#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oh3 s ALA 5 N 0.00 3.31 -0.19 2.89 0.00 -1.26 -5.00 121.76 121.51 1oh3 s ALA 5 Ca 0.00 -0.56 -0.10 0.00 0.00 0.00 0.00 51.96 51.30 1oh3 s ALA 5 Cb 0.00 -2.65 -0.05 0.00 0.00 0.00 0.00 23.12 20.42 1oh3 s ALA 5 CO 0.00 -0.62 0.12 0.99 0.00 0.00 0.00 175.76 176.25 1oh3 s THR 6 N -2.92 5.36 -0.11 0.00 2.01 -1.26 -4.93 115.64 113.79 1oh3 s THR 6 Ca 0.52 0.17 -0.02 0.00 0.31 0.00 0.00 61.69 62.66 1oh3 s THR 6 Cb -0.10 -3.44 -0.03 0.00 0.01 0.00 0.00 72.50 68.94 1oh3 s THR 6 CO 0.46 0.45 -0.02 -0.31 -0.69 0.00 0.00 174.62 174.51 1oh3 s TYR 7 N 0.27 3.08 -0.24 4.92 1.51 -1.26 -1.71 117.35 123.93 1oh3 s TYR 7 Ca 0.08 0.02 0.01 0.00 -1.01 0.00 0.00 57.07 56.17 1oh3 s TYR 7 Cb -0.11 -1.84 0.06 0.00 -0.11 0.00 0.00 41.96 39.96 1oh3 s TYR 7 CO -0.01 0.28 -0.08 0.99 -1.11 0.00 0.00 175.55 175.62 1oh3 s THR 8 N -0.44 1.75 -0.31 -0.71 2.01 0.32 -4.99 115.64 113.27 1oh3 s THR 8 Ca 0.07 -1.33 -0.29 0.00 0.31 0.00 0.00 61.69 60.46 1oh3 s THR 8 Cb -0.12 -1.94 0.01 0.00 0.01 0.00 0.00 72.50 70.46 1oh3 s THR 8 CO 0.02 -0.05 1.18 -0.69 -0.69 0.00 0.00 174.62 174.40 1oh3 s VAL 9 N 1.30 4.32 -0.18 3.82 1.01 -1.26 -0.92 120.40 128.50 1oh3 s VAL 9 Ca -0.06 1.51 -0.23 0.00 0.00 0.00 0.00 61.98 63.19 1oh3 s VAL 9 Cb -0.19 -4.30 -0.20 0.00 0.00 0.00 0.00 36.38 31.69 1oh3 s VAL 9 CO -0.06 -0.49 0.40 0.40 0.00 0.00 0.00 175.10 175.34 1oh3 h ILE 10 N 5.85 1.17 -2.69 2.22 2.04 -0.97 -3.47 117.51 121.66 1oh3 h ILE 10 Ca -0.23 -2.15 -0.10 0.00 1.00 0.00 0.00 64.86 63.38 1oh3 h ILE 10 Cb 1.08 2.49 -0.21 0.00 -0.74 0.00 0.00 36.82 39.44 1oh3 h ILE 10 CO 1.04 0.40 -0.14 0.72 0.00 0.00 0.00 178.15 180.17 1oh3 s PHE 11 N -2.28 -0.37 0.00 1.37 -0.71 -0.97 -4.70 117.98 110.32 1oh3 s PHE 11 Ca -0.24 0.69 0.00 0.00 -1.04 0.00 0.00 56.93 56.34 1oh3 s PHE 11 Cb 0.02 0.19 0.00 0.00 -1.21 0.00 0.00 43.02 42.02 1oh3 s PHE 11 CO 0.59 -0.41 0.00 1.63 -1.34 0.00 0.00 175.22 175.69 1oh3 n LYS 12 N 1.51 0.00 -3.75 1.99 5.02 -1.26 -0.46 118.16 121.21 1oh3 n LYS 12 Ca -0.19 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.73 1oh3 n LYS 12 Cb 0.56 -0.04 -0.11 0.00 -0.02 0.00 0.00 35.03 35.42 1oh3 n LYS 12 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1oh3 s ASN 13 N -1.00 5.31 -0.06 4.39 0.01 -1.26 -1.98 114.94 120.34 1oh3 s ASN 13 Ca 0.00 -2.05 -0.30 0.00 -0.71 0.00 0.00 52.86 49.80 1oh3 s ASN 13 Cb 0.00 -1.85 -0.03 0.00 0.41 0.00 0.00 41.25 39.78 1oh3 s ASN 13 CO 0.00 -0.56 1.22 0.00 -1.51 0.00 0.00 177.10 176.25 1oh3 s ALA 14 N 1.12 3.52 -2.49 0.60 0.00 -1.09 -4.87 121.76 118.54 1oh3 s ALA 14 Ca 0.08 0.62 0.24 0.00 0.00 0.00 0.00 51.96 52.90 1oh3 s ALA 14 Cb -0.23 -3.53 0.19 0.00 0.00 0.00 0.00 23.12 19.55 1oh3 s ALA 14 CO -0.04 -0.81 1.23 -1.13 0.00 0.00 0.00 175.76 175.01 1oh3 n SER 15 N 5.35 2.39 0.00 0.00 3.41 -1.26 -4.26 113.62 119.24 1oh3 n SER 15 Ca 0.11 -1.70 0.00 0.00 -0.26 0.00 0.00 58.87 57.02 1oh3 n SER 15 Cb 0.46 0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.62 1oh3 n SER 15 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oh3 n GLY 16 N 1.37 -1.31 3.69 5.00 0.00 -1.26 -4.83 105.19 107.85 1oh3 n GLY 16 Ca 0.12 -1.01 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 1oh3 n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1oh3 n LEU 17 N 0.00 3.47 -4.76 0.99 4.77 -1.26 -4.89 117.00 115.33 1oh3 n LEU 17 Ca 0.00 1.17 -0.38 0.00 -0.03 0.00 0.00 56.01 56.77 1oh3 n LEU 17 Cb 0.00 -1.48 0.03 0.00 -2.33 0.00 0.00 43.42 39.64 1oh3 n LEU 17 CO 0.00 -0.40 0.96 -2.16 -1.33 0.00 0.00 177.39 174.46 1oh3 s PRO 18 N -1.09 3.38 0.21 3.23 0.04 -1.26 -4.93 135.00 134.57 1oh3 s PRO 18 Ca 0.62 2.16 -0.32 0.00 0.04 0.00 0.00 61.00 63.49 1oh3 s PRO 18 Cb -0.59 -2.36 -0.13 0.00 0.04 0.00 0.00 34.50 31.45 1oh3 s PRO 18 CO 0.55 -0.98 1.56 -1.71 0.04 0.00 0.00 177.00 176.46 1oh3 n ASN 19 N -0.75 3.24 0.00 6.66 5.15 -1.26 -1.94 115.26 126.36 1oh3 n ASN 19 Ca 0.09 1.10 0.00 0.00 -0.60 0.00 0.00 54.58 55.17 1oh3 n ASN 19 Cb 0.45 -1.47 0.00 0.00 -0.53 0.00 0.00 39.78 38.23 1oh3 n ASN 19 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1oh3 n GLY 20 N 2.97 0.75 3.13 8.20 0.00 -1.26 -5.04 105.19 113.94 1oh3 n GLY 20 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 1oh3 n GLY 20 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oh3 s TYR 21 N -2.55 1.11 0.39 1.61 1.51 -0.82 -1.42 117.35 117.18 1oh3 s TYR 21 Ca 0.00 -0.36 0.08 0.00 -1.01 0.00 0.00 57.07 55.77 1oh3 s TYR 21 Cb 0.00 -0.66 -0.06 0.00 -0.11 0.00 0.00 41.96 41.13 1oh3 s TYR 21 CO 0.00 0.02 0.07 -0.51 -1.11 0.00 0.00 175.55 174.03 1oh3 s ASP 22 N -1.19 4.16 -0.33 2.29 1.11 -0.10 -4.66 116.67 117.95 1oh3 s ASP 22 Ca -0.00 -1.17 -0.06 0.00 0.18 0.00 0.00 52.55 51.50 1oh3 s ASP 22 Cb -0.08 -0.46 0.04 0.00 1.07 0.00 0.00 42.92 43.49 1oh3 s ASP 22 CO 0.01 -0.43 0.09 0.21 1.18 0.00 0.00 175.17 176.23 1oh3 s ASN 23 N -3.79 5.23 -0.35 0.27 2.47 -1.26 -0.73 114.94 116.79 1oh3 s ASN 23 Ca 0.37 -1.10 0.09 0.00 0.42 0.00 0.00 52.86 52.64 1oh3 s ASN 23 Cb 0.05 -1.85 0.72 0.00 -1.45 0.00 0.00 41.25 38.72 1oh3 s ASN 23 CO 0.20 -0.30 1.82 0.79 -3.72 0.00 0.00 177.10 175.89 1oh3 n TRP 24 N 4.80 2.53 -1.04 0.43 7.02 0.52 -4.93 117.44 126.76 1oh3 n TRP 24 Ca -0.13 -1.36 -0.06 0.00 -1.02 0.00 0.00 57.50 54.93 1oh3 n TRP 24 Cb 0.45 -0.74 0.04 0.00 -2.42 0.00 0.00 31.31 28.65 1oh3 n TRP 24 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1oh3 n GLY 25 N -0.43 -1.52 3.47 6.99 0.00 -1.25 -4.66 105.19 107.80 1oh3 n GLY 25 Ca 0.45 -1.62 -0.14 0.00 0.00 0.00 0.00 46.02 44.70 1oh3 n GLY 25 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1oh3 s TRP 26 N -1.52 -0.57 -0.99 1.61 -2.14 -0.49 -4.91 118.94 109.94 1oh3 s TRP 26 Ca 0.14 0.66 0.00 0.00 2.66 0.00 0.00 56.10 59.56 1oh3 s TRP 26 Cb -0.01 0.49 0.00 0.00 -3.10 0.00 0.00 33.47 30.86 1oh3 s TRP 26 CO 0.10 -0.71 0.00 0.41 -2.66 0.00 0.00 176.95 174.09 1oh3 n GLY 27 N 0.20 0.99 3.11 3.67 0.00 -1.26 -0.84 105.19 111.06 1oh3 n GLY 27 Ca -0.17 -0.59 -0.10 0.00 0.00 0.00 0.00 46.02 45.15 1oh3 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oh3 s THR 29 N -2.92 3.96 -0.00 0.00 -4.23 -0.58 -4.96 115.64 106.91 1oh3 s THR 29 Ca 0.03 -1.05 0.06 0.00 -1.18 0.00 0.00 61.69 59.55 1oh3 s THR 29 Cb 0.01 -2.90 -0.02 0.00 1.34 0.00 0.00 72.50 70.93 1oh3 s THR 29 CO -0.04 0.09 -0.18 -0.76 -0.54 0.00 0.00 174.62 173.19 1oh3 s LEU 30 N -2.37 2.06 0.18 4.79 1.02 -1.26 -0.56 118.68 122.53 1oh3 s LEU 30 Ca 0.26 -0.37 -0.01 0.00 0.02 0.00 0.00 54.13 54.04 1oh3 s LEU 30 Cb -0.11 -0.92 -0.04 0.00 0.02 0.00 0.00 46.19 45.14 1oh3 s LEU 30 CO 0.18 0.20 0.09 -0.94 0.02 0.00 0.00 176.35 175.90 1oh3 s SER 31 N -0.59 0.38 -0.25 2.29 1.04 -0.70 -5.00 113.70 110.86 1oh3 s SER 31 Ca 0.07 -1.31 -0.04 0.00 0.48 0.00 0.00 55.95 55.15 1oh3 s SER 31 Cb -0.07 0.31 0.09 0.00 0.10 0.00 0.00 66.02 66.44 1oh3 s SER 31 CO -0.00 -0.77 0.11 -0.31 0.98 0.00 0.00 173.24 173.25 1oh3 s TYR 32 N -4.05 0.41 -0.00 5.02 1.51 -1.26 -0.77 117.35 118.21 1oh3 s TYR 32 Ca 0.32 -0.77 -0.03 0.00 -1.01 0.00 0.00 57.07 55.59 1oh3 s TYR 32 Cb 0.07 -0.90 -0.01 0.00 -0.11 0.00 0.00 41.96 41.02 1oh3 s TYR 32 CO 0.08 -0.73 0.05 0.71 -1.11 0.00 0.00 175.55 174.55 1oh3 s TYR 33 N 2.07 0.09 -1.67 2.71 2.02 -1.10 -4.88 117.35 116.59 1oh3 s TYR 33 Ca 0.07 -0.18 0.00 0.00 -0.37 0.00 0.00 57.07 56.59 1oh3 s TYR 33 Cb -0.16 -0.08 0.00 0.00 -0.40 0.00 0.00 41.96 41.32 1oh3 s TYR 33 CO -0.27 -0.16 0.00 0.41 -1.57 0.00 0.00 175.55 173.96 1oh3 n GLY 34 N 2.07 0.03 2.27 0.71 0.00 -1.26 -1.78 105.19 107.23 1oh3 n GLY 34 Ca -0.20 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1oh3 n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oh3 n GLY 35 N -0.95 0.74 3.69 -0.02 0.00 -1.26 -5.02 105.19 102.36 1oh3 n GLY 35 Ca -0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 1oh3 n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oh3 s ALA 36 N -2.86 3.29 -0.31 4.61 0.00 -0.73 -2.69 121.76 123.06 1oh3 s ALA 36 Ca 0.00 -1.19 -0.23 0.00 0.00 0.00 0.00 51.96 50.54 1oh3 s ALA 36 Cb 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 23.12 21.96 1oh3 s ALA 36 CO 0.00 0.63 0.76 1.41 0.00 0.00 0.00 175.76 178.56 1oh3 s MET 37 N -2.55 3.92 -0.29 0.00 1.75 -0.04 -2.70 119.30 119.39 1oh3 s MET 37 Ca 0.27 0.50 -0.08 0.00 -1.25 0.00 0.00 55.69 55.12 1oh3 s MET 37 Cb -0.11 -3.74 -0.00 0.00 2.84 0.00 0.00 34.83 33.82 1oh3 s MET 37 CO 0.19 -0.68 0.11 0.42 -0.65 0.00 0.00 175.02 174.40 1oh3 s ILE 38 N 2.92 4.29 -0.21 10.11 1.01 0.05 -1.09 121.20 138.28 1oh3 s ILE 38 Ca 0.31 -0.50 -0.09 0.00 0.00 0.00 0.00 60.65 60.37 1oh3 s ILE 38 Cb -0.14 -3.17 -0.04 0.00 0.01 0.00 0.00 42.46 39.12 1oh3 s ILE 38 CO 0.13 0.11 0.11 -0.63 0.00 0.00 0.00 174.94 174.66 1oh3 s ILE 39 N 1.57 5.04 -0.71 2.92 1.01 0.12 -1.73 121.20 129.41 1oh3 s ILE 39 Ca 0.04 0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.75 1oh3 s ILE 39 Cb -0.17 -3.31 0.18 0.00 0.01 0.00 0.00 42.46 39.17 1oh3 s ILE 39 CO 0.04 0.41 0.54 0.21 0.00 0.00 0.00 174.94 176.14 1oh3 s ASN 40 N 0.69 5.26 0.65 3.58 3.04 0.27 -1.78 114.94 126.65 1oh3 s ASN 40 Ca 0.06 -3.38 -0.15 0.00 0.04 0.00 0.00 52.86 49.42 1oh3 s ASN 40 Cb -0.13 -1.79 -0.01 0.00 -1.54 0.00 0.00 41.25 37.78 1oh3 s ASN 40 CO 0.01 -0.23 1.11 -2.84 -3.04 0.00 0.00 177.10 172.11 1oh3 s PRO 41 N -0.82 2.87 -0.09 0.43 0.02 -1.26 -1.53 135.00 134.63 1oh3 s PRO 41 Ca 0.22 1.38 -0.05 0.00 0.02 0.00 0.00 61.00 62.57 1oh3 s PRO 41 Cb -0.14 -1.96 -0.04 0.00 0.02 0.00 0.00 34.50 32.39 1oh3 s PRO 41 CO -0.09 -1.19 0.12 -0.65 -0.33 0.00 0.00 177.00 174.87 1oh3 s GLN 42 N -4.06 3.35 0.12 5.54 -1.52 0.37 -4.32 119.66 119.12 1oh3 s GLN 42 Ca 0.67 -0.23 -0.34 0.00 -1.95 0.00 0.00 55.36 53.50 1oh3 s GLN 42 Cb -0.20 -3.09 -0.14 0.00 -0.22 0.00 0.00 33.01 29.35 1oh3 s GLN 42 CO 0.40 0.74 1.57 -1.91 -0.25 0.00 0.00 175.29 175.85 1oh3 n GLU 43 N 1.74 1.98 -0.18 2.91 0.00 -1.26 -2.17 120.64 123.66 1oh3 n GLU 43 Ca -0.18 0.71 0.00 0.00 0.00 0.00 0.00 57.16 57.70 1oh3 n GLU 43 Cb 0.54 -2.47 0.00 0.00 0.00 0.00 0.00 31.44 29.51 1oh3 n GLU 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1oh3 n GLY 44 N 3.39 1.63 0.09 8.31 0.00 0.16 -4.89 105.19 113.87 1oh3 n GLY 44 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 1oh3 n GLY 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1oh3 n LYS 45 N -2.00 0.59 -3.80 1.61 4.76 -0.92 -4.96 118.16 113.44 1oh3 n LYS 45 Ca 0.00 0.05 -0.24 0.00 -2.87 0.00 0.00 58.31 55.25 1oh3 n LYS 45 Cb 0.00 -1.75 0.02 0.00 -1.84 0.00 0.00 35.03 31.46 1oh3 n LYS 45 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1oh3 n TYR 46 N -2.54 -1.90 -1.72 2.13 4.01 -1.26 -4.89 117.16 110.99 1oh3 n TYR 46 Ca -0.01 0.83 -0.34 0.00 -0.16 0.00 0.00 57.90 58.22 1oh3 n TYR 46 Cb 0.55 -4.16 0.06 0.00 -0.31 0.00 0.00 39.34 35.48 1oh3 n TYR 46 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1oh3 s GLY 47 N -4.20 2.40 0.03 2.72 0.00 -1.26 -4.57 107.32 102.44 1oh3 s GLY 47 Ca 0.11 0.81 -0.09 0.00 0.00 0.00 0.00 44.72 45.54 1oh3 s GLY 47 CO 0.83 1.19 0.19 0.00 0.00 0.00 0.00 173.10 175.32 1oh3 s ALA 48 N -1.98 -0.38 -0.06 3.20 0.00 -0.02 -0.52 121.76 121.99 1oh3 s ALA 48 Ca 0.73 -0.20 -0.16 0.00 0.00 0.00 0.00 51.96 52.32 1oh3 s ALA 48 Cb -0.27 0.22 -0.05 0.00 0.00 0.00 0.00 23.12 23.03 1oh3 s ALA 48 CO 0.40 -0.32 0.42 0.08 0.00 0.00 0.00 175.76 176.35 1oh3 s VAL 49 N -2.19 5.12 -0.37 0.00 1.01 -0.67 -1.39 120.40 121.90 1oh3 s VAL 49 Ca -0.08 0.85 0.01 0.00 0.00 0.00 0.00 61.98 62.76 1oh3 s VAL 49 Cb -0.03 -3.75 0.11 0.00 0.00 0.00 0.00 36.38 32.72 1oh3 s VAL 49 CO -0.02 0.46 0.15 -0.55 0.00 0.00 0.00 175.10 175.14 1oh3 s SER 50 N -0.22 3.97 -0.24 3.32 0.15 -1.26 -0.96 113.70 118.46 1oh3 s SER 50 Ca 0.24 -2.11 -0.29 0.00 0.70 0.00 0.00 55.95 54.48 1oh3 s SER 50 Cb -0.16 -1.03 -0.01 0.00 -1.71 0.00 0.00 66.02 63.11 1oh3 s SER 50 CO 0.11 -0.35 1.35 -0.76 1.20 0.00 0.00 173.24 174.79 1oh3 s LEU 51 N 1.00 3.98 -0.31 3.45 1.43 0.15 -0.36 118.68 128.04 1oh3 s LEU 51 Ca 0.13 1.45 -0.09 0.00 -1.03 0.00 0.00 54.13 54.59 1oh3 s LEU 51 Cb -0.21 -3.54 -0.00 0.00 0.03 0.00 0.00 46.19 42.47 1oh3 s LEU 51 CO -0.12 -1.01 0.13 -0.75 0.23 0.00 0.00 176.35 174.83 1oh3 s LYS 52 N 4.05 3.27 0.01 1.70 2.47 0.09 -0.96 119.74 130.37 1oh3 s LYS 52 Ca 0.59 -0.76 -0.30 0.00 -1.56 0.00 0.00 55.97 53.94 1oh3 s LYS 52 Cb -0.20 -3.51 -0.07 0.00 -1.46 0.00 0.00 37.83 32.60 1oh3 s LYS 52 CO 0.22 -0.42 1.57 0.50 0.16 0.00 0.00 175.35 177.38 1oh3 s ARG 53 N 1.58 4.22 0.35 4.03 3.52 0.33 -0.92 118.95 132.06 1oh3 s ARG 53 Ca 0.04 2.18 0.17 0.00 -0.13 0.00 0.00 55.73 57.99 1oh3 s ARG 53 Cb -0.17 -3.71 0.55 0.00 -1.56 0.00 0.00 34.95 30.06 1oh3 s ARG 53 CO 0.05 -0.72 1.67 -0.91 -0.81 0.00 0.00 175.30 174.58 1oh3 h ASN 54 N 8.53 0.00 -3.34 -2.12 2.35 -1.57 -3.43 115.58 116.01 1oh3 h ASN 54 Ca -0.40 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.09 1oh3 h ASN 54 Cb 1.19 0.00 -0.33 0.00 0.05 0.00 0.00 38.32 39.23 1oh3 h ASN 54 CO 0.93 0.42 -0.61 -0.55 -1.65 0.00 0.00 177.43 175.97 1oh3 s SER 55 N -6.47 0.13 0.00 5.81 0.15 -1.26 -5.12 113.70 106.94 1oh3 s SER 55 Ca 0.01 0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.96 1oh3 s SER 55 Cb 0.10 0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 1oh3 s SER 55 CO 0.70 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.58 1oh3 n GLY 56 N 4.51 -0.58 3.09 9.45 0.00 -1.26 -5.06 105.19 115.34 1oh3 n GLY 56 Ca -0.21 -1.74 -0.07 0.00 0.00 0.00 0.00 46.02 44.00 1oh3 n GLY 56 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oh3 s SER 57 N -2.06 0.50 0.32 1.61 0.01 -1.26 -4.75 113.70 108.07 1oh3 s SER 57 Ca 0.00 -0.99 -0.04 0.00 1.31 0.00 0.00 55.95 56.23 1oh3 s SER 57 Cb 0.00 0.20 -0.05 0.00 0.21 0.00 0.00 66.02 66.38 1oh3 s SER 57 CO 0.00 -0.59 0.57 -0.36 0.41 0.00 0.00 173.24 173.27 1oh3 s PHE 58 N -3.87 3.49 -0.11 2.43 0.08 0.19 -4.87 117.98 115.32 1oh3 s PHE 58 Ca 0.07 0.60 -0.00 0.00 0.12 0.00 0.00 56.93 57.71 1oh3 s PHE 58 Cb 0.08 -2.08 0.02 0.00 -0.57 0.00 0.00 43.02 40.47 1oh3 s PHE 58 CO -0.10 0.13 -0.08 1.03 -0.10 0.00 0.00 175.22 176.10 1oh3 s ARG 59 N -3.79 1.57 3.47 0.44 0.52 -1.26 -0.22 118.95 119.68 1oh3 s ARG 59 Ca 0.43 -0.28 0.00 0.00 -0.52 0.00 0.00 55.73 55.37 1oh3 s ARG 59 Cb -0.10 -1.60 0.00 0.00 0.52 0.00 0.00 34.95 33.76 1oh3 s ARG 59 CO 0.32 -0.25 0.00 0.41 0.02 0.00 0.00 175.30 175.80 1oh3 n GLY 60 N 4.88 2.49 7.00 -3.53 0.00 -1.26 -4.85 105.19 109.92 1oh3 n GLY 60 Ca -0.13 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1oh3 n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oh3 n GLY 61 N 0.00 1.65 3.31 -0.02 0.00 -1.25 -4.67 105.19 104.21 1oh3 n GLY 61 Ca 0.00 -0.64 -0.12 0.00 0.00 0.00 0.00 46.02 45.25 1oh3 n GLY 61 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1oh3 s SER 62 N -4.00 -0.26 -0.07 1.61 1.04 -0.02 -1.01 113.70 110.99 1oh3 s SER 62 Ca 0.00 -0.05 0.05 0.00 0.48 0.00 0.00 55.95 56.43 1oh3 s SER 62 Cb 0.00 0.42 -0.01 0.00 0.10 0.00 0.00 66.02 66.53 1oh3 s SER 62 CO 0.00 -0.67 -0.22 -0.76 0.98 0.00 0.00 173.24 172.57 1oh3 s LEU 63 N -2.07 2.23 -0.03 2.42 1.43 -0.29 -0.95 118.68 121.42 1oh3 s LEU 63 Ca -0.05 -0.46 0.07 0.00 -1.03 0.00 0.00 54.13 52.66 1oh3 s LEU 63 Cb -0.01 -1.43 -0.02 0.00 0.03 0.00 0.00 46.19 44.77 1oh3 s LEU 63 CO -0.03 0.23 -0.24 -0.60 0.23 0.00 0.00 176.35 175.93 1oh3 s ARG 64 N -0.05 2.10 0.09 1.70 3.00 0.60 -0.69 118.95 125.70 1oh3 s ARG 64 Ca -0.06 -0.86 -0.26 0.00 -1.00 0.00 0.00 55.73 53.55 1oh3 s ARG 64 Cb -0.15 -1.95 0.08 0.00 0.00 0.00 0.00 34.95 32.94 1oh3 s ARG 64 CO 0.05 0.48 0.77 -0.59 0.00 0.00 0.00 175.30 176.01 1oh3 s PHE 65 N -0.45 -0.39 -0.14 5.12 -0.71 -0.29 -0.80 117.98 120.33 1oh3 s PHE 65 Ca 0.06 0.19 -0.07 0.00 -1.04 0.00 0.00 56.93 56.06 1oh3 s PHE 65 Cb -0.10 0.57 -0.04 0.00 -1.21 0.00 0.00 43.02 42.23 1oh3 s PHE 65 CO 0.00 -0.73 0.11 -0.51 -1.34 0.00 0.00 175.22 172.75 1oh3 s ASP 66 N -2.66 6.13 -0.08 1.98 1.01 0.04 -0.92 116.67 122.18 1oh3 s ASP 66 Ca 0.05 0.34 -0.07 0.00 0.71 0.00 0.00 52.55 53.58 1oh3 s ASP 66 Cb -0.01 -1.99 0.02 0.00 1.01 0.00 0.00 42.92 41.95 1oh3 s ASP 66 CO -0.08 0.34 0.21 -0.32 0.21 0.00 0.00 175.17 175.52 1oh3 s MET 67 N -0.59 0.23 0.16 8.23 1.75 -0.46 -1.36 119.30 127.26 1oh3 s MET 67 Ca 0.12 0.32 0.10 0.00 -1.25 0.00 0.00 55.69 54.98 1oh3 s MET 67 Cb -0.12 0.07 -0.04 0.00 2.84 0.00 0.00 34.83 37.58 1oh3 s MET 67 CO 0.02 -0.06 -0.21 -1.59 -0.65 0.00 0.00 175.02 172.54 1oh3 s LYS 68 N 0.33 1.34 -0.29 4.11 -2.85 -0.92 -1.30 119.74 120.16 1oh3 s LYS 68 Ca -0.02 -1.40 -0.16 0.00 -1.00 0.00 0.00 55.97 53.39 1oh3 s LYS 68 Cb -0.03 -1.54 0.13 0.00 -2.06 0.00 0.00 37.83 34.33 1oh3 s LYS 68 CO -0.01 0.33 0.93 0.54 0.10 0.00 0.00 175.35 177.24 1oh3 s ASN 69 N -2.51 -0.58 0.34 0.03 4.22 -0.64 -0.75 114.94 115.05 1oh3 s ASN 69 Ca 0.16 0.93 0.16 0.00 -2.14 0.00 0.00 52.86 51.97 1oh3 s ASN 69 Cb -0.07 1.24 0.55 0.00 1.28 0.00 0.00 41.25 44.24 1oh3 s ASN 69 CO 0.07 -0.15 1.68 -0.33 -2.04 0.00 0.00 177.10 176.33 1oh3 h GLU 70 N 6.21 0.00 0.00 3.55 5.08 -1.56 -0.95 114.58 126.91 1oh3 h GLU 70 Ca -0.28 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.51 1oh3 h GLU 70 Cb 1.20 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.32 1oh3 h GLU 70 CO 0.19 0.46 -0.48 0.41 -1.00 0.00 0.00 179.01 178.59 1oh3 n GLY 71 N 0.29 3.19 3.77 -3.84 0.00 -1.26 -4.78 105.19 102.56 1oh3 n GLY 71 Ca -0.00 -2.11 -0.41 0.00 0.00 0.00 0.00 46.02 43.49 1oh3 n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oh3 s LYS 72 N -3.60 4.22 -0.12 1.61 1.02 -1.26 -4.04 119.74 117.57 1oh3 s LYS 72 Ca 0.22 2.41 0.02 0.00 0.02 0.00 0.00 55.97 58.64 1oh3 s LYS 72 Cb 0.01 -3.04 0.01 0.00 -0.52 0.00 0.00 37.83 34.30 1oh3 s LYS 72 CO 0.16 -0.42 -0.18 0.08 -0.92 0.00 0.00 175.35 174.07 1oh3 s VAL 73 N -0.75 1.76 -0.14 3.17 1.01 -0.45 -2.88 120.40 122.13 1oh3 s VAL 73 Ca 0.54 -0.80 -0.16 0.00 0.00 0.00 0.00 61.98 61.56 1oh3 s VAL 73 Cb -0.44 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 1oh3 s VAL 73 CO 0.54 0.49 0.38 -0.75 0.00 0.00 0.00 175.10 175.76 1oh3 s LYS 74 N 0.91 4.29 -0.20 2.72 2.20 -0.58 -0.12 119.74 128.96 1oh3 s LYS 74 Ca -0.07 0.27 -0.07 0.00 -0.36 0.00 0.00 55.97 55.74 1oh3 s LYS 74 Cb -0.15 -3.43 -0.03 0.00 -1.51 0.00 0.00 37.83 32.71 1oh3 s LYS 74 CO -0.02 0.21 0.05 0.42 -0.36 0.00 0.00 175.35 175.65 1oh3 s ILE 75 N 0.52 4.47 0.13 5.43 -1.09 0.55 -0.77 121.20 130.43 1oh3 s ILE 75 Ca 0.21 -0.14 0.02 0.00 -2.23 0.00 0.00 60.65 58.52 1oh3 s ILE 75 Cb -0.14 -3.03 -0.04 0.00 -1.58 0.00 0.00 42.46 37.66 1oh3 s ILE 75 CO 0.07 0.42 -0.05 -0.76 -1.23 0.00 0.00 174.94 173.38 1oh3 s LEU 76 N 0.86 2.40 0.16 2.97 1.02 -0.78 -0.42 118.68 124.89 1oh3 s LEU 76 Ca 0.03 -1.05 0.08 0.00 0.02 0.00 0.00 54.13 53.21 1oh3 s LEU 76 Cb -0.14 -0.11 -0.04 0.00 0.02 0.00 0.00 46.19 45.92 1oh3 s LEU 76 CO 0.02 -0.47 -0.18 0.68 0.02 0.00 0.00 176.35 176.42 1oh3 s VAL 77 N -3.59 1.79 0.03 -1.59 -7.23 -0.43 -0.45 120.40 108.93 1oh3 s VAL 77 Ca 0.16 -1.90 0.02 0.00 -1.81 0.00 0.00 61.98 58.45 1oh3 s VAL 77 Cb 0.05 -1.82 -0.02 0.00 0.56 0.00 0.00 36.38 35.15 1oh3 s VAL 77 CO -0.02 -0.32 -0.07 -0.13 -0.31 0.00 0.00 175.10 174.26 1oh3 s ARG 78 N -2.78 0.50 -0.41 4.82 0.52 -0.40 -0.94 118.95 120.27 1oh3 s ARG 78 Ca 0.15 -0.62 -0.17 0.00 -0.52 0.00 0.00 55.73 54.57 1oh3 s ARG 78 Cb -0.06 -0.32 0.02 0.00 0.52 0.00 0.00 34.95 35.11 1oh3 s ARG 78 CO 0.06 0.06 0.44 1.21 0.02 0.00 0.00 175.30 177.10 1oh3 s ASN 79 N -1.24 6.20 0.20 0.23 3.84 -0.40 -1.28 114.94 122.50 1oh3 s ASN 79 Ca -0.07 -0.57 -0.05 0.00 0.21 0.00 0.00 52.86 52.38 1oh3 s ASN 79 Cb -0.08 -2.23 0.14 0.00 -0.55 0.00 0.00 41.25 38.54 1oh3 s ASN 79 CO 0.00 -0.55 1.58 0.28 -2.79 0.00 0.00 177.10 175.62 1oh3 h SER 80 N 8.69 0.77 -0.50 -4.21 0.02 -1.88 -0.76 113.55 115.68 1oh3 h SER 80 Ca -0.27 -0.32 -0.09 0.00 -0.84 0.00 0.00 61.79 60.28 1oh3 h SER 80 Cb 1.11 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.42 1oh3 h SER 80 CO 0.79 1.03 -0.03 -0.33 -1.14 0.00 0.00 176.83 177.15 1oh3 h GLU 81 N 0.62 0.91 0.00 3.45 5.08 -1.97 -2.94 114.58 119.73 1oh3 h GLU 81 Ca 0.07 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1oh3 h GLU 81 Cb 0.85 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.03 1oh3 h GLU 81 CO 0.07 0.95 -0.11 0.00 -1.00 0.00 0.00 179.01 178.93 1oh3 h ALA 82 N 0.92 0.93 -6.22 3.43 0.00 -1.96 -3.47 119.26 112.89 1oh3 h ALA 82 Ca 0.14 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.59 1oh3 h ALA 82 Cb 0.56 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1oh3 h ALA 82 CO 0.03 0.00 -0.75 -3.47 0.00 0.00 0.00 179.25 175.06 1oh3 n ASP 83 N -2.42 -4.73 -4.58 0.00 2.03 -0.32 -5.00 116.55 101.52 1oh3 n ASP 83 Ca 0.05 -0.75 -0.34 0.00 0.52 0.00 0.00 54.79 54.27 1oh3 n ASP 83 Cb 0.45 -4.07 -0.11 0.00 -0.72 0.00 0.00 41.12 36.68 1oh3 n ASP 83 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1oh3 s GLU 84 N -6.52 3.52 0.17 -0.67 0.41 -1.02 -4.99 118.70 109.59 1oh3 s GLU 84 Ca 0.60 -0.45 0.08 0.00 -0.41 0.00 0.00 54.97 54.79 1oh3 s GLU 84 Cb -0.29 -2.94 -0.04 0.00 -1.78 0.00 0.00 34.13 29.08 1oh3 s GLU 84 CO 0.81 0.39 -0.07 0.15 -0.49 0.00 0.00 175.26 176.05 1oh3 s LYS 85 N -0.03 2.15 -0.10 1.61 3.01 -1.26 -1.28 119.74 123.85 1oh3 s LYS 85 Ca 0.03 -1.19 -0.03 0.00 -1.01 0.00 0.00 55.97 53.77 1oh3 s LYS 85 Cb -0.13 -2.23 0.05 0.00 -1.01 0.00 0.00 37.83 34.51 1oh3 s LYS 85 CO 0.02 0.45 0.16 0.12 0.51 0.00 0.00 175.35 176.62 1oh3 s PHE 86 N -1.62 -0.18 -0.28 3.18 2.19 -0.11 -5.00 117.98 116.16 1oh3 s PHE 86 Ca 0.25 0.56 -0.29 0.00 0.33 0.00 0.00 56.93 57.77 1oh3 s PHE 86 Cb -0.09 -0.28 0.01 0.00 -1.31 0.00 0.00 43.02 41.34 1oh3 s PHE 86 CO 0.16 -0.31 1.19 -2.00 1.83 0.00 0.00 175.22 176.09 1oh3 s GLU 87 N 2.29 4.05 -0.12 10.12 2.12 -1.26 -1.31 118.70 134.58 1oh3 s GLU 87 Ca 0.03 1.25 -0.25 0.00 0.36 0.00 0.00 54.97 56.37 1oh3 s GLU 87 Cb -0.12 -3.79 -0.22 0.00 0.26 0.00 0.00 34.13 30.26 1oh3 s GLU 87 CO -0.06 -0.94 0.74 0.28 -0.54 0.00 0.00 175.26 174.74 1oh3 h VAL 88 N 5.77 1.50 -1.52 3.70 2.07 -1.09 -3.49 116.25 123.19 1oh3 h VAL 88 Ca -0.24 -2.00 0.09 0.00 0.82 0.00 0.00 66.70 65.37 1oh3 h VAL 88 Cb 1.08 2.78 -0.23 0.00 -1.52 0.00 0.00 31.29 33.40 1oh3 h VAL 88 CO 1.02 0.49 0.58 -0.70 0.02 0.00 0.00 177.57 178.97 1oh3 s GLU 89 N -2.43 0.55 -0.16 1.57 2.56 -1.14 -5.02 118.70 114.63 1oh3 s GLU 89 Ca -0.16 0.14 -0.04 0.00 0.00 0.00 0.00 54.97 54.91 1oh3 s GLU 89 Cb -0.02 0.26 -0.03 0.00 2.00 0.00 0.00 34.13 36.34 1oh3 s GLU 89 CO 0.60 -0.17 -0.02 0.99 -0.56 0.00 0.00 175.26 176.10 1oh3 s THR 90 N -1.07 3.99 -0.19 -1.70 2.01 -1.26 -0.33 115.64 117.09 1oh3 s THR 90 Ca -0.01 -0.32 -0.05 0.00 0.31 0.00 0.00 61.69 61.62 1oh3 s THR 90 Cb -0.01 -2.76 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 1oh3 s THR 90 CO 0.01 0.49 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.79 1oh3 s ILE 91 N 0.41 3.98 0.70 1.82 1.01 0.83 -4.93 121.20 125.02 1oh3 s ILE 91 Ca -0.03 -0.31 -0.12 0.00 0.00 0.00 0.00 60.65 60.19 1oh3 s ILE 91 Cb -0.14 -2.79 0.02 0.00 0.01 0.00 0.00 42.46 39.56 1oh3 s ILE 91 CO 0.03 0.45 1.07 -0.44 0.00 0.00 0.00 174.94 176.05 1oh3 s SER 92 N 0.79 5.15 0.47 3.58 0.01 -1.26 -1.34 113.70 121.11 1oh3 s SER 92 Ca 0.00 1.74 -0.23 0.00 1.31 0.00 0.00 55.95 58.77 1oh3 s SER 92 Cb -0.14 -2.51 -0.09 0.00 0.21 0.00 0.00 66.02 63.49 1oh3 s SER 92 CO 0.02 -1.60 1.14 -2.65 0.41 0.00 0.00 173.24 170.56 1oh3 n PRO 93 N -3.02 1.52 -3.70 12.44 -0.02 -1.26 -4.86 135.00 136.10 1oh3 n PRO 93 Ca 0.08 0.55 -0.11 0.00 -2.02 0.00 0.00 63.50 62.01 1oh3 n PRO 93 Cb 0.53 -2.26 -0.10 0.00 -0.02 0.00 0.00 33.50 31.65 1oh3 n PRO 93 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1oh3 s SER 94 N -0.77 -0.54 0.00 2.55 0.15 -0.36 -4.99 113.70 109.74 1oh3 s SER 94 Ca 0.66 0.95 0.24 0.00 0.70 0.00 0.00 55.95 58.50 1oh3 s SER 94 Cb -0.50 0.86 0.90 0.00 -1.71 0.00 0.00 66.02 65.58 1oh3 s SER 94 CO 0.55 -0.19 1.65 0.47 1.20 0.00 0.00 173.24 176.92 1oh3 n ASP 95 N 3.89 1.58 -4.21 5.45 8.00 -1.26 -1.62 116.55 128.39 1oh3 n ASP 95 Ca -0.20 -1.60 -0.20 0.00 0.71 0.00 0.00 54.79 53.50 1oh3 n ASP 95 Cb 0.56 -0.05 -0.12 0.00 -0.02 0.00 0.00 41.12 41.49 1oh3 n ASP 95 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1oh3 s GLU 96 N -1.89 0.93 0.29 -1.24 8.01 -1.26 -4.99 118.70 118.55 1oh3 s GLU 96 Ca 0.35 -1.05 -0.30 0.00 0.01 0.00 0.00 54.97 53.98 1oh3 s GLU 96 Cb 0.19 -0.98 -0.12 0.00 -4.31 0.00 0.00 34.13 28.91 1oh3 s GLU 96 CO 0.30 0.22 1.55 0.66 0.01 0.00 0.00 175.26 177.99 1oh3 n TYR 97 N 1.11 2.72 -4.86 1.61 4.01 -1.26 -4.52 117.16 115.97 1oh3 n TYR 97 Ca -0.20 0.30 -0.26 0.00 -0.16 0.00 0.00 57.90 57.59 1oh3 n TYR 97 Cb 0.54 -2.56 -0.16 0.00 -0.31 0.00 0.00 39.34 36.85 1oh3 n TYR 97 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1oh3 s VAL 98 N -0.11 1.45 -0.20 -0.72 1.01 -0.42 -4.91 120.40 116.50 1oh3 s VAL 98 Ca 0.64 -0.75 -0.22 0.00 0.00 0.00 0.00 61.98 61.65 1oh3 s VAL 98 Cb -0.52 -1.23 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 1oh3 s VAL 98 CO 0.50 0.42 0.68 -0.89 0.00 0.00 0.00 175.10 175.80 1oh3 s THR 99 N -0.14 4.98 -0.11 3.92 2.01 -1.26 -1.35 115.64 123.69 1oh3 s THR 99 Ca 0.00 1.28 -0.02 0.00 0.31 0.00 0.00 61.69 63.26 1oh3 s THR 99 Cb -0.10 -3.99 -0.03 0.00 0.01 0.00 0.00 72.50 68.39 1oh3 s THR 99 CO 0.01 0.07 -0.03 -0.31 -0.69 0.00 0.00 174.62 173.68 1oh3 s TYR 100 N 2.10 3.06 -0.22 4.92 2.02 -0.10 -4.98 117.35 124.16 1oh3 s TYR 100 Ca 0.30 -0.00 -0.00 0.00 -0.37 0.00 0.00 57.07 57.00 1oh3 s TYR 100 Cb -0.16 -1.83 0.06 0.00 -0.40 0.00 0.00 41.96 39.63 1oh3 s TYR 100 CO 0.10 0.27 -0.03 0.42 -1.57 0.00 0.00 175.55 174.74 1oh3 s ILE 101 N -0.44 1.26 -0.11 2.71 1.01 -1.26 -1.14 121.20 123.24 1oh3 s ILE 101 Ca 0.07 -1.00 0.03 0.00 0.00 0.00 0.00 60.65 59.75 1oh3 s ILE 101 Cb -0.12 -1.57 0.00 0.00 0.01 0.00 0.00 42.46 40.78 1oh3 s ILE 101 CO 0.02 -0.10 -0.23 -0.76 0.00 0.00 0.00 174.94 173.87 1oh3 s LEU 102 N 1.53 2.12 0.34 2.97 1.43 0.14 -4.86 118.68 122.34 1oh3 s LEU 102 Ca -0.04 -0.56 -0.28 0.00 -1.03 0.00 0.00 54.13 52.21 1oh3 s LEU 102 Cb -0.18 -1.43 -0.10 0.00 0.03 0.00 0.00 46.19 44.51 1oh3 s LEU 102 CO -0.07 0.14 1.31 -1.81 0.23 0.00 0.00 176.35 176.15 1oh3 s ASP 103 N 0.46 6.72 -0.43 2.29 1.01 -1.26 -1.14 116.67 124.31 1oh3 s ASP 103 Ca -0.16 2.69 -0.09 0.00 0.71 0.00 0.00 52.55 55.70 1oh3 s ASP 103 Cb -0.17 -2.65 0.08 0.00 1.01 0.00 0.00 42.92 41.19 1oh3 s ASP 103 CO 0.06 -0.57 0.27 -0.69 0.21 0.00 0.00 175.17 174.45 1oh3 s VAL 104 N -1.16 4.23 -2.19 -1.27 1.01 -0.18 -4.91 120.40 115.93 1oh3 s VAL 104 Ca 0.50 -1.46 0.18 0.00 0.00 0.00 0.00 61.98 61.20 1oh3 s VAL 104 Cb -0.40 -3.62 0.42 0.00 0.00 0.00 0.00 36.38 32.78 1oh3 s VAL 104 CO 0.53 -0.55 1.44 0.47 0.00 0.00 0.00 175.10 176.99 1oh3 n ASP 105 N 4.92 2.00 -4.76 3.32 8.00 -1.26 -3.97 116.55 124.79 1oh3 n ASP 105 Ca -0.10 -1.84 -0.41 0.00 0.71 0.00 0.00 54.79 53.15 1oh3 n ASP 105 Cb 0.43 -0.18 -0.01 0.00 -0.02 0.00 0.00 41.12 41.34 1oh3 n ASP 105 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1oh3 s PHE 106 N -1.65 2.76 -2.40 1.24 5.36 -1.26 -4.92 117.98 117.11 1oh3 s PHE 106 Ca 0.31 1.00 0.22 0.00 -0.96 0.00 0.00 56.93 57.50 1oh3 s PHE 106 Cb 0.17 -3.99 0.66 0.00 -0.34 0.00 0.00 43.02 39.53 1oh3 s PHE 106 CO 0.24 -3.11 1.51 -0.40 -1.46 0.00 0.00 175.22 172.00 1oh3 n ASP 107 N 1.51 2.16 -4.51 6.13 5.75 -1.26 -4.47 116.55 121.86 1oh3 n ASP 107 Ca 0.05 -1.78 -0.25 0.00 -0.01 0.00 0.00 54.79 52.81 1oh3 n ASP 107 Cb 0.39 -0.12 -0.10 0.00 -1.03 0.00 0.00 41.12 40.26 1oh3 n ASP 107 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1oh3 s LEU 108 N -1.62 2.74 0.59 -2.12 1.43 -1.26 -5.07 118.68 113.37 1oh3 s LEU 108 Ca 0.34 -0.86 -0.20 0.00 -1.03 0.00 0.00 54.13 52.38 1oh3 s LEU 108 Cb 0.19 -1.31 -0.03 0.00 0.03 0.00 0.00 46.19 45.06 1oh3 s LEU 108 CO 0.28 0.05 1.28 -2.65 0.23 0.00 0.00 176.35 175.55 1oh3 n PRO 109 N -0.44 1.37 -4.74 1.29 -0.02 -1.26 -4.63 135.00 126.56 1oh3 n PRO 109 Ca -0.07 0.52 -0.24 0.00 -2.02 0.00 0.00 63.50 61.68 1oh3 n PRO 109 Cb 0.59 -2.50 -0.15 0.00 -0.02 0.00 0.00 33.50 31.42 1oh3 n PRO 109 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1oh3 s PHE 110 N -1.35 1.54 0.00 6.00 -0.71 0.69 -4.20 117.98 119.95 1oh3 s PHE 110 Ca 0.76 -0.31 0.00 0.00 -1.04 0.00 0.00 56.93 56.35 1oh3 s PHE 110 Cb -0.41 -0.97 0.00 0.00 -1.21 0.00 0.00 43.02 40.43 1oh3 s PHE 110 CO 0.46 -0.00 0.61 -0.40 -1.34 0.00 0.00 175.22 174.54 1oh3 n ASP 111 N 2.47 1.05 -4.02 1.98 5.75 -0.40 -0.64 116.55 122.74 1oh3 n ASP 111 Ca -0.15 -1.37 -0.20 0.00 -0.01 0.00 0.00 54.79 53.06 1oh3 n ASP 111 Cb 0.54 0.00 -0.15 0.00 -1.03 0.00 0.00 41.12 40.48 1oh3 n ASP 111 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1oh3 s ARG 112 N -0.37 0.88 -0.14 0.11 0.52 -1.02 -0.51 118.95 118.43 1oh3 s ARG 112 Ca 0.00 -0.33 0.01 0.00 -0.52 0.00 0.00 55.73 54.89 1oh3 s ARG 112 Cb 0.00 -0.84 0.02 0.00 0.52 0.00 0.00 34.95 34.65 1oh3 s ARG 112 CO 0.00 0.16 -0.16 0.42 0.02 0.00 0.00 175.30 175.74 1oh3 s ILE 113 N -0.01 1.65 -0.08 1.52 1.01 -0.13 -1.28 121.20 123.87 1oh3 s ILE 113 Ca 0.00 -0.70 -0.01 0.00 0.00 0.00 0.00 60.65 59.94 1oh3 s ILE 113 Cb -0.06 -1.52 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 1oh3 s ILE 113 CO 0.00 0.47 -0.03 -1.81 0.00 0.00 0.00 174.94 173.57 1oh3 s ASP 114 N 1.24 4.98 -0.25 3.58 1.01 0.40 -0.67 116.67 126.96 1oh3 s ASP 114 Ca 0.00 0.07 0.02 0.00 0.71 0.00 0.00 52.55 53.34 1oh3 s ASP 114 Cb -0.14 -1.35 0.06 0.00 1.01 0.00 0.00 42.92 42.50 1oh3 s ASP 114 CO -0.07 0.37 -0.08 -0.36 0.21 0.00 0.00 175.17 175.24 1oh3 s PHE 115 N -0.81 2.78 -0.06 4.23 0.40 -0.13 -1.86 117.98 122.53 1oh3 s PHE 115 Ca 0.12 -2.01 0.04 0.00 -0.60 0.00 0.00 56.93 54.48 1oh3 s PHE 115 Cb -0.11 -1.74 -0.02 0.00 0.51 0.00 0.00 43.02 41.66 1oh3 s PHE 115 CO 0.02 -0.82 -0.16 -1.14 0.70 0.00 0.00 175.22 173.82 1oh3 s GLN 116 N 1.26 2.59 -1.07 0.44 0.74 0.05 -1.68 119.66 122.00 1oh3 s GLN 116 Ca -0.07 -0.73 -0.23 0.00 0.05 0.00 0.00 55.36 54.38 1oh3 s GLN 116 Cb -0.19 -2.36 -0.04 0.00 1.10 0.00 0.00 33.01 31.51 1oh3 s GLN 116 CO -0.06 0.54 1.86 0.34 -0.55 0.00 0.00 175.29 177.43 1oh3 s ASP 117 N -0.53 5.43 0.21 6.67 2.15 0.32 -1.52 116.67 129.41 1oh3 s ASP 117 Ca 0.07 -1.34 -0.10 0.00 0.43 0.00 0.00 52.55 51.61 1oh3 s ASP 117 Cb -0.12 -2.57 0.17 0.00 -0.30 0.00 0.00 42.92 40.10 1oh3 s ASP 117 CO 0.01 -2.57 1.87 0.00 -0.17 0.00 0.00 175.17 174.32 1oh3 h ALA 118 N 10.11 0.95 0.00 3.66 0.00 -1.83 -1.82 119.26 130.34 1oh3 h ALA 118 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1oh3 h ALA 118 Cb 0.97 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1oh3 h ALA 118 CO 1.27 0.34 0.00 -1.35 0.00 0.00 0.00 179.25 179.51 1oh3 h PRO 119 N 0.99 0.00 -0.30 0.00 0.11 -1.90 -3.47 132.00 127.43 1oh3 h PRO 119 Ca 0.28 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.26 1oh3 h PRO 119 Cb -0.08 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 30.98 1oh3 h PRO 119 CO -0.07 0.00 -0.12 0.41 -0.21 0.00 0.00 178.00 178.01 1oh3 n GLY 120 N 0.15 0.86 0.67 -0.55 0.00 -0.68 -4.91 105.19 100.72 1oh3 n GLY 120 Ca 0.01 -0.67 0.10 0.00 0.00 0.00 0.00 46.02 45.46 1oh3 n GLY 120 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1oh3 n ASN 121 N 0.77 2.37 0.00 1.61 5.03 -1.26 0.38 115.26 124.16 1oh3 n ASN 121 Ca -0.06 -1.69 0.00 0.00 0.87 0.00 0.00 54.58 53.70 1oh3 n ASN 121 Cb 0.22 0.20 0.00 0.00 -1.02 0.00 0.00 39.78 39.18 1oh3 n ASN 121 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1oh3 n GLY 122 N 1.24 0.84 3.74 7.41 0.00 -1.26 -4.52 105.19 112.64 1oh3 n GLY 122 Ca 0.10 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1oh3 n GLY 122 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1oh3 s ASP 123 N -2.25 6.38 0.47 1.61 1.01 -1.26 -4.46 116.67 118.17 1oh3 s ASP 123 Ca 0.00 2.92 -0.19 0.00 0.71 0.00 0.00 52.55 55.98 1oh3 s ASP 123 Cb 0.00 -2.62 -0.09 0.00 1.01 0.00 0.00 42.92 41.21 1oh3 s ASP 123 CO 0.00 -0.93 0.99 -0.60 0.21 0.00 0.00 175.17 174.84 1oh3 s ARG 124 N 0.01 4.00 -0.03 8.23 3.52 -1.26 -4.43 118.95 128.99 1oh3 s ARG 124 Ca 0.67 1.15 0.02 0.00 -0.13 0.00 0.00 55.73 57.43 1oh3 s ARG 124 Cb -0.48 -2.14 0.01 0.00 -1.56 0.00 0.00 34.95 30.78 1oh3 s ARG 124 CO 0.43 -0.23 -0.08 0.42 -0.81 0.00 0.00 175.30 175.03 1oh3 s ILE 125 N -2.25 0.70 -0.08 4.11 1.01 -0.74 -1.70 121.20 122.25 1oh3 s ILE 125 Ca 0.63 -0.29 0.04 0.00 0.00 0.00 0.00 60.65 61.03 1oh3 s ILE 125 Cb -0.11 -0.64 -0.00 0.00 0.01 0.00 0.00 42.46 41.71 1oh3 s ILE 125 CO 0.20 0.23 -0.23 0.26 0.00 0.00 0.00 174.94 175.41 1oh3 s TRP 126 N 0.37 2.40 -0.03 3.97 0.51 0.07 0.14 118.94 126.37 1oh3 s TRP 126 Ca -0.05 -0.90 0.03 0.00 -2.12 0.00 0.00 56.10 53.05 1oh3 s TRP 126 Cb -0.10 -1.60 -0.00 0.00 -0.81 0.00 0.00 33.47 30.96 1oh3 s TRP 126 CO 0.01 -0.35 -0.11 0.42 -0.51 0.00 0.00 176.95 176.40 1oh3 s ILE 127 N 0.23 0.97 0.07 2.03 1.01 -0.25 -2.17 121.20 123.08 1oh3 s ILE 127 Ca -0.14 -0.47 0.01 0.00 0.00 0.00 0.00 60.65 60.04 1oh3 s ILE 127 Cb -0.16 -0.84 -0.04 0.00 0.01 0.00 0.00 42.46 41.43 1oh3 s ILE 127 CO 0.07 0.29 -0.05 -0.54 0.00 0.00 0.00 174.94 174.70 1oh3 s LYS 128 N 0.06 0.69 -1.15 2.79 1.02 -0.47 -0.86 119.74 121.81 1oh3 s LYS 128 Ca -0.02 -1.16 -0.03 0.00 0.02 0.00 0.00 55.97 54.78 1oh3 s LYS 128 Cb -0.08 -0.08 -0.03 0.00 -0.52 0.00 0.00 37.83 37.12 1oh3 s LYS 128 CO 0.01 -0.04 0.93 0.09 -0.92 0.00 0.00 175.35 175.42 1oh3 n ASN 129 N 0.35 -3.82 -4.65 2.83 3.02 -0.84 -0.78 115.26 111.37 1oh3 n ASN 129 Ca -0.15 -0.69 -0.40 0.00 -0.03 0.00 0.00 54.58 53.31 1oh3 n ASN 129 Cb 0.59 -4.99 -0.06 0.00 -0.61 0.00 0.00 39.78 34.72 1oh3 n ASN 129 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1oh3 s LEU 130 N -6.03 4.12 -0.00 3.41 2.96 0.39 -3.85 118.68 119.67 1oh3 s LEU 130 Ca 0.19 0.76 0.01 0.00 -0.22 0.00 0.00 54.13 54.87 1oh3 s LEU 130 Cb -0.03 -2.83 0.00 0.00 0.50 0.00 0.00 46.19 43.83 1oh3 s LEU 130 CO 0.75 -0.27 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.79 1oh3 s VAL 131 N 2.00 0.20 -0.12 1.68 1.01 0.02 -0.22 120.40 124.97 1oh3 s VAL 131 Ca 0.27 -0.10 -0.05 0.00 0.00 0.00 0.00 61.98 62.10 1oh3 s VAL 131 Cb -0.16 -0.19 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 1oh3 s VAL 131 CO 0.10 0.07 0.08 -2.28 0.00 0.00 0.00 175.10 173.07 1oh3 s HIS 132 N 0.03 3.40 0.03 5.22 2.46 -0.10 -0.29 115.29 126.05 1oh3 s HIS 132 Ca 0.00 0.35 0.08 0.00 0.47 0.00 0.00 55.06 55.96 1oh3 s HIS 132 Cb -0.02 -1.92 -0.03 0.00 -0.13 0.00 0.00 32.58 30.48 1oh3 s HIS 132 CO -0.00 0.56 -0.21 0.45 -2.47 0.00 0.00 174.74 173.07 1oh3 s SER 133 N -0.75 3.56 0.36 9.88 0.15 -0.12 -0.52 113.70 126.26 1oh3 s SER 133 Ca 0.13 -0.46 0.27 0.00 0.70 0.00 0.00 55.95 56.59 1oh3 s SER 133 Cb -0.12 -0.51 1.06 0.00 -1.71 0.00 0.00 66.02 64.74 1oh3 s SER 133 CO 0.03 0.27 1.80 0.71 1.20 0.00 0.00 173.24 177.25 1oh3 h THR 134 N 4.12 0.00 -5.15 6.45 1.35 -1.63 -0.01 112.91 118.03 1oh3 h THR 134 Ca -0.47 -0.40 -0.32 0.00 -0.55 0.00 0.00 66.41 64.68 1oh3 h THR 134 Cb 1.15 1.26 0.04 0.00 -1.73 0.00 0.00 68.15 68.88 1oh3 h THR 134 CO 0.46 0.00 0.03 0.61 -0.25 0.00 0.00 175.52 176.38 1oh3 n GLY 135 N 0.22 1.14 3.89 5.82 0.00 -1.26 -3.84 105.19 111.16 1oh3 n GLY 135 Ca 0.02 -2.07 -0.29 0.00 0.00 0.00 0.00 46.02 43.67 1oh3 n GLY 135 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1oh3 s SER 136 N -3.65 5.48 0.27 1.61 1.04 -1.26 -2.58 113.70 114.60 1oh3 s SER 136 Ca 0.44 1.04 -0.04 0.00 0.48 0.00 0.00 55.95 57.87 1oh3 s SER 136 Cb -0.03 -1.88 0.35 0.00 0.10 0.00 0.00 66.02 64.56 1oh3 s SER 136 CO 0.29 -1.28 1.88 0.00 0.98 0.00 0.00 173.24 175.11 1oh3 h ALA 137 N -0.55 1.26 0.00 5.32 0.00 -1.87 -2.36 119.26 121.06 1oh3 h ALA 137 Ca -0.45 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.29 1oh3 h ALA 137 Cb 1.25 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 1oh3 h ALA 137 CO 0.63 0.59 -0.16 -0.44 0.00 0.00 0.00 179.25 179.87 1oh3 h ASP 138 N 1.07 0.00 -0.69 0.00 3.32 -1.93 -2.53 116.42 115.66 1oh3 h ASP 138 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 1oh3 h ASP 138 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1oh3 h ASP 138 CO -0.04 0.16 0.00 0.47 -1.72 0.00 0.00 179.24 178.11 1oh3 n ASP 139 N -3.64 4.13 -4.63 6.45 8.00 -0.92 -4.98 116.55 120.96 1oh3 n ASP 139 Ca -0.01 -2.13 -0.43 0.00 0.71 0.00 0.00 54.79 52.92 1oh3 n ASP 139 Cb 0.28 -0.50 -0.02 0.00 -0.02 0.00 0.00 41.12 40.86 1oh3 n ASP 139 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1oh3 s PHE 140 N -1.25 2.24 -0.49 1.24 2.19 -0.96 -4.86 117.98 116.09 1oh3 s PHE 140 Ca 0.48 0.63 -0.17 0.00 0.33 0.00 0.00 56.93 58.20 1oh3 s PHE 140 Cb 0.27 -3.98 0.07 0.00 -1.31 0.00 0.00 43.02 38.06 1oh3 s PHE 140 CO 0.30 -2.61 0.50 0.08 1.83 0.00 0.00 175.22 175.31 1oh3 s VAL 141 N 5.09 5.07 -0.37 3.12 1.01 -1.26 -5.03 120.40 128.02 1oh3 s VAL 141 Ca 0.68 -0.79 -0.28 0.00 0.00 0.00 0.00 61.98 61.58 1oh3 s VAL 141 Cb -0.22 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 31.94 1oh3 s VAL 141 CO 0.28 -0.68 1.72 -0.62 0.00 0.00 0.00 175.10 175.80 1oh3 s ASP 142 N 2.63 5.93 0.45 3.32 2.15 -1.26 -4.87 116.67 125.03 1oh3 s ASP 142 Ca 0.09 1.11 0.30 0.00 0.43 0.00 0.00 52.55 54.48 1oh3 s ASP 142 Cb -0.22 -2.53 1.18 0.00 -0.30 0.00 0.00 42.92 41.05 1oh3 s ASP 142 CO 0.09 -1.72 1.88 1.55 -0.17 0.00 0.00 175.17 176.81 1oh3 h PRO 143 N 12.61 0.00 0.00 4.34 0.13 -2.02 -3.56 132.00 143.50 1oh3 h PRO 143 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1oh3 h PRO 143 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1oh3 h PRO 143 CO 1.06 0.00 0.00 -0.89 -0.23 0.00 0.00 178.00 177.94