#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ozy h PRO 20 N 0.00 0.00 0.00 1.20 0.13 -2.01 -0.98 132.00 130.34 2ozy h PRO 20 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 2ozy h PRO 20 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2ozy h PRO 20 CO 0.00 0.06 -0.11 -0.44 -0.23 0.00 0.00 178.00 177.28 2ozy h ASP 21 N 0.00 0.00 -0.07 1.44 5.19 -1.98 -3.11 116.42 117.89 2ozy h ASP 21 Ca -0.00 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.38 2ozy h ASP 21 Cb 0.23 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.73 2ozy h ASP 21 CO 0.01 0.11 -0.03 0.00 -3.12 0.00 0.00 179.24 176.21 2ozy h ALA 22 N 1.89 1.60 -0.39 3.45 0.00 -1.58 -1.57 119.26 122.65 2ozy h ALA 22 Ca -0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2ozy h ALA 22 Cb 0.43 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2ozy h ALA 22 CO 0.01 0.30 0.21 0.00 0.00 0.00 0.00 179.25 179.77 2ozy h ALA 23 N 1.70 0.49 -0.49 0.00 0.00 -1.70 -1.54 119.26 117.72 2ozy h ALA 23 Ca 0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2ozy h ALA 23 Cb 0.25 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2ozy h ALA 23 CO 0.01 0.02 0.20 0.00 0.00 0.00 0.00 179.25 179.48 2ozy n LEU 25 N -4.57 0.00 0.22 0.00 4.77 -0.63 -1.25 117.00 115.54 2ozy n LEU 25 Ca 0.02 0.01 0.07 0.00 -0.03 0.00 0.00 56.01 56.08 2ozy n LEU 25 Cb 0.15 -0.01 0.51 0.00 -2.33 0.00 0.00 43.42 41.74 2ozy n LEU 25 CO 0.38 -0.00 0.83 -0.78 -1.33 0.00 0.00 177.39 176.48 2ozy h ASP 26 N 0.00 0.00 0.00 -1.43 3.58 -1.05 -3.37 116.42 114.15 2ozy h ASP 26 Ca 0.00 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.40 2ozy h ASP 26 Cb 0.00 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 2ozy h ASP 26 CO 0.00 0.26 -1.20 0.00 -2.88 0.00 0.00 179.24 175.42 2ozy s HIS 28 N -2.07 3.35 -0.23 0.00 3.76 -0.38 -4.99 115.29 114.72 2ozy s HIS 28 Ca -0.05 1.52 -0.29 0.00 -0.15 0.00 0.00 55.06 56.09 2ozy s HIS 28 Cb 0.01 -2.84 -0.01 0.00 1.11 0.00 0.00 32.58 30.85 2ozy s HIS 28 CO 0.08 -0.36 1.37 0.15 -0.85 0.00 0.00 174.74 175.13 2ozy s LYS 29 N -3.74 4.00 0.43 1.40 -0.14 -1.26 -4.55 119.74 115.87 2ozy s LYS 29 Ca 0.61 1.50 0.29 0.00 -1.36 0.00 0.00 55.97 57.01 2ozy s LYS 29 Cb -0.10 -3.88 1.57 0.00 -1.68 0.00 0.00 37.83 33.73 2ozy s LYS 29 CO 0.25 -1.02 1.88 -1.35 -0.76 0.00 0.00 175.35 174.35 2ozy h PRO 30 N 9.29 0.00 0.00 -1.68 0.11 -1.88 0.54 132.00 138.37 2ozy h PRO 30 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2ozy h PRO 30 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2ozy h PRO 30 CO 1.00 0.00 -0.07 0.38 -0.21 0.00 0.00 178.00 179.10 2ozy h ASP 31 N 0.00 0.00 1.21 -2.05 2.03 -1.91 -3.10 116.42 112.61 2ozy h ASP 31 Ca 0.00 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.20 2ozy h ASP 31 Cb 0.03 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.51 2ozy h ASP 31 CO 0.00 0.12 -0.48 0.71 -1.03 0.00 0.00 179.24 178.57 2ozy h THR 32 N -0.18 0.91 -0.27 1.15 1.35 -1.96 -3.01 112.91 110.90 2ozy h THR 32 Ca 0.00 -2.01 0.00 0.00 -0.55 0.00 0.00 66.41 63.85 2ozy h THR 32 Cb 0.07 2.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 2ozy h THR 32 CO 0.00 0.47 0.00 -0.62 -0.25 0.00 0.00 175.52 175.12 2ozy n GLU 33 N -3.34 2.13 -2.85 4.72 1.02 0.12 -4.89 120.64 117.55 2ozy n GLU 33 Ca 0.01 -1.85 -0.30 0.00 -0.02 0.00 0.00 57.16 55.00 2ozy n GLU 33 Cb 0.66 -1.30 -0.03 0.00 -0.02 0.00 0.00 31.44 30.75 2ozy n GLU 33 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2ozy s GLY 34 N -1.04 1.96 -0.61 0.62 0.00 -0.81 -4.82 107.32 102.62 2ozy s GLY 34 Ca 0.23 -0.19 -0.22 0.00 0.00 0.00 0.00 44.72 44.54 2ozy s GLY 34 CO 0.18 0.01 0.90 -0.29 0.00 0.00 0.00 173.10 173.90 2ozy s MET 35 N -3.83 3.17 0.00 2.90 1.75 -1.26 -4.81 119.30 117.22 2ozy s MET 35 Ca 0.51 -0.70 0.05 0.00 -1.25 0.00 0.00 55.69 54.31 2ozy s MET 35 Cb -0.10 -4.16 0.08 0.00 2.84 0.00 0.00 34.83 33.49 2ozy s MET 35 CO 0.31 -1.64 0.84 0.72 -0.65 0.00 0.00 175.02 174.60 2ozy n HIS 36 N 7.39 0.09 -1.06 4.11 8.25 -0.81 -4.48 115.22 128.71 2ozy n HIS 36 Ca -0.03 -0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.25 2ozy n HIS 36 Cb 0.46 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.55 2ozy n HIS 36 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2ozy n GLY 37 N 0.20 -0.44 0.37 -1.41 0.00 -0.94 -4.06 105.19 98.91 2ozy n GLY 37 Ca 0.04 -1.74 0.15 0.00 0.00 0.00 0.00 46.02 44.46 2ozy n GLY 37 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2ozy h LYS 38 N 0.00 0.35 0.00 1.61 3.64 -1.83 -1.58 116.57 118.75 2ozy h LYS 38 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2ozy h LYS 38 Cb 0.00 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 2ozy h LYS 38 CO 0.00 0.23 0.00 0.72 -2.27 0.00 0.00 179.45 178.13 2ozy n HIS 39 N -4.46 0.39 0.22 1.91 8.25 -1.26 -1.77 115.22 118.50 2ozy n HIS 39 Ca 0.12 0.18 0.07 0.00 -0.26 0.00 0.00 57.72 57.83 2ozy n HIS 39 Cb 0.47 -0.78 0.52 0.00 1.12 0.00 0.00 29.99 31.31 2ozy n HIS 39 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2ozy h ALA 40 N 2.20 1.32 -0.02 -1.41 0.00 -1.50 -3.28 119.26 116.57 2ozy h ALA 40 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2ozy h ALA 40 Cb 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2ozy h ALA 40 CO 0.00 0.31 0.00 0.43 0.00 0.00 0.00 179.25 179.99 2ozy n SER 41 N -3.85 1.72 -4.93 0.00 7.64 -0.73 -4.91 113.62 108.57 2ozy n SER 41 Ca -0.02 -1.37 -0.25 0.00 1.01 0.00 0.00 58.87 58.25 2ozy n SER 41 Cb 0.34 -0.01 -0.00 0.00 -1.01 0.00 0.00 64.21 63.53 2ozy n SER 41 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2ozy s VAL 42 N -0.70 4.76 -0.17 0.44 -7.23 -1.20 -5.08 120.40 111.23 2ozy s VAL 42 Ca 0.10 -0.17 -0.08 0.00 -1.81 0.00 0.00 61.98 60.02 2ozy s VAL 42 Cb 0.07 -3.78 -0.04 0.00 0.56 0.00 0.00 36.38 33.19 2ozy s VAL 42 CO 0.10 -0.64 0.09 -0.63 -0.31 0.00 0.00 175.10 173.71 2ozy s ILE 43 N -2.57 5.05 -0.08 -0.62 -1.09 -1.26 -3.66 121.20 116.96 2ozy s ILE 43 Ca 0.45 0.05 -0.29 0.00 -2.23 0.00 0.00 60.65 58.63 2ozy s ILE 43 Cb -0.10 -3.26 -0.06 0.00 -1.58 0.00 0.00 42.46 37.45 2ozy s ILE 43 CO 0.41 0.49 1.91 0.21 -1.23 0.00 0.00 174.94 176.72 2ozy s ASN 44 N 0.06 6.25 0.26 3.58 3.84 0.45 -4.87 114.94 124.50 2ozy s ASN 44 Ca 0.07 2.23 0.23 0.00 0.21 0.00 0.00 52.86 55.60 2ozy s ASN 44 Cb -0.12 -2.53 0.99 0.00 -0.55 0.00 0.00 41.25 39.04 2ozy s ASN 44 CO 0.00 -1.27 1.69 -0.81 -2.79 0.00 0.00 177.10 173.92 2ozy n PRO 45 N 7.77 0.18 0.09 0.43 -0.04 -1.26 -0.18 135.00 141.98 2ozy n PRO 45 Ca 0.21 0.45 -0.13 0.00 -0.04 0.00 0.00 63.50 63.99 2ozy n PRO 45 Cb 0.43 -1.87 -0.13 0.00 -0.04 0.00 0.00 33.50 31.89 2ozy n PRO 45 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 2ozy h ASN 46 N 0.00 0.28 0.00 3.54 -0.26 -1.91 -3.40 115.58 113.84 2ozy h ASN 46 Ca 0.00 -0.30 0.00 0.00 -0.56 0.00 0.00 56.30 55.44 2ozy h ASN 46 Cb 0.31 -0.09 0.00 0.00 -1.06 0.00 0.00 38.32 37.47 2ozy h ASN 46 CO 0.00 1.24 0.00 -0.46 -1.06 0.00 0.00 177.43 177.15 2ozy n ASN 47 N -3.47 0.34 -1.44 5.81 0.23 -1.07 -5.02 115.26 110.63 2ozy n ASN 47 Ca -0.06 -1.03 -0.19 0.00 -0.53 0.00 0.00 54.58 52.78 2ozy n ASN 47 Cb 1.00 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.62 2ozy n ASN 47 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 2ozy n LYS 48 N -0.01 -1.40 -3.88 -3.83 4.76 0.74 -5.00 118.16 109.54 2ozy n LYS 48 Ca 0.00 1.16 -0.21 0.00 -2.87 0.00 0.00 58.31 56.39 2ozy n LYS 48 Cb 0.20 -5.51 -0.04 0.00 -1.84 0.00 0.00 35.03 27.84 2ozy n LYS 48 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2ozy s LEU 49 N -4.29 3.72 0.44 -0.35 1.43 -1.25 -4.83 118.68 113.55 2ozy s LEU 49 Ca 0.00 -0.38 -0.24 0.00 -1.03 0.00 0.00 54.13 52.48 2ozy s LEU 49 Cb 0.00 -2.32 -0.10 0.00 0.03 0.00 0.00 46.19 43.80 2ozy s LEU 49 CO 0.00 -0.25 1.16 -2.65 0.23 0.00 0.00 176.35 174.83 2ozy n PRO 50 N -1.34 1.63 -1.91 1.29 -0.02 -1.26 -0.41 135.00 132.97 2ozy n PRO 50 Ca -0.04 0.58 -0.41 0.00 -2.02 0.00 0.00 63.50 61.61 2ozy n PRO 50 Cb 0.59 -2.25 -0.02 0.00 -0.02 0.00 0.00 33.50 31.80 2ozy n PRO 50 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2ozy s VAL 51 N -1.25 2.42 0.34 -1.45 1.01 -1.24 -4.70 120.40 115.53 2ozy s VAL 51 Ca 0.63 0.35 0.09 0.00 0.00 0.00 0.00 61.98 63.05 2ozy s VAL 51 Cb -0.52 -3.22 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 2ozy s VAL 51 CO 0.56 0.06 0.05 0.42 0.00 0.00 0.00 175.10 176.19 2ozy s THR 52 N 0.01 2.71 0.24 3.92 -4.23 -1.26 -4.96 115.64 112.06 2ozy s THR 52 Ca 0.61 -1.89 -0.06 0.00 -1.18 0.00 0.00 61.69 59.17 2ozy s THR 52 Cb -0.44 -2.86 0.23 0.00 1.34 0.00 0.00 72.50 70.77 2ozy s THR 52 CO 0.45 -0.18 1.68 0.00 -0.54 0.00 0.00 174.62 176.03 2ozy h THR 54 N 0.25 0.00 -0.19 0.00 1.35 -1.94 -1.11 112.91 111.27 2ozy h THR 54 Ca 0.40 -0.44 -0.00 0.00 -0.55 0.00 0.00 66.41 65.82 2ozy h THR 54 Cb 0.68 1.40 -0.01 0.00 -1.73 0.00 0.00 68.15 68.49 2ozy h THR 54 CO -0.51 0.00 0.11 0.78 -0.25 0.00 0.00 175.52 175.65 2ozy h ASN 55 N 0.00 0.23 0.00 5.36 -0.26 -1.60 -0.13 115.58 119.18 2ozy h ASN 55 Ca 0.00 -0.01 -0.32 0.00 -0.56 0.00 0.00 56.30 55.41 2ozy h ASN 55 Cb 0.45 -0.06 -0.06 0.00 -1.06 0.00 0.00 38.32 37.60 2ozy h ASN 55 CO 0.00 0.19 -2.20 0.00 -1.06 0.00 0.00 177.43 174.35 2ozy n HIS 57 N -2.82 0.00 -4.54 0.00 8.25 -0.45 -4.71 115.22 110.95 2ozy n HIS 57 Ca -0.32 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.14 2ozy n HIS 57 Cb 1.00 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 32.08 2ozy n HIS 57 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2ozy n GLY 58 N 1.42 0.29 3.18 -1.41 0.00 -0.07 -0.76 105.19 107.84 2ozy n GLY 58 Ca 0.03 -0.87 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 2ozy n GLY 58 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ozy s GLN 59 N 0.00 2.48 0.55 1.61 -0.21 -1.26 -4.37 119.66 118.46 2ozy s GLN 59 Ca 0.00 -0.75 -0.20 0.00 0.02 0.00 0.00 55.36 54.43 2ozy s GLN 59 Cb 0.00 -1.98 -0.05 0.00 1.00 0.00 0.00 33.01 31.98 2ozy s GLN 59 CO 0.00 0.20 1.19 -2.14 -2.12 0.00 0.00 175.29 172.42 2ozy s PRO 60 N 0.25 3.22 0.56 2.91 0.02 -1.26 -3.98 135.00 136.71 2ozy s PRO 60 Ca -0.12 1.78 0.08 0.00 0.02 0.00 0.00 61.00 62.76 2ozy s PRO 60 Cb -0.16 -2.04 0.08 0.00 0.02 0.00 0.00 34.50 32.40 2ozy s PRO 60 CO 0.06 -0.99 0.77 -1.54 -0.33 0.00 0.00 177.00 174.97 2ozy s SER 61 N -1.57 5.14 0.64 2.53 1.04 -1.26 -4.97 113.70 115.25 2ozy s SER 61 Ca 0.74 -0.73 0.40 0.00 0.48 0.00 0.00 55.95 56.84 2ozy s SER 61 Cb -0.29 0.10 2.24 0.00 0.10 0.00 0.00 66.02 68.16 2ozy s SER 61 CO 0.32 -1.28 2.33 -0.65 0.98 0.00 0.00 173.24 174.94 2ozy h PRO 62 N 0.20 0.00 -0.56 4.02 0.11 -2.06 -1.96 132.00 131.76 2ozy h PRO 62 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2ozy h PRO 62 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2ozy h PRO 62 CO 0.42 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.25 2ozy n GLN 63 N -3.30 2.48 -0.24 1.05 3.00 -1.26 -4.69 117.38 114.43 2ozy n GLN 63 Ca -0.03 -1.96 0.02 0.00 -0.01 0.00 0.00 57.00 55.02 2ozy n GLN 63 Cb 0.08 -1.52 0.11 0.00 0.00 0.00 0.00 30.24 28.91 2ozy n GLN 63 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.06 178.31 2ozy h HIS 64 N 3.05 -0.20 0.00 1.08 2.76 -1.73 -0.89 115.15 119.22 2ozy h HIS 64 Ca 0.00 0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 2ozy h HIS 64 Cb 0.85 0.20 0.00 0.00 1.55 0.00 0.00 27.41 30.01 2ozy h HIS 64 CO 0.42 -0.26 0.00 0.54 -1.30 0.00 0.00 177.93 177.34 2ozy n ARG 65 N -5.39 0.17 0.06 5.26 1.74 -1.26 -2.26 116.66 114.98 2ozy n ARG 65 Ca 0.10 0.54 0.13 0.00 -0.77 0.00 0.00 57.85 57.85 2ozy n ARG 65 Cb 0.40 -1.93 0.33 0.00 -1.02 0.00 0.00 32.46 30.24 2ozy n ARG 65 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2ozy n GLU 66 N -2.26 0.20 -1.05 5.56 -0.58 -0.34 -4.98 120.64 117.18 2ozy n GLU 66 Ca 0.00 0.10 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 2ozy n GLU 66 Cb 0.12 -1.67 0.00 0.00 -0.57 0.00 0.00 31.44 29.33 2ozy n GLU 66 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ozy n GLY 67 N 1.38 -0.22 3.40 0.62 0.00 -0.96 -5.12 105.19 104.29 2ozy n GLY 67 Ca 0.05 -0.29 -0.20 0.00 0.00 0.00 0.00 46.02 45.59 2ozy n GLY 67 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ozy s VAL 68 N -1.01 1.07 -0.31 1.61 -7.23 -1.26 -5.04 120.40 108.23 2ozy s VAL 68 Ca 0.00 -2.02 -0.07 0.00 -1.81 0.00 0.00 61.98 58.09 2ozy s VAL 68 Cb 0.00 -2.64 -0.23 0.00 0.56 0.00 0.00 36.38 34.07 2ozy s VAL 68 CO 0.00 -0.09 3.43 0.29 -0.31 0.00 0.00 175.10 178.41 2ozy n LYS 69 N -0.58 2.27 -0.04 4.82 5.02 -1.26 -4.39 118.16 124.01 2ozy n LYS 69 Ca -0.03 -1.21 -0.03 0.00 -2.02 0.00 0.00 58.31 55.03 2ozy n LYS 69 Cb 0.66 -2.14 -0.01 0.00 -0.02 0.00 0.00 35.03 33.52 2ozy n LYS 69 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2ozy n ASP 70 N 2.73 0.87 -4.86 4.39 5.68 -1.26 -4.96 116.55 119.13 2ozy n ASP 70 Ca 0.49 0.36 -0.31 0.00 -0.50 0.00 0.00 54.79 54.83 2ozy n ASP 70 Cb 0.77 -0.66 -0.05 0.00 -1.14 0.00 0.00 41.12 40.04 2ozy n ASP 70 CO 0.00 0.00 0.00 0.68 -1.33 0.00 0.00 177.20 176.55 2ozy s VAL 71 N -1.67 4.74 0.36 2.12 -7.23 -1.26 -4.34 120.40 113.13 2ozy s VAL 71 Ca -0.09 0.76 -0.27 0.00 -1.81 0.00 0.00 61.98 60.58 2ozy s VAL 71 Cb 0.01 -3.67 -0.09 0.00 0.56 0.00 0.00 36.38 33.19 2ozy s VAL 71 CO 0.13 -0.34 1.18 -0.32 -0.31 0.00 0.00 175.10 175.43 2ozy s MET 72 N -3.40 4.27 -0.08 4.82 1.75 0.06 -5.03 119.30 121.69 2ozy s MET 72 Ca 0.52 1.90 0.02 0.00 -1.25 0.00 0.00 55.69 56.88 2ozy s MET 72 Cb -0.10 -2.88 0.01 0.00 2.84 0.00 0.00 34.83 34.70 2ozy s MET 72 CO 0.24 -0.15 -0.14 1.03 -0.65 0.00 0.00 175.02 175.35 2ozy s ARG 73 N -1.99 1.99 -0.13 4.11 0.52 -1.26 -4.79 118.95 117.40 2ozy s ARG 73 Ca 0.52 -0.50 -0.07 0.00 -0.52 0.00 0.00 55.73 55.16 2ozy s ARG 73 Cb -0.33 -1.65 -0.04 0.00 0.52 0.00 0.00 34.95 33.45 2ozy s ARG 73 CO 0.42 0.01 0.12 -0.06 0.02 0.00 0.00 175.30 175.80 2ozy s PHE 74 N 0.76 3.49 -1.63 -0.53 0.08 -1.26 -4.39 117.98 114.49 2ozy s PHE 74 Ca -0.12 0.42 -0.00 0.00 0.12 0.00 0.00 56.93 57.35 2ozy s PHE 74 Cb -0.16 -1.96 0.00 0.00 -0.57 0.00 0.00 43.02 40.33 2ozy s PHE 74 CO 0.02 0.59 0.05 -1.71 -0.10 0.00 0.00 175.22 174.08 2ozy n ASN 75 N 2.35 -5.58 -4.32 1.36 4.05 -1.25 -5.01 115.26 106.86 2ozy n ASN 75 Ca -0.19 -0.04 -0.20 0.00 0.45 0.00 0.00 54.58 54.60 2ozy n ASN 75 Cb 0.54 -4.60 -0.11 0.00 1.23 0.00 0.00 39.78 36.85 2ozy n ASN 75 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 2ozy s GLU 76 N -5.02 1.25 0.00 1.20 0.41 -1.13 -4.41 118.70 111.00 2ozy s GLU 76 Ca 0.02 -1.44 0.17 0.00 -0.41 0.00 0.00 54.97 53.31 2ozy s GLU 76 Cb -0.01 -1.17 0.71 0.00 -1.78 0.00 0.00 34.13 31.88 2ozy s GLU 76 CO 0.03 0.22 1.53 -0.35 -0.49 0.00 0.00 175.26 176.20 2ozy n PRO 77 N 0.09 0.00 -0.18 0.39 -0.04 -1.26 -4.04 135.00 129.96 2ozy n PRO 77 Ca -0.12 0.22 -0.06 0.00 -0.04 0.00 0.00 63.50 63.50 2ozy n PRO 77 Cb 0.58 -1.51 0.03 0.00 -0.04 0.00 0.00 33.50 32.57 2ozy n PRO 77 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 2ozy h MET 78 N 0.00 0.66 -6.34 0.54 4.05 -1.92 -3.43 114.93 108.48 2ozy h MET 78 Ca 0.00 -0.04 -0.68 0.00 -0.28 0.00 0.00 59.70 58.70 2ozy h MET 78 Cb 0.29 -0.15 -0.18 0.00 -0.80 0.00 0.00 31.60 30.76 2ozy h MET 78 CO 0.00 0.43 -0.72 0.71 0.23 0.00 0.00 176.91 177.56 2ozy s TYR 79 N -6.14 2.83 0.65 1.39 2.02 -1.26 -5.12 117.35 111.72 2ozy s TYR 79 Ca -0.13 -0.08 -0.18 0.00 -0.37 0.00 0.00 57.07 56.31 2ozy s TYR 79 Cb 0.13 -1.58 -0.02 0.00 -0.40 0.00 0.00 41.96 40.09 2ozy s TYR 79 CO 0.74 0.35 1.17 1.63 -1.57 0.00 0.00 175.55 177.88 2ozy n LYS 80 N 1.52 0.98 -0.24 -0.62 5.02 -1.26 -4.81 118.16 118.75 2ozy n LYS 80 Ca -0.15 0.39 0.04 0.00 -2.02 0.00 0.00 58.31 56.56 2ozy n LYS 80 Cb 0.52 -2.40 0.15 0.00 -0.02 0.00 0.00 35.03 33.28 2ozy n LYS 80 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2ozy h VAL 81 N 0.41 0.46 -0.63 -0.18 2.07 -1.90 -1.79 116.25 114.69 2ozy h VAL 81 Ca -0.50 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 66.95 2ozy h VAL 81 Cb 1.35 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 2ozy h VAL 81 CO 0.52 0.03 0.34 1.23 0.02 0.00 0.00 177.57 179.71 2ozy h GLY 82 N 0.18 0.93 0.77 2.17 0.00 -1.85 -0.86 103.07 104.40 2ozy h GLY 82 Ca 0.39 -0.41 -0.07 0.00 0.00 0.00 0.00 47.33 47.24 2ozy h GLY 82 CO -0.56 0.39 -0.15 0.83 0.00 0.00 0.00 176.54 177.06 2ozy h GLU 83 N 0.88 0.40 0.16 4.80 5.08 -1.71 -1.69 114.58 122.50 2ozy h GLU 83 Ca 0.22 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2ozy h GLU 83 Cb 0.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2ozy h GLU 83 CO -0.04 0.76 -0.14 1.96 -1.00 0.00 0.00 179.01 180.56 2ozy h GLN 84 N 0.05 -0.30 0.00 2.33 4.20 -1.14 -3.15 115.11 117.09 2ozy h GLN 84 Ca 0.03 0.02 -0.11 0.00 0.06 0.00 0.00 58.65 58.65 2ozy h GLN 84 Cb 0.68 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.51 2ozy h GLN 84 CO 0.04 -0.20 -0.54 -0.91 -0.67 0.00 0.00 178.83 176.54 2ozy h ASN 85 N -0.31 0.00 -0.34 1.46 4.21 -1.17 -3.01 115.58 116.42 2ozy h ASN 85 Ca -0.00 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.51 2ozy h ASN 85 Cb 0.29 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.47 2ozy h ASN 85 CO -0.02 0.54 0.21 0.77 -1.29 0.00 0.00 177.43 177.64 2ozy h SER 86 N 0.00 0.40 -0.55 5.81 4.64 -1.26 -2.04 113.55 120.56 2ozy h SER 86 Ca -0.01 -0.01 0.05 0.00 -0.47 0.00 0.00 61.79 61.35 2ozy h SER 86 Cb 0.96 -0.10 -0.05 0.00 -0.31 0.00 0.00 62.40 62.90 2ozy h SER 86 CO 0.07 0.31 0.27 0.58 -0.87 0.00 0.00 176.83 177.19 2ozy h VAL 87 N 0.47 0.94 -0.82 0.95 2.07 -1.59 -1.70 116.25 116.56 2ozy h VAL 87 Ca 0.13 -0.18 0.11 0.00 0.82 0.00 0.00 66.70 67.57 2ozy h VAL 87 Cb -0.03 0.37 -0.06 0.00 -1.52 0.00 0.00 31.29 30.06 2ozy h VAL 87 CO -0.02 0.10 0.54 0.00 0.02 0.00 0.00 177.57 178.20 2ozy n MET 89 N -4.52 0.98 0.16 0.00 2.81 -0.65 -1.52 117.12 114.38 2ozy n MET 89 Ca 0.14 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.17 2ozy n MET 89 Cb 0.35 -1.35 0.46 0.00 -0.71 0.00 0.00 33.22 31.97 2ozy n MET 89 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2ozy h SER 90 N 0.00 0.00 0.00 7.83 4.64 -1.16 -3.38 113.55 121.48 2ozy h SER 90 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ozy h SER 90 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2ozy h SER 90 CO 0.00 0.00 -0.88 0.00 -0.87 0.00 0.00 176.83 175.08 2ozy s HIS 92 N -1.90 3.58 -0.20 0.00 4.02 -0.57 -4.98 115.29 115.23 2ozy s HIS 92 Ca 0.00 1.19 -0.01 0.00 1.02 0.00 0.00 55.06 57.26 2ozy s HIS 92 Cb 0.00 -2.61 0.01 0.00 -1.02 0.00 0.00 32.58 28.96 2ozy s HIS 92 CO 0.00 -0.51 -0.14 -0.51 1.02 0.00 0.00 174.74 174.61 2ozy s LEU 93 N -4.82 2.48 0.30 0.89 1.43 -1.26 -4.61 118.68 113.09 2ozy s LEU 93 Ca 0.54 -0.59 0.06 0.00 -1.03 0.00 0.00 54.13 53.11 2ozy s LEU 93 Cb -0.11 -1.58 0.77 0.00 0.03 0.00 0.00 46.19 45.30 2ozy s LEU 93 CO 0.47 -0.02 1.75 -0.65 0.23 0.00 0.00 176.35 178.13 2ozy h PRO 94 N 8.00 0.64 -0.77 1.29 0.11 -1.97 -0.82 132.00 138.48 2ozy h PRO 94 Ca -0.43 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.65 2ozy h PRO 94 Cb 1.14 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.07 2ozy h PRO 94 CO 0.62 0.42 0.50 1.49 -0.21 0.00 0.00 178.00 180.83 2ozy h GLU 95 N 0.66 1.02 -0.20 1.05 4.81 -2.01 -2.63 114.58 117.29 2ozy h GLU 95 Ca 0.59 -0.07 -0.17 0.00 -0.13 0.00 0.00 59.36 59.58 2ozy h GLU 95 Cb 1.00 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 30.15 2ozy h GLU 95 CO -0.43 0.68 -0.59 1.96 -0.73 0.00 0.00 179.01 179.90 2ozy h GLN 96 N 1.04 0.64 -0.89 1.92 1.08 -1.62 -3.04 115.11 114.25 2ozy h GLN 96 Ca 0.28 -0.42 0.07 0.00 -1.45 0.00 0.00 58.65 57.12 2ozy h GLN 96 Cb -0.11 0.06 -0.06 0.00 -0.05 0.00 0.00 27.48 27.31 2ozy h GLN 96 CO -0.06 1.04 0.55 -0.07 -0.95 0.00 0.00 178.83 179.34 2ozy h LEU 97 N 0.48 0.86 -1.02 1.46 3.38 -1.07 -1.73 115.31 117.67 2ozy h LEU 97 Ca 0.00 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.02 2ozy h LEU 97 Cb 1.16 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.69 2ozy h LEU 97 CO 0.12 0.55 0.65 1.56 0.09 0.00 0.00 178.44 181.40 2ozy h GLN 98 N 0.99 1.25 0.00 1.13 1.08 -1.38 -0.79 115.11 117.39 2ozy h GLN 98 Ca 0.39 -0.07 -0.10 0.00 -1.45 0.00 0.00 58.65 57.41 2ozy h GLN 98 Cb 0.19 -0.28 -0.01 0.00 -0.05 0.00 0.00 27.48 27.33 2ozy h GLN 98 CO -0.18 0.82 -0.48 0.87 -0.95 0.00 0.00 178.83 178.91 2ozy h LYS 99 N 1.28 0.00 0.17 1.46 1.57 -1.23 -3.12 116.57 116.70 2ozy h LYS 99 Ca 0.39 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.87 2ozy h LYS 99 Cb -0.04 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.30 2ozy h LYS 99 CO -0.11 0.48 -1.26 0.00 -0.57 0.00 0.00 179.45 177.99 2ozy h ALA 100 N 1.52 -0.08 -0.83 3.86 0.00 -0.71 -3.46 119.26 119.56 2ozy h ALA 100 Ca -0.00 -0.79 0.10 0.00 0.00 0.00 0.00 54.91 54.22 2ozy h ALA 100 Cb 0.87 0.13 -0.21 0.00 0.00 0.00 0.00 17.79 18.59 2ozy h ALA 100 CO 0.06 0.64 -0.24 0.12 0.00 0.00 0.00 179.25 179.83 2ozy s PHE 101 N -2.78 -1.45 0.24 0.00 5.36 -0.36 -5.08 117.98 113.90 2ozy s PHE 101 Ca -0.10 1.16 -0.06 0.00 -0.96 0.00 0.00 56.93 56.97 2ozy s PHE 101 Cb 0.04 0.37 0.44 0.00 -0.34 0.00 0.00 43.02 43.53 2ozy s PHE 101 CO 0.92 -0.82 1.67 2.35 -1.46 0.00 0.00 175.22 177.88 2ozy h TRP 102 N 7.91 0.17 0.00 10.12 7.01 -1.77 -2.26 115.95 137.13 2ozy h TRP 102 Ca -0.11 0.05 0.00 0.00 2.11 0.00 0.00 58.89 60.93 2ozy h TRP 102 Cb 1.18 0.04 0.00 0.00 -2.10 0.00 0.00 29.16 28.27 2ozy h TRP 102 CO 0.13 -0.13 0.08 -2.30 -2.79 0.00 0.00 178.44 173.44 2ozy n PRO 103 N -5.21 0.00 -0.13 2.65 -0.02 -1.26 -3.27 135.00 127.76 2ozy n PRO 103 Ca 0.13 0.42 -0.05 0.00 -2.02 0.00 0.00 63.50 61.98 2ozy n PRO 103 Cb 0.45 -1.58 0.02 0.00 -0.02 0.00 0.00 33.50 32.36 2ozy n PRO 103 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2ozy h HIS 104 N 0.00 -0.48 -0.34 6.00 3.86 -1.71 -3.19 115.15 119.29 2ozy h HIS 104 Ca 0.00 0.05 0.04 0.00 -1.16 0.00 0.00 60.37 59.30 2ozy h HIS 104 Cb 0.16 0.28 -0.04 0.00 1.06 0.00 0.00 27.41 28.88 2ozy h HIS 104 CO 0.00 -0.28 0.10 0.22 0.86 0.00 0.00 177.93 178.84 2ozy h ASP 105 N -0.11 0.10 0.64 2.45 3.58 -1.83 -1.42 116.42 119.83 2ozy h ASP 105 Ca 0.21 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.70 2ozy h ASP 105 Cb 0.43 0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.52 2ozy h ASP 105 CO -0.50 0.09 0.00 -0.37 -2.88 0.00 0.00 179.24 175.58 2ozy h VAL 106 N 0.24 0.00 0.00 2.25 -1.51 -1.81 -2.91 116.25 112.51 2ozy h VAL 106 Ca 0.15 -0.26 0.00 0.00 -1.23 0.00 0.00 66.70 65.37 2ozy h VAL 106 Cb 0.14 1.06 0.00 0.00 -2.13 0.00 0.00 31.29 30.36 2ozy h VAL 106 CO -0.17 0.00 -1.19 1.41 -1.23 0.00 0.00 177.57 176.39 2ozy n HIS 107 N -2.59 0.00 -0.34 5.19 8.25 -0.59 -4.50 115.22 120.64 2ozy n HIS 107 Ca 0.01 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.51 2ozy n HIS 107 Cb 0.21 -0.10 0.20 0.00 1.12 0.00 0.00 29.99 31.42 2ozy n HIS 107 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2ozy h VAL 108 N 0.00 0.96 -0.23 1.59 2.07 -1.20 -0.37 116.25 119.06 2ozy h VAL 108 Ca 0.00 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.18 2ozy h VAL 108 Cb 0.60 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 2ozy h VAL 108 CO 0.00 0.18 0.00 0.35 0.02 0.00 0.00 177.57 178.12 2ozy n THR 109 N -4.63 0.28 -0.03 2.57 -2.24 -1.26 -4.70 114.28 104.27 2ozy n THR 109 Ca 0.16 -0.64 -0.03 0.00 -2.27 0.00 0.00 64.05 61.28 2ozy n THR 109 Cb 0.29 1.21 -0.04 0.00 -2.10 0.00 0.00 70.33 69.69 2ozy n THR 109 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2ozy n LYS 110 N 1.42 2.93 -3.86 -0.78 4.76 -0.21 -4.56 118.16 117.85 2ozy n LYS 110 Ca 0.17 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.49 2ozy n LYS 110 Cb 0.60 -1.13 -0.10 0.00 -1.84 0.00 0.00 35.03 32.56 2ozy n LYS 110 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2ozy s VAL 111 N -2.12 0.07 0.24 -0.18 0.11 -0.84 -4.79 120.40 112.89 2ozy s VAL 111 Ca -0.03 -0.56 -0.31 0.00 -2.93 0.00 0.00 61.98 58.14 2ozy s VAL 111 Cb 0.02 -0.41 -0.12 0.00 -1.53 0.00 0.00 36.38 34.33 2ozy s VAL 111 CO 0.20 -0.31 1.64 0.00 -3.33 0.00 0.00 175.10 173.31 2ozy n ALA 112 N 1.71 2.49 -0.33 1.54 0.00 -0.65 -4.75 120.51 120.52 2ozy n ALA 112 Ca -0.21 0.40 0.14 0.00 0.00 0.00 0.00 53.44 53.76 2ozy n ALA 112 Cb 0.56 -2.47 0.36 0.00 0.00 0.00 0.00 19.45 17.90 2ozy n ALA 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ozy n ALA 114 N -2.38 2.58 0.19 0.00 0.00 -1.26 -1.63 120.51 118.00 2ozy n ALA 114 Ca 0.21 -0.16 0.05 0.00 0.00 0.00 0.00 53.44 53.54 2ozy n ALA 114 Cb 0.57 -1.41 0.34 0.00 0.00 0.00 0.00 19.45 18.95 2ozy n ALA 114 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2ozy h SER 115 N 0.00 0.00 0.00 0.00 0.02 -1.57 -3.37 113.55 108.64 2ozy h SER 115 Ca 0.00 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.69 2ozy h SER 115 Cb 0.00 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.50 2ozy h SER 115 CO 0.00 0.39 -1.81 0.00 -1.14 0.00 0.00 176.83 174.27 2ozy s HIS 117 N -2.57 3.95 -0.28 0.00 3.76 -0.65 -4.44 115.29 115.05 2ozy s HIS 117 Ca -0.31 1.88 0.01 0.00 -0.15 0.00 0.00 55.06 56.49 2ozy s HIS 117 Cb 0.10 -2.96 0.06 0.00 1.11 0.00 0.00 32.58 30.88 2ozy s HIS 117 CO 0.41 0.43 -0.05 0.45 -0.85 0.00 0.00 174.74 175.13 2ozy s SER 118 N -1.24 4.67 -0.06 1.40 0.15 -1.26 -4.43 113.70 112.94 2ozy s SER 118 Ca 0.42 -1.34 0.20 0.00 0.70 0.00 0.00 55.95 55.93 2ozy s SER 118 Cb -0.25 -1.63 -0.27 0.00 -1.71 0.00 0.00 66.02 62.16 2ozy s SER 118 CO 0.31 -0.23 0.43 0.18 1.20 0.00 0.00 173.24 175.12 2ozy n LEU 119 N 4.52 0.14 0.07 3.45 4.77 -1.26 -4.10 117.00 124.59 2ozy n LEU 119 Ca -0.13 0.06 -0.21 0.00 -0.03 0.00 0.00 56.01 55.70 2ozy n LEU 119 Cb 0.43 0.16 -0.11 0.00 -2.33 0.00 0.00 43.42 41.56 2ozy n LEU 119 CO 0.24 0.16 0.01 0.45 -1.33 0.00 0.00 177.39 176.92 2ozy h HIS 120 N 0.00 1.00 -3.59 -1.77 3.86 -1.93 -3.18 115.15 109.55 2ozy h HIS 120 Ca -0.19 -0.59 -0.45 0.00 -1.16 0.00 0.00 60.37 57.99 2ozy h HIS 120 Cb 1.44 -0.10 0.19 0.00 1.06 0.00 0.00 27.41 30.01 2ozy h HIS 120 CO 0.00 1.43 0.10 -2.14 0.86 0.00 0.00 177.93 178.18 2ozy s PRO 121 N -3.15 -0.22 0.60 2.45 0.02 -1.26 -1.92 135.00 131.52 2ozy s PRO 121 Ca -0.09 0.78 0.31 0.00 0.02 0.00 0.00 61.00 62.01 2ozy s PRO 121 Cb 0.06 -1.64 1.82 0.00 0.02 0.00 0.00 34.50 34.76 2ozy s PRO 121 CO 0.92 -3.24 2.21 1.96 -0.33 0.00 0.00 177.00 178.53 2ozy h GLN 122 N -2.27 0.00 -3.86 5.54 4.20 -1.91 -2.49 115.11 114.32 2ozy h GLN 122 Ca -0.57 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 57.97 2ozy h GLN 122 Cb 1.32 0.00 -0.21 0.00 0.30 0.00 0.00 27.48 28.90 2ozy h GLN 122 CO 0.52 0.00 -0.64 -1.14 -0.67 0.00 0.00 178.83 176.90 2ozy s GLN 123 N -4.58 0.36 -0.22 1.46 0.74 -1.26 -4.63 119.66 111.53 2ozy s GLN 123 Ca -0.05 -0.57 -0.14 0.00 0.05 0.00 0.00 55.36 54.65 2ozy s GLN 123 Cb 0.15 0.14 -0.04 0.00 1.10 0.00 0.00 33.01 34.35 2ozy s GLN 123 CO 0.53 -0.07 0.33 0.34 -0.55 0.00 0.00 175.29 175.87 2ozy s ASP 124 N -1.47 6.32 0.42 6.67 2.15 -1.26 -4.90 116.67 124.60 2ozy s ASP 124 Ca -0.15 0.37 0.24 0.00 0.43 0.00 0.00 52.55 53.44 2ozy s ASP 124 Cb -0.09 -2.20 1.25 0.00 -0.30 0.00 0.00 42.92 41.59 2ozy s ASP 124 CO -0.01 -0.06 1.72 0.00 -0.17 0.00 0.00 175.17 176.66 2ozy h THR 125 N 5.09 0.37 0.00 1.71 1.03 -1.86 -1.05 112.91 118.20 2ozy h THR 125 Ca -0.36 -0.09 -0.09 0.00 -0.01 0.00 0.00 66.41 65.86 2ozy h THR 125 Cb 1.16 0.10 -0.01 0.00 -1.07 0.00 0.00 68.15 68.33 2ozy h THR 125 CO 0.69 0.05 -0.44 0.24 -0.01 0.00 0.00 175.52 176.04 2ozy h MET 126 N 0.25 0.00 0.00 0.00 2.86 -1.94 -3.00 114.93 113.11 2ozy h MET 126 Ca 0.67 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.31 2ozy h MET 126 Cb 1.95 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.61 2ozy h MET 126 CO -0.32 0.44 -0.27 1.04 1.06 0.00 0.00 176.91 178.87 2ozy n GLN 127 N -3.81 0.25 0.00 1.72 1.13 -0.40 -3.67 117.38 112.60 2ozy n GLN 127 Ca -0.01 0.15 0.10 0.00 -1.94 0.00 0.00 57.00 55.30 2ozy n GLN 127 Cb 0.50 -1.73 0.03 0.00 0.11 0.00 0.00 30.24 29.15 2ozy n GLN 127 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2ozy n THR 128 N -2.14 0.00 -1.72 5.09 -2.24 -1.14 -5.00 114.28 107.12 2ozy n THR 128 Ca 0.05 -0.38 -0.42 0.00 -2.27 0.00 0.00 64.05 61.03 2ozy n THR 128 Cb 0.43 1.32 -0.01 0.00 -2.10 0.00 0.00 70.33 69.97 2ozy n THR 128 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2ozy n LEU 129 N 0.46 3.91 -4.71 3.22 4.77 -1.16 -5.00 117.00 118.51 2ozy n LEU 129 Ca 0.10 1.19 -0.29 0.00 -0.03 0.00 0.00 56.01 56.98 2ozy n LEU 129 Cb 0.47 -1.53 0.16 0.00 -2.33 0.00 0.00 43.42 40.19 2ozy n LEU 129 CO 0.20 -0.20 0.66 -0.94 -1.33 0.00 0.00 177.39 175.78 2ozy s SER 130 N 0.03 2.90 0.23 -1.43 1.04 -1.26 -4.84 113.70 110.37 2ozy s SER 130 Ca 0.59 1.16 -0.06 0.00 0.48 0.00 0.00 55.95 58.13 2ozy s SER 130 Cb -0.55 -1.81 0.39 0.00 0.10 0.00 0.00 66.02 64.15 2ozy s SER 130 CO 0.57 -2.95 1.75 0.44 0.98 0.00 0.00 173.24 174.02 2ozy h ASP 131 N -1.77 0.34 -0.65 7.02 3.32 -1.99 -1.82 116.42 120.85 2ozy h ASP 131 Ca -0.53 0.09 -0.06 0.00 0.02 0.00 0.00 57.03 56.54 2ozy h ASP 131 Cb 1.33 0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.90 2ozy h ASP 131 CO 0.58 0.16 0.16 0.11 -1.72 0.00 0.00 179.24 178.53 2ozy h LYS 132 N 0.49 1.05 -0.15 3.56 1.79 -2.01 -2.98 116.57 118.32 2ozy h LYS 132 Ca 0.38 -0.25 -0.02 0.00 -2.18 0.00 0.00 60.65 58.58 2ozy h LYS 132 Cb 0.51 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 31.01 2ozy h LYS 132 CO -0.34 0.94 0.01 0.78 -1.08 0.00 0.00 179.45 179.76 2ozy h GLY 133 N 0.97 0.23 1.12 3.86 0.00 -1.71 -0.88 103.07 106.67 2ozy h GLY 133 Ca 0.20 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.43 2ozy h GLY 133 CO 0.00 0.10 0.00 0.54 0.00 0.00 0.00 176.54 177.19 2ozy n ARG 134 N -4.42 0.73 -0.05 4.80 1.74 -0.79 -2.15 116.66 116.53 2ozy n ARG 134 Ca -0.01 0.01 -0.07 0.00 -0.77 0.00 0.00 57.85 57.01 2ozy n ARG 134 Cb 0.16 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.04 2ozy n ARG 134 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2ozy n ILE 135 N -1.06 0.65 0.01 0.55 5.41 -0.73 -4.66 119.36 119.53 2ozy n ILE 135 Ca 0.18 -0.29 0.03 0.00 1.00 0.00 0.00 62.75 63.68 2ozy n ILE 135 Cb 0.12 -0.87 0.40 0.00 -0.71 0.00 0.00 39.64 38.58 2ozy n ILE 135 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2ozy h LYS 136 N 0.00 0.51 -0.66 0.38 3.64 -0.96 -2.04 116.57 117.42 2ozy h LYS 136 Ca -0.25 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.08 2ozy h LYS 136 Cb 1.44 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 33.12 2ozy h LYS 136 CO -0.03 0.39 0.44 -0.84 -2.27 0.00 0.00 179.45 177.14 2ozy h ILE 137 N 0.51 1.17 -0.08 2.00 3.07 -1.70 0.13 117.51 122.62 2ozy h ILE 137 Ca 0.13 -0.32 -0.00 0.00 1.55 0.00 0.00 64.86 66.22 2ozy h ILE 137 Cb 0.05 0.20 -0.00 0.00 -0.27 0.00 0.00 36.82 36.79 2ozy h ILE 137 CO -0.02 0.17 0.04 0.00 -1.05 0.00 0.00 178.15 177.28 2ozy h VAL 139 N -0.01 1.14 0.01 0.00 2.07 -1.21 -1.50 116.25 116.74 2ozy h VAL 139 Ca 0.03 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 2ozy h VAL 139 Cb 0.15 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 2ozy h VAL 139 CO -0.00 0.14 -0.00 0.44 0.02 0.00 0.00 177.57 178.16 2ozy h ASP 140 N 0.28 -0.01 0.07 0.57 3.32 -0.68 0.34 116.42 120.32 2ozy h ASP 140 Ca 0.09 -0.04 -0.27 0.00 0.02 0.00 0.00 57.03 56.83 2ozy h ASP 140 Cb 0.11 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.69 2ozy h ASP 140 CO -0.01 0.03 -1.09 0.00 -1.72 0.00 0.00 179.24 176.45 2ozy h HIS 142 N 0.23 1.00 -0.44 0.00 3.86 -1.26 -1.37 115.15 117.18 2ozy h HIS 142 Ca -0.16 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 58.95 2ozy h HIS 142 Cb 1.77 -0.30 -0.02 0.00 1.06 0.00 0.00 27.41 29.92 2ozy h HIS 142 CO 0.12 0.80 0.22 1.03 0.86 0.00 0.00 177.93 180.96 2ozy h SER 143 N 0.95 0.57 -0.85 2.45 0.87 -0.93 -2.60 113.55 114.01 2ozy h SER 143 Ca 0.21 -0.12 0.08 0.00 -1.23 0.00 0.00 61.79 60.73 2ozy h SER 143 Cb 0.27 -0.15 -0.07 0.00 -0.44 0.00 0.00 62.40 62.01 2ozy h SER 143 CO -0.01 0.53 0.51 -0.78 -0.53 0.00 0.00 176.83 176.56 2ozy h ASP 144 N 0.57 0.77 -0.41 6.23 3.58 -0.91 -0.68 116.42 125.57 2ozy h ASP 144 Ca 0.15 0.03 0.02 0.00 0.42 0.00 0.00 57.03 57.66 2ozy h ASP 144 Cb 0.11 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.02 2ozy h ASP 144 CO -0.02 0.46 0.27 1.56 -2.88 0.00 0.00 179.24 178.64 2ozy h GLN 145 N 0.89 0.47 0.00 0.28 4.20 -0.98 0.22 115.11 120.19 2ozy h GLN 145 Ca 0.39 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 59.03 2ozy h GLN 145 Cb 0.29 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2ozy h GLN 145 CO -0.21 0.31 -0.22 0.00 -0.67 0.00 0.00 178.83 178.04 2ozy h ARG 146 N 0.48 0.00 0.00 1.46 3.08 -0.77 -3.36 114.38 115.27 2ozy h ARG 146 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 2ozy h ARG 146 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2ozy h ARG 146 CO -0.04 0.22 0.00 0.25 -1.07 0.00 0.00 179.97 179.33 2ozy n THR 147 N -3.22 0.00 -3.90 2.04 -2.24 -0.76 -4.96 114.28 101.23 2ozy n THR 147 Ca 0.02 -0.41 -0.34 0.00 -2.27 0.00 0.00 64.05 61.05 2ozy n THR 147 Cb 0.54 1.15 -0.13 0.00 -2.10 0.00 0.00 70.33 69.79 2ozy n THR 147 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2ozy s ASN 148 N -0.14 4.95 0.36 3.42 2.47 0.71 -4.96 114.94 121.75 2ozy s ASN 148 Ca 0.00 -1.82 0.26 0.00 0.42 0.00 0.00 52.86 51.72 2ozy s ASN 148 Cb 0.00 -1.72 1.27 0.00 -1.45 0.00 0.00 41.25 39.36 2ozy s ASN 148 CO 0.00 -0.39 1.79 -0.65 -3.72 0.00 0.00 177.10 174.12 2ozy h PRO 149 N 7.89 0.00 -0.43 0.43 0.11 -1.89 -2.03 132.00 136.07 2ozy h PRO 149 Ca -0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.98 2ozy h PRO 149 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2ozy h PRO 149 CO 0.58 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.46 2ozy n ASN 150 N -2.41 3.37 -4.58 -2.05 3.02 -1.26 -4.99 115.26 106.35 2ozy n ASN 150 Ca -0.00 -1.95 -0.51 0.00 -0.03 0.00 0.00 54.58 52.09 2ozy n ASN 150 Cb 0.12 -0.28 -0.05 0.00 -0.61 0.00 0.00 39.78 38.95 2ozy n ASN 150 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 2ozy n PHE 151 N 1.29 1.41 -3.76 3.10 7.35 -0.77 -4.97 117.46 121.10 2ozy n PHE 151 Ca 0.18 0.66 -0.26 0.00 -0.76 0.00 0.00 57.45 57.27 2ozy n PHE 151 Cb 0.55 -2.31 -0.17 0.00 0.35 0.00 0.00 39.48 37.90 2ozy n PHE 151 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 2ozy s ASN 152 N 0.29 2.37 0.41 -2.13 3.84 -1.26 -5.01 114.94 113.45 2ozy s ASN 152 Ca 0.80 -0.51 0.29 0.00 0.21 0.00 0.00 52.86 53.65 2ozy s ASN 152 Cb -0.92 -0.56 1.39 0.00 -0.55 0.00 0.00 41.25 40.60 2ozy s ASN 152 CO 0.49 -0.25 1.88 1.55 -2.79 0.00 0.00 177.10 177.98 2ozy h PRO 153 N 8.27 0.00 0.00 0.43 0.13 -1.93 -0.92 132.00 137.97 2ozy h PRO 153 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 2ozy h PRO 153 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2ozy h PRO 153 CO 0.31 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.08 2ozy h ALA 154 N 2.09 1.00 -1.59 -0.56 0.00 -1.88 -1.72 119.26 116.60 2ozy h ALA 154 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 2ozy h ALA 154 Cb 0.22 0.00 -0.27 0.00 0.00 0.00 0.00 17.79 17.74 2ozy h ALA 154 CO 0.00 0.00 -0.54 0.45 0.00 0.00 0.00 179.25 179.16 2ozy s SER 155 N -5.41 0.09 -0.30 0.00 0.15 -0.35 -2.82 113.70 105.05 2ozy s SER 155 Ca 0.08 -0.65 0.02 0.00 0.70 0.00 0.00 55.95 56.11 2ozy s SER 155 Cb 0.08 1.20 0.08 0.00 -1.71 0.00 0.00 66.02 65.67 2ozy s SER 155 CO 0.62 -0.30 -0.03 -0.69 1.20 0.00 0.00 173.24 174.04 2ozy s VAL 156 N 2.23 2.36 -1.78 4.45 1.01 -1.25 -4.41 120.40 123.01 2ozy s VAL 156 Ca 0.12 -1.88 0.31 0.00 0.00 0.00 0.00 61.98 60.53 2ozy s VAL 156 Cb -0.12 -2.52 0.73 0.00 0.00 0.00 0.00 36.38 34.47 2ozy s VAL 156 CO -0.21 -0.27 2.13 -0.81 0.00 0.00 0.00 175.10 175.94 2ozy n PRO 157 N 4.40 0.79 -0.07 2.72 -0.04 -1.26 -4.52 135.00 137.01 2ozy n PRO 157 Ca -0.07 -0.04 -0.07 0.00 -0.04 0.00 0.00 63.50 63.28 2ozy n PRO 157 Cb 0.42 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.38 2ozy n PRO 157 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2ozy h LEU 158 N 0.10 -0.18 -0.83 1.53 5.85 -1.93 -2.19 115.31 117.66 2ozy h LEU 158 Ca 0.00 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2ozy h LEU 158 Cb 0.14 0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.31 2ozy h LEU 158 CO 0.00 -0.05 0.00 0.18 -0.34 0.00 0.00 178.44 178.23 2ozy n LEU 159 N -5.20 1.23 -0.85 2.25 4.77 -1.26 -5.12 117.00 112.83 2ozy n LEU 159 Ca -0.00 -0.54 0.12 0.00 -0.03 0.00 0.00 56.01 55.56 2ozy n LEU 159 Cb 0.16 -0.10 0.20 0.00 -2.33 0.00 0.00 43.42 41.35 2ozy n LEU 159 CO 0.22 0.27 0.69 0.29 -1.33 0.00 0.00 177.39 177.53