#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ozt s THR 2 N 0.00 4.07 0.10 0.00 2.01 -1.08 -4.88 115.64 115.86 1ozt s THR 2 Ca 0.00 1.14 0.03 0.00 0.31 0.00 0.00 61.69 63.17 1ozt s THR 2 Cb 0.00 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 68.95 1ozt s THR 2 CO 0.00 -0.42 -0.08 -0.54 -0.69 0.00 0.00 174.62 172.89 1ozt s LYS 3 N -3.62 0.86 0.16 4.92 1.02 -1.26 -1.53 119.74 120.30 1ozt s LYS 3 Ca 0.63 -1.28 -0.15 0.00 0.02 0.00 0.00 55.97 55.19 1ozt s LYS 3 Cb -0.13 -0.37 0.02 0.00 -0.52 0.00 0.00 37.83 36.83 1ozt s LYS 3 CO 0.25 0.03 0.43 0.00 -0.92 0.00 0.00 175.35 175.14 1ozt s ALA 4 N -3.15 -0.73 0.13 5.17 0.00 -0.33 -2.09 121.76 120.76 1ozt s ALA 4 Ca 0.10 -0.31 -0.09 0.00 0.00 0.00 0.00 51.96 51.65 1ozt s ALA 4 Cb 0.02 0.79 -0.00 0.00 0.00 0.00 0.00 23.12 23.93 1ozt s ALA 4 CO -0.02 -0.72 0.25 0.54 0.00 0.00 0.00 175.76 175.81 1ozt s VAL 5 N -3.87 0.09 -0.17 0.00 0.11 0.07 -0.29 120.40 116.34 1ozt s VAL 5 Ca 0.09 -1.29 -0.10 0.00 -2.93 0.00 0.00 61.98 57.75 1ozt s VAL 5 Cb 0.01 -1.63 0.06 0.00 -1.53 0.00 0.00 36.38 33.28 1ozt s VAL 5 CO -0.05 -0.43 0.42 0.00 -3.33 0.00 0.00 175.10 171.71 1ozt s VAL 7 N 1.24 4.72 -0.07 0.00 1.01 -1.26 -1.39 120.40 124.65 1ozt s VAL 7 Ca -0.08 -0.03 -0.17 0.00 0.00 0.00 0.00 61.98 61.69 1ozt s VAL 7 Cb -0.08 -3.22 -0.05 0.00 0.00 0.00 0.00 36.38 33.03 1ozt s VAL 7 CO -0.11 0.31 0.47 -0.76 0.00 0.00 0.00 175.10 175.01 1ozt s LEU 8 N 1.64 4.35 0.10 3.92 2.01 0.11 -3.79 118.68 127.02 1ozt s LEU 8 Ca 0.07 0.90 -0.11 0.00 0.01 0.00 0.00 54.13 55.00 1ozt s LEU 8 Cb -0.15 -2.69 0.01 0.00 0.01 0.00 0.00 46.19 43.37 1ozt s LEU 8 CO 0.06 0.11 0.25 -0.54 1.01 0.00 0.00 176.35 177.24 1ozt s LYS 9 N 0.01 0.91 0.00 1.70 1.02 0.10 -2.70 119.74 120.78 1ozt s LYS 9 Ca 0.26 -0.89 0.00 0.00 0.02 0.00 0.00 55.97 55.36 1ozt s LYS 9 Cb -0.16 0.38 0.00 0.00 -0.52 0.00 0.00 37.83 37.53 1ozt s LYS 9 CO 0.12 -0.31 0.00 0.41 -0.92 0.00 0.00 175.35 174.65 1ozt n GLY 10 N -0.11 2.24 0.23 -3.33 0.00 -1.25 0.24 105.19 103.20 1ozt n GLY 10 Ca -0.15 -1.01 0.13 0.00 0.00 0.00 0.00 46.02 44.99 1ozt n GLY 10 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ozt h ASP 11 N 0.00 0.00 -0.94 1.61 3.32 -1.92 -3.46 116.42 115.03 1ozt h ASP 11 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ozt h ASP 11 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1ozt h ASP 11 CO 0.00 0.01 0.00 0.61 -1.72 0.00 0.00 179.24 178.14 1ozt n GLY 12 N 0.88 1.69 0.08 2.75 0.00 -1.26 -5.02 105.19 104.32 1ozt n GLY 12 Ca 0.03 -1.93 0.13 0.00 0.00 0.00 0.00 46.02 44.26 1ozt n GLY 12 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ozt n PRO 13 N 0.00 0.38 -2.15 1.61 -0.04 -1.26 -4.91 135.00 128.63 1ozt n PRO 13 Ca 0.00 -0.16 -0.42 0.00 -0.04 0.00 0.00 63.50 62.88 1ozt n PRO 13 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 1ozt n PRO 13 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ozt s VAL 14 N -2.73 3.43 -0.02 0.52 1.01 -1.26 -4.27 120.40 117.08 1ozt s VAL 14 Ca 0.20 0.93 -0.29 0.00 0.00 0.00 0.00 61.98 62.82 1ozt s VAL 14 Cb 0.19 -3.59 0.08 0.00 0.00 0.00 0.00 36.38 33.06 1ozt s VAL 14 CO 0.56 0.03 0.74 0.00 0.00 0.00 0.00 175.10 176.43 1ozt s GLN 15 N 1.90 1.00 -0.04 2.72 -2.07 -0.70 -3.86 119.66 118.61 1ozt s GLN 15 Ca 0.66 0.02 -0.16 0.00 -1.82 0.00 0.00 55.36 54.05 1ozt s GLN 15 Cb -0.35 0.47 0.05 0.00 -1.09 0.00 0.00 33.01 32.09 1ozt s GLN 15 CO 0.29 -0.36 0.74 0.41 -1.32 0.00 0.00 175.29 175.05 1ozt n GLY 16 N 0.47 0.28 2.86 2.60 0.00 -1.10 -0.43 105.19 109.87 1ozt n GLY 16 Ca -0.16 -0.93 -0.20 0.00 0.00 0.00 0.00 46.02 44.74 1ozt n GLY 16 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ozt s ILE 17 N -2.03 0.45 0.07 -0.61 1.01 -0.91 -0.71 121.20 118.47 1ozt s ILE 17 Ca 0.18 -0.05 0.10 0.00 0.00 0.00 0.00 60.65 60.87 1ozt s ILE 17 Cb -0.00 -0.51 -0.03 0.00 0.01 0.00 0.00 42.46 41.93 1ozt s ILE 17 CO -0.01 0.22 -0.26 -0.63 0.00 0.00 0.00 174.94 174.25 1ozt s ILE 18 N 1.09 2.16 0.12 2.92 -1.09 -0.48 -2.39 121.20 123.52 1ozt s ILE 18 Ca -0.08 -1.48 0.10 0.00 -2.23 0.00 0.00 60.65 56.95 1ozt s ILE 18 Cb -0.14 -1.86 -0.04 0.00 -1.58 0.00 0.00 42.46 38.84 1ozt s ILE 18 CO -0.01 0.29 -0.24 0.20 -1.23 0.00 0.00 174.94 173.95 1ozt s ASN 19 N -1.45 2.97 0.01 3.58 0.01 0.14 -1.49 114.94 118.71 1ozt s ASN 19 Ca 0.12 -0.74 0.05 0.00 -0.71 0.00 0.00 52.86 51.59 1ozt s ASN 19 Cb -0.10 -0.19 -0.02 0.00 0.41 0.00 0.00 41.25 41.36 1ozt s ASN 19 CO 0.03 0.12 -0.15 -0.36 -1.51 0.00 0.00 177.10 175.22 1ozt s PHE 20 N -1.19 1.37 -0.10 2.20 0.40 0.61 -1.45 117.98 119.82 1ozt s PHE 20 Ca 0.11 -0.30 -0.05 0.00 -0.60 0.00 0.00 56.93 56.09 1ozt s PHE 20 Cb -0.10 -0.85 0.05 0.00 0.51 0.00 0.00 43.02 42.63 1ozt s PHE 20 CO 0.06 0.01 0.23 -2.00 0.70 0.00 0.00 175.22 174.22 1ozt s GLU 21 N -0.72 0.17 -0.32 0.44 2.12 -0.14 -1.19 118.70 119.06 1ozt s GLU 21 Ca 0.05 0.53 -0.01 0.00 0.36 0.00 0.00 54.97 55.89 1ozt s GLU 21 Cb -0.07 -0.13 0.11 0.00 0.26 0.00 0.00 34.13 34.30 1ozt s GLU 21 CO 0.00 -0.18 0.13 -1.14 -0.54 0.00 0.00 175.26 173.53 1ozt s GLN 22 N 1.41 0.63 0.58 4.30 0.74 -0.58 0.09 119.66 126.83 1ozt s GLN 22 Ca -0.08 -1.06 0.37 0.00 0.05 0.00 0.00 55.36 54.64 1ozt s GLN 22 Cb -0.11 -1.77 1.66 0.00 1.10 0.00 0.00 33.01 33.90 1ozt s GLN 22 CO -0.08 -1.03 2.09 0.87 -0.55 0.00 0.00 175.29 176.59 1ozt h LYS 23 N 7.93 0.00 -3.94 1.67 1.57 -1.81 -2.87 116.57 119.13 1ozt h LYS 23 Ca -0.12 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.36 1ozt h LYS 23 Cb 1.00 0.00 -0.30 0.00 0.08 0.00 0.00 32.23 33.01 1ozt h LYS 23 CO 0.45 0.00 -0.74 -1.21 -0.57 0.00 0.00 179.45 177.38 1ozt s GLU 24 N -3.80 0.25 0.23 3.15 2.02 -1.26 -3.59 118.70 115.70 1ozt s GLU 24 Ca -0.01 -0.05 -0.03 0.00 0.02 0.00 0.00 54.97 54.91 1ozt s GLU 24 Cb 0.10 -0.30 0.45 0.00 0.10 0.00 0.00 34.13 34.49 1ozt s GLU 24 CO 0.50 0.00 1.20 0.45 0.02 0.00 0.00 175.26 177.43 1ozt n SER 25 N 3.35 -0.20 -0.97 -0.19 2.88 -1.26 0.19 113.62 117.42 1ozt n SER 25 Ca -0.17 1.31 0.08 0.00 -1.33 0.00 0.00 58.87 58.76 1ozt n SER 25 Cb 0.56 -0.43 0.26 0.00 -0.75 0.00 0.00 64.21 63.85 1ozt n SER 25 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1ozt n ASN 26 N -5.18 3.92 -3.55 -3.46 6.94 -1.26 -4.89 115.26 107.78 1ozt n ASN 26 Ca 0.15 -2.79 -0.12 0.00 -0.02 0.00 0.00 54.58 51.79 1ozt n ASN 26 Cb 0.47 -0.50 0.06 0.00 -2.36 0.00 0.00 39.78 37.45 1ozt n ASN 26 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ozt n GLY 27 N -0.14 1.17 3.82 4.83 0.00 0.13 -5.09 105.19 109.90 1ozt n GLY 27 Ca 0.20 -2.07 -0.31 0.00 0.00 0.00 0.00 46.02 43.85 1ozt n GLY 27 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1ozt s PRO 28 N -3.78 2.67 -0.16 1.61 0.02 -1.26 -4.87 135.00 129.23 1ozt s PRO 28 Ca 0.37 0.83 -0.02 0.00 0.02 0.00 0.00 61.00 62.20 1ozt s PRO 28 Cb -0.02 -1.97 -0.02 0.00 0.02 0.00 0.00 34.50 32.51 1ozt s PRO 28 CO 0.24 -1.25 -0.08 0.08 -0.33 0.00 0.00 177.00 175.65 1ozt s VAL 29 N -3.09 3.35 -0.10 3.83 1.01 0.28 -4.34 120.40 121.34 1ozt s VAL 29 Ca 0.59 -0.54 -0.16 0.00 0.00 0.00 0.00 61.98 61.87 1ozt s VAL 29 Cb -0.14 -2.46 -0.05 0.00 0.00 0.00 0.00 36.38 33.74 1ozt s VAL 29 CO 0.55 0.49 0.41 -0.54 0.00 0.00 0.00 175.10 176.00 1ozt s LYS 30 N 0.67 4.21 -0.07 2.72 1.02 0.11 -1.39 119.74 127.01 1ozt s LYS 30 Ca -0.04 0.34 0.02 0.00 0.02 0.00 0.00 55.97 56.30 1ozt s LYS 30 Cb -0.15 -3.38 0.02 0.00 -0.52 0.00 0.00 37.83 33.80 1ozt s LYS 30 CO 0.02 0.31 -0.11 0.54 -0.92 0.00 0.00 175.35 175.19 1ozt s VAL 31 N 0.17 1.07 0.13 3.17 0.11 -0.63 -0.97 120.40 123.45 1ozt s VAL 31 Ca 0.23 -0.43 -0.16 0.00 -2.93 0.00 0.00 61.98 58.70 1ozt s VAL 31 Cb -0.15 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.73 1ozt s VAL 31 CO 0.09 0.35 0.39 -1.66 -3.33 0.00 0.00 175.10 170.94 1ozt s TRP 32 N 0.82 -0.16 -5.00 1.54 -2.14 -0.53 -0.56 118.94 112.91 1ozt s TRP 32 Ca -0.12 -0.16 0.00 0.00 2.66 0.00 0.00 56.10 58.48 1ozt s TRP 32 Cb -0.15 0.24 0.00 0.00 -3.10 0.00 0.00 33.47 30.46 1ozt s TRP 32 CO 0.02 -0.71 0.00 0.41 -2.66 0.00 0.00 176.95 174.01 1ozt n GLY 33 N -0.22 -0.07 3.26 3.67 0.00 -0.58 0.23 105.19 111.47 1ozt n GLY 33 Ca -0.15 -1.24 -0.10 0.00 0.00 0.00 0.00 46.02 44.53 1ozt n GLY 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ozt s SER 34 N -4.00 -0.07 -0.02 1.61 1.04 -1.01 -0.14 113.70 111.11 1ozt s SER 34 Ca 0.00 -0.42 0.03 0.00 0.48 0.00 0.00 55.95 56.03 1ozt s SER 34 Cb 0.00 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.52 1ozt s SER 34 CO 0.00 -0.76 -0.09 -0.63 0.98 0.00 0.00 173.24 172.74 1ozt s ILE 35 N -3.57 0.80 0.38 -1.02 1.01 -0.24 -2.15 121.20 116.41 1ozt s ILE 35 Ca 0.02 -0.38 0.05 0.00 0.00 0.00 0.00 60.65 60.34 1ozt s ILE 35 Cb 0.03 -0.70 -0.07 0.00 0.01 0.00 0.00 42.46 41.73 1ozt s ILE 35 CO -0.10 0.24 0.03 -1.59 0.00 0.00 0.00 174.94 173.53 1ozt s LYS 36 N 0.10 1.84 0.00 2.79 -2.85 0.43 0.03 119.74 122.08 1ozt s LYS 36 Ca -0.02 -2.05 0.00 0.00 -1.00 0.00 0.00 55.97 52.91 1ozt s LYS 36 Cb -0.08 -1.29 0.00 0.00 -2.06 0.00 0.00 37.83 34.40 1ozt s LYS 36 CO 0.00 -0.13 0.00 0.41 0.10 0.00 0.00 175.35 175.73 1ozt n GLY 37 N -0.87 0.52 3.90 0.59 0.00 -0.88 -1.73 105.19 106.72 1ozt n GLY 37 Ca -0.05 -0.43 -0.30 0.00 0.00 0.00 0.00 46.02 45.24 1ozt n GLY 37 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ozt s LEU 38 N 0.00 4.13 0.43 0.99 1.02 -0.23 -4.10 118.68 120.92 1ozt s LEU 38 Ca 0.00 0.74 -0.22 0.00 0.02 0.00 0.00 54.13 54.67 1ozt s LEU 38 Cb 0.00 -3.52 -0.10 0.00 0.02 0.00 0.00 46.19 42.59 1ozt s LEU 38 CO 0.00 -0.11 0.98 0.42 0.02 0.00 0.00 176.35 177.66 1ozt s THR 39 N -1.92 4.14 0.25 5.49 -4.23 -1.26 -3.88 115.64 114.22 1ozt s THR 39 Ca 0.44 1.41 -0.31 0.00 -1.18 0.00 0.00 61.69 62.05 1ozt s THR 39 Cb -0.11 -3.62 -0.13 0.00 1.34 0.00 0.00 72.50 69.98 1ozt s THR 39 CO 0.26 -0.21 1.48 1.21 -0.54 0.00 0.00 174.62 176.82 1ozt n GLU 40 N -0.52 2.24 0.00 3.99 2.13 -1.26 -4.60 120.64 122.62 1ozt n GLU 40 Ca 0.07 0.80 0.00 0.00 0.66 0.00 0.00 57.16 58.68 1ozt n GLU 40 Cb 0.53 -2.50 0.00 0.00 0.27 0.00 0.00 31.44 29.74 1ozt n GLU 40 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ozt n GLY 41 N 2.30 0.61 3.75 8.31 0.00 0.90 -4.90 105.19 116.15 1ozt n GLY 41 Ca 0.11 -2.13 -0.40 0.00 0.00 0.00 0.00 46.02 43.60 1ozt n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ozt s LEU 42 N 0.00 4.47 -0.04 0.99 1.02 -1.26 -0.05 118.68 123.80 1ozt s LEU 42 Ca 0.00 1.47 0.01 0.00 0.02 0.00 0.00 54.13 55.62 1ozt s LEU 42 Cb 0.00 -3.23 0.02 0.00 0.02 0.00 0.00 46.19 43.00 1ozt s LEU 42 CO 0.00 0.04 -0.02 -1.00 0.02 0.00 0.00 176.35 175.38 1ozt s HIS 43 N -0.18 0.56 0.34 0.29 3.76 -0.33 -2.81 115.29 116.92 1ozt s HIS 43 Ca 0.38 -0.12 -0.28 0.00 -0.15 0.00 0.00 55.06 54.89 1ozt s HIS 43 Cb -0.21 -0.56 -0.12 0.00 1.11 0.00 0.00 32.58 32.80 1ozt s HIS 43 CO 0.23 -0.17 1.33 0.41 -0.85 0.00 0.00 174.74 175.69 1ozt n GLY 44 N 4.13 0.70 2.78 -2.22 0.00 0.01 -0.57 105.19 110.01 1ozt n GLY 44 Ca -0.25 0.32 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 1ozt n GLY 44 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ozt s PHE 45 N -1.04 1.45 0.06 1.61 5.36 -0.16 0.35 117.98 125.63 1ozt s PHE 45 Ca 0.56 -1.23 -0.01 0.00 -0.96 0.00 0.00 56.93 55.28 1ozt s PHE 45 Cb -0.56 -1.29 -0.04 0.00 -0.34 0.00 0.00 43.02 40.80 1ozt s PHE 45 CO 0.62 -0.70 -0.02 1.03 -1.46 0.00 0.00 175.22 174.69 1ozt s ARG 46 N 1.71 0.67 -0.22 10.12 0.52 -0.48 -1.69 118.95 129.59 1ozt s ARG 46 Ca 0.00 -1.26 -0.09 0.00 -0.52 0.00 0.00 55.73 53.86 1ozt s ARG 46 Cb -0.17 0.21 -0.05 0.00 0.52 0.00 0.00 34.95 35.46 1ozt s ARG 46 CO -0.11 -0.13 0.12 0.08 0.02 0.00 0.00 175.30 175.27 1ozt s VAL 47 N -3.94 5.15 0.19 3.52 1.01 0.20 0.11 120.40 126.65 1ozt s VAL 47 Ca 0.10 0.10 0.05 0.00 0.00 0.00 0.00 61.98 62.23 1ozt s VAL 47 Cb 0.08 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.05 1ozt s VAL 47 CO -0.08 0.39 0.24 -1.00 0.00 0.00 0.00 175.10 174.65 1ozt s HIS 48 N 0.77 3.30 0.30 5.22 0.09 0.15 -0.39 115.29 124.73 1ozt s HIS 48 Ca 0.06 -0.00 0.05 0.00 -0.00 0.00 0.00 55.06 55.17 1ozt s HIS 48 Cb -0.13 -1.54 0.69 0.00 -0.00 0.00 0.00 32.58 31.60 1ozt s HIS 48 CO 0.02 0.50 1.81 1.49 -0.00 0.00 0.00 174.74 178.56 1ozt h GLU 49 N 1.89 0.81 -6.02 1.40 4.81 -0.84 -2.87 114.58 113.76 1ozt h GLU 49 Ca -0.49 -0.05 -0.68 0.00 -0.13 0.00 0.00 59.36 58.01 1ozt h GLU 49 Cb 1.21 -0.18 -0.24 0.00 0.63 0.00 0.00 28.75 30.17 1ozt h GLU 49 CO 0.64 0.54 -0.76 -0.06 -0.73 0.00 0.00 179.01 178.63 1ozt s PHE 50 N -5.86 2.75 -0.31 0.92 0.08 -0.10 -4.71 117.98 110.74 1ozt s PHE 50 Ca -0.11 -0.28 -0.03 0.00 0.12 0.00 0.00 56.93 56.63 1ozt s PHE 50 Cb 0.24 -1.70 0.06 0.00 -0.57 0.00 0.00 43.02 41.05 1ozt s PHE 50 CO 0.80 0.08 2.58 0.41 -0.10 0.00 0.00 175.22 179.00 1ozt n GLY 51 N 2.65 3.93 3.38 4.36 0.00 -1.02 -3.57 105.19 114.92 1ozt n GLY 51 Ca -0.17 -1.38 -0.37 0.00 0.00 0.00 0.00 46.02 44.10 1ozt n GLY 51 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ozt s ASP 52 N 0.65 5.07 -0.16 1.61 -1.08 -1.26 -4.94 116.67 116.56 1ozt s ASP 52 Ca 0.46 -0.51 0.16 0.00 -0.52 0.00 0.00 52.55 52.15 1ozt s ASP 52 Cb 0.30 -1.89 0.35 0.00 -1.46 0.00 0.00 42.92 40.22 1ozt s ASP 52 CO -0.10 -0.13 1.20 -3.20 0.52 0.00 0.00 175.17 173.47 1ozt n ASN 53 N 4.89 2.29 0.25 -0.34 4.05 -1.26 -3.06 115.26 122.07 1ozt n ASN 53 Ca -0.15 -3.33 0.08 0.00 0.45 0.00 0.00 54.58 51.62 1ozt n ASN 53 Cb 0.49 -0.47 0.60 0.00 1.23 0.00 0.00 39.78 41.63 1ozt n ASN 53 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 1ozt h THR 54 N 0.44 1.00 -1.93 -0.44 1.35 -1.93 -3.04 112.91 108.36 1ozt h THR 54 Ca 0.01 -0.31 -0.55 0.00 -0.55 0.00 0.00 66.41 65.00 1ozt h THR 54 Cb 1.06 1.17 -0.42 0.00 -1.73 0.00 0.00 68.15 68.24 1ozt h THR 54 CO 0.03 0.09 -0.80 0.00 -0.25 0.00 0.00 175.52 174.59 1ozt n ALA 55 N -2.49 4.26 -0.91 6.62 0.00 -1.26 -5.05 120.51 121.68 1ozt n ALA 55 Ca -0.03 -4.27 0.00 0.00 0.00 0.00 0.00 53.44 49.14 1ozt n ALA 55 Cb 0.17 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 18.89 1ozt n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ozt n GLY 56 N -0.21 0.78 0.12 0.00 0.00 -1.15 -2.90 105.19 101.82 1ozt n GLY 56 Ca 0.30 -0.80 0.12 0.00 0.00 0.00 0.00 46.02 45.64 1ozt n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ozt h THR 58 N 0.00 1.26 0.00 0.00 2.02 -1.87 -2.17 112.91 112.14 1ozt h THR 58 Ca 0.00 -0.68 0.00 0.00 0.77 0.00 0.00 66.41 66.50 1ozt h THR 58 Cb 0.40 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.96 1ozt h THR 58 CO 0.00 0.30 0.00 -1.20 0.37 0.00 0.00 175.52 174.99 1ozt n SER 59 N -4.34 0.00 0.26 4.18 7.64 -1.18 -2.09 113.62 118.10 1ozt n SER 59 Ca 0.08 0.23 0.17 0.00 1.01 0.00 0.00 58.87 60.37 1ozt n SER 59 Cb 0.12 -0.33 0.74 0.00 -1.01 0.00 0.00 64.21 63.73 1ozt n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ozt h ALA 60 N 2.39 1.00 -0.08 -0.43 0.00 -1.31 -3.40 119.26 117.44 1ozt h ALA 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ozt h ALA 60 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ozt h ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1ozt n GLY 61 N -0.20 -1.30 3.74 0.00 0.00 -0.89 -0.93 105.19 105.61 1ozt n GLY 61 Ca 0.00 -1.27 -0.30 0.00 0.00 0.00 0.00 46.02 44.45 1ozt n GLY 61 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ozt s PRO 62 N 0.00 1.34 0.63 1.61 0.04 -1.26 -4.69 135.00 132.67 1ozt s PRO 62 Ca 0.00 0.68 -0.17 0.00 0.04 0.00 0.00 61.00 61.55 1ozt s PRO 62 Cb 0.00 -1.83 -0.02 0.00 0.04 0.00 0.00 34.50 32.69 1ozt s PRO 62 CO 0.00 -2.15 1.15 -3.38 0.04 0.00 0.00 177.00 172.67 1ozt s HIS 63 N -3.03 2.49 0.12 0.56 -3.43 -1.26 -0.60 115.29 110.13 1ozt s HIS 63 Ca 0.63 1.55 -0.31 0.00 -0.80 0.00 0.00 55.06 56.13 1ozt s HIS 63 Cb -0.17 -3.32 -0.09 0.00 -1.43 0.00 0.00 32.58 27.57 1ozt s HIS 63 CO 0.56 -1.93 1.67 0.12 -2.00 0.00 0.00 174.74 173.16 1ozt s PHE 64 N -1.97 2.57 -0.35 0.38 5.36 0.47 -4.39 117.98 120.06 1ozt s PHE 64 Ca 0.72 0.33 0.05 0.00 -0.96 0.00 0.00 56.93 57.08 1ozt s PHE 64 Cb -0.25 -4.01 0.19 0.00 -0.34 0.00 0.00 43.02 38.61 1ozt s PHE 64 CO 0.36 -3.99 0.65 1.21 -1.46 0.00 0.00 175.22 172.00 1ozt s ASN 65 N 2.04 -1.47 0.00 6.13 2.47 -1.26 -1.59 114.94 121.25 1ozt s ASN 65 Ca 0.74 -0.27 0.00 0.00 0.42 0.00 0.00 52.86 53.75 1ozt s ASN 65 Cb -0.43 1.89 0.00 0.00 -1.45 0.00 0.00 41.25 41.26 1ozt s ASN 65 CO 0.33 -0.22 0.94 -2.65 -3.72 0.00 0.00 177.10 171.78 1ozt n PRO 66 N 4.87 0.00 0.00 0.43 -0.02 -1.26 -5.03 135.00 134.00 1ozt n PRO 66 Ca 0.08 0.94 0.00 0.00 -2.02 0.00 0.00 63.50 62.50 1ozt n PRO 66 Cb 0.56 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.60 1ozt n PRO 66 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1ozt n LEU 67 N -2.76 0.00 -2.45 2.45 7.94 -1.26 -5.21 117.00 115.70 1ozt n LEU 67 Ca 0.00 0.00 -0.33 0.00 -1.11 0.00 0.00 56.01 54.57 1ozt n LEU 67 Cb 0.00 0.00 0.05 0.00 0.53 0.00 0.00 43.42 44.00 1ozt n LEU 67 CO 0.00 0.00 1.07 -0.62 -1.11 0.00 0.00 177.39 176.73 1ozt n GLU 78 N 0.00 2.99 -3.55 1.96 -0.58 -1.26 -5.19 120.64 115.01 1ozt n GLU 78 Ca 0.00 -3.69 -0.37 0.00 -0.42 0.00 0.00 57.16 52.69 1ozt n GLU 78 Cb 0.00 -2.28 -0.06 0.00 -0.57 0.00 0.00 31.44 28.53 1ozt n GLU 78 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1ozt s ARG 79 N -3.82 3.84 0.48 3.49 1.70 -1.26 -5.06 118.95 118.32 1ozt s ARG 79 Ca 0.56 0.30 -0.24 0.00 -0.47 0.00 0.00 55.73 55.89 1ozt s ARG 79 Cb 0.46 -3.14 -0.07 0.00 -0.57 0.00 0.00 34.95 31.63 1ozt s ARG 79 CO -0.14 0.65 1.37 -1.01 -1.08 0.00 0.00 175.30 175.10 1ozt s HIS 80 N -1.19 2.46 0.25 5.89 3.76 -1.26 -4.90 115.29 120.30 1ozt s HIS 80 Ca 0.26 1.34 -0.03 0.00 -0.15 0.00 0.00 55.06 56.48 1ozt s HIS 80 Cb -0.15 -3.82 0.48 0.00 1.11 0.00 0.00 32.58 30.20 1ozt s HIS 80 CO 0.14 -2.74 1.75 0.28 -0.85 0.00 0.00 174.74 173.33 1ozt h VAL 81 N 1.99 0.72 0.00 -0.90 2.07 -1.95 -2.00 116.25 116.18 1ozt h VAL 81 Ca -0.51 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 66.82 1ozt h VAL 81 Cb 1.27 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1ozt h VAL 81 CO 0.60 0.10 0.00 0.61 0.02 0.00 0.00 177.57 178.90 1ozt n GLY 82 N -1.32 -1.11 3.59 2.17 0.00 -0.62 -4.43 105.19 103.46 1ozt n GLY 82 Ca 0.15 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1ozt n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ozt s ASP 83 N -2.68 6.30 -0.02 1.61 1.01 -0.75 -0.63 116.67 121.50 1ozt s ASP 83 Ca 0.19 0.41 0.21 0.00 0.71 0.00 0.00 52.55 54.06 1ozt s ASP 83 Cb 0.15 -2.55 0.63 0.00 1.01 0.00 0.00 42.92 42.16 1ozt s ASP 83 CO 0.37 -1.54 1.53 0.18 0.21 0.00 0.00 175.17 175.91 1ozt n LEU 84 N 8.97 4.00 0.00 1.23 4.77 -0.68 -4.94 117.00 130.35 1ozt n LEU 84 Ca 0.13 -2.09 0.00 0.00 -0.03 0.00 0.00 56.01 54.02 1ozt n LEU 84 Cb 0.49 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1ozt n LEU 84 CO 0.71 0.93 0.00 0.61 -1.33 0.00 0.00 177.39 178.31 1ozt n GLY 85 N 1.43 0.64 3.33 -0.72 0.00 -1.21 -4.88 105.19 103.78 1ozt n GLY 85 Ca 0.23 -1.09 -0.17 0.00 0.00 0.00 0.00 46.02 44.99 1ozt n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ozt s ASN 86 N -4.00 2.07 0.12 1.61 0.01 -1.26 -0.98 114.94 112.50 1ozt s ASN 86 Ca 0.00 -1.16 0.10 0.00 -0.71 0.00 0.00 52.86 51.09 1ozt s ASN 86 Cb 0.00 -0.04 -0.04 0.00 0.41 0.00 0.00 41.25 41.58 1ozt s ASN 86 CO 0.00 -0.42 -0.24 0.68 -1.51 0.00 0.00 177.10 175.61 1ozt s VAL 87 N -3.28 2.02 -0.17 1.60 -7.23 0.26 -4.85 120.40 108.76 1ozt s VAL 87 Ca 0.26 -1.67 -0.01 0.00 -1.81 0.00 0.00 61.98 58.74 1ozt s VAL 87 Cb 0.04 -1.81 -0.01 0.00 0.56 0.00 0.00 36.38 35.16 1ozt s VAL 87 CO 0.08 0.02 -0.10 -0.89 -0.31 0.00 0.00 175.10 173.89 1ozt s THR 88 N -1.12 3.08 -0.15 5.32 2.01 -1.26 -1.19 115.64 122.33 1ozt s THR 88 Ca 0.11 -0.62 -0.13 0.00 0.31 0.00 0.00 61.69 61.36 1ozt s THR 88 Cb -0.10 -2.34 -0.05 0.00 0.01 0.00 0.00 72.50 70.03 1ozt s THR 88 CO 0.05 0.49 0.26 0.00 -0.69 0.00 0.00 174.62 174.73 1ozt s ALA 89 N 0.87 3.64 1.04 7.40 0.00 0.93 -4.04 121.76 131.60 1ozt s ALA 89 Ca -0.03 -0.49 -0.06 0.00 0.00 0.00 0.00 51.96 51.38 1ozt s ALA 89 Cb -0.15 -2.31 0.08 0.00 0.00 0.00 0.00 23.12 20.73 1ozt s ALA 89 CO 0.00 0.18 0.36 -0.40 0.00 0.00 0.00 175.76 175.90 1ozt n ASP 90 N 3.29 -0.65 0.32 0.00 5.68 0.25 -0.07 116.55 125.36 1ozt n ASP 90 Ca -0.13 -0.92 0.20 0.00 -0.50 0.00 0.00 54.79 53.43 1ozt n ASP 90 Cb 0.52 -0.30 1.05 0.00 -1.14 0.00 0.00 41.12 41.25 1ozt n ASP 90 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1ozt h LYS 91 N 0.00 0.00 -0.18 0.11 2.10 -1.97 -1.74 116.57 114.89 1ozt h LYS 91 Ca -0.12 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.53 1ozt h LYS 91 Cb 0.36 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.69 1ozt h LYS 91 CO 0.08 0.01 0.00 -0.25 -2.00 0.00 0.00 179.45 177.30 1ozt n ASP 92 N -3.28 1.74 0.00 7.07 8.00 -1.26 -4.81 116.55 124.00 1ozt n ASP 92 Ca -0.02 -1.73 0.00 0.00 0.71 0.00 0.00 54.79 53.75 1ozt n ASP 92 Cb 0.12 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.11 1ozt n ASP 92 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ozt n GLY 93 N 1.14 0.48 3.64 0.44 0.00 -0.65 -4.76 105.19 105.47 1ozt n GLY 93 Ca 0.16 -0.31 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 1ozt n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ozt s VAL 94 N -2.00 4.44 -0.18 1.61 1.01 -1.26 -1.07 120.40 122.95 1ozt s VAL 94 Ca 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 61.98 61.80 1ozt s VAL 94 Cb 0.00 -2.93 0.01 0.00 0.00 0.00 0.00 36.38 33.46 1ozt s VAL 94 CO 0.00 0.54 -0.16 0.00 0.00 0.00 0.00 175.10 175.48 1ozt s ALA 95 N -0.24 2.46 -0.23 5.51 0.00 0.10 -0.58 121.76 128.78 1ozt s ALA 95 Ca 0.06 -1.17 -0.16 0.00 0.00 0.00 0.00 51.96 50.70 1ozt s ALA 95 Cb -0.12 -1.29 -0.04 0.00 0.00 0.00 0.00 23.12 21.68 1ozt s ALA 95 CO 0.02 -0.28 0.42 0.34 0.00 0.00 0.00 175.76 176.26 1ozt s ASP 96 N 1.20 6.40 -0.13 0.00 2.15 -1.26 -1.08 116.67 123.96 1ozt s ASP 96 Ca 0.02 0.48 -0.03 0.00 0.43 0.00 0.00 52.55 53.45 1ozt s ASP 96 Cb -0.14 -2.24 -0.03 0.00 -0.30 0.00 0.00 42.92 40.21 1ozt s ASP 96 CO -0.07 -0.14 -0.02 -0.69 -0.17 0.00 0.00 175.17 174.07 1ozt s VAL 97 N 1.66 4.04 -0.28 1.11 1.01 0.80 -4.76 120.40 123.97 1ozt s VAL 97 Ca 0.19 -0.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.84 1ozt s VAL 97 Cb -0.15 -2.74 0.17 0.00 0.00 0.00 0.00 36.38 33.66 1ozt s VAL 97 CO 0.09 0.53 0.53 -0.55 0.00 0.00 0.00 175.10 175.70 1ozt s SER 98 N -0.13 -0.87 0.07 3.32 0.15 -1.25 -1.53 113.70 113.46 1ozt s SER 98 Ca 0.03 0.60 0.00 0.00 0.70 0.00 0.00 55.95 57.28 1ozt s SER 98 Cb -0.13 1.82 -0.04 0.00 -1.71 0.00 0.00 66.02 65.96 1ozt s SER 98 CO 0.02 -0.28 -0.05 -0.63 1.20 0.00 0.00 173.24 173.51 1ozt s ILE 99 N 2.76 0.45 -0.06 6.45 1.01 0.28 -5.01 121.20 127.08 1ozt s ILE 99 Ca 0.17 -1.84 -0.01 0.00 0.00 0.00 0.00 60.65 58.97 1ozt s ILE 99 Cb -0.15 -1.56 0.03 0.00 0.01 0.00 0.00 42.46 40.79 1ozt s ILE 99 CO -0.20 -0.92 0.01 -0.70 0.00 0.00 0.00 174.94 173.13 1ozt s GLU 100 N -3.80 0.44 -0.01 2.79 2.12 -1.26 -1.60 118.70 117.38 1ozt s GLU 100 Ca 0.09 0.14 0.03 0.00 0.36 0.00 0.00 54.97 55.59 1ozt s GLU 100 Cb 0.06 -0.79 -0.01 0.00 0.26 0.00 0.00 34.13 33.65 1ozt s GLU 100 CO -0.07 -0.27 -0.10 0.34 -0.54 0.00 0.00 175.26 174.62 1ozt s ASP 101 N 1.79 1.24 -0.12 -1.70 -1.08 -0.49 -4.97 116.67 111.34 1ozt s ASP 101 Ca 0.01 -0.19 0.15 0.00 -0.52 0.00 0.00 52.55 52.00 1ozt s ASP 101 Cb -0.13 -0.17 0.36 0.00 -1.46 0.00 0.00 42.92 41.53 1ozt s ASP 101 CO -0.04 0.12 1.26 -1.54 0.52 0.00 0.00 175.17 175.50 1ozt n SER 102 N 2.90 3.05 -0.13 -0.34 3.41 -1.26 -0.55 113.62 120.69 1ozt n SER 102 Ca -0.14 -2.80 -0.27 0.00 -0.26 0.00 0.00 58.87 55.39 1ozt n SER 102 Cb 0.56 -0.41 -0.11 0.00 -0.26 0.00 0.00 64.21 64.00 1ozt n SER 102 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1ozt n VAL 103 N -0.69 1.53 -1.25 -3.33 0.31 -1.26 -4.92 118.33 108.72 1ozt n VAL 103 Ca 0.16 -0.41 -0.31 0.00 -0.01 0.00 0.00 64.34 63.78 1ozt n VAL 103 Cb 0.68 -1.79 0.11 0.00 -0.91 0.00 0.00 33.84 31.92 1ozt n VAL 103 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1ozt s ILE 104 N -2.50 3.10 0.13 2.52 -4.36 -1.26 -4.86 121.20 113.96 1ozt s ILE 104 Ca -0.37 0.36 -0.11 0.00 -0.26 0.00 0.00 60.65 60.26 1ozt s ILE 104 Cb 0.13 -2.85 0.01 0.00 1.25 0.00 0.00 42.46 41.00 1ozt s ILE 104 CO 0.53 -0.46 0.30 -0.55 0.24 0.00 0.00 174.94 174.99 1ozt s SER 105 N -3.42 -0.03 0.00 4.36 0.15 -0.95 -4.69 113.70 109.13 1ozt s SER 105 Ca 0.62 -0.62 0.22 0.00 0.70 0.00 0.00 55.95 56.88 1ozt s SER 105 Cb -0.17 0.42 0.62 0.00 -1.71 0.00 0.00 66.02 65.18 1ozt s SER 105 CO 0.56 -0.84 1.52 0.18 1.20 0.00 0.00 173.24 175.87 1ozt n LEU 106 N -0.17 3.91 -3.90 3.45 4.77 -1.26 -1.05 117.00 122.74 1ozt n LEU 106 Ca -0.13 -1.96 -0.08 0.00 -0.03 0.00 0.00 56.01 53.81 1ozt n LEU 106 Cb 0.63 -0.47 -0.02 0.00 -2.33 0.00 0.00 43.42 41.23 1ozt n LEU 106 CO 0.21 0.97 0.39 -0.94 -1.33 0.00 0.00 177.39 176.69 1ozt s SER 107 N -1.04 -0.14 0.54 -1.43 1.04 -1.26 -4.81 113.70 106.60 1ozt s SER 107 Ca 0.48 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 56.12 1ozt s SER 107 Cb 0.25 0.71 0.00 0.00 0.10 0.00 0.00 66.02 67.08 1ozt s SER 107 CO 0.33 -1.34 0.00 0.61 0.98 0.00 0.00 173.24 173.82 1ozt n GLY 108 N -0.45 -0.05 0.26 7.32 0.00 -1.26 -3.08 105.19 107.92 1ozt n GLY 108 Ca -0.04 -1.00 0.10 0.00 0.00 0.00 0.00 46.02 45.08 1ozt n GLY 108 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ozt h ASP 109 N 1.93 0.00 -0.60 1.61 3.32 -2.01 -2.39 116.42 118.28 1ozt h ASP 109 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ozt h ASP 109 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1ozt h ASP 109 CO 0.00 0.08 0.00 1.41 -1.72 0.00 0.00 179.24 179.01 1ozt n HIS 110 N -4.10 1.51 -1.68 4.55 8.25 -1.25 -4.91 115.22 117.58 1ozt n HIS 110 Ca -0.03 -0.65 -0.46 0.00 -0.26 0.00 0.00 57.72 56.33 1ozt n HIS 110 Cb 0.16 -0.29 -0.04 0.00 1.12 0.00 0.00 29.99 30.95 1ozt n HIS 110 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ozt n ILE 112 N 4.41 0.46 -2.39 0.00 -5.35 -0.22 -4.92 119.36 111.35 1ozt n ILE 112 Ca 0.19 -0.73 -0.42 0.00 -0.27 0.00 0.00 62.75 61.52 1ozt n ILE 112 Cb 0.32 0.99 -0.03 0.00 -1.74 0.00 0.00 39.64 39.18 1ozt n ILE 112 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1ozt s ILE 113 N -1.34 3.89 0.00 7.28 1.01 -1.26 -2.13 121.20 128.64 1ozt s ILE 113 Ca 0.31 1.39 0.00 0.00 0.00 0.00 0.00 60.65 62.35 1ozt s ILE 113 Cb 0.19 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.77 1ozt s ILE 113 CO 0.26 0.13 0.00 0.61 0.00 0.00 0.00 174.94 175.94 1ozt n GLY 114 N 3.08 0.41 3.98 6.18 0.00 -0.15 -5.01 105.19 113.69 1ozt n GLY 114 Ca 0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 1ozt n GLY 114 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ozt s ARG 115 N -0.91 2.23 -0.08 1.61 0.52 -0.91 -2.43 118.95 118.98 1ozt s ARG 115 Ca 0.00 -1.88 -0.00 0.00 -0.52 0.00 0.00 55.73 53.32 1ozt s ARG 115 Cb 0.00 -2.37 -0.03 0.00 0.52 0.00 0.00 34.95 33.07 1ozt s ARG 115 CO 0.00 -0.83 -0.05 0.99 0.02 0.00 0.00 175.30 175.43 1ozt s THR 116 N -2.76 3.83 -0.18 0.02 2.01 -1.08 -0.54 115.64 116.93 1ozt s THR 116 Ca 0.48 -0.42 -0.09 0.00 0.31 0.00 0.00 61.69 61.96 1ozt s THR 116 Cb -0.04 -2.59 -0.05 0.00 0.01 0.00 0.00 72.50 69.84 1ozt s THR 116 CO 0.31 0.59 0.13 -0.22 -0.69 0.00 0.00 174.62 174.74 1ozt s LEU 117 N -0.68 4.26 -0.01 4.42 2.96 -0.47 0.34 118.68 129.50 1ozt s LEU 117 Ca 0.10 0.30 0.04 0.00 -0.22 0.00 0.00 54.13 54.35 1ozt s LEU 117 Cb -0.11 -2.09 -0.01 0.00 0.50 0.00 0.00 46.19 44.48 1ozt s LEU 117 CO 0.02 0.24 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.48 1ozt s VAL 118 N -0.02 0.96 -0.18 1.68 1.01 0.12 -2.67 120.40 121.30 1ozt s VAL 118 Ca 0.10 -0.54 -0.03 0.00 0.00 0.00 0.00 61.98 61.51 1ozt s VAL 118 Cb -0.11 -0.81 -0.02 0.00 0.00 0.00 0.00 36.38 35.45 1ozt s VAL 118 CO -0.00 0.25 -0.06 0.54 0.00 0.00 0.00 175.10 175.83 1ozt s VAL 119 N -0.32 3.43 0.29 2.92 0.11 -0.79 -1.38 120.40 124.66 1ozt s VAL 119 Ca 0.04 -0.50 -0.05 0.00 -2.93 0.00 0.00 61.98 58.54 1ozt s VAL 119 Cb -0.05 -2.51 -0.05 0.00 -1.53 0.00 0.00 36.38 32.24 1ozt s VAL 119 CO -0.00 0.47 0.55 -1.00 -3.33 0.00 0.00 175.10 171.78 1ozt s HIS 120 N 0.89 3.48 0.20 1.54 3.76 0.16 -1.60 115.29 123.71 1ozt s HIS 120 Ca -0.01 0.64 -0.11 0.00 -0.15 0.00 0.00 55.06 55.42 1ozt s HIS 120 Cb -0.15 -2.10 0.19 0.00 1.11 0.00 0.00 32.58 31.63 1ozt s HIS 120 CO 0.01 0.18 1.80 1.49 -0.85 0.00 0.00 174.74 177.36 1ozt h GLU 121 N 1.69 0.58 -6.19 1.40 4.81 -0.25 -3.32 114.58 113.30 1ozt h GLU 121 Ca -0.48 -0.03 -0.52 0.00 -0.13 0.00 0.00 59.36 58.20 1ozt h GLU 121 Cb 1.19 -0.13 -0.06 0.00 0.63 0.00 0.00 28.75 30.38 1ozt h GLU 121 CO 0.66 0.38 -0.56 0.15 -0.73 0.00 0.00 179.01 178.92 1ozt s LYS 122 N -6.11 2.69 0.72 1.92 1.02 -1.26 -4.83 119.74 113.88 1ozt s LYS 122 Ca -0.13 -1.21 -0.13 0.00 0.02 0.00 0.00 55.97 54.51 1ozt s LYS 122 Cb 0.15 -2.41 0.03 0.00 -0.52 0.00 0.00 37.83 35.08 1ozt s LYS 122 CO 0.75 0.35 1.12 0.00 -0.92 0.00 0.00 175.35 176.65 1ozt s ALA 123 N -2.22 2.28 -0.24 5.17 0.00 -1.12 -0.81 121.76 124.80 1ozt s ALA 123 Ca 0.33 0.54 -0.09 0.00 0.00 0.00 0.00 51.96 52.74 1ozt s ALA 123 Cb -0.07 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 1ozt s ALA 123 CO 0.23 -1.62 0.13 0.34 0.00 0.00 0.00 175.76 174.84 1ozt s ASP 124 N -2.70 5.76 0.00 0.00 -1.08 -1.26 -4.67 116.67 112.73 1ozt s ASP 124 Ca 0.67 -0.01 0.18 0.00 -0.52 0.00 0.00 52.55 52.87 1ozt s ASP 124 Cb -0.21 -2.04 1.01 0.00 -1.46 0.00 0.00 42.92 40.22 1ozt s ASP 124 CO 0.47 0.03 1.46 -0.90 0.52 0.00 0.00 175.17 176.75 1ozt n ASP 125 N 4.54 0.00 -2.10 -0.34 5.68 -1.26 -4.84 116.55 118.22 1ozt n ASP 125 Ca -0.15 -0.43 -0.14 0.00 -0.50 0.00 0.00 54.79 53.56 1ozt n ASP 125 Cb 0.52 -0.06 -0.02 0.00 -1.14 0.00 0.00 41.12 40.41 1ozt n ASP 125 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1ozt n LEU 126 N -1.06 -1.25 0.00 -2.12 4.77 -1.26 -1.51 117.00 114.57 1ozt n LEU 126 Ca 0.12 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 1ozt n LEU 126 Cb 0.08 -2.28 0.00 0.00 -2.33 0.00 0.00 43.42 38.88 1ozt n LEU 126 CO 0.11 -0.35 0.00 0.61 -1.33 0.00 0.00 177.39 176.43 1ozt n GLY 127 N -0.67 1.56 2.07 -0.72 0.00 -1.26 -4.86 105.19 101.32 1ozt n GLY 127 Ca -0.16 -0.09 -0.03 0.00 0.00 0.00 0.00 46.02 45.73 1ozt n GLY 127 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ozt n LYS 128 N 0.00 0.69 0.00 1.61 4.76 -0.57 -4.39 118.16 120.26 1ozt n LYS 128 Ca 0.00 -0.25 0.14 0.00 -2.87 0.00 0.00 58.31 55.32 1ozt n LYS 128 Cb 0.00 -1.54 0.52 0.00 -1.84 0.00 0.00 35.03 32.18 1ozt n LYS 128 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ozt n GLY 129 N 2.36 -1.30 0.55 0.72 0.00 -1.25 -4.97 105.19 101.30 1ozt n GLY 129 Ca 0.11 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1ozt n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ozt n GLY 130 N 1.44 0.83 0.00 -0.02 0.00 -1.26 -5.05 105.19 101.13 1ozt n GLY 130 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1ozt n GLY 130 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ozt n ASN 131 N 0.00 1.59 0.00 1.61 0.23 -1.26 -5.30 115.26 112.13 1ozt n ASN 131 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1ozt n ASN 131 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1ozt n ASN 131 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 1ozt n GLU 132 N 0.00 0.00 0.00 -3.83 4.07 -1.26 -5.12 120.64 114.50 1ozt n GLU 132 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1ozt n GLU 132 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1ozt n GLU 132 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ozt n GLY 141 N 0.00 1.36 3.83 8.31 0.00 -1.26 -5.27 105.19 112.15 1ozt n GLY 141 Ca 0.00 -0.13 -0.22 0.00 0.00 0.00 0.00 46.02 45.67 1ozt n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ozt s SER 142 N 1.00 5.33 -0.44 1.61 1.04 -1.26 -4.86 113.70 116.12 1ozt s SER 142 Ca 0.00 -0.41 -0.26 0.00 0.48 0.00 0.00 55.95 55.76 1ozt s SER 142 Cb 0.00 -1.13 0.03 0.00 0.10 0.00 0.00 66.02 65.01 1ozt s SER 142 CO 0.00 -0.21 0.95 -0.13 0.98 0.00 0.00 173.24 174.83 1ozt s ARG 143 N -3.92 3.61 0.08 4.02 0.52 -1.26 0.53 118.95 122.53 1ozt s ARG 143 Ca 0.37 0.28 -0.14 0.00 -0.52 0.00 0.00 55.73 55.72 1ozt s ARG 143 Cb -0.07 -3.90 -0.20 0.00 0.52 0.00 0.00 34.95 31.31 1ozt s ARG 143 CO 0.25 -1.19 1.23 -0.07 0.02 0.00 0.00 175.30 175.55 1ozt h LEU 144 N 10.54 0.86 -7.00 2.53 3.38 -1.60 -3.47 115.31 120.54 1ozt h LEU 144 Ca -0.24 -0.68 -0.01 0.00 0.09 0.00 0.00 57.88 57.04 1ozt h LEU 144 Cb 1.07 -0.26 -0.14 0.00 0.09 0.00 0.00 40.66 41.42 1ozt h LEU 144 CO 1.03 1.42 0.26 0.00 0.09 0.00 0.00 178.44 181.24 1ozt s ALA 145 N -3.53 -1.68 0.28 1.53 0.00 -1.21 -4.18 121.76 112.97 1ozt s ALA 145 Ca -0.11 0.76 -0.20 0.00 0.00 0.00 0.00 51.96 52.41 1ozt s ALA 145 Cb 0.07 0.60 0.05 0.00 0.00 0.00 0.00 23.12 23.84 1ozt s ALA 145 CO 0.90 -0.67 0.82 0.00 0.00 0.00 0.00 175.76 176.81 1ozt s GLY 147 N -3.02 -0.47 0.22 0.00 0.00 -1.09 -0.72 107.32 102.24 1ozt s GLY 147 Ca 0.14 1.02 -0.22 0.00 0.00 0.00 0.00 44.72 45.65 1ozt s GLY 147 CO 0.07 0.35 0.78 0.14 0.00 0.00 0.00 173.10 174.44 1ozt s VAL 148 N -3.08 4.45 -0.38 1.40 1.01 -1.26 -1.36 120.40 121.17 1ozt s VAL 148 Ca 0.04 1.50 -0.23 0.00 0.00 0.00 0.00 61.98 63.29 1ozt s VAL 148 Cb -0.01 -3.97 0.01 0.00 0.00 0.00 0.00 36.38 32.42 1ozt s VAL 148 CO -0.09 0.29 0.80 -0.63 0.00 0.00 0.00 175.10 175.46 1ozt s ILE 149 N -1.43 4.70 0.27 2.22 1.01 0.29 -4.50 121.20 123.77 1ozt s ILE 149 Ca 0.42 0.82 0.08 0.00 0.00 0.00 0.00 60.65 61.97 1ozt s ILE 149 Cb -0.19 -4.24 -0.04 0.00 0.01 0.00 0.00 42.46 38.00 1ozt s ILE 149 CO 0.23 -0.50 0.13 -0.83 0.00 0.00 0.00 174.94 173.97 1ozt s GLY 150 N 1.91 1.57 0.14 6.18 0.00 0.27 -0.98 107.32 116.41 1ozt s GLY 150 Ca 0.32 -1.56 -0.31 0.00 0.00 0.00 0.00 44.72 43.17 1ozt s GLY 150 CO 0.18 -1.59 1.48 -0.42 0.00 0.00 0.00 173.10 172.76 1ozt s ILE 151 N -2.24 2.97 0.29 0.90 1.01 -1.26 -0.75 121.20 122.11 1ozt s ILE 151 Ca 0.33 0.68 0.09 0.00 0.00 0.00 0.00 60.65 61.76 1ozt s ILE 151 Cb -0.07 -3.44 -0.04 0.00 0.01 0.00 0.00 42.46 38.92 1ozt s ILE 151 CO 0.23 0.05 0.08 0.00 0.00 0.00 0.00 174.94 175.31 1ozt s ALA 152 N 1.18 3.36 -2.00 9.38 0.00 -0.89 -4.78 121.76 128.01 1ozt s ALA 152 Ca 0.67 -1.69 0.29 0.00 0.00 0.00 0.00 51.96 51.24 1ozt s ALA 152 Cb -0.40 -0.83 1.76 0.00 0.00 0.00 0.00 23.12 23.65 1ozt s ALA 152 CO 0.31 0.17 2.09 0.94 0.00 0.00 0.00 175.76 179.27