#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 3.12 -0.19 7.54 0.00 -1.26 -4.96 121.76 126.01 1oh3 s ALA 5 Ca 0.00 1.00 -0.07 0.00 0.00 0.00 0.00 51.96 52.88 1oh3 s ALA 5 Cb 0.00 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 1oh3 s ALA 5 CO 0.00 -0.60 0.06 0.99 0.00 0.00 0.00 175.76 176.20 1oh3 s THR 6 N -1.42 4.65 -0.14 0.00 2.01 -1.26 -4.92 115.64 114.55 1oh3 s THR 6 Ca 0.59 -0.08 -0.07 0.00 0.31 0.00 0.00 61.69 62.44 1oh3 s THR 6 Cb -0.31 -3.10 -0.04 0.00 0.01 0.00 0.00 72.50 69.05 1oh3 s THR 6 CO 0.39 0.44 0.09 -0.31 -0.69 0.00 0.00 174.62 174.54 1oh3 s TYR 7 N 0.57 3.39 -0.23 4.92 1.51 -1.26 -1.64 117.35 124.60 1oh3 s TYR 7 Ca 0.03 0.31 0.02 0.00 -1.01 0.00 0.00 57.07 56.42 1oh3 s TYR 7 Cb -0.13 -1.99 0.05 0.00 -0.11 0.00 0.00 41.96 39.79 1oh3 s TYR 7 CO 0.01 0.46 -0.11 0.99 -1.11 0.00 0.00 175.55 175.79 1oh3 s THR 8 N -0.40 1.92 -0.14 -0.71 2.01 0.93 -4.99 115.64 114.27 1oh3 s THR 8 Ca 0.10 -1.34 -0.29 0.00 0.31 0.00 0.00 61.69 60.47 1oh3 s THR 8 Cb -0.12 -2.01 -0.01 0.00 0.01 0.00 0.00 72.50 70.37 1oh3 s THR 8 CO 0.02 0.06 1.09 -0.69 -0.69 0.00 0.00 174.62 174.41 1oh3 s VAL 9 N 1.24 4.58 -0.21 3.82 1.01 -1.26 -0.59 120.40 128.99 1oh3 s VAL 9 Ca -0.05 1.88 -0.20 0.00 0.00 0.00 0.00 61.98 63.60 1oh3 s VAL 9 Cb -0.18 -4.21 -0.18 0.00 0.00 0.00 0.00 36.38 31.81 1oh3 s VAL 9 CO -0.07 -0.07 0.15 -0.38 0.00 0.00 0.00 175.10 174.73 1oh3 n ILE 10 N 4.88 1.53 -3.63 2.22 5.41 0.15 -4.99 119.36 124.93 1oh3 n ILE 10 Ca 0.11 -0.04 -0.16 0.00 1.00 0.00 0.00 62.75 63.66 1oh3 n ILE 10 Cb 0.47 -2.04 -0.07 0.00 -0.71 0.00 0.00 39.64 37.28 1oh3 n ILE 10 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 176.55 177.27 1oh3 s PHE 11 N -2.37 -0.46 0.00 1.39 -0.71 -1.04 -4.71 117.98 110.09 1oh3 s PHE 11 Ca -0.29 0.80 0.00 0.00 -1.04 0.00 0.00 56.93 56.40 1oh3 s PHE 11 Cb 0.06 0.26 0.00 0.00 -1.21 0.00 0.00 43.02 42.14 1oh3 s PHE 11 CO 0.57 -0.49 0.00 1.63 -1.34 0.00 0.00 175.22 175.59 1oh3 n LYS 12 N 1.23 0.00 -2.88 1.99 5.02 -1.26 -0.51 118.16 121.74 1oh3 n LYS 12 Ca -0.20 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.68 1oh3 n LYS 12 Cb 0.56 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.54 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 -0.91 6.98 -0.20 4.39 0.02 -1.26 -1.03 114.94 122.94 1oh3 s ASN 13 Ca 0.00 1.21 -0.14 0.00 -1.02 0.00 0.00 52.86 52.90 1oh3 s ASN 13 Cb 0.00 -2.46 -0.04 0.00 0.02 0.00 0.00 41.25 38.77 1oh3 s ASN 13 CO 0.00 -0.38 0.33 0.00 0.02 0.00 0.00 177.10 177.07 1oh3 s ALA 14 N 2.03 3.57 -0.97 0.60 0.00 0.42 -4.91 121.76 122.51 1oh3 s ALA 14 Ca 0.39 -0.57 0.09 0.00 0.00 0.00 0.00 51.96 51.87 1oh3 s ALA 14 Cb -0.17 -2.52 0.04 0.00 0.00 0.00 0.00 23.12 20.47 1oh3 s ALA 14 CO 0.13 -0.17 0.69 -1.13 0.00 0.00 0.00 175.76 175.28 1oh3 n SER 15 N 4.19 1.45 -2.90 0.00 3.41 -1.26 -3.95 113.62 114.56 1oh3 n SER 15 Ca -0.10 -1.22 0.01 0.00 -0.26 0.00 0.00 58.87 57.29 1oh3 n SER 15 Cb 0.51 0.23 0.01 0.00 -0.26 0.00 0.00 64.21 64.70 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 0.67 0.47 3.72 5.00 0.00 -1.26 -4.87 105.19 108.92 1oh3 n GLY 16 Ca 0.04 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.63 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 3.91 -4.76 0.99 4.77 -1.26 -4.91 117.00 115.74 1oh3 n LEU 17 Ca 0.02 1.21 -0.40 0.00 -0.03 0.00 0.00 56.01 56.81 1oh3 n LEU 17 Cb 0.41 -1.52 0.02 0.00 -2.33 0.00 0.00 43.42 40.00 1oh3 n LEU 17 CO 0.12 -0.29 1.08 -2.65 -1.33 0.00 0.00 177.39 174.32 1oh3 n PRO 18 N 0.56 2.27 -1.68 3.23 -0.02 -1.26 -4.88 135.00 133.21 1oh3 n PRO 18 Ca 0.04 0.81 -0.45 0.00 -2.02 0.00 0.00 63.50 61.88 1oh3 n PRO 18 Cb 0.37 -2.64 -0.04 0.00 -0.02 0.00 0.00 33.50 31.17 1oh3 n PRO 18 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1oh3 n ASN 19 N -0.19 3.25 0.00 2.55 5.03 -1.26 -1.81 115.26 122.83 1oh3 n ASN 19 Ca 0.05 1.09 0.00 0.00 0.87 0.00 0.00 54.58 56.59 1oh3 n ASN 19 Cb 0.41 -1.47 0.00 0.00 -1.02 0.00 0.00 39.78 37.71 1oh3 n ASN 19 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1oh3 n GLY 20 N 3.21 0.59 3.27 7.41 0.00 -1.26 -5.04 105.19 113.37 1oh3 n GLY 20 Ca 0.15 -0.06 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.00 1.81 0.39 1.61 1.51 -0.75 -1.08 117.35 118.84 1oh3 s TYR 21 Ca 0.00 -0.40 0.08 0.00 -1.01 0.00 0.00 57.07 55.74 1oh3 s TYR 21 Cb 0.00 -1.03 -0.05 0.00 -0.11 0.00 0.00 41.96 40.77 1oh3 s TYR 21 CO 0.00 0.16 0.14 -0.51 -1.11 0.00 0.00 175.55 174.23 1oh3 s ASP 22 N -1.61 4.38 -0.30 2.29 1.01 -0.16 -4.71 116.67 117.59 1oh3 s ASP 22 Ca 0.07 -1.04 -0.02 0.00 0.71 0.00 0.00 52.55 52.27 1oh3 s ASP 22 Cb -0.09 -0.52 0.05 0.00 1.01 0.00 0.00 42.92 43.37 1oh3 s ASP 22 CO 0.03 -0.46 -0.01 0.21 0.21 0.00 0.00 175.17 175.16 1oh3 s ASN 23 N -3.85 4.84 -0.51 0.27 2.47 -1.26 -0.72 114.94 116.18 1oh3 s ASN 23 Ca 0.39 -1.24 0.02 0.00 0.42 0.00 0.00 52.86 52.45 1oh3 s ASN 23 Cb 0.03 -1.71 0.53 0.00 -1.45 0.00 0.00 41.25 38.65 1oh3 s ASN 23 CO 0.22 -0.25 1.85 0.79 -3.72 0.00 0.00 177.10 175.99 1oh3 n TRP 24 N 4.62 2.87 -1.44 0.43 7.02 0.19 -4.93 117.44 126.20 1oh3 n TRP 24 Ca -0.13 -2.38 -0.21 0.00 -1.02 0.00 0.00 57.50 53.75 1oh3 n TRP 24 Cb 0.44 -1.06 0.16 0.00 -2.42 0.00 0.00 31.31 28.42 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 -1.00 -1.79 3.26 6.99 0.00 -1.25 -4.56 105.19 106.84 1oh3 n GLY 25 Ca 0.56 -1.63 -0.12 0.00 0.00 0.00 0.00 46.02 44.83 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 -2.91 -0.14 -1.67 1.61 -2.14 -0.51 -4.90 118.94 108.29 1oh3 s TRP 26 Ca 0.54 0.02 0.00 0.00 2.66 0.00 0.00 56.10 59.32 1oh3 s TRP 26 Cb -0.03 0.12 0.00 0.00 -3.10 0.00 0.00 33.47 30.46 1oh3 s TRP 26 CO 0.39 -0.51 0.00 0.41 -2.66 0.00 0.00 176.95 174.57 1oh3 n GLY 27 N 0.58 0.54 3.80 3.67 0.00 -1.26 -0.73 105.19 111.79 1oh3 n GLY 27 Ca -0.19 -0.16 -0.05 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.52 1.57 -0.06 0.00 -4.23 -0.88 -4.97 115.64 103.54 1oh3 s THR 29 Ca 0.12 -1.93 -0.00 0.00 -1.18 0.00 0.00 61.69 58.70 1oh3 s THR 29 Cb -0.03 -1.78 -0.03 0.00 1.34 0.00 0.00 72.50 72.00 1oh3 s THR 29 CO 0.04 -0.46 -0.03 -0.76 -0.54 0.00 0.00 174.62 172.88 1oh3 s LEU 30 N -2.79 3.41 0.23 4.79 1.43 -1.26 -0.98 118.68 123.51 1oh3 s LEU 30 Ca 0.15 0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.31 1oh3 s LEU 30 Cb -0.03 -1.80 -0.05 0.00 0.03 0.00 0.00 46.19 44.34 1oh3 s LEU 30 CO 0.05 0.36 0.09 -0.94 0.23 0.00 0.00 176.35 176.13 1oh3 s SER 31 N -0.97 0.91 -0.07 2.29 1.04 -0.13 -4.99 113.70 111.78 1oh3 s SER 31 Ca 0.14 -1.35 -0.00 0.00 0.48 0.00 0.00 55.95 55.22 1oh3 s SER 31 Cb -0.11 0.21 0.02 0.00 0.10 0.00 0.00 66.02 66.25 1oh3 s SER 31 CO 0.03 -0.73 -0.04 -0.31 0.98 0.00 0.00 173.24 173.17 1oh3 s TYR 32 N -3.85 0.92 -0.26 5.02 2.02 -1.26 -0.49 117.35 119.46 1oh3 s TYR 32 Ca 0.35 -0.33 -0.25 0.00 -0.37 0.00 0.00 57.07 56.47 1oh3 s TYR 32 Cb 0.07 -0.88 0.07 0.00 -0.40 0.00 0.00 41.96 40.83 1oh3 s TYR 32 CO 0.11 -0.33 0.75 -0.47 -1.57 0.00 0.00 175.55 174.04 1oh3 s TYR 33 N 1.54 -0.75 -1.63 2.71 6.14 -0.93 -4.93 117.35 119.49 1oh3 s TYR 33 Ca -0.01 1.82 0.00 0.00 0.64 0.00 0.00 57.07 59.52 1oh3 s TYR 33 Cb -0.13 0.29 0.00 0.00 0.42 0.00 0.00 41.96 42.53 1oh3 s TYR 33 CO -0.04 -0.38 0.00 0.41 0.64 0.00 0.00 175.55 176.18 1oh3 n GLY 34 N 2.56 0.65 2.92 8.97 0.00 -1.26 -1.58 105.19 117.44 1oh3 n GLY 34 Ca -0.14 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 0.96 3.87 -0.02 0.00 -1.26 -4.98 105.19 102.81 1oh3 n GLY 35 Ca -0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 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 -3.86 3.82 -0.19 4.61 0.00 -0.62 -0.44 121.76 125.09 1oh3 s ALA 36 Ca 0.00 -0.51 -0.29 0.00 0.00 0.00 0.00 51.96 51.16 1oh3 s ALA 36 Cb 0.00 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 21.01 1oh3 s ALA 36 CO 0.00 0.59 1.04 1.41 0.00 0.00 0.00 175.76 178.80 1oh3 s MET 37 N -1.27 4.30 -0.17 0.00 1.75 -0.36 -2.19 119.30 121.36 1oh3 s MET 37 Ca 0.21 1.38 -0.01 0.00 -1.25 0.00 0.00 55.69 56.02 1oh3 s MET 37 Cb -0.14 -3.61 -0.00 0.00 2.84 0.00 0.00 34.83 33.92 1oh3 s MET 37 CO 0.10 -0.54 -0.13 0.42 -0.65 0.00 0.00 175.02 174.22 1oh3 s ILE 38 N 2.87 2.79 -0.23 10.11 1.01 0.36 -0.84 121.20 137.28 1oh3 s ILE 38 Ca 0.45 -0.72 -0.10 0.00 0.00 0.00 0.00 60.65 60.29 1oh3 s ILE 38 Cb -0.16 -2.20 -0.05 0.00 0.01 0.00 0.00 42.46 40.07 1oh3 s ILE 38 CO 0.10 0.50 0.13 -0.63 0.00 0.00 0.00 174.94 175.04 1oh3 s ILE 39 N 0.92 5.13 -0.69 2.92 1.01 0.59 -0.96 121.20 130.12 1oh3 s ILE 39 Ca -0.03 0.10 -0.02 0.00 0.00 0.00 0.00 60.65 60.70 1oh3 s ILE 39 Cb -0.15 -3.38 0.17 0.00 0.01 0.00 0.00 42.46 39.11 1oh3 s ILE 39 CO -0.01 0.36 0.51 0.20 0.00 0.00 0.00 174.94 176.01 1oh3 s ASN 40 N 1.00 5.31 0.53 3.58 0.01 -0.15 -2.11 114.94 123.12 1oh3 s ASN 40 Ca 0.06 -3.15 -0.18 0.00 -0.71 0.00 0.00 52.86 48.88 1oh3 s ASN 40 Cb -0.14 -1.84 -0.07 0.00 0.41 0.00 0.00 41.25 39.62 1oh3 s ASN 40 CO 0.04 -0.29 1.05 -2.84 -1.51 0.00 0.00 177.10 173.54 1oh3 s PRO 41 N -0.49 3.61 -0.04 -0.60 0.02 -1.26 -2.07 135.00 134.16 1oh3 s PRO 41 Ca 0.20 1.30 -0.20 0.00 0.02 0.00 0.00 61.00 62.32 1oh3 s PRO 41 Cb -0.17 -2.07 -0.05 0.00 0.02 0.00 0.00 34.50 32.24 1oh3 s PRO 41 CO -0.06 -0.58 0.58 -1.14 -0.33 0.00 0.00 177.00 175.46 1oh3 s GLN 42 N -3.58 4.33 0.24 5.54 0.74 0.08 -4.41 119.66 122.61 1oh3 s GLN 42 Ca 0.66 0.67 -0.31 0.00 0.05 0.00 0.00 55.36 56.43 1oh3 s GLN 42 Cb -0.16 -3.38 -0.14 0.00 1.10 0.00 0.00 33.01 30.43 1oh3 s GLN 42 CO 0.27 0.27 1.24 -1.91 -0.55 0.00 0.00 175.29 174.61 1oh3 n GLU 43 N 3.12 1.64 -0.12 1.67 0.00 -1.26 -2.13 120.64 123.56 1oh3 n GLU 43 Ca -0.06 0.58 0.00 0.00 0.00 0.00 0.00 57.16 57.68 1oh3 n GLU 43 Cb 0.51 -2.13 0.00 0.00 0.00 0.00 0.00 31.44 29.83 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 1.79 2.19 0.02 8.31 0.00 0.98 -4.89 105.19 113.59 1oh3 n GLY 44 Ca 0.12 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.24 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 0.43 -3.78 1.61 4.76 -0.91 -4.98 118.16 113.29 1oh3 n LYS 45 Ca 0.00 -0.09 -0.23 0.00 -2.87 0.00 0.00 58.31 55.12 1oh3 n LYS 45 Cb 0.00 -1.55 0.02 0.00 -1.84 0.00 0.00 35.03 31.66 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 -2.06 -1.94 -1.08 2.13 4.01 -1.26 -4.86 117.16 112.11 1oh3 n TYR 46 Ca -0.01 0.84 -0.31 0.00 -0.16 0.00 0.00 57.90 58.26 1oh3 n TYR 46 Cb 0.49 -4.22 0.12 0.00 -0.31 0.00 0.00 39.34 35.41 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 -4.19 1.72 -0.08 2.72 0.00 -1.26 -4.58 107.32 101.66 1oh3 s GLY 47 Ca 0.12 0.41 -0.21 0.00 0.00 0.00 0.00 44.72 45.04 1oh3 s GLY 47 CO 0.83 0.79 0.49 0.00 0.00 0.00 0.00 173.10 175.21 1oh3 s ALA 48 N -2.77 -1.26 0.31 3.20 0.00 0.09 -0.36 121.76 120.98 1oh3 s ALA 48 Ca 0.64 0.98 -0.27 0.00 0.00 0.00 0.00 51.96 53.31 1oh3 s ALA 48 Cb -0.20 -0.20 -0.10 0.00 0.00 0.00 0.00 23.12 22.63 1oh3 s ALA 48 CO 0.56 -0.29 0.97 0.54 0.00 0.00 0.00 175.76 177.53 1oh3 s VAL 49 N -0.85 4.07 -0.32 0.00 0.11 -0.85 -1.42 120.40 121.15 1oh3 s VAL 49 Ca -0.09 1.79 -0.01 0.00 -2.93 0.00 0.00 61.98 60.74 1oh3 s VAL 49 Cb -0.03 -4.03 0.10 0.00 -1.53 0.00 0.00 36.38 30.90 1oh3 s VAL 49 CO 0.05 0.21 0.12 -0.55 -3.33 0.00 0.00 175.10 171.60 1oh3 s SER 50 N -1.47 3.85 -0.37 3.54 0.15 -1.26 -2.06 113.70 116.07 1oh3 s SER 50 Ca 0.49 -1.64 -0.29 0.00 0.70 0.00 0.00 55.95 55.21 1oh3 s SER 50 Cb -0.21 -0.73 0.02 0.00 -1.71 0.00 0.00 66.02 63.38 1oh3 s SER 50 CO 0.27 -0.41 1.15 -0.76 1.20 0.00 0.00 173.24 174.69 1oh3 s LEU 51 N 1.63 3.81 -0.36 3.45 1.43 0.27 -0.63 118.68 128.28 1oh3 s LEU 51 Ca 0.10 0.88 -0.13 0.00 -1.03 0.00 0.00 54.13 53.96 1oh3 s LEU 51 Cb -0.18 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.50 1oh3 s LEU 51 CO -0.25 -1.06 0.24 -0.75 0.23 0.00 0.00 176.35 174.76 1oh3 s LYS 52 N 4.05 3.22 -0.13 1.70 2.47 0.10 -1.40 119.74 129.75 1oh3 s LYS 52 Ca 0.49 -0.83 -0.29 0.00 -1.56 0.00 0.00 55.97 53.77 1oh3 s LYS 52 Cb -0.11 -3.80 -0.03 0.00 -1.46 0.00 0.00 37.83 32.42 1oh3 s LYS 52 CO 0.23 -0.57 1.44 0.50 0.16 0.00 0.00 175.35 177.11 1oh3 s ARG 53 N 1.67 4.17 0.19 4.03 3.52 0.22 -0.99 118.95 131.77 1oh3 s ARG 53 Ca 0.05 1.86 0.06 0.00 -0.13 0.00 0.00 55.73 57.57 1oh3 s ARG 53 Cb -0.18 -3.87 0.08 0.00 -1.56 0.00 0.00 34.95 29.42 1oh3 s ARG 53 CO 0.09 -0.81 1.44 -0.91 -0.81 0.00 0.00 175.30 174.30 1oh3 h ASN 54 N 8.93 0.11 -3.64 -2.12 2.35 -1.43 -3.41 115.58 116.38 1oh3 h ASN 54 Ca -0.32 -0.09 -0.63 0.00 -0.55 0.00 0.00 56.30 54.71 1oh3 h ASN 54 Cb 1.14 -0.03 -0.37 0.00 0.05 0.00 0.00 38.32 39.10 1oh3 h ASN 54 CO 0.97 0.87 -0.80 -0.44 -1.65 0.00 0.00 177.43 176.38 1oh3 s SER 55 N -6.85 3.90 0.00 5.81 0.01 -1.26 -5.08 113.70 110.23 1oh3 s SER 55 Ca -0.02 -1.16 0.00 0.00 1.31 0.00 0.00 55.95 56.09 1oh3 s SER 55 Cb 0.11 -1.32 0.00 0.00 0.21 0.00 0.00 66.02 65.02 1oh3 s SER 55 CO 0.80 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.87 1oh3 n GLY 56 N 4.60 -2.55 3.07 3.44 0.00 -1.26 -5.03 105.19 107.46 1oh3 n GLY 56 Ca -0.14 -1.71 -0.09 0.00 0.00 0.00 0.00 46.02 44.09 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 -2.51 0.24 0.40 1.61 0.01 -1.26 -4.75 113.70 107.44 1oh3 s SER 57 Ca 0.00 -0.59 -0.04 0.00 1.31 0.00 0.00 55.95 56.63 1oh3 s SER 57 Cb 0.00 0.19 -0.04 0.00 0.21 0.00 0.00 66.02 66.38 1oh3 s SER 57 CO 0.00 -0.46 0.67 -0.36 0.41 0.00 0.00 173.24 173.50 1oh3 s PHE 58 N -2.46 3.52 -0.09 2.43 0.08 0.07 -4.88 117.98 116.65 1oh3 s PHE 58 Ca -0.06 0.67 -0.01 0.00 0.12 0.00 0.00 56.93 57.65 1oh3 s PHE 58 Cb -0.02 -2.16 0.03 0.00 -0.57 0.00 0.00 43.02 40.29 1oh3 s PHE 58 CO -0.04 -0.06 -0.02 1.03 -0.10 0.00 0.00 175.22 176.03 1oh3 s ARG 59 N -4.31 0.86 3.74 0.44 0.52 -1.26 -0.55 118.95 118.40 1oh3 s ARG 59 Ca 0.45 -0.03 0.00 0.00 -0.52 0.00 0.00 55.73 55.63 1oh3 s ARG 59 Cb -0.10 -1.22 0.00 0.00 0.52 0.00 0.00 34.95 34.15 1oh3 s ARG 59 CO 0.38 -0.32 0.00 0.41 0.02 0.00 0.00 175.30 175.80 1oh3 n GLY 60 N 5.08 2.53 7.00 -3.53 0.00 -1.26 -4.81 105.19 110.21 1oh3 n GLY 60 Ca -0.09 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 1.88 3.19 -0.02 0.00 -1.24 -4.66 105.19 104.34 1oh3 n GLY 61 Ca 0.00 -0.59 -0.10 0.00 0.00 0.00 0.00 46.02 45.33 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 0.03 -0.10 1.61 1.04 -0.25 -0.96 113.70 111.08 1oh3 s SER 62 Ca 0.00 -0.39 0.02 0.00 0.48 0.00 0.00 55.95 56.06 1oh3 s SER 62 Cb 0.00 0.30 -0.02 0.00 0.10 0.00 0.00 66.02 66.40 1oh3 s SER 62 CO 0.00 -0.58 -0.15 -0.76 0.98 0.00 0.00 173.24 172.73 1oh3 s LEU 63 N -2.18 2.63 -0.03 2.42 1.43 -0.06 -1.29 118.68 121.60 1oh3 s LEU 63 Ca -0.04 -0.31 0.07 0.00 -1.03 0.00 0.00 54.13 52.82 1oh3 s LEU 63 Cb -0.00 -1.56 -0.02 0.00 0.03 0.00 0.00 46.19 44.64 1oh3 s LEU 63 CO -0.05 0.23 -0.24 -0.60 0.23 0.00 0.00 176.35 175.92 1oh3 s ARG 64 N -0.03 2.17 0.05 1.70 3.00 -0.09 -0.68 118.95 125.06 1oh3 s ARG 64 Ca -0.04 -0.87 -0.27 0.00 -1.00 0.00 0.00 55.73 53.55 1oh3 s ARG 64 Cb -0.14 -1.98 0.08 0.00 0.00 0.00 0.00 34.95 32.91 1oh3 s ARG 64 CO 0.04 0.46 0.73 -0.59 0.00 0.00 0.00 175.30 175.94 1oh3 s PHE 65 N -0.40 -0.49 -0.15 5.12 -0.71 -0.38 -0.99 117.98 119.98 1oh3 s PHE 65 Ca 0.04 0.48 -0.09 0.00 -1.04 0.00 0.00 56.93 56.32 1oh3 s PHE 65 Cb -0.11 0.52 -0.04 0.00 -1.21 0.00 0.00 43.02 42.17 1oh3 s PHE 65 CO 0.01 -0.67 0.15 -0.51 -1.34 0.00 0.00 175.22 172.86 1oh3 s ASP 66 N -2.23 6.34 -0.07 1.98 1.01 -0.12 -0.68 116.67 122.89 1oh3 s ASP 66 Ca -0.00 0.39 -0.06 0.00 0.71 0.00 0.00 52.55 53.59 1oh3 s ASP 66 Cb -0.01 -2.09 0.02 0.00 1.01 0.00 0.00 42.92 41.85 1oh3 s ASP 66 CO -0.06 0.30 0.19 -0.32 0.21 0.00 0.00 175.17 175.49 1oh3 s MET 67 N -0.41 0.22 0.16 8.23 1.75 -0.33 -1.32 119.30 127.59 1oh3 s MET 67 Ca 0.13 0.29 0.08 0.00 -1.25 0.00 0.00 55.69 54.94 1oh3 s MET 67 Cb -0.12 0.08 -0.04 0.00 2.84 0.00 0.00 34.83 37.59 1oh3 s MET 67 CO 0.02 -0.04 -0.18 -1.59 -0.65 0.00 0.00 175.02 172.57 1oh3 s LYS 68 N 0.23 1.25 -0.28 4.11 -2.85 -0.73 -1.49 119.74 119.96 1oh3 s LYS 68 Ca -0.01 -1.38 -0.18 0.00 -1.00 0.00 0.00 55.97 53.40 1oh3 s LYS 68 Cb -0.02 -1.32 0.12 0.00 -2.06 0.00 0.00 37.83 34.55 1oh3 s LYS 68 CO -0.01 0.27 0.90 0.54 0.10 0.00 0.00 175.35 177.16 1oh3 s ASN 69 N -2.58 -0.62 0.44 0.03 4.22 -0.55 -1.04 114.94 114.85 1oh3 s ASN 69 Ca 0.14 1.03 0.24 0.00 -2.14 0.00 0.00 52.86 52.13 1oh3 s ASN 69 Cb -0.06 1.21 0.61 0.00 1.28 0.00 0.00 41.25 44.28 1oh3 s ASN 69 CO 0.06 -0.17 1.70 -0.33 -2.04 0.00 0.00 177.10 176.32 1oh3 h GLU 70 N 5.91 0.00 -4.85 3.55 5.08 -1.52 -1.59 114.58 121.16 1oh3 h GLU 70 Ca -0.29 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.68 1oh3 h GLU 70 Cb 1.20 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.31 1oh3 h GLU 70 CO 0.16 0.12 -0.56 0.20 -1.00 0.00 0.00 179.01 177.93 1oh3 s GLY 71 N -4.26 1.98 0.33 -3.84 0.00 -1.26 -4.82 107.32 95.45 1oh3 s GLY 71 Ca 0.04 -1.78 -0.29 0.00 0.00 0.00 0.00 44.72 42.69 1oh3 s GLY 71 CO 0.65 -1.56 1.56 0.54 0.00 0.00 0.00 173.10 174.29 1oh3 s LYS 72 N -3.85 4.10 -0.13 2.90 1.02 -1.26 -4.15 119.74 118.38 1oh3 s LYS 72 Ca 0.37 2.60 0.02 0.00 0.02 0.00 0.00 55.97 58.97 1oh3 s LYS 72 Cb 0.05 -2.99 -0.00 0.00 -0.52 0.00 0.00 37.83 34.37 1oh3 s LYS 72 CO 0.17 -0.61 -0.20 0.08 -0.92 0.00 0.00 175.35 173.87 1oh3 s VAL 73 N -0.46 2.36 -0.19 3.17 1.01 -0.31 -2.25 120.40 123.72 1oh3 s VAL 73 Ca 0.59 -0.90 -0.12 0.00 0.00 0.00 0.00 61.98 61.56 1oh3 s VAL 73 Cb -0.48 -1.95 -0.05 0.00 0.00 0.00 0.00 36.38 33.91 1oh3 s VAL 73 CO 0.55 0.54 0.21 -0.75 0.00 0.00 0.00 175.10 175.65 1oh3 s LYS 74 N 0.56 4.20 -0.20 2.72 2.20 -0.41 -0.70 119.74 128.09 1oh3 s LYS 74 Ca -0.12 -0.09 -0.09 0.00 -0.36 0.00 0.00 55.97 55.32 1oh3 s LYS 74 Cb -0.16 -3.45 -0.04 0.00 -1.51 0.00 0.00 37.83 32.66 1oh3 s LYS 74 CO 0.04 0.22 0.10 0.42 -0.36 0.00 0.00 175.35 175.77 1oh3 s ILE 75 N 0.57 5.02 0.14 5.43 -1.09 0.05 -0.57 121.20 130.75 1oh3 s ILE 75 Ca 0.12 0.05 0.03 0.00 -2.23 0.00 0.00 60.65 58.62 1oh3 s ILE 75 Cb -0.12 -3.29 -0.04 0.00 -1.58 0.00 0.00 42.46 37.42 1oh3 s ILE 75 CO 0.02 0.42 -0.05 -0.76 -1.23 0.00 0.00 174.94 173.33 1oh3 s LEU 76 N 0.63 2.39 0.18 2.97 1.02 -0.57 -0.55 118.68 124.75 1oh3 s LEU 76 Ca 0.05 -1.06 0.07 0.00 0.02 0.00 0.00 54.13 53.21 1oh3 s LEU 76 Cb -0.13 -0.16 -0.04 0.00 0.02 0.00 0.00 46.19 45.88 1oh3 s LEU 76 CO 0.01 -0.46 -0.14 0.68 0.02 0.00 0.00 176.35 176.47 1oh3 s VAL 77 N -3.54 1.58 0.02 -1.59 -7.23 -0.21 -0.49 120.40 108.94 1oh3 s VAL 77 Ca 0.17 -2.11 0.01 0.00 -1.81 0.00 0.00 61.98 58.24 1oh3 s VAL 77 Cb 0.05 -1.93 -0.01 0.00 0.56 0.00 0.00 36.38 35.04 1oh3 s VAL 77 CO -0.00 -0.59 -0.04 -0.13 -0.31 0.00 0.00 175.10 174.03 1oh3 s ARG 78 N -3.50 0.32 -0.35 4.82 0.52 -0.39 -0.50 118.95 119.87 1oh3 s ARG 78 Ca 0.19 -0.46 -0.14 0.00 -0.52 0.00 0.00 55.73 54.80 1oh3 s ARG 78 Cb -0.01 -0.09 -0.01 0.00 0.52 0.00 0.00 34.95 35.36 1oh3 s ARG 78 CO 0.05 0.01 0.31 1.21 0.02 0.00 0.00 175.30 176.89 1oh3 s ASN 79 N -1.00 6.12 0.20 0.23 3.84 -0.30 -0.90 114.94 123.13 1oh3 s ASN 79 Ca -0.09 -0.37 -0.05 0.00 0.21 0.00 0.00 52.86 52.57 1oh3 s ASN 79 Cb -0.07 -2.17 0.15 0.00 -0.55 0.00 0.00 41.25 38.61 1oh3 s ASN 79 CO -0.00 -0.31 1.59 0.28 -2.79 0.00 0.00 177.10 175.87 1oh3 h SER 80 N 8.49 0.77 -0.90 -4.21 0.02 -1.86 -0.91 113.55 114.95 1oh3 h SER 80 Ca -0.30 -0.31 0.02 0.00 -0.84 0.00 0.00 61.79 60.35 1oh3 h SER 80 Cb 1.15 -0.21 -0.05 0.00 0.14 0.00 0.00 62.40 63.43 1oh3 h SER 80 CO 0.67 1.03 0.60 -0.08 -1.14 0.00 0.00 176.83 177.90 1oh3 h GLU 81 N 0.63 1.16 -0.00 3.45 4.22 -1.96 -2.42 114.58 119.66 1oh3 h GLU 81 Ca 0.07 -0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1oh3 h GLU 81 Cb 0.84 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1oh3 h GLU 81 CO 0.07 0.77 -0.67 0.00 -2.18 0.00 0.00 179.01 177.00 1oh3 n ALA 82 N -2.35 3.96 -3.85 2.92 0.00 -1.22 -4.99 120.51 114.99 1oh3 n ALA 82 Ca 0.11 -0.44 -0.34 0.00 0.00 0.00 0.00 53.44 52.77 1oh3 n ALA 82 Cb 0.04 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 18.51 1oh3 n ALA 82 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1oh3 n ASP 83 N -1.47 -4.83 -4.08 0.00 -0.08 -0.42 -5.00 116.55 100.68 1oh3 n ASP 83 Ca 0.05 -1.07 -0.29 0.00 -1.51 0.00 0.00 54.79 51.98 1oh3 n ASP 83 Cb 0.33 -2.20 -0.17 0.00 2.34 0.00 0.00 41.12 41.43 1oh3 n ASP 83 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 1oh3 s GLU 84 N -6.07 2.33 0.16 -0.67 2.12 -0.79 -4.99 118.70 110.79 1oh3 s GLU 84 Ca 0.30 -0.61 0.04 0.00 0.36 0.00 0.00 54.97 55.06 1oh3 s GLU 84 Cb -0.15 -1.92 -0.04 0.00 0.26 0.00 0.00 34.13 32.29 1oh3 s GLU 84 CO 0.91 -0.01 0.20 -1.59 -0.54 0.00 0.00 175.26 174.23 1oh3 s LYS 85 N 0.83 3.12 -0.08 4.30 -2.85 -1.26 -1.15 119.74 122.64 1oh3 s LYS 85 Ca -0.10 -0.77 -0.03 0.00 -1.00 0.00 0.00 55.97 54.08 1oh3 s LYS 85 Cb -0.16 -2.77 0.04 0.00 -2.06 0.00 0.00 37.83 32.89 1oh3 s LYS 85 CO 0.01 0.49 0.10 0.12 0.10 0.00 0.00 175.35 176.17 1oh3 s PHE 86 N -1.77 -0.00 -0.12 1.78 5.36 0.35 -4.99 117.98 118.58 1oh3 s PHE 86 Ca 0.32 0.26 -0.29 0.00 -0.96 0.00 0.00 56.93 56.26 1oh3 s PHE 86 Cb -0.10 -0.45 -0.01 0.00 -0.34 0.00 0.00 43.02 42.12 1oh3 s PHE 86 CO 0.26 -0.29 1.08 -2.00 -1.46 0.00 0.00 175.22 172.81 1oh3 s GLU 87 N 2.21 4.36 -0.22 10.12 2.12 -1.26 -1.05 118.70 134.98 1oh3 s GLU 87 Ca 0.04 1.47 -0.21 0.00 0.36 0.00 0.00 54.97 56.63 1oh3 s GLU 87 Cb -0.13 -3.58 -0.18 0.00 0.26 0.00 0.00 34.13 30.50 1oh3 s GLU 87 CO -0.05 -0.44 0.15 0.28 -0.54 0.00 0.00 175.26 174.66 1oh3 n VAL 88 N 4.78 1.54 -3.56 3.70 0.31 0.28 -4.98 118.33 120.40 1oh3 n VAL 88 Ca 0.10 -0.07 -0.08 0.00 -0.01 0.00 0.00 64.34 64.29 1oh3 n VAL 88 Cb 0.47 -2.02 -0.03 0.00 -0.91 0.00 0.00 33.84 31.35 1oh3 n VAL 88 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1oh3 s GLU 89 N -2.38 0.58 -0.07 5.55 2.56 -1.17 -5.00 118.70 118.76 1oh3 s GLU 89 Ca -0.30 -0.11 0.02 0.00 0.00 0.00 0.00 54.97 54.58 1oh3 s GLU 89 Cb 0.07 0.27 -0.02 0.00 2.00 0.00 0.00 34.13 36.44 1oh3 s GLU 89 CO 0.58 -0.23 -0.13 0.99 -0.56 0.00 0.00 175.26 175.90 1oh3 s THR 90 N -2.28 3.10 -0.10 -1.70 2.01 -1.26 -0.77 115.64 114.64 1oh3 s THR 90 Ca 0.05 -0.69 0.04 0.00 0.31 0.00 0.00 61.69 61.39 1oh3 s THR 90 Cb -0.01 -2.24 -0.00 0.00 0.01 0.00 0.00 72.50 70.26 1oh3 s THR 90 CO -0.05 0.57 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.59 1oh3 s ILE 91 N -0.44 2.15 0.63 1.82 1.01 0.12 -4.95 121.20 121.54 1oh3 s ILE 91 Ca 0.05 -0.99 -0.13 0.00 0.00 0.00 0.00 60.65 59.58 1oh3 s ILE 91 Cb -0.12 -1.82 -0.02 0.00 0.01 0.00 0.00 42.46 40.51 1oh3 s ILE 91 CO 0.02 0.56 1.05 -0.44 0.00 0.00 0.00 174.94 176.13 1oh3 s SER 92 N 0.28 5.71 0.46 3.58 0.01 -1.26 -1.17 113.70 121.31 1oh3 s SER 92 Ca -0.17 1.68 -0.24 0.00 1.31 0.00 0.00 55.95 58.53 1oh3 s SER 92 Cb -0.17 -2.51 -0.08 0.00 0.21 0.00 0.00 66.02 63.46 1oh3 s SER 92 CO 0.08 -1.22 1.33 -2.65 0.41 0.00 0.00 173.24 171.19 1oh3 n PRO 93 N -2.53 1.95 -3.76 12.44 -0.02 -1.26 -4.85 135.00 136.97 1oh3 n PRO 93 Ca 0.08 0.70 -0.13 0.00 -2.02 0.00 0.00 63.50 62.13 1oh3 n PRO 93 Cb 0.53 -2.49 -0.12 0.00 -0.02 0.00 0.00 33.50 31.40 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 -0.61 -0.25 0.00 2.55 0.15 -0.60 -4.98 113.70 109.96 1oh3 s SER 94 Ca 0.64 0.49 0.28 0.00 0.70 0.00 0.00 55.95 58.06 1oh3 s SER 94 Cb -0.47 0.44 1.09 0.00 -1.71 0.00 0.00 66.02 65.37 1oh3 s SER 94 CO 0.56 -0.12 1.78 -0.90 1.20 0.00 0.00 173.24 175.75 1oh3 n ASP 95 N 3.58 0.59 -4.40 5.45 5.75 -1.26 -1.48 116.55 124.77 1oh3 n ASP 95 Ca -0.19 -0.60 -0.28 0.00 -0.01 0.00 0.00 54.79 53.71 1oh3 n ASP 95 Cb 0.56 -0.03 -0.13 0.00 -1.03 0.00 0.00 41.12 40.49 1oh3 n ASP 95 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1oh3 s GLU 96 N -2.51 1.45 0.32 0.11 0.41 -1.26 -4.94 118.70 112.27 1oh3 s GLU 96 Ca 0.27 -1.42 -0.29 0.00 -0.41 0.00 0.00 54.97 53.12 1oh3 s GLU 96 Cb 0.20 -1.88 -0.11 0.00 -1.78 0.00 0.00 34.13 30.55 1oh3 s GLU 96 CO 0.49 0.43 1.56 0.71 -0.49 0.00 0.00 175.26 177.96 1oh3 s TYR 97 N -1.29 2.71 -0.01 1.61 2.02 -1.26 -4.47 117.35 116.66 1oh3 s TYR 97 Ca 0.17 0.90 0.05 0.00 -0.37 0.00 0.00 57.07 57.82 1oh3 s TYR 97 Cb -0.09 -4.05 -0.01 0.00 -0.40 0.00 0.00 41.96 37.40 1oh3 s TYR 97 CO 0.07 -3.40 -0.17 0.08 -1.57 0.00 0.00 175.55 170.57 1oh3 s VAL 98 N -0.33 1.33 -0.16 0.71 1.01 -0.56 -4.91 120.40 117.48 1oh3 s VAL 98 Ca 0.60 -0.76 -0.19 0.00 0.00 0.00 0.00 61.98 61.63 1oh3 s VAL 98 Cb -0.47 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 1oh3 s VAL 98 CO 0.52 0.34 0.54 -0.89 0.00 0.00 0.00 175.10 175.61 1oh3 s THR 99 N -0.44 5.12 -0.06 3.92 2.01 -1.26 -1.19 115.64 123.73 1oh3 s THR 99 Ca 0.06 1.03 0.03 0.00 0.31 0.00 0.00 61.69 63.12 1oh3 s THR 99 Cb -0.07 -3.86 -0.02 0.00 0.01 0.00 0.00 72.50 68.55 1oh3 s THR 99 CO -0.00 0.22 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.70 1oh3 s TYR 100 N 1.27 2.73 -0.19 4.92 2.02 0.14 -4.98 117.35 123.26 1oh3 s TYR 100 Ca 0.26 -0.21 -0.01 0.00 -0.37 0.00 0.00 57.07 56.74 1oh3 s TYR 100 Cb -0.16 -1.67 0.05 0.00 -0.40 0.00 0.00 41.96 39.79 1oh3 s TYR 100 CO 0.11 0.14 -0.01 0.42 -1.57 0.00 0.00 175.55 174.64 1oh3 s ILE 101 N -0.58 0.88 -0.10 2.71 1.01 -1.26 -1.24 121.20 122.63 1oh3 s ILE 101 Ca 0.08 -0.68 0.03 0.00 0.00 0.00 0.00 60.65 60.09 1oh3 s ILE 101 Cb -0.11 -1.23 0.01 0.00 0.01 0.00 0.00 42.46 41.13 1oh3 s ILE 101 CO 0.01 -0.07 -0.19 -0.76 0.00 0.00 0.00 174.94 173.93 1oh3 s LEU 102 N 1.71 1.92 0.35 2.97 1.43 0.14 -4.87 118.68 122.33 1oh3 s LEU 102 Ca -0.01 -0.48 -0.28 0.00 -1.03 0.00 0.00 54.13 52.33 1oh3 s LEU 102 Cb -0.17 -1.22 -0.10 0.00 0.03 0.00 0.00 46.19 44.74 1oh3 s LEU 102 CO -0.07 0.09 1.26 -1.81 0.23 0.00 0.00 176.35 176.05 1oh3 s ASP 103 N 0.59 6.70 -0.41 2.29 1.01 -1.26 -0.88 116.67 124.71 1oh3 s ASP 103 Ca -0.14 2.58 -0.06 0.00 0.71 0.00 0.00 52.55 55.64 1oh3 s ASP 103 Cb -0.17 -2.64 0.09 0.00 1.01 0.00 0.00 42.92 41.22 1oh3 s ASP 103 CO 0.04 -0.57 0.22 -0.69 0.21 0.00 0.00 175.17 174.38 1oh3 s VAL 104 N -1.21 3.76 -0.80 -1.27 1.01 -0.13 -4.90 120.40 116.86 1oh3 s VAL 104 Ca 0.51 -1.66 0.11 0.00 0.00 0.00 0.00 61.98 60.94 1oh3 s VAL 104 Cb -0.37 -3.40 0.56 0.00 0.00 0.00 0.00 36.38 33.17 1oh3 s VAL 104 CO 0.49 -0.55 1.39 0.47 0.00 0.00 0.00 175.10 176.90 1oh3 n ASP 105 N 4.77 4.05 -4.75 3.32 8.00 -1.26 -4.01 116.55 126.67 1oh3 n ASP 105 Ca -0.08 -2.52 -0.41 0.00 0.71 0.00 0.00 54.79 52.49 1oh3 n ASP 105 Cb 0.42 -0.57 -0.02 0.00 -0.02 0.00 0.00 41.12 40.92 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 -2.05 3.12 -0.93 1.24 5.36 -1.26 -4.95 117.98 118.52 1oh3 s PHE 106 Ca 0.38 1.25 0.28 0.00 -0.96 0.00 0.00 56.93 57.88 1oh3 s PHE 106 Cb 0.27 -3.69 1.04 0.00 -0.34 0.00 0.00 43.02 40.31 1oh3 s PHE 106 CO 0.14 -2.06 1.82 -0.25 -1.46 0.00 0.00 175.22 173.41 1oh3 n ASP 107 N 1.82 0.26 -4.71 6.13 9.92 -1.26 -4.53 116.55 124.17 1oh3 n ASP 107 Ca 0.04 0.43 -0.25 0.00 -0.53 0.00 0.00 54.79 54.48 1oh3 n ASP 107 Cb 0.42 -0.47 -0.07 0.00 -0.64 0.00 0.00 41.12 40.36 1oh3 n ASP 107 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1oh3 s LEU 108 N -3.39 3.47 0.72 0.64 1.43 -1.26 -5.06 118.68 115.24 1oh3 s LEU 108 Ca 0.13 -0.37 -0.16 0.00 -1.03 0.00 0.00 54.13 52.69 1oh3 s LEU 108 Cb 0.17 -2.07 -0.01 0.00 0.03 0.00 0.00 46.19 44.32 1oh3 s LEU 108 CO 0.57 0.04 0.81 -2.65 0.23 0.00 0.00 176.35 175.35 1oh3 n PRO 109 N -0.54 0.41 -4.54 1.29 -0.02 -1.26 -4.65 135.00 125.70 1oh3 n PRO 109 Ca -0.08 0.19 -0.22 0.00 -2.02 0.00 0.00 63.50 61.37 1oh3 n PRO 109 Cb 0.56 -2.08 -0.14 0.00 -0.02 0.00 0.00 33.50 31.82 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 -1.87 1.34 0.00 6.00 -0.71 0.29 -4.08 117.98 118.95 1oh3 s PHE 110 Ca 0.70 -0.31 0.00 0.00 -1.04 0.00 0.00 56.93 56.29 1oh3 s PHE 110 Cb -0.34 -0.83 0.00 0.00 -1.21 0.00 0.00 43.02 40.64 1oh3 s PHE 110 CO 0.53 0.02 0.48 -0.40 -1.34 0.00 0.00 175.22 174.50 1oh3 n ASP 111 N 2.26 0.77 -4.06 1.98 5.75 -0.07 -0.75 116.55 122.43 1oh3 n ASP 111 Ca -0.16 -1.22 -0.19 0.00 -0.01 0.00 0.00 54.79 53.21 1oh3 n ASP 111 Cb 0.55 0.00 -0.14 0.00 -1.03 0.00 0.00 41.12 40.49 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 -0.22 0.82 -0.12 0.11 0.52 -1.08 -0.61 118.95 118.37 1oh3 s ARG 112 Ca 0.00 -0.44 0.00 0.00 -0.52 0.00 0.00 55.73 54.77 1oh3 s ARG 112 Cb 0.00 -0.79 0.02 0.00 0.52 0.00 0.00 34.95 34.71 1oh3 s ARG 112 CO 0.00 0.21 -0.11 0.42 0.02 0.00 0.00 175.30 175.84 1oh3 s ILE 113 N -0.39 1.28 -0.07 1.52 1.01 -0.49 -1.26 121.20 122.79 1oh3 s ILE 113 Ca 0.03 -0.46 0.02 0.00 0.00 0.00 0.00 60.65 60.23 1oh3 s ILE 113 Cb -0.05 -1.23 -0.03 0.00 0.01 0.00 0.00 42.46 41.16 1oh3 s ILE 113 CO -0.00 0.41 -0.11 -1.81 0.00 0.00 0.00 174.94 173.43 1oh3 s ASP 114 N 1.49 4.29 -0.23 3.58 1.01 0.36 -0.57 116.67 126.61 1oh3 s ASP 114 Ca 0.02 -0.15 0.02 0.00 0.71 0.00 0.00 52.55 53.16 1oh3 s ASP 114 Cb -0.13 -1.13 0.05 0.00 1.01 0.00 0.00 42.92 42.72 1oh3 s ASP 114 CO -0.08 0.32 -0.12 -0.36 0.21 0.00 0.00 175.17 175.14 1oh3 s PHE 115 N -0.54 2.88 -0.06 4.23 0.40 -0.88 -1.51 117.98 122.51 1oh3 s PHE 115 Ca 0.08 -1.98 0.03 0.00 -0.60 0.00 0.00 56.93 54.46 1oh3 s PHE 115 Cb -0.12 -1.82 -0.03 0.00 0.51 0.00 0.00 43.02 41.57 1oh3 s PHE 115 CO 0.02 -0.82 -0.14 -1.14 0.70 0.00 0.00 175.22 173.84 1oh3 s GLN 116 N 1.24 2.59 -0.96 0.44 0.74 0.26 -2.00 119.66 121.97 1oh3 s GLN 116 Ca -0.05 -0.69 -0.24 0.00 0.05 0.00 0.00 55.36 54.44 1oh3 s GLN 116 Cb -0.18 -2.41 -0.04 0.00 1.10 0.00 0.00 33.01 31.48 1oh3 s GLN 116 CO -0.07 0.59 1.89 0.34 -0.55 0.00 0.00 175.29 177.49 1oh3 s ASP 117 N -0.64 5.30 0.23 6.67 2.15 0.51 -1.29 116.67 129.60 1oh3 s ASP 117 Ca 0.09 -0.92 -0.07 0.00 0.43 0.00 0.00 52.55 52.08 1oh3 s ASP 117 Cb -0.11 -2.57 0.22 0.00 -0.30 0.00 0.00 42.92 40.16 1oh3 s ASP 117 CO 0.01 -2.63 1.88 0.00 -0.17 0.00 0.00 175.17 174.26 1oh3 h ALA 118 N 10.86 1.16 0.00 3.66 0.00 -1.76 -2.08 119.26 131.10 1oh3 h ALA 118 Ca 0.13 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1oh3 h ALA 118 Cb 0.99 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1oh3 h ALA 118 CO 1.24 0.62 0.00 -1.35 0.00 0.00 0.00 179.25 179.76 1oh3 h PRO 119 N 1.26 0.00 -0.92 0.00 0.11 -1.90 -3.48 132.00 127.07 1oh3 h PRO 119 Ca 0.33 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.22 1oh3 h PRO 119 Cb -0.05 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.00 1oh3 h PRO 119 CO -0.06 0.00 -0.23 0.41 -0.21 0.00 0.00 178.00 177.91 1oh3 n GLY 120 N 0.47 0.68 0.71 -0.55 0.00 -0.78 -4.92 105.19 100.79 1oh3 n GLY 120 Ca 0.03 -0.50 0.12 0.00 0.00 0.00 0.00 46.02 45.66 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 0.15 2.45 0.00 1.61 3.02 -1.26 -0.01 115.26 121.22 1oh3 n ASN 121 Ca -0.11 -1.73 0.00 0.00 -0.03 0.00 0.00 54.58 52.71 1oh3 n ASN 121 Cb 0.45 0.24 0.00 0.00 -0.61 0.00 0.00 39.78 39.86 1oh3 n ASN 121 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1oh3 n GLY 122 N 1.38 0.92 3.74 7.41 0.00 -1.26 -4.50 105.19 112.88 1oh3 n GLY 122 Ca 0.12 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.04 6.36 0.51 1.61 1.01 -1.26 -4.38 116.67 118.47 1oh3 s ASP 123 Ca 0.00 2.95 -0.17 0.00 0.71 0.00 0.00 52.55 56.03 1oh3 s ASP 123 Cb 0.00 -2.63 -0.08 0.00 1.01 0.00 0.00 42.92 41.22 1oh3 s ASP 123 CO 0.00 -0.94 0.99 -0.13 0.21 0.00 0.00 175.17 175.30 1oh3 s ARG 124 N -0.11 3.92 -0.04 8.23 0.52 -1.26 -4.50 118.95 125.70 1oh3 s ARG 124 Ca 0.66 1.04 0.02 0.00 -0.52 0.00 0.00 55.73 56.94 1oh3 s ARG 124 Cb -0.49 -2.13 0.01 0.00 0.52 0.00 0.00 34.95 32.86 1oh3 s ARG 124 CO 0.44 -0.30 -0.10 0.42 0.02 0.00 0.00 175.30 175.78 1oh3 s ILE 125 N -2.49 0.92 -0.10 1.52 1.01 -0.89 -1.54 121.20 119.63 1oh3 s ILE 125 Ca 0.60 -0.40 0.03 0.00 0.00 0.00 0.00 60.65 60.89 1oh3 s ILE 125 Cb -0.11 -0.83 0.01 0.00 0.01 0.00 0.00 42.46 41.54 1oh3 s ILE 125 CO 0.28 0.29 -0.20 0.26 0.00 0.00 0.00 174.94 175.56 1oh3 s TRP 126 N 0.38 2.28 -0.03 3.97 0.51 -0.20 -0.30 118.94 125.55 1oh3 s TRP 126 Ca -0.07 -0.96 0.03 0.00 -2.12 0.00 0.00 56.10 52.98 1oh3 s TRP 126 Cb -0.12 -1.56 0.00 0.00 -0.81 0.00 0.00 33.47 30.99 1oh3 s TRP 126 CO 0.01 -0.41 -0.11 0.42 -0.51 0.00 0.00 176.95 176.35 1oh3 s ILE 127 N 0.51 0.96 0.12 2.03 1.01 -0.02 -1.78 121.20 124.03 1oh3 s ILE 127 Ca -0.16 -0.46 0.01 0.00 0.00 0.00 0.00 60.65 60.04 1oh3 s ILE 127 Cb -0.17 -0.85 -0.04 0.00 0.01 0.00 0.00 42.46 41.41 1oh3 s ILE 127 CO 0.06 0.29 -0.02 -0.54 0.00 0.00 0.00 174.94 174.73 1oh3 s LYS 128 N 0.16 0.89 -1.18 2.79 1.02 -0.43 -1.22 119.74 121.76 1oh3 s LYS 128 Ca -0.03 -1.39 -0.01 0.00 0.02 0.00 0.00 55.97 54.55 1oh3 s LYS 128 Cb -0.09 -0.08 -0.01 0.00 -0.52 0.00 0.00 37.83 37.12 1oh3 s LYS 128 CO 0.01 -0.10 0.95 0.09 -0.92 0.00 0.00 175.35 175.38 1oh3 n ASN 129 N -0.08 -2.82 -4.64 2.83 3.02 -0.20 -0.95 115.26 112.43 1oh3 n ASN 129 Ca -0.10 -0.66 -0.41 0.00 -0.03 0.00 0.00 54.58 53.38 1oh3 n ASN 129 Cb 0.62 -5.01 -0.05 0.00 -0.61 0.00 0.00 39.78 34.73 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 -6.22 4.10 -0.01 3.41 2.96 0.33 -3.81 118.68 119.44 1oh3 s LEU 130 Ca 0.09 0.90 0.00 0.00 -0.22 0.00 0.00 54.13 54.90 1oh3 s LEU 130 Cb -0.01 -3.02 0.01 0.00 0.50 0.00 0.00 46.19 43.67 1oh3 s LEU 130 CO 0.74 -0.41 0.01 -0.69 -1.32 0.00 0.00 176.35 174.68 1oh3 s VAL 131 N 2.47 0.01 -0.08 1.68 1.01 -0.16 -0.67 120.40 124.65 1oh3 s VAL 131 Ca 0.31 0.05 -0.05 0.00 0.00 0.00 0.00 61.98 62.29 1oh3 s VAL 131 Cb -0.16 -0.05 -0.04 0.00 0.00 0.00 0.00 36.38 36.14 1oh3 s VAL 131 CO 0.09 0.03 0.12 -2.28 0.00 0.00 0.00 175.10 173.06 1oh3 s HIS 132 N 0.30 3.49 0.05 5.22 2.46 0.24 -0.91 115.29 126.13 1oh3 s HIS 132 Ca -0.02 0.41 0.08 0.00 0.47 0.00 0.00 55.06 55.99 1oh3 s HIS 132 Cb -0.04 -1.87 -0.03 0.00 -0.13 0.00 0.00 32.58 30.51 1oh3 s HIS 132 CO -0.01 0.66 -0.23 0.45 -2.47 0.00 0.00 174.74 173.14 1oh3 s SER 133 N -1.30 3.45 0.34 9.88 0.15 -0.41 -0.05 113.70 125.76 1oh3 s SER 133 Ca 0.18 -0.52 0.27 0.00 0.70 0.00 0.00 55.95 56.58 1oh3 s SER 133 Cb -0.12 -0.43 0.97 0.00 -1.71 0.00 0.00 66.02 64.73 1oh3 s SER 133 CO 0.08 0.25 1.78 0.71 1.20 0.00 0.00 173.24 177.27 1oh3 h THR 134 N 4.09 0.00 -5.45 6.45 1.35 -1.61 -0.64 112.91 117.11 1oh3 h THR 134 Ca -0.47 -0.44 -0.40 0.00 -0.55 0.00 0.00 66.41 64.55 1oh3 h THR 134 Cb 1.15 1.33 0.06 0.00 -1.73 0.00 0.00 68.15 68.96 1oh3 h THR 134 CO 0.45 0.00 0.06 0.61 -0.25 0.00 0.00 175.52 176.39 1oh3 n GLY 135 N 0.42 0.96 3.85 5.82 0.00 -1.26 -3.71 105.19 111.28 1oh3 n GLY 135 Ca 0.03 -2.06 -0.31 0.00 0.00 0.00 0.00 46.02 43.68 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 -4.38 5.47 0.17 1.61 1.04 -1.26 -2.39 113.70 113.95 1oh3 s SER 136 Ca 0.56 1.35 -0.13 0.00 0.48 0.00 0.00 55.95 58.21 1oh3 s SER 136 Cb -0.03 -2.23 0.07 0.00 0.10 0.00 0.00 66.02 63.92 1oh3 s SER 136 CO 0.37 -1.35 1.74 0.00 0.98 0.00 0.00 173.24 174.97 1oh3 h ALA 137 N -0.66 0.74 -0.55 5.32 0.00 -1.88 -1.56 119.26 120.67 1oh3 h ALA 137 Ca -0.45 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.39 1oh3 h ALA 137 Cb 1.23 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1oh3 h ALA 137 CO 0.61 0.33 0.37 -0.44 0.00 0.00 0.00 179.25 180.12 1oh3 h ASP 138 N 0.78 0.39 0.10 0.00 5.19 -1.93 -2.25 116.42 118.70 1oh3 h ASP 138 Ca 0.19 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.61 1oh3 h ASP 138 Cb 0.16 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.59 1oh3 h ASP 138 CO -0.02 0.25 -0.21 0.47 -3.12 0.00 0.00 179.24 176.61 1oh3 n ASP 139 N -4.47 1.51 -4.66 6.45 8.00 -0.91 -4.95 116.55 117.52 1oh3 n ASP 139 Ca 0.08 -1.26 -0.42 0.00 0.71 0.00 0.00 54.79 53.90 1oh3 n ASP 139 Cb 0.30 0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.51 1oh3 n ASP 139 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1oh3 n PHE 140 N -0.14 2.49 -3.59 1.24 -0.00 -0.64 -4.91 117.46 111.91 1oh3 n PHE 140 Ca 0.14 -0.35 -0.41 0.00 -0.00 0.00 0.00 57.45 56.83 1oh3 n PHE 140 Cb 0.39 -2.80 -0.11 0.00 -0.00 0.00 0.00 39.48 36.97 1oh3 n PHE 140 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 1oh3 s VAL 141 N 4.58 4.48 -0.23 -2.13 1.01 -1.26 -5.05 120.40 121.81 1oh3 s VAL 141 Ca 0.90 -1.04 -0.29 0.00 0.00 0.00 0.00 61.98 61.55 1oh3 s VAL 141 Cb -0.45 -3.58 -0.01 0.00 0.00 0.00 0.00 36.38 32.34 1oh3 s VAL 141 CO 0.42 -0.33 1.43 -0.62 0.00 0.00 0.00 175.10 176.00 1oh3 s ASP 142 N 1.76 6.62 0.24 3.32 -1.08 -1.26 -4.88 116.67 121.39 1oh3 s ASP 142 Ca 0.02 1.50 0.25 0.00 -0.52 0.00 0.00 52.55 53.81 1oh3 s ASP 142 Cb -0.21 -2.54 0.88 0.00 -1.46 0.00 0.00 42.92 39.60 1oh3 s ASP 142 CO 0.05 -1.07 1.75 -0.81 0.52 0.00 0.00 175.17 175.61 1oh3 n PRO 143 N 7.30 0.24 0.00 4.34 -0.04 -1.26 -5.29 135.00 140.29 1oh3 n PRO 143 Ca 0.16 0.31 0.16 0.00 -0.04 0.00 0.00 63.50 64.09 1oh3 n PRO 143 Cb 0.46 -1.85 0.89 0.00 -0.04 0.00 0.00 33.50 32.95 1oh3 n PRO 143 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57