#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 2.51 0.41 -2.82 1.02 -1.26 -4.87 119.74 114.73 1oe0 s LYS 13 Ca 0.00 -0.79 -0.26 0.00 0.02 0.00 0.00 55.97 54.94 1oe0 s LYS 13 Cb 0.00 -2.50 -0.10 0.00 -0.52 0.00 0.00 37.83 34.71 1oe0 s LYS 13 CO 0.00 0.57 1.31 0.98 -0.92 0.00 0.00 175.35 177.29 1oe0 n TYR 14 N 1.11 2.27 -1.22 3.18 9.36 -0.56 -1.47 117.16 129.82 1oe0 n TYR 14 Ca -0.14 0.50 -0.07 0.00 3.32 0.00 0.00 57.90 61.51 1oe0 n TYR 14 Cb 0.52 -2.40 -0.03 0.00 -0.63 0.00 0.00 39.34 36.80 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 -0.09 -0.11 -1.77 2.98 0.00 -1.26 -1.64 120.51 118.62 1oe0 n ALA 15 Ca 0.06 0.12 -0.42 0.00 0.00 0.00 0.00 53.44 53.20 1oe0 n ALA 15 Cb 0.39 -1.40 -0.03 0.00 0.00 0.00 0.00 19.45 18.42 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 -2.38 4.14 -1.35 0.00 2.56 -0.54 -2.86 118.70 118.27 1oe0 s GLU 16 Ca 0.00 2.56 -0.00 0.00 0.00 0.00 0.00 54.97 57.53 1oe0 s GLU 16 Cb 0.00 -3.08 0.00 0.00 2.00 0.00 0.00 34.13 33.06 1oe0 s GLU 16 CO 0.00 -0.70 0.58 0.41 -0.56 0.00 0.00 175.26 174.99 1oe0 n GLY 17 N 3.58 -0.26 0.00 -1.50 0.00 -1.26 -4.84 105.19 100.90 1oe0 n GLY 17 Ca 0.14 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.29 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 -4.33 0.00 -4.39 2.61 -2.24 -1.13 -5.08 114.28 99.72 1oe0 n THR 18 Ca -0.30 -0.13 -0.34 0.00 -2.27 0.00 0.00 64.05 61.01 1oe0 n THR 18 Cb 0.68 1.35 -0.10 0.00 -2.10 0.00 0.00 70.33 70.15 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 3.21 0.07 -0.78 -1.52 -1.26 -4.63 119.66 114.62 1oe0 s GLN 19 Ca 0.00 -0.45 -0.01 0.00 -1.95 0.00 0.00 55.36 52.95 1oe0 s GLN 19 Cb 0.00 -2.83 0.02 0.00 -0.22 0.00 0.00 33.01 29.98 1oe0 s GLN 19 CO 0.00 0.54 0.06 -0.35 -0.25 0.00 0.00 175.29 175.29 1oe0 n PRO 20 N 2.63 -1.33 -1.91 2.91 -0.04 -1.26 -4.92 135.00 131.07 1oe0 n PRO 20 Ca -0.18 -0.10 -0.42 0.00 -0.04 0.00 0.00 63.50 62.76 1oe0 n PRO 20 Cb 0.53 -0.10 -0.03 0.00 -0.04 0.00 0.00 33.50 33.86 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 -1.10 2.78 -0.10 0.54 5.36 -1.19 -4.82 117.98 119.45 1oe0 s PHE 21 Ca 0.04 0.47 0.04 0.00 -0.96 0.00 0.00 56.93 56.52 1oe0 s PHE 21 Cb -0.00 -3.96 -0.00 0.00 -0.34 0.00 0.00 43.02 38.71 1oe0 s PHE 21 CO 0.03 -3.69 -0.22 0.99 -1.46 0.00 0.00 175.22 170.87 1oe0 s THR 22 N 1.75 2.24 -0.09 0.12 2.01 -1.26 -1.01 115.64 119.40 1oe0 s THR 22 Ca 0.72 -0.96 0.01 0.00 0.31 0.00 0.00 61.69 61.77 1oe0 s THR 22 Cb -0.43 -1.86 -0.02 0.00 0.01 0.00 0.00 72.50 70.19 1oe0 s THR 22 CO 0.32 0.56 -0.10 -0.69 -0.69 0.00 0.00 174.62 174.01 1oe0 s VAL 23 N 0.26 3.35 -0.14 3.82 1.01 0.14 -1.45 120.40 127.39 1oe0 s VAL 23 Ca -0.15 -0.59 -0.02 0.00 0.00 0.00 0.00 61.98 61.22 1oe0 s VAL 23 Cb -0.17 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 1oe0 s VAL 23 CO 0.08 0.56 -0.09 -0.76 0.00 0.00 0.00 175.10 174.89 1oe0 s LEU 24 N -0.27 2.96 -0.36 3.92 1.43 0.94 -0.86 118.68 126.43 1oe0 s LEU 24 Ca 0.03 -0.24 -0.14 0.00 -1.03 0.00 0.00 54.13 52.75 1oe0 s LEU 24 Cb -0.13 -1.69 -0.00 0.00 0.03 0.00 0.00 46.19 44.40 1oe0 s LEU 24 CO 0.03 0.17 0.27 -0.63 0.23 0.00 0.00 176.35 176.41 1oe0 s ILE 25 N 0.36 5.27 0.29 -0.59 -1.09 0.11 -0.37 121.20 125.17 1oe0 s ILE 25 Ca -0.08 -0.34 0.11 0.00 -2.23 0.00 0.00 60.65 58.11 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 0.04 -0.12 -0.12 -1.61 -1.23 0.00 0.00 174.94 171.91 1oe0 s GLU 26 N 1.74 1.89 0.00 2.79 0.41 -0.29 -0.93 118.70 124.30 1oe0 s GLU 26 Ca 0.06 -1.70 0.00 0.00 -0.41 0.00 0.00 54.97 52.92 1oe0 s GLU 26 Cb -0.18 -1.87 0.00 0.00 -1.78 0.00 0.00 34.13 30.30 1oe0 s GLU 26 CO 0.11 0.30 0.00 0.41 -0.49 0.00 0.00 175.26 175.58 1oe0 n GLY 27 N -0.74 3.15 3.50 -1.39 0.00 -1.26 -0.74 105.19 107.72 1oe0 n GLY 27 Ca -0.05 -0.86 -0.29 0.00 0.00 0.00 0.00 46.02 44.82 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 1.12 0.23 1.61 3.84 -1.26 -4.80 114.94 115.68 1oe0 s ASN 28 Ca 0.00 1.67 -0.31 0.00 0.21 0.00 0.00 52.86 54.42 1oe0 s ASN 28 Cb 0.00 -2.39 -0.12 0.00 -0.55 0.00 0.00 41.25 38.19 1oe0 s ASN 28 CO 0.00 -4.14 1.66 -0.38 -2.79 0.00 0.00 177.10 171.45 1oe0 n ILE 29 N -4.89 0.37 -1.07 -5.21 5.41 -1.26 -1.21 119.36 111.50 1oe0 n ILE 29 Ca 0.04 -0.09 -0.02 0.00 1.00 0.00 0.00 62.75 63.68 1oe0 n ILE 29 Cb 0.54 -1.93 -0.01 0.00 -0.71 0.00 0.00 39.64 37.53 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 3.27 0.56 0.04 7.39 0.00 -1.26 -4.73 105.19 110.45 1oe0 n GLY 30 Ca 0.13 -0.32 0.12 0.00 0.00 0.00 0.00 46.02 45.95 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 0.26 0.29 -0.00 1.61 3.41 -0.35 -4.63 113.62 114.21 1oe0 n SER 31 Ca -0.02 0.54 0.00 0.00 -0.26 0.00 0.00 58.87 59.13 1oe0 n SER 31 Cb 0.16 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.50 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 0.95 1.84 0.27 5.00 0.00 -1.26 -4.89 105.19 107.09 1oe0 n GLY 32 Ca 0.05 -0.07 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 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 0.89 -0.22 1.61 1.57 -1.90 -1.29 116.57 117.23 1oe0 h LYS 33 Ca 0.00 -0.15 -0.09 0.00 -1.87 0.00 0.00 60.65 58.53 1oe0 h LYS 33 Cb 0.08 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 1oe0 h LYS 33 CO 0.00 0.75 -0.23 1.15 -0.57 0.00 0.00 179.45 180.55 1oe0 h THR 34 N 0.83 1.32 -0.67 -0.16 2.02 -1.97 -2.16 112.91 112.12 1oe0 h THR 34 Ca 0.20 -1.39 0.07 0.00 0.77 0.00 0.00 66.41 66.06 1oe0 h THR 34 Cb 0.18 1.72 -0.06 0.00 -1.74 0.00 0.00 68.15 68.25 1oe0 h THR 34 CO -0.02 0.43 0.35 0.74 0.37 0.00 0.00 175.52 177.39 1oe0 h THR 35 N 0.24 0.92 -0.79 3.16 2.02 -1.95 -0.67 112.91 115.85 1oe0 h THR 35 Ca 0.03 -0.22 -0.05 0.00 0.77 0.00 0.00 66.41 66.95 1oe0 h THR 35 Cb 0.78 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 1oe0 h THR 35 CO 0.06 0.12 0.31 0.22 0.37 0.00 0.00 175.52 176.59 1oe0 h TYR 36 N 0.63 1.20 0.00 3.16 3.20 -1.16 -2.86 116.97 121.13 1oe0 h TYR 36 Ca 0.31 -0.09 -0.08 0.00 3.14 0.00 0.00 58.73 62.01 1oe0 h TYR 36 Cb 0.25 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 1oe0 h TYR 36 CO -0.09 0.91 -0.40 -0.07 -1.64 0.00 0.00 178.16 176.86 1oe0 h LEU 37 N 1.15 0.00 0.00 2.82 3.38 -0.60 -2.98 115.31 119.08 1oe0 h LEU 37 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1oe0 h LEU 37 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1oe0 h LEU 37 CO -0.02 0.40 0.00 0.59 0.09 0.00 0.00 178.44 179.50 1oe0 n ASN 38 N -3.63 0.00 0.22 -0.43 3.02 -0.36 -1.87 115.26 112.21 1oe0 n ASN 38 Ca -0.01 0.49 0.12 0.00 -0.03 0.00 0.00 54.58 55.16 1oe0 n ASN 38 Cb 0.51 -0.50 0.20 0.00 -0.61 0.00 0.00 39.78 39.38 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 -0.20 3.10 3.86 -1.63 -2.98 115.15 117.30 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 0.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.59 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 0.24 -0.32 2.45 3.01 -0.78 -4.48 117.46 114.46 1oe0 n PHE 40 Ca 0.04 -0.12 0.15 0.00 1.01 0.00 0.00 57.45 58.52 1oe0 n PHE 40 Cb 0.53 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 3.66 0.47 0.00 -1.08 4.81 -1.59 -1.05 114.58 119.80 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 30.07 1oe0 h GLU 41 CO 0.00 0.31 0.00 1.57 -0.73 0.00 0.00 179.01 180.16 1oe0 h LYS 42 N 0.49 0.00 -0.67 1.92 2.10 -1.83 -2.68 116.57 115.89 1oe0 h LYS 42 Ca 0.59 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.24 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 -0.50 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 177.61 1oe0 n TYR 43 N -2.68 1.63 -0.33 0.07 0.53 -0.40 -4.58 117.16 111.39 1oe0 n TYR 43 Ca 0.03 -0.57 0.27 0.00 -1.02 0.00 0.00 57.90 56.61 1oe0 n TYR 43 Cb 0.35 -0.42 0.51 0.00 -1.03 0.00 0.00 39.34 38.76 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 3.15 0.17 -0.68 -0.72 3.11 -1.50 0.20 116.57 120.30 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 1.65 -0.04 0.00 0.00 -1.00 0.00 0.00 32.23 32.84 1oe0 h LYS 44 CO 0.38 0.11 0.00 0.09 -2.81 0.00 0.00 179.45 177.23 1oe0 n ASN 45 N -5.16 2.59 0.00 4.20 5.03 -1.26 -3.68 115.26 116.98 1oe0 n ASN 45 Ca 0.34 -2.28 0.00 0.00 0.87 0.00 0.00 54.58 53.51 1oe0 n ASN 45 Cb 1.10 -0.47 0.00 0.00 -1.02 0.00 0.00 39.78 39.38 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 0.30 0.43 -3.94 6.41 8.00 0.58 -5.02 116.55 123.30 1oe0 n ASP 46 Ca 0.11 -0.02 -0.21 0.00 0.71 0.00 0.00 54.79 55.38 1oe0 n ASP 46 Cb 0.53 0.13 -0.16 0.00 -0.02 0.00 0.00 41.12 41.60 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 -0.21 0.74 -0.34 0.53 1.01 -0.52 -3.87 121.20 118.54 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 -0.72 0.02 0.00 0.01 0.00 0.00 42.46 41.77 1oe0 s ILE 47 CO 0.00 0.27 1.08 0.00 0.00 0.00 0.00 174.94 176.29 1oe0 s LEU 49 N 3.75 3.88 -0.47 0.00 1.43 -1.26 -1.46 118.68 124.55 1oe0 s LEU 49 Ca 0.46 -0.76 -0.04 0.00 -1.03 0.00 0.00 54.13 52.75 1oe0 s LEU 49 Cb -0.12 -1.87 0.12 0.00 0.03 0.00 0.00 46.19 44.36 1oe0 s LEU 49 CO 0.17 -0.20 0.28 -0.76 0.23 0.00 0.00 176.35 176.07 1oe0 s LEU 50 N 1.48 5.36 0.41 1.79 1.43 -0.79 -5.03 118.68 123.33 1oe0 s LEU 50 Ca 0.02 -2.17 0.07 0.00 -1.03 0.00 0.00 54.13 51.02 1oe0 s LEU 50 Cb -0.17 -1.87 -0.07 0.00 0.03 0.00 0.00 46.19 44.10 1oe0 s LEU 50 CO 0.02 -0.54 0.03 0.42 0.23 0.00 0.00 176.35 176.51 1oe0 s THR 51 N 0.95 2.07 -1.16 5.49 -4.23 -1.26 -1.58 115.64 115.91 1oe0 s THR 51 Ca 0.10 -1.96 -0.30 0.00 -1.18 0.00 0.00 61.69 58.35 1oe0 s THR 51 Cb -0.23 -2.98 0.04 0.00 1.34 0.00 0.00 72.50 70.67 1oe0 s THR 51 CO -0.03 -0.01 0.68 1.21 -0.54 0.00 0.00 174.62 175.92 1oe0 n GLU 52 N -1.00 -0.47 0.32 3.99 4.07 -1.26 -4.85 120.64 121.43 1oe0 n GLU 52 Ca -0.04 0.19 0.20 0.00 -0.06 0.00 0.00 57.16 57.45 1oe0 n GLU 52 Cb 0.66 -2.59 1.03 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 -2.29 0.00 -0.70 5.31 0.11 -1.90 -2.91 132.00 129.62 1oe0 h PRO 53 Ca -0.70 0.00 0.16 0.00 0.11 0.00 0.00 66.00 65.57 1oe0 h PRO 53 Cb 1.40 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.47 1oe0 h PRO 53 CO 0.50 0.01 0.48 0.28 -0.21 0.00 0.00 178.00 179.06 1oe0 h VAL 54 N 0.00 0.75 -0.68 3.15 2.07 -1.98 -1.54 116.25 118.02 1oe0 h VAL 54 Ca -0.00 -0.09 0.06 0.00 0.82 0.00 0.00 66.70 67.49 1oe0 h VAL 54 Cb 0.16 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.36 1oe0 h VAL 54 CO 0.00 0.05 0.45 -0.33 0.02 0.00 0.00 177.57 177.76 1oe0 h GLU 55 N 0.26 0.68 -0.36 1.57 4.39 -1.89 -1.03 114.58 118.20 1oe0 h GLU 55 Ca 0.34 -0.04 -0.14 0.00 0.34 0.00 0.00 59.36 59.86 1oe0 h GLU 55 Cb 0.98 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.47 1oe0 h GLU 55 CO -0.08 0.45 -0.36 0.87 -1.16 0.00 0.00 179.01 178.74 1oe0 h LYS 56 N 0.70 0.82 0.00 2.33 1.57 -1.52 -2.98 116.57 117.49 1oe0 h LYS 56 Ca 0.29 -0.41 -0.05 0.00 -1.87 0.00 0.00 60.65 58.62 1oe0 h LYS 56 Cb 0.25 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1oe0 h LYS 56 CO -0.09 1.04 -0.22 -1.49 -0.57 0.00 0.00 179.45 178.13 1oe0 h TRP 57 N 0.68 0.00 -0.00 -1.35 6.55 -1.28 -2.88 115.95 117.67 1oe0 h TRP 57 Ca 0.06 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.90 1oe0 h TRP 57 Cb 0.91 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.21 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 -3.39 0.06 -3.30 0.49 1.74 -0.50 -1.89 116.66 109.87 1oe0 n ARG 58 Ca 0.00 -0.02 -0.10 0.00 -0.77 0.00 0.00 57.85 56.97 1oe0 n ARG 58 Cb 0.42 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.31 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 -2.96 0.15 -0.62 0.55 2.47 -1.09 -3.99 114.94 109.46 1oe0 s ASN 59 Ca 0.14 -1.12 -0.08 0.00 0.42 0.00 0.00 52.86 52.23 1oe0 s ASN 59 Cb 0.18 1.11 0.16 0.00 -1.45 0.00 0.00 41.25 41.26 1oe0 s ASN 59 CO 0.59 -0.25 0.48 -0.69 -3.72 0.00 0.00 177.10 173.52 1oe0 s VAL 60 N 1.76 4.32 -1.44 -5.21 1.01 0.13 -4.54 120.40 116.42 1oe0 s VAL 60 Ca 0.15 -2.43 -0.07 0.00 0.00 0.00 0.00 61.98 59.63 1oe0 s VAL 60 Cb -0.11 -3.78 0.05 0.00 0.00 0.00 0.00 36.38 32.53 1oe0 s VAL 60 CO -0.09 -0.87 0.81 0.59 0.00 0.00 0.00 175.10 175.53 1oe0 n ASN 61 N 4.10 -2.84 0.00 3.32 3.02 -1.26 -1.04 115.26 120.56 1oe0 n ASN 61 Ca 0.04 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.76 1oe0 n ASN 61 Cb 0.41 -3.83 0.00 0.00 -0.61 0.00 0.00 39.78 35.75 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 2.82 3.75 7.41 0.00 -1.26 -5.03 105.19 111.21 1oe0 n GLY 62 Ca -0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.19 4.94 -0.93 1.61 1.01 -0.21 -4.95 120.40 119.69 1oe0 s VAL 63 Ca 0.00 1.26 -0.13 0.00 0.00 0.00 0.00 61.98 63.10 1oe0 s VAL 63 Cb 0.00 -3.94 0.23 0.00 0.00 0.00 0.00 36.38 32.67 1oe0 s VAL 63 CO 0.00 0.39 0.92 0.21 0.00 0.00 0.00 175.10 176.62 1oe0 s ASN 64 N -0.02 6.91 0.28 3.32 3.84 -1.26 0.18 114.94 128.20 1oe0 s ASN 64 Ca 0.32 -2.89 -0.04 0.00 0.21 0.00 0.00 52.86 50.46 1oe0 s ASN 64 Cb -0.18 -2.24 0.36 0.00 -0.55 0.00 0.00 41.25 38.65 1oe0 s ASN 64 CO 0.17 -0.55 1.94 -0.07 -2.79 0.00 0.00 177.10 175.80 1oe0 h LEU 65 N 7.81 1.03 -0.55 3.21 3.38 -1.62 -2.08 115.31 126.50 1oe0 h LEU 65 Ca 0.14 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.09 1oe0 h LEU 65 Cb 0.99 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 1oe0 h LEU 65 CO 0.87 0.76 0.34 0.25 0.09 0.00 0.00 178.44 180.75 1oe0 h LEU 66 N 1.21 0.57 -0.18 1.67 5.85 -1.83 -0.37 115.31 122.23 1oe0 h LEU 66 Ca 0.32 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 59.01 1oe0 h LEU 66 Cb -0.11 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 1oe0 h LEU 66 CO -0.07 0.40 -0.00 -0.08 -0.34 0.00 0.00 178.44 178.35 1oe0 h GLU 67 N 0.68 0.32 -0.91 1.25 4.81 -1.78 -2.62 114.58 116.33 1oe0 h GLU 67 Ca 0.21 -0.10 0.09 0.00 -0.13 0.00 0.00 59.36 59.43 1oe0 h GLU 67 Cb -0.01 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.28 1oe0 h GLU 67 CO -0.08 0.53 0.59 -0.07 -0.73 0.00 0.00 179.01 179.25 1oe0 h LEU 68 N 0.07 0.85 -0.26 1.64 3.38 -1.12 -1.32 115.31 118.55 1oe0 h LEU 68 Ca 0.05 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1oe0 h LEU 68 Cb 0.39 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1oe0 h LEU 68 CO 0.01 0.51 0.08 -0.03 0.09 0.00 0.00 178.44 179.11 1oe0 h MET 69 N 0.95 0.40 -0.23 1.13 4.05 -0.90 -1.04 114.93 119.29 1oe0 h MET 69 Ca 0.41 -0.09 -0.08 0.00 -0.28 0.00 0.00 59.70 59.66 1oe0 h MET 69 Cb 0.34 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.07 1oe0 h MET 69 CO -0.17 0.47 -0.21 1.88 0.23 0.00 0.00 176.91 179.11 1oe0 h TYR 70 N 0.25 0.46 0.04 1.39 0.99 -1.06 -1.78 116.97 117.26 1oe0 h TYR 70 Ca 0.08 -0.09 -0.23 0.00 2.00 0.00 0.00 58.73 60.50 1oe0 h TYR 70 Cb 0.23 -0.12 -0.00 0.00 1.00 0.00 0.00 36.73 37.84 1oe0 h TYR 70 CO 0.00 0.61 -1.01 0.87 -0.00 0.00 0.00 178.16 178.64 1oe0 h LYS 71 N 0.38 0.31 -1.55 4.88 1.57 -1.10 -3.40 116.57 117.66 1oe0 h LYS 71 Ca 0.06 -0.39 -0.48 0.00 -1.87 0.00 0.00 60.65 57.97 1oe0 h LYS 71 Cb 0.59 0.12 -0.33 0.00 0.08 0.00 0.00 32.23 32.69 1oe0 h LYS 71 CO 0.04 1.10 -0.97 -3.47 -0.57 0.00 0.00 179.45 175.58 1oe0 n ASP 72 N -3.66 -0.55 -0.22 0.86 2.03 -0.41 -5.01 116.55 109.58 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 0.88 -0.07 0.14 0.00 -0.72 0.00 0.00 41.12 41.35 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 4.03 0.31 -0.62 -0.67 0.11 -1.52 -0.02 132.00 133.63 1oe0 h PRO 73 Ca 0.02 -0.02 0.18 0.00 0.11 0.00 0.00 66.00 66.29 1oe0 h PRO 73 Cb 0.92 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.93 1oe0 h PRO 73 CO 0.43 0.21 0.44 0.87 -0.21 0.00 0.00 178.00 179.74 1oe0 h LYS 74 N 0.32 0.00 0.00 1.05 1.79 -1.85 -0.69 116.57 117.19 1oe0 h LYS 74 Ca 0.36 -0.00 -0.30 0.00 -2.18 0.00 0.00 60.65 58.52 1oe0 h LYS 74 Cb 0.54 -0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.13 1oe0 h LYS 74 CO -0.41 0.00 -2.15 1.17 -1.08 0.00 0.00 179.45 176.98 1oe0 n LYS 75 N -4.35 0.88 -0.00 3.15 4.81 0.82 -4.75 118.16 118.72 1oe0 n LYS 75 Ca 0.12 0.06 0.08 0.00 -0.87 0.00 0.00 58.31 57.71 1oe0 n LYS 75 Cb 0.69 -1.41 -0.10 0.00 0.02 0.00 0.00 35.03 34.22 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 -2.89 0.00 -0.32 5.64 7.02 -0.08 -4.51 117.44 122.31 1oe0 n TRP 76 Ca -0.32 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.14 1oe0 n TRP 76 Cb 0.95 -0.00 0.14 0.00 -2.42 0.00 0.00 31.31 29.97 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 2.50 1.27 0.31 6.99 0.00 -1.31 -1.40 119.26 127.61 1oe0 h ALA 77 Ca 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1oe0 h ALA 77 Cb 0.42 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1oe0 h ALA 77 CO 0.00 0.63 -0.15 1.98 0.00 0.00 0.00 179.25 181.71 1oe0 h MET 78 N 1.23 -0.40 -0.30 0.00 1.85 -1.79 -0.73 114.93 114.79 1oe0 h MET 78 Ca 0.32 0.03 -0.03 0.00 -0.61 0.00 0.00 59.70 59.41 1oe0 h MET 78 Cb -0.06 0.09 -0.02 0.00 0.43 0.00 0.00 31.60 32.05 1oe0 h MET 78 CO -0.06 -0.08 0.06 -1.00 -0.40 0.00 0.00 176.91 175.42 1oe0 h PRO 79 N -0.77 0.43 0.15 0.39 0.13 -1.81 -0.89 132.00 129.64 1oe0 h PRO 79 Ca -0.04 -0.07 -0.01 0.00 -0.87 0.00 0.00 66.00 65.01 1oe0 h PRO 79 Cb 0.51 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.56 1oe0 h PRO 79 CO 0.07 0.42 -0.07 0.35 -0.23 0.00 0.00 178.00 178.54 1oe0 h PHE 80 N 0.43 -0.19 -0.16 1.56 3.57 -1.18 -1.42 116.94 119.55 1oe0 h PHE 80 Ca 0.10 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.55 1oe0 h PHE 80 Cb 0.20 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 1oe0 h PHE 80 CO 0.01 0.01 -0.13 1.96 -2.23 0.00 0.00 178.31 177.93 1oe0 h GLN 81 N -0.36 0.25 -0.29 1.11 1.08 -0.86 0.73 115.11 116.77 1oe0 h GLN 81 Ca -0.02 -0.06 -0.08 0.00 -1.45 0.00 0.00 58.65 57.04 1oe0 h GLN 81 Cb 0.28 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.66 1oe0 h GLN 81 CO 0.03 0.39 -0.16 1.03 -0.95 0.00 0.00 178.83 179.17 1oe0 h SER 82 N 0.24 0.50 0.49 1.46 0.87 -0.97 -0.37 113.55 115.78 1oe0 h SER 82 Ca 0.05 -0.14 -0.25 0.00 -1.23 0.00 0.00 61.79 60.21 1oe0 h SER 82 Cb 0.38 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 1oe0 h SER 82 CO 0.02 0.69 -1.09 0.22 -0.53 0.00 0.00 176.83 176.14 1oe0 h TYR 83 N 0.47 0.54 -0.26 2.24 3.20 -0.17 -2.19 116.97 120.80 1oe0 h TYR 83 Ca 0.08 -0.34 -0.00 0.00 3.14 0.00 0.00 58.73 61.60 1oe0 h TYR 83 Cb 0.56 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 1oe0 h TYR 83 CO 0.02 1.21 0.16 0.28 -1.64 0.00 0.00 178.16 178.19 1oe0 h VAL 84 N 0.14 1.10 -0.37 1.81 2.07 -0.62 -1.14 116.25 119.25 1oe0 h VAL 84 Ca -0.11 -0.25 0.06 0.00 0.82 0.00 0.00 66.70 67.22 1oe0 h VAL 84 Cb 1.77 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 32.28 1oe0 h VAL 84 CO 0.18 0.10 0.07 0.74 0.02 0.00 0.00 177.57 178.68 1oe0 h THR 85 N 0.33 0.81 -0.01 2.57 2.02 -1.05 -1.24 112.91 116.33 1oe0 h THR 85 Ca 0.09 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.21 1oe0 h THR 85 Cb 0.02 0.60 -0.00 0.00 -1.74 0.00 0.00 68.15 67.04 1oe0 h THR 85 CO -0.02 0.03 0.01 0.25 0.37 0.00 0.00 175.52 176.17 1oe0 h LEU 86 N 0.19 0.02 -1.30 2.58 5.85 -1.11 -1.06 115.31 120.47 1oe0 h LEU 86 Ca 0.18 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.83 1oe0 h LEU 86 Cb 0.21 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1oe0 h LEU 86 CO -0.24 0.02 -0.19 0.71 -0.34 0.00 0.00 178.44 178.40 1oe0 h THR 87 N 0.01 1.21 -0.16 1.05 1.35 -0.96 0.08 112.91 115.49 1oe0 h THR 87 Ca 0.00 -0.95 -0.03 0.00 -0.55 0.00 0.00 66.41 64.88 1oe0 h THR 87 Cb 0.00 1.31 -0.00 0.00 -1.73 0.00 0.00 68.15 67.73 1oe0 h THR 87 CO -0.00 0.29 -0.04 0.24 -0.25 0.00 0.00 175.52 175.76 1oe0 h MET 88 N 0.22 0.31 -1.00 4.72 2.86 -1.04 -1.78 114.93 119.22 1oe0 h MET 88 Ca 0.04 -0.12 0.06 0.00 -2.06 0.00 0.00 59.70 57.62 1oe0 h MET 88 Cb 0.47 -0.02 -0.06 0.00 0.06 0.00 0.00 31.60 32.05 1oe0 h MET 88 CO 0.03 0.58 0.65 1.25 1.06 0.00 0.00 176.91 180.48 1oe0 h LEU 89 N 0.01 1.05 -0.81 1.22 5.85 -0.76 0.24 115.31 122.10 1oe0 h LEU 89 Ca 0.04 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 1oe0 h LEU 89 Cb 0.47 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 1oe0 h LEU 89 CO 0.02 0.68 0.15 1.56 -0.34 0.00 0.00 178.44 180.51 1oe0 h GLN 90 N 1.19 1.04 -0.17 1.25 4.20 -0.76 -1.88 115.11 119.98 1oe0 h GLN 90 Ca 0.42 -0.24 -0.15 0.00 0.06 0.00 0.00 58.65 58.74 1oe0 h GLN 90 Cb 0.12 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.76 1oe0 h GLN 90 CO -0.16 0.93 -0.47 0.77 -0.67 0.00 0.00 178.83 179.23 1oe0 h SER 91 N 0.99 0.71 -0.99 1.46 0.02 -0.29 -1.16 113.55 114.29 1oe0 h SER 91 Ca 0.21 -0.58 0.05 0.00 -0.84 0.00 0.00 61.79 60.63 1oe0 h SER 91 Cb 0.36 -0.21 -0.06 0.00 0.14 0.00 0.00 62.40 62.63 1oe0 h SER 91 CO 0.00 1.17 0.64 0.45 -1.14 0.00 0.00 176.83 177.95 1oe0 h HIS 92 N 0.30 1.19 -0.34 3.45 3.86 -0.46 -2.61 115.15 120.54 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 1.09 -0.40 0.00 0.00 1.06 0.00 0.00 27.41 29.16 1oe0 h HIS 92 CO 0.10 0.66 0.00 0.25 0.86 0.00 0.00 177.93 179.79 1oe0 n THR 93 N -4.48 0.44 -1.93 2.45 -2.24 -0.72 -4.68 114.28 103.11 1oe0 n THR 93 Ca 0.14 -0.64 -0.42 0.00 -2.27 0.00 0.00 64.05 60.86 1oe0 n THR 93 Cb 0.13 0.78 -0.03 0.00 -2.10 0.00 0.00 70.33 69.12 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 -1.56 3.73 0.41 6.98 0.00 -0.44 -4.93 121.76 125.95 1oe0 s ALA 94 Ca 0.37 1.39 -0.25 0.00 0.00 0.00 0.00 51.96 53.47 1oe0 s ALA 94 Cb 0.21 -3.61 -0.08 0.00 0.00 0.00 0.00 23.12 19.64 1oe0 s ALA 94 CO 0.30 -0.80 1.21 -2.14 0.00 0.00 0.00 175.76 174.33 1oe0 s PRO 95 N 0.40 3.97 -0.06 0.00 0.02 -1.26 -4.99 135.00 133.07 1oe0 s PRO 95 Ca 0.66 1.93 -0.30 0.00 0.02 0.00 0.00 61.00 63.30 1oe0 s PRO 95 Cb -0.44 -2.66 0.09 0.00 0.02 0.00 0.00 34.50 31.51 1oe0 s PRO 95 CO 0.38 -0.42 0.76 -0.08 -0.33 0.00 0.00 177.00 177.31 1oe0 s THR 96 N -1.38 0.00 -0.14 0.99 -1.32 -1.26 -5.06 115.64 107.47 1oe0 s THR 96 Ca 0.58 0.00 -0.02 0.00 -1.21 0.00 0.00 61.69 61.04 1oe0 s THR 96 Cb -0.33 -1.00 -0.24 0.00 -1.51 0.00 0.00 72.50 69.42 1oe0 s THR 96 CO 0.41 0.00 0.28 0.59 -2.21 0.00 0.00 174.62 173.69 1oe0 n ASN 97 N 0.76 1.88 -4.18 8.08 3.02 -1.26 -4.85 115.26 118.71 1oe0 n ASN 97 Ca -0.16 0.16 -0.37 0.00 -0.03 0.00 0.00 54.58 54.18 1oe0 n ASN 97 Cb 0.58 -0.62 0.04 0.00 -0.61 0.00 0.00 39.78 39.16 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 -3.36 0.03 0.06 3.52 5.02 -1.26 -4.89 118.16 117.28 1oe0 n LYS 98 Ca -0.33 0.02 0.12 0.00 -2.02 0.00 0.00 58.31 56.10 1oe0 n LYS 98 Cb 1.04 -1.16 0.23 0.00 -0.02 0.00 0.00 35.03 35.13 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 1.48 0.26 -4.33 1.97 5.02 -1.25 -4.70 118.16 116.61 1oe0 n LYS 99 Ca 0.04 0.10 -0.18 0.00 -2.02 0.00 0.00 58.31 56.25 1oe0 n LYS 99 Cb 0.52 -1.69 -0.14 0.00 -0.02 0.00 0.00 35.03 33.69 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 -4.18 2.07 -0.06 -0.35 2.96 -1.26 -3.14 118.68 114.73 1oe0 s LEU 100 Ca 0.08 -0.26 0.01 0.00 -0.22 0.00 0.00 54.13 53.73 1oe0 s LEU 100 Cb 0.14 -0.45 0.02 0.00 0.50 0.00 0.00 46.19 46.39 1oe0 s LEU 100 CO 0.69 0.06 -0.05 -0.75 -1.32 0.00 0.00 176.35 174.98 1oe0 s LYS 101 N -0.54 0.98 -0.09 1.98 2.20 -0.18 -0.68 119.74 123.42 1oe0 s LYS 101 Ca 0.02 -0.12 0.03 0.00 -0.36 0.00 0.00 55.97 55.53 1oe0 s LYS 101 Cb -0.05 -1.03 0.01 0.00 -1.51 0.00 0.00 37.83 35.25 1oe0 s LYS 101 CO 0.00 -0.13 -0.17 0.42 -0.36 0.00 0.00 175.35 175.11 1oe0 s ILE 102 N 1.17 1.58 0.08 5.43 1.01 -0.53 0.24 121.20 130.19 1oe0 s ILE 102 Ca -0.07 -0.73 0.10 0.00 0.00 0.00 0.00 60.65 59.95 1oe0 s ILE 102 Cb -0.14 -1.41 -0.03 0.00 0.01 0.00 0.00 42.46 40.89 1oe0 s ILE 102 CO -0.01 0.46 -0.25 -0.04 0.00 0.00 0.00 174.94 175.09 1oe0 s MET 103 N 0.65 1.53 -0.26 2.79 -1.94 -0.04 -1.88 119.30 120.16 1oe0 s MET 103 Ca -0.14 -1.19 -0.18 0.00 -1.71 0.00 0.00 55.69 52.47 1oe0 s MET 103 Cb -0.16 -1.84 -0.03 0.00 2.01 0.00 0.00 34.83 34.81 1oe0 s MET 103 CO 0.04 0.46 0.54 -2.00 -0.01 0.00 0.00 175.02 174.04 1oe0 s GLU 104 N -1.61 4.08 0.13 2.03 2.12 -0.62 0.06 118.70 124.89 1oe0 s GLU 104 Ca 0.12 0.37 0.00 0.00 0.36 0.00 0.00 54.97 55.82 1oe0 s GLU 104 Cb -0.10 -3.65 0.00 0.00 0.26 0.00 0.00 34.13 30.64 1oe0 s GLU 104 CO 0.04 -0.37 0.00 0.54 -0.54 0.00 0.00 175.26 174.93 1oe0 n ARG 105 N 5.58 -1.09 -3.79 4.30 5.12 -0.11 -4.77 116.66 121.89 1oe0 n ARG 105 Ca -0.03 0.74 -0.03 0.00 -1.93 0.00 0.00 57.85 56.59 1oe0 n ARG 105 Cb 0.50 -1.33 -0.00 0.00 -1.16 0.00 0.00 32.46 30.47 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 -4.28 -0.11 0.49 0.55 1.04 -1.26 -4.61 113.70 105.51 1oe0 s SER 106 Ca 0.00 -0.51 0.24 0.00 0.48 0.00 0.00 55.95 56.16 1oe0 s SER 106 Cb 0.00 0.50 1.26 0.00 0.10 0.00 0.00 66.02 67.88 1oe0 s SER 106 CO 0.00 -0.95 2.00 -0.29 0.98 0.00 0.00 173.24 174.98 1oe0 h ILE 107 N 2.00 0.69 -0.41 -1.02 2.10 -1.93 -3.06 117.51 115.87 1oe0 h ILE 107 Ca -0.26 -0.71 -0.15 0.00 1.08 0.00 0.00 64.86 64.82 1oe0 h ILE 107 Cb 1.23 1.45 -0.01 0.00 -1.09 0.00 0.00 36.82 38.39 1oe0 h ILE 107 CO 0.29 0.17 -0.33 -0.26 -1.08 0.00 0.00 178.15 176.94 1oe0 h PHE 108 N 0.00 1.13 0.00 2.19 -1.00 -1.99 -1.97 116.94 115.29 1oe0 h PHE 108 Ca -0.00 -0.32 -0.13 0.00 2.81 0.00 0.00 57.97 60.33 1oe0 h PHE 108 Cb 0.43 -0.24 -0.02 0.00 3.61 0.00 0.00 35.95 39.73 1oe0 h PHE 108 CO 0.00 1.15 -0.61 0.66 -1.61 0.00 0.00 178.31 177.89 1oe0 h SER 109 N 0.78 0.00 -0.44 2.17 4.64 -1.94 0.13 113.55 118.89 1oe0 h SER 109 Ca 0.08 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.34 1oe0 h SER 109 Cb 0.92 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.00 1oe0 h SER 109 CO 0.09 0.61 0.05 0.00 -0.87 0.00 0.00 176.83 176.71 1oe0 h ALA 110 N 1.39 0.58 0.24 5.18 0.00 -1.43 -1.81 119.26 123.40 1oe0 h ALA 110 Ca -0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1oe0 h ALA 110 Cb 1.13 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1oe0 h ALA 110 CO 0.08 0.32 -0.11 -0.09 0.00 0.00 0.00 179.25 179.45 1oe0 h ARG 111 N 0.59 -0.31 0.00 0.00 2.43 -1.15 0.68 114.38 116.63 1oe0 h ARG 111 Ca 0.13 0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.25 1oe0 h ARG 111 Cb 0.41 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 1oe0 h ARG 111 CO 0.01 -0.12 -0.33 1.88 -1.51 0.00 0.00 179.97 179.90 1oe0 h TYR 112 N -1.06 0.00 0.00 2.20 0.99 -0.86 -2.92 116.97 115.32 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 0.33 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.05 1oe0 h TYR 112 CO 0.02 0.33 -0.65 0.00 -0.00 0.00 0.00 178.16 177.86 1oe0 h PHE 114 N -0.60 0.12 -0.49 0.00 -1.00 -1.45 -1.62 116.94 111.90 1oe0 h PHE 114 Ca -0.01 -0.05 -0.03 0.00 2.81 0.00 0.00 57.97 60.68 1oe0 h PHE 114 Cb 0.63 -0.02 -0.02 0.00 3.61 0.00 0.00 35.95 40.15 1oe0 h PHE 114 CO -0.25 0.72 0.19 0.28 -1.61 0.00 0.00 178.31 177.64 1oe0 h VAL 115 N -0.51 1.21 -0.34 -0.55 2.07 -0.93 -1.04 116.25 116.16 1oe0 h VAL 115 Ca -0.00 -0.67 0.01 0.00 0.82 0.00 0.00 66.70 66.86 1oe0 h VAL 115 Cb 0.73 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 1oe0 h VAL 115 CO 0.02 0.25 0.22 -0.08 0.02 0.00 0.00 177.57 177.99 1oe0 h GLU 116 N 0.65 0.43 -0.52 1.57 4.57 -1.60 -1.02 114.58 118.67 1oe0 h GLU 116 Ca 0.16 -0.03 -0.06 0.00 -1.18 0.00 0.00 59.36 58.26 1oe0 h GLU 116 Cb 0.20 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.67 1oe0 h GLU 116 CO -0.01 0.29 0.10 -0.97 -1.18 0.00 0.00 179.01 177.23 1oe0 h ASN 117 N 0.45 0.76 0.71 1.04 -1.24 -1.10 -1.70 115.58 114.51 1oe0 h ASN 117 Ca 0.13 -0.15 -0.05 0.00 0.71 0.00 0.00 56.30 56.94 1oe0 h ASN 117 Cb -0.03 -0.20 -0.01 0.00 0.73 0.00 0.00 38.32 38.81 1oe0 h ASN 117 CO -0.04 0.77 -0.25 0.24 -1.29 0.00 0.00 177.43 176.86 1oe0 h MET 118 N 0.78 0.00 -0.10 6.67 2.86 -0.78 -1.05 114.93 123.31 1oe0 h MET 118 Ca 0.17 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.71 1oe0 h MET 118 Cb 0.33 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1oe0 h MET 118 CO 0.00 0.25 -0.30 -0.09 1.06 0.00 0.00 176.91 177.83 1oe0 h ARG 119 N 0.00 0.38 -0.88 1.72 2.43 -0.41 -1.20 114.38 116.41 1oe0 h ARG 119 Ca -0.00 -0.28 -0.02 0.00 -0.81 0.00 0.00 59.98 58.87 1oe0 h ARG 119 Cb 0.68 0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 30.23 1oe0 h ARG 119 CO 0.03 0.90 0.46 0.00 -1.51 0.00 0.00 179.97 179.85 1oe0 h ARG 120 N -0.07 1.24 -0.21 0.20 3.08 -0.86 -2.72 114.38 115.05 1oe0 h ARG 120 Ca -0.01 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1oe0 h ARG 120 Cb 0.92 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.74 1oe0 h ARG 120 CO 0.06 0.92 0.00 0.27 -1.07 0.00 0.00 179.97 180.16 1oe0 n ASN 121 N -4.33 1.43 0.00 7.04 2.04 -0.44 -4.91 115.26 116.09 1oe0 n ASN 121 Ca 0.09 -1.81 0.00 0.00 -0.44 0.00 0.00 54.58 52.42 1oe0 n ASN 121 Cb 0.11 -0.13 0.00 0.00 -2.53 0.00 0.00 39.78 37.23 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 1.01 0.94 0.33 4.83 0.00 -1.03 -4.91 105.19 106.36 1oe0 n GLY 122 Ca 0.13 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 0.79 -3.62 1.61 0.02 -1.52 -3.38 113.55 107.45 1oe0 h SER 123 Ca 0.00 -0.06 -0.68 0.00 -0.84 0.00 0.00 61.79 60.20 1oe0 h SER 123 Cb 0.00 -0.20 -0.27 0.00 0.14 0.00 0.00 62.40 62.07 1oe0 h SER 123 CO 0.00 0.65 -0.61 -0.76 -1.14 0.00 0.00 176.83 174.97 1oe0 s LEU 124 N -9.63 4.03 0.82 5.07 1.43 -0.56 -3.88 118.68 115.96 1oe0 s LEU 124 Ca -0.10 -0.83 -0.12 0.00 -1.03 0.00 0.00 54.13 52.05 1oe0 s LEU 124 Cb 0.17 -1.89 0.09 0.00 0.03 0.00 0.00 46.19 44.59 1oe0 s LEU 124 CO 0.78 -0.24 1.16 -1.61 0.23 0.00 0.00 176.35 176.68 1oe0 s GLU 125 N 1.48 1.63 0.31 1.70 0.41 -1.26 -4.60 118.70 118.37 1oe0 s GLU 125 Ca 0.02 1.57 0.05 0.00 -0.41 0.00 0.00 54.97 56.20 1oe0 s GLU 125 Cb -0.18 -1.79 0.70 0.00 -1.78 0.00 0.00 34.13 31.08 1oe0 s GLU 125 CO 0.03 -2.18 1.82 0.37 -0.49 0.00 0.00 175.26 174.81 1oe0 h GLN 126 N -1.16 0.80 -0.32 1.61 4.15 -1.95 -0.70 115.11 117.54 1oe0 h GLN 126 Ca -0.45 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 58.90 1oe0 h GLN 126 Cb 1.27 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 28.76 1oe0 h GLN 126 CO 0.46 0.53 0.08 0.78 -1.93 0.00 0.00 178.83 178.75 1oe0 h GLY 127 N 0.83 0.49 0.99 2.39 0.00 -2.00 -0.90 103.07 104.87 1oe0 h GLY 127 Ca 0.51 -0.25 -0.18 0.00 0.00 0.00 0.00 47.33 47.42 1oe0 h GLY 127 CO -0.29 0.23 -0.61 -0.33 0.00 0.00 0.00 176.54 175.55 1oe0 h MET 128 N 0.46 0.63 -0.31 4.80 2.86 -1.50 -2.64 114.93 119.22 1oe0 h MET 128 Ca 0.11 -0.51 0.02 0.00 -2.06 0.00 0.00 59.70 57.25 1oe0 h MET 128 Cb 0.18 0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 1oe0 h MET 128 CO -0.00 1.13 0.16 -0.92 1.06 0.00 0.00 176.91 178.34 1oe0 h TYR 129 N 0.28 0.30 -0.67 -0.22 3.20 -0.95 -1.69 116.97 117.22 1oe0 h TYR 129 Ca -0.04 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 1oe0 h TYR 129 Cb 1.25 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 39.40 1oe0 h TYR 129 CO 0.10 0.17 0.37 -0.91 -1.64 0.00 0.00 178.16 176.25 1oe0 h ASN 130 N 0.33 0.82 -0.12 -2.11 2.35 -1.21 0.11 115.58 115.77 1oe0 h ASN 130 Ca 0.13 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1oe0 h ASN 130 Cb 0.03 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.19 1oe0 h ASN 130 CO -0.08 0.67 0.07 0.74 -1.65 0.00 0.00 177.43 177.18 1oe0 h THR 131 N 0.91 1.02 -0.35 2.81 2.02 -1.17 0.17 112.91 118.31 1oe0 h THR 131 Ca 0.24 -0.05 0.01 0.00 0.77 0.00 0.00 66.41 67.37 1oe0 h THR 131 Cb 0.02 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 1oe0 h THR 131 CO -0.04 0.03 0.22 -0.07 0.37 0.00 0.00 175.52 176.03 1oe0 h LEU 132 N 0.14 0.38 -0.88 2.58 3.38 -1.03 -1.63 115.31 118.25 1oe0 h LEU 132 Ca 0.04 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1oe0 h LEU 132 Cb -0.01 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1oe0 h LEU 132 CO -0.02 0.27 0.56 -0.33 0.09 0.00 0.00 178.44 179.01 1oe0 h GLU 133 N 0.46 1.18 -0.24 1.13 4.39 -0.61 -0.69 114.58 120.21 1oe0 h GLU 133 Ca 0.13 -0.09 -0.05 0.00 0.34 0.00 0.00 59.36 59.69 1oe0 h GLU 133 Cb -0.03 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.35 1oe0 h GLU 133 CO -0.04 0.81 -0.09 0.93 -1.16 0.00 0.00 179.01 179.45 1oe0 h GLU 134 N 1.21 0.38 -0.22 2.33 4.39 -0.33 -1.10 114.58 121.24 1oe0 h GLU 134 Ca 0.32 -0.09 -0.05 0.00 0.34 0.00 0.00 59.36 59.88 1oe0 h GLU 134 Cb -0.09 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.50 1oe0 h GLU 134 CO -0.06 0.48 -0.04 -1.49 -1.16 0.00 0.00 179.01 176.73 1oe0 h TRP 135 N 0.36 0.46 -0.90 4.33 4.06 -0.35 -1.97 115.95 121.95 1oe0 h TRP 135 Ca 0.07 -0.10 0.06 0.00 2.06 0.00 0.00 58.89 60.99 1oe0 h TRP 135 Cb 0.39 -0.11 -0.06 0.00 -1.00 0.00 0.00 29.16 28.37 1oe0 h TRP 135 CO 0.01 0.64 0.56 1.88 -3.56 0.00 0.00 178.44 177.98 1oe0 h TYR 136 N 0.14 1.05 -0.20 0.49 0.99 -0.63 0.37 116.97 119.18 1oe0 h TYR 136 Ca 0.06 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.80 1oe0 h TYR 136 Cb 0.49 -0.34 -0.01 0.00 1.00 0.00 0.00 36.73 37.87 1oe0 h TYR 136 CO 0.05 0.53 0.07 0.87 -0.00 0.00 0.00 178.16 179.69 1oe0 h LYS 137 N 1.03 0.30 -0.37 4.88 1.57 -1.09 -1.23 116.57 121.66 1oe0 h LYS 137 Ca 0.39 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 59.09 1oe0 h LYS 137 Cb 0.17 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1oe0 h LYS 137 CO -0.17 0.37 0.15 0.35 -0.57 0.00 0.00 179.45 179.58 1oe0 h PHE 138 N 0.16 0.51 -0.39 -1.35 3.57 -0.87 -2.54 116.94 116.03 1oe0 h PHE 138 Ca 0.07 -0.01 -0.13 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 0.40 -0.29 0.82 -2.23 0.00 0.00 178.31 177.01 1oe0 h ILE 139 N 0.52 1.28 -0.08 1.41 2.04 -0.47 -1.29 117.51 120.91 1oe0 h ILE 139 Ca 0.13 -1.44 -0.00 0.00 1.00 0.00 0.00 64.86 64.55 1oe0 h ILE 139 Cb 0.10 1.28 -0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1oe0 h ILE 139 CO -0.01 0.48 0.05 -0.33 0.00 0.00 0.00 178.15 178.34 1oe0 h GLU 140 N 0.71 0.11 0.00 2.37 5.08 -0.81 -0.92 114.58 121.13 1oe0 h GLU 140 Ca 0.08 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.34 1oe0 h GLU 140 Cb 0.84 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 1oe0 h GLU 140 CO 0.07 0.08 -1.48 0.39 -1.00 0.00 0.00 179.01 177.08 1oe0 n GLU 141 N -4.52 0.63 -0.00 2.33 1.02 -1.07 -4.48 120.64 114.55 1oe0 n GLU 141 Ca -0.02 0.09 0.06 0.00 -0.02 0.00 0.00 57.16 57.27 1oe0 n GLU 141 Cb 0.09 -1.73 -0.08 0.00 -0.02 0.00 0.00 31.44 29.69 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 -2.68 1.50 -4.07 1.62 3.41 -0.51 -4.73 113.62 108.16 1oe0 n SER 142 Ca -0.07 -0.32 -0.21 0.00 -0.26 0.00 0.00 58.87 58.01 1oe0 n SER 142 Cb 0.72 1.33 -0.15 0.00 -0.26 0.00 0.00 64.21 65.85 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 -2.56 0.93 -0.18 -1.33 1.01 -0.37 -1.50 121.20 117.20 1oe0 s ILE 143 Ca -0.01 -0.50 -0.22 0.00 0.00 0.00 0.00 60.65 59.91 1oe0 s ILE 143 Cb 0.08 -0.77 -0.02 0.00 0.01 0.00 0.00 42.46 41.76 1oe0 s ILE 143 CO 0.51 0.26 0.70 -2.28 0.00 0.00 0.00 174.94 174.13 1oe0 s HIS 144 N -0.28 3.41 -0.35 3.97 5.65 -0.65 -4.60 115.29 122.43 1oe0 s HIS 144 Ca 0.04 1.06 0.02 0.00 0.25 0.00 0.00 55.06 56.44 1oe0 s HIS 144 Cb -0.05 -2.87 0.10 0.00 -1.18 0.00 0.00 32.58 28.59 1oe0 s HIS 144 CO -0.00 -0.17 0.08 0.08 -0.65 0.00 0.00 174.74 174.07 1oe0 s VAL 145 N 1.90 2.52 -0.03 0.89 1.01 -1.26 -4.67 120.40 120.75 1oe0 s VAL 145 Ca 0.32 -2.23 -0.30 0.00 0.00 0.00 0.00 61.98 59.78 1oe0 s VAL 145 Cb -0.16 -2.80 -0.06 0.00 0.00 0.00 0.00 36.38 33.36 1oe0 s VAL 145 CO 0.12 -0.58 1.63 -1.58 0.00 0.00 0.00 175.10 174.68 1oe0 s GLN 146 N 0.97 4.19 -0.30 2.72 2.00 -1.26 -4.97 119.66 123.00 1oe0 s GLN 146 Ca 0.09 2.19 -0.01 0.00 -2.00 0.00 0.00 55.36 55.63 1oe0 s GLN 146 Cb -0.20 -3.90 0.13 0.00 0.80 0.00 0.00 33.01 29.83 1oe0 s GLN 146 CO -0.07 -0.81 0.24 0.00 -0.50 0.00 0.00 175.29 174.16 1oe0 s ALA 147 N 3.73 0.01 -0.24 1.58 0.00 -1.26 -4.78 121.76 120.81 1oe0 s ALA 147 Ca 0.73 -0.78 -0.08 0.00 0.00 0.00 0.00 51.96 51.83 1oe0 s ALA 147 Cb -0.34 -1.68 -0.17 0.00 0.00 0.00 0.00 23.12 20.93 1oe0 s ALA 147 CO 0.30 -1.78 -0.12 -0.25 0.00 0.00 0.00 175.76 173.91 1oe0 n ASP 148 N 5.05 1.98 -3.90 0.00 8.00 -0.53 -4.93 116.55 122.23 1oe0 n ASP 148 Ca -0.00 0.15 -0.11 0.00 0.71 0.00 0.00 54.79 55.53 1oe0 n ASP 148 Cb 0.44 -0.69 -0.12 0.00 -0.02 0.00 0.00 41.12 40.73 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 -7.10 1.94 -0.14 0.64 2.96 -0.87 -3.97 118.68 112.14 1oe0 s LEU 149 Ca -0.33 -0.16 0.01 0.00 -0.22 0.00 0.00 54.13 53.42 1oe0 s LEU 149 Cb 0.10 0.21 0.02 0.00 0.50 0.00 0.00 46.19 47.02 1oe0 s LEU 149 CO 0.59 -0.17 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.67 1oe0 s ILE 150 N -0.71 1.63 -0.37 6.68 1.01 -0.57 -0.04 121.20 128.82 1oe0 s ILE 150 Ca -0.08 -0.68 -0.14 0.00 0.00 0.00 0.00 60.65 59.75 1oe0 s ILE 150 Cb -0.05 -1.51 -0.00 0.00 0.01 0.00 0.00 42.46 40.91 1oe0 s ILE 150 CO -0.00 0.47 0.30 -0.63 0.00 0.00 0.00 174.94 175.08 1oe0 s ILE 151 N 1.33 5.24 -0.44 2.92 1.01 0.50 -1.05 121.20 130.70 1oe0 s ILE 151 Ca 0.02 -0.31 -0.18 0.00 0.00 0.00 0.00 60.65 60.18 1oe0 s ILE 151 Cb -0.13 -3.83 0.03 0.00 0.01 0.00 0.00 42.46 38.54 1oe0 s ILE 151 CO -0.09 -0.16 0.50 -0.47 0.00 0.00 0.00 174.94 174.73 1oe0 s TYR 152 N 1.81 3.14 -1.03 3.97 5.04 -0.01 -1.14 117.35 129.13 1oe0 s TYR 152 Ca 0.07 -0.39 -0.21 0.00 -2.44 0.00 0.00 57.07 54.10 1oe0 s TYR 152 Cb -0.18 -3.09 0.07 0.00 0.35 0.00 0.00 41.96 39.11 1oe0 s TYR 152 CO 0.11 -0.79 1.41 -0.51 -1.34 0.00 0.00 175.55 174.43 1oe0 s LEU 153 N 2.30 3.87 0.01 6.97 1.43 0.08 -0.97 118.68 132.37 1oe0 s LEU 153 Ca 0.14 -1.70 -0.30 0.00 -1.03 0.00 0.00 54.13 51.24 1oe0 s LEU 153 Cb -0.17 -2.53 -0.05 0.00 0.03 0.00 0.00 46.19 43.46 1oe0 s LEU 153 CO 0.14 -1.37 1.26 -0.60 0.23 0.00 0.00 176.35 176.01 1oe0 s ARG 154 N 4.38 4.36 0.31 1.70 3.52 0.20 -4.37 118.95 129.05 1oe0 s ARG 154 Ca 0.44 1.81 0.05 0.00 -0.13 0.00 0.00 55.73 57.90 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 -0.42 0.28 0.95 -0.81 0.00 0.00 175.30 175.22 1oe0 s THR 155 N 1.80 0.00 -0.01 4.11 -4.23 -1.26 -0.35 115.64 115.70 1oe0 s THR 155 Ca 0.59 -1.96 -0.01 0.00 -1.18 0.00 0.00 61.69 59.13 1oe0 s THR 155 Cb -0.29 -2.51 -0.04 0.00 1.34 0.00 0.00 72.50 71.00 1oe0 s THR 155 CO 0.26 0.00 0.11 -0.94 -0.54 0.00 0.00 174.62 173.52 1oe0 s SER 156 N -3.33 5.92 0.35 3.99 1.04 -1.26 -5.00 113.70 115.41 1oe0 s SER 156 Ca 0.40 0.22 0.13 0.00 0.48 0.00 0.00 55.95 57.18 1oe0 s SER 156 Cb 0.03 -1.76 0.97 0.00 0.10 0.00 0.00 66.02 65.36 1oe0 s SER 156 CO 0.25 0.27 1.74 -0.65 0.98 0.00 0.00 173.24 175.83 1oe0 h PRO 157 N 4.04 0.49 -0.34 4.02 0.11 -1.96 -1.15 132.00 137.20 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 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1oe0 h PRO 157 CO 0.64 0.32 0.13 0.93 -0.21 0.00 0.00 178.00 179.82 1oe0 h GLU 158 N 0.50 0.51 -0.28 1.05 3.07 -1.94 0.13 114.58 117.62 1oe0 h GLU 158 Ca 0.63 -0.10 -0.01 0.00 -0.50 0.00 0.00 59.36 59.39 1oe0 h GLU 158 Cb 1.36 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 29.17 1oe0 h GLU 158 CO -0.42 0.51 0.15 0.28 -1.40 0.00 0.00 179.01 178.14 1oe0 h VAL 159 N 0.40 1.12 -0.65 3.13 2.07 -1.65 -1.99 116.25 118.69 1oe0 h VAL 159 Ca 0.11 -0.32 0.05 0.00 0.82 0.00 0.00 66.70 67.36 1oe0 h VAL 159 Cb 0.19 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 30.74 1oe0 h VAL 159 CO -0.01 0.12 0.36 0.00 0.02 0.00 0.00 177.57 178.07 1oe0 h ALA 160 N 1.03 0.87 -0.83 1.67 0.00 -1.11 -1.27 119.26 119.62 1oe0 h ALA 160 Ca 0.10 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1oe0 h ALA 160 Cb 0.06 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1oe0 h ALA 160 CO -0.02 0.05 0.55 -0.92 0.00 0.00 0.00 179.25 178.91 1oe0 h TYR 161 N 0.68 1.04 0.15 0.00 3.20 -0.40 -1.46 116.97 120.18 1oe0 h TYR 161 Ca 0.29 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.18 1oe0 h TYR 161 Cb 0.16 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 38.08 1oe0 h TYR 161 CO -0.08 0.65 -0.07 0.93 -1.64 0.00 0.00 178.16 177.95 1oe0 h GLU 162 N 1.12 -0.19 -0.64 1.82 5.08 -0.51 -2.63 114.58 118.63 1oe0 h GLU 162 Ca 0.30 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1oe0 h GLU 162 Cb -0.12 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1oe0 h GLU 162 CO -0.07 0.02 0.40 0.00 -1.00 0.00 0.00 179.01 178.36 1oe0 h ARG 163 N -0.38 0.85 0.76 2.33 3.08 -1.13 -1.77 114.38 118.11 1oe0 h ARG 163 Ca -0.02 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.93 1oe0 h ARG 163 Cb 0.30 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1oe0 h ARG 163 CO 0.03 0.58 -0.40 0.82 -1.07 0.00 0.00 179.97 179.93 1oe0 h ILE 164 N 0.87 0.18 -0.50 2.04 2.04 -1.14 -1.95 117.51 119.04 1oe0 h ILE 164 Ca 0.23 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.17 1oe0 h ILE 164 Cb -0.07 0.18 -0.10 0.00 -0.74 0.00 0.00 36.82 36.10 1oe0 h ILE 164 CO -0.05 0.00 -0.46 0.03 0.00 0.00 0.00 178.15 177.68 1oe0 h ARG 165 N -1.07 -0.28 -0.98 2.37 2.47 -1.32 -0.84 114.38 114.74 1oe0 h ARG 165 Ca -0.10 0.02 0.15 0.00 -1.26 0.00 0.00 59.98 58.79 1oe0 h ARG 165 Cb 0.84 0.06 -0.09 0.00 -1.65 0.00 0.00 29.97 29.13 1oe0 h ARG 165 CO 0.14 -0.18 0.61 1.96 0.56 0.00 0.00 179.97 183.06 1oe0 h GLN 166 N -0.29 0.81 -0.21 0.04 4.20 -1.20 0.92 115.11 119.39 1oe0 h GLN 166 Ca 0.15 -0.05 -0.15 0.00 0.06 0.00 0.00 58.65 58.65 1oe0 h GLN 166 Cb 0.57 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 1oe0 h GLN 166 CO -0.64 0.54 -0.51 -0.09 -0.67 0.00 0.00 178.83 177.46 1oe0 h ARG 167 N 0.83 0.58 -5.89 1.46 2.43 -0.59 -3.48 114.38 109.72 1oe0 h ARG 167 Ca 0.51 -0.34 -0.39 0.00 -0.81 0.00 0.00 59.98 58.95 1oe0 h ARG 167 Cb 0.70 0.03 0.11 0.00 -0.42 0.00 0.00 29.97 30.39 1oe0 h ARG 167 CO -0.28 0.95 -0.76 0.00 -1.51 0.00 0.00 179.97 178.36 1oe0 n ALA 168 N -2.52 -1.76 -2.18 2.80 0.00 0.32 -4.95 120.51 112.22 1oe0 n ALA 168 Ca -0.03 0.06 -0.42 0.00 0.00 0.00 0.00 53.44 53.05 1oe0 n ALA 168 Cb 0.58 -3.30 -0.03 0.00 0.00 0.00 0.00 19.45 16.71 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 -5.90 4.29 0.32 0.00 0.52 -1.26 -4.88 118.95 112.03 1oe0 s ARG 169 Ca 0.22 2.03 0.07 0.00 -0.52 0.00 0.00 55.73 57.53 1oe0 s ARG 169 Cb -0.10 -3.48 0.78 0.00 0.52 0.00 0.00 34.95 32.66 1oe0 s ARG 169 CO 0.76 -0.55 1.79 0.66 0.02 0.00 0.00 175.30 177.99 1oe0 h SER 170 N 7.58 0.74 0.10 0.23 4.64 -1.99 -1.03 113.55 123.82 1oe0 h SER 170 Ca -0.40 0.09 -0.04 0.00 -0.47 0.00 0.00 61.79 60.97 1oe0 h SER 170 Cb 1.19 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 1oe0 h SER 170 CO 0.89 0.27 -0.15 -0.33 -0.87 0.00 0.00 176.83 176.65 1oe0 h GLU 171 N 0.73 0.11 -0.22 4.77 3.07 -1.96 -2.71 114.58 118.37 1oe0 h GLU 171 Ca 0.56 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.40 1oe0 h GLU 171 Cb 0.92 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.82 1oe0 h GLU 171 CO -0.34 0.26 0.00 0.39 -1.40 0.00 0.00 179.01 177.92 1oe0 n GLU 172 N -4.31 1.87 0.27 2.33 1.02 -0.40 -4.45 120.64 116.97 1oe0 n GLU 172 Ca -0.02 -1.31 0.18 0.00 -0.02 0.00 0.00 57.16 55.99 1oe0 n GLU 172 Cb 0.25 -1.40 0.94 0.00 -0.02 0.00 0.00 31.44 31.20 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 2.57 0.00 -0.30 1.62 4.64 -1.34 -2.36 113.55 118.39 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 -1.19 3.35 0.58 0.00 1.01 -0.89 -4.98 120.40 118.28 1oe0 s VAL 175 Ca 0.28 0.38 -0.14 0.00 0.00 0.00 0.00 61.98 62.50 1oe0 s VAL 175 Cb 0.16 -3.39 -0.05 0.00 0.00 0.00 0.00 36.38 33.10 1oe0 s VAL 175 CO 0.23 -0.20 1.02 -2.16 0.00 0.00 0.00 175.10 173.99 1oe0 s PRO 176 N 5.37 3.62 0.42 2.72 0.04 -1.26 -4.97 135.00 140.95 1oe0 s PRO 176 Ca 0.84 0.92 0.09 0.00 0.04 0.00 0.00 61.00 62.89 1oe0 s PRO 176 Cb -0.29 -2.09 0.92 0.00 0.04 0.00 0.00 34.50 33.08 1oe0 s PRO 176 CO 0.34 -0.54 2.06 1.25 0.04 0.00 0.00 177.00 180.14 1oe0 h LEU 177 N 0.23 0.42 -0.97 -3.56 5.85 -1.97 -2.31 115.31 113.01 1oe0 h LEU 177 Ca -0.45 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.26 1oe0 h LEU 177 Cb 1.19 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 42.07 1oe0 h LEU 177 CO 0.61 0.30 0.64 0.11 -0.34 0.00 0.00 178.44 179.75 1oe0 h LYS 178 N 0.49 1.28 -0.45 1.25 1.57 -1.99 -0.84 116.57 117.87 1oe0 h LYS 178 Ca 0.15 -0.08 0.03 0.00 -1.87 0.00 0.00 60.65 58.88 1oe0 h LYS 178 Cb 0.00 -0.29 -0.03 0.00 0.08 0.00 0.00 32.23 31.99 1oe0 h LYS 178 CO -0.03 0.85 0.25 -0.92 -0.57 0.00 0.00 179.45 179.03 1oe0 h TYR 179 N 1.31 0.47 -0.06 -1.35 3.20 -1.80 0.12 116.97 118.86 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 -0.15 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 37.97 1oe0 h TYR 179 CO -0.00 0.26 -0.33 -0.07 -1.64 0.00 0.00 178.16 176.37 1oe0 h LEU 180 N 0.51 0.12 -0.31 2.82 3.38 -1.33 -1.21 115.31 119.28 1oe0 h LEU 180 Ca 0.19 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.98 1oe0 h LEU 180 Cb 0.05 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1oe0 h LEU 180 CO -0.10 0.45 -0.34 1.56 0.09 0.00 0.00 178.44 180.10 1oe0 h GLN 181 N 0.11 0.78 -0.35 1.13 4.20 -0.21 0.30 115.11 121.06 1oe0 h GLN 181 Ca 0.01 -0.42 -0.01 0.00 0.06 0.00 0.00 58.65 58.29 1oe0 h GLN 181 Cb 0.64 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 1oe0 h GLN 181 CO 0.05 1.05 0.17 0.93 -0.67 0.00 0.00 178.83 180.36 1oe0 h GLU 182 N 0.55 0.50 -0.71 1.46 5.08 -0.38 -1.77 114.58 119.32 1oe0 h GLU 182 Ca 0.05 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 1oe0 h GLU 182 Cb 0.92 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.05 1oe0 h GLU 182 CO 0.08 0.45 0.24 -0.07 -1.00 0.00 0.00 179.01 178.72 1oe0 h LEU 183 N 0.43 1.01 0.35 1.33 3.38 -1.16 -2.21 115.31 118.44 1oe0 h LEU 183 Ca 0.12 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1oe0 h LEU 183 Cb 0.11 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1oe0 h LEU 183 CO -0.02 0.92 -0.29 -0.74 0.09 0.00 0.00 178.44 178.41 1oe0 h HIS 184 N 1.05 -0.77 -0.77 1.13 2.76 -0.51 -0.55 115.15 117.49 1oe0 h HIS 184 Ca 0.23 0.00 0.12 0.00 -2.20 0.00 0.00 60.37 58.52 1oe0 h HIS 184 Cb 0.26 0.29 -0.08 0.00 1.55 0.00 0.00 27.41 29.43 1oe0 h HIS 184 CO 0.02 -0.43 0.38 0.93 -1.30 0.00 0.00 177.93 177.54 1oe0 h GLU 185 N -0.65 0.58 -0.64 5.26 4.39 -1.18 0.75 114.58 123.10 1oe0 h GLU 185 Ca -0.03 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 1oe0 h GLU 185 Cb 0.57 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 29.06 1oe0 h GLU 185 CO -0.02 0.39 0.32 -0.07 -1.16 0.00 0.00 179.01 178.46 1oe0 h LEU 186 N 0.60 0.80 -0.43 1.33 3.38 -0.98 0.19 115.31 120.21 1oe0 h LEU 186 Ca 0.40 -0.08 -0.16 0.00 0.09 0.00 0.00 57.88 58.13 1oe0 h LEU 186 Cb 0.50 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1oe0 h LEU 186 CO -0.32 0.67 -0.42 0.45 0.09 0.00 0.00 178.44 178.91 1oe0 h HIS 187 N 0.89 1.03 0.33 1.13 3.86 0.27 -2.57 115.15 120.10 1oe0 h HIS 187 Ca 0.22 -0.32 -0.01 0.00 -1.16 0.00 0.00 60.37 59.10 1oe0 h HIS 187 Cb 0.08 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.33 1oe0 h HIS 187 CO 0.01 1.13 -0.17 0.93 0.86 0.00 0.00 177.93 180.69 1oe0 h GLU 188 N 0.69 -0.44 -1.00 2.45 4.39 -0.08 0.59 114.58 121.18 1oe0 h GLU 188 Ca 0.05 0.03 0.13 0.00 0.34 0.00 0.00 59.36 59.91 1oe0 h GLU 188 Cb 1.00 0.10 -0.09 0.00 -0.10 0.00 0.00 28.75 29.67 1oe0 h GLU 188 CO 0.10 -0.29 0.63 -0.44 -1.16 0.00 0.00 179.01 177.84 1oe0 h ASP 189 N -0.46 0.89 0.02 1.42 3.32 -0.62 0.46 116.42 121.45 1oe0 h ASP 189 Ca -0.04 0.06 -0.06 0.00 0.02 0.00 0.00 57.03 57.01 1oe0 h ASP 189 Cb 0.36 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 1oe0 h ASP 189 CO 0.07 0.45 -0.28 -0.25 -1.72 0.00 0.00 179.24 177.50 1oe0 h TRP 190 N 0.94 0.07 0.00 4.55 7.01 -1.29 0.57 115.95 127.80 1oe0 h TRP 190 Ca 0.51 -0.05 -0.10 0.00 2.11 0.00 0.00 58.89 61.35 1oe0 h TRP 190 Cb 0.58 -0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.62 1oe0 h TRP 190 CO -0.00 1.11 -0.97 -0.07 -2.79 0.00 0.00 178.44 175.72 1oe0 h LEU 191 N -0.92 0.00 0.00 0.65 3.38 -0.85 -3.26 115.31 114.31 1oe0 h LEU 191 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1oe0 h LEU 191 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1oe0 h LEU 191 CO -0.01 0.40 -0.40 -0.38 0.09 0.00 0.00 178.44 178.14 1oe0 n ILE 192 N -2.96 0.86 0.21 1.22 5.41 0.08 -4.71 119.36 119.47 1oe0 n ILE 192 Ca -0.03 0.27 0.08 0.00 1.00 0.00 0.00 62.75 64.07 1oe0 n ILE 192 Cb 0.73 -1.79 0.37 0.00 -0.71 0.00 0.00 39.64 38.24 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 -0.40 0.00 -5.48 1.39 3.86 -1.44 -3.49 115.15 109.60 1oe0 h HIS 193 Ca 0.00 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 1oe0 h HIS 193 Cb 0.40 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.87 1oe0 h HIS 193 CO -0.17 0.28 -0.11 1.04 0.86 0.00 0.00 177.93 179.83 1oe0 n GLN 194 N -3.39 -1.36 -0.50 2.45 6.02 0.17 -4.94 117.38 115.83 1oe0 n GLN 194 Ca 0.00 1.42 0.08 0.00 -0.01 0.00 0.00 57.00 58.49 1oe0 n GLN 194 Cb 0.48 -5.50 0.28 0.00 1.02 0.00 0.00 30.24 26.52 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 -1.89 3.36 -3.87 -1.09 1.74 0.38 -4.93 116.66 110.36 1oe0 n ARG 195 Ca -0.03 -2.76 -0.12 0.00 -0.77 0.00 0.00 57.85 54.17 1oe0 n ARG 195 Cb 0.52 -1.82 -0.14 0.00 -1.02 0.00 0.00 32.46 30.00 1oe0 n ARG 195 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1oe0 s ARG 196 N -2.35 0.03 -0.18 5.56 1.81 -1.26 -4.99 118.95 117.57 1oe0 s ARG 196 Ca 0.42 -0.01 -0.31 0.00 -1.72 0.00 0.00 55.73 54.11 1oe0 s ARG 196 Cb 0.31 0.01 -0.09 0.00 -0.45 0.00 0.00 34.95 34.74 1oe0 s ARG 196 CO 0.14 -0.00 2.10 -2.30 -0.68 0.00 0.00 175.30 174.55 1oe0 n PRO 197 N 3.01 1.94 -2.54 3.54 -0.02 -1.26 -4.79 135.00 134.87 1oe0 n PRO 197 Ca -0.13 0.61 -0.04 0.00 -2.02 0.00 0.00 63.50 61.93 1oe0 n PRO 197 Cb 0.60 -2.89 0.10 0.00 -0.02 0.00 0.00 33.50 31.29 1oe0 n PRO 197 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oe0 n GLN 198 N 7.95 1.02 -1.36 -0.52 -0.00 -1.26 -5.09 117.38 118.12 1oe0 n GLN 198 Ca 0.29 -1.22 -0.12 0.00 -0.00 0.00 0.00 57.00 55.96 1oe0 n GLN 198 Cb 0.35 0.17 -0.11 0.00 -0.00 0.00 0.00 30.24 30.66 1oe0 n GLN 198 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 1oe0 n SER 199 N -0.94 -0.56 -3.37 2.61 3.41 -1.26 -4.73 113.62 108.77 1oe0 n SER 199 Ca -0.12 -1.36 -0.03 0.00 -0.26 0.00 0.00 58.87 57.10 1oe0 n SER 199 Cb 0.80 -0.98 0.02 0.00 -0.26 0.00 0.00 64.21 63.79 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 -2.09 4.52 -0.09 0.00 -0.14 -1.25 -5.01 119.74 115.67 1oe0 s LYS 201 Ca 0.23 1.16 0.04 0.00 -1.36 0.00 0.00 55.97 56.04 1oe0 s LYS 201 Cb -0.03 -3.43 -0.00 0.00 -1.68 0.00 0.00 37.83 32.69 1oe0 s LYS 201 CO 0.05 0.09 -0.24 0.08 -0.76 0.00 0.00 175.35 174.57 1oe0 s VAL 202 N 0.61 2.06 -0.28 3.17 1.01 -1.26 -1.52 120.40 124.20 1oe0 s VAL 202 Ca 0.44 -1.03 -0.04 0.00 0.00 0.00 0.00 61.98 61.34 1oe0 s VAL 202 Cb -0.20 -1.77 0.02 0.00 0.00 0.00 0.00 36.38 34.43 1oe0 s VAL 202 CO 0.24 0.56 0.02 -0.22 0.00 0.00 0.00 175.10 175.70 1oe0 s LEU 203 N 0.22 3.64 -0.04 3.92 2.96 -0.22 -4.99 118.68 124.18 1oe0 s LEU 203 Ca -0.15 -0.86 -0.21 0.00 -0.22 0.00 0.00 54.13 52.68 1oe0 s LEU 203 Cb -0.17 -1.78 -0.05 0.00 0.50 0.00 0.00 46.19 44.69 1oe0 s LEU 203 CO 0.08 -0.19 0.61 -0.69 -1.32 0.00 0.00 176.35 174.84 1oe0 s VAL 204 N 1.40 5.00 -0.05 1.68 1.01 -1.26 -0.83 120.40 127.35 1oe0 s VAL 204 Ca 0.00 1.26 0.04 0.00 0.00 0.00 0.00 61.98 63.28 1oe0 s VAL 204 Cb -0.17 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.26 1oe0 s VAL 204 CO -0.01 0.35 -0.16 -0.76 0.00 0.00 0.00 175.10 174.52 1oe0 s LEU 205 N 0.28 1.87 -0.60 3.92 1.02 -0.14 -4.95 118.68 120.07 1oe0 s LEU 205 Ca 0.32 -0.35 -0.27 0.00 0.02 0.00 0.00 54.13 53.85 1oe0 s LEU 205 Cb -0.18 -0.95 0.01 0.00 0.02 0.00 0.00 46.19 45.09 1oe0 s LEU 205 CO 0.16 0.12 1.48 -0.62 0.02 0.00 0.00 176.35 177.52 1oe0 s ASP 206 N 0.20 5.97 -0.20 2.29 -1.08 -1.26 -0.63 116.67 121.95 1oe0 s ASP 206 Ca -0.07 0.17 0.05 0.00 -0.52 0.00 0.00 52.55 52.18 1oe0 s ASP 206 Cb -0.13 -2.55 0.43 0.00 -1.46 0.00 0.00 42.92 39.22 1oe0 s ASP 206 CO 0.03 -1.86 1.39 0.00 0.52 0.00 0.00 175.17 175.24 1oe0 n ALA 207 N 10.15 3.83 -0.81 3.66 0.00 0.53 -4.10 120.51 133.77 1oe0 n ALA 207 Ca 0.12 -1.41 -0.20 0.00 0.00 0.00 0.00 53.44 51.96 1oe0 n ALA 207 Cb 0.50 -1.17 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 -0.06 5.71 -3.09 0.00 8.00 -1.26 -4.83 116.55 121.02 1oe0 n ASP 208 Ca 0.26 -3.18 -0.11 0.00 0.71 0.00 0.00 54.79 52.47 1oe0 n ASP 208 Cb 1.00 -0.93 0.05 0.00 -0.02 0.00 0.00 41.12 41.22 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 -0.18 -5.65 0.00 0.64 4.77 -1.26 -5.14 117.00 110.18 1oe0 n LEU 209 Ca 0.39 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1oe0 n LEU 209 Cb 0.81 -3.06 0.00 0.00 -2.33 0.00 0.00 43.42 38.84 1oe0 n LEU 209 CO 0.46 -0.17 0.00 -3.20 -1.33 0.00 0.00 177.39 173.15