29 -0.12 -0.34 0.00 -2.27 0.00 0.00 64.05 61.03 1oe0 n THR 18 Cb 0.68 1.30 -0.11 0.00 -2.10 0.00 0.00 70.33 70.09 1oe0 n THR 18 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1oe0 s GLN 19 N -0.14 3.33 0.06 -0.78 -1.52 -1.26 -4.62 119.66 114.71 1oe0 s GLN 19 Ca 0.00 -0.49 -0.01 0.00 -1.95 0.00 0.00 55.36 52.92 1oe0 s GLN 19 Cb 0.00 -2.83 0.01 0.00 -0.22 0.00 0.00 33.01 29.97 1oe0 s GLN 19 CO 0.00 0.45 0.04 -0.35 -0.25 0.00 0.00 175.29 175.18 1oe0 n PRO 20 N 2.90 -1.48 -1.79 2.91 -0.04 -1.26 -4.93 135.00 131.31 1oe0 n PRO 20 Ca -0.18 -0.07 -0.42 0.00 -0.04 0.00 0.00 63.50 62.79 1oe0 n PRO 20 Cb 0.53 -0.07 -0.03 0.00 -0.04 0.00 0.00 33.50 33.89 1oe0 n PRO 20 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1oe0 s PHE 21 N -1.07 2.42 -0.10 0.54 5.36 -1.20 -4.83 117.98 119.08 1oe0 s PHE 21 Ca 0.03 0.18 0.03 0.00 -0.96 0.00 0.00 56.93 56.21 1oe0 s PHE 21 Cb -0.00 -4.10 -0.00 0.00 -0.34 0.00 0.00 43.02 38.58 1oe0 s PHE 21 CO 0.02 -4.40 -0.22 0.99 -1.46 0.00 0.00 175.22 170.15 1oe0 s THR 22 N 2.32 2.23 -0.11 0.12 2.01 -1.26 -0.92 115.64 120.03 1oe0 s THR 22 Ca 0.77 -0.96 -0.00 0.00 0.31 0.00 0.00 61.69 61.81 1oe0 s THR 22 Cb -0.45 -1.86 -0.02 0.00 0.01 0.00 0.00 72.50 70.18 1oe0 s THR 22 CO 0.34 0.55 -0.09 -0.69 -0.69 0.00 0.00 174.62 174.05 1oe0 s VAL 23 N 0.31 3.45 -0.16 3.82 1.01 0.13 -1.34 120.40 127.63 1oe0 s VAL 23 Ca -0.17 -0.54 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 1oe0 s VAL 23 Cb -0.17 -2.44 -0.02 0.00 0.00 0.00 0.00 36.38 33.74 1oe0 s VAL 23 CO 0.08 0.55 -0.06 -0.76 0.00 0.00 0.00 175.10 174.91 1oe0 s LEU 24 N -0.13 3.07 -0.35 3.92 1.43 0.11 -0.80 118.68 125.92 1oe0 s LEU 24 Ca 0.00 -0.21 -0.14 0.00 -1.03 0.00 0.00 54.13 52.75 1oe0 s LEU 24 Cb -0.13 -1.73 -0.01 0.00 0.03 0.00 0.00 46.19 44.34 1oe0 s LEU 24 CO 0.03 0.14 0.31 -0.63 0.23 0.00 0.00 176.35 176.44 1oe0 s ILE 25 N 0.51 5.22 0.28 -0.59 -1.09 0.95 -0.37 121.20 126.10 1oe0 s ILE 25 Ca -0.05 -0.15 0.12 0.00 -2.23 0.00 0.00 60.65 58.34 1oe0 s ILE 25 Cb -0.15 -3.80 -0.05 0.00 -1.58 0.00 0.00 42.46 36.88 1oe0 s ILE 25 CO 0.03 -0.10 -0.17 -1.61 -1.23 0.00 0.00 174.94 171.86 1oe0 s GLU 26 N 1.88 1.76 0.00 2.79 0.41 -0.20 -0.79 118.70 124.55 1oe0 s GLU 26 Ca 0.09 -1.73 0.00 0.00 -0.41 0.00 0.00 54.97 52.92 1oe0 s GLU 26 Cb -0.17 -1.82 0.00 0.00 -1.78 0.00 0.00 34.13 30.36 1oe0 s GLU 26 CO 0.11 0.33 0.00 0.41 -0.49 0.00 0.00 175.26 175.62 1oe0 n GLY 27 N -0.66 2.93 3.52 -1.39 0.00 -1.26 -0.63 105.19 107.69 1oe0 n GLY 27 Ca -0.05 -0.88 -0.29 0.00 0.00 0.00 0.00 46.02 44.81 1oe0 n GLY 27 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1oe0 s ASN 28 N 0.00 1.24 0.23 1.61 3.84 -1.26 -4.81 114.94 115.78 1oe0 s ASN 28 Ca 0.00 1.62 -0.32 0.00 0.21 0.00 0.00 52.86 54.38 1oe0 s ASN 28 Cb 0.00 -2.35 -0.12 0.00 -0.55 0.00 0.00 41.25 38.23 1oe0 s ASN 28 CO 0.00 -4.06 1.65 -0.38 -2.79 0.00 0.00 177.10 171.52 1oe0 n ILE 29 N -4.83 0.32 -1.11 -5.21 5.41 -1.26 -1.35 119.36 111.33 1oe0 n ILE 29 Ca 0.04 -0.08 -0.04 0.00 1.00 0.00 0.00 62.75 63.68 1oe0 n ILE 29 Cb 0.54 -1.89 -0.02 0.00 -0.71 0.00 0.00 39.64 37.56 1oe0 n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1oe0 n GLY 30 N 3.31 0.64 0.04 7.39 0.00 -1.26 -4.74 105.19 110.58 1oe0 n GLY 30 Ca 0.14 -0.40 0.12 0.00 0.00 0.00 0.00 46.02 45.88 1oe0 n GLY 30 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1oe0 n SER 31 N 0.34 0.29 -0.00 1.61 3.41 -0.46 -4.61 113.62 114.20 1oe0 n SER 31 Ca -0.04 0.54 0.00 0.00 -0.26 0.00 0.00 58.87 59.11 1oe0 n SER 31 Cb 0.19 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.53 1oe0 n SER 31 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oe0 n GLY 32 N 1.05 1.89 0.28 5.00 0.00 -1.26 -4.89 105.19 107.25 1oe0 n GLY 32 Ca 0.06 -0.04 -0.07 0.00 0.00 0.00 0.00 46.02 45.96 1oe0 n GLY 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oe0 h LYS 33 N 0.00 0.93 -0.22 1.61 1.57 -1.90 -1.34 116.57 117.21 1oe0 h LYS 33 Ca 0.00 -0.17 -0.12 0.00 -1.87 0.00 0.00 60.65 58.49 1oe0 h LYS 33 Cb 0.05 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 1oe0 h LYS 33 CO 0.00 0.80 -0.33 1.15 -0.57 0.00 0.00 179.45 180.50 1oe0 h THR 34 N 0.87 1.32 -0.61 -0.16 2.02 -1.97 -2.23 112.91 112.14 1oe0 h THR 34 Ca 0.21 -1.53 0.06 0.00 0.77 0.00 0.00 66.41 65.91 1oe0 h THR 34 Cb 0.22 1.78 -0.05 0.00 -1.74 0.00 0.00 68.15 68.35 1oe0 h THR 34 CO -0.02 0.48 0.32 0.74 0.37 0.00 0.00 175.52 177.41 1oe0 h THR 35 N 0.30 0.94 -0.80 3.16 2.02 -1.95 -0.61 112.91 115.98 1oe0 h THR 35 Ca 0.02 -0.20 -0.04 0.00 0.77 0.00 0.00 66.41 66.96 1oe0 h THR 35 Cb 0.91 0.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.58 1oe0 h THR 35 CO 0.08 0.11 0.36 0.22 0.37 0.00 0.00 175.52 176.66 1oe0 h TYR 36 N 0.59 1.17 0.00 3.16 3.20 -1.19 -2.85 116.97 121.05 1oe0 h TYR 36 Ca 0.28 -0.07 -0.09 0.00 3.14 0.00 0.00 58.73 61.99 1oe0 h TYR 36 Cb 0.20 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 1oe0 h TYR 36 CO -0.10 0.86 -0.43 -0.07 -1.64 0.00 0.00 178.16 176.79 1oe0 h LEU 37 N 1.15 0.00 -0.01 2.82 3.38 -0.67 -3.00 115.31 118.98 1oe0 h LEU 37 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1oe0 h LEU 37 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1oe0 h LEU 37 CO -0.03 0.43 0.00 0.59 0.09 0.00 0.00 178.44 179.52 1oe0 n ASN 38 N -3.60 0.00 0.22 -0.43 3.02 -0.33 -1.88 115.26 112.26 1oe0 n ASN 38 Ca -0.00 0.50 0.12 0.00 -0.03 0.00 0.00 54.58 55.17 1oe0 n ASN 38 Cb 0.53 -0.50 0.21 0.00 -0.61 0.00 0.00 39.78 39.41 1oe0 n ASN 38 CO 0.00 0.00 0.00 0.45 -2.62 0.00 0.00 177.26 175.09 1oe0 h HIS 39 N 0.00 0.00 -0.23 3.10 3.86 -1.64 -2.97 115.15 117.27 1oe0 h HIS 39 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1oe0 h HIS 39 Cb 0.13 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.60 1oe0 h HIS 39 CO 0.00 0.03 0.00 1.19 0.86 0.00 0.00 177.93 180.01 1oe0 n PHE 40 N -3.11 0.29 -0.32 2.45 3.01 -0.79 -4.48 117.46 114.51 1oe0 n PHE 40 Ca 0.04 -0.14 0.15 0.00 1.01 0.00 0.00 57.45 58.50 1oe0 n PHE 40 Cb 0.52 0.00 0.34 0.00 -0.01 0.00 0.00 39.48 40.33 1oe0 n PHE 40 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 1oe0 h GLU 41 N 3.64 0.49 0.00 -1.08 4.81 -1.59 -1.15 114.58 119.70 1oe0 h GLU 41 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1oe0 h GLU 41 Cb 0.79 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.06 1oe0 h GLU 41 CO 0.00 0.32 0.00 1.57 -0.73 0.00 0.00 179.01 180.17 1oe0 h LYS 42 N 0.50 0.00 -0.67 1.92 2.10 -1.83 -2.72 116.57 115.87 1oe0 h LYS 42 Ca 0.60 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.25 1oe0 h LYS 42 Cb 1.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 1oe0 h LYS 42 CO -0.49 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 177.62 1oe0 n TYR 43 N -2.66 1.66 -0.34 0.07 0.53 -0.44 -4.58 117.16 111.40 1oe0 n TYR 43 Ca 0.03 -0.57 0.28 0.00 -1.02 0.00 0.00 57.90 56.61 1oe0 n TYR 43 Cb 0.36 -0.43 0.53 0.00 -1.03 0.00 0.00 39.34 38.77 1oe0 n TYR 43 CO 0.00 0.00 0.00 -0.22 -1.02 0.00 0.00 176.86 175.62 1oe0 h LYS 44 N 3.18 0.19 -0.64 -0.72 3.11 -1.51 0.18 116.57 120.36 1oe0 h LYS 44 Ca 0.00 -0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.83 1oe0 h LYS 44 Cb 1.68 -0.04 0.00 0.00 -1.00 0.00 0.00 32.23 32.87 1oe0 h LYS 44 CO 0.39 0.13 0.00 0.09 -2.81 0.00 0.00 179.45 177.25 1oe0 n ASN 45 N -5.07 2.61 0.00 4.20 5.03 -1.26 -3.75 115.26 117.02 1oe0 n ASN 45 Ca 0.34 -2.26 0.00 0.00 0.87 0.00 0.00 54.58 53.53 1oe0 n ASN 45 Cb 1.13 -0.45 0.00 0.00 -1.02 0.00 0.00 39.78 39.44 1oe0 n ASN 45 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1oe0 n ASP 46 N 0.34 0.61 -3.94 6.41 8.00 0.52 -5.02 116.55 123.47 1oe0 n ASP 46 Ca 0.12 -0.03 -0.22 0.00 0.71 0.00 0.00 54.79 55.37 1oe0 n ASP 46 Cb 0.53 0.18 -0.16 0.00 -0.02 0.00 0.00 41.12 41.64 1oe0 n ASP 46 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1oe0 s ILE 47 N -0.30 0.76 -0.32 0.53 1.01 -0.53 -3.87 121.20 118.47 1oe0 s ILE 47 Ca 0.00 -0.25 -0.29 0.00 0.00 0.00 0.00 60.65 60.11 1oe0 s ILE 47 Cb 0.00 -0.74 0.02 0.00 0.01 0.00 0.00 42.46 41.75 1oe0 s ILE 47 CO 0.00 0.27 1.09 0.00 0.00 0.00 0.00 174.94 176.30 1oe0 s LEU 49 N 3.70 3.72 -0.44 0.00 1.43 -1.26 -1.43 118.68 124.40 1oe0 s LEU 49 Ca 0.46 -0.72 -0.03 0.00 -1.03 0.00 0.00 54.13 52.80 1oe0 s LEU 49 Cb -0.12 -1.84 0.12 0.00 0.03 0.00 0.00 46.19 44.37 1oe0 s LEU 49 CO 0.16 -0.18 0.25 -0.76 0.23 0.00 0.00 176.35 176.05 1oe0 s LEU 50 N 1.47 5.30 0.41 1.79 1.43 -0.78 -5.03 118.68 123.27 1oe0 s LEU 50 Ca 0.02 -2.13 0.07 0.00 -1.03 0.00 0.00 54.13 51.06 1oe0 s LEU 50 Cb -0.17 -1.85 -0.08 0.00 0.03 0.00 0.00 46.19 44.12 1oe0 s LEU 50 CO 0.01 -0.54 0.02 0.42 0.23 0.00 0.00 176.35 176.49 1oe0 s THR 51 N 1.00 2.02 -1.13 5.49 -4.23 -1.26 -1.49 115.64 116.05 1oe0 s THR 51 Ca 0.09 -1.99 -0.27 0.00 -1.18 0.00 0.00 61.69 58.35 1oe0 s THR 51 Cb -0.23 -2.99 0.03 0.00 1.34 0.00 0.00 72.50 70.65 1oe0 s THR 51 CO -0.04 -0.00 0.67 1.21 -0.54 0.00 0.00 174.62 175.92 1oe0 n GLU 52 N -0.98 -0.56 0.31 3.99 4.07 -1.26 -4.85 120.64 121.35 1oe0 n GLU 52 Ca -0.05 0.24 0.20 0.00 -0.06 0.00 0.00 57.16 57.50 1oe0 n GLU 52 Cb 0.67 -2.56 0.99 0.00 -0.06 0.00 0.00 31.44 30.48 1oe0 n GLU 52 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 1oe0 h PRO 53 N -2.09 0.00 -0.64 5.31 0.11 -1.90 -2.97 132.00 129.83 1oe0 h PRO 53 Ca -0.69 0.00 0.14 0.00 0.11 0.00 0.00 66.00 65.56 1oe0 h PRO 53 Cb 1.40 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.48 1oe0 h PRO 53 CO 0.48 0.01 0.44 0.28 -0.21 0.00 0.00 178.00 179.00 1oe0 h VAL 54 N 0.00 0.78 -0.70 3.15 2.07 -1.98 -1.56 116.25 118.02 1oe0 h VAL 54 Ca -0.00 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.50 1oe0 h VAL 54 Cb 0.21 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.47 1oe0 h VAL 54 CO 0.00 0.04 0.46 -0.33 0.02 0.00 0.00 177.57 177.76 1oe0 h GLU 55 N 0.24 0.70 -0.30 1.57 4.39 -1.90 -0.85 114.58 118.43 1oe0 h GLU 55 Ca 0.31 -0.04 -0.15 0.00 0.34 0.00 0.00 59.36 59.81 1oe0 h GLU 55 Cb 0.87 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.36 1oe0 h GLU 55 CO -0.06 0.46 -0.42 0.87 -1.16 0.00 0.00 179.01 178.70 1oe0 h LYS 56 N 0.72 0.75 0.00 2.33 1.57 -1.52 -3.01 116.57 117.40 1oe0 h LYS 56 Ca 0.30 -0.40 -0.05 0.00 -1.87 0.00 0.00 60.65 58.63 1oe0 h LYS 56 Cb 0.25 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 1oe0 h LYS 56 CO -0.10 1.02 -0.22 -1.49 -0.57 0.00 0.00 179.45 178.09 1oe0 h TRP 57 N 0.61 0.00 0.00 -1.35 6.55 -1.22 -2.86 115.95 117.68 1oe0 h TRP 57 Ca 0.05 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.89 1oe0 h TRP 57 Cb 0.97 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.27 1oe0 h TRP 57 CO 0.05 0.22 -0.21 0.54 -1.05 0.00 0.00 178.44 177.99 1oe0 n ARG 58 N -3.42 0.03 -3.32 0.49 1.74 -0.46 -1.94 116.66 109.78 1oe0 n ARG 58 Ca -0.00 0.02 -0.11 0.00 -0.77 0.00 0.00 57.85 56.98 1oe0 n ARG 58 Cb 0.42 -1.52 -0.06 0.00 -1.02 0.00 0.00 32.46 30.27 1oe0 n ARG 58 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1oe0 s ASN 59 N -3.14 0.43 -0.62 0.55 2.47 -1.08 -3.96 114.94 109.59 1oe0 s ASN 59 Ca 0.12 -1.17 -0.07 0.00 0.42 0.00 0.00 52.86 52.16 1oe0 s ASN 59 Cb 0.18 0.97 0.16 0.00 -1.45 0.00 0.00 41.25 41.11 1oe0 s ASN 59 CO 0.61 -0.26 0.49 -0.69 -3.72 0.00 0.00 177.10 173.52 1oe0 s VAL 60 N 1.75 4.30 -1.45 -5.21 1.01 0.93 -4.55 120.40 117.19 1oe0 s VAL 60 Ca 0.15 -2.48 -0.08 0.00 0.00 0.00 0.00 61.98 59.57 1oe0 s VAL 60 Cb -0.12 -3.77 0.05 0.00 0.00 0.00 0.00 36.38 32.54 1oe0 s VAL 60 CO -0.10 -0.88 0.82 0.59 0.00 0.00 0.00 175.10 175.53 1oe0 n ASN 61 N 4.04 -2.98 0.00 3.32 3.02 -1.26 -1.20 115.26 120.20 1oe0 n ASN 61 Ca 0.05 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.77 1oe0 n ASN 61 Cb 0.41 -3.81 0.00 0.00 -0.61 0.00 0.00 39.78 35.77 1oe0 n ASN 61 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1oe0 n GLY 62 N -1.67 3.33 3.74 7.41 0.00 -1.26 -5.04 105.19 111.70 1oe0 n GLY 62 Ca -0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 1oe0 n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oe0 s VAL 63 N -2.31 4.96 -0.93 1.61 1.01 -0.34 -4.94 120.40 119.46 1oe0 s VAL 63 Ca 0.00 1.32 -0.14 0.00 0.00 0.00 0.00 61.98 63.17 1oe0 s VAL 63 Cb 0.00 -3.98 0.22 0.00 0.00 0.00 0.00 36.38 32.62 1oe0 s VAL 63 CO 0.00 0.35 0.95 0.21 0.00 0.00 0.00 175.10 176.61 1oe0 s ASN 64 N 0.21 6.89 0.31 3.32 3.84 -1.25 -0.05 114.94 128.21 1oe0 s ASN 64 Ca 0.33 -2.81 -0.01 0.00 0.21 0.00 0.00 52.86 50.58 1oe0 s ASN 64 Cb -0.18 -2.25 0.48 0.00 -0.55 0.00 0.00 41.25 38.75 1oe0 s ASN 64 CO 0.17 -0.60 1.97 -0.07 -2.79 0.00 0.00 177.10 175.79 1oe0 h LEU 65 N 8.08 0.91 -0.41 3.21 3.38 -1.63 -2.05 115.31 126.81 1oe0 h LEU 65 Ca 0.15 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.10 1oe0 h LEU 65 Cb 0.99 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 1oe0 h LEU 65 CO 0.90 0.66 0.26 0.25 0.09 0.00 0.00 178.44 180.60 1oe0 h LEU 66 N 1.07 0.45 -0.13 1.67 5.85 -1.82 -0.45 115.31 121.94 1oe0 h LEU 66 Ca 0.29 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.99 1oe0 h LEU 66 Cb -0.11 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 1oe0 h LEU 66 CO -0.07 0.32 0.01 -0.08 -0.34 0.00 0.00 178.44 178.29 1oe0 h GLU 67 N 0.53 0.23 -0.95 1.25 4.81 -1.79 -2.61 114.58 116.05 1oe0 h GLU 67 Ca 0.15 -0.07 0.12 0.00 -0.13 0.00 0.00 59.36 59.44 1oe0 h GLU 67 Cb -0.04 -0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.23 1oe0 h GLU 67 CO -0.04 0.44 0.61 -0.07 -0.73 0.00 0.00 179.01 179.21 1oe0 h LEU 68 N -0.01 0.84 -0.35 1.64 3.38 -1.13 -1.22 115.31 118.46 1oe0 h LEU 68 Ca 0.04 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1oe0 h LEU 68 Cb 0.32 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1oe0 h LEU 68 CO 0.00 0.46 0.12 -0.03 0.09 0.00 0.00 178.44 179.08 1oe0 h MET 69 N 0.91 0.54 -0.14 1.13 4.05 -0.91 -1.14 114.93 119.37 1oe0 h MET 69 Ca 0.47 -0.11 -0.10 0.00 -0.28 0.00 0.00 59.70 59.67 1oe0 h MET 69 Cb 0.52 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.22 1oe0 h MET 69 CO -0.23 0.55 -0.36 1.88 0.23 0.00 0.00 176.91 178.98 1oe0 h TYR 70 N 0.42 0.35 0.05 1.39 0.99 -1.00 -1.87 116.97 117.29 1oe0 h TYR 70 Ca 0.11 -0.09 -0.24 0.00 2.00 0.00 0.00 58.73 60.52 1oe0 h TYR 70 Cb 0.23 -0.08 -0.00 0.00 1.00 0.00 0.00 36.73 37.88 1oe0 h TYR 70 CO 0.00 0.63 -1.04 0.87 -0.00 0.00 0.00 178.16 178.63 1oe0 h LYS 71 N 0.26 0.30 -1.54 4.88 1.57 -1.09 -3.41 116.57 117.55 1oe0 h LYS 71 Ca 0.03 -0.39 -0.48 0.00 -1.87 0.00 0.00 60.65 57.94 1oe0 h LYS 71 Cb 0.76 0.13 -0.33 0.00 0.08 0.00 0.00 32.23 32.87 1oe0 h LYS 71 CO 0.06 1.11 -0.96 -3.47 -0.57 0.00 0.00 179.45 175.62 1oe0 n ASP 72 N -3.64 -0.59 -0.23 0.86 2.03 -0.44 -5.01 116.55 109.51 1oe0 n ASP 72 Ca -0.06 -2.83 0.03 0.00 0.52 0.00 0.00 54.79 52.45 1oe0 n ASP 72 Cb 0.90 -0.04 0.16 0.00 -0.72 0.00 0.00 41.12 41.41 1oe0 n ASP 72 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1oe0 h PRO 73 N 4.06 0.35 -0.53 -0.67 0.11 -1.54 -0.10 132.00 133.68 1oe0 h PRO 73 Ca 0.03 -0.02 0.15 0.00 0.11 0.00 0.00 66.00 66.27 1oe0 h PRO 73 Cb 0.92 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.93 1oe0 h PRO 73 CO 0.42 0.23 0.40 0.87 -0.21 0.00 0.00 178.00 179.71 1oe0 h LYS 74 N 0.36 0.00 0.00 1.05 1.79 -1.88 -0.66 116.57 117.23 1oe0 h LYS 74 Ca 0.38 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.57 1oe0 h LYS 74 Cb 0.57 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.17 1oe0 h LYS 74 CO -0.41 0.00 -2.04 1.17 -1.08 0.00 0.00 179.45 177.09 1oe0 n LYS 75 N -4.27 1.12 -0.00 3.15 4.81 -0.81 -4.75 118.16 117.40 1oe0 n LYS 75 Ca 0.10 0.04 0.08 0.00 -0.87 0.00 0.00 58.31 57.66 1oe0 n LYS 75 Cb 0.62 -1.38 -0.09 0.00 0.02 0.00 0.00 35.03 34.20 1oe0 n LYS 75 CO 0.00 0.00 0.00 0.91 1.17 0.00 0.00 177.40 179.48 1oe0 n TRP 76 N -2.76 0.00 -0.28 5.64 7.02 -0.12 -4.51 117.44 122.43 1oe0 n TRP 76 Ca -0.28 0.00 -0.01 0.00 -1.02 0.00 0.00 57.50 56.19 1oe0 n TRP 76 Cb 0.93 -0.01 0.18 0.00 -2.42 0.00 0.00 31.31 29.98 1oe0 n TRP 76 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1oe0 h ALA 77 N 2.30 1.36 0.23 6.99 0.00 -1.31 -1.29 119.26 127.53 1oe0 h ALA 77 Ca 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1oe0 h ALA 77 Cb 0.39 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1oe0 h ALA 77 CO 0.00 0.58 -0.11 1.98 0.00 0.00 0.00 179.25 181.70 1oe0 h MET 78 N 1.16 -0.29 -0.39 0.00 1.85 -1.79 -0.80 114.93 114.67 1oe0 h MET 78 Ca 0.31 0.02 -0.03 0.00 -0.61 0.00 0.00 59.70 59.39 1oe0 h MET 78 Cb -0.10 0.07 -0.02 0.00 0.43 0.00 0.00 31.60 31.98 1oe0 h MET 78 CO -0.06 0.07 0.10 -1.00 -0.40 0.00 0.00 176.91 175.62 1oe0 h PRO 79 N -0.73 0.56 0.17 0.39 0.13 -1.80 -0.78 132.00 129.95 1oe0 h PRO 79 Ca -0.03 -0.09 -0.01 0.00 -0.87 0.00 0.00 66.00 65.00 1oe0 h PRO 79 Cb 0.49 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.53 1oe0 h PRO 79 CO 0.05 0.51 -0.08 0.35 -0.23 0.00 0.00 178.00 178.60 1oe0 h PHE 80 N 0.56 -0.21 -0.23 1.56 3.57 -1.19 -1.23 116.94 119.77 1oe0 h PHE 80 Ca 0.13 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.57 1oe0 h PHE 80 Cb 0.20 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 1oe0 h PHE 80 CO 0.01 -0.04 -0.09 1.96 -2.23 0.00 0.00 178.31 177.92 1oe0 h GLN 81 N -0.35 0.36 -0.27 1.11 1.08 -0.93 0.20 115.11 116.31 1oe0 h GLN 81 Ca -0.02 -0.08 -0.08 0.00 -1.45 0.00 0.00 58.65 57.02 1oe0 h GLN 81 Cb 0.27 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.64 1oe0 h GLN 81 CO 0.04 0.46 -0.16 1.03 -0.95 0.00 0.00 178.83 179.25 1oe0 h SER 82 N 0.34 0.46 0.56 1.46 0.87 -0.90 -0.56 113.55 115.79 1oe0 h SER 82 Ca 0.07 -0.13 -0.22 0.00 -1.23 0.00 0.00 61.79 60.28 1oe0 h SER 82 Cb 0.37 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.20 1oe0 h SER 82 CO 0.02 0.64 -0.98 0.22 -0.53 0.00 0.00 176.83 176.20 1oe0 h TYR 83 N 0.44 0.40 -0.29 2.24 3.20 -0.31 -2.16 116.97 120.48 1oe0 h TYR 83 Ca 0.08 -0.24 -0.02 0.00 3.14 0.00 0.00 58.73 61.69 1oe0 h TYR 83 Cb 0.53 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 1oe0 h TYR 83 CO 0.02 1.09 0.11 0.28 -1.64 0.00 0.00 178.16 178.01 1oe0 h VAL 84 N 0.12 1.19 -0.41 1.81 2.07 -0.63 -1.22 116.25 119.18 1oe0 h VAL 84 Ca -0.07 -0.58 0.05 0.00 0.82 0.00 0.00 66.70 66.92 1oe0 h VAL 84 Cb 1.64 1.03 -0.05 0.00 -1.52 0.00 0.00 31.29 32.39 1oe0 h VAL 84 CO 0.16 0.20 0.13 0.74 0.02 0.00 0.00 177.57 178.81 1oe0 h THR 85 N 0.31 0.85 0.03 2.57 2.02 -1.11 -1.47 112.91 116.12 1oe0 h THR 85 Ca 0.10 -0.10 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1oe0 h THR 85 Cb 0.20 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 1oe0 h THR 85 CO -0.01 0.05 -0.01 0.25 0.37 0.00 0.00 175.52 176.17 1oe0 h LEU 86 N 0.28 -0.03 -1.33 2.58 5.85 -1.08 -1.01 115.31 120.56 1oe0 h LEU 86 Ca 0.19 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 1oe0 h LEU 86 Cb 0.19 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1oe0 h LEU 86 CO -0.21 -0.02 -0.22 0.71 -0.34 0.00 0.00 178.44 178.37 1oe0 h THR 87 N -0.05 1.21 -0.12 1.05 1.35 -1.04 0.31 112.91 115.62 1oe0 h THR 87 Ca -0.00 -0.96 -0.03 0.00 -0.55 0.00 0.00 66.41 64.86 1oe0 h THR 87 Cb 0.04 1.37 -0.00 0.00 -1.73 0.00 0.00 68.15 67.82 1oe0 h THR 87 CO 0.01 0.29 -0.06 0.24 -0.25 0.00 0.00 175.52 175.75 1oe0 h MET 88 N 0.17 0.26 -0.89 4.72 2.86 -1.07 -1.90 114.93 119.07 1oe0 h MET 88 Ca 0.03 -0.11 0.06 0.00 -2.06 0.00 0.00 59.70 57.62 1oe0 h MET 88 Cb 0.48 -0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.08 1oe0 h MET 88 CO 0.03 0.59 0.58 1.25 1.06 0.00 0.00 176.91 180.42 1oe0 h LEU 89 N -0.09 0.89 -0.76 1.22 5.85 -0.75 0.23 115.31 121.90 1oe0 h LEU 89 Ca 0.03 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.66 1oe0 h LEU 89 Cb 0.51 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 1oe0 h LEU 89 CO 0.02 0.57 -0.07 1.56 -0.34 0.00 0.00 178.44 180.18 1oe0 h GLN 90 N 1.01 0.87 -0.16 1.25 4.20 -0.73 -1.93 115.11 119.61 1oe0 h GLN 90 Ca 0.38 -0.28 -0.14 0.00 0.06 0.00 0.00 58.65 58.67 1oe0 h GLN 90 Cb 0.19 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.90 1oe0 h GLN 90 CO -0.14 0.91 -0.45 0.77 -0.67 0.00 0.00 178.83 179.25 1oe0 h SER 91 N 0.79 0.67 -0.93 1.46 0.02 -0.34 -1.36 113.55 113.85 1oe0 h SER 91 Ca 0.14 -0.59 0.05 0.00 -0.84 0.00 0.00 61.79 60.55 1oe0 h SER 91 Cb 0.57 -0.19 -0.06 0.00 0.14 0.00 0.00 62.40 62.86 1oe0 h SER 91 CO 0.03 1.14 0.60 0.45 -1.14 0.00 0.00 176.83 177.91 1oe0 h HIS 92 N 0.23 1.12 -0.38 3.45 3.86 -0.52 -2.63 115.15 120.29 1oe0 h HIS 92 Ca -0.01 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1oe0 h HIS 92 Cb 1.06 -0.37 0.00 0.00 1.06 0.00 0.00 27.41 29.17 1oe0 h HIS 92 CO 0.10 0.61 0.00 0.25 0.86 0.00 0.00 177.93 179.75 1oe0 n THR 93 N -4.53 0.49 -2.00 2.45 -2.24 -0.74 -4.68 114.28 103.04 1oe0 n THR 93 Ca 0.13 -0.65 -0.42 0.00 -2.27 0.00 0.00 64.05 60.85 1oe0 n THR 93 Cb 0.14 0.68 -0.03 0.00 -2.10 0.00 0.00 70.33 69.03 1oe0 n THR 93 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oe0 s ALA 94 N -1.51 3.67 0.40 6.98 0.00 -0.51 -4.93 121.76 125.86 1oe0 s ALA 94 Ca 0.37 1.32 -0.25 0.00 0.00 0.00 0.00 51.96 53.40 1oe0 s ALA 94 Cb 0.21 -3.57 -0.08 0.00 0.00 0.00 0.00 23.12 19.67 1oe0 s ALA 94 CO 0.29 -0.74 1.21 -2.14 0.00 0.00 0.00 175.76 174.38 1oe0 s PRO 95 N 0.19 4.02 -0.06 0.00 0.02 -1.26 -4.99 135.00 132.92 1oe0 s PRO 95 Ca 0.63 1.95 -0.30 0.00 0.02 0.00 0.00 61.00 63.29 1oe0 s PRO 95 Cb -0.42 -2.70 0.08 0.00 0.02 0.00 0.00 34.50 31.48 1oe0 s PRO 95 CO 0.39 -0.38 0.74 -0.08 -0.33 0.00 0.00 177.00 177.34 1oe0 s THR 96 N -1.36 0.00 -0.14 0.99 -1.32 -1.26 -5.06 115.64 107.49 1oe0 s THR 96 Ca 0.57 0.00 -0.02 0.00 -1.21 0.00 0.00 61.69 61.03 1oe0 s THR 96 Cb -0.33 -1.00 -0.24 0.00 -1.51 0.00 0.00 72.50 69.41 1oe0 s THR 96 CO 0.42 0.00 0.29 0.59 -2.21 0.00 0.00 174.62 173.71 1oe0 n ASN 97 N 0.81 1.91 -4.16 8.08 3.02 -1.26 -4.85 115.26 118.80 1oe0 n ASN 97 Ca -0.17 0.17 -0.37 0.00 -0.03 0.00 0.00 54.58 54.18 1oe0 n ASN 97 Cb 0.58 -0.65 0.04 0.00 -0.61 0.00 0.00 39.78 39.13 1oe0 n ASN 97 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1oe0 n LYS 98 N -3.38 0.02 0.06 3.52 5.02 -1.26 -4.89 118.16 117.25 1oe0 n LYS 98 Ca -0.33 0.01 0.12 0.00 -2.02 0.00 0.00 58.31 56.10 1oe0 n LYS 98 Cb 1.04 -1.15 0.22 0.00 -0.02 0.00 0.00 35.03 35.12 1oe0 n LYS 98 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1oe0 n LYS 99 N 1.52 0.25 -4.30 1.97 5.02 -1.25 -4.68 118.16 116.69 1oe0 n LYS 99 Ca 0.03 0.09 -0.18 0.00 -2.02 0.00 0.00 58.31 56.24 1oe0 n LYS 99 Cb 0.52 -1.68 -0.14 0.00 -0.02 0.00 0.00 35.03 33.71 1oe0 n LYS 99 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1oe0 s LEU 100 N -4.13 2.06 -0.06 -0.35 2.96 -1.26 -3.27 118.68 114.64 1oe0 s LEU 100 Ca 0.07 -0.23 0.01 0.00 -0.22 0.00 0.00 54.13 53.76 1oe0 s LEU 100 Cb 0.14 -0.42 0.02 0.00 0.50 0.00 0.00 46.19 46.42 1oe0 s LEU 100 CO 0.70 0.06 -0.05 -0.75 -1.32 0.00 0.00 176.35 174.98 1oe0 s LYS 101 N -0.47 1.02 -0.09 1.98 2.20 -0.10 -0.70 119.74 123.58 1oe0 s LYS 101 Ca 0.02 -0.14 0.03 0.00 -0.36 0.00 0.00 55.97 55.51 1oe0 s LYS 101 Cb -0.05 -1.04 0.01 0.00 -1.51 0.00 0.00 37.83 35.25 1oe0 s LYS 101 CO -0.00 -0.12 -0.17 0.42 -0.36 0.00 0.00 175.35 175.13 1oe0 s ILE 102 N 1.11 1.54 0.10 5.43 1.01 -0.51 0.19 121.20 130.08 1oe0 s ILE 102 Ca -0.08 -0.70 0.10 0.00 0.00 0.00 0.00 60.65 59.97 1oe0 s ILE 102 Cb -0.14 -1.37 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 1oe0 s ILE 102 CO -0.01 0.45 -0.25 -0.04 0.00 0.00 0.00 174.94 175.08 1oe0 s MET 103 N 0.64 1.44 -0.26 2.79 -1.94 0.01 -1.87 119.30 120.12 1oe0 s MET 103 Ca -0.14 -1.24 -0.17 0.00 -1.71 0.00 0.00 55.69 52.43 1oe0 s MET 103 Cb -0.16 -1.81 -0.03 0.00 2.01 0.00 0.00 34.83 34.84 1oe0 s MET 103 CO 0.04 0.44 0.49 -2.00 -0.01 0.00 0.00 175.02 173.98 1oe0 s GLU 104 N -1.79 4.07 0.16 2.03 2.12 -0.56 -0.03 118.70 124.70 1oe0 s GLU 104 Ca 0.12 0.28 0.00 0.00 0.36 0.00 0.00 54.97 55.73 1oe0 s GLU 104 Cb -0.10 -3.65 0.00 0.00 0.26 0.00 0.00 34.13 30.65 1oe0 s GLU 104 CO 0.05 -0.32 0.00 0.54 -0.54 0.00 0.00 175.26 174.98 1oe0 n ARG 105 N 5.45 -1.29 -3.79 4.30 5.12 0.03 -4.77 116.66 121.70 1oe0 n ARG 105 Ca -0.05 0.88 -0.04 0.00 -1.93 0.00 0.00 57.85 56.72 1oe0 n ARG 105 Cb 0.50 -1.57 -0.00 0.00 -1.16 0.00 0.00 32.46 30.23 1oe0 n ARG 105 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1oe0 s SER 106 N -4.71 -0.11 0.49 0.55 1.04 -1.26 -4.63 113.70 105.08 1oe0 s SER 106 Ca 0.00 -0.53 0.25 0.00 0.48 0.00 0.00 55.95 56.15 1oe0 s SER 106 Cb 0.00 0.51 1.29 0.00 0.10 0.00 0.00 66.02 67.93 1oe0 s SER 106 CO 0.00 -0.97 2.02 -0.29 0.98 0.00 0.00 173.24 174.97 1oe0 h ILE 107 N 2.00 0.66 -0.34 -1.02 2.10 -1.93 -3.03 117.51 115.96 1oe0 h ILE 107 Ca -0.26 -0.68 -0.17 0.00 1.08 0.00 0.00 64.86 64.84 1oe0 h ILE 107 Cb 1.23 1.43 -0.00 0.00 -1.09 0.00 0.00 36.82 38.38 1oe0 h ILE 107 CO 0.29 0.15 -0.44 -0.26 -1.08 0.00 0.00 178.15 176.82 1oe0 h PHE 108 N 0.00 1.06 0.00 2.19 -1.00 -1.99 -2.12 116.94 115.08 1oe0 h PHE 108 Ca -0.00 -0.34 -0.14 0.00 2.81 0.00 0.00 57.97 60.30 1oe0 h PHE 108 Cb 0.41 -0.22 -0.02 0.00 3.61 0.00 0.00 35.95 39.74 1oe0 h PHE 108 CO 0.00 1.15 -0.67 0.66 -1.61 0.00 0.00 178.31 177.84 1oe0 h SER 109 N 0.70 0.00 -0.53 2.17 4.64 -1.94 0.20 113.55 118.79 1oe0 h SER 109 Ca 0.04 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.30 1oe0 h SER 109 Cb 1.03 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.10 1oe0 h SER 109 CO 0.10 0.67 0.07 0.00 -0.87 0.00 0.00 176.83 176.80 1oe0 h ALA 110 N 1.33 0.70 0.19 5.18 0.00 -1.43 -1.83 119.26 123.40 1oe0 h ALA 110 Ca -0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1oe0 h ALA 110 Cb 1.21 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1oe0 h ALA 110 CO 0.09 0.46 -0.09 -0.09 0.00 0.00 0.00 179.25 179.61 1oe0 h ARG 111 N 0.77 -0.25 0.00 0.00 2.43 -1.18 0.87 114.38 117.02 1oe0 h ARG 111 Ca 0.16 0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.28 1oe0 h ARG 111 Cb 0.43 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 1oe0 h ARG 111 CO 0.01 -0.12 -0.30 1.88 -1.51 0.00 0.00 179.97 179.93 1oe0 h TYR 112 N -1.06 0.00 0.00 2.20 0.99 -0.73 -2.92 116.97 115.46 1oe0 h TYR 112 Ca -0.03 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.69 1oe0 h TYR 112 Cb 0.24 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 37.97 1oe0 h TYR 112 CO 0.01 0.30 -0.63 0.00 -0.00 0.00 0.00 178.16 177.85 1oe0 h PHE 114 N -0.58 0.12 -0.43 0.00 -1.00 -1.45 -1.64 116.94 111.95 1oe0 h PHE 114 Ca -0.01 -0.05 -0.02 0.00 2.81 0.00 0.00 57.97 60.70 1oe0 h PHE 114 Cb 0.61 -0.02 -0.02 0.00 3.61 0.00 0.00 35.95 40.13 1oe0 h PHE 114 CO -0.24 0.71 0.19 0.28 -1.61 0.00 0.00 178.31 177.63 1oe0 h VAL 115 N -0.51 1.19 -0.47 -0.55 2.07 -0.88 -0.99 116.25 116.12 1oe0 h VAL 115 Ca -0.00 -0.57 0.03 0.00 0.82 0.00 0.00 66.70 66.97 1oe0 h VAL 115 Cb 0.72 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1oe0 h VAL 115 CO 0.02 0.21 0.27 -0.08 0.02 0.00 0.00 177.57 178.00 1oe0 h GLU 116 N 0.55 0.52 -0.52 1.57 4.57 -1.60 -0.99 114.58 118.68 1oe0 h GLU 116 Ca 0.14 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.22 1oe0 h GLU 116 Cb 0.16 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 1oe0 h GLU 116 CO -0.01 0.34 0.02 -0.97 -1.18 0.00 0.00 179.01 177.20 1oe0 h ASN 117 N 0.53 0.82 0.66 1.04 -1.24 -1.08 -1.86 115.58 114.46 1oe0 h ASN 117 Ca 0.19 -0.20 -0.05 0.00 0.71 0.00 0.00 56.30 56.95 1oe0 h ASN 117 Cb 0.04 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 38.86 1oe0 h ASN 117 CO -0.10 0.88 -0.24 0.24 -1.29 0.00 0.00 177.43 176.92 1oe0 h MET 118 N 0.80 0.00 -0.12 6.67 2.86 -0.76 -0.89 114.93 123.49 1oe0 h MET 118 Ca 0.16 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.70 1oe0 h MET 118 Cb 0.45 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.12 1oe0 h MET 118 CO 0.02 0.24 -0.30 -0.09 1.06 0.00 0.00 176.91 177.83 1oe0 h ARG 119 N 0.00 0.41 -0.81 1.72 2.43 -0.56 -1.11 114.38 116.46 1oe0 h ARG 119 Ca -0.00 -0.29 -0.03 0.00 -0.81 0.00 0.00 59.98 58.85 1oe0 h ARG 119 Cb 0.63 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.19 1oe0 h ARG 119 CO 0.03 0.90 0.37 0.00 -1.51 0.00 0.00 179.97 179.76 1oe0 h ARG 120 N -0.01 1.18 -0.24 0.20 3.08 -0.74 -2.80 114.38 115.03 1oe0 h ARG 120 Ca -0.00 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.86 1oe0 h ARG 120 Cb 0.91 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.76 1oe0 h ARG 120 CO 0.07 0.92 0.00 0.27 -1.07 0.00 0.00 179.97 180.15 1oe0 n ASN 121 N -4.30 1.58 0.00 7.04 2.04 -0.40 -4.91 115.26 116.31 1oe0 n ASN 121 Ca 0.08 -1.86 0.00 0.00 -0.44 0.00 0.00 54.58 52.35 1oe0 n ASN 121 Cb 0.15 -0.16 0.00 0.00 -2.53 0.00 0.00 39.78 37.24 1oe0 n ASN 121 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1oe0 n GLY 122 N 1.04 1.19 0.33 4.83 0.00 -1.06 -4.91 105.19 106.61 1oe0 n GLY 122 Ca 0.13 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.16 1oe0 n GLY 122 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1oe0 h SER 123 N 0.00 0.73 -3.62 1.61 0.02 -1.53 -3.38 113.55 107.38 1oe0 h SER 123 Ca 0.00 -0.02 -0.68 0.00 -0.84 0.00 0.00 61.79 60.24 1oe0 h SER 123 Cb 0.00 -0.18 -0.27 0.00 0.14 0.00 0.00 62.40 62.08 1oe0 h SER 123 CO 0.00 0.54 -0.62 -0.76 -1.14 0.00 0.00 176.83 174.85 1oe0 s LEU 124 N -9.71 4.00 0.85 5.07 1.43 -0.52 -3.88 118.68 115.91 1oe0 s LEU 124 Ca -0.10 -0.87 -0.11 0.00 -1.03 0.00 0.00 54.13 52.01 1oe0 s LEU 124 Cb 0.18 -1.87 0.11 0.00 0.03 0.00 0.00 46.19 44.63 1oe0 s LEU 124 CO 0.77 -0.24 1.15 -1.61 0.23 0.00 0.00 176.35 176.65 1oe0 s GLU 125 N 1.46 1.48 0.31 1.70 0.41 -1.26 -4.60 118.70 118.19 1oe0 s GLU 125 Ca 0.01 1.54 0.04 0.00 -0.41 0.00 0.00 54.97 56.15 1oe0 s GLU 125 Cb -0.18 -1.78 0.65 0.00 -1.78 0.00 0.00 34.13 31.04 1oe0 s GLU 125 CO 0.02 -2.29 1.84 0.37 -0.49 0.00 0.00 175.26 174.71 1oe0 h GLN 126 N -1.38 0.86 -0.32 1.61 4.15 -1.95 -0.74 115.11 117.34 1oe0 h GLN 126 Ca -0.44 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 58.90 1oe0 h GLN 126 Cb 1.27 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 28.75 1oe0 h GLN 126 CO 0.45 0.57 0.09 0.78 -1.93 0.00 0.00 178.83 178.79 1oe0 h GLY 127 N 0.89 0.49 1.00 2.39 0.00 -2.00 -0.74 103.07 105.10 1oe0 h GLY 127 Ca 0.49 -0.24 -0.19 0.00 0.00 0.00 0.00 47.33 47.40 1oe0 h GLY 127 CO -0.26 0.23 -0.67 -0.33 0.00 0.00 0.00 176.54 175.51 1oe0 h MET 128 N 0.46 0.62 -0.35 4.80 2.86 -1.51 -2.61 114.93 119.19 1oe0 h MET 128 Ca 0.11 -0.54 0.02 0.00 -2.06 0.00 0.00 59.70 57.23 1oe0 h MET 128 Cb 0.15 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 1oe0 h MET 128 CO -0.01 1.16 0.19 -0.92 1.06 0.00 0.00 176.91 178.39 1oe0 h TYR 129 N 0.25 0.35 -0.47 -0.22 3.20 -0.94 -1.74 116.97 117.40 1oe0 h TYR 129 Ca -0.06 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.82 1oe0 h TYR 129 Cb 1.32 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 39.46 1oe0 h TYR 129 CO 0.11 0.20 0.26 -0.91 -1.64 0.00 0.00 178.16 176.17 1oe0 h ASN 130 N 0.39 0.59 -0.11 -2.11 2.35 -1.17 -0.07 115.58 115.44 1oe0 h ASN 130 Ca 0.14 -0.09 0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1oe0 h ASN 130 Cb 0.03 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.23 1oe0 h ASN 130 CO -0.09 0.51 -0.06 0.74 -1.65 0.00 0.00 177.43 176.89 1oe0 h THR 131 N 0.62 0.81 -0.40 2.81 2.02 -1.19 0.16 112.91 117.74 1oe0 h THR 131 Ca 0.17 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.37 1oe0 h THR 131 Cb 0.06 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 1oe0 h THR 131 CO -0.03 0.00 0.22 -0.07 0.37 0.00 0.00 175.52 176.02 1oe0 h LEU 132 N -0.06 0.35 -0.90 2.58 3.38 -1.09 -1.68 115.31 117.90 1oe0 h LEU 132 Ca 0.07 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1oe0 h LEU 132 Cb 0.15 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 1oe0 h LEU 132 CO -0.15 0.25 0.52 -0.33 0.09 0.00 0.00 178.44 178.83 1oe0 h GLU 133 N 0.45 1.23 -0.33 1.13 4.39 -0.54 -0.94 114.58 119.97 1oe0 h GLU 133 Ca 0.16 -0.13 -0.05 0.00 0.34 0.00 0.00 59.36 59.69 1oe0 h GLU 133 Cb 0.03 -0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 28.41 1oe0 h GLU 133 CO -0.09 0.88 0.00 0.93 -1.16 0.00 0.00 179.01 179.58 1oe0 h GLU 134 N 1.24 0.51 -0.27 2.33 4.39 -0.33 -1.03 114.58 121.44 1oe0 h GLU 134 Ca 0.32 -0.11 -0.05 0.00 0.34 0.00 0.00 59.36 59.86 1oe0 h GLU 134 Cb -0.02 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.55 1oe0 h GLU 134 CO -0.06 0.54 -0.03 -1.49 -1.16 0.00 0.00 179.01 176.81 1oe0 h TRP 135 N 0.50 0.55 -0.86 4.33 4.06 -0.38 -1.80 115.95 122.34 1oe0 h TRP 135 Ca 0.11 -0.11 0.05 0.00 2.06 0.00 0.00 58.89 61.00 1oe0 h TRP 135 Cb 0.32 -0.14 -0.06 0.00 -1.00 0.00 0.00 29.16 28.28 1oe0 h TRP 135 CO 0.01 0.68 0.55 1.88 -3.56 0.00 0.00 178.44 177.99 1oe0 h TYR 136 N 0.26 1.02 -0.21 0.49 0.99 -0.68 0.74 116.97 119.58 1oe0 h TYR 136 Ca 0.07 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.82 1oe0 h TYR 136 Cb 0.48 -0.33 -0.01 0.00 1.00 0.00 0.00 36.73 37.87 1oe0 h TYR 136 CO 0.04 0.55 0.08 0.87 -0.00 0.00 0.00 178.16 179.70 1oe0 h LYS 137 N 1.03 0.32 -0.37 4.88 1.57 -1.04 -1.09 116.57 121.86 1oe0 h LYS 137 Ca 0.36 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 59.06 1oe0 h LYS 137 Cb 0.09 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1oe0 h LYS 137 CO -0.15 0.38 0.16 0.35 -0.57 0.00 0.00 179.45 179.63 1oe0 h PHE 138 N 0.18 0.50 -0.37 -1.35 3.57 -0.79 -2.58 116.94 116.10 1oe0 h PHE 138 Ca 0.07 -0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.42 1oe0 h PHE 138 Cb 0.19 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1oe0 h PHE 138 CO -0.01 0.39 -0.34 0.82 -2.23 0.00 0.00 178.31 176.95 1oe0 h ILE 139 N 0.51 1.28 -0.14 1.41 2.04 -0.38 -1.51 117.51 120.72 1oe0 h ILE 139 Ca 0.13 -1.50 0.01 0.00 1.00 0.00 0.00 64.86 64.50 1oe0 h ILE 139 Cb 0.08 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 1oe0 h ILE 139 CO -0.02 0.50 0.09 -0.33 0.00 0.00 0.00 178.15 178.40 1oe0 h GLU 140 N 0.70 0.14 0.00 2.37 5.08 -0.80 -0.93 114.58 121.13 1oe0 h GLU 140 Ca 0.07 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.32 1oe0 h GLU 140 Cb 0.89 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 1oe0 h GLU 140 CO 0.08 0.09 -1.47 0.39 -1.00 0.00 0.00 179.01 177.10 1oe0 n GLU 141 N -4.51 0.63 -0.00 2.33 1.02 -1.08 -4.49 120.64 114.53 1oe0 n GLU 141 Ca -0.01 0.10 0.06 0.00 -0.02 0.00 0.00 57.16 57.29 1oe0 n GLU 141 Cb 0.12 -1.74 -0.09 0.00 -0.02 0.00 0.00 31.44 29.71 1oe0 n GLU 141 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1oe0 n SER 142 N -2.70 1.58 -4.08 1.62 3.41 -0.59 -4.73 113.62 108.13 1oe0 n SER 142 Ca -0.08 -0.29 -0.21 0.00 -0.26 0.00 0.00 58.87 58.04 1oe0 n SER 142 Cb 0.72 1.36 -0.15 0.00 -0.26 0.00 0.00 64.21 65.89 1oe0 n SER 142 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1oe0 s ILE 143 N -2.60 0.99 -0.18 -1.33 1.01 -0.37 -1.54 121.20 117.19 1oe0 s ILE 143 Ca -0.01 -0.54 -0.22 0.00 0.00 0.00 0.00 60.65 59.87 1oe0 s ILE 143 Cb 0.08 -0.83 -0.02 0.00 0.01 0.00 0.00 42.46 41.71 1oe0 s ILE 143 CO 0.51 0.27 0.69 -2.28 0.00 0.00 0.00 174.94 174.14 1oe0 s HIS 144 N -0.30 3.41 -0.34 3.97 5.65 -0.62 -4.61 115.29 122.44 1oe0 s HIS 144 Ca 0.05 1.05 0.02 0.00 0.25 0.00 0.00 55.06 56.43 1oe0 s HIS 144 Cb -0.05 -2.86 0.10 0.00 -1.18 0.00 0.00 32.58 28.59 1oe0 s HIS 144 CO -0.00 -0.17 0.06 0.08 -0.65 0.00 0.00 174.74 174.06 1oe0 s VAL 145 N 1.87 2.51 -0.05 0.89 1.01 -1.26 -4.66 120.40 120.70 1oe0 s VAL 145 Ca 0.32 -2.18 -0.30 0.00 0.00 0.00 0.00 61.98 59.82 1oe0 s VAL 145 Cb -0.16 -2.77 -0.05 0.00 0.00 0.00 0.00 36.38 33.40 1oe0 s VAL 145 CO 0.12 -0.54 1.60 -1.58 0.00 0.00 0.00 175.10 174.69 1oe0 s GLN 146 N 0.98 4.19 -0.30 2.72 2.00 -1.26 -4.97 119.66 123.02 1oe0 s GLN 146 Ca 0.08 2.13 -0.02 0.00 -2.00 0.00 0.00 55.36 55.55 1oe0 s GLN 146 Cb -0.20 -3.92 0.12 0.00 0.80 0.00 0.00 33.01 29.81 1oe0 s GLN 146 CO -0.07 -0.81 0.22 0.00 -0.50 0.00 0.00 175.29 174.13 1oe0 s ALA 147 N 3.82 0.16 -0.24 1.58 0.00 -1.26 -4.78 121.76 121.04 1oe0 s ALA 147 Ca 0.71 -0.87 -0.07 0.00 0.00 0.00 0.00 51.96 51.73 1oe0 s ALA 147 Cb -0.32 -1.62 -0.17 0.00 0.00 0.00 0.00 23.12 21.00 1oe0 s ALA 147 CO 0.28 -1.76 -0.13 -0.25 0.00 0.00 0.00 175.76 173.90 1oe0 n ASP 148 N 5.07 1.99 -3.90 0.00 8.00 -0.45 -4.91 116.55 122.36 1oe0 n ASP 148 Ca -0.01 0.12 -0.11 0.00 0.71 0.00 0.00 54.79 55.50 1oe0 n ASP 148 Cb 0.43 -0.66 -0.12 0.00 -0.02 0.00 0.00 41.12 40.74 1oe0 n ASP 148 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1oe0 s LEU 149 N -7.04 1.93 -0.15 0.64 2.96 -0.89 -4.11 118.68 112.02 1oe0 s LEU 149 Ca -0.34 -0.13 0.01 0.00 -0.22 0.00 0.00 54.13 53.45 1oe0 s LEU 149 Cb 0.10 0.19 0.02 0.00 0.50 0.00 0.00 46.19 47.00 1oe0 s LEU 149 CO 0.59 -0.14 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.70 1oe0 s ILE 150 N -0.58 1.68 -0.37 6.68 1.01 -0.82 0.05 121.20 128.85 1oe0 s ILE 150 Ca -0.07 -0.70 -0.15 0.00 0.00 0.00 0.00 60.65 59.73 1oe0 s ILE 150 Cb -0.04 -1.55 -0.00 0.00 0.01 0.00 0.00 42.46 40.87 1oe0 s ILE 150 CO -0.00 0.48 0.33 -0.63 0.00 0.00 0.00 174.94 175.11 1oe0 s ILE 151 N 1.38 5.20 -0.44 2.92 1.01 0.50 -1.04 121.20 130.73 1oe0 s ILE 151 Ca 0.04 -0.23 -0.17 0.00 0.00 0.00 0.00 60.65 60.28 1oe0 s ILE 151 Cb -0.13 -3.85 0.03 0.00 0.01 0.00 0.00 42.46 38.52 1oe0 s ILE 151 CO -0.10 -0.17 0.46 -0.47 0.00 0.00 0.00 174.94 174.67 1oe0 s TYR 152 N 1.89 3.16 -1.03 3.97 5.04 -0.15 -1.03 117.35 129.21 1oe0 s TYR 152 Ca 0.09 -0.47 -0.22 0.00 -2.44 0.00 0.00 57.07 54.04 1oe0 s TYR 152 Cb -0.17 -3.03 0.07 0.00 0.35 0.00 0.00 41.96 39.17 1oe0 s TYR 152 CO 0.11 -0.77 1.41 -0.51 -1.34 0.00 0.00 175.55 174.46 1oe0 s LEU 153 N 2.16 3.84 0.01 6.97 1.43 0.20 -1.07 118.68 132.22 1oe0 s LEU 153 Ca 0.12 -1.66 -0.30 0.00 -1.03 0.00 0.00 54.13 51.25 1oe0 s LEU 153 Cb -0.18 -2.54 -0.05 0.00 0.03 0.00 0.00 46.19 43.45 1oe0 s LEU 153 CO 0.13 -1.39 1.25 -0.60 0.23 0.00 0.00 176.35 175.97 1oe0 s ARG 154 N 4.44 4.36 0.31 1.70 3.52 0.26 -4.37 118.95 129.16 1oe0 s ARG 154 Ca 0.44 1.79 0.05 0.00 -0.13 0.00 0.00 55.73 57.88 1oe0 s ARG 154 Cb -0.01 -3.47 -0.03 0.00 -1.56 0.00 0.00 34.95 29.88 1oe0 s ARG 154 CO -0.08 -0.41 0.27 0.95 -0.81 0.00 0.00 175.30 175.22 1oe0 s THR 155 N 1.79 0.00 -0.01 4.11 -4.23 -1.26 -0.24 115.64 115.80 1oe0 s THR 155 Ca 0.59 -1.96 -0.02 0.00 -1.18 0.00 0.00 61.69 59.13 1oe0 s THR 155 Cb -0.28 -2.51 -0.04 0.00 1.34 0.00 0.00 72.50 71.01 1oe0 s THR 155 CO 0.26 0.00 0.13 -0.94 -0.54 0.00 0.00 174.62 173.52 1oe0 s SER 156 N -3.32 5.99 0.36 3.99 1.04 -1.26 -5.00 113.70 115.51 1oe0 s SER 156 Ca 0.39 0.24 0.15 0.00 0.48 0.00 0.00 55.95 57.21 1oe0 s SER 156 Cb 0.03 -1.80 1.00 0.00 0.10 0.00 0.00 66.02 65.36 1oe0 s SER 156 CO 0.24 0.27 1.76 -0.65 0.98 0.00 0.00 173.24 175.84 1oe0 h PRO 157 N 4.00 0.47 -0.35 4.02 0.11 -1.96 -1.16 132.00 137.12 1oe0 h PRO 157 Ca -0.49 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 1oe0 h PRO 157 Cb 1.19 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1oe0 h PRO 157 CO 0.65 0.31 0.12 0.93 -0.21 0.00 0.00 178.00 179.80 1oe0 h GLU 158 N 0.48 0.54 -0.31 1.05 3.07 -1.94 0.89 114.58 118.36 1oe0 h GLU 158 Ca 0.61 -0.11 -0.01 0.00 -0.50 0.00 0.00 59.36 59.35 1oe0 h GLU 158 Cb 1.37 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 29.18 1oe0 h GLU 158 CO -0.36 0.55 0.15 0.28 -1.40 0.00 0.00 179.01 178.23 1oe0 h VAL 159 N 0.42 1.15 -0.61 3.13 2.07 -1.65 -1.98 116.25 118.77 1oe0 h VAL 159 Ca 0.11 -0.42 0.05 0.00 0.82 0.00 0.00 66.70 67.26 1oe0 h VAL 159 Cb 0.23 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 30.81 1oe0 h VAL 159 CO -0.01 0.15 0.35 0.00 0.02 0.00 0.00 177.57 178.09 1oe0 h ALA 160 N 1.01 0.81 -0.82 1.67 0.00 -1.15 -1.30 119.26 119.48 1oe0 h ALA 160 Ca 0.11 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1oe0 h ALA 160 Cb 0.11 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1oe0 h ALA 160 CO -0.01 0.04 0.54 -0.92 0.00 0.00 0.00 179.25 178.90 1oe0 h TYR 161 N 0.66 1.01 0.16 0.00 3.20 -0.47 -1.16 116.97 120.37 1oe0 h TYR 161 Ca 0.27 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.15 1oe0 h TYR 161 Cb 0.12 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.05 1oe0 h TYR 161 CO -0.08 0.61 -0.08 0.93 -1.64 0.00 0.00 178.16 177.91 1oe0 h GLU 162 N 1.07 -0.21 -0.61 1.82 5.08 -0.51 -2.61 114.58 118.60 1oe0 h GLU 162 Ca 0.31 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.68 1oe0 h GLU 162 Cb -0.05 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1oe0 h GLU 162 CO -0.08 0.02 0.36 0.00 -1.00 0.00 0.00 179.01 178.31 1oe0 h ARG 163 N -0.42 0.83 -0.45 2.33 3.08 -1.11 -1.90 114.38 116.74 1oe0 h ARG 163 Ca -0.02 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 59.91 1oe0 h ARG 163 Cb 0.33 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 1oe0 h ARG 163 CO 0.04 0.59 0.08 0.82 -1.07 0.00 0.00 179.97 180.43 1oe0 h ILE 164 N 0.84 1.21 0.00 2.04 2.04 -1.08 -1.94 117.51 120.61 1oe0 h ILE 164 Ca 0.22 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 65.31 1oe0 h ILE 164 Cb -0.02 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 1oe0 h ILE 164 CO -0.04 0.28 -0.76 -2.11 0.00 0.00 0.00 178.15 175.52 1oe0 n ARG 165 N -4.29 0.27 0.08 2.37 1.85 -0.82 -2.34 116.66 113.79 1oe0 n ARG 165 Ca 0.03 0.05 -0.09 0.00 -1.00 0.00 0.00 57.85 56.84 1oe0 n ARG 165 Cb 0.23 -1.64 -0.06 0.00 -1.05 0.00 0.00 32.46 29.94 1oe0 n ARG 165 CO 0.00 0.00 0.00 1.96 -0.01 0.00 0.00 177.63 179.58 1oe0 h GLN 166 N 0.00 0.13 -0.25 2.89 4.20 -1.04 -3.05 115.11 118.00 1oe0 h GLN 166 Ca 0.00 -0.17 -0.15 0.00 0.06 0.00 0.00 58.65 58.39 1oe0 h GLN 166 Cb 0.72 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.55 1oe0 h GLN 166 CO 0.00 1.00 -0.46 -0.09 -0.67 0.00 0.00 178.83 178.61 1oe0 h ARG 167 N 0.06 0.64 -5.85 1.46 2.43 -1.34 -3.48 114.38 108.29 1oe0 h ARG 167 Ca -0.05 -0.36 -0.38 0.00 -0.81 0.00 0.00 59.98 58.39 1oe0 h ARG 167 Cb 1.65 0.02 0.12 0.00 -0.42 0.00 0.00 29.97 31.34 1oe0 h ARG 167 CO 0.14 0.96 -0.76 0.00 -1.51 0.00 0.00 179.97 178.80 1oe0 n ALA 168 N -2.52 -1.79 -2.21 2.80 0.00 -0.99 -4.95 120.51 110.85 1oe0 n ALA 168 Ca -0.02 0.05 -0.42 0.00 0.00 0.00 0.00 53.44 53.04 1oe0 n ALA 168 Cb 0.56 -3.23 -0.03 0.00 0.00 0.00 0.00 19.45 16.74 1oe0 n ALA 168 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1oe0 s ARG 169 N -5.84 4.31 0.31 0.00 0.52 -1.26 -4.89 118.95 112.10 1oe0 s ARG 169 Ca 0.20 2.00 0.05 0.00 -0.52 0.00 0.00 55.73 57.46 1oe0 s ARG 169 Cb -0.09 -3.42 0.71 0.00 0.52 0.00 0.00 34.95 32.67 1oe0 s ARG 169 CO 0.76 -0.49 1.81 0.66 0.02 0.00 0.00 175.30 178.05 1oe0 h SER 170 N 7.32 0.80 0.10 0.23 4.64 -1.99 -1.21 113.55 123.44 1oe0 h SER 170 Ca -0.40 0.07 -0.04 0.00 -0.47 0.00 0.00 61.79 60.95 1oe0 h SER 170 Cb 1.20 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 1oe0 h SER 170 CO 0.88 0.34 -0.14 -0.33 -0.87 0.00 0.00 176.83 176.71 1oe0 h GLU 171 N 0.81 0.10 -0.19 4.77 3.07 -1.96 -2.70 114.58 118.48 1oe0 h GLU 171 Ca 0.54 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.38 1oe0 h GLU 171 Cb 0.77 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.67 1oe0 h GLU 171 CO -0.32 0.24 0.00 0.39 -1.40 0.00 0.00 179.01 177.93 1oe0 n GLU 172 N -4.32 1.85 0.25 2.33 1.02 -0.47 -4.43 120.64 116.86 1oe0 n GLU 172 Ca -0.02 -1.28 0.17 0.00 -0.02 0.00 0.00 57.16 56.02 1oe0 n GLU 172 Cb 0.24 -1.41 0.89 0.00 -0.02 0.00 0.00 31.44 31.13 1oe0 n GLU 172 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1oe0 h SER 173 N 2.59 0.00 -0.29 1.62 4.64 -1.33 -2.39 113.55 118.39 1oe0 h SER 173 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1oe0 h SER 173 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1oe0 h SER 173 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1oe0 s VAL 175 N -1.26 3.30 0.55 0.00 1.01 -0.90 -4.98 120.40 118.13 1oe0 s VAL 175 Ca 0.29 0.33 -0.15 0.00 0.00 0.00 0.00 61.98 62.45 1oe0 s VAL 175 Cb 0.17 -3.34 -0.06 0.00 0.00 0.00 0.00 36.38 33.15 1oe0 s VAL 175 CO 0.24 -0.17 1.00 -2.16 0.00 0.00 0.00 175.10 174.01 1oe0 s PRO 176 N 5.41 3.78 0.43 2.72 0.04 -1.26 -4.97 135.00 141.15 1oe0 s PRO 176 Ca 0.86 0.92 0.10 0.00 0.04 0.00 0.00 61.00 62.92 1oe0 s PRO 176 Cb -0.30 -2.11 0.96 0.00 0.04 0.00 0.00 34.50 33.09 1oe0 s PRO 176 CO 0.34 -0.42 2.05 1.25 0.04 0.00 0.00 177.00 180.26 1oe0 h LEU 177 N 0.51 0.39 -0.98 -3.56 5.85 -1.97 -2.07 115.31 113.48 1oe0 h LEU 177 Ca -0.46 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.26 1oe0 h LEU 177 Cb 1.19 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 42.08 1oe0 h LEU 177 CO 0.61 0.27 0.61 0.11 -0.34 0.00 0.00 178.44 179.70 1oe0 h LYS 178 N 0.45 1.30 -0.48 1.25 1.57 -1.99 -0.93 116.57 117.74 1oe0 h LYS 178 Ca 0.17 -0.10 0.03 0.00 -1.87 0.00 0.00 60.65 58.87 1oe0 h LYS 178 Cb 0.13 -0.28 -0.03 0.00 0.08 0.00 0.00 32.23 32.12 1oe0 h LYS 178 CO -0.04 0.89 0.28 -0.92 -0.57 0.00 0.00 179.45 179.09 1oe0 h TYR 179 N 1.33 0.52 -0.01 -1.35 3.20 -1.76 0.85 116.97 119.74 1oe0 h TYR 179 Ca 0.35 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 62.16 1oe0 h TYR 179 Cb -0.10 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.00 1oe0 h TYR 179 CO 0.00 0.29 -0.37 -0.07 -1.64 0.00 0.00 178.16 176.37 1oe0 h LEU 180 N 0.56 0.03 -0.29 2.82 3.38 -1.31 -1.36 115.31 119.13 1oe0 h LEU 180 Ca 0.20 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.99 1oe0 h LEU 180 Cb 0.04 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1oe0 h LEU 180 CO -0.10 0.40 -0.48 1.56 0.09 0.00 0.00 178.44 179.91 1oe0 h GLN 181 N 0.02 0.84 -0.38 1.13 4.20 -0.17 -0.13 115.11 120.61 1oe0 h GLN 181 Ca -0.00 -0.51 -0.02 0.00 0.06 0.00 0.00 58.65 58.17 1oe0 h GLN 181 Cb 0.67 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.48 1oe0 h GLN 181 CO 0.05 1.15 0.15 0.93 -0.67 0.00 0.00 178.83 180.43 1oe0 h GLU 182 N 0.61 0.58 -0.64 1.46 5.08 -0.48 -1.90 114.58 119.29 1oe0 h GLU 182 Ca 0.02 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.22 1oe0 h GLU 182 Cb 1.08 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.21 1oe0 h GLU 182 CO 0.11 0.56 0.18 -0.07 -1.00 0.00 0.00 179.01 178.78 1oe0 h LEU 183 N 0.47 0.92 0.39 1.33 3.38 -1.20 -2.28 115.31 118.32 1oe0 h LEU 183 Ca 0.13 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1oe0 h LEU 183 Cb 0.20 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1oe0 h LEU 183 CO -0.01 0.88 -0.25 -0.74 0.09 0.00 0.00 178.44 178.40 1oe0 h HIS 184 N 0.95 -0.67 -0.77 1.13 2.76 -0.68 -0.44 115.15 117.43 1oe0 h HIS 184 Ca 0.21 -0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.48 1oe0 h HIS 184 Cb 0.30 0.24 -0.08 0.00 1.55 0.00 0.00 27.41 29.43 1oe0 h HIS 184 CO 0.02 -0.39 0.40 0.93 -1.30 0.00 0.00 177.93 177.59 1oe0 h GLU 185 N -0.62 0.64 -0.64 5.26 4.39 -1.19 0.73 114.58 123.14 1oe0 h GLU 185 Ca -0.04 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.60 1oe0 h GLU 185 Cb 0.52 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.00 1oe0 h GLU 185 CO 0.03 0.42 0.30 -0.07 -1.16 0.00 0.00 179.01 178.53 1oe0 h LEU 186 N 0.66 0.83 -0.47 1.33 3.38 -1.07 0.29 115.31 120.25 1oe0 h LEU 186 Ca 0.39 -0.09 -0.15 0.00 0.09 0.00 0.00 57.88 58.11 1oe0 h LEU 186 Cb 0.42 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1oe0 h LEU 186 CO -0.28 0.71 -0.39 0.45 0.09 0.00 0.00 178.44 179.02 1oe0 h HIS 187 N 0.91 1.00 0.27 1.13 3.86 0.22 -2.59 115.15 119.95 1oe0 h HIS 187 Ca 0.22 -0.30 -0.01 0.00 -1.16 0.00 0.00 60.37 59.12 1oe0 h HIS 187 Cb 0.11 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.37 1oe0 h HIS 187 CO 0.01 1.09 -0.13 0.93 0.86 0.00 0.00 177.93 180.69 1oe0 h GLU 188 N 0.68 -0.35 -0.99 2.45 4.39 0.05 0.54 114.58 121.36 1oe0 h GLU 188 Ca 0.06 0.02 0.13 0.00 0.34 0.00 0.00 59.36 59.91 1oe0 h GLU 188 Cb 0.96 0.08 -0.09 0.00 -0.10 0.00 0.00 28.75 29.60 1oe0 h GLU 188 CO 0.09 -0.22 0.62 -0.44 -1.16 0.00 0.00 179.01 177.91 1oe0 h ASP 189 N -0.39 0.87 0.00 1.42 3.32 -0.42 0.42 116.42 121.65 1oe0 h ASP 189 Ca -0.04 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 1oe0 h ASP 189 Cb 0.30 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 1oe0 h ASP 189 CO 0.06 0.44 -0.18 -0.25 -1.72 0.00 0.00 179.24 177.59 1oe0 h TRP 190 N 0.93 0.00 0.00 4.55 7.01 -1.25 0.37 115.95 127.55 1oe0 h TRP 190 Ca 0.50 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.50 1oe0 h TRP 190 Cb 0.57 -0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.63 1oe0 h TRP 190 CO -0.00 1.07 -0.37 -0.07 -2.79 0.00 0.00 178.44 176.28 1oe0 h LEU 191 N -0.99 0.00 0.00 0.65 3.38 -0.87 -3.36 115.31 114.12 1oe0 h LEU 191 Ca -0.05 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1oe0 h LEU 191 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1oe0 h LEU 191 CO -0.03 0.03 0.00 -0.38 0.09 0.00 0.00 178.44 178.15 1oe0 n ILE 192 N -2.57 0.00 0.24 1.22 5.41 0.05 -4.82 119.36 118.89 1oe0 n ILE 192 Ca 0.03 0.00 0.13 0.00 1.00 0.00 0.00 62.75 63.92 1oe0 n ILE 192 Cb 0.49 -0.91 0.67 0.00 -0.71 0.00 0.00 39.64 39.18 1oe0 n ILE 192 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 176.55 177.00 1oe0 h HIS 193 N 0.00 0.00 -5.88 1.39 3.86 -1.38 -3.47 115.15 109.67 1oe0 h HIS 193 Ca 0.00 0.00 -0.28 0.00 -1.16 0.00 0.00 60.37 58.93 1oe0 h HIS 193 Cb 0.00 0.00 0.08 0.00 1.06 0.00 0.00 27.41 28.55 1oe0 h HIS 193 CO 0.00 0.00 -0.67 1.04 0.86 0.00 0.00 177.93 179.16 1oe0 n GLN 194 N -2.42 -1.51 -0.61 2.45 6.02 0.10 -4.90 117.38 116.51 1oe0 n GLN 194 Ca -0.01 0.89 0.09 0.00 -0.01 0.00 0.00 57.00 57.96 1oe0 n GLN 194 Cb 0.09 -4.72 0.35 0.00 1.02 0.00 0.00 30.24 26.98 1oe0 n GLN 194 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1oe0 n ARG 195 N -3.07 3.76 -3.84 -1.09 1.74 0.41 -4.97 116.66 109.60 1oe0 n ARG 195 Ca -0.09 -2.88 -0.04 0.00 -0.77 0.00 0.00 57.85 54.07 1oe0 n ARG 195 Cb 0.58 -1.90 0.01 0.00 -1.02 0.00 0.00 32.46 30.14 1oe0 n ARG 195 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1oe0 s ARG 196 N -1.95 1.40 0.00 5.56 1.70 -1.26 -4.99 118.95 119.42 1oe0 s ARG 196 Ca 0.50 -0.87 -0.09 0.00 -0.47 0.00 0.00 55.73 54.80 1oe0 s ARG 196 Cb 0.33 0.41 -0.11 0.00 -0.57 0.00 0.00 34.95 35.01 1oe0 s ARG 196 CO 0.23 -0.65 0.80 -2.30 -1.08 0.00 0.00 175.30 172.29 1oe0 n PRO 197 N -0.61 0.00 -3.54 3.89 -0.02 -1.26 -4.89 135.00 128.57 1oe0 n PRO 197 Ca -0.05 -0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.14 1oe0 n PRO 197 Cb 0.60 -1.44 -0.04 0.00 -0.02 0.00 0.00 33.50 32.60 1oe0 n PRO 197 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1oe0 s GLN 198 N 4.09 0.48 -0.35 -0.52 -1.52 -1.26 -5.00 119.66 115.59 1oe0 s GLN 198 Ca 0.20 1.20 0.07 0.00 -1.95 0.00 0.00 55.36 54.87 1oe0 s GLN 198 Cb 0.04 0.72 0.52 0.00 -0.22 0.00 0.00 33.01 34.07 1oe0 s GLN 198 CO 0.10 -0.19 1.55 -1.13 -0.25 0.00 0.00 175.29 175.37 1oe0 n SER 199 N 5.30 3.28 -4.87 5.90 3.41 -1.26 -4.99 113.62 120.40 1oe0 n SER 199 Ca -0.10 -3.77 -0.35 0.00 -0.26 0.00 0.00 58.87 54.38 1oe0 n SER 199 Cb 0.50 -0.67 -0.05 0.00 -0.26 0.00 0.00 64.21 63.73 1oe0 n SER 199 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1oe0 s LYS 201 N -1.71 4.32 -0.05 0.00 -0.14 -1.26 -4.92 119.74 115.98 1oe0 s LYS 201 Ca 0.28 2.15 0.04 0.00 -1.36 0.00 0.00 55.97 57.08 1oe0 s LYS 201 Cb -0.14 -3.02 0.00 0.00 -1.68 0.00 0.00 37.83 32.99 1oe0 s LYS 201 CO 0.16 -0.19 -0.16 0.08 -0.76 0.00 0.00 175.35 174.48 1oe0 s VAL 202 N -1.17 1.36 -0.29 3.17 1.01 -1.26 -1.94 120.40 121.28 1oe0 s VAL 202 Ca 0.50 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.78 1oe0 s VAL 202 Cb -0.38 -1.19 0.02 0.00 0.00 0.00 0.00 36.38 34.84 1oe0 s VAL 202 CO 0.50 0.40 0.02 -0.22 0.00 0.00 0.00 175.10 175.81 1oe0 s LEU 203 N 0.20 3.69 -0.04 3.92 2.96 -0.21 -4.99 118.68 124.22 1oe0 s LEU 203 Ca -0.07 -0.90 -0.22 0.00 -0.22 0.00 0.00 54.13 52.72 1oe0 s LEU 203 Cb -0.13 -1.78 -0.05 0.00 0.50 0.00 0.00 46.19 44.74 1oe0 s LEU 203 CO 0.03 -0.20 0.63 -0.69 -1.32 0.00 0.00 176.35 174.80 1oe0 s VAL 204 N 1.39 4.99 -0.05 1.68 1.01 -1.26 -0.98 120.40 127.18 1oe0 s VAL 204 Ca 0.00 1.30 0.04 0.00 0.00 0.00 0.00 61.98 63.32 1oe0 s VAL 204 Cb -0.18 -3.97 0.00 0.00 0.00 0.00 0.00 36.38 32.24 1oe0 s VAL 204 CO -0.00 0.34 -0.16 -0.76 0.00 0.00 0.00 175.10 174.51 1oe0 s LEU 205 N 0.33 1.86 -0.60 3.92 1.02 -0.23 -4.95 118.68 120.03 1oe0 s LEU 205 Ca 0.33 -0.35 -0.27 0.00 0.02 0.00 0.00 54.13 53.86 1oe0 s LEU 205 Cb -0.18 -0.96 0.01 0.00 0.02 0.00 0.00 46.19 45.09 1oe0 s LEU 205 CO 0.17 0.12 1.50 -0.62 0.02 0.00 0.00 176.35 177.54 1oe0 s ASP 206 N 0.23 5.93 -0.20 2.29 -1.08 -1.26 -0.58 116.67 122.01 1oe0 s ASP 206 Ca -0.08 0.18 0.05 0.00 -0.52 0.00 0.00 52.55 52.19 1oe0 s ASP 206 Cb -0.13 -2.54 0.43 0.00 -1.46 0.00 0.00 42.92 39.22 1oe0 s ASP 206 CO 0.03 -1.89 1.37 0.00 0.52 0.00 0.00 175.17 175.20 1oe0 n ALA 207 N 10.28 3.77 -0.78 3.66 0.00 0.67 -4.09 120.51 134.02 1oe0 n ALA 207 Ca 0.13 -1.37 -0.19 0.00 0.00 0.00 0.00 53.44 52.01 1oe0 n ALA 207 Cb 0.50 -1.16 0.07 0.00 0.00 0.00 0.00 19.45 18.85 1oe0 n ALA 207 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1oe0 n ASP 208 N -0.03 5.67 -3.09 0.00 8.00 -1.26 -4.82 116.55 121.02 1oe0 n ASP 208 Ca 0.25 -3.15 -0.11 0.00 0.71 0.00 0.00 54.79 52.49 1oe0 n ASP 208 Cb 0.98 -0.93 0.05 0.00 -0.02 0.00 0.00 41.12 41.20 1oe0 n ASP 208 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1oe0 n LEU 209 N -0.13 -5.62 0.00 0.64 4.77 -1.26 -5.14 117.00 110.25 1oe0 n LEU 209 Ca 0.37 -0.54 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 1oe0 n LEU 209 Cb 0.80 -3.05 0.00 0.00 -2.33 0.00 0.00 43.42 38.84 1oe0 n LEU 209 CO 0.44 -0.15 0.00 -3.20 -1.33 0.00 0.00 177.39 173.16