#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oux n GLU 8 N 0.00 0.00 0.03 3.49 -0.58 -1.26 -3.70 120.64 118.62 2oux n GLU 8 Ca 0.00 0.00 -0.11 0.00 -0.42 0.00 0.00 57.16 56.63 2oux n GLU 8 Cb 0.00 0.00 -0.09 0.00 -0.57 0.00 0.00 31.44 30.78 2oux n GLU 8 CO 0.00 0.00 0.00 1.05 -0.48 0.00 0.00 177.13 177.70 2oux h GLU 9 N 0.00 -0.15 -0.69 3.49 4.11 -2.06 -2.73 114.58 116.55 2oux h GLU 9 Ca 0.00 0.01 0.14 0.00 0.07 0.00 0.00 59.36 59.58 2oux h GLU 9 Cb 0.00 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.18 2oux h GLU 9 CO 0.00 0.35 0.15 1.96 0.07 0.00 0.00 179.01 181.54 2oux h GLN 10 N -0.81 0.25 -0.38 1.06 1.08 -2.01 0.15 115.11 114.46 2oux h GLN 10 Ca -0.02 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.15 2oux h GLN 10 Cb 0.56 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.92 2oux h GLN 10 CO 0.03 0.17 0.15 0.74 -0.95 0.00 0.00 178.83 178.97 2oux h PHE 11 N 0.26 0.53 -0.29 2.96 -1.00 -1.89 -1.91 116.94 115.60 2oux h PHE 11 Ca 0.38 -0.02 -0.04 0.00 2.81 0.00 0.00 57.97 61.11 2oux h PHE 11 Cb 0.62 -0.17 -0.01 0.00 3.61 0.00 0.00 35.95 40.00 2oux h PHE 11 CO -0.26 0.42 0.04 0.00 -1.61 0.00 0.00 178.31 176.90 2oux h ALA 12 N 1.64 0.39 0.00 2.45 0.00 -0.41 0.13 119.26 123.45 2oux h ALA 12 Ca 0.13 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2oux h ALA 12 Cb 0.11 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2oux h ALA 12 CO -0.01 0.08 -0.17 -0.07 0.00 0.00 0.00 179.25 179.08 2oux h LEU 13 N 0.30 0.00 0.08 0.00 4.07 -0.95 -0.99 115.31 117.82 2oux h LEU 13 Ca 0.09 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.04 2oux h LEU 13 Cb 0.35 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.09 2oux h LEU 13 CO 0.01 0.17 -0.04 -0.07 -1.08 0.00 0.00 178.44 177.43 2oux h LEU 14 N 0.00 -0.09 -1.37 1.67 3.38 -0.89 -2.88 115.31 115.13 2oux h LEU 14 Ca -0.00 -0.33 0.22 0.00 0.09 0.00 0.00 57.88 57.85 2oux h LEU 14 Cb 0.41 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.10 2oux h LEU 14 CO 0.02 0.55 0.62 0.25 0.09 0.00 0.00 178.44 179.97 2oux h LEU 15 N -0.98 0.50 -0.32 1.67 5.85 -0.66 0.71 115.31 122.08 2oux h LEU 15 Ca -0.01 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2oux h LEU 15 Cb 0.41 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 2oux h LEU 15 CO 0.02 0.17 0.15 -0.33 -0.34 0.00 0.00 178.44 178.11 2oux h GLU 16 N 0.48 0.46 0.00 1.25 4.39 -1.23 -1.47 114.58 118.46 2oux h GLU 16 Ca 0.52 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 60.15 2oux h GLU 16 Cb 1.20 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.76 2oux h GLU 16 CO -0.24 0.44 0.00 1.79 -1.16 0.00 0.00 179.01 179.83 2oux h THR 17 N 0.37 0.00 0.04 1.13 1.35 -0.64 -1.15 112.91 114.02 2oux h THR 17 Ca 0.11 -0.06 -0.14 0.00 -0.55 0.00 0.00 66.41 65.77 2oux h THR 17 Cb 0.13 0.81 -0.01 0.00 -1.73 0.00 0.00 68.15 67.36 2oux h THR 17 CO -0.01 0.00 -0.72 -0.07 -0.25 0.00 0.00 175.52 174.47 2oux h LEU 18 N 0.00 0.14 -1.76 3.87 3.38 -0.89 0.99 115.31 121.04 2oux h LEU 18 Ca 0.00 -0.84 0.00 0.00 0.09 0.00 0.00 57.88 57.13 2oux h LEU 18 Cb 0.07 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2oux h LEU 18 CO 0.00 1.30 0.00 0.11 0.09 0.00 0.00 178.44 179.94 2oux h LYS 19 N -0.78 0.00 0.00 1.13 1.57 -0.69 -0.87 116.57 116.94 2oux h LYS 19 Ca -0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 2oux h LYS 19 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 2oux h LYS 19 CO -0.02 0.00 -1.59 0.09 -0.57 0.00 0.00 179.45 177.36 2oux n ASN 20 N -2.68 0.60 -3.49 0.86 5.03 -0.49 -5.02 115.26 110.07 2oux n ASN 20 Ca -0.01 -0.31 -0.18 0.00 0.87 0.00 0.00 54.58 54.95 2oux n ASN 20 Cb 0.14 1.61 0.08 0.00 -1.02 0.00 0.00 39.78 40.59 2oux n ASN 20 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2oux n GLN 21 N -1.95 -6.39 -4.03 3.52 6.02 0.14 -5.05 117.38 109.63 2oux n GLN 21 Ca -0.01 0.81 -0.24 0.00 -0.01 0.00 0.00 57.00 57.55 2oux n GLN 21 Cb 0.45 -5.75 -0.04 0.00 1.02 0.00 0.00 30.24 25.92 2oux n GLN 21 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2oux s GLN 22 N -5.52 3.17 0.00 -1.09 -0.21 -0.02 -5.03 119.66 110.96 2oux s GLN 22 Ca 0.03 -0.83 0.00 0.00 0.02 0.00 0.00 55.36 54.58 2oux s GLN 22 Cb -0.02 -2.76 0.00 0.00 1.00 0.00 0.00 33.01 31.24 2oux s GLN 22 CO 0.74 0.46 0.00 0.09 -2.12 0.00 0.00 175.29 174.46 2oux n ASN 24 N -0.89 0.00 -0.19 5.90 3.02 -1.26 -1.60 115.26 120.25 2oux n ASN 24 Ca -0.08 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.38 2oux n ASN 24 Cb 0.56 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.74 2oux n ASN 24 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2oux h GLU 25 N 0.00 0.83 -0.04 3.52 3.07 -1.98 -2.54 114.58 117.44 2oux h GLU 25 Ca 0.00 -0.19 0.02 0.00 -0.50 0.00 0.00 59.36 58.69 2oux h GLU 25 Cb 0.00 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 27.77 2oux h GLU 25 CO 0.00 0.78 -0.10 0.35 -1.40 0.00 0.00 179.01 178.64 2oux h PHE 26 N 0.73 -0.24 -0.57 4.33 3.57 -1.62 -2.63 116.94 120.52 2oux h PHE 26 Ca 0.17 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.68 2oux h PHE 26 Cb 0.30 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 2oux h PHE 26 CO 0.02 -0.15 0.35 0.00 -2.23 0.00 0.00 178.31 176.30 2oux h ARG 27 N -0.14 0.76 -0.11 1.11 3.08 -1.80 0.16 114.38 117.44 2oux h ARG 27 Ca 0.05 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 59.90 2oux h ARG 27 Cb 0.21 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 2oux h ARG 27 CO -0.13 0.53 -0.54 1.49 -1.07 0.00 0.00 179.97 180.25 2oux h GLU 28 N 0.78 0.33 0.21 0.04 4.81 -1.23 -0.63 114.58 118.88 2oux h GLU 28 Ca 0.21 -0.20 -0.31 0.00 -0.13 0.00 0.00 59.36 58.93 2oux h GLU 28 Cb -0.04 0.02 0.03 0.00 0.63 0.00 0.00 28.75 29.39 2oux h GLU 28 CO -0.04 0.78 -1.41 -0.07 -0.73 0.00 0.00 179.01 177.55 2oux h LEU 29 N 0.25 0.68 -0.14 1.64 3.38 -1.10 -3.27 115.31 116.75 2oux h LEU 29 Ca 0.01 -0.92 -0.02 0.00 0.09 0.00 0.00 57.88 57.03 2oux h LEU 29 Cb 1.03 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 2oux h LEU 29 CO 0.09 1.66 0.01 0.15 0.09 0.00 0.00 178.44 180.43 2oux h PHE 30 N -0.01 0.27 0.00 1.13 3.57 -0.69 -2.92 116.94 118.29 2oux h PHE 30 Ca -0.26 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.19 2oux h PHE 30 Cb 2.01 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 40.68 2oux h PHE 30 CO 0.14 0.47 0.00 1.28 -2.23 0.00 0.00 178.31 177.96 2oux n LEU 31 N -4.77 0.00 0.16 0.59 4.77 -0.25 -1.92 117.00 115.58 2oux n LEU 31 Ca -0.05 0.31 0.12 0.00 -0.03 0.00 0.00 56.01 56.35 2oux n LEU 31 Cb 0.20 -0.31 0.12 0.00 -2.33 0.00 0.00 43.42 41.11 2oux n LEU 31 CO 0.36 -0.12 0.49 0.00 -1.33 0.00 0.00 177.39 176.79 2oux h ALA 32 N 2.86 0.78 -2.16 -1.18 0.00 -1.56 -3.46 119.26 114.53 2oux h ALA 32 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.45 2oux h ALA 32 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2oux h ALA 32 CO 0.00 0.00 0.34 -0.51 0.00 0.00 0.00 179.25 179.08 2oux s LEU 33 N -5.65 3.75 0.43 0.00 1.43 -0.81 -5.04 118.68 112.79 2oux s LEU 33 Ca 0.04 1.57 -0.23 0.00 -1.03 0.00 0.00 54.13 54.48 2oux s LEU 33 Cb 0.08 -4.47 -0.08 0.00 0.03 0.00 0.00 46.19 41.74 2oux s LEU 33 CO 0.71 -0.49 1.10 -2.28 0.23 0.00 0.00 176.35 175.63 2oux s HIS 34 N -2.45 3.08 0.56 0.29 5.65 -1.26 -4.80 115.29 116.36 2oux s HIS 34 Ca 0.59 1.59 0.32 0.00 0.25 0.00 0.00 55.06 57.81 2oux s HIS 34 Cb -0.10 -3.24 1.46 0.00 -1.18 0.00 0.00 32.58 29.52 2oux s HIS 34 CO 0.25 -1.04 1.82 -0.84 -0.65 0.00 0.00 174.74 174.28 2oux h ILE 35 N 2.04 0.40 -0.39 0.89 3.07 -1.95 0.15 117.51 121.72 2oux h ILE 35 Ca -0.49 0.00 -0.10 0.00 1.55 0.00 0.00 64.86 65.82 2oux h ILE 35 Cb 1.23 0.48 -0.01 0.00 -0.27 0.00 0.00 36.82 38.25 2oux h ILE 35 CO 0.61 0.00 -0.16 0.22 -1.05 0.00 0.00 178.15 177.77 2oux h TYR 36 N 0.00 0.90 0.00 0.16 3.20 -1.94 -0.69 116.97 118.60 2oux h TYR 36 Ca 0.41 -0.22 -0.09 0.00 3.14 0.00 0.00 58.73 61.98 2oux h TYR 36 Cb 1.83 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 39.88 2oux h TYR 36 CO 0.00 0.95 -0.42 0.93 -1.64 0.00 0.00 178.16 177.98 2oux h GLU 37 N 0.59 0.00 -0.35 1.82 5.08 -1.36 -1.98 114.58 118.38 2oux h GLU 37 Ca 0.09 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 2oux h GLU 37 Cb 0.70 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 2oux h GLU 37 CO 0.05 0.42 0.07 1.96 -1.00 0.00 0.00 179.01 180.51 2oux h GLN 38 N 0.00 0.56 -0.46 2.33 4.20 -1.02 -1.78 115.11 118.94 2oux h GLN 38 Ca -0.00 -0.14 0.02 0.00 0.06 0.00 0.00 58.65 58.58 2oux h GLN 38 Cb 0.88 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.56 2oux h GLN 38 CO 0.05 0.62 0.28 0.78 -0.67 0.00 0.00 178.83 179.90 2oux h GLY 39 N 0.41 0.65 0.92 3.46 0.00 -0.63 -1.30 103.07 106.57 2oux h GLY 39 Ca 0.11 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 2oux h GLY 39 CO 0.00 0.20 0.02 1.46 0.00 0.00 0.00 176.54 178.23 2oux h GLN 40 N 0.57 0.07 -0.11 4.80 1.08 -1.26 -0.85 115.11 119.41 2oux h GLN 40 Ca 0.18 -0.01 0.04 0.00 -1.45 0.00 0.00 58.65 57.42 2oux h GLN 40 Cb -0.02 -0.01 -0.06 0.00 -0.05 0.00 0.00 27.48 27.34 2oux h GLN 40 CO -0.07 0.13 -0.33 0.35 -0.95 0.00 0.00 178.83 177.96 2oux h PHE 41 N -0.02 -0.92 -0.14 2.96 3.57 -1.09 -2.46 116.94 118.83 2oux h PHE 41 Ca 0.02 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.60 2oux h PHE 41 Cb 0.08 0.42 -0.07 0.00 2.79 0.00 0.00 35.95 39.18 2oux h PHE 41 CO -0.05 -0.41 -0.37 -0.92 -2.23 0.00 0.00 178.31 174.34 2oux h TYR 42 N -0.42 -1.03 0.00 0.41 3.20 -1.11 -2.02 116.97 116.00 2oux h TYR 42 Ca 0.09 0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.00 2oux h TYR 42 Cb 0.56 0.47 0.00 0.00 1.54 0.00 0.00 36.73 39.30 2oux h TYR 42 CO -0.41 -0.43 0.00 1.04 -1.64 0.00 0.00 178.16 176.72 2oux n GLN 43 N -5.42 0.03 -0.23 1.82 6.02 -0.33 -1.38 117.38 117.88 2oux n GLN 43 Ca -0.03 0.20 0.06 0.00 -0.01 0.00 0.00 57.00 57.21 2oux n GLN 43 Cb 0.34 -1.50 0.18 0.00 1.02 0.00 0.00 30.24 30.28 2oux n GLN 43 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2oux n SER 44 N -1.20 3.13 -4.96 1.08 3.41 -0.76 -5.01 113.62 109.30 2oux n SER 44 Ca 0.01 -2.17 -0.22 0.00 -0.26 0.00 0.00 58.87 56.23 2oux n SER 44 Cb 0.01 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.67 2oux n SER 44 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2oux s LEU 45 N -1.30 3.83 0.57 1.04 1.43 -0.48 -5.10 118.68 118.67 2oux s LEU 45 Ca 0.27 0.17 0.04 0.00 -1.03 0.00 0.00 54.13 53.58 2oux s LEU 45 Cb 0.16 -3.06 0.06 0.00 0.03 0.00 0.00 46.19 43.39 2oux s LEU 45 CO 0.15 -0.54 0.79 1.51 0.23 0.00 0.00 176.35 178.49 2oux s ASP 46 N -4.17 5.10 0.27 2.29 3.84 -1.26 -4.91 116.67 117.83 2oux s ASP 46 Ca 0.45 -0.36 -0.00 0.00 -0.00 0.00 0.00 52.55 52.64 2oux s ASP 46 Cb -0.10 -0.38 0.62 0.00 -1.38 0.00 0.00 42.92 41.68 2oux s ASP 46 CO 0.35 -1.27 1.67 -0.08 -0.00 0.00 0.00 175.17 175.84 2oux h GLU 47 N 0.07 0.27 0.02 2.11 4.57 -1.99 -2.46 114.58 117.16 2oux h GLU 47 Ca -0.38 -0.02 -0.22 0.00 -1.18 0.00 0.00 59.36 57.57 2oux h GLU 47 Cb 1.28 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.81 2oux h GLU 47 CO 0.45 0.18 -0.94 1.57 -1.18 0.00 0.00 179.01 179.09 2oux h LYS 48 N 0.28 0.28 0.00 1.92 2.10 -1.99 -1.85 116.57 117.31 2oux h LYS 48 Ca 0.50 -0.33 -0.14 0.00 -2.00 0.00 0.00 60.65 58.68 2oux h LYS 48 Cb 0.94 0.10 -0.02 0.00 -0.90 0.00 0.00 32.23 32.35 2oux h LYS 48 CO -0.57 1.04 -0.69 -0.44 -2.00 0.00 0.00 179.45 176.79 2oux h ASP 49 N 0.15 0.00 -0.39 7.07 3.32 -1.93 -1.86 116.42 122.78 2oux h ASP 49 Ca -0.07 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 2oux h ASP 49 Cb 1.59 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.12 2oux h ASP 49 CO 0.15 0.69 0.11 -0.09 -1.72 0.00 0.00 179.24 178.38 2oux h ARG 50 N 0.00 0.62 -0.80 3.56 2.43 -1.42 -0.50 114.38 118.26 2oux h ARG 50 Ca -0.01 -0.14 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 2oux h ARG 50 Cb 1.32 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 30.75 2oux h ARG 50 CO 0.09 0.63 0.47 1.96 -1.51 0.00 0.00 179.97 181.61 2oux h GLN 51 N 0.49 1.10 -0.82 0.20 1.08 -1.10 -1.23 115.11 114.82 2oux h GLN 51 Ca 0.13 -0.11 -0.04 0.00 -1.45 0.00 0.00 58.65 57.18 2oux h GLN 51 Cb 0.28 -0.23 -0.04 0.00 -0.05 0.00 0.00 27.48 27.45 2oux h GLN 51 CO -0.00 0.78 0.37 0.45 -0.95 0.00 0.00 178.83 179.48 2oux h HIS 52 N 1.11 1.22 -0.78 2.96 3.86 -0.83 -2.26 115.15 120.43 2oux h HIS 52 Ca 0.29 -0.07 0.01 0.00 -1.16 0.00 0.00 60.37 59.44 2oux h HIS 52 Cb -0.02 -0.37 -0.04 0.00 1.06 0.00 0.00 27.41 28.04 2oux h HIS 52 CO 0.01 0.90 0.52 1.25 0.86 0.00 0.00 177.93 181.46 2oux h LEU 53 N 1.19 0.88 -1.47 2.43 6.46 0.06 -0.55 115.31 124.31 2oux h LEU 53 Ca 0.28 -0.02 -0.05 0.00 -0.12 0.00 0.00 57.88 57.97 2oux h LEU 53 Cb 0.16 -0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 39.87 2oux h LEU 53 CO -0.03 0.63 -0.24 1.88 -0.62 0.00 0.00 178.44 180.07 2oux h TYR 54 N 1.04 0.00 0.09 1.25 0.05 -0.79 -2.01 116.97 116.60 2oux h TYR 54 Ca 0.29 0.00 -0.26 0.00 0.05 0.00 0.00 58.73 58.81 2oux h TYR 54 Cb -0.09 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.65 2oux h TYR 54 CO -0.00 0.24 -1.14 -0.91 -1.05 0.00 0.00 178.16 175.30 2oux h ASN 55 N 0.00 0.48 0.31 3.88 -0.26 -0.89 -3.32 115.58 115.78 2oux h ASN 55 Ca -0.00 -0.46 0.00 0.00 -0.56 0.00 0.00 56.30 55.28 2oux h ASN 55 Cb 0.56 -0.15 0.00 0.00 -1.06 0.00 0.00 38.32 37.67 2oux h ASN 55 CO 0.03 1.32 -0.30 -1.22 -1.06 0.00 0.00 177.43 176.19 2oux n TYR 56 N -3.62 0.00 -5.08 1.19 4.01 -0.79 -4.87 117.16 108.00 2oux n TYR 56 Ca -0.08 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.37 2oux n TYR 56 Cb 0.96 -0.16 -0.16 0.00 -0.31 0.00 0.00 39.34 39.66 2oux n TYR 56 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2oux s LEU 57 N -2.62 2.00 0.66 7.72 1.43 -0.78 -4.92 118.68 122.18 2oux s LEU 57 Ca 0.21 -0.44 -0.13 0.00 -1.03 0.00 0.00 54.13 52.75 2oux s LEU 57 Cb 0.19 -1.20 -0.00 0.00 0.03 0.00 0.00 46.19 45.21 2oux s LEU 57 CO 0.56 0.21 1.06 -0.94 0.23 0.00 0.00 176.35 177.47 2oux s SER 58 N -0.10 5.45 0.21 2.29 1.04 -1.26 -4.80 113.70 116.53 2oux s SER 58 Ca -0.03 1.72 -0.09 0.00 0.48 0.00 0.00 55.95 58.03 2oux s SER 58 Cb -0.13 -2.51 0.30 0.00 0.10 0.00 0.00 66.02 63.78 2oux s SER 58 CO 0.03 -1.39 1.73 -0.65 0.98 0.00 0.00 173.24 173.93 2oux h PRO 59 N -0.29 0.34 0.00 4.02 0.11 -1.92 -0.17 132.00 134.09 2oux h PRO 59 Ca -0.45 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 2oux h PRO 59 Cb 1.22 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 2oux h PRO 59 CO 0.56 0.23 -0.21 1.57 -0.21 0.00 0.00 178.00 179.94 2oux h LYS 60 N 0.35 0.00 -0.04 1.05 2.10 -1.93 0.24 116.57 118.34 2oux h LYS 60 Ca 0.32 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.85 2oux h LYS 60 Cb 0.44 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.77 2oux h LYS 60 CO -0.35 0.21 -0.44 0.93 -2.00 0.00 0.00 179.45 177.79 2oux h GLU 61 N 0.00 0.37 -0.32 0.07 5.08 -1.61 -1.60 114.58 116.58 2oux h GLU 61 Ca -0.00 -0.35 -0.05 0.00 -1.00 0.00 0.00 59.36 57.97 2oux h GLU 61 Cb 0.64 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 2oux h GLU 61 CO 0.03 1.01 -0.00 1.25 -1.00 0.00 0.00 179.01 180.29 2oux h LEU 62 N -0.13 0.45 -0.44 1.33 5.85 -0.71 -2.39 115.31 119.28 2oux h LEU 62 Ca -0.04 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 2oux h LEU 62 Cb 1.13 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 2oux h LEU 62 CO 0.09 0.52 0.18 0.00 -0.34 0.00 0.00 178.44 178.89 2oux h ALA 63 N 1.53 0.57 0.00 1.25 0.00 -0.43 -0.93 119.26 121.25 2oux h ALA 63 Ca 0.10 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2oux h ALA 63 Cb 0.31 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2oux h ALA 63 CO 0.01 0.16 0.00 -0.25 0.00 0.00 0.00 179.25 179.17 2oux n ASP 64 N -4.62 0.00 0.00 0.00 8.00 -0.61 -1.05 116.55 118.26 2oux n ASP 64 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.51 2oux n ASP 64 Cb 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 2oux n ASP 64 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2oux n PHE 66 N 0.08 0.00 -0.36 1.24 3.01 -0.36 -4.36 117.46 116.72 2oux n PHE 66 Ca 0.00 0.00 0.29 0.00 1.01 0.00 0.00 57.45 58.75 2oux n PHE 66 Cb 0.00 0.00 0.58 0.00 -0.01 0.00 0.00 39.48 40.05 2oux n PHE 66 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 2oux h ASP 67 N 0.00 0.32 -0.01 4.37 3.32 -1.36 0.93 116.42 123.99 2oux h ASP 67 Ca 0.00 0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2oux h ASP 67 Cb 0.00 0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2oux h ASP 67 CO 0.00 -0.00 -0.25 1.33 -1.72 0.00 0.00 179.24 178.60 2oux n VAL 68 N -4.58 0.00 -2.28 -1.35 0.24 -1.26 -4.92 118.33 104.18 2oux n VAL 68 Ca 0.29 -0.37 -0.42 0.00 -2.04 0.00 0.00 64.34 61.79 2oux n VAL 68 Cb 1.09 1.24 -0.03 0.00 -1.47 0.00 0.00 33.84 34.68 2oux n VAL 68 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2oux s ILE 69 N -1.81 3.83 -0.16 1.34 1.01 0.32 -4.91 121.20 120.82 2oux s ILE 69 Ca 0.15 1.21 -0.29 0.00 0.00 0.00 0.00 60.65 61.73 2oux s ILE 69 Cb 0.14 -3.78 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 2oux s ILE 69 CO 0.36 0.01 1.72 -1.61 0.00 0.00 0.00 174.94 175.42 2oux s GLU 70 N 2.22 3.85 1.03 2.79 2.02 -1.26 -4.98 118.70 124.37 2oux s GLU 70 Ca 0.62 1.92 -0.13 0.00 0.02 0.00 0.00 54.97 57.40 2oux s GLU 70 Cb -0.30 -4.07 0.21 0.00 0.10 0.00 0.00 34.13 30.06 2oux s GLU 70 CO 0.26 -1.25 1.08 -1.83 0.02 0.00 0.00 175.26 173.54 2oux s GLU 71 N 4.69 0.15 0.00 1.61 1.03 -1.26 -2.71 118.70 122.21 2oux s GLU 71 Ca 0.77 0.53 0.00 0.00 0.03 0.00 0.00 54.97 56.30 2oux s GLU 71 Cb -0.29 -1.70 0.00 0.00 -0.80 0.00 0.00 34.13 31.33 2oux s GLU 71 CO 0.31 -2.92 0.00 -0.40 -1.33 0.00 0.00 175.26 170.92 2oux n ASP 72 N -4.31 0.00 -4.54 0.83 5.75 -1.26 -5.00 116.55 108.02 2oux n ASP 72 Ca 0.05 0.00 -0.47 0.00 -0.01 0.00 0.00 54.79 54.35 2oux n ASP 72 Cb 0.57 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.61 2oux n ASP 72 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2oux n ASN 73 N 0.14 2.78 -0.35 -1.12 2.85 -1.10 -4.70 115.26 113.76 2oux n ASN 73 Ca 0.00 0.43 0.00 0.00 -0.11 0.00 0.00 54.58 54.90 2oux n ASN 73 Cb 0.00 -1.39 0.00 0.00 1.24 0.00 0.00 39.78 39.63 2oux n ASN 73 CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 2oux n GLU 74 N 8.15 0.00 -2.79 1.20 2.13 -1.26 -4.72 120.64 123.35 2oux n GLU 74 Ca 0.34 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.78 2oux n GLU 74 Cb 0.32 -0.95 0.00 0.00 0.27 0.00 0.00 31.44 31.08 2oux n GLU 74 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2oux n ASN 75 N 0.17 6.45 0.00 4.31 5.03 -1.26 -4.55 115.26 125.42 2oux n ASN 75 Ca 0.00 -3.64 0.00 0.00 0.87 0.00 0.00 54.58 51.81 2oux n ASN 75 Cb 0.00 -1.03 0.00 0.00 -1.02 0.00 0.00 39.78 37.73 2oux n ASN 75 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 2oux n LYS 77 N 0.13 0.00 0.11 3.52 5.02 -1.26 0.20 118.16 125.88 2oux n LYS 77 Ca 0.40 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.52 2oux n LYS 77 Cb 0.30 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.18 2oux n LYS 77 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 2oux h ASP 78 N 0.00 0.51 -0.07 4.39 3.32 -1.96 -2.19 116.42 120.42 2oux h ASP 78 Ca 0.00 -0.52 -0.00 0.00 0.02 0.00 0.00 57.03 56.53 2oux h ASP 78 Cb 0.00 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.38 2oux h ASP 78 CO 0.00 1.40 0.04 1.88 -1.72 0.00 0.00 179.24 180.84 2oux h TYR 79 N 0.11 0.09 -0.32 4.55 0.05 0.18 -0.46 116.97 121.16 2oux h TYR 79 Ca -0.15 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.55 2oux h TYR 79 Cb 1.96 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 39.66 2oux h TYR 79 CO 0.07 0.09 -0.14 -0.07 -1.05 0.00 0.00 178.16 177.07 2oux h LEU 80 N 0.06 0.68 -0.39 3.88 -0.00 -1.78 -3.23 115.31 114.53 2oux h LEU 80 Ca 0.02 -0.40 0.04 0.00 -0.00 0.00 0.00 57.88 57.54 2oux h LEU 80 Cb 0.03 -0.19 -0.04 0.00 -0.00 0.00 0.00 40.66 40.47 2oux h LEU 80 CO -0.00 0.92 0.17 0.00 -0.00 0.00 0.00 178.44 179.53 2oux h ALA 81 N 0.78 0.47 0.00 1.53 0.00 -1.25 -3.43 119.26 117.36 2oux h ALA 81 Ca 0.08 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2oux h ALA 81 Cb 0.66 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2oux h ALA 81 CO 0.04 -0.21 0.06 -0.85 0.00 0.00 0.00 179.25 178.30 2oux n GLU 82 N -4.96 0.82 -3.54 0.00 0.28 -0.19 -4.91 120.64 108.14 2oux n GLU 82 Ca 0.02 -0.35 -0.38 0.00 -0.16 0.00 0.00 57.16 56.28 2oux n GLU 82 Cb 0.11 -1.62 -0.10 0.00 1.43 0.00 0.00 31.44 31.26 2oux n GLU 82 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 2oux s ARG 84 N 1.81 3.97 0.16 3.44 3.52 -1.26 -5.05 118.95 125.53 2oux s ARG 84 Ca 0.24 -0.22 -0.18 0.00 -0.13 0.00 0.00 55.73 55.44 2oux s ARG 84 Cb 0.11 -3.66 0.08 0.00 -1.56 0.00 0.00 34.95 29.93 2oux s ARG 84 CO 0.00 -0.20 1.20 -2.30 -0.81 0.00 0.00 175.30 173.19 2oux n PRO 85 N 5.12 -0.25 -0.35 5.12 -0.02 -1.26 0.29 135.00 143.65 2oux n PRO 85 Ca -0.12 1.19 -0.03 0.00 -2.02 0.00 0.00 63.50 62.52 2oux n PRO 85 Cb 0.52 -1.76 0.10 0.00 -0.02 0.00 0.00 33.50 32.34 2oux n PRO 85 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2oux h SER 86 N 0.00 1.07 0.21 2.55 4.64 -1.98 0.16 113.55 120.20 2oux h SER 86 Ca 0.21 -0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.49 2oux h SER 86 Cb 0.40 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2oux h SER 86 CO -0.75 0.77 -0.10 0.22 -0.87 0.00 0.00 176.83 176.10 2oux h TYR 87 N 1.26 -0.26 -0.92 4.77 3.20 -0.60 -1.05 116.97 123.37 2oux h TYR 87 Ca 0.34 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.24 2oux h TYR 87 Cb -0.14 0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.16 2oux h TYR 87 CO -0.01 -0.08 0.59 0.00 -1.64 0.00 0.00 178.16 177.03 2oux h ALA 88 N 0.36 1.22 -0.56 1.82 0.00 -0.35 -2.41 119.26 119.34 2oux h ALA 88 Ca -0.03 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2oux h ALA 88 Cb 0.31 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2oux h ALA 88 CO 0.05 0.45 0.18 0.00 0.00 0.00 0.00 179.25 179.93 2oux h ALA 89 N 1.38 0.74 0.00 0.00 0.00 -0.50 -1.83 119.26 119.05 2oux h ALA 89 Ca 0.37 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2oux h ALA 89 Cb 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.59 2oux h ALA 89 CO -0.12 0.39 0.00 -0.25 0.00 0.00 0.00 179.25 179.27 2oux n ASP 90 N -4.45 1.14 0.00 0.00 8.00 -0.41 -2.22 116.55 118.62 2oux n ASP 90 Ca 0.03 -0.92 0.00 0.00 0.71 0.00 0.00 54.79 54.61 2oux n ASP 90 Cb 0.20 -0.22 0.00 0.00 -0.02 0.00 0.00 41.12 41.08 2oux n ASP 90 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2oux n LEU 92 N 1.27 0.00 0.13 0.64 4.77 -0.69 -2.84 117.00 120.29 2oux n LEU 92 Ca 0.00 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.08 2oux n LEU 92 Cb 0.14 0.00 0.49 0.00 -2.33 0.00 0.00 43.42 41.73 2oux n LEU 92 CO 0.00 0.00 0.82 0.00 -1.33 0.00 0.00 177.39 176.88 2oux n ALA 93 N 0.00 1.36 -2.08 -1.18 0.00 -0.94 -4.80 120.51 112.87 2oux n ALA 93 Ca 0.00 0.12 -0.40 0.00 0.00 0.00 0.00 53.44 53.16 2oux n ALA 93 Cb 0.00 -1.32 0.03 0.00 0.00 0.00 0.00 19.45 18.16 2oux n ALA 93 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2oux n GLU 94 N -2.16 3.30 -3.90 0.00 -0.58 -1.13 -5.04 120.64 111.13 2oux n GLU 94 Ca 0.01 -3.77 -0.37 0.00 -0.42 0.00 0.00 57.16 52.60 2oux n GLU 94 Cb 0.13 -2.31 -0.06 0.00 -0.57 0.00 0.00 31.44 28.63 2oux n GLU 94 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 2oux s TYR 96 N -4.12 3.57 0.28 -0.32 2.02 -1.26 -4.86 117.35 112.66 2oux s TYR 96 Ca 0.49 0.51 -0.01 0.00 -0.37 0.00 0.00 57.07 57.69 2oux s TYR 96 Cb 0.39 -1.94 0.63 0.00 -0.40 0.00 0.00 41.96 40.64 2oux s TYR 96 CO -0.36 0.71 1.64 1.15 -1.57 0.00 0.00 175.55 177.13 2oux h THR 97 N 4.01 0.31 -0.91 -0.71 2.02 -1.96 -0.56 112.91 115.11 2oux h THR 97 Ca -0.54 -0.06 0.01 0.00 0.77 0.00 0.00 66.41 66.58 2oux h THR 97 Cb 1.23 0.12 -0.05 0.00 -1.74 0.00 0.00 68.15 67.72 2oux h THR 97 CO 0.58 0.03 0.60 -2.24 0.37 0.00 0.00 175.52 174.87 2oux h ASP 98 N 0.17 1.05 -0.13 4.18 2.03 -1.95 -1.38 116.42 120.39 2oux h ASP 98 Ca 0.51 -0.03 -0.19 0.00 -0.73 0.00 0.00 57.03 56.60 2oux h ASP 98 Cb 1.00 -0.26 -0.00 0.00 -0.83 0.00 0.00 39.33 39.24 2oux h ASP 98 CO -0.67 0.76 -0.61 0.78 -1.03 0.00 0.00 179.24 178.48 2oux h ASN 99 N 1.24 0.83 -0.56 4.15 2.35 -1.52 -2.35 115.58 119.72 2oux h ASN 99 Ca 0.33 -0.47 -0.01 0.00 -0.55 0.00 0.00 56.30 55.60 2oux h ASN 99 Cb -0.14 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 37.96 2oux h ASN 99 CO -0.07 1.24 0.31 0.00 -1.65 0.00 0.00 177.43 177.26 2oux h ALA 100 N 0.77 0.72 -0.58 -0.83 0.00 -0.84 -1.19 119.26 117.30 2oux h ALA 100 Ca -0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2oux h ALA 100 Cb 1.20 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 2oux h ALA 100 CO 0.12 0.23 0.35 0.28 0.00 0.00 0.00 179.25 180.24 2oux h VAL 101 N 0.75 1.17 -0.94 0.00 2.07 -1.22 -1.66 116.25 116.42 2oux h VAL 101 Ca 0.20 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.35 2oux h VAL 101 Cb 0.03 0.37 -0.05 0.00 -1.52 0.00 0.00 31.29 30.12 2oux h VAL 101 CO -0.03 0.17 0.59 0.44 0.02 0.00 0.00 177.57 178.76 2oux h ASP 102 N 0.78 1.11 -0.02 0.57 3.32 -0.92 -1.90 116.42 119.35 2oux h ASP 102 Ca 0.21 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 2oux h ASP 102 Cb -0.03 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.24 2oux h ASP 102 CO -0.04 0.83 -0.00 0.25 -1.72 0.00 0.00 179.24 178.56 2oux h LEU 103 N 1.28 0.03 -0.72 1.55 6.46 -0.91 -3.11 115.31 119.89 2oux h LEU 103 Ca 0.34 -0.33 0.12 0.00 -0.12 0.00 0.00 57.88 57.89 2oux h LEU 103 Cb -0.09 -0.01 -0.08 0.00 -0.73 0.00 0.00 40.66 39.75 2oux h LEU 103 CO -0.07 0.35 0.32 -0.07 -0.62 0.00 0.00 178.44 178.35 2oux h LEU 104 N -0.29 0.35 -3.98 2.25 3.38 -1.12 -2.92 115.31 112.98 2oux h LEU 104 Ca 0.00 0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 2oux h LEU 104 Cb 0.33 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2oux h LEU 104 CO 0.00 0.18 0.02 0.59 0.09 0.00 0.00 178.44 179.32 2oux n ASN 105 N -4.94 2.73 -0.41 -0.43 3.02 -0.73 -4.72 115.26 109.77 2oux n ASN 105 Ca 0.12 -1.86 0.00 0.00 -0.03 0.00 0.00 54.58 52.81 2oux n ASN 105 Cb 0.34 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 38.86 2oux n ASN 105 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2oux n LEU 107 N 2.23 0.00 -4.71 3.41 4.77 -1.11 -5.07 117.00 116.52 2oux n LEU 107 Ca 0.11 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.66 2oux n LEU 107 Cb 0.36 -0.79 -0.02 0.00 -2.33 0.00 0.00 43.42 40.64 2oux n LEU 107 CO 0.09 0.00 1.21 0.47 -1.33 0.00 0.00 177.39 177.83 2oux n ASP 108 N -1.29 3.53 -0.56 -1.43 8.00 -1.26 -4.63 116.55 118.90 2oux n ASP 108 Ca 0.00 1.12 0.43 0.00 0.71 0.00 0.00 54.79 57.05 2oux n ASP 108 Cb 0.00 -1.53 0.67 0.00 -0.02 0.00 0.00 41.12 40.24 2oux n ASP 108 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2oux n LYS 109 N 2.59 -0.01 0.04 -1.24 4.76 -1.26 0.50 118.16 123.55 2oux n LYS 109 Ca 0.12 0.93 -0.09 0.00 -2.87 0.00 0.00 58.31 56.40 2oux n LYS 109 Cb 0.34 -2.10 -0.07 0.00 -1.84 0.00 0.00 35.03 31.37 2oux n LYS 109 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 2oux h SER 110 N 0.00 -0.17 -0.78 4.39 0.02 -2.00 -3.12 113.55 111.89 2oux h SER 110 Ca 0.78 -0.33 0.12 0.00 -0.84 0.00 0.00 61.79 61.52 2oux h SER 110 Cb 3.05 0.04 -0.08 0.00 0.14 0.00 0.00 62.40 65.55 2oux h SER 110 CO -0.08 0.41 0.39 1.56 -1.14 0.00 0.00 176.83 177.97 2oux h GLN 111 N -0.93 0.59 -0.32 3.45 1.08 -0.29 0.15 115.11 118.84 2oux h GLN 111 Ca -0.02 -0.04 0.06 0.00 -1.45 0.00 0.00 58.65 57.20 2oux h GLN 111 Cb 0.49 -0.13 -0.05 0.00 -0.05 0.00 0.00 27.48 27.74 2oux h GLN 111 CO 0.03 0.39 -0.02 -0.22 -0.95 0.00 0.00 178.83 178.06 2oux h LYS 112 N 0.60 0.06 -0.69 1.46 3.64 -1.35 -1.17 116.57 119.13 2oux h LYS 112 Ca 0.40 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.75 2oux h LYS 112 Cb 0.51 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.28 2oux h LYS 112 CO -0.32 0.04 0.32 0.00 -2.27 0.00 0.00 179.45 177.22 2oux h ALA 113 N 1.29 0.89 0.07 5.00 0.00 -1.15 -1.19 119.26 124.17 2oux h ALA 113 Ca 0.15 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2oux h ALA 113 Cb 0.22 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2oux h ALA 113 CO -0.28 0.47 -0.35 -0.22 0.00 0.00 0.00 179.25 178.87 2oux h LYS 114 N 0.96 -0.48 -0.37 0.00 3.64 0.34 0.11 116.57 120.77 2oux h LYS 114 Ca 0.23 0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.54 2oux h LYS 114 Cb 0.14 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 2oux h LYS 114 CO -0.03 -0.32 -0.22 1.88 -2.27 0.00 0.00 179.45 178.49 2oux h TYR 115 N -0.50 0.81 -0.31 1.91 0.05 -1.27 -2.82 116.97 114.83 2oux h TYR 115 Ca -0.00 -0.18 0.04 0.00 0.05 0.00 0.00 58.73 58.64 2oux h TYR 115 Cb 0.50 -0.20 -0.04 0.00 1.01 0.00 0.00 36.73 38.01 2oux h TYR 115 CO -0.41 0.88 0.07 1.25 -1.05 0.00 0.00 178.16 178.90 2oux h LEU 116 N 0.63 0.03 -1.44 3.88 7.12 -0.98 -1.92 115.31 122.63 2oux h LEU 116 Ca 0.09 0.05 -0.06 0.00 0.13 0.00 0.00 57.88 58.09 2oux h LEU 116 Cb 0.71 0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 40.89 2oux h LEU 116 CO 0.05 0.05 -0.28 0.77 -0.13 0.00 0.00 178.44 178.90 2oux h SER 117 N 0.18 0.00 0.00 1.25 4.64 -0.69 -2.44 113.55 116.49 2oux h SER 117 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2oux h SER 117 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 2oux h SER 117 CO -0.19 0.28 0.00 0.18 -0.87 0.00 0.00 176.83 176.23 2oux n LEU 118 N -4.19 0.00 -4.66 5.97 4.77 -0.73 -4.76 117.00 113.40 2oux n LEU 118 Ca -0.02 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.64 2oux n LEU 118 Cb 0.33 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.33 2oux n LEU 118 CO 0.38 0.00 -0.34 -0.76 -1.33 0.00 0.00 177.39 175.34 2oux s LEU 119 N -1.66 3.43 1.16 2.23 1.43 -0.92 -4.94 118.68 119.42 2oux s LEU 119 Ca 0.21 -0.07 -0.16 0.00 -1.03 0.00 0.00 54.13 53.08 2oux s LEU 119 Cb 0.10 -2.00 0.27 0.00 0.03 0.00 0.00 46.19 44.58 2oux s LEU 119 CO 0.16 0.26 1.06 -0.94 0.23 0.00 0.00 176.35 177.12 2oux s SER 120 N -1.65 1.17 0.17 2.29 1.04 -1.26 -4.79 113.70 110.67 2oux s SER 120 Ca 0.20 1.03 -0.14 0.00 0.48 0.00 0.00 55.95 57.52 2oux s SER 120 Cb -0.11 -1.57 0.06 0.00 0.10 0.00 0.00 66.02 64.50 2oux s SER 120 CO 0.11 -4.02 1.78 -1.28 0.98 0.00 0.00 173.24 170.81 2oux h SER 121 N -2.50 0.66 -0.23 7.02 0.87 -1.97 -2.68 113.55 114.71 2oux h SER 121 Ca -0.52 -0.09 -0.13 0.00 -1.23 0.00 0.00 61.79 59.82 2oux h SER 121 Cb 1.33 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 63.12 2oux h SER 121 CO 0.45 0.56 -0.36 -0.08 -0.53 0.00 0.00 176.83 176.87 2oux h GLU 122 N 0.70 0.66 -0.64 2.24 4.81 -2.00 -1.85 114.58 118.50 2oux h GLU 122 Ca 0.19 -0.40 0.08 0.00 -0.13 0.00 0.00 59.36 59.10 2oux h GLU 122 Cb 0.04 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 2oux h GLU 122 CO -0.03 1.01 0.43 0.93 -0.73 0.00 0.00 179.01 180.62 2oux h GLU 123 N 0.37 0.54 -0.02 1.92 5.08 -1.88 -2.57 114.58 118.02 2oux h GLU 123 Ca 0.02 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2oux h GLU 123 Cb 0.95 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.08 2oux h GLU 123 CO 0.08 0.36 -0.46 0.00 -1.00 0.00 0.00 179.01 178.00 2oux n ALA 124 N -2.48 3.52 -1.00 3.43 0.00 -1.02 -4.75 120.51 118.21 2oux n ALA 124 Ca 0.10 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.90 2oux n ALA 124 Cb 0.30 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 18.94 2oux n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oux n GLY 125 N 1.42 -3.64 0.36 0.00 0.00 -0.70 -1.15 105.19 101.48 2oux n GLY 125 Ca 0.09 0.73 0.18 0.00 0.00 0.00 0.00 46.02 47.02 2oux n GLY 125 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2oux h GLU 126 N 0.00 0.02 0.03 1.61 5.08 -1.86 -1.10 114.58 118.36 2oux h GLU 126 Ca 0.00 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2oux h GLU 126 Cb 0.00 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2oux h GLU 126 CO 0.00 0.01 -0.06 0.82 -1.00 0.00 0.00 179.01 178.79 2oux h ILE 127 N 0.02 0.86 0.00 3.13 1.08 -1.73 -2.12 117.51 118.75 2oux h ILE 127 Ca 0.21 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.62 2oux h ILE 127 Cb 0.80 0.86 -0.01 0.00 -3.07 0.00 0.00 36.82 35.40 2oux h ILE 127 CO -0.01 0.00 -0.28 0.11 -0.69 0.00 0.00 178.15 177.29 2oux h LYS 128 N -0.12 0.00 0.23 2.37 1.57 0.14 -1.88 116.57 118.88 2oux h LYS 128 Ca 0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2oux h LYS 128 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.44 2oux h LYS 128 CO -0.04 0.28 -0.11 0.93 -0.57 0.00 0.00 179.45 179.94 2oux h GLU 129 N 0.00 -0.30 0.00 3.15 5.08 -1.02 -3.18 114.58 118.31 2oux h GLU 129 Ca -0.00 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2oux h GLU 129 Cb 0.65 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.97 2oux h GLU 129 CO 0.04 0.05 0.00 1.28 -1.00 0.00 0.00 179.01 179.38 2oux n LEU 130 N -5.06 0.27 0.20 1.33 4.32 -0.83 -2.84 117.00 114.39 2oux n LEU 130 Ca -0.09 0.55 0.06 0.00 -0.02 0.00 0.00 56.01 56.52 2oux n LEU 130 Cb 0.25 -0.49 0.41 0.00 -1.62 0.00 0.00 43.42 41.97 2oux n LEU 130 CO 0.30 -0.26 0.74 -0.07 -1.22 0.00 0.00 177.39 176.88 2oux h LEU 131 N 0.00 0.00 -0.20 2.23 3.38 -1.31 -2.94 115.31 116.46 2oux h LEU 131 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2oux h LEU 131 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2oux h LEU 131 CO 0.00 0.33 -0.04 1.41 0.09 0.00 0.00 178.44 180.23 2oux n HIS 132 N -3.64 0.00 -2.65 1.13 8.25 -1.13 -4.84 115.22 112.33 2oux n HIS 132 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.03 2oux n HIS 132 Cb 0.44 -0.11 -0.03 0.00 1.12 0.00 0.00 29.99 31.41 2oux n HIS 132 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2oux s TYR 133 N -2.26 3.65 0.33 4.41 2.02 -1.11 -4.99 117.35 119.40 2oux s TYR 133 Ca 0.37 1.65 -0.29 0.00 -0.37 0.00 0.00 57.07 58.43 2oux s TYR 133 Cb 0.21 -3.17 -0.11 0.00 -0.40 0.00 0.00 41.96 38.49 2oux s TYR 133 CO 0.42 -0.21 1.48 -1.21 -1.57 0.00 0.00 175.55 174.46 2oux s GLU 134 N 0.74 4.16 0.27 -0.62 8.01 -1.26 -4.66 118.70 125.34 2oux s GLU 134 Ca 0.52 2.50 -0.30 0.00 0.01 0.00 0.00 54.97 57.70 2oux s GLU 134 Cb -0.23 -3.01 -0.14 0.00 -4.31 0.00 0.00 34.13 26.44 2oux s GLU 134 CO 0.29 -0.50 1.22 -3.47 0.01 0.00 0.00 175.26 172.81 2oux n ASP 135 N 1.15 2.08 -0.01 -0.19 2.03 -1.26 -2.43 116.55 117.92 2oux n ASP 135 Ca 0.03 1.17 -0.00 0.00 0.52 0.00 0.00 54.79 56.51 2oux n ASP 135 Cb 0.39 -1.36 -0.00 0.00 -0.72 0.00 0.00 41.12 39.43 2oux n ASP 135 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2oux n GLU 136 N 1.24 -0.24 -3.32 -0.67 1.02 -1.26 -5.03 120.64 112.38 2oux n GLU 136 Ca 0.10 0.09 -0.20 0.00 -0.02 0.00 0.00 57.16 57.13 2oux n GLU 136 Cb 0.32 -3.29 -0.00 0.00 -0.02 0.00 0.00 31.44 28.45 2oux n GLU 136 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2oux s THR 137 N -1.89 2.60 0.18 2.62 -4.23 -1.02 -1.10 115.64 112.80 2oux s THR 137 Ca 0.00 -1.19 -0.14 0.00 -1.18 0.00 0.00 61.69 59.19 2oux s THR 137 Cb 0.00 -2.78 0.07 0.00 1.34 0.00 0.00 72.50 71.13 2oux s THR 137 CO 0.00 0.00 1.77 0.00 -0.54 0.00 0.00 174.62 175.85 2oux h ALA 138 N 0.73 0.59 -0.47 3.99 0.00 -0.76 -1.60 119.26 121.75 2oux h ALA 138 Ca -0.39 0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.63 2oux h ALA 138 Cb 1.28 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.01 2oux h ALA 138 CO 0.50 -0.15 0.32 0.78 0.00 0.00 0.00 179.25 180.70 2oux h GLY 139 N 0.42 0.41 2.00 0.00 0.00 -1.35 -0.94 103.07 103.61 2oux h GLY 139 Ca 0.21 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2oux h GLY 139 CO -0.17 0.09 0.00 0.00 0.00 0.00 0.00 176.54 176.46 2oux h ALA 140 N 1.75 1.00 -1.87 3.60 0.00 -1.48 -3.46 119.26 118.80 2oux h ALA 140 Ca 0.21 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.51 2oux h ALA 140 Cb 0.43 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 17.81 2oux h ALA 140 CO -0.05 0.00 -0.53 0.44 0.00 0.00 0.00 179.25 179.11 2oux n ILE 141 N -2.61 2.95 -3.50 0.00 -5.35 -0.36 -4.88 119.36 105.60 2oux n ILE 141 Ca 0.04 -5.29 -0.09 0.00 -0.27 0.00 0.00 62.75 57.14 2oux n ILE 141 Cb 0.40 -1.35 -0.02 0.00 -1.74 0.00 0.00 39.64 36.94 2oux n ILE 141 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 2oux s THR 143 N -4.94 0.00 -0.61 7.28 -1.32 -0.12 -4.69 115.64 111.24 2oux s THR 143 Ca 0.48 -0.04 0.23 0.00 -1.21 0.00 0.00 61.69 61.16 2oux s THR 143 Cb 0.33 -1.05 -0.04 0.00 -1.51 0.00 0.00 72.50 70.23 2oux s THR 143 CO -0.17 0.00 1.16 0.35 -2.21 0.00 0.00 174.62 173.74 2oux n THR 144 N -0.28 0.27 -1.13 5.08 -2.24 -1.26 -0.97 114.28 113.74 2oux n THR 144 Ca -0.10 -0.27 -0.33 0.00 -2.27 0.00 0.00 64.05 61.08 2oux n THR 144 Cb 0.62 0.04 -0.02 0.00 -2.10 0.00 0.00 70.33 68.86 2oux n THR 144 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2oux n GLU 145 N -2.05 2.95 -4.14 -0.78 4.71 -1.26 -4.88 120.64 115.18 2oux n GLU 145 Ca 0.02 -1.95 -0.22 0.00 -0.01 0.00 0.00 57.16 55.00 2oux n GLU 145 Cb 0.44 -2.72 -0.05 0.00 -1.01 0.00 0.00 31.44 28.10 2oux n GLU 145 CO 0.00 0.00 0.00 -0.59 0.09 0.00 0.00 177.13 176.63 2oux s PHE 146 N 2.84 3.05 -0.20 -0.32 -0.12 -1.26 0.13 117.98 122.08 2oux s PHE 146 Ca 0.57 -0.12 -0.08 0.00 -0.05 0.00 0.00 56.93 57.24 2oux s PHE 146 Cb 0.15 -1.37 -0.04 0.00 -0.63 0.00 0.00 43.02 41.12 2oux s PHE 146 CO -0.04 0.54 0.08 0.08 -0.05 0.00 0.00 175.22 175.83 2oux s VAL 147 N -2.15 4.85 0.07 -2.49 1.01 -1.26 -4.96 120.40 115.46 2oux s VAL 147 Ca 0.32 -0.01 0.06 0.00 0.00 0.00 0.00 61.98 62.36 2oux s VAL 147 Cb -0.08 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 2oux s VAL 147 CO 0.24 0.42 -0.17 -0.94 0.00 0.00 0.00 175.10 174.65 2oux s SER 148 N 0.69 2.06 0.29 3.32 1.04 -1.26 -0.98 113.70 118.87 2oux s SER 148 Ca 0.04 -0.59 0.04 0.00 0.48 0.00 0.00 55.95 55.93 2oux s SER 148 Cb -0.13 -0.11 -0.03 0.00 0.10 0.00 0.00 66.02 65.85 2oux s SER 148 CO 0.02 0.02 0.24 0.27 0.98 0.00 0.00 173.24 174.77 2oux s ILE 149 N -1.08 0.00 0.12 -1.02 -5.25 0.47 -4.94 121.20 109.50 2oux s ILE 149 Ca 0.03 -1.98 0.04 0.00 -0.99 0.00 0.00 60.65 57.75 2oux s ILE 149 Cb -0.09 -2.50 -0.04 0.00 2.95 0.00 0.00 42.46 42.78 2oux s ILE 149 CO 0.03 0.00 0.10 0.68 -1.79 0.00 0.00 174.94 173.95 2oux s VAL 150 N -3.66 4.45 0.39 8.37 -7.23 -1.26 -0.96 120.40 120.50 2oux s VAL 150 Ca 0.40 -0.94 0.08 0.00 -1.81 0.00 0.00 61.98 59.71 2oux s VAL 150 Cb 0.04 -3.20 0.18 0.00 0.56 0.00 0.00 36.38 33.96 2oux s VAL 150 CO 0.22 0.01 1.94 0.00 -0.31 0.00 0.00 175.10 176.97 2oux h ALA 151 N 2.90 1.54 -1.51 1.32 0.00 -1.95 -3.37 119.26 118.18 2oux h ALA 151 Ca -0.47 -0.16 -0.77 0.00 0.00 0.00 0.00 54.91 53.50 2oux h ALA 151 Cb 1.18 -0.11 -0.21 0.00 0.00 0.00 0.00 17.79 18.65 2oux h ALA 151 CO 0.64 0.34 1.38 0.09 0.00 0.00 0.00 179.25 181.70 2oux n ASN 152 N -4.33 5.56 -3.68 0.00 3.02 -1.26 -0.86 115.26 113.72 2oux n ASN 152 Ca 0.00 -3.17 -0.10 0.00 -0.03 0.00 0.00 54.58 51.28 2oux n ASN 152 Cb 0.22 -1.42 -0.03 0.00 -0.61 0.00 0.00 39.78 37.94 2oux n ASN 152 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2oux s GLN 153 N -0.56 1.46 0.67 3.52 -2.07 -1.26 -5.02 119.66 116.40 2oux s GLN 153 Ca 0.37 -0.79 -0.09 0.00 -1.82 0.00 0.00 55.36 53.03 2oux s GLN 153 Cb 0.04 0.56 0.02 0.00 -1.09 0.00 0.00 33.01 32.55 2oux s GLN 153 CO 0.03 -0.64 1.02 0.95 -1.32 0.00 0.00 175.29 175.32 2oux s THR 154 N -3.85 3.29 0.14 3.63 -4.23 -1.26 -0.44 115.64 112.92 2oux s THR 154 Ca 0.07 0.17 -0.16 0.00 -1.18 0.00 0.00 61.69 60.59 2oux s THR 154 Cb -0.02 -3.38 -0.00 0.00 1.34 0.00 0.00 72.50 70.44 2oux s THR 154 CO -0.03 -0.44 1.74 0.58 -0.54 0.00 0.00 174.62 175.92 2oux h VAL 155 N -0.49 1.15 -0.82 2.29 2.07 -1.24 -0.76 116.25 118.44 2oux h VAL 155 Ca -0.45 -0.39 0.17 0.00 0.82 0.00 0.00 66.70 66.84 2oux h VAL 155 Cb 1.27 0.72 -0.10 0.00 -1.52 0.00 0.00 31.29 31.65 2oux h VAL 155 CO 0.62 0.16 0.36 -0.09 0.02 0.00 0.00 177.57 178.64 2oux h ARG 156 N 0.48 0.45 -0.45 1.57 2.43 -1.73 0.14 114.38 117.29 2oux h ARG 156 Ca 0.13 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 2oux h ARG 156 Cb 0.07 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 2oux h ARG 156 CO -0.02 0.30 0.20 0.77 -1.51 0.00 0.00 179.97 179.71 2oux h SER 157 N 0.47 0.60 0.00 -3.80 0.02 -1.61 -1.50 113.55 107.72 2oux h SER 157 Ca 0.47 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.28 2oux h SER 157 Cb 0.77 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.16 2oux h SER 157 CO -0.44 0.57 0.00 0.00 -1.14 0.00 0.00 176.83 175.83 2oux n ALA 158 N -2.30 1.26 0.00 3.77 0.00 0.50 -2.25 120.51 121.48 2oux n ALA 158 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2oux n ALA 158 Cb 0.13 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.58 2oux n ALA 158 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2oux n TYR 160 N 0.70 0.00 -0.23 0.00 9.36 -0.57 -0.93 117.16 125.49 2oux n TYR 160 Ca 0.00 0.00 -0.06 0.00 3.32 0.00 0.00 57.90 61.16 2oux n TYR 160 Cb 0.01 0.00 0.04 0.00 -0.63 0.00 0.00 39.34 38.76 2oux n TYR 160 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 2oux h VAL 161 N 0.00 1.22 -0.22 2.97 2.07 -1.73 -2.91 116.25 117.65 2oux h VAL 161 Ca 0.00 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 66.96 2oux h VAL 161 Cb 0.00 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.16 2oux h VAL 161 CO 0.00 0.25 0.03 -0.07 0.02 0.00 0.00 177.57 177.80 2oux h LEU 162 N 0.89 -0.02 -0.77 2.57 -0.00 -1.32 -1.90 115.31 114.75 2oux h LEU 162 Ca 0.22 0.04 0.04 0.00 -0.00 0.00 0.00 57.88 58.18 2oux h LEU 162 Cb 0.10 0.06 -0.05 0.00 -0.00 0.00 0.00 40.66 40.77 2oux h LEU 162 CO -0.03 0.02 0.48 0.11 -0.00 0.00 0.00 178.44 179.02 2oux h LYS 163 N 0.11 0.91 0.00 1.13 1.57 -1.81 -0.30 116.57 118.18 2oux h LYS 163 Ca 0.10 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 2oux h LYS 163 Cb 0.11 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 2oux h LYS 163 CO -0.15 0.60 -0.22 -0.91 -0.57 0.00 0.00 179.45 178.20 2oux h ASN 164 N 0.93 0.00 0.66 0.86 -0.26 -1.27 -3.02 115.58 113.48 2oux h ASN 164 Ca 0.31 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.05 2oux h ASN 164 Cb 0.04 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.30 2oux h ASN 164 CO -0.12 0.22 -1.04 0.00 -1.06 0.00 0.00 177.43 175.43 2oux n GLN 165 N -4.03 0.43 -0.37 0.81 1.13 -0.73 -4.50 117.38 110.12 2oux n GLN 165 Ca -0.02 0.04 -0.05 0.00 -1.94 0.00 0.00 57.00 55.02 2oux n GLN 165 Cb 0.30 -1.68 -0.02 0.00 0.11 0.00 0.00 30.24 28.95 2oux n GLN 165 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2oux h ALA 166 N 2.30 -0.14 0.00 -1.58 0.00 -0.94 0.12 119.26 119.01 2oux h ALA 166 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2oux h ALA 166 Cb 0.85 1.13 0.00 0.00 0.00 0.00 0.00 17.79 19.77 2oux h ALA 166 CO 0.00 -0.77 0.00 -0.40 0.00 0.00 0.00 179.25 178.08 2oux n ASP 167 N -5.39 0.00 -0.08 0.00 5.68 -1.26 -4.92 116.55 110.58 2oux n ASP 167 Ca 0.06 -0.11 0.00 0.00 -0.50 0.00 0.00 54.79 54.24 2oux n ASP 167 Cb 0.35 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.33 2oux n ASP 167 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2oux n ALA 169 N -0.55 -1.00 -0.14 2.12 0.00 0.42 -5.17 120.51 116.20 2oux n ALA 169 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 2oux n ALA 169 Cb 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 19.45 19.39 2oux n ALA 169 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2oux h GLU 170 N -0.04 0.70 -2.23 0.00 4.57 0.66 -3.46 114.58 114.78 2oux h GLU 170 Ca 0.00 -0.23 -0.07 0.00 -1.18 0.00 0.00 59.36 57.88 2oux h GLU 170 Cb 0.00 -0.06 -0.20 0.00 -0.16 0.00 0.00 28.75 28.33 2oux h GLU 170 CO 0.00 0.80 0.06 -0.08 -1.18 0.00 0.00 179.01 178.62 2oux s THR 171 N -4.97 0.01 -0.18 0.32 -1.32 -1.25 -5.04 115.64 103.20 2oux s THR 171 Ca -0.13 -0.08 0.02 0.00 -1.21 0.00 0.00 61.69 60.29 2oux s THR 171 Cb 0.10 -0.90 0.06 0.00 -1.51 0.00 0.00 72.50 70.25 2oux s THR 171 CO 0.79 -0.04 1.04 2.30 -2.21 0.00 0.00 174.62 176.50 2oux n ILE 172 N 1.53 0.97 0.23 5.08 -0.00 -1.26 -4.36 119.36 121.55 2oux n ILE 172 Ca -0.18 -0.99 0.12 0.00 -0.00 0.00 0.00 62.75 61.71 2oux n ILE 172 Cb 0.56 0.52 0.30 0.00 -0.00 0.00 0.00 39.64 41.02 2oux n ILE 172 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 176.55 178.43 2oux h TYR 173 N 0.40 0.00 -3.34 4.28 0.05 -1.96 -3.39 116.97 113.00 2oux h TYR 173 Ca 0.00 0.00 -0.58 0.00 0.05 0.00 0.00 58.73 58.20 2oux h TYR 173 Cb 0.53 0.00 -0.34 0.00 1.01 0.00 0.00 36.73 37.93 2oux h TYR 173 CO 0.04 0.06 -0.84 0.71 -1.05 0.00 0.00 178.16 177.09 2oux s TYR 174 N -3.32 1.90 -0.18 4.88 2.02 -1.26 -1.07 117.35 120.31 2oux s TYR 174 Ca 0.05 -0.80 -0.01 0.00 -0.37 0.00 0.00 57.07 55.94 2oux s TYR 174 Cb 0.06 -1.35 -0.00 0.00 -0.40 0.00 0.00 41.96 40.28 2oux s TYR 174 CO 0.64 -0.38 -0.11 0.08 -1.57 0.00 0.00 175.55 174.21 2oux s VAL 175 N 0.72 2.87 0.05 0.71 1.01 0.77 -4.63 120.40 121.89 2oux s VAL 175 Ca -0.13 -0.68 -0.17 0.00 0.00 0.00 0.00 61.98 61.00 2oux s VAL 175 Cb -0.16 -2.25 -0.06 0.00 0.00 0.00 0.00 36.38 33.90 2oux s VAL 175 CO 0.03 0.48 0.51 -0.31 0.00 0.00 0.00 175.10 175.81 2oux s TYR 176 N 1.14 3.78 -0.25 5.22 2.02 -0.15 -1.38 117.35 127.72 2oux s TYR 176 Ca 0.01 1.16 -0.09 0.00 -0.37 0.00 0.00 57.07 57.78 2oux s TYR 176 Cb -0.14 -2.41 -0.04 0.00 -0.40 0.00 0.00 41.96 38.96 2oux s TYR 176 CO -0.04 0.61 0.12 0.08 -1.57 0.00 0.00 175.55 174.75 2oux s VAL 177 N -1.10 4.84 0.25 0.71 1.01 -0.14 -0.40 120.40 125.56 2oux s VAL 177 Ca 0.27 0.01 0.11 0.00 0.00 0.00 0.00 61.98 62.37 2oux s VAL 177 Cb -0.18 -3.27 -0.05 0.00 0.00 0.00 0.00 36.38 32.88 2oux s VAL 177 CO 0.17 0.32 -0.18 0.68 0.00 0.00 0.00 175.10 176.09 2oux s VAL 178 N 1.47 2.62 0.24 2.92 -7.23 -0.13 -0.93 120.40 119.35 2oux s VAL 178 Ca 0.06 -2.19 -0.01 0.00 -1.81 0.00 0.00 61.98 58.03 2oux s VAL 178 Cb -0.15 -2.34 0.05 0.00 0.56 0.00 0.00 36.38 34.50 2oux s VAL 178 CO 0.06 -0.30 0.33 -0.90 -0.31 0.00 0.00 175.10 173.98 2oux n ASP 179 N -0.36 0.35 -0.13 4.85 5.68 -0.34 -4.35 116.55 122.24 2oux n ASP 179 Ca -0.08 -1.32 0.15 0.00 -0.50 0.00 0.00 54.79 53.05 2oux n ASP 179 Cb 0.58 -0.22 0.53 0.00 -1.14 0.00 0.00 41.12 40.87 2oux n ASP 179 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 2oux h GLN 180 N 0.00 0.35 -0.29 0.11 4.20 -1.98 0.38 115.11 117.87 2oux h GLN 180 Ca -0.11 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.58 2oux h GLN 180 Cb 0.38 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.08 2oux h GLN 180 CO 0.11 0.23 0.00 0.39 -0.67 0.00 0.00 178.83 178.89 2oux n GLU 181 N -4.46 1.95 -2.01 1.46 1.02 -1.26 -4.92 120.64 112.41 2oux n GLU 181 Ca 0.13 -1.44 -0.06 0.00 -0.02 0.00 0.00 57.16 55.77 2oux n GLU 181 Cb 0.52 -1.39 -0.00 0.00 -0.02 0.00 0.00 31.44 30.54 2oux n GLU 181 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2oux n ASN 182 N 0.66 -2.48 -4.73 1.62 2.85 0.12 -4.99 115.26 108.31 2oux n ASN 182 Ca 0.16 0.01 -0.40 0.00 -0.11 0.00 0.00 54.58 54.24 2oux n ASN 182 Cb 0.38 -1.71 -0.05 0.00 1.24 0.00 0.00 39.78 39.65 2oux n ASN 182 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 2oux s HIS 183 N -2.28 3.68 -0.34 1.20 3.76 -1.26 -2.31 115.29 117.74 2oux s HIS 183 Ca 0.00 1.41 -0.29 0.00 -0.15 0.00 0.00 55.06 56.04 2oux s HIS 183 Cb 0.00 -2.83 -0.01 0.00 1.11 0.00 0.00 32.58 30.85 2oux s HIS 183 CO 0.00 0.20 1.65 -1.17 -0.85 0.00 0.00 174.74 174.56 2oux s LEU 184 N 0.29 3.57 -0.00 0.89 2.96 -0.47 -1.20 118.68 124.71 2oux s LEU 184 Ca 0.39 1.18 0.09 0.00 -0.22 0.00 0.00 54.13 55.57 2oux s LEU 184 Cb -0.20 -3.53 -0.11 0.00 0.50 0.00 0.00 46.19 42.85 2oux s LEU 184 CO 0.22 -1.56 0.29 1.33 -1.32 0.00 0.00 176.35 175.31 2oux n VAL 185 N 7.20 0.00 -3.81 1.68 0.24 -0.11 -4.99 118.33 118.54 2oux n VAL 185 Ca 0.20 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 62.25 2oux n VAL 185 Cb 0.47 0.71 0.01 0.00 -1.47 0.00 0.00 33.84 33.56 2oux n VAL 185 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2oux n GLY 186 N 1.53 0.65 3.45 7.63 0.00 -0.86 -4.76 105.19 112.83 2oux n GLY 186 Ca 0.00 -0.97 -0.16 0.00 0.00 0.00 0.00 46.02 44.89 2oux n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oux s VAL 187 N -2.18 0.01 -0.17 1.61 0.11 -0.99 -0.97 120.40 117.82 2oux s VAL 187 Ca 0.13 -0.09 -0.15 0.00 -2.93 0.00 0.00 61.98 58.94 2oux s VAL 187 Cb -0.01 -0.97 0.04 0.00 -1.53 0.00 0.00 36.38 33.92 2oux s VAL 187 CO 0.01 -0.05 0.44 -0.51 -3.33 0.00 0.00 175.10 171.66 2oux s ILE 188 N -1.94 -0.00 0.30 7.04 2.07 -0.48 -0.17 121.20 128.01 2oux s ILE 188 Ca -0.08 0.01 -0.11 0.00 -1.41 0.00 0.00 60.65 59.06 2oux s ILE 188 Cb -0.01 -0.62 -0.08 0.00 0.13 0.00 0.00 42.46 41.89 2oux s ILE 188 CO 0.03 0.00 0.66 -0.94 -1.91 0.00 0.00 174.94 172.78 2oux s SER 189 N 0.37 6.66 0.51 4.50 1.04 -1.26 -0.16 113.70 125.35 2oux s SER 189 Ca -0.01 1.08 0.20 0.00 0.48 0.00 0.00 55.95 57.70 2oux s SER 189 Cb -0.04 -2.29 1.29 0.00 0.10 0.00 0.00 66.02 65.08 2oux s SER 189 CO -0.01 -0.18 2.04 0.25 0.98 0.00 0.00 173.24 176.32 2oux h LEU 190 N 2.18 0.07 -0.97 2.42 5.85 -1.30 0.05 115.31 123.60 2oux h LEU 190 Ca -0.47 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 2oux h LEU 190 Cb 1.18 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.15 2oux h LEU 190 CO 0.67 0.04 0.52 -0.09 -0.34 0.00 0.00 178.44 179.24 2oux h ARG 191 N 0.08 1.23 -0.06 1.25 2.43 -1.93 -0.33 114.38 117.05 2oux h ARG 191 Ca 0.18 -0.13 -0.16 0.00 -0.81 0.00 0.00 59.98 59.06 2oux h ARG 191 Cb 0.62 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 2oux h ARG 191 CO -0.02 0.88 -0.68 -0.44 -1.51 0.00 0.00 179.97 178.21 2oux h ASP 192 N 1.24 0.33 0.29 -3.80 3.32 -1.39 -3.14 116.42 113.28 2oux h ASP 192 Ca 0.32 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 2oux h ASP 192 Cb -0.02 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.44 2oux h ASP 192 CO -0.06 0.91 -0.14 -0.07 -1.72 0.00 0.00 179.24 178.16 2oux h LEU 193 N 0.20 -0.33 -1.65 1.55 3.38 -0.81 -3.07 115.31 114.58 2oux h LEU 193 Ca -0.02 -0.06 0.20 0.00 0.09 0.00 0.00 57.88 58.08 2oux h LEU 193 Cb 1.22 0.09 -0.05 0.00 0.09 0.00 0.00 40.66 42.00 2oux h LEU 193 CO 0.11 -0.14 0.57 0.40 0.09 0.00 0.00 178.44 179.46 2oux h ILE 194 N -0.50 0.69 -0.34 1.22 1.08 -1.09 -1.96 117.51 116.60 2oux h ILE 194 Ca -0.04 -0.11 0.00 0.00 -0.39 0.00 0.00 64.86 64.32 2oux h ILE 194 Cb 0.38 0.35 0.00 0.00 -3.07 0.00 0.00 36.82 34.48 2oux h ILE 194 CO 0.07 0.06 0.00 1.33 -0.69 0.00 0.00 178.15 178.91 2oux n VAL 195 N -4.45 0.45 -4.06 1.67 0.24 -1.18 -4.91 118.33 106.08 2oux n VAL 195 Ca 0.17 -0.61 -0.26 0.00 -2.04 0.00 0.00 64.34 61.60 2oux n VAL 195 Cb 0.70 0.67 -0.05 0.00 -1.47 0.00 0.00 33.84 33.68 2oux n VAL 195 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2oux s ASN 196 N -1.42 5.67 0.37 -1.34 0.01 -0.74 -5.08 114.94 112.40 2oux s ASN 196 Ca 0.36 -0.07 -0.27 0.00 -0.71 0.00 0.00 52.86 52.17 2oux s ASN 196 Cb 0.20 -1.53 -0.09 0.00 0.41 0.00 0.00 41.25 40.24 2oux s ASN 196 CO 0.29 0.07 1.23 -1.81 -1.51 0.00 0.00 177.10 175.36 2oux s ASP 197 N -3.13 6.63 0.59 -1.22 1.01 -1.26 -4.89 116.67 114.40 2oux s ASP 197 Ca 0.32 2.49 0.31 0.00 0.71 0.00 0.00 52.55 56.37 2oux s ASP 197 Cb -0.10 -2.63 1.67 0.00 1.01 0.00 0.00 42.92 42.86 2oux s ASP 197 CO 0.24 -0.62 1.93 -2.24 0.21 0.00 0.00 175.17 174.69 2oux h ASP 198 N 2.97 0.00 0.64 0.27 2.03 -1.95 -0.90 116.42 119.48 2oux h ASP 198 Ca -0.49 0.00 -0.27 0.00 -0.73 0.00 0.00 57.03 55.54 2oux h ASP 198 Cb 1.23 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 39.69 2oux h ASP 198 CO 0.64 0.00 -1.48 0.44 -1.03 0.00 0.00 179.24 177.80 2oux h ASP 199 N 0.00 0.04 -1.93 4.15 3.32 -1.97 -2.44 116.42 117.59 2oux h ASP 199 Ca 0.00 -0.07 -0.63 0.00 0.02 0.00 0.00 57.03 56.35 2oux h ASP 199 Cb 0.43 -0.01 0.11 0.00 0.22 0.00 0.00 39.33 40.08 2oux h ASP 199 CO 0.00 1.06 -0.08 0.41 -1.72 0.00 0.00 179.24 178.91 2oux n THR 200 N -3.18 1.89 -3.10 0.35 -1.04 -0.34 -4.62 114.28 104.23 2oux n THR 200 Ca -0.12 -0.47 -0.39 0.00 -2.04 0.00 0.00 64.05 61.02 2oux n THR 200 Cb 1.02 -0.64 -0.05 0.00 -1.82 0.00 0.00 70.33 68.83 2oux n THR 200 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2oux s LEU 201 N 1.30 4.46 0.25 -4.42 1.02 -1.26 -1.55 118.68 118.48 2oux s LEU 201 Ca 0.62 1.33 -0.03 0.00 0.02 0.00 0.00 54.13 56.07 2oux s LEU 201 Cb -0.80 -3.08 0.49 0.00 0.02 0.00 0.00 46.19 42.83 2oux s LEU 201 CO 0.58 0.10 1.72 0.40 0.02 0.00 0.00 176.35 179.17 2oux h ILE 202 N 3.97 0.62 0.00 -0.59 2.04 -0.83 0.20 117.51 122.93 2oux h ILE 202 Ca -0.45 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.26 2oux h ILE 202 Cb 1.20 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 2oux h ILE 202 CO 0.69 0.08 0.06 0.00 0.00 0.00 0.00 178.15 178.97 2oux h ALA 203 N 1.57 1.05 0.00 1.87 0.00 -1.25 -0.41 119.26 122.10 2oux h ALA 203 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 2oux h ALA 203 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2oux h ALA 203 CO -0.43 -0.05 -1.02 -0.25 0.00 0.00 0.00 179.25 177.51 2oux n ASP 204 N -2.72 0.65 0.00 0.00 8.00 0.06 -4.37 116.55 118.17 2oux n ASP 204 Ca -0.02 0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.53 2oux n ASP 204 Cb 0.11 0.65 0.00 0.00 -0.02 0.00 0.00 41.12 41.86 2oux n ASP 204 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2oux n ILE 205 N -2.24 0.00 -1.88 0.53 -5.35 -0.63 -5.05 119.36 104.74 2oux n ILE 205 Ca 0.01 -0.47 -0.34 0.00 -0.27 0.00 0.00 62.75 61.68 2oux n ILE 205 Cb 0.48 1.02 0.04 0.00 -1.74 0.00 0.00 39.64 39.44 2oux n ILE 205 CO 0.00 0.00 0.00 -1.48 -1.76 0.00 0.00 176.55 173.31 2oux s LEU 206 N -1.05 3.48 -0.23 7.28 0.05 -0.26 -4.96 118.68 123.00 2oux s LEU 206 Ca 0.00 2.07 -0.18 0.00 0.05 0.00 0.00 54.13 56.08 2oux s LEU 206 Cb 0.00 -4.56 -0.03 0.00 -2.05 0.00 0.00 46.19 39.55 2oux s LEU 206 CO 0.00 -1.55 0.49 0.21 -0.55 0.00 0.00 176.35 174.94 2oux s ASN 207 N -2.33 6.48 0.09 1.48 3.84 0.76 -4.91 114.94 120.35 2oux s ASN 207 Ca 0.69 0.57 -0.14 0.00 0.21 0.00 0.00 52.86 54.19 2oux s ASN 207 Cb -0.22 -2.27 -0.16 0.00 -0.55 0.00 0.00 41.25 38.05 2oux s ASN 207 CO 0.38 -0.20 1.30 -0.08 -2.79 0.00 0.00 177.10 175.71 2oux h GLU 208 N 7.68 0.75 -5.34 0.43 4.81 -1.86 -2.64 114.58 118.41 2oux h GLU 208 Ca -0.32 -0.60 -0.61 0.00 -0.13 0.00 0.00 59.36 57.70 2oux h GLU 208 Cb 1.15 0.12 -0.05 0.00 0.63 0.00 0.00 28.75 30.60 2oux h GLU 208 CO 0.72 1.21 2.13 0.54 -0.73 0.00 0.00 179.01 182.88 2oux n ARG 209 N -4.00 2.65 -3.17 1.92 5.12 -1.26 -4.76 116.66 113.15 2oux n ARG 209 Ca -0.07 -2.87 -0.39 0.00 -1.93 0.00 0.00 57.85 52.58 2oux n ARG 209 Cb 0.71 -3.47 -0.06 0.00 -1.16 0.00 0.00 32.46 28.48 2oux n ARG 209 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2oux s VAL 210 N 5.63 5.07 -0.01 1.55 0.11 -1.26 -5.02 120.40 126.47 2oux s VAL 210 Ca 0.56 1.14 -0.23 0.00 -2.93 0.00 0.00 61.98 60.52 2oux s VAL 210 Cb 0.06 -3.92 -0.05 0.00 -1.53 0.00 0.00 36.38 30.94 2oux s VAL 210 CO 0.07 0.19 0.69 -0.63 -3.33 0.00 0.00 175.10 172.08 2oux s ILE 211 N 1.43 4.90 0.26 7.04 1.09 -1.26 -5.06 121.20 129.60 2oux s ILE 211 Ca 0.29 1.44 -0.04 0.00 -1.10 0.00 0.00 60.65 61.23 2oux s ILE 211 Cb -0.16 -4.03 -0.02 0.00 -1.06 0.00 0.00 42.46 37.19 2oux s ILE 211 CO 0.11 0.34 0.33 -0.94 -0.10 0.00 0.00 174.94 174.68 2oux s SER 212 N 0.20 0.35 0.26 3.58 1.04 -1.26 -4.41 113.70 113.46 2oux s SER 212 Ca 0.36 -1.29 0.03 0.00 0.48 0.00 0.00 55.95 55.53 2oux s SER 212 Cb -0.19 0.52 -0.05 0.00 0.10 0.00 0.00 66.02 66.40 2oux s SER 212 CO 0.19 -1.05 0.05 0.68 0.98 0.00 0.00 173.24 174.09 2oux s VAL 213 N -3.83 0.88 0.10 5.02 -7.23 -0.92 -5.02 120.40 109.41 2oux s VAL 213 Ca 0.32 -2.01 -0.02 0.00 -1.81 0.00 0.00 61.98 58.46 2oux s VAL 213 Cb 0.03 -2.55 -0.05 0.00 0.56 0.00 0.00 36.38 34.37 2oux s VAL 213 CO 0.14 -0.14 0.29 -2.28 -0.31 0.00 0.00 175.10 172.80 2oux s HIS 214 N -3.52 3.50 0.41 2.82 2.46 -1.26 -1.90 115.29 117.80 2oux s HIS 214 Ca 0.34 0.36 0.18 0.00 0.47 0.00 0.00 55.06 56.40 2oux s HIS 214 Cb 0.07 -1.85 1.09 0.00 -0.13 0.00 0.00 32.58 31.76 2oux s HIS 214 CO 0.12 0.52 1.82 0.28 -2.47 0.00 0.00 174.74 175.00 2oux h VAL 215 N 2.01 0.61 -0.01 0.89 2.07 -1.40 -0.81 116.25 119.62 2oux h VAL 215 Ca -0.46 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.92 2oux h VAL 215 Cb 1.17 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2oux h VAL 215 CO 0.74 0.07 -0.07 0.61 0.02 0.00 0.00 177.57 178.95 2oux n GLY 216 N -1.50 -0.38 3.72 2.17 0.00 -1.26 -1.01 105.19 106.93 2oux n GLY 216 Ca 0.22 -0.38 -0.36 0.00 0.00 0.00 0.00 46.02 45.50 2oux n GLY 216 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2oux s ASP 217 N -2.17 4.37 0.20 1.61 1.01 -0.31 -4.66 116.67 116.72 2oux s ASP 217 Ca 0.35 2.54 -0.30 0.00 0.71 0.00 0.00 52.55 55.85 2oux s ASP 217 Cb 0.21 -2.61 -0.08 0.00 1.01 0.00 0.00 42.92 41.45 2oux s ASP 217 CO 0.40 -2.16 1.15 -0.62 0.21 0.00 0.00 175.17 174.15 2oux s ASP 218 N -1.62 7.17 0.40 0.27 2.15 -1.26 -1.11 116.67 122.67 2oux s ASP 218 Ca 0.80 2.20 0.18 0.00 0.43 0.00 0.00 52.55 56.15 2oux s ASP 218 Cb -0.35 -2.61 1.08 0.00 -0.30 0.00 0.00 42.92 40.74 2oux s ASP 218 CO 0.42 -0.28 1.80 0.06 -0.17 0.00 0.00 175.17 177.00 2oux h GLN 219 N 4.91 0.41 -0.94 4.34 3.07 -1.38 0.18 115.11 125.69 2oux h GLN 219 Ca -0.45 -0.02 0.05 0.00 0.09 0.00 0.00 58.65 58.32 2oux h GLN 219 Cb 1.21 -0.09 -0.06 0.00 0.08 0.00 0.00 27.48 28.62 2oux h GLN 219 CO 0.72 0.27 0.60 1.49 0.09 0.00 0.00 178.83 182.00 2oux h GLU 220 N 0.42 1.08 -0.14 0.06 4.57 -1.91 0.46 114.58 119.13 2oux h GLU 220 Ca 0.55 -0.07 -0.16 0.00 -1.18 0.00 0.00 59.36 58.51 2oux h GLU 220 Cb 1.37 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 29.71 2oux h GLU 220 CO -0.26 0.72 -0.59 -0.44 -1.18 0.00 0.00 179.01 177.26 2oux h ASP 221 N 1.12 0.50 -0.57 1.04 3.32 -1.35 -1.30 116.42 119.18 2oux h ASP 221 Ca 0.39 -0.28 -0.10 0.00 0.02 0.00 0.00 57.03 57.06 2oux h ASP 221 Cb 0.11 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 2oux h ASP 221 CO -0.15 0.98 -0.05 0.58 -1.72 0.00 0.00 179.24 178.87 2oux h VAL 222 N 0.34 1.27 -0.88 -1.35 2.07 -0.74 -1.80 116.25 115.15 2oux h VAL 222 Ca -0.00 -1.20 -0.02 0.00 0.82 0.00 0.00 66.70 66.29 2oux h VAL 222 Cb 1.13 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 2oux h VAL 222 CO 0.10 0.43 0.46 0.00 0.02 0.00 0.00 177.57 178.59 2oux h ALA 223 N 0.95 1.13 -0.54 1.67 0.00 0.08 -1.98 119.26 120.58 2oux h ALA 223 Ca 0.15 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2oux h ALA 223 Cb 0.61 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2oux h ALA 223 CO 0.04 0.66 0.18 0.37 0.00 0.00 0.00 179.25 180.50 2oux h GLN 224 N 1.24 0.83 -0.62 0.00 5.75 -0.83 -1.34 115.11 120.15 2oux h GLN 224 Ca 0.31 -0.17 -0.02 0.00 -0.15 0.00 0.00 58.65 58.62 2oux h GLN 224 Cb 0.06 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.46 2oux h GLN 224 CO -0.05 0.75 0.32 1.15 -2.65 0.00 0.00 178.83 178.36 2oux h THR 225 N 0.74 1.21 -0.22 2.39 2.02 -0.95 -0.05 112.91 118.04 2oux h THR 225 Ca 0.17 -0.55 -0.10 0.00 0.77 0.00 0.00 66.41 66.71 2oux h THR 225 Cb 0.26 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 2oux h THR 225 CO -0.01 0.23 -0.29 0.40 0.37 0.00 0.00 175.52 176.22 2oux h ILE 226 N 0.84 1.27 -0.14 3.11 1.08 -1.23 -1.88 117.51 120.57 2oux h ILE 226 Ca 0.21 -1.32 -0.03 0.00 -0.39 0.00 0.00 64.86 63.34 2oux h ILE 226 Cb 0.08 1.42 -0.00 0.00 -3.07 0.00 0.00 36.82 35.24 2oux h ILE 226 CO -0.03 0.41 -0.02 -0.09 -0.69 0.00 0.00 178.15 177.73 2oux h ARG 227 N 0.38 0.25 -0.12 2.37 2.43 -0.79 -2.10 114.38 116.81 2oux h ARG 227 Ca 0.05 -0.09 -0.05 0.00 -0.81 0.00 0.00 59.98 59.08 2oux h ARG 227 Cb 0.70 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2oux h ARG 227 CO 0.05 0.53 -0.13 -0.44 -1.51 0.00 0.00 179.97 178.47 2oux h ASP 228 N -0.04 0.33 -0.04 -3.80 3.32 -0.88 -3.25 116.42 112.06 2oux h ASP 228 Ca 0.04 -0.49 0.00 0.00 0.02 0.00 0.00 57.03 56.59 2oux h ASP 228 Cb 0.43 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.88 2oux h ASP 228 CO 0.01 0.75 0.00 -1.22 -1.72 0.00 0.00 179.24 177.07 2oux n TYR 229 N -4.59 0.05 -3.91 4.55 4.01 -0.72 -4.94 117.16 111.61 2oux n TYR 229 Ca -0.07 -0.02 -0.25 0.00 -0.16 0.00 0.00 57.90 57.40 2oux n TYR 229 Cb 0.35 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.38 2oux n TYR 229 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2oux n ASP 230 N -0.30 -0.87 -4.85 7.72 8.00 -0.81 -4.95 116.55 120.49 2oux n ASP 230 Ca 0.19 -0.95 -0.34 0.00 0.71 0.00 0.00 54.79 54.40 2oux n ASP 230 Cb 0.23 -3.31 -0.06 0.00 -0.02 0.00 0.00 41.12 37.96 2oux n ASP 230 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2oux s PHE 231 N -3.83 3.50 -0.10 1.24 0.08 -1.08 -4.96 117.98 112.83 2oux s PHE 231 Ca 0.07 1.04 0.14 0.00 0.12 0.00 0.00 56.93 58.31 2oux s PHE 231 Cb -0.04 -2.38 -0.05 0.00 -0.57 0.00 0.00 43.02 39.98 2oux s PHE 231 CO 0.87 0.30 1.19 -0.07 -0.10 0.00 0.00 175.22 177.41 2oux h LEU 232 N 2.91 0.00 -7.33 -0.37 3.38 -1.92 -3.42 115.31 108.55 2oux h LEU 232 Ca -0.48 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.49 2oux h LEU 232 Cb 1.18 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.83 2oux h LEU 232 CO 0.67 0.61 0.16 0.00 0.09 0.00 0.00 178.44 179.98 2oux s ALA 233 N -2.90 -1.37 -0.03 1.53 0.00 -1.26 -0.67 121.76 117.06 2oux s ALA 233 Ca 0.01 0.18 -0.01 0.00 0.00 0.00 0.00 51.96 52.14 2oux s ALA 233 Cb 0.08 0.86 0.02 0.00 0.00 0.00 0.00 23.12 24.09 2oux s ALA 233 CO 0.78 -0.82 0.06 0.54 0.00 0.00 0.00 175.76 176.32 2oux s VAL 234 N -3.81 -0.04 0.53 0.00 0.11 -0.48 -4.96 120.40 111.76 2oux s VAL 234 Ca 0.04 0.14 -0.18 0.00 -2.93 0.00 0.00 61.98 59.05 2oux s VAL 234 Cb -0.02 -0.11 -0.06 0.00 -1.53 0.00 0.00 36.38 34.66 2oux s VAL 234 CO -0.07 0.06 1.06 -2.16 -3.33 0.00 0.00 175.10 170.65 2oux s PRO 235 N 0.75 3.56 -0.06 1.54 0.04 -1.26 -0.95 135.00 138.62 2oux s PRO 235 Ca -0.06 1.33 0.05 0.00 0.04 0.00 0.00 61.00 62.35 2oux s PRO 235 Cb -0.08 -2.06 -0.00 0.00 0.04 0.00 0.00 34.50 32.39 2oux s PRO 235 CO -0.03 -0.63 -0.20 0.08 0.04 0.00 0.00 177.00 176.26 2oux s VAL 236 N -2.15 1.70 0.36 -0.36 1.01 0.97 -2.16 120.40 119.78 2oux s VAL 236 Ca 0.66 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.82 2oux s VAL 236 Cb -0.17 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.72 2oux s VAL 236 CO 0.27 0.48 0.14 0.42 0.00 0.00 0.00 175.10 176.41 2oux s THR 237 N 0.05 0.55 0.16 3.92 -4.23 -0.80 0.48 115.64 115.78 2oux s THR 237 Ca -0.06 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.47 2oux s THR 237 Cb -0.13 -2.46 0.03 0.00 1.34 0.00 0.00 72.50 71.27 2oux s THR 237 CO 0.04 0.00 0.22 -0.90 -0.54 0.00 0.00 174.62 173.43 2oux n ASP 238 N -1.12 0.67 0.26 3.99 5.68 -1.10 -0.96 116.55 123.97 2oux n ASP 238 Ca -0.02 -1.44 0.11 0.00 -0.50 0.00 0.00 54.79 52.93 2oux n ASP 238 Cb 0.65 -0.11 0.70 0.00 -1.14 0.00 0.00 41.12 41.22 2oux n ASP 238 CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 2oux h TYR 239 N 0.07 0.00 -0.31 2.11 3.20 -1.99 -1.75 116.97 118.30 2oux h TYR 239 Ca -0.08 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.79 2oux h TYR 239 Cb 0.35 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.62 2oux h TYR 239 CO 0.00 0.09 0.00 -0.25 -1.64 0.00 0.00 178.16 176.36 2oux n ASP 240 N -4.01 1.69 -0.70 -2.11 8.00 -1.26 -4.91 116.55 113.25 2oux n ASP 240 Ca -0.02 -1.99 -0.09 0.00 0.71 0.00 0.00 54.79 53.40 2oux n ASP 240 Cb 0.18 -0.21 -0.04 0.00 -0.02 0.00 0.00 41.12 41.03 2oux n ASP 240 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2oux n ASP 241 N 0.42 -4.06 -4.68 -2.24 8.00 -0.66 -4.93 116.55 108.40 2oux n ASP 241 Ca 0.11 0.22 -0.43 0.00 0.71 0.00 0.00 54.79 55.40 2oux n ASP 241 Cb 0.27 -2.38 -0.02 0.00 -0.02 0.00 0.00 41.12 38.96 2oux n ASP 241 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 2oux s HIS 242 N -2.34 3.33 -0.26 1.24 3.76 -1.26 -1.36 115.29 118.41 2oux s HIS 242 Ca 0.00 1.41 -0.29 0.00 -0.15 0.00 0.00 55.06 56.03 2oux s HIS 242 Cb 0.00 -3.30 -0.03 0.00 1.11 0.00 0.00 32.58 30.36 2oux s HIS 242 CO 0.00 -0.74 1.78 -1.17 -0.85 0.00 0.00 174.74 173.76 2oux s LEU 243 N 2.33 3.70 -0.05 0.89 2.96 -0.98 -2.72 118.68 124.80 2oux s LEU 243 Ca 0.51 1.56 0.19 0.00 -0.22 0.00 0.00 54.13 56.17 2oux s LEU 243 Cb -0.20 -3.53 -0.29 0.00 0.50 0.00 0.00 46.19 42.67 2oux s LEU 243 CO 0.18 -1.52 0.37 0.18 -1.32 0.00 0.00 176.35 174.24 2oux n LEU 244 N 9.55 0.00 0.00 -0.68 4.77 0.18 -4.99 117.00 125.83 2oux n LEU 244 Ca 0.22 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 2oux n LEU 244 Cb 0.46 0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2oux n LEU 244 CO 0.67 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.41 2oux n GLY 245 N 1.47 -1.09 2.94 -0.72 0.00 -1.10 -4.69 105.19 102.00 2oux n GLY 245 Ca -0.08 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.86 2oux n GLY 245 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2oux s ILE 246 N -3.00 0.08 -0.23 -0.61 -0.00 -0.15 -0.02 121.20 117.27 2oux s ILE 246 Ca 0.00 -0.61 -0.04 0.00 -0.00 0.00 0.00 60.65 60.00 2oux s ILE 246 Cb 0.00 -0.18 -0.01 0.00 -0.00 0.00 0.00 42.46 42.27 2oux s ILE 246 CO 0.00 -0.33 -0.03 -0.69 -0.00 0.00 0.00 174.94 173.89 2oux s VAL 247 N -0.97 3.48 0.21 8.37 1.01 -0.13 -0.94 120.40 131.43 2oux s VAL 247 Ca -0.11 -0.47 -0.04 0.00 0.00 0.00 0.00 61.98 61.36 2oux s VAL 247 Cb -0.07 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.66 2oux s VAL 247 CO -0.01 0.40 0.44 0.42 0.00 0.00 0.00 175.10 176.36 2oux s THR 248 N 1.49 5.12 0.31 3.92 -4.23 -1.26 -1.38 115.64 119.61 2oux s THR 248 Ca 0.06 -0.05 0.02 0.00 -1.18 0.00 0.00 61.69 60.53 2oux s THR 248 Cb -0.14 -3.69 0.28 0.00 1.34 0.00 0.00 72.50 70.29 2oux s THR 248 CO -0.02 -0.14 1.91 1.62 -0.54 0.00 0.00 174.62 177.45 2oux h VAL 249 N 1.69 1.05 -0.39 2.29 3.04 -1.15 -1.95 116.25 120.82 2oux h VAL 249 Ca -0.47 -0.34 -0.01 0.00 -1.01 0.00 0.00 66.70 64.87 2oux h VAL 249 Cb 1.18 -0.02 -0.02 0.00 -2.01 0.00 0.00 31.29 30.42 2oux h VAL 249 CO 0.69 0.18 0.21 -2.24 -1.01 0.00 0.00 177.57 175.40 2oux h ASP 250 N 0.99 0.46 0.68 3.17 2.03 -1.95 -1.67 116.42 120.13 2oux h ASP 250 Ca 0.39 -0.03 -0.26 0.00 -0.73 0.00 0.00 57.03 56.40 2oux h ASP 250 Cb 0.23 -0.12 -0.01 0.00 -0.83 0.00 0.00 39.33 38.60 2oux h ASP 250 CO -0.15 0.38 -1.29 0.44 -1.03 0.00 0.00 179.24 177.59 2oux h ASP 251 N 0.53 0.24 0.13 4.15 3.32 -1.79 -3.23 116.42 119.78 2oux h ASP 251 Ca 0.14 -0.30 -0.03 0.00 0.02 0.00 0.00 57.03 56.86 2oux h ASP 251 Cb 0.02 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.48 2oux h ASP 251 CO -0.02 1.24 -0.14 0.40 -1.72 0.00 0.00 179.24 179.00 2oux h ILE 252 N 0.04 1.11 -0.65 0.35 1.08 -0.79 -1.57 117.51 117.08 2oux h ILE 252 Ca -0.14 -0.51 -0.07 0.00 -0.39 0.00 0.00 64.86 63.75 2oux h ILE 252 Cb 1.93 1.26 -0.03 0.00 -3.07 0.00 0.00 36.82 36.91 2oux h ILE 252 CO 0.16 0.15 0.12 0.40 -0.69 0.00 0.00 178.15 178.29 2oux h ILE 253 N 0.02 1.26 -0.60 -0.67 2.04 -1.34 0.70 117.51 118.92 2oux h ILE 253 Ca 0.00 -1.00 -0.09 0.00 1.00 0.00 0.00 64.86 64.78 2oux h ILE 253 Cb 0.26 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 2oux h ILE 253 CO 0.02 0.38 0.02 0.44 0.00 0.00 0.00 178.15 179.01 2oux h ASP 254 N 1.00 1.01 -0.27 1.72 3.32 -1.38 -0.10 116.42 121.73 2oux h ASP 254 Ca 0.20 -0.27 0.01 0.00 0.02 0.00 0.00 57.03 56.99 2oux h ASP 254 Cb 0.41 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 2oux h ASP 254 CO 0.01 1.05 0.16 0.58 -1.72 0.00 0.00 179.24 179.32 2oux h VAL 255 N 0.96 1.04 -0.63 -1.35 2.07 -0.80 -0.05 116.25 117.49 2oux h VAL 255 Ca 0.18 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 2oux h VAL 255 Cb 0.52 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 2oux h VAL 255 CO 0.03 0.06 0.34 0.40 0.02 0.00 0.00 177.57 178.41 2oux h ILE 256 N 0.33 1.21 -0.31 4.57 1.08 -0.58 0.25 117.51 124.07 2oux h ILE 256 Ca 0.10 -0.53 0.03 0.00 -0.39 0.00 0.00 64.86 64.07 2oux h ILE 256 Cb -0.01 0.40 -0.03 0.00 -3.07 0.00 0.00 36.82 34.11 2oux h ILE 256 CO -0.04 0.23 0.13 0.44 -0.69 0.00 0.00 178.15 178.22 2oux h ASP 257 N 0.87 0.18 0.46 1.72 3.32 -0.59 -1.99 116.42 120.40 2oux h ASP 257 Ca 0.22 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.28 2oux h ASP 257 Cb 0.06 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 2oux h ASP 257 CO -0.03 0.14 -0.30 0.44 -1.72 0.00 0.00 179.24 177.77 2oux h ASP 258 N 0.29 -0.75 -0.91 6.45 5.19 -0.23 -2.71 116.42 123.75 2oux h ASP 258 Ca 0.13 0.05 0.21 0.00 -0.62 0.00 0.00 57.03 56.80 2oux h ASP 258 Cb 0.07 0.23 -0.07 0.00 0.18 0.00 0.00 39.33 39.74 2oux h ASP 258 CO -0.11 -0.46 0.61 -0.33 -3.12 0.00 0.00 179.24 175.83 2oux h GLU 259 N -0.73 0.35 0.00 3.56 4.39 -0.34 -3.38 114.58 118.42 2oux h GLU 259 Ca -0.05 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.63 2oux h GLU 259 Cb 0.60 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 2oux h GLU 259 CO 0.04 0.23 0.00 0.00 -1.16 0.00 0.00 179.01 178.12 2oux n ALA 260 N -2.54 0.00 0.00 3.43 0.00 -0.76 -5.10 120.51 115.54 2oux n ALA 260 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2oux n ALA 260 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.19 2oux n ALA 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50