#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ozb s VAL 17 N 0.00 -0.02 -0.29 0.58 1.01 0.21 -4.97 120.40 116.93 1ozb s VAL 17 Ca 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 61.98 62.03 1ozb s VAL 17 Cb 0.00 -0.45 0.12 0.00 0.00 0.00 0.00 36.38 36.05 1ozb s VAL 17 CO 0.00 0.03 0.23 -0.22 0.00 0.00 0.00 175.10 175.13 1ozb s LEU 18 N 0.74 0.06 0.03 3.92 2.96 -1.23 -0.97 118.68 124.19 1ozb s LEU 18 Ca -0.05 -0.94 0.05 0.00 -0.22 0.00 0.00 54.13 52.98 1ozb s LEU 18 Cb -0.06 0.17 -0.02 0.00 0.50 0.00 0.00 46.19 46.78 1ozb s LEU 18 CO -0.05 -0.41 -0.16 -1.58 -1.32 0.00 0.00 176.35 172.84 1ozb s GLN 19 N 2.26 1.11 -0.25 1.98 2.00 -0.40 -4.97 119.66 121.39 1ozb s GLN 19 Ca 0.09 -0.75 -0.17 0.00 -2.00 0.00 0.00 55.36 52.52 1ozb s GLN 19 Cb -0.15 -1.13 -0.03 0.00 0.80 0.00 0.00 33.01 32.50 1ozb s GLN 19 CO -0.33 0.29 0.48 -1.50 -0.50 0.00 0.00 175.29 173.73 1ozb s ILE 20 N -0.73 5.10 -0.16 -2.34 1.10 -1.26 -0.21 121.20 122.71 1ozb s ILE 20 Ca 0.04 0.83 -0.02 0.00 -0.51 0.00 0.00 60.65 60.99 1ozb s ILE 20 Cb -0.08 -3.80 -0.23 0.00 0.15 0.00 0.00 42.46 38.50 1ozb s ILE 20 CO 0.01 0.13 0.20 1.67 -2.11 0.00 0.00 174.94 174.84 1ozb n GLN 21 N 5.28 0.72 -3.64 3.50 7.27 0.81 -4.96 117.38 126.36 1ozb n GLN 21 Ca -0.05 0.22 -0.11 0.00 0.07 0.00 0.00 57.00 57.13 1ozb n GLN 21 Cb 0.50 -1.65 -0.07 0.00 2.41 0.00 0.00 30.24 31.43 1ozb n GLN 21 CO 0.00 0.00 0.00 0.50 0.07 0.00 0.00 177.06 177.63 1ozb s ARG 22 N -2.55 0.65 -0.15 3.69 3.52 -1.14 -4.97 118.95 118.01 1ozb s ARG 22 Ca -0.25 0.83 0.01 0.00 -0.13 0.00 0.00 55.73 56.19 1ozb s ARG 22 Cb 0.07 0.29 0.00 0.00 -1.56 0.00 0.00 34.95 33.76 1ozb s ARG 22 CO 0.72 -0.09 -0.17 0.42 -0.81 0.00 0.00 175.30 175.38 1ozb s ILE 23 N 0.49 2.50 0.21 4.11 1.01 -1.26 -0.64 121.20 127.62 1ozb s ILE 23 Ca -0.00 -0.83 -0.17 0.00 0.00 0.00 0.00 60.65 59.65 1ozb s ILE 23 Cb -0.05 -2.04 0.02 0.00 0.01 0.00 0.00 42.46 40.41 1ozb s ILE 23 CO -0.05 0.53 0.52 -0.72 0.00 0.00 0.00 174.94 175.22 1ozb s TYR 24 N 0.76 -0.03 -0.20 3.97 -0.85 -0.51 -5.00 117.35 115.49 1ozb s TYR 24 Ca -0.07 -0.32 -0.08 0.00 -0.52 0.00 0.00 57.07 56.08 1ozb s TYR 24 Cb -0.16 0.37 -0.04 0.00 0.38 0.00 0.00 41.96 42.51 1ozb s TYR 24 CO 0.00 -0.94 0.09 0.08 -1.52 0.00 0.00 175.55 173.26 1ozb s VAL 25 N -3.90 4.94 -0.11 -3.49 1.01 -1.26 -0.38 120.40 117.20 1ozb s VAL 25 Ca 0.11 0.02 0.06 0.00 0.00 0.00 0.00 61.98 62.18 1ozb s VAL 25 Cb -0.01 -3.25 -0.24 0.00 0.00 0.00 0.00 36.38 32.89 1ozb s VAL 25 CO -0.00 0.43 0.39 0.29 0.00 0.00 0.00 175.10 176.22 1ozb n LYS 26 N 3.71 0.68 -3.72 2.72 5.02 -0.52 -4.97 118.16 121.08 1ozb n LYS 26 Ca -0.16 0.23 -0.13 0.00 -2.02 0.00 0.00 58.31 56.22 1ozb n LYS 26 Cb 0.52 -1.70 -0.10 0.00 -0.02 0.00 0.00 35.03 33.73 1ozb n LYS 26 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ozb s ASP 27 N -6.34 -0.45 -0.02 4.39 2.15 -1.23 -5.02 116.67 110.15 1ozb s ASP 27 Ca -0.14 0.87 -0.02 0.00 0.43 0.00 0.00 52.55 53.69 1ozb s ASP 27 Cb 0.07 0.89 0.00 0.00 -0.30 0.00 0.00 42.92 43.58 1ozb s ASP 27 CO 0.79 -0.15 0.06 -0.69 -0.17 0.00 0.00 175.17 175.00 1ozb s VAL 28 N 0.22 0.01 -0.17 1.11 1.01 -1.26 -0.87 120.40 120.45 1ozb s VAL 28 Ca -0.00 -0.12 -0.10 0.00 0.00 0.00 0.00 61.98 61.76 1ozb s VAL 28 Cb -0.03 -0.13 0.06 0.00 0.00 0.00 0.00 36.38 36.28 1ozb s VAL 28 CO 0.01 -0.06 0.41 -0.55 0.00 0.00 0.00 175.10 174.90 1ozb s SER 29 N -0.17 -0.50 -0.07 3.32 0.15 -0.03 -5.00 113.70 111.40 1ozb s SER 29 Ca -0.02 0.88 -0.03 0.00 0.70 0.00 0.00 55.95 57.48 1ozb s SER 29 Cb -0.02 0.79 0.04 0.00 -1.71 0.00 0.00 66.02 65.12 1ozb s SER 29 CO 0.00 -0.18 0.14 0.12 1.20 0.00 0.00 173.24 174.52 1ozb s PHE 30 N 1.18 -0.15 -0.03 3.44 5.36 -1.26 -0.33 117.98 126.20 1ozb s PHE 30 Ca -0.08 0.51 0.03 0.00 -0.96 0.00 0.00 56.93 56.43 1ozb s PHE 30 Cb -0.07 -0.18 0.00 0.00 -0.34 0.00 0.00 43.02 42.43 1ozb s PHE 30 CO -0.10 -0.21 -0.10 -1.21 -1.46 0.00 0.00 175.22 172.14 1ozb s GLU 31 N 1.68 1.05 -0.53 10.12 2.02 0.15 -4.98 118.70 128.22 1ozb s GLU 31 Ca -0.04 -0.34 0.05 0.00 0.02 0.00 0.00 54.97 54.66 1ozb s GLU 31 Cb -0.12 -0.97 0.18 0.00 0.10 0.00 0.00 34.13 33.32 1ozb s GLU 31 CO -0.06 0.13 0.44 0.00 0.02 0.00 0.00 175.26 175.79 1ozb n ALA 32 N 3.27 3.09 -0.15 5.21 0.00 -1.26 -0.73 120.51 129.93 1ozb n ALA 32 Ca -0.18 -3.74 -0.03 0.00 0.00 0.00 0.00 53.44 49.50 1ozb n ALA 32 Cb 0.54 -0.86 0.06 0.00 0.00 0.00 0.00 19.45 19.19 1ozb n ALA 32 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1ozb h PRO 33 N 5.27 0.24 -1.91 0.00 0.11 -1.83 -3.27 132.00 130.59 1ozb h PRO 33 Ca 0.20 -0.01 -0.68 0.00 0.11 0.00 0.00 66.00 65.62 1ozb h PRO 33 Cb 0.84 -0.05 -0.24 0.00 0.11 0.00 0.00 31.00 31.65 1ozb h PRO 33 CO 0.53 0.16 0.85 0.09 -0.21 0.00 0.00 178.00 179.42 1ozb n ASN 34 N -5.10 7.23 -4.81 -2.05 3.02 -1.26 -4.95 115.26 107.33 1ozb n ASN 34 Ca 0.05 -3.64 -0.31 0.00 -0.03 0.00 0.00 54.58 50.66 1ozb n ASN 34 Cb 0.23 -1.11 -0.06 0.00 -0.61 0.00 0.00 39.78 38.24 1ozb n ASN 34 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ozb s LEU 35 N -3.47 3.95 0.00 3.41 1.43 -1.24 -1.12 118.68 121.65 1ozb s LEU 35 Ca 0.54 0.07 0.26 0.00 -1.03 0.00 0.00 54.13 53.97 1ozb s LEU 35 Cb 0.42 -2.61 0.61 0.00 0.03 0.00 0.00 46.19 44.64 1ozb s LEU 35 CO -0.32 0.17 1.48 -0.81 0.23 0.00 0.00 176.35 177.10 1ozb n PRO 36 N 0.41 1.51 -0.11 1.29 -0.04 -1.26 -4.91 135.00 131.90 1ozb n PRO 36 Ca -0.08 -1.05 0.07 0.00 -0.04 0.00 0.00 63.50 62.40 1ozb n PRO 36 Cb 0.51 -1.48 0.40 0.00 -0.04 0.00 0.00 33.50 32.90 1ozb n PRO 36 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 1ozb h HIS 37 N 2.57 0.63 0.00 0.54 2.07 -1.98 -2.12 115.15 116.86 1ozb h HIS 37 Ca 0.00 0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.54 1ozb h HIS 37 Cb 0.65 -0.21 0.00 0.00 2.57 0.00 0.00 27.41 30.43 1ozb h HIS 37 CO 0.00 0.34 0.05 0.97 -3.07 0.00 0.00 177.93 176.23 1ozb h ILE 38 N 0.63 0.00 0.00 6.12 2.10 -1.47 0.11 117.51 125.00 1ozb h ILE 38 Ca 0.26 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.20 1ozb h ILE 38 Cb 0.22 0.76 0.00 0.00 -1.09 0.00 0.00 36.82 36.71 1ozb h ILE 38 CO -0.08 0.00 0.00 0.49 -1.08 0.00 0.00 178.15 177.48 1ozb n PHE 39 N -2.75 0.00 1.02 2.19 0.99 -0.79 -2.39 117.46 115.73 1ozb n PHE 39 Ca -0.02 0.00 0.11 0.00 -0.00 0.00 0.00 57.45 57.54 1ozb n PHE 39 Cb 0.11 -0.42 0.05 0.00 -1.00 0.00 0.00 39.48 38.22 1ozb n PHE 39 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 1ozb n GLN 40 N -1.42 0.23 -2.22 -1.08 6.02 0.40 -4.93 117.38 114.38 1ozb n GLN 40 Ca 0.06 -0.17 -0.28 0.00 -0.01 0.00 0.00 57.00 56.59 1ozb n GLN 40 Cb 0.18 -1.50 0.03 0.00 1.02 0.00 0.00 30.24 29.97 1ozb n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1ozb s GLN 41 N -2.89 3.12 0.03 -1.09 -0.21 -1.01 -5.01 119.66 112.61 1ozb s GLN 41 Ca 0.12 0.27 -0.30 0.00 0.02 0.00 0.00 55.36 55.47 1ozb s GLN 41 Cb 0.17 -2.19 -0.05 0.00 1.00 0.00 0.00 33.01 31.93 1ozb s GLN 41 CO 0.75 -0.68 1.24 -1.21 -2.12 0.00 0.00 175.29 173.27 1ozb s GLU 42 N -5.07 4.39 -1.17 2.91 2.02 -1.26 -4.90 118.70 115.61 1ozb s GLU 42 Ca 0.54 1.80 -0.23 0.00 0.02 0.00 0.00 54.97 57.10 1ozb s GLU 42 Cb -0.11 -3.41 -0.08 0.00 0.10 0.00 0.00 34.13 30.64 1ozb s GLU 42 CO 0.48 -0.35 1.93 -0.46 0.02 0.00 0.00 175.26 176.88 1ozb s TRP 43 N 1.45 1.98 -0.80 1.61 -0.11 -1.26 -4.78 118.94 117.03 1ozb s TRP 43 Ca 0.59 0.39 0.02 0.00 1.22 0.00 0.00 56.10 58.32 1ozb s TRP 43 Cb -0.29 -4.04 0.20 0.00 -1.50 0.00 0.00 33.47 27.84 1ozb s TRP 43 CO 0.27 -1.26 0.64 1.63 -4.62 0.00 0.00 176.95 173.61 1ozb n LYS 44 N 8.33 2.24 -2.26 5.86 5.02 -1.26 -5.09 118.16 131.00 1ozb n LYS 44 Ca 0.45 -4.50 -0.41 0.00 -2.02 0.00 0.00 58.31 51.83 1ozb n LYS 44 Cb 0.47 -2.35 -0.03 0.00 -0.02 0.00 0.00 35.03 33.10 1ozb n LYS 44 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1ozb s PRO 45 N -1.48 4.47 -0.25 1.97 0.04 -1.26 -0.71 135.00 137.77 1ozb s PRO 45 Ca 0.27 2.05 0.01 0.00 0.04 0.00 0.00 61.00 63.36 1ozb s PRO 45 Cb -0.05 -3.13 0.07 0.00 0.04 0.00 0.00 34.50 31.43 1ozb s PRO 45 CO -0.15 -0.04 -0.03 0.21 0.04 0.00 0.00 177.00 177.03 1ozb s LYS 46 N -1.48 1.54 -0.21 4.56 2.20 0.21 -4.85 119.74 121.71 1ozb s LYS 46 Ca 0.48 -1.09 -0.17 0.00 -0.36 0.00 0.00 55.97 54.83 1ozb s LYS 46 Cb -0.36 -2.60 -0.03 0.00 -1.51 0.00 0.00 37.83 33.32 1ozb s LYS 46 CO 0.47 -0.66 0.46 -1.17 -0.36 0.00 0.00 175.35 174.09 1ozb s LEU 47 N 1.36 4.13 -0.23 5.43 2.96 -1.26 -1.40 118.68 129.67 1ozb s LEU 47 Ca -0.03 0.58 -0.06 0.00 -0.22 0.00 0.00 54.13 54.40 1ozb s LEU 47 Cb -0.19 -2.61 -0.02 0.00 0.50 0.00 0.00 46.19 43.87 1ozb s LEU 47 CO -0.08 -0.15 0.02 -0.83 -1.32 0.00 0.00 176.35 173.99 1ozb s GLY 48 N 1.18 1.71 -0.15 7.98 0.00 0.20 -4.97 107.32 113.28 1ozb s GLY 48 Ca 0.21 -1.09 0.00 0.00 0.00 0.00 0.00 44.72 43.85 1ozb s GLY 48 CO 0.09 0.41 -0.14 -0.12 0.00 0.00 0.00 173.10 173.34 1ozb s PHE 49 N 1.38 2.19 -0.01 1.90 5.36 -1.26 -0.29 117.98 127.24 1ozb s PHE 49 Ca 0.05 -1.25 0.06 0.00 -0.96 0.00 0.00 56.93 54.83 1ozb s PHE 49 Cb -0.15 -1.60 -0.03 0.00 -0.34 0.00 0.00 43.02 40.91 1ozb s PHE 49 CO 0.01 -0.68 -0.19 -0.51 -1.46 0.00 0.00 175.22 172.40 1ozb s ASP 50 N 1.48 3.70 -0.01 6.13 1.01 0.98 -4.98 116.67 124.98 1ozb s ASP 50 Ca 0.04 -0.35 -0.10 0.00 0.71 0.00 0.00 52.55 52.86 1ozb s ASP 50 Cb -0.13 -0.63 0.01 0.00 1.01 0.00 0.00 42.92 43.17 1ozb s ASP 50 CO -0.10 0.31 0.20 -0.22 0.21 0.00 0.00 175.17 175.56 1ozb s LEU 51 N -0.95 1.30 -0.04 1.23 0.20 -1.26 -0.37 118.68 118.79 1ozb s LEU 51 Ca 0.12 -0.08 -0.30 0.00 0.69 0.00 0.00 54.13 54.56 1ozb s LEU 51 Cb -0.10 0.87 0.11 0.00 -0.43 0.00 0.00 46.19 46.64 1ozb s LEU 51 CO 0.02 -0.38 0.94 -0.94 -0.29 0.00 0.00 176.35 175.70 1ozb s SER 52 N -1.29 -0.33 0.10 3.68 1.04 -0.61 -5.01 113.70 111.28 1ozb s SER 52 Ca -0.14 0.03 0.03 0.00 0.48 0.00 0.00 55.95 56.34 1ozb s SER 52 Cb -0.07 0.34 -0.04 0.00 0.10 0.00 0.00 66.02 66.36 1ozb s SER 52 CO 0.02 -0.54 -0.08 0.42 0.98 0.00 0.00 173.24 174.04 1ozb s THR 53 N -2.88 0.81 -0.12 2.02 -4.23 -1.26 0.41 115.64 110.38 1ozb s THR 53 Ca 0.05 -1.88 -0.16 0.00 -1.18 0.00 0.00 61.69 58.52 1ozb s THR 53 Cb -0.01 -1.63 0.04 0.00 1.34 0.00 0.00 72.50 72.24 1ozb s THR 53 CO -0.08 -0.79 0.42 -1.83 -0.54 0.00 0.00 174.62 171.80 1ozb s GLU 54 N -3.59 0.58 0.23 3.99 -1.05 -0.59 -4.99 118.70 113.28 1ozb s GLU 54 Ca 0.11 0.40 0.10 0.00 -0.15 0.00 0.00 54.97 55.43 1ozb s GLU 54 Cb 0.03 0.27 -0.04 0.00 -0.44 0.00 0.00 34.13 33.95 1ozb s GLU 54 CO -0.03 -0.11 -0.13 0.99 0.95 0.00 0.00 175.26 176.94 1ozb s THR 55 N -0.21 2.90 -0.16 1.83 2.01 -1.26 -0.62 115.64 120.14 1ozb s THR 55 Ca -0.04 -1.99 -0.07 0.00 0.31 0.00 0.00 61.69 59.90 1ozb s THR 55 Cb -0.03 -2.48 0.06 0.00 0.01 0.00 0.00 72.50 70.06 1ozb s THR 55 CO 0.02 -0.25 0.36 -0.89 -0.69 0.00 0.00 174.62 173.17 1ozb s THR 56 N -2.06 -0.21 -0.10 -0.82 2.01 -0.54 -4.99 115.64 108.92 1ozb s THR 56 Ca 0.27 0.15 -0.30 0.00 0.31 0.00 0.00 61.69 62.12 1ozb s THR 56 Cb -0.07 -0.55 -0.02 0.00 0.01 0.00 0.00 72.50 71.87 1ozb s THR 56 CO 0.15 0.06 1.11 -1.58 -0.69 0.00 0.00 174.62 173.67 1ozb s GLN 57 N 1.77 4.37 -0.02 4.92 0.74 -1.26 0.01 119.66 130.19 1ozb s GLN 57 Ca -0.06 1.53 0.06 0.00 0.05 0.00 0.00 55.36 56.93 1ozb s GLN 57 Cb -0.10 -3.57 0.16 0.00 1.10 0.00 0.00 33.01 30.60 1ozb s GLN 57 CO -0.11 -0.42 1.13 1.55 -0.55 0.00 0.00 175.29 176.88 1ozb n VAL 58 N 4.69 1.12 -1.89 1.34 3.14 0.65 -4.92 118.33 122.46 1ozb n VAL 58 Ca 0.10 -1.12 0.00 0.00 -2.96 0.00 0.00 64.34 60.36 1ozb n VAL 58 Cb 0.47 0.42 0.00 0.00 -1.06 0.00 0.00 33.84 33.67 1ozb n VAL 58 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1ozb n GLY 59 N -0.17 -1.55 3.62 7.55 0.00 -0.99 -4.94 105.19 108.72 1ozb n GLY 59 Ca 0.06 -1.05 -0.43 0.00 0.00 0.00 0.00 46.02 44.61 1ozb n GLY 59 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ozb s ASP 60 N -2.22 6.34 -1.06 1.61 1.11 -1.26 -2.37 116.67 118.83 1ozb s ASP 60 Ca 0.00 1.47 0.00 0.00 0.18 0.00 0.00 52.55 54.20 1ozb s ASP 60 Cb 0.00 -2.53 0.00 0.00 1.07 0.00 0.00 42.92 41.46 1ozb s ASP 60 CO 0.00 -1.31 0.00 0.47 1.18 0.00 0.00 175.17 175.51 1ozb n ASP 61 N 8.63 -5.29 -4.28 0.27 10.43 -1.26 -4.96 116.55 120.09 1ozb n ASP 61 Ca 0.19 0.25 -0.35 0.00 2.57 0.00 0.00 54.79 57.45 1ozb n ASP 61 Cb 0.46 -3.67 -0.14 0.00 1.84 0.00 0.00 41.12 39.60 1ozb n ASP 61 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1ozb s LEU 62 N -2.27 2.75 -0.02 0.64 1.43 -1.00 -0.50 118.68 119.70 1ozb s LEU 62 Ca 0.00 -0.43 0.04 0.00 -1.03 0.00 0.00 54.13 52.71 1ozb s LEU 62 Cb 0.00 -1.68 -0.01 0.00 0.03 0.00 0.00 46.19 44.53 1ozb s LEU 62 CO 0.00 -0.00 -0.14 -0.31 0.23 0.00 0.00 176.35 176.12 1ozb s TYR 63 N 1.37 1.33 -0.31 0.29 1.51 -0.08 -0.25 117.35 121.21 1ozb s TYR 63 Ca 0.05 -0.28 -0.11 0.00 -1.01 0.00 0.00 57.07 55.72 1ozb s TYR 63 Cb -0.14 -0.87 -0.02 0.00 -0.11 0.00 0.00 41.96 40.82 1ozb s TYR 63 CO -0.04 -0.05 0.18 -2.00 -1.11 0.00 0.00 175.55 172.53 1ozb s GLU 64 N -0.23 3.56 -0.21 -0.62 2.12 0.10 -0.11 118.70 123.31 1ozb s GLU 64 Ca 0.03 -0.58 -0.09 0.00 0.36 0.00 0.00 54.97 54.69 1ozb s GLU 64 Cb -0.07 -3.65 -0.05 0.00 0.26 0.00 0.00 34.13 30.63 1ozb s GLU 64 CO -0.00 -0.35 0.12 0.08 -0.54 0.00 0.00 175.26 174.57 1ozb s VAL 65 N 1.69 5.18 -0.14 3.70 1.01 0.27 -1.47 120.40 130.64 1ozb s VAL 65 Ca 0.06 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.15 1ozb s VAL 65 Cb -0.17 -3.38 -0.01 0.00 0.00 0.00 0.00 36.38 32.83 1ozb s VAL 65 CO 0.09 0.41 -0.14 -0.69 0.00 0.00 0.00 175.10 174.76 1ozb s VAL 66 N 0.66 2.88 -0.31 2.92 1.01 0.21 -1.66 120.40 126.12 1ozb s VAL 66 Ca 0.06 -0.71 -0.10 0.00 0.00 0.00 0.00 61.98 61.23 1ozb s VAL 66 Cb -0.12 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.04 1ozb s VAL 66 CO 0.01 0.52 0.15 -0.22 0.00 0.00 0.00 175.10 175.57 1ozb s LEU 67 N 0.54 4.10 -0.27 3.92 2.96 0.15 -1.54 118.68 128.54 1ozb s LEU 67 Ca -0.09 -0.48 -0.10 0.00 -0.22 0.00 0.00 54.13 53.24 1ozb s LEU 67 Cb -0.16 -2.01 -0.05 0.00 0.50 0.00 0.00 46.19 44.47 1ozb s LEU 67 CO 0.04 -0.18 0.17 0.20 -1.32 0.00 0.00 176.35 175.26 1ozb s ASN 68 N 1.63 5.94 -0.08 3.68 0.01 0.17 -1.23 114.94 125.05 1ozb s ASN 68 Ca 0.05 -0.01 0.03 0.00 -0.71 0.00 0.00 52.86 52.22 1ozb s ASN 68 Cb -0.17 -2.09 0.01 0.00 0.41 0.00 0.00 41.25 39.41 1ozb s ASN 68 CO 0.07 -0.02 -0.15 -0.63 -1.51 0.00 0.00 177.10 174.85 1ozb s ILE 69 N 1.60 1.38 -0.12 0.60 1.01 0.11 -1.57 121.20 124.22 1ozb s ILE 69 Ca 0.07 -0.61 0.03 0.00 0.00 0.00 0.00 60.65 60.13 1ozb s ILE 69 Cb -0.15 -1.24 0.01 0.00 0.01 0.00 0.00 42.46 41.08 1ozb s ILE 69 CO 0.09 0.41 -0.20 -0.55 0.00 0.00 0.00 174.94 174.69 1ozb s SER 70 N 0.65 2.88 -0.07 3.58 0.15 0.50 -0.30 113.70 121.08 1ozb s SER 70 Ca -0.14 -0.53 0.00 0.00 0.70 0.00 0.00 55.95 55.98 1ozb s SER 70 Cb -0.16 -1.32 0.02 0.00 -1.71 0.00 0.00 66.02 62.85 1ozb s SER 70 CO 0.04 0.09 -0.06 -0.69 1.20 0.00 0.00 173.24 173.82 1ozb s VAL 71 N 0.71 0.75 -0.07 4.45 1.01 0.12 -0.01 120.40 127.35 1ozb s VAL 71 Ca -0.11 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.70 1ozb s VAL 71 Cb -0.16 -0.77 0.02 0.00 0.00 0.00 0.00 36.38 35.46 1ozb s VAL 71 CO 0.02 0.29 -0.09 -0.70 0.00 0.00 0.00 175.10 174.62 1ozb s GLU 72 N 1.27 1.43 -0.10 2.72 2.12 0.60 0.50 118.70 127.23 1ozb s GLU 72 Ca -0.05 -0.30 0.04 0.00 0.36 0.00 0.00 54.97 55.02 1ozb s GLU 72 Cb -0.14 -1.27 0.00 0.00 0.26 0.00 0.00 34.13 32.99 1ozb s GLU 72 CO -0.02 -0.04 -0.23 0.99 -0.54 0.00 0.00 175.26 175.41 1ozb s THR 73 N 0.88 2.02 0.14 -1.70 2.01 -0.38 0.61 115.64 119.22 1ozb s THR 73 Ca -0.11 -0.99 0.07 0.00 0.31 0.00 0.00 61.69 60.97 1ozb s THR 73 Cb -0.15 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.57 1ozb s THR 73 CO 0.01 0.55 -0.17 0.42 -0.69 0.00 0.00 174.62 174.74 1ozb s THR 74 N 0.42 1.59 -0.19 -0.82 -4.23 -0.49 0.14 115.64 112.06 1ozb s THR 74 Ca -0.17 -1.77 -0.18 0.00 -1.18 0.00 0.00 61.69 58.39 1ozb s THR 74 Cb -0.18 -1.66 -0.03 0.00 1.34 0.00 0.00 72.50 71.97 1ozb s THR 74 CO 0.07 -0.31 0.50 -0.76 -0.54 0.00 0.00 174.62 173.58 1ozb s LEU 75 N -2.44 4.16 0.13 4.79 1.02 -0.75 0.68 118.68 126.27 1ozb s LEU 75 Ca 0.11 0.66 -0.20 0.00 0.02 0.00 0.00 54.13 54.73 1ozb s LEU 75 Cb -0.06 -2.68 -0.02 0.00 0.02 0.00 0.00 46.19 43.45 1ozb s LEU 75 CO 0.05 -0.15 1.72 -0.33 0.02 0.00 0.00 176.35 177.66 1ozb h GLU 76 N 7.38 0.05 -1.22 1.70 5.08 -1.25 0.29 114.58 126.61 1ozb h GLU 76 Ca -0.35 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 1ozb h GLU 76 Cb 1.16 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1ozb h GLU 76 CO 0.74 0.04 0.00 -0.40 -1.00 0.00 0.00 179.01 178.38 1ozb n ASP 77 N -5.15 1.68 0.00 1.42 3.85 -1.26 -3.41 116.55 113.68 1ozb n ASP 77 Ca -0.02 -1.28 0.00 0.00 -0.71 0.00 0.00 54.79 52.77 1ozb n ASP 77 Cb 0.11 -0.32 0.00 0.00 -1.35 0.00 0.00 41.12 39.56 1ozb n ASP 77 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 1ozb n SER 78 N 0.58 0.00 0.00 -1.12 3.41 -1.16 -5.02 113.62 110.32 1ozb n SER 78 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1ozb n SER 78 Cb 0.29 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 1ozb n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ozb n GLY 79 N -0.17 2.46 3.75 5.00 0.00 0.99 -4.99 105.19 112.23 1ozb n GLY 79 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1ozb n GLY 79 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ozb s ASP 80 N -3.69 5.29 -0.15 1.61 -0.00 -1.25 -4.68 116.67 113.81 1ozb s ASP 80 Ca 0.00 2.76 -0.29 0.00 -0.00 0.00 0.00 52.55 55.02 1ozb s ASP 80 Cb 0.00 -2.64 -0.01 0.00 -0.00 0.00 0.00 42.92 40.28 1ozb s ASP 80 CO 0.00 -1.55 1.01 -0.69 -0.00 0.00 0.00 175.17 173.93 1ozb s VAL 81 N -1.31 4.76 -0.12 -1.27 1.01 -1.26 -1.81 120.40 120.40 1ozb s VAL 81 Ca 0.71 2.02 -0.15 0.00 0.00 0.00 0.00 61.98 64.56 1ozb s VAL 81 Cb -0.40 -4.30 -0.13 0.00 0.00 0.00 0.00 36.38 31.54 1ozb s VAL 81 CO 0.48 -0.05 0.40 0.00 0.00 0.00 0.00 175.10 175.92 1ozb h ALA 82 N 7.22 -0.00 -2.20 5.51 0.00 -0.64 -3.39 119.26 125.75 1ozb h ALA 82 Ca -0.27 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 1ozb h ALA 82 Cb 1.12 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.74 1ozb h ALA 82 CO 0.89 -0.00 0.28 -0.59 0.00 0.00 0.00 179.25 179.83 1ozb s PHE 83 N -1.91 -0.56 -0.08 0.00 -0.12 -1.09 -4.49 117.98 109.74 1ozb s PHE 83 Ca -0.10 0.77 0.03 0.00 -0.05 0.00 0.00 56.93 57.59 1ozb s PHE 83 Cb -0.02 0.46 0.01 0.00 -0.63 0.00 0.00 43.02 42.85 1ozb s PHE 83 CO 0.35 -0.62 -0.18 0.42 -0.05 0.00 0.00 175.22 175.15 1ozb s ILE 84 N -1.98 1.54 -0.07 -4.49 1.01 0.09 -1.25 121.20 116.04 1ozb s ILE 84 Ca -0.05 -0.72 -0.00 0.00 0.00 0.00 0.00 60.65 59.87 1ozb s ILE 84 Cb -0.00 -1.36 0.03 0.00 0.01 0.00 0.00 42.46 41.14 1ozb s ILE 84 CO 0.01 0.44 -0.03 0.00 0.00 0.00 0.00 174.94 175.37 1ozb s GLU 86 N 1.60 2.87 -0.01 0.00 2.02 0.55 0.12 118.70 125.85 1ozb s GLU 86 Ca 0.00 -0.84 0.03 0.00 0.02 0.00 0.00 54.97 54.19 1ozb s GLU 86 Cb -0.13 -2.20 -0.01 0.00 0.10 0.00 0.00 34.13 31.89 1ozb s GLU 86 CO -0.04 0.19 -0.11 0.08 0.02 0.00 0.00 175.26 175.39 1ozb s VAL 87 N 0.32 0.88 -0.56 2.63 1.01 0.59 -0.85 120.40 124.42 1ozb s VAL 87 Ca -0.17 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 61.38 1ozb s VAL 87 Cb -0.17 -0.74 0.15 0.00 0.00 0.00 0.00 36.38 35.61 1ozb s VAL 87 CO 0.08 0.25 0.34 -0.75 0.00 0.00 0.00 175.10 175.03 1ozb s LYS 88 N -0.22 1.92 -0.11 2.72 2.20 -0.05 -0.71 119.74 125.49 1ozb s LYS 88 Ca 0.03 -2.71 -0.21 0.00 -0.36 0.00 0.00 55.97 52.72 1ozb s LYS 88 Cb -0.05 -3.00 -0.04 0.00 -1.51 0.00 0.00 37.83 33.24 1ozb s LYS 88 CO -0.00 -1.20 0.62 -1.14 -0.36 0.00 0.00 175.35 173.26 1ozb s GLN 89 N -0.55 4.36 0.33 4.03 2.00 -0.37 -1.44 119.66 128.02 1ozb s GLN 89 Ca 0.21 0.70 0.04 0.00 -2.00 0.00 0.00 55.36 54.30 1ozb s GLN 89 Cb -0.16 -3.47 -0.06 0.00 0.80 0.00 0.00 33.01 30.12 1ozb s GLN 89 CO -0.07 0.02 0.07 0.00 -0.50 0.00 0.00 175.29 174.80 1ozb s ALA 90 N 1.02 2.35 -0.16 1.58 0.00 0.49 0.32 121.76 127.34 1ozb s ALA 90 Ca 0.32 -1.98 -0.27 0.00 0.00 0.00 0.00 51.96 50.03 1ozb s ALA 90 Cb -0.16 0.70 0.07 0.00 0.00 0.00 0.00 23.12 23.72 1ozb s ALA 90 CO 0.14 -0.32 0.68 0.20 0.00 0.00 0.00 175.76 176.45 1ozb s GLY 91 N -3.48 -0.54 -0.23 0.00 0.00 -0.66 -1.42 107.32 100.99 1ozb s GLY 91 Ca 0.36 1.64 -0.08 0.00 0.00 0.00 0.00 44.72 46.64 1ozb s GLY 91 CO 0.15 1.33 0.08 0.14 0.00 0.00 0.00 173.10 174.81 1ozb s VAL 92 N -0.35 4.57 0.17 1.40 1.01 0.18 -0.56 120.40 126.82 1ozb s VAL 92 Ca -0.05 -0.09 0.10 0.00 0.00 0.00 0.00 61.98 61.94 1ozb s VAL 92 Cb -0.03 -3.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 1ozb s VAL 92 CO 0.05 0.36 -0.21 -0.36 0.00 0.00 0.00 175.10 174.94 1ozb s PHE 93 N 1.30 2.40 -0.36 5.22 0.40 0.85 -0.13 117.98 127.65 1ozb s PHE 93 Ca 0.05 -0.32 -0.13 0.00 -0.60 0.00 0.00 56.93 55.93 1ozb s PHE 93 Cb -0.15 -1.22 0.01 0.00 0.51 0.00 0.00 43.02 42.17 1ozb s PHE 93 CO 0.04 0.45 0.24 0.99 0.70 0.00 0.00 175.22 177.64 1ozb s THR 94 N -1.46 5.03 -0.05 0.64 2.01 0.71 -0.90 115.64 121.61 1ozb s THR 94 Ca 0.20 -0.52 0.03 0.00 0.31 0.00 0.00 61.69 61.71 1ozb s THR 94 Cb -0.09 -3.69 0.00 0.00 0.01 0.00 0.00 72.50 68.73 1ozb s THR 94 CO 0.10 -0.14 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.11 1ozb s ILE 95 N 1.66 1.28 -0.06 1.82 1.01 0.34 -1.27 121.20 125.97 1ozb s ILE 95 Ca 0.05 -0.60 -0.29 0.00 0.00 0.00 0.00 60.65 59.80 1ozb s ILE 95 Cb -0.18 -1.13 0.10 0.00 0.01 0.00 0.00 42.46 41.26 1ozb s ILE 95 CO 0.09 0.38 0.83 -0.94 0.00 0.00 0.00 174.94 175.29 1ozb s SER 96 N 0.31 -0.49 0.00 3.58 1.04 -0.15 -4.61 113.70 113.38 1ozb s SER 96 Ca -0.09 0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.75 1ozb s SER 96 Cb -0.13 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.42 1ozb s SER 96 CO 0.03 -0.55 0.00 0.61 0.98 0.00 0.00 173.24 174.31 1ozb n GLY 97 N 0.51 0.78 2.95 7.32 0.00 -1.26 0.64 105.19 116.13 1ozb n GLY 97 Ca -0.14 -0.53 -0.15 0.00 0.00 0.00 0.00 46.02 45.20 1ozb n GLY 97 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ozb s LEU 98 N -1.19 2.02 0.69 0.99 1.43 -1.26 -4.54 118.68 116.82 1ozb s LEU 98 Ca 0.00 -0.11 -0.14 0.00 -1.03 0.00 0.00 54.13 52.85 1ozb s LEU 98 Cb 0.00 -0.23 0.02 0.00 0.03 0.00 0.00 46.19 46.00 1ozb s LEU 98 CO 0.00 0.04 1.10 -1.61 0.23 0.00 0.00 176.35 176.11 1ozb s GLU 99 N -0.19 2.66 0.26 1.70 8.01 -1.26 -4.60 118.70 125.28 1ozb s GLU 99 Ca 0.01 1.31 -0.01 0.00 0.01 0.00 0.00 54.97 56.29 1ozb s GLU 99 Cb -0.02 -1.94 0.58 0.00 -4.31 0.00 0.00 34.13 28.43 1ozb s GLU 99 CO -0.00 -1.35 1.37 -0.25 0.01 0.00 0.00 175.26 175.04 1ozb n ASP 100 N -2.74 -0.18 0.05 -0.19 10.43 -1.26 -0.67 116.55 122.00 1ozb n ASP 100 Ca 0.10 1.49 -0.19 0.00 2.57 0.00 0.00 54.79 58.76 1ozb n ASP 100 Cb 0.52 -0.51 -0.10 0.00 1.84 0.00 0.00 41.12 42.87 1ozb n ASP 100 CO 0.00 0.00 0.00 0.58 -1.07 0.00 0.00 177.20 176.71 1ozb h VAL 101 N 0.00 1.30 -0.57 2.53 2.07 -1.99 -2.01 116.25 117.59 1ozb h VAL 101 Ca 0.49 -2.32 0.06 0.00 0.82 0.00 0.00 66.70 65.75 1ozb h VAL 101 Cb 0.93 2.43 -0.05 0.00 -1.52 0.00 0.00 31.29 33.09 1ozb h VAL 101 CO -0.85 0.71 0.29 -0.61 0.02 0.00 0.00 177.57 177.13 1ozb h GLN 102 N 0.35 0.52 -0.49 1.57 5.75 -1.26 -0.56 115.11 120.98 1ozb h GLN 102 Ca -0.13 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.30 1ozb h GLN 102 Cb 1.71 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 30.12 1ozb h GLN 102 CO 0.20 0.35 0.15 1.98 -2.65 0.00 0.00 178.83 178.86 1ozb h MET 103 N 0.54 0.77 -0.73 1.69 4.05 -0.90 -1.67 114.93 118.68 1ozb h MET 103 Ca 0.26 -0.17 -0.02 0.00 -0.28 0.00 0.00 59.70 59.49 1ozb h MET 103 Cb 0.18 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 30.84 1ozb h MET 103 CO -0.19 0.73 0.39 0.00 0.23 0.00 0.00 176.91 178.07 1ozb h ALA 104 N 1.01 1.32 -0.44 0.39 0.00 -0.61 -0.46 119.26 120.48 1ozb h ALA 104 Ca 0.16 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 1ozb h ALA 104 Cb 0.28 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ozb h ALA 104 CO -0.00 0.55 -0.26 1.25 0.00 0.00 0.00 179.25 180.79 1ozb h HIS 105 N 1.01 1.10 -0.67 0.00 6.17 -0.88 -2.06 115.15 119.83 1ozb h HIS 105 Ca 0.26 -0.29 -0.06 0.00 0.71 0.00 0.00 60.37 60.99 1ozb h HIS 105 Cb 0.03 -0.25 -0.03 0.00 2.52 0.00 0.00 27.41 29.69 1ozb h HIS 105 CO 0.01 1.10 0.20 0.00 0.71 0.00 0.00 177.93 179.95 1ozb h LEU 107 N 0.98 0.00 -0.16 0.00 3.38 -1.04 -0.37 115.31 118.10 1ozb h LEU 107 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1ozb h LEU 107 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1ozb h LEU 107 CO -0.00 0.61 -0.51 0.35 0.09 0.00 0.00 178.44 178.98 1ozb n THR 108 N -3.43 0.00 0.05 0.22 -2.24 -0.78 -4.51 114.28 103.59 1ozb n THR 108 Ca 0.00 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1ozb n THR 108 Cb 0.71 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.97 1ozb n THR 108 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1ozb n SER 109 N -1.07 0.32 0.02 3.42 2.88 0.26 -4.64 113.62 114.81 1ozb n SER 109 Ca 0.03 0.15 -0.13 0.00 -1.33 0.00 0.00 58.87 57.58 1ozb n SER 109 Cb 0.21 -0.02 -0.07 0.00 -0.75 0.00 0.00 64.21 63.57 1ozb n SER 109 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1ozb h GLN 110 N 0.00 -0.52 0.44 -1.46 4.20 -1.40 -1.15 115.11 115.22 1ozb h GLN 110 Ca 0.00 0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.72 1ozb h GLN 110 Cb 0.00 0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.90 1ozb h GLN 110 CO 0.00 -0.35 -0.21 0.00 -0.67 0.00 0.00 178.83 177.60 1ozb h PRO 112 N -0.80 0.27 -0.51 0.00 0.11 -1.78 0.11 132.00 129.41 1ozb h PRO 112 Ca -0.06 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.99 1ozb h PRO 112 Cb 0.55 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.57 1ozb h PRO 112 CO 0.10 0.18 0.13 -0.97 -0.21 0.00 0.00 178.00 177.23 1ozb h ASN 113 N 0.28 0.71 0.39 -2.05 -0.73 -1.01 -0.10 115.58 113.08 1ozb h ASN 113 Ca 0.33 -0.12 -0.14 0.00 1.87 0.00 0.00 56.30 58.25 1ozb h ASN 113 Cb 0.91 -0.19 -0.01 0.00 0.27 0.00 0.00 38.32 39.30 1ozb h ASN 113 CO -0.08 0.70 -0.59 0.24 -0.37 0.00 0.00 177.43 177.33 1ozb h MET 114 N 0.75 0.20 0.00 6.67 2.86 -0.37 -3.15 114.93 121.87 1ozb h MET 114 Ca 0.17 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1ozb h MET 114 Cb 0.26 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.94 1ozb h MET 114 CO -0.00 0.73 -0.28 -0.07 1.06 0.00 0.00 176.91 178.34 1ozb h LEU 115 N 0.15 0.00 0.20 1.22 3.38 -0.77 -3.39 115.31 116.10 1ozb h LEU 115 Ca -0.00 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1ozb h LEU 115 Cb 1.07 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.79 1ozb h LEU 115 CO 0.09 0.00 -0.32 0.15 0.09 0.00 0.00 178.44 178.45 1ozb h PHE 116 N 0.00 -0.87 -0.34 1.13 3.57 -0.99 -2.27 116.94 117.17 1ozb h PHE 116 Ca 0.00 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.61 1ozb h PHE 116 Cb 0.99 0.35 -0.01 0.00 2.79 0.00 0.00 35.95 40.07 1ozb h PHE 116 CO 0.00 -0.44 0.34 -1.00 -2.23 0.00 0.00 178.31 174.98 1ozb h PRO 117 N -0.59 0.00 -0.10 6.41 0.13 -1.75 0.24 132.00 136.33 1ozb h PRO 117 Ca 0.01 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.92 1ozb h PRO 117 Cb 0.59 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.73 1ozb h PRO 117 CO -0.14 0.00 -0.79 1.88 -0.23 0.00 0.00 178.00 178.72 1ozb h TYR 118 N 0.00 0.99 -0.42 1.56 -1.99 -1.66 -2.57 116.97 112.87 1ozb h TYR 118 Ca 0.16 -0.47 -0.09 0.00 2.00 0.00 0.00 58.73 60.34 1ozb h TYR 118 Cb 0.84 -0.14 -0.02 0.00 2.00 0.00 0.00 36.73 39.41 1ozb h TYR 118 CO 0.00 1.29 -0.10 0.00 -0.00 0.00 0.00 178.16 179.35 1ozb h ALA 119 N 0.49 1.03 0.06 3.88 0.00 -0.41 -2.06 119.26 122.24 1ozb h ALA 119 Ca -0.07 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.54 1ozb h ALA 119 Cb 1.43 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1ozb h ALA 119 CO 0.16 0.59 -0.10 -0.09 0.00 0.00 0.00 179.25 179.81 1ozb h ARG 120 N 0.68 -0.19 -0.61 0.00 2.43 -0.62 -0.48 114.38 115.58 1ozb h ARG 120 Ca 0.12 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 1ozb h ARG 120 Cb 0.56 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.13 1ozb h ARG 120 CO 0.03 -0.13 0.30 1.49 -1.51 0.00 0.00 179.97 180.16 1ozb h GLU 121 N -0.20 0.86 -0.19 0.20 4.22 -1.30 0.01 114.58 118.19 1ozb h GLU 121 Ca 0.02 -0.11 -0.02 0.00 0.08 0.00 0.00 59.36 59.33 1ozb h GLU 121 Cb 0.21 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1ozb h GLU 121 CO -0.06 0.67 0.05 1.25 -2.18 0.00 0.00 179.01 178.74 1ozb h LEU 122 N 0.86 0.29 -0.26 1.64 5.85 -0.93 0.11 115.31 122.87 1ozb h LEU 122 Ca 0.21 -0.22 0.02 0.00 0.84 0.00 0.00 57.88 58.73 1ozb h LEU 122 Cb 0.09 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 1ozb h LEU 122 CO -0.03 0.44 0.12 0.58 -0.34 0.00 0.00 178.44 179.21 1ozb h VAL 123 N 0.13 0.98 -0.62 1.05 2.07 -0.71 -1.45 116.25 117.68 1ozb h VAL 123 Ca 0.06 -0.09 0.02 0.00 0.82 0.00 0.00 66.70 67.52 1ozb h VAL 123 Cb 0.26 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 30.69 1ozb h VAL 123 CO 0.00 0.05 0.39 -1.28 0.02 0.00 0.00 177.57 176.75 1ozb h SER 124 N 0.25 0.65 -0.14 0.57 0.87 -0.83 -1.17 113.55 113.75 1ozb h SER 124 Ca 0.11 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1ozb h SER 124 Cb 0.04 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 1ozb h SER 124 CO -0.08 0.45 0.07 -1.13 -0.53 0.00 0.00 176.83 175.61 1ozb h ASN 125 N 0.77 0.18 -0.42 6.23 -0.73 -0.38 -1.95 115.58 119.28 1ozb h ASN 125 Ca 0.25 -0.10 -0.03 0.00 1.87 0.00 0.00 56.30 58.28 1ozb h ASN 125 Cb -0.00 -0.04 -0.02 0.00 0.27 0.00 0.00 38.32 38.52 1ozb h ASN 125 CO -0.09 0.23 0.15 -0.07 -0.37 0.00 0.00 177.43 177.27 1ozb h LEU 126 N 0.11 0.59 -0.64 0.34 3.38 -1.12 -2.40 115.31 115.57 1ozb h LEU 126 Ca 0.05 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.85 1ozb h LEU 126 Cb 0.09 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1ozb h LEU 126 CO -0.01 0.62 0.41 0.58 0.09 0.00 0.00 178.44 180.14 1ozb h VAL 127 N 0.53 1.11 -0.34 1.22 2.07 -1.14 -1.45 116.25 118.26 1ozb h VAL 127 Ca 0.14 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 1ozb h VAL 127 Cb 0.23 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 1ozb h VAL 127 CO -0.01 0.15 0.08 -1.13 0.02 0.00 0.00 177.57 176.68 1ozb h ASN 128 N 0.81 0.45 0.26 0.57 -1.24 -1.20 -1.25 115.58 113.98 1ozb h ASN 128 Ca 0.25 -0.06 -0.00 0.00 0.71 0.00 0.00 56.30 57.20 1ozb h ASN 128 Cb -0.01 -0.11 -0.00 0.00 0.73 0.00 0.00 38.32 38.92 1ozb h ASN 128 CO -0.09 0.45 -0.02 0.03 -1.29 0.00 0.00 177.43 176.51 1ozb h ARG 129 N 0.48 0.00 -0.33 6.67 3.08 -0.75 0.16 114.38 123.69 1ozb h ARG 129 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 1ozb h ARG 129 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1ozb h ARG 129 CO -0.00 0.02 0.00 0.41 -1.07 0.00 0.00 179.97 179.33 1ozb n GLY 130 N -0.83 1.05 3.19 0.04 0.00 -0.48 -4.93 105.19 103.23 1ozb n GLY 130 Ca -0.02 -0.56 -0.23 0.00 0.00 0.00 0.00 46.02 45.20 1ozb n GLY 130 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ozb n THR 131 N 0.90 -2.00 -3.64 2.61 -2.24 0.55 -5.00 114.28 105.45 1ozb n THR 131 Ca 0.17 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.71 1ozb n THR 131 Cb 0.45 -3.29 -0.02 0.00 -2.10 0.00 0.00 70.33 65.37 1ozb n THR 131 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1ozb s PHE 132 N -3.17 3.48 0.52 4.78 0.40 -1.17 -5.05 117.98 117.78 1ozb s PHE 132 Ca 0.37 0.26 -0.23 0.00 -0.60 0.00 0.00 56.93 56.74 1ozb s PHE 132 Cb -0.17 -1.80 -0.06 0.00 0.51 0.00 0.00 43.02 41.50 1ozb s PHE 132 CO 0.46 0.29 1.35 -1.25 0.70 0.00 0.00 175.22 176.78 1ozb s PRO 133 N -3.87 3.32 0.16 0.24 0.04 -1.26 -4.56 135.00 129.06 1ozb s PRO 133 Ca 0.38 2.23 -0.29 0.00 0.04 0.00 0.00 61.00 63.36 1ozb s PRO 133 Cb -0.10 -2.36 -0.17 0.00 0.04 0.00 0.00 34.50 31.91 1ozb s PRO 133 CO 0.32 -1.05 0.60 0.00 0.04 0.00 0.00 177.00 176.91 1ozb n ALA 134 N -0.79 -2.96 -3.73 8.56 0.00 -1.26 -4.92 120.51 115.42 1ozb n ALA 134 Ca 0.09 0.45 -0.29 0.00 0.00 0.00 0.00 53.44 53.69 1ozb n ALA 134 Cb 0.45 -1.58 -0.15 0.00 0.00 0.00 0.00 19.45 18.16 1ozb n ALA 134 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1ozb s LEU 135 N 2.35 1.88 -0.45 0.00 2.96 -1.26 -5.08 118.68 119.08 1ozb s LEU 135 Ca 0.67 -1.41 -0.02 0.00 -0.22 0.00 0.00 54.13 53.15 1ozb s LEU 135 Cb -0.96 -0.78 0.12 0.00 0.50 0.00 0.00 46.19 45.07 1ozb s LEU 135 CO 0.54 -0.39 0.23 0.20 -1.32 0.00 0.00 176.35 175.62 1ozb s ASN 136 N 1.70 5.15 0.01 3.68 0.01 -1.26 -4.06 114.94 120.18 1ozb s ASN 136 Ca 0.07 -2.25 -0.39 0.00 -0.71 0.00 0.00 52.86 49.57 1ozb s ASN 136 Cb -0.17 -1.80 -0.20 0.00 0.41 0.00 0.00 41.25 39.49 1ozb s ASN 136 CO -0.22 -0.48 1.04 0.18 -1.51 0.00 0.00 177.10 176.11 1ozb n LEU 137 N 4.27 -0.07 -4.79 0.60 4.77 -1.26 -4.90 117.00 115.62 1ozb n LEU 137 Ca 0.01 1.16 -0.35 0.00 -0.03 0.00 0.00 56.01 56.80 1ozb n LEU 137 Cb 0.40 -0.93 -0.02 0.00 -2.33 0.00 0.00 43.42 40.55 1ozb n LEU 137 CO 0.32 -1.97 0.74 -0.94 -1.33 0.00 0.00 177.39 174.21 1ozb s SER 138 N -0.06 6.15 0.32 -1.43 1.04 -1.26 -4.95 113.70 113.50 1ozb s SER 138 Ca 0.89 2.02 -0.27 0.00 0.48 0.00 0.00 55.95 59.08 1ozb s SER 138 Cb -1.24 -2.57 -0.13 0.00 0.10 0.00 0.00 66.02 62.17 1ozb s SER 138 CO 0.57 -0.92 0.95 -2.65 0.98 0.00 0.00 173.24 172.17 1ozb n PRO 139 N -1.03 1.24 -4.74 4.02 -0.02 -1.26 -4.99 135.00 128.22 1ozb n PRO 139 Ca 0.10 0.44 -0.33 0.00 -2.02 0.00 0.00 63.50 61.68 1ozb n PRO 139 Cb 0.52 -1.82 -0.12 0.00 -0.02 0.00 0.00 33.50 32.06 1ozb n PRO 139 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ozb s VAL 140 N -1.13 3.42 -0.52 -1.45 1.01 -1.26 -5.08 120.40 115.39 1ozb s VAL 140 Ca 0.60 -0.59 -0.14 0.00 0.00 0.00 0.00 61.98 61.85 1ozb s VAL 140 Cb -0.68 -2.38 0.13 0.00 0.00 0.00 0.00 36.38 33.46 1ozb s VAL 140 CO 0.59 0.59 0.45 0.21 0.00 0.00 0.00 175.10 176.95 1ozb s ASN 141 N -0.79 6.04 0.48 3.32 3.84 -1.26 -4.91 114.94 121.65 1ozb s ASN 141 Ca 0.12 -1.86 0.31 0.00 0.21 0.00 0.00 52.86 51.64 1ozb s ASN 141 Cb -0.11 -2.14 1.30 0.00 -0.55 0.00 0.00 41.25 39.75 1ozb s ASN 141 CO 0.01 -0.80 1.92 -0.26 -2.79 0.00 0.00 177.10 175.19 1ozb h PHE 142 N 8.71 0.00 0.00 0.43 -1.00 -1.91 -2.93 116.94 120.24 1ozb h PHE 142 Ca -0.26 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.52 1ozb h PHE 142 Cb 1.09 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.65 1ozb h PHE 142 CO 0.71 0.00 0.15 -0.44 -1.61 0.00 0.00 178.31 177.12 1ozb h ASP 143 N 0.00 0.00 0.67 2.17 3.32 -1.90 0.67 116.42 121.34 1ozb h ASP 143 Ca 0.00 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.79 1ozb h ASP 143 Cb 0.45 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.97 1ozb h ASP 143 CO 0.00 0.00 -1.41 0.00 -1.72 0.00 0.00 179.24 176.11 1ozb h ALA 144 N 1.67 0.50 0.00 3.45 0.00 -1.92 -2.24 119.26 120.73 1ozb h ALA 144 Ca 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 54.91 53.73 1ozb h ALA 144 Cb 0.31 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ozb h ALA 144 CO 0.00 1.36 0.00 -0.07 0.00 0.00 0.00 179.25 180.54 1ozb h LEU 145 N 0.02 0.00 0.07 0.00 3.38 0.15 0.23 115.31 119.15 1ozb h LEU 145 Ca -0.17 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.49 1ozb h LEU 145 Cb 1.92 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.65 1ozb h LEU 145 CO 0.12 0.00 -1.67 0.33 0.09 0.00 0.00 178.44 177.31 1ozb n PHE 146 N -2.35 1.14 -0.08 1.13 7.35 -0.60 -3.01 117.46 121.04 1ozb n PHE 146 Ca 0.02 0.34 -0.11 0.00 -0.76 0.00 0.00 57.45 56.94 1ozb n PHE 146 Cb 0.22 -1.13 -0.04 0.00 0.35 0.00 0.00 39.48 38.88 1ozb n PHE 146 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1ozb h VAL 147 N -0.43 1.23 0.00 -2.13 2.07 -0.99 0.11 116.25 116.10 1ozb h VAL 147 Ca -0.39 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 66.36 1ozb h VAL 147 Cb 1.70 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.73 1ozb h VAL 147 CO -0.06 0.24 0.00 -0.62 0.02 0.00 0.00 177.57 177.16 1ozb n GLU 148 N -4.70 0.33 -0.07 1.57 1.02 0.78 -3.00 120.64 116.57 1ozb n GLU 148 Ca -0.03 0.07 -0.05 0.00 -0.02 0.00 0.00 57.16 57.13 1ozb n GLU 148 Cb 0.20 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.10 1ozb n GLU 148 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1ozb n TYR 149 N -1.28 0.88 -0.25 -0.32 9.36 -0.75 -4.45 117.16 120.34 1ozb n TYR 149 Ca 0.11 0.38 -0.08 0.00 3.32 0.00 0.00 57.90 61.63 1ozb n TYR 149 Cb 0.18 -0.76 -0.04 0.00 -0.63 0.00 0.00 39.34 38.10 1ozb n TYR 149 CO 0.00 0.00 0.00 0.52 0.22 0.00 0.00 176.86 177.60 1ozb h MET 150 N -1.00 -0.17 0.00 2.98 2.86 -0.85 -3.50 114.93 115.26 1ozb h MET 150 Ca 0.00 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1ozb h MET 150 Cb 0.54 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.23 1ozb h MET 150 CO 0.00 -0.11 0.00 0.09 1.06 0.00 0.00 176.91 177.95