#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oo3 n ALA 10 N 0.00 2.74 -0.98 -1.41 0.00 -1.26 -1.94 120.51 117.66 2oo3 n ALA 10 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.84 2oo3 n ALA 10 Cb 0.00 -2.51 0.00 0.00 0.00 0.00 0.00 19.45 16.94 2oo3 n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oo3 n GLY 11 N 3.93 0.49 3.54 0.00 0.00 -1.26 -3.86 105.19 108.04 2oo3 n GLY 11 Ca 0.16 -0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2oo3 n GLY 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oo3 s ASN 12 N -2.15 0.64 0.46 1.61 4.22 -0.82 -0.70 114.94 118.20 2oo3 s ASN 12 Ca 0.00 0.74 0.13 0.00 -2.14 0.00 0.00 52.86 51.59 2oo3 s ASN 12 Cb 0.00 -1.05 1.06 0.00 1.28 0.00 0.00 41.25 42.54 2oo3 s ASN 12 CO 0.00 -4.31 2.05 2.19 -2.04 0.00 0.00 177.10 174.99 2oo3 h PHE 13 N -2.71 0.31 -0.28 1.54 -5.15 -1.84 -1.88 116.94 106.94 2oo3 h PHE 13 Ca -0.46 0.01 -0.13 0.00 -0.20 0.00 0.00 57.97 57.19 2oo3 h PHE 13 Cb 1.31 -0.10 -0.00 0.00 0.22 0.00 0.00 35.95 37.37 2oo3 h PHE 13 CO -2.10 0.18 -0.33 0.00 -2.00 0.00 0.00 178.31 174.05 2oo3 h ALA 14 N 1.79 0.42 -0.75 12.09 0.00 -1.95 -2.31 119.26 128.55 2oo3 h ALA 14 Ca 0.16 -0.42 0.08 0.00 0.00 0.00 0.00 54.91 54.73 2oo3 h ALA 14 Cb 0.24 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.88 2oo3 h ALA 14 CO -0.04 0.47 0.41 -0.44 0.00 0.00 0.00 179.25 179.66 2oo3 h ASP 15 N 0.46 0.59 0.34 0.00 5.19 -1.72 -0.77 116.42 120.51 2oo3 h ASP 15 Ca 0.04 0.05 -0.02 0.00 -0.62 0.00 0.00 57.03 56.48 2oo3 h ASP 15 Cb 0.92 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.36 2oo3 h ASP 15 CO 0.08 0.35 -0.17 0.58 -3.12 0.00 0.00 179.24 176.96 2oo3 h VAL 16 N 0.72 0.67 -0.54 -1.35 2.07 -1.04 0.55 116.25 117.33 2oo3 h VAL 16 Ca 0.36 -0.06 -0.11 0.00 0.82 0.00 0.00 66.70 67.71 2oo3 h VAL 16 Cb 0.31 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2oo3 h VAL 16 CO -0.23 0.01 -0.08 -0.29 0.02 0.00 0.00 177.57 177.00 2oo3 h ILE 17 N -0.49 1.27 -0.59 4.57 6.09 -1.36 -1.36 117.51 125.63 2oo3 h ILE 17 Ca -0.05 -1.22 -0.02 0.00 -1.37 0.00 0.00 64.86 62.21 2oo3 h ILE 17 Cb 0.38 0.93 -0.03 0.00 0.47 0.00 0.00 36.82 38.57 2oo3 h ILE 17 CO 0.08 0.43 0.29 0.50 -3.07 0.00 0.00 178.15 176.38 2oo3 h LYS 18 N 0.89 0.84 0.02 2.19 3.64 -1.02 -1.59 116.57 121.54 2oo3 h LYS 18 Ca 0.15 -0.12 -0.22 0.00 -1.27 0.00 0.00 60.65 59.19 2oo3 h LYS 18 Cb 0.63 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 2oo3 h LYS 18 CO 0.04 0.67 -0.96 0.45 -2.27 0.00 0.00 179.45 177.39 2oo3 h HIS 19 N 0.80 0.48 -0.46 1.91 3.86 -0.73 -0.44 115.15 120.57 2oo3 h HIS 19 Ca 0.20 -0.27 -0.05 0.00 -1.16 0.00 0.00 60.37 59.10 2oo3 h HIS 19 Cb 0.10 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.50 2oo3 h HIS 19 CO -0.00 1.10 0.11 0.82 0.86 0.00 0.00 177.93 180.82 2oo3 h ILE 20 N 0.16 1.24 -0.18 2.45 2.04 -1.24 -0.64 117.51 121.33 2oo3 h ILE 20 Ca -0.07 -0.84 0.05 0.00 1.00 0.00 0.00 64.86 65.00 2oo3 h ILE 20 Cb 1.60 0.90 -0.06 0.00 -0.74 0.00 0.00 36.82 38.53 2oo3 h ILE 20 CO 0.16 0.30 -0.18 0.74 0.00 0.00 0.00 178.15 179.16 2oo3 h THR 21 N 0.62 0.52 -0.47 -0.27 2.02 -1.17 -1.38 112.91 112.78 2oo3 h THR 21 Ca 0.14 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.41 2oo3 h THR 21 Cb 0.33 0.52 -0.08 0.00 -1.74 0.00 0.00 68.15 67.18 2oo3 h THR 21 CO 0.00 0.00 -0.01 0.25 0.37 0.00 0.00 175.52 176.13 2oo3 h LEU 22 N -0.20 -0.23 -1.49 2.58 5.85 -0.85 -1.58 115.31 119.40 2oo3 h LEU 22 Ca 0.12 0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.97 2oo3 h LEU 22 Cb 0.38 0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 2oo3 h LEU 22 CO -0.30 -0.08 0.36 0.71 -0.34 0.00 0.00 178.44 178.79 2oo3 h THR 23 N 0.10 1.11 -0.08 1.05 1.35 -0.35 -0.39 112.91 115.69 2oo3 h THR 23 Ca 0.23 -0.24 -0.21 0.00 -0.55 0.00 0.00 66.41 65.65 2oo3 h THR 23 Cb 0.35 0.35 0.00 0.00 -1.73 0.00 0.00 68.15 67.12 2oo3 h THR 23 CO -0.40 0.13 -0.80 0.03 -0.25 0.00 0.00 175.52 174.23 2oo3 h ARG 24 N 0.69 0.55 -0.44 4.72 2.47 -0.72 -0.71 114.38 120.95 2oo3 h ARG 24 Ca 0.21 -0.48 -0.06 0.00 -1.26 0.00 0.00 59.98 58.39 2oo3 h ARG 24 Cb -0.01 0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 28.40 2oo3 h ARG 24 CO -0.05 1.11 0.03 -0.07 0.56 0.00 0.00 179.97 181.55 2oo3 h LEU 25 N 0.36 0.74 -0.42 3.04 3.38 -0.59 -1.68 115.31 120.13 2oo3 h LEU 25 Ca -0.05 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 2oo3 h LEU 25 Cb 1.41 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 2oo3 h LEU 25 CO 0.15 0.84 0.07 -0.07 0.09 0.00 0.00 178.44 179.52 2oo3 h LEU 26 N 0.61 0.67 -1.26 1.67 3.38 -1.01 -1.70 115.31 117.67 2oo3 h LEU 26 Ca 0.13 -0.26 0.06 0.00 0.09 0.00 0.00 57.88 57.90 2oo3 h LEU 26 Cb 0.44 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 2oo3 h LEU 26 CO 0.02 0.75 0.53 0.00 0.09 0.00 0.00 178.44 179.83 2oo3 h ALA 27 N 0.94 1.59 -0.01 1.53 0.00 -1.02 -1.86 119.26 120.42 2oo3 h ALA 27 Ca 0.13 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2oo3 h ALA 27 Cb 0.37 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2oo3 h ALA 27 CO 0.01 0.29 -0.06 -0.92 0.00 0.00 0.00 179.25 178.57 2oo3 h TYR 28 N 0.91 0.08 -0.13 0.00 3.20 -0.99 -3.35 116.97 116.69 2oo3 h TYR 28 Ca 0.35 -0.04 -0.10 0.00 3.14 0.00 0.00 58.73 62.08 2oo3 h TYR 28 Cb 0.20 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 2oo3 h TYR 28 CO -0.00 0.75 -0.35 -0.07 -1.64 0.00 0.00 178.16 176.85 2oo3 h LEU 29 N -0.61 0.27 0.00 2.82 3.38 -1.15 -1.70 115.31 118.32 2oo3 h LEU 29 Ca -0.01 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2oo3 h LEU 29 Cb 0.76 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2oo3 h LEU 29 CO 0.01 0.62 0.00 0.35 0.09 0.00 0.00 178.44 179.51 2oo3 n THR 30 N -4.07 0.00 0.19 0.22 -2.24 -0.72 -2.66 114.28 105.01 2oo3 n THR 30 Ca -0.01 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.80 2oo3 n THR 30 Cb 0.44 -0.64 0.39 0.00 -2.10 0.00 0.00 70.33 68.42 2oo3 n THR 30 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2oo3 h HIS 31 N 0.00 0.00 -3.36 4.78 3.86 -1.44 -3.42 115.15 115.58 2oo3 h HIS 31 Ca 0.00 -0.00 -0.57 0.00 -1.16 0.00 0.00 60.37 58.64 2oo3 h HIS 31 Cb 0.00 -0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.41 2oo3 h HIS 31 CO 0.00 0.33 0.20 0.21 0.86 0.00 0.00 177.93 179.53 2oo3 s LYS 32 N -4.30 4.36 -1.30 2.45 2.20 -1.09 -4.96 119.74 117.10 2oo3 s LYS 32 Ca -0.03 0.90 -0.07 0.00 -0.36 0.00 0.00 55.97 56.41 2oo3 s LYS 32 Cb 0.15 -3.51 0.01 0.00 -1.51 0.00 0.00 37.83 32.96 2oo3 s LYS 32 CO 0.72 -0.11 2.73 -3.47 -0.36 0.00 0.00 175.35 174.86 2oo3 n ASP 33 N 4.45 8.07 -3.95 1.43 2.03 -1.26 -4.78 116.55 122.54 2oo3 n ASP 33 Ca 0.01 -2.87 -0.11 0.00 0.52 0.00 0.00 54.79 52.34 2oo3 n ASP 33 Cb 0.50 -1.44 -0.12 0.00 -0.72 0.00 0.00 41.12 39.34 2oo3 n ASP 33 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2oo3 s LYS 34 N 0.30 0.23 0.56 -0.67 -0.14 -1.26 -5.14 119.74 113.61 2oo3 s LYS 34 Ca 0.62 -0.39 -0.21 0.00 -1.36 0.00 0.00 55.97 54.63 2oo3 s LYS 34 Cb 0.21 0.01 -0.05 0.00 -1.68 0.00 0.00 37.83 36.31 2oo3 s LYS 34 CO -0.08 -0.01 1.23 -0.35 -0.76 0.00 0.00 175.35 175.38 2oo3 n PRO 35 N 2.17 1.43 -5.12 -1.68 -0.04 -1.26 -5.00 135.00 125.50 2oo3 n PRO 35 Ca -0.19 0.53 -0.32 0.00 -0.04 0.00 0.00 63.50 63.48 2oo3 n PRO 35 Cb 0.57 -2.43 -0.16 0.00 -0.04 0.00 0.00 33.50 31.44 2oo3 n PRO 35 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2oo3 s LEU 36 N -2.93 2.29 -0.13 1.53 2.96 -1.26 -4.60 118.68 116.53 2oo3 s LEU 36 Ca 0.73 -0.43 -0.23 0.00 -0.22 0.00 0.00 54.13 53.97 2oo3 s LEU 36 Cb -0.43 -1.45 -0.03 0.00 0.50 0.00 0.00 46.19 44.79 2oo3 s LEU 36 CO 0.49 0.24 0.73 0.12 -1.32 0.00 0.00 176.35 176.61 2oo3 s PHE 37 N -0.12 3.47 -0.22 5.38 5.36 -0.12 -0.68 117.98 131.05 2oo3 s PHE 37 Ca -0.04 1.18 -0.01 0.00 -0.96 0.00 0.00 56.93 57.10 2oo3 s PHE 37 Cb -0.14 -2.88 0.02 0.00 -0.34 0.00 0.00 43.02 39.68 2oo3 s PHE 37 CO 0.04 -0.09 -0.10 -0.47 -1.46 0.00 0.00 175.22 173.14 2oo3 s TYR 38 N 1.53 2.97 -0.17 10.12 5.04 0.93 -0.83 117.35 136.94 2oo3 s TYR 38 Ca 0.36 -1.44 0.00 0.00 -2.44 0.00 0.00 57.07 53.55 2oo3 s TYR 38 Cb -0.17 -2.03 0.01 0.00 0.35 0.00 0.00 41.96 40.12 2oo3 s TYR 38 CO 0.14 -0.71 -0.16 -1.17 -1.34 0.00 0.00 175.55 172.31 2oo3 s LEU 39 N 1.35 2.36 -0.17 6.97 2.96 -0.14 -0.19 118.68 131.82 2oo3 s LEU 39 Ca 0.03 -0.54 -0.04 0.00 -0.22 0.00 0.00 54.13 53.36 2oo3 s LEU 39 Cb -0.15 -1.54 -0.03 0.00 0.50 0.00 0.00 46.19 44.97 2oo3 s LEU 39 CO -0.07 0.05 -0.03 -1.61 -1.32 0.00 0.00 176.35 173.37 2oo3 s GLU 40 N 1.04 3.66 0.13 1.98 2.02 -0.42 -0.62 118.70 126.49 2oo3 s GLU 40 Ca -0.01 -0.52 0.11 0.00 0.02 0.00 0.00 54.97 54.58 2oo3 s GLU 40 Cb -0.15 -2.96 -0.13 0.00 0.10 0.00 0.00 34.13 31.00 2oo3 s GLU 40 CO -0.05 0.19 1.16 1.79 0.02 0.00 0.00 175.26 178.37 2oo3 h THR 41 N 5.19 1.18 -2.45 3.63 1.35 -1.80 -1.91 112.91 118.10 2oo3 h THR 41 Ca -0.32 -2.79 -0.59 0.00 -0.55 0.00 0.00 66.41 62.15 2oo3 h THR 41 Cb 1.19 2.55 -0.39 0.00 -1.73 0.00 0.00 68.15 69.77 2oo3 h THR 41 CO 0.63 0.67 -0.92 1.41 -0.25 0.00 0.00 175.52 177.05 2oo3 n HIS 42 N -3.20 -0.28 0.21 4.73 8.25 -1.24 -3.53 115.22 120.16 2oo3 n HIS 42 Ca -0.04 -3.46 0.10 0.00 -0.26 0.00 0.00 57.72 54.06 2oo3 n HIS 42 Cb 0.89 0.11 0.28 0.00 1.12 0.00 0.00 29.99 32.39 2oo3 n HIS 42 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2oo3 h SER 43 N 5.51 0.00 0.00 0.41 0.02 -0.89 -3.43 113.55 115.17 2oo3 h SER 43 Ca 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 2oo3 h SER 43 Cb 0.88 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.42 2oo3 h SER 43 CO 0.43 0.18 0.00 0.61 -1.14 0.00 0.00 176.83 176.91 2oo3 n GLY 44 N 0.74 0.63 0.03 -3.77 0.00 -1.26 -3.84 105.19 97.72 2oo3 n GLY 44 Ca 0.02 -0.78 0.12 0.00 0.00 0.00 0.00 46.02 45.37 2oo3 n GLY 44 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2oo3 n ARG 45 N 0.00 0.09 0.00 1.61 1.85 -1.26 -4.55 116.66 114.39 2oo3 n ARG 45 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 57.85 56.79 2oo3 n ARG 45 Cb 0.00 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 29.91 2oo3 n ARG 45 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2oo3 n GLY 46 N 1.49 2.72 2.97 2.89 0.00 -1.25 -3.25 105.19 110.76 2oo3 n GLY 46 Ca 0.06 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.55 2oo3 n GLY 46 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2oo3 s ILE 47 N -1.31 0.12 -0.11 -0.61 -4.36 -1.26 -0.02 121.20 113.64 2oo3 s ILE 47 Ca 0.00 -0.82 -0.00 0.00 -0.26 0.00 0.00 60.65 59.57 2oo3 s ILE 47 Cb 0.00 -0.25 0.02 0.00 1.25 0.00 0.00 42.46 43.49 2oo3 s ILE 47 CO 0.00 -0.44 -0.08 -0.31 0.24 0.00 0.00 174.94 174.35 2oo3 s TYR 48 N -1.30 1.49 -0.39 1.37 2.02 0.16 -4.87 117.35 115.83 2oo3 s TYR 48 Ca -0.14 -0.72 -0.26 0.00 -0.37 0.00 0.00 57.07 55.57 2oo3 s TYR 48 Cb -0.09 -1.22 0.02 0.00 -0.40 0.00 0.00 41.96 40.27 2oo3 s TYR 48 CO -0.01 -0.49 0.97 0.34 -1.57 0.00 0.00 175.55 174.79 2oo3 s ASP 49 N 1.57 6.67 0.00 2.29 -1.08 -1.26 -0.48 116.67 124.38 2oo3 s ASP 49 Ca 0.03 0.54 0.29 0.00 -0.52 0.00 0.00 52.55 52.89 2oo3 s ASP 49 Cb -0.13 -2.48 1.39 0.00 -1.46 0.00 0.00 42.92 40.24 2oo3 s ASP 49 CO -0.07 -0.94 1.99 0.18 0.52 0.00 0.00 175.17 176.85 2oo3 n LEU 50 N 6.99 0.00 -0.61 -1.34 4.77 0.08 -3.67 117.00 123.22 2oo3 n LEU 50 Ca 0.08 0.37 0.06 0.00 -0.03 0.00 0.00 56.01 56.49 2oo3 n LEU 50 Cb 0.48 -0.37 0.12 0.00 -2.33 0.00 0.00 43.42 41.32 2oo3 n LEU 50 CO 0.61 -0.01 0.56 0.29 -1.33 0.00 0.00 177.39 177.51 2oo3 n LYS 51 N -1.37 1.97 -1.66 3.23 5.02 -1.25 -5.02 118.16 119.09 2oo3 n LYS 51 Ca 0.11 -1.74 -0.30 0.00 -2.02 0.00 0.00 58.31 54.37 2oo3 n LYS 51 Cb 0.27 -1.27 0.18 0.00 -0.02 0.00 0.00 35.03 34.19 2oo3 n LYS 51 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 2oo3 s ASP 52 N -1.01 2.81 -0.52 4.39 1.47 -1.24 -5.24 116.67 117.34 2oo3 s ASP 52 Ca 0.21 0.53 -0.18 0.00 1.18 0.00 0.00 52.55 54.29 2oo3 s ASP 52 Cb 0.12 -0.76 0.07 0.00 -0.34 0.00 0.00 42.92 42.01 2oo3 s ASP 52 CO 0.16 -2.95 0.59 -0.54 0.68 0.00 0.00 175.17 173.11 2oo3 s LYS 53 N -5.64 3.07 0.19 2.11 1.02 -1.26 -5.15 119.74 114.08 2oo3 s LYS 53 Ca 0.70 -1.12 -0.31 0.00 0.02 0.00 0.00 55.97 55.26 2oo3 s LYS 53 Cb -0.08 -4.15 -0.09 0.00 -0.52 0.00 0.00 37.83 32.99 2oo3 s LYS 53 CO 0.53 -1.25 1.40 -0.08 -0.92 0.00 0.00 175.35 175.03 2oo3 s THR 58 N 2.38 3.01 -1.47 2.17 -1.32 -1.26 -5.21 115.64 113.94 2oo3 s THR 58 Ca 0.11 0.79 -0.10 0.00 -1.21 0.00 0.00 61.69 61.28 2oo3 s THR 58 Cb -0.22 -3.51 0.03 0.00 -1.51 0.00 0.00 72.50 67.29 2oo3 s THR 58 CO 0.09 0.10 2.48 -0.62 -2.21 0.00 0.00 174.62 174.46 2oo3 n GLU 59 N 3.05 3.59 0.27 7.08 1.02 -1.26 -4.69 120.64 129.70 2oo3 n GLU 59 Ca 0.09 -2.74 0.13 0.00 -0.02 0.00 0.00 57.16 54.62 2oo3 n GLU 59 Cb 0.41 -2.94 0.77 0.00 -0.02 0.00 0.00 31.44 29.67 2oo3 n GLU 59 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2oo3 h GLU 60 N 5.35 0.00 -0.06 3.49 5.08 -1.92 -2.24 114.58 124.28 2oo3 h GLU 60 Ca 0.68 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 59.06 2oo3 h GLU 60 Cb 0.45 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 2oo3 h GLU 60 CO 1.74 0.09 0.05 0.10 -1.00 0.00 0.00 179.01 179.99 2oo3 h TYR 61 N 0.00 0.00 -0.23 4.33 -0.00 -1.75 -2.00 116.97 117.33 2oo3 h TYR 61 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 58.73 58.80 2oo3 h TYR 61 Cb 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.98 2oo3 h TYR 61 CO 0.00 0.00 0.32 0.87 -0.00 0.00 0.00 178.16 179.35 2oo3 h LYS 62 N 0.00 0.00 -0.22 0.10 1.57 -1.70 -0.21 116.57 116.10 2oo3 h LYS 62 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2oo3 h LYS 62 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 2oo3 h LYS 62 CO -0.00 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.27 2oo3 n GLU 63 N -3.53 2.02 0.00 3.15 1.02 -0.76 -4.16 120.64 118.39 2oo3 n GLU 63 Ca 0.03 -1.72 0.00 0.00 -0.02 0.00 0.00 57.16 55.45 2oo3 n GLU 63 Cb 0.45 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 30.62 2oo3 n GLU 63 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2oo3 n GLY 64 N 0.55 0.96 0.36 0.62 0.00 -0.63 -4.43 105.19 102.62 2oo3 n GLY 64 Ca 0.10 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.17 2oo3 n GLY 64 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2oo3 h ILE 65 N 0.00 1.05 -0.27 -0.61 6.09 -0.78 -3.32 117.51 119.66 2oo3 h ILE 65 Ca 0.00 -0.30 0.03 0.00 -1.37 0.00 0.00 64.86 63.21 2oo3 h ILE 65 Cb 0.00 0.08 -0.03 0.00 0.47 0.00 0.00 36.82 37.35 2oo3 h ILE 65 CO 0.00 0.16 0.09 -1.13 -3.07 0.00 0.00 178.15 174.20 2oo3 h ASN 66 N 0.88 0.11 -0.12 2.19 -1.24 -1.30 0.31 115.58 116.41 2oo3 h ASN 66 Ca 0.35 0.03 -0.03 0.00 0.71 0.00 0.00 56.30 57.36 2oo3 h ASN 66 Cb 0.22 0.02 -0.01 0.00 0.73 0.00 0.00 38.32 39.28 2oo3 h ASN 66 CO -0.12 0.09 0.01 -0.65 -1.29 0.00 0.00 177.43 175.47 2oo3 h PRO 67 N 0.22 0.30 -0.08 6.67 0.11 -1.72 0.54 132.00 138.03 2oo3 h PRO 67 Ca 0.12 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.12 2oo3 h PRO 67 Cb 0.08 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.14 2oo3 h PRO 67 CO -0.12 0.32 -0.19 0.28 -0.21 0.00 0.00 178.00 178.09 2oo3 h VAL 68 N 0.30 1.41 -0.20 3.15 2.07 -1.45 -2.62 116.25 118.91 2oo3 h VAL 68 Ca 0.07 -1.50 -0.01 0.00 0.82 0.00 0.00 66.70 66.08 2oo3 h VAL 68 Cb 0.19 2.19 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 2oo3 h VAL 68 CO 0.00 0.43 0.09 -0.25 0.02 0.00 0.00 177.57 177.86 2oo3 h TRP 69 N -0.20 0.30 -0.67 1.57 2.91 -0.23 -2.45 115.95 117.17 2oo3 h TRP 69 Ca 0.00 -0.02 0.05 0.00 1.13 0.00 0.00 58.89 60.05 2oo3 h TRP 69 Cb 0.78 -0.09 -0.04 0.00 -0.51 0.00 0.00 29.16 29.30 2oo3 h TRP 69 CO 0.11 0.32 0.44 -0.07 -1.03 0.00 0.00 178.44 178.21 2oo3 h LEU 70 N 0.19 0.65 -3.36 0.65 3.38 -0.93 -2.24 115.31 113.65 2oo3 h LEU 70 Ca 0.07 -0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.88 2oo3 h LEU 70 Cb 0.14 -0.15 -0.09 0.00 0.09 0.00 0.00 40.66 40.65 2oo3 h LEU 70 CO -0.01 0.44 0.20 -0.67 0.09 0.00 0.00 178.44 178.49 2oo3 n ASP 71 N -4.47 4.54 0.26 -0.43 2.03 -0.99 -4.72 116.55 112.78 2oo3 n ASP 71 Ca 0.09 -3.00 0.09 0.00 0.52 0.00 0.00 54.79 52.49 2oo3 n ASP 71 Cb 0.17 -0.71 0.68 0.00 -0.72 0.00 0.00 41.12 40.54 2oo3 n ASP 71 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 2oo3 h ARG 72 N 2.49 0.00 0.00 -0.67 0.11 -0.93 -0.49 114.38 114.89 2oo3 h ARG 72 Ca 0.19 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.27 2oo3 h ARG 72 Cb 2.06 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.14 2oo3 h ARG 72 CO 0.61 0.01 0.00 0.39 0.10 0.00 0.00 179.97 181.08 2oo3 n GLU 73 N -4.41 0.13 -0.22 0.08 -0.58 -1.26 -2.35 120.64 112.03 2oo3 n GLU 73 Ca -0.03 0.12 0.07 0.00 -0.42 0.00 0.00 57.16 56.90 2oo3 n GLU 73 Cb 0.10 -1.50 0.19 0.00 -0.57 0.00 0.00 31.44 29.66 2oo3 n GLU 73 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2oo3 n ASN 74 N -1.41 3.15 -4.85 1.62 3.02 -0.19 -5.02 115.26 111.58 2oo3 n ASN 74 Ca 0.07 -1.99 -0.33 0.00 -0.03 0.00 0.00 54.58 52.31 2oo3 n ASN 74 Cb 0.21 -0.29 -0.06 0.00 -0.61 0.00 0.00 39.78 39.04 2oo3 n ASN 74 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2oo3 s LEU 75 N -1.01 4.12 0.67 3.41 1.43 -0.99 -5.04 118.68 121.27 2oo3 s LEU 75 Ca 0.29 1.19 -0.17 0.00 -1.03 0.00 0.00 54.13 54.41 2oo3 s LEU 75 Cb 0.15 -3.91 0.00 0.00 0.03 0.00 0.00 46.19 42.47 2oo3 s LEU 75 CO 0.20 -0.14 1.26 -2.84 0.23 0.00 0.00 176.35 175.06 2oo3 s PRO 76 N -2.82 2.44 0.65 1.29 0.02 -1.26 -4.89 135.00 130.42 2oo3 s PRO 76 Ca 0.51 1.95 0.36 0.00 0.02 0.00 0.00 61.00 63.84 2oo3 s PRO 76 Cb -0.11 -1.85 2.00 0.00 0.02 0.00 0.00 34.50 34.57 2oo3 s PRO 76 CO 0.19 -1.65 2.18 0.66 -0.33 0.00 0.00 177.00 178.04 2oo3 h SER 77 N 0.29 0.00 0.00 2.53 4.64 -1.99 -1.51 113.55 117.51 2oo3 h SER 77 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 2oo3 h SER 77 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 2oo3 h SER 77 CO 0.52 0.00 0.12 -0.07 -0.87 0.00 0.00 176.83 176.53 2oo3 h LEU 78 N 0.00 0.00 -0.23 5.97 3.38 -1.99 -1.85 115.31 120.59 2oo3 h LEU 78 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2oo3 h LEU 78 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2oo3 h LEU 78 CO -0.00 0.00 -0.27 0.49 0.09 0.00 0.00 178.44 178.75 2oo3 n PHE 79 N -2.86 0.00 -0.08 1.13 3.72 -0.57 -4.54 117.46 114.26 2oo3 n PHE 79 Ca -0.02 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.31 2oo3 n PHE 79 Cb 0.18 -0.21 -0.00 0.00 -0.94 0.00 0.00 39.48 38.51 2oo3 n PHE 79 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2oo3 h LEU 80 N 0.56 -0.13 -0.50 4.37 3.38 -1.51 -0.83 115.31 120.64 2oo3 h LEU 80 Ca 0.00 0.07 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 2oo3 h LEU 80 Cb 0.47 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 2oo3 h LEU 80 CO 0.00 -0.03 -0.10 -0.33 0.09 0.00 0.00 178.44 178.06 2oo3 h GLU 81 N 0.08 0.96 0.53 1.13 3.07 -1.82 -0.79 114.58 117.75 2oo3 h GLU 81 Ca 0.14 -0.36 -0.02 0.00 -0.50 0.00 0.00 59.36 58.62 2oo3 h GLU 81 Cb 0.19 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.05 2oo3 h GLU 81 CO -0.25 1.03 -0.29 -0.92 -1.40 0.00 0.00 179.01 177.19 2oo3 h TYR 82 N 0.82 -0.74 -0.83 4.33 3.20 -1.78 -2.67 116.97 119.30 2oo3 h TYR 82 Ca 0.13 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.06 2oo3 h TYR 82 Cb 0.66 0.25 -0.06 0.00 1.54 0.00 0.00 36.73 39.12 2oo3 h TYR 82 CO 0.05 -0.45 0.50 0.82 -1.64 0.00 0.00 178.16 177.43 2oo3 h ILE 83 N -0.76 0.99 -0.57 1.81 1.08 -1.07 -2.84 117.51 116.15 2oo3 h ILE 83 Ca -0.07 -0.30 -0.03 0.00 -0.39 0.00 0.00 64.86 64.07 2oo3 h ILE 83 Cb 0.60 0.03 -0.03 0.00 -3.07 0.00 0.00 36.82 34.35 2oo3 h ILE 83 CO 0.10 0.16 0.25 0.77 -0.69 0.00 0.00 178.15 178.74 2oo3 h SER 84 N 0.88 0.74 -0.48 1.72 4.64 -0.93 0.66 113.55 120.78 2oo3 h SER 84 Ca 0.37 -0.08 -0.11 0.00 -0.47 0.00 0.00 61.79 61.50 2oo3 h SER 84 Cb 0.23 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 2oo3 h SER 84 CO -0.20 0.65 -0.14 0.58 -0.87 0.00 0.00 176.83 176.86 2oo3 h VAL 85 N 0.81 1.27 -0.59 0.95 2.07 -1.25 -0.96 116.25 118.55 2oo3 h VAL 85 Ca 0.20 -1.28 -0.08 0.00 0.82 0.00 0.00 66.70 66.35 2oo3 h VAL 85 Cb 0.13 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2oo3 h VAL 85 CO -0.02 0.44 0.05 0.40 0.02 0.00 0.00 177.57 178.46 2oo3 h ILE 86 N 0.80 1.26 -0.48 4.57 2.04 -1.24 -1.57 117.51 122.89 2oo3 h ILE 86 Ca 0.12 -1.06 0.02 0.00 1.00 0.00 0.00 64.86 64.94 2oo3 h ILE 86 Cb 0.70 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 2oo3 h ILE 86 CO 0.05 0.39 0.29 0.50 0.00 0.00 0.00 178.15 179.38 2oo3 h LYS 87 N 0.93 0.57 -0.27 2.37 3.64 -0.73 -3.03 116.57 120.04 2oo3 h LYS 87 Ca 0.18 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 2oo3 h LYS 87 Cb 0.47 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2oo3 h LYS 87 CO 0.02 0.38 0.09 0.37 -2.27 0.00 0.00 179.45 178.04 2oo3 h GLN 88 N 0.59 0.42 0.00 1.90 4.15 -0.68 -2.96 115.11 118.52 2oo3 h GLN 88 Ca 0.19 -0.09 -0.07 0.00 0.77 0.00 0.00 58.65 59.45 2oo3 h GLN 88 Cb -0.01 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.61 2oo3 h GLN 88 CO -0.07 0.48 -0.31 0.97 -1.93 0.00 0.00 178.83 177.96 2oo3 h ILE 89 N 0.28 0.98 -2.99 2.39 2.10 -1.31 -3.44 117.51 115.52 2oo3 h ILE 89 Ca 0.09 -1.18 -0.62 0.00 1.08 0.00 0.00 64.86 64.24 2oo3 h ILE 89 Cb 0.23 1.68 -0.06 0.00 -1.09 0.00 0.00 36.82 37.58 2oo3 h ILE 89 CO -0.00 0.31 -0.24 0.20 -1.08 0.00 0.00 178.15 177.33 2oo3 s ASN 90 N -6.59 6.74 0.22 2.19 0.01 -1.12 -4.87 114.94 111.51 2oo3 s ASN 90 Ca -0.02 0.88 -0.03 0.00 -0.71 0.00 0.00 52.86 52.99 2oo3 s ASN 90 Cb 0.13 -2.23 0.20 0.00 0.41 0.00 0.00 41.25 39.76 2oo3 s ASN 90 CO 0.68 0.32 1.59 -0.07 -1.51 0.00 0.00 177.10 178.11 2oo3 h LEU 91 N 4.87 0.67 0.00 0.60 3.38 -1.85 -3.47 115.31 119.51 2oo3 h LEU 91 Ca -0.51 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.17 2oo3 h LEU 91 Cb 1.22 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.78 2oo3 h LEU 91 CO 0.62 0.97 0.00 -0.46 0.09 0.00 0.00 178.44 179.65 2oo3 n ASN 92 N -4.05 0.01 -0.14 -0.43 0.23 -1.26 -5.05 115.26 104.57 2oo3 n ASN 92 Ca -0.01 0.00 0.13 0.00 -0.53 0.00 0.00 54.58 54.16 2oo3 n ASN 92 Cb 0.50 0.00 0.37 0.00 -2.08 0.00 0.00 39.78 38.56 2oo3 n ASN 92 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2oo3 n SER 93 N 0.00 0.75 -4.72 0.53 3.41 -1.26 -4.77 113.62 107.56 2oo3 n SER 93 Ca 0.00 -0.59 -0.39 0.00 -0.26 0.00 0.00 58.87 57.63 2oo3 n SER 93 Cb 0.00 0.13 -0.05 0.00 -0.26 0.00 0.00 64.21 64.03 2oo3 n SER 93 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2oo3 s THR 94 N -2.68 5.08 -0.40 6.66 2.01 -1.26 -5.02 115.64 120.03 2oo3 s THR 94 Ca 0.20 1.32 -0.29 0.00 0.31 0.00 0.00 61.69 63.23 2oo3 s THR 94 Cb 0.19 -3.98 0.01 0.00 0.01 0.00 0.00 72.50 68.72 2oo3 s THR 94 CO 0.58 0.27 1.46 -0.22 -0.69 0.00 0.00 174.62 176.01 2oo3 s LEU 95 N 0.78 3.58 -0.10 4.42 2.96 -1.26 -4.76 118.68 124.30 2oo3 s LEU 95 Ca 0.34 0.89 0.05 0.00 -0.22 0.00 0.00 54.13 55.20 2oo3 s LEU 95 Cb -0.17 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 42.89 2oo3 s LEU 95 CO 0.16 -1.46 -0.03 -1.20 -1.32 0.00 0.00 176.35 172.50 2oo3 n SER 96 N 8.99 2.97 -4.19 3.68 7.64 -1.26 -4.92 113.62 126.54 2oo3 n SER 96 Ca 0.17 -0.03 -0.25 0.00 1.01 0.00 0.00 58.87 59.78 2oo3 n SER 96 Cb 0.48 0.33 -0.15 0.00 -1.01 0.00 0.00 64.21 63.86 2oo3 n SER 96 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2oo3 s TYR 97 N -2.22 1.60 -0.10 1.43 2.02 -1.26 -0.74 117.35 118.08 2oo3 s TYR 97 Ca -0.09 -0.32 0.02 0.00 -0.37 0.00 0.00 57.07 56.31 2oo3 s TYR 97 Cb 0.03 -1.00 -0.01 0.00 -0.40 0.00 0.00 41.96 40.57 2oo3 s TYR 97 CO 0.31 0.01 -0.16 -0.47 -1.57 0.00 0.00 175.55 173.67 2oo3 s TYR 98 N -0.55 2.72 0.42 2.71 5.04 0.37 -4.78 117.35 123.28 2oo3 s TYR 98 Ca 0.06 -0.62 -0.23 0.00 -2.44 0.00 0.00 57.07 53.85 2oo3 s TYR 98 Cb -0.07 -1.76 -0.09 0.00 0.35 0.00 0.00 41.96 40.38 2oo3 s TYR 98 CO 0.00 -0.17 1.01 -1.25 -1.34 0.00 0.00 175.55 173.81 2oo3 s PRO 99 N 0.11 4.14 0.68 4.97 0.05 -1.26 -0.66 135.00 143.02 2oo3 s PRO 99 Ca -0.07 1.37 -0.04 0.00 0.05 0.00 0.00 61.00 62.30 2oo3 s PRO 99 Cb -0.15 -2.39 0.07 0.00 0.05 0.00 0.00 34.50 32.08 2oo3 s PRO 99 CO 0.05 -0.13 0.96 0.20 0.05 0.00 0.00 177.00 178.12 2oo3 s GLY 100 N -1.80 1.75 0.31 0.56 0.00 0.97 -4.88 107.32 104.23 2oo3 s GLY 100 Ca 0.60 -1.18 0.06 0.00 0.00 0.00 0.00 44.72 44.21 2oo3 s GLY 100 CO 0.22 -0.76 1.80 1.48 0.00 0.00 0.00 173.10 175.84 2oo3 h SER 101 N -0.45 0.78 -0.48 1.64 4.64 -1.86 -1.09 113.55 116.73 2oo3 h SER 101 Ca -0.43 0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 60.97 2oo3 h SER 101 Cb 1.30 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 63.30 2oo3 h SER 101 CO 0.54 0.31 0.27 -0.65 -0.87 0.00 0.00 176.83 176.43 2oo3 h PRO 102 N 0.78 0.69 -0.60 4.77 0.11 -1.83 -0.89 132.00 135.02 2oo3 h PRO 102 Ca 0.55 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 66.50 2oo3 h PRO 102 Cb 0.84 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.79 2oo3 h PRO 102 CO -0.33 0.51 0.01 -0.92 -0.21 0.00 0.00 178.00 177.06 2oo3 h TYR 103 N 0.70 1.13 -0.25 0.65 3.20 -1.36 -1.12 116.97 119.92 2oo3 h TYR 103 Ca 0.18 -0.19 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2oo3 h TYR 103 Cb 0.02 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 37.98 2oo3 h TYR 103 CO 0.00 0.99 0.16 0.74 -1.64 0.00 0.00 178.16 178.42 2oo3 h PHE 104 N 0.96 0.31 -0.64 -3.82 0.04 -1.18 -2.82 116.94 109.79 2oo3 h PHE 104 Ca 0.17 0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.91 2oo3 h PHE 104 Cb 0.54 -0.11 -0.03 0.00 2.20 0.00 0.00 35.95 38.55 2oo3 h PHE 104 CO 0.04 0.20 0.26 0.00 -0.60 0.00 0.00 178.31 178.20 2oo3 h ALA 105 N 1.09 0.83 -0.18 2.45 0.00 -0.81 -1.86 119.26 120.77 2oo3 h ALA 105 Ca 0.09 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2oo3 h ALA 105 Cb -0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2oo3 h ALA 105 CO -0.02 0.44 -0.05 0.82 0.00 0.00 0.00 179.25 180.44 2oo3 h ILE 106 N 0.89 1.15 -0.24 0.00 2.04 -1.25 -0.09 117.51 120.01 2oo3 h ILE 106 Ca 0.21 -0.61 -0.17 0.00 1.00 0.00 0.00 64.86 65.30 2oo3 h ILE 106 Cb 0.20 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 2oo3 h ILE 106 CO -0.02 0.20 -0.50 0.78 0.00 0.00 0.00 178.15 178.61 2oo3 h ASN 107 N 0.26 0.85 0.83 1.72 2.35 -1.09 -3.35 115.58 117.14 2oo3 h ASN 107 Ca 0.06 -0.55 -0.09 0.00 -0.55 0.00 0.00 56.30 55.17 2oo3 h ASN 107 Cb 0.27 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 2oo3 h ASN 107 CO 0.01 1.24 -1.23 0.00 -1.65 0.00 0.00 177.43 175.80 2oo3 n GLN 108 N -4.11 0.61 -1.69 0.81 6.02 -0.78 -4.95 117.38 113.28 2oo3 n GLN 108 Ca -0.05 0.17 -0.29 0.00 -0.01 0.00 0.00 57.00 56.81 2oo3 n GLN 108 Cb 0.60 -1.81 0.14 0.00 1.02 0.00 0.00 30.24 30.19 2oo3 n GLN 108 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2oo3 s LEU 109 N -5.56 2.20 0.35 1.08 1.43 -0.07 -4.95 118.68 113.16 2oo3 s LEU 109 Ca -0.02 0.72 0.09 0.00 -1.03 0.00 0.00 54.13 53.89 2oo3 s LEU 109 Cb 0.09 -2.98 -0.05 0.00 0.03 0.00 0.00 46.19 43.28 2oo3 s LEU 109 CO 0.80 -2.54 0.05 -0.13 0.23 0.00 0.00 176.35 174.76 2oo3 s ARG 110 N -5.52 2.14 0.55 1.70 0.52 -1.26 -4.96 118.95 112.11 2oo3 s ARG 110 Ca 0.66 -1.73 0.23 0.00 -0.52 0.00 0.00 55.73 54.37 2oo3 s ARG 110 Cb -0.11 -1.97 1.45 0.00 0.52 0.00 0.00 34.95 34.84 2oo3 s ARG 110 CO 0.52 0.10 2.11 0.66 0.02 0.00 0.00 175.30 178.71 2oo3 h SER 111 N 1.72 0.00 1.05 0.23 4.64 -1.98 -1.47 113.55 117.74 2oo3 h SER 111 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2oo3 h SER 111 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2oo3 h SER 111 CO 0.67 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.63 2oo3 n GLN 112 N -4.26 0.10 -2.23 4.77 10.64 -1.26 -4.55 117.38 120.58 2oo3 n GLN 112 Ca 0.01 0.14 -0.26 0.00 -1.83 0.00 0.00 57.00 55.06 2oo3 n GLN 112 Cb 0.27 -1.62 0.10 0.00 -0.86 0.00 0.00 30.24 28.12 2oo3 n GLN 112 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2oo3 s ASP 113 N -3.57 4.43 -0.08 2.61 1.01 -0.55 -4.55 116.67 115.97 2oo3 s ASP 113 Ca 0.11 0.27 -0.00 0.00 0.71 0.00 0.00 52.55 53.64 2oo3 s ASP 113 Cb 0.15 -0.77 0.03 0.00 1.01 0.00 0.00 42.92 43.34 2oo3 s ASP 113 CO 0.50 -1.84 -0.04 -0.60 0.21 0.00 0.00 175.17 173.40 2oo3 s ARG 114 N -5.34 0.96 -0.16 8.23 3.52 0.14 -4.37 118.95 121.93 2oo3 s ARG 114 Ca 0.64 -0.06 -0.07 0.00 -0.13 0.00 0.00 55.73 56.11 2oo3 s ARG 114 Cb -0.09 -1.13 -0.04 0.00 -1.56 0.00 0.00 34.95 32.13 2oo3 s ARG 114 CO 0.46 -0.23 0.08 -0.51 -0.81 0.00 0.00 175.30 174.29 2oo3 s LEU 115 N 1.62 3.95 -0.19 -0.88 1.02 -0.40 -0.05 118.68 123.76 2oo3 s LEU 115 Ca 0.01 0.19 -0.00 0.00 0.02 0.00 0.00 54.13 54.34 2oo3 s LEU 115 Cb -0.13 -1.98 0.05 0.00 0.02 0.00 0.00 46.19 44.14 2oo3 s LEU 115 CO -0.05 0.25 -0.06 -0.47 0.02 0.00 0.00 176.35 176.04 2oo3 s TYR 116 N -0.06 1.97 -0.14 0.29 5.04 0.74 -0.58 117.35 124.60 2oo3 s TYR 116 Ca 0.07 -1.32 -0.00 0.00 -2.44 0.00 0.00 57.07 53.38 2oo3 s TYR 116 Cb -0.12 -1.43 -0.01 0.00 0.35 0.00 0.00 41.96 40.75 2oo3 s TYR 116 CO 0.01 -0.68 -0.14 -0.51 -1.34 0.00 0.00 175.55 172.89 2oo3 s LEU 117 N 1.54 2.66 -0.07 6.97 1.43 0.31 -1.30 118.68 130.22 2oo3 s LEU 117 Ca -0.01 -0.36 0.03 0.00 -1.03 0.00 0.00 54.13 52.76 2oo3 s LEU 117 Cb -0.16 -1.60 -0.02 0.00 0.03 0.00 0.00 46.19 44.44 2oo3 s LEU 117 CO -0.08 0.15 -0.16 0.00 0.23 0.00 0.00 176.35 176.49 2oo3 s GLU 119 N -0.32 0.15 0.03 0.00 2.56 -0.33 -0.29 118.70 120.49 2oo3 s GLU 119 Ca 0.02 0.51 -0.10 0.00 0.00 0.00 0.00 54.97 55.40 2oo3 s GLU 119 Cb -0.13 -0.14 -0.32 0.00 2.00 0.00 0.00 34.13 35.54 2oo3 s GLU 119 CO 0.02 -0.19 0.97 1.25 -0.56 0.00 0.00 175.26 176.76 2oo3 h LEU 120 N 7.42 0.64 -9.39 2.70 5.85 -1.85 -2.90 115.31 117.78 2oo3 h LEU 120 Ca -0.37 -0.74 -0.54 0.00 0.84 0.00 0.00 57.88 57.07 2oo3 h LEU 120 Cb 1.14 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 2oo3 h LEU 120 CO 0.35 1.59 0.60 -2.28 -0.34 0.00 0.00 178.44 178.36 2oo3 s HIS 121 N -2.61 3.35 0.27 1.25 2.46 -1.26 -4.79 115.29 113.96 2oo3 s HIS 121 Ca -0.09 1.32 -0.03 0.00 0.47 0.00 0.00 55.06 56.73 2oo3 s HIS 121 Cb 0.05 -3.38 0.35 0.00 -0.13 0.00 0.00 32.58 29.48 2oo3 s HIS 121 CO 0.91 -1.10 1.89 -1.00 -2.47 0.00 0.00 174.74 172.96 2oo3 h PRO 122 N 7.11 1.08 -0.22 2.88 0.13 -1.98 0.26 132.00 141.25 2oo3 h PRO 122 Ca -0.38 -0.13 -0.04 0.00 -0.87 0.00 0.00 66.00 64.59 2oo3 h PRO 122 Cb 1.19 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 32.10 2oo3 h PRO 122 CO 0.84 0.80 -0.01 1.15 -0.23 0.00 0.00 178.00 180.54 2oo3 h THR 123 N 1.08 1.26 -0.24 1.56 2.02 -1.99 -1.34 112.91 115.26 2oo3 h THR 123 Ca 0.27 -0.93 -0.01 0.00 0.77 0.00 0.00 66.41 66.51 2oo3 h THR 123 Cb 0.04 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.87 2oo3 h THR 123 CO -0.04 0.29 0.12 -0.33 0.37 0.00 0.00 175.52 175.93 2oo3 h GLU 124 N 0.16 0.34 -0.66 6.66 4.39 -1.85 -2.15 114.58 121.47 2oo3 h GLU 124 Ca 0.06 -0.05 0.07 0.00 0.34 0.00 0.00 59.36 59.78 2oo3 h GLU 124 Cb 0.43 -0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 28.96 2oo3 h GLU 124 CO 0.01 0.33 0.35 -0.92 -1.16 0.00 0.00 179.01 177.62 2oo3 h TYR 125 N 0.26 0.63 -0.24 4.33 3.20 -0.49 -0.54 116.97 124.13 2oo3 h TYR 125 Ca 0.08 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.94 2oo3 h TYR 125 Cb 0.10 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 2oo3 h TYR 125 CO -0.03 0.28 -0.01 -0.91 -1.64 0.00 0.00 178.16 175.86 2oo3 h ASN 126 N 0.63 0.32 0.02 -2.11 -0.26 -0.90 -1.89 115.58 111.39 2oo3 h ASN 126 Ca 0.30 -0.05 -0.19 0.00 -0.56 0.00 0.00 56.30 55.80 2oo3 h ASN 126 Cb 0.24 -0.08 0.00 0.00 -1.06 0.00 0.00 38.32 37.41 2oo3 h ASN 126 CO -0.21 0.39 -0.69 -0.26 -1.06 0.00 0.00 177.43 175.60 2oo3 h PHE 127 N 0.35 0.81 0.00 1.19 0.04 -0.73 -3.16 116.94 115.44 2oo3 h PHE 127 Ca 0.08 -0.34 -0.02 0.00 2.80 0.00 0.00 57.97 60.49 2oo3 h PHE 127 Cb 0.24 -0.13 -0.00 0.00 2.20 0.00 0.00 35.95 38.26 2oo3 h PHE 127 CO 0.01 1.12 -0.11 1.25 -0.60 0.00 0.00 178.31 179.98 2oo3 h LEU 128 N 0.44 0.00 -1.22 1.54 5.85 -0.42 -1.30 115.31 120.20 2oo3 h LEU 128 Ca -0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.69 2oo3 h LEU 128 Cb 1.28 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.31 2oo3 h LEU 128 CO 0.13 0.11 0.00 -0.07 -0.34 0.00 0.00 178.44 178.27 2oo3 h LEU 129 N 0.00 0.00 -0.78 2.25 3.38 -1.33 -2.71 115.31 116.12 2oo3 h LEU 129 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2oo3 h LEU 129 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2oo3 h LEU 129 CO 0.01 0.00 -0.32 0.29 0.09 0.00 0.00 178.44 178.51 2oo3 n LYS 130 N -2.31 1.10 -1.84 1.13 4.76 -0.49 -4.97 118.16 115.54 2oo3 n LYS 130 Ca -0.00 -0.78 -0.41 0.00 -2.87 0.00 0.00 58.31 54.24 2oo3 n LYS 130 Cb 0.12 -1.48 -0.01 0.00 -1.84 0.00 0.00 35.03 31.81 2oo3 n LYS 130 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2oo3 s LEU 131 N -2.44 4.35 0.51 -0.35 2.01 -1.02 -4.98 118.68 116.76 2oo3 s LEU 131 Ca 0.23 2.91 -0.22 0.00 0.01 0.00 0.00 54.13 57.06 2oo3 s LEU 131 Cb 0.19 -3.64 -0.06 0.00 0.01 0.00 0.00 46.19 42.69 2oo3 s LEU 131 CO 0.52 -0.85 1.26 -2.16 1.01 0.00 0.00 176.35 176.14 2oo3 s PRO 132 N -0.93 3.39 -0.01 1.29 0.04 -1.26 -4.94 135.00 132.59 2oo3 s PRO 132 Ca 0.59 2.00 0.18 0.00 0.04 0.00 0.00 61.00 63.81 2oo3 s PRO 132 Cb -0.46 -2.29 -0.22 0.00 0.04 0.00 0.00 34.50 31.57 2oo3 s PRO 132 CO 0.51 -0.91 0.65 0.72 0.04 0.00 0.00 177.00 178.01 2oo3 n HIS 133 N -0.84 0.00 -0.27 0.56 8.25 -1.26 -5.02 115.22 116.64 2oo3 n HIS 133 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 2oo3 n HIS 133 Cb 0.47 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.46 2oo3 n HIS 133 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2oo3 n PHE 134 N -1.62 0.00 -0.95 4.41 3.72 -1.26 -0.45 117.46 121.31 2oo3 n PHE 134 Ca 0.01 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.37 2oo3 n PHE 134 Cb 0.33 0.00 0.31 0.00 -0.94 0.00 0.00 39.48 39.19 2oo3 n PHE 134 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 2oo3 n ASN 135 N 2.57 4.93 -4.97 4.37 6.94 -1.26 -4.98 115.26 122.85 2oo3 n ASN 135 Ca 0.00 -3.14 -0.21 0.00 -0.02 0.00 0.00 54.58 51.22 2oo3 n ASN 135 Cb 0.00 -0.73 0.03 0.00 -2.36 0.00 0.00 39.78 36.71 2oo3 n ASN 135 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2oo3 s LYS 136 N -2.88 2.68 -0.44 -3.83 -0.14 0.40 -4.38 119.74 111.16 2oo3 s LYS 136 Ca 0.54 -0.79 -0.07 0.00 -1.36 0.00 0.00 55.97 54.29 2oo3 s LYS 136 Cb 0.42 -2.54 0.10 0.00 -1.68 0.00 0.00 37.83 34.14 2oo3 s LYS 136 CO 0.14 -0.57 0.27 0.21 -0.76 0.00 0.00 175.35 174.64 2oo3 s LYS 137 N -4.67 2.38 -0.21 1.68 2.20 -1.26 -4.91 119.74 114.95 2oo3 s LYS 137 Ca 0.55 -1.69 0.02 0.00 -0.36 0.00 0.00 55.97 54.49 2oo3 s LYS 137 Cb -0.10 -3.77 0.04 0.00 -1.51 0.00 0.00 37.83 32.49 2oo3 s LYS 137 CO 0.38 -1.08 -0.14 0.08 -0.36 0.00 0.00 175.35 174.22 2oo3 s VAL 138 N 1.31 1.98 -0.32 4.02 1.01 -1.26 -1.27 120.40 125.87 2oo3 s VAL 138 Ca 0.05 -1.18 -0.09 0.00 0.00 0.00 0.00 61.98 60.76 2oo3 s VAL 138 Cb -0.24 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 34.19 2oo3 s VAL 138 CO -0.01 0.25 0.14 -0.31 0.00 0.00 0.00 175.10 175.17 2oo3 s TYR 139 N 1.26 3.18 -0.22 5.22 2.02 0.25 -5.01 117.35 124.06 2oo3 s TYR 139 Ca -0.01 -0.77 -0.09 0.00 -0.37 0.00 0.00 57.07 55.83 2oo3 s TYR 139 Cb -0.16 -2.34 -0.04 0.00 -0.40 0.00 0.00 41.96 39.02 2oo3 s TYR 139 CO -0.09 -0.53 0.11 0.08 -1.57 0.00 0.00 175.55 173.56 2oo3 s VAL 140 N 1.57 5.03 -0.08 0.71 1.01 -1.26 -0.53 120.40 126.84 2oo3 s VAL 140 Ca 0.03 0.06 0.02 0.00 0.00 0.00 0.00 61.98 62.10 2oo3 s VAL 140 Cb -0.17 -3.32 0.01 0.00 0.00 0.00 0.00 36.38 32.90 2oo3 s VAL 140 CO 0.05 0.39 -0.15 0.20 0.00 0.00 0.00 175.10 175.59 2oo3 s ASN 141 N 0.89 2.19 -0.86 3.32 0.01 0.90 -4.96 114.94 116.42 2oo3 s ASN 141 Ca 0.06 -0.38 -0.20 0.00 -0.71 0.00 0.00 52.86 51.63 2oo3 s ASN 141 Cb -0.13 -1.00 0.11 0.00 0.41 0.00 0.00 41.25 40.64 2oo3 s ASN 141 CO 0.03 0.05 1.11 -2.28 -1.51 0.00 0.00 177.10 174.49 2oo3 s HIS 142 N 0.70 2.94 0.02 2.20 5.65 -1.26 -1.19 115.29 124.36 2oo3 s HIS 142 Ca -0.13 -1.11 -0.28 0.00 0.25 0.00 0.00 55.06 53.79 2oo3 s HIS 142 Cb -0.16 -4.32 0.09 0.00 -1.18 0.00 0.00 32.58 27.01 2oo3 s HIS 142 CO 0.03 -1.57 0.78 -0.08 -0.65 0.00 0.00 174.74 173.25 2oo3 s THR 143 N 3.26 0.00 -0.54 0.89 -1.32 -1.10 -4.95 115.64 111.88 2oo3 s THR 143 Ca 0.31 0.00 -0.27 0.00 -1.21 0.00 0.00 61.69 60.52 2oo3 s THR 143 Cb -0.08 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.88 2oo3 s THR 143 CO -0.04 0.00 1.96 -0.62 -2.21 0.00 0.00 174.62 173.71 2oo3 s ASP 144 N -2.18 5.22 0.34 8.08 -1.08 -1.26 -3.42 116.67 122.37 2oo3 s ASP 144 Ca 0.00 0.65 0.04 0.00 -0.52 0.00 0.00 52.55 52.73 2oo3 s ASP 144 Cb -0.01 -2.52 0.67 0.00 -1.46 0.00 0.00 42.92 39.60 2oo3 s ASP 144 CO -0.06 -2.36 1.92 1.23 0.52 0.00 0.00 175.17 176.42 2oo3 h GLY 145 N 16.57 1.16 1.04 2.66 0.00 -1.87 -2.44 103.07 120.19 2oo3 h GLY 145 Ca -0.27 -0.35 -0.05 0.00 0.00 0.00 0.00 47.33 46.67 2oo3 h GLY 145 CO 1.17 0.23 0.30 -2.08 0.00 0.00 0.00 176.54 176.16 2oo3 h VAL 146 N 0.85 1.26 -0.02 4.60 2.07 -1.90 -1.49 116.25 121.62 2oo3 h VAL 146 Ca 0.37 -0.81 -0.06 0.00 0.82 0.00 0.00 66.70 67.02 2oo3 h VAL 146 Cb 0.33 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2oo3 h VAL 146 CO -0.14 0.33 -0.28 0.77 0.02 0.00 0.00 177.57 178.27 2oo3 h SER 147 N 1.10 0.04 0.70 0.57 4.64 -1.86 -3.06 113.55 115.67 2oo3 h SER 147 Ca 0.25 -0.01 -0.05 0.00 -0.47 0.00 0.00 61.79 61.51 2oo3 h SER 147 Cb 0.22 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 2oo3 h SER 147 CO -0.02 0.31 -0.25 0.11 -0.87 0.00 0.00 176.83 176.12 2oo3 h LYS 148 N 0.03 0.00 -0.80 4.77 1.79 -0.83 -3.17 116.57 118.36 2oo3 h LYS 148 Ca 0.00 0.00 0.19 0.00 -2.18 0.00 0.00 60.65 58.66 2oo3 h LYS 148 Cb 0.51 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 31.02 2oo3 h LYS 148 CO 0.04 0.25 0.02 -0.07 -1.08 0.00 0.00 179.45 178.60 2oo3 h LEU 149 N 0.00 -0.36 -1.13 2.94 3.38 -1.40 -1.29 115.31 117.45 2oo3 h LEU 149 Ca -0.00 0.21 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 2oo3 h LEU 149 Cb 0.66 0.36 -0.03 0.00 0.09 0.00 0.00 40.66 41.75 2oo3 h LEU 149 CO 0.03 -0.20 0.28 -1.13 0.09 0.00 0.00 178.44 177.51 2oo3 h ASN 150 N 0.10 0.81 1.15 -0.43 -0.00 -1.77 -3.10 115.58 112.34 2oo3 h ASN 150 Ca 0.45 -0.09 -0.17 0.00 -0.00 0.00 0.00 56.30 56.49 2oo3 h ASN 150 Cb 0.81 -0.21 -0.03 0.00 -0.00 0.00 0.00 38.32 38.90 2oo3 h ASN 150 CO -0.71 0.70 -0.87 0.00 -0.00 0.00 0.00 177.43 176.56 2oo3 h ALA 151 N 1.42 0.52 -0.01 1.57 0.00 -1.43 -3.37 119.26 117.96 2oo3 h ALA 151 Ca 0.22 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2oo3 h ALA 151 Cb 0.12 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2oo3 h ALA 151 CO -0.03 1.00 -0.44 1.28 0.00 0.00 0.00 179.25 181.06 2oo3 n LEU 152 N -3.25 1.68 -4.27 0.00 4.77 -0.88 -4.95 117.00 110.10 2oo3 n LEU 152 Ca -0.01 -0.73 -0.28 0.00 -0.03 0.00 0.00 56.01 54.96 2oo3 n LEU 152 Cb 0.86 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.80 2oo3 n LEU 152 CO 0.44 0.32 -0.54 -0.76 -1.33 0.00 0.00 177.39 175.53 2oo3 s LEU 153 N -2.28 2.11 0.40 2.23 1.43 -1.18 -3.51 118.68 117.88 2oo3 s LEU 153 Ca 0.14 -0.48 -0.25 0.00 -1.03 0.00 0.00 54.13 52.51 2oo3 s LEU 153 Cb 0.15 -1.11 -0.08 0.00 0.03 0.00 0.00 46.19 45.18 2oo3 s LEU 153 CO 0.50 0.23 1.15 -2.16 0.23 0.00 0.00 176.35 176.30 2oo3 s PRO 154 N -0.91 4.08 0.50 1.29 0.04 -1.26 -4.89 135.00 133.86 2oo3 s PRO 154 Ca 0.09 1.80 -0.13 0.00 0.04 0.00 0.00 61.00 62.79 2oo3 s PRO 154 Cb -0.09 -2.67 -0.06 0.00 0.04 0.00 0.00 34.50 31.72 2oo3 s PRO 154 CO 0.01 -0.28 0.92 -1.25 0.04 0.00 0.00 177.00 176.43 2oo3 s PRO 155 N -2.30 3.81 0.47 0.56 0.04 -1.23 -4.96 135.00 131.39 2oo3 s PRO 155 Ca 0.57 0.73 0.18 0.00 0.04 0.00 0.00 61.00 62.52 2oo3 s PRO 155 Cb -0.30 -2.21 1.16 0.00 0.04 0.00 0.00 34.50 33.20 2oo3 s PRO 155 CO 0.37 -0.26 1.99 -1.00 0.04 0.00 0.00 177.00 178.14 2oo3 h PRO 156 N 0.73 0.24 0.00 0.56 0.13 -1.97 0.39 132.00 132.09 2oo3 h PRO 156 Ca -0.46 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2oo3 h PRO 156 Cb 1.19 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 2oo3 h PRO 156 CO 0.62 0.16 -0.01 0.93 -0.23 0.00 0.00 178.00 179.47 2oo3 h GLU 157 N 0.25 0.00 -0.03 0.86 3.07 -1.93 -3.46 114.58 113.35 2oo3 h GLU 157 Ca 0.26 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.11 2oo3 h GLU 157 Cb 0.68 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.59 2oo3 h GLU 157 CO -0.05 0.01 -0.01 1.63 -1.40 0.00 0.00 179.01 179.19 2oo3 n LYS 158 N -3.84 -1.55 -3.86 2.33 4.01 0.13 -4.88 118.16 110.48 2oo3 n LYS 158 Ca -0.03 0.42 -0.17 0.00 -0.51 0.00 0.00 58.31 58.02 2oo3 n LYS 158 Cb 0.09 -4.59 -0.16 0.00 -0.51 0.00 0.00 35.03 29.86 2oo3 n LYS 158 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2oo3 s ARG 159 N -1.63 0.18 -0.10 1.97 0.52 -1.26 -4.95 118.95 113.67 2oo3 s ARG 159 Ca 0.00 0.13 -0.12 0.00 -0.52 0.00 0.00 55.73 55.22 2oo3 s ARG 159 Cb 0.00 -0.42 0.03 0.00 0.52 0.00 0.00 34.95 35.08 2oo3 s ARG 159 CO 0.00 -0.16 0.32 0.20 0.02 0.00 0.00 175.30 175.68 2oo3 s GLY 160 N 1.11 -0.23 -0.22 -3.53 0.00 -1.26 -0.95 107.32 102.24 2oo3 s GLY 160 Ca -0.09 0.81 -0.04 0.00 0.00 0.00 0.00 44.72 45.41 2oo3 s GLY 160 CO -0.02 0.68 -0.04 -2.27 0.00 0.00 0.00 173.10 171.44 2oo3 s LEU 161 N -0.07 2.90 -0.29 0.66 2.96 -0.01 -1.10 118.68 123.73 2oo3 s LEU 161 Ca -0.02 -0.41 -0.04 0.00 -0.22 0.00 0.00 54.13 53.45 2oo3 s LEU 161 Cb -0.03 -1.74 0.03 0.00 0.50 0.00 0.00 46.19 44.96 2oo3 s LEU 161 CO 0.01 -0.02 0.01 -0.63 -1.32 0.00 0.00 176.35 174.40 2oo3 s ILE 162 N 1.47 3.31 -0.29 6.68 1.09 0.18 -0.97 121.20 132.68 2oo3 s ILE 162 Ca 0.06 -1.05 -0.04 0.00 -1.10 0.00 0.00 60.65 58.52 2oo3 s ILE 162 Cb -0.14 -2.77 0.03 0.00 -1.06 0.00 0.00 42.46 38.52 2oo3 s ILE 162 CO -0.03 0.04 0.02 0.12 -0.10 0.00 0.00 174.94 174.98 2oo3 s PHE 163 N 1.36 3.16 -0.28 3.97 5.36 0.21 -0.88 117.98 130.88 2oo3 s PHE 163 Ca -0.01 -1.43 -0.02 0.00 -0.96 0.00 0.00 56.93 54.51 2oo3 s PHE 163 Cb -0.18 -2.16 0.04 0.00 -0.34 0.00 0.00 43.02 40.38 2oo3 s PHE 163 CO -0.01 -0.70 -0.01 0.42 -1.46 0.00 0.00 175.22 173.46 2oo3 s ILE 164 N 1.37 3.04 -0.61 3.12 1.01 0.39 -2.92 121.20 126.60 2oo3 s ILE 164 Ca -0.01 -1.21 0.06 0.00 0.00 0.00 0.00 60.65 59.50 2oo3 s ILE 164 Cb -0.18 -2.67 0.24 0.00 0.01 0.00 0.00 42.46 39.86 2oo3 s ILE 164 CO -0.01 0.01 0.68 -0.67 0.00 0.00 0.00 174.94 174.95 2oo3 n ASP 165 N 4.66 3.13 -4.78 3.58 2.03 -1.26 -1.42 116.55 122.48 2oo3 n ASP 165 Ca -0.14 -3.30 -0.32 0.00 0.52 0.00 0.00 54.79 51.54 2oo3 n ASP 165 Cb 0.45 -0.67 0.05 0.00 -0.72 0.00 0.00 41.12 40.23 2oo3 n ASP 165 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 2oo3 s PRO 166 N -2.15 2.76 0.28 -0.67 0.02 -1.26 -4.73 135.00 129.26 2oo3 s PRO 166 Ca 0.37 1.29 0.15 0.00 0.02 0.00 0.00 61.00 62.84 2oo3 s PRO 166 Cb 0.13 -1.95 0.15 0.00 0.02 0.00 0.00 34.50 32.85 2oo3 s PRO 166 CO -0.05 -1.26 1.48 0.66 -0.33 0.00 0.00 177.00 177.50 2oo3 h SER 167 N -0.20 0.00 -4.19 2.53 4.64 -1.98 -3.48 113.55 110.87 2oo3 h SER 167 Ca -0.46 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.56 2oo3 h SER 167 Cb 1.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 2oo3 h SER 167 CO 0.54 0.52 -0.41 -1.22 -0.87 0.00 0.00 176.83 175.38 2oo3 n TYR 168 N -3.28 -1.52 0.24 4.77 4.01 -1.26 -4.88 117.16 115.23 2oo3 n TYR 168 Ca 0.01 0.16 0.09 0.00 -0.16 0.00 0.00 57.90 58.00 2oo3 n TYR 168 Cb 0.71 -3.07 0.59 0.00 -0.31 0.00 0.00 39.34 37.26 2oo3 n TYR 168 CO 0.00 0.00 0.00 1.05 -0.46 0.00 0.00 176.86 177.45 2oo3 h GLU 169 N -0.36 0.00 -5.56 -0.72 4.11 -2.02 -3.41 114.58 106.63 2oo3 h GLU 169 Ca -0.36 0.00 -0.65 0.00 0.07 0.00 0.00 59.36 58.42 2oo3 h GLU 169 Cb 1.26 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.38 2oo3 h GLU 169 CO 0.43 0.19 -0.55 1.03 0.07 0.00 0.00 179.01 180.17 2oo3 s ARG 170 N -4.24 3.58 0.37 1.06 0.52 -1.26 -4.99 118.95 113.98 2oo3 s ARG 170 Ca -0.03 -0.30 0.09 0.00 -0.52 0.00 0.00 55.73 54.98 2oo3 s ARG 170 Cb 0.14 -3.10 0.84 0.00 0.52 0.00 0.00 34.95 33.35 2oo3 s ARG 170 CO 0.64 0.52 1.90 -0.22 0.02 0.00 0.00 175.30 178.16 2oo3 h LYS 171 N 5.83 0.64 0.00 3.54 3.64 -2.02 -1.38 116.57 126.82 2oo3 h LYS 171 Ca -0.45 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2oo3 h LYS 171 Cb 1.19 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.86 2oo3 h LYS 171 CO 0.63 0.42 -0.01 0.93 -2.27 0.00 0.00 179.45 179.15 2oo3 h GLU 172 N 0.66 0.00 -0.20 1.90 3.07 -1.95 -1.90 114.58 116.15 2oo3 h GLU 172 Ca 0.41 0.00 0.06 0.00 -0.50 0.00 0.00 59.36 59.33 2oo3 h GLU 172 Cb 0.65 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.55 2oo3 h GLU 172 CO -0.17 0.01 0.17 0.93 -1.40 0.00 0.00 179.01 178.55 2oo3 h GLU 173 N 0.00 0.00 0.00 2.33 5.08 -1.63 0.23 114.58 120.59 2oo3 h GLU 173 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2oo3 h GLU 173 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2oo3 h GLU 173 CO 0.00 0.00 0.00 1.88 -1.00 0.00 0.00 179.01 179.89 2oo3 h TYR 174 N 0.00 0.00 0.00 4.33 0.05 -1.52 -1.78 116.97 118.04 2oo3 h TYR 174 Ca 0.10 0.00 -0.27 0.00 0.05 0.00 0.00 58.73 58.61 2oo3 h TYR 174 Cb 0.43 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.12 2oo3 h TYR 174 CO 0.00 0.00 -2.01 0.36 -1.05 0.00 0.00 178.16 175.46 2oo3 n LYS 175 N -2.85 1.46 -0.24 4.88 2.85 -0.62 -4.35 118.16 119.29 2oo3 n LYS 175 Ca 0.01 0.01 -0.05 0.00 -1.05 0.00 0.00 58.31 57.23 2oo3 n LYS 175 Cb 0.30 -1.37 0.05 0.00 -0.65 0.00 0.00 35.03 33.36 2oo3 n LYS 175 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 2oo3 h GLU 176 N 0.00 0.89 0.34 -1.58 5.08 -0.91 -2.81 114.58 115.58 2oo3 h GLU 176 Ca -0.40 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 57.89 2oo3 h GLU 176 Cb 1.87 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.92 2oo3 h GLU 176 CO 0.01 0.59 -0.16 0.82 -1.00 0.00 0.00 179.01 179.27 2oo3 h ILE 177 N 0.91 0.67 -0.07 3.13 1.08 -1.58 -0.69 117.51 120.96 2oo3 h ILE 177 Ca 0.25 -0.45 -0.04 0.00 -0.39 0.00 0.00 64.86 64.24 2oo3 h ILE 177 Cb -0.09 0.90 -0.01 0.00 -3.07 0.00 0.00 36.82 34.55 2oo3 h ILE 177 CO -0.06 0.09 -0.12 -0.65 -0.69 0.00 0.00 178.15 176.72 2oo3 h PRO 178 N -0.71 0.11 0.05 2.37 0.11 -1.79 -0.95 132.00 131.18 2oo3 h PRO 178 Ca -0.05 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2oo3 h PRO 178 Cb 0.49 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.58 2oo3 h PRO 178 CO 0.08 0.24 -0.04 -0.92 -0.21 0.00 0.00 178.00 177.14 2oo3 h TYR 179 N 0.11 -0.11 -0.51 0.65 3.20 -1.26 0.62 116.97 119.66 2oo3 h TYR 179 Ca 0.02 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 2oo3 h TYR 179 Cb 0.28 0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 2oo3 h TYR 179 CO 0.00 -0.07 0.27 0.00 -1.64 0.00 0.00 178.16 176.72 2oo3 h ALA 180 N 0.85 0.65 -0.66 1.82 0.00 -0.64 -2.07 119.26 119.21 2oo3 h ALA 180 Ca 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2oo3 h ALA 180 Cb 0.10 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2oo3 h ALA 180 CO -0.01 0.18 0.29 0.82 0.00 0.00 0.00 179.25 180.53 2oo3 h ILE 181 N 0.68 1.23 -0.80 0.00 2.04 -1.10 -1.12 117.51 118.44 2oo3 h ILE 181 Ca 0.18 -0.69 0.06 0.00 1.00 0.00 0.00 64.86 65.41 2oo3 h ILE 181 Cb 0.06 0.46 -0.06 0.00 -0.74 0.00 0.00 36.82 36.54 2oo3 h ILE 181 CO -0.03 0.28 0.48 0.50 0.00 0.00 0.00 178.15 179.38 2oo3 h LYS 182 N 0.92 0.85 -0.26 2.37 3.64 -0.63 0.20 116.57 123.65 2oo3 h LYS 182 Ca 0.22 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 2oo3 h LYS 182 Cb 0.17 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 2oo3 h LYS 182 CO -0.02 0.56 -0.00 -0.97 -2.27 0.00 0.00 179.45 176.75 2oo3 h ASN 183 N 0.88 0.46 -0.18 4.20 -0.73 -1.07 -1.64 115.58 117.50 2oo3 h ASN 183 Ca 0.35 -0.31 0.01 0.00 1.87 0.00 0.00 56.30 58.23 2oo3 h ASN 183 Cb 0.18 -0.12 -0.02 0.00 0.27 0.00 0.00 38.32 38.63 2oo3 h ASN 183 CO -0.18 0.66 0.08 0.00 -0.37 0.00 0.00 177.43 177.61 2oo3 h ALA 184 N 0.82 0.21 -0.88 1.57 0.00 -0.82 -2.57 119.26 117.58 2oo3 h ALA 184 Ca 0.07 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.02 2oo3 h ALA 184 Cb 0.42 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 2oo3 h ALA 184 CO 0.01 -0.35 0.58 -0.92 0.00 0.00 0.00 179.25 178.57 2oo3 h TYR 185 N 0.17 1.08 -0.23 0.00 3.20 -0.46 -0.89 116.97 119.85 2oo3 h TYR 185 Ca 0.07 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.99 2oo3 h TYR 185 Cb 0.03 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 37.93 2oo3 h TYR 185 CO -0.10 0.65 0.15 0.66 -1.64 0.00 0.00 178.16 177.88 2oo3 h SER 186 N 1.14 0.19 0.70 -2.11 4.64 -0.88 -2.18 113.55 115.05 2oo3 h SER 186 Ca 0.34 -0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.56 2oo3 h SER 186 Cb -0.04 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 61.99 2oo3 h SER 186 CO -0.09 0.13 -1.37 0.29 -0.87 0.00 0.00 176.83 174.93 2oo3 n LYS 187 N -4.50 0.62 -3.14 4.77 5.02 -0.73 -4.67 118.16 115.54 2oo3 n LYS 187 Ca 0.01 0.12 -0.19 0.00 -2.02 0.00 0.00 58.31 56.24 2oo3 n LYS 187 Cb 0.14 -1.77 -0.05 0.00 -0.02 0.00 0.00 35.03 33.33 2oo3 n LYS 187 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2oo3 n PHE 188 N -2.73 -1.83 1.15 2.13 7.35 -0.42 -4.15 117.46 118.97 2oo3 n PHE 188 Ca -0.06 -2.69 0.14 0.00 -0.76 0.00 0.00 57.45 54.08 2oo3 n PHE 188 Cb 0.71 0.61 0.66 0.00 0.35 0.00 0.00 39.48 41.81 2oo3 n PHE 188 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 2oo3 n SER 189 N 2.54 0.02 -0.79 -2.13 3.41 -0.86 -2.77 113.62 113.03 2oo3 n SER 189 Ca 0.24 0.24 0.11 0.00 -0.26 0.00 0.00 58.87 59.20 2oo3 n SER 189 Cb 0.52 -0.40 0.07 0.00 -0.26 0.00 0.00 64.21 64.14 2oo3 n SER 189 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2oo3 n THR 190 N -1.42 0.00 -1.71 6.66 -2.24 -1.26 -4.98 114.28 109.33 2oo3 n THR 190 Ca 0.10 -0.45 -0.34 0.00 -2.27 0.00 0.00 64.05 61.10 2oo3 n THR 190 Cb 0.30 1.41 0.06 0.00 -2.10 0.00 0.00 70.33 70.00 2oo3 n THR 190 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2oo3 s GLY 191 N -1.99 2.26 -0.42 3.38 0.00 -1.12 -4.84 107.32 104.59 2oo3 s GLY 191 Ca 0.24 0.67 -0.18 0.00 0.00 0.00 0.00 44.72 45.45 2oo3 s GLY 191 CO 0.34 1.04 0.46 -2.27 0.00 0.00 0.00 173.10 172.67 2oo3 s LEU 192 N -4.84 4.78 -0.19 0.66 0.20 -0.26 -4.60 118.68 114.44 2oo3 s LEU 192 Ca 0.70 -0.59 -0.08 0.00 0.69 0.00 0.00 54.13 54.84 2oo3 s LEU 192 Cb -0.23 -2.43 -0.04 0.00 -0.43 0.00 0.00 46.19 43.05 2oo3 s LEU 192 CO 0.41 -0.59 0.08 -0.31 -0.29 0.00 0.00 176.35 175.65 2oo3 s TYR 193 N 2.22 3.28 -0.17 5.38 2.02 -0.93 -0.64 117.35 128.51 2oo3 s TYR 193 Ca 0.14 0.11 -0.01 0.00 -0.37 0.00 0.00 57.07 56.94 2oo3 s TYR 193 Cb -0.17 -2.11 0.05 0.00 -0.40 0.00 0.00 41.96 39.33 2oo3 s TYR 193 CO 0.14 0.16 -0.02 0.00 -1.57 0.00 0.00 175.55 174.26 2oo3 s VAL 195 N 1.70 2.13 0.24 0.00 0.11 -0.49 -0.46 120.40 123.64 2oo3 s VAL 195 Ca -0.00 -0.99 -0.20 0.00 -2.93 0.00 0.00 61.98 57.86 2oo3 s VAL 195 Cb -0.16 -1.82 -0.08 0.00 -1.53 0.00 0.00 36.38 32.78 2oo3 s VAL 195 CO -0.07 0.56 0.75 0.86 -3.33 0.00 0.00 175.10 173.86 2oo3 s TRP 196 N 0.43 3.62 0.00 1.54 -0.00 -0.51 -0.97 118.94 123.06 2oo3 s TRP 196 Ca -0.16 1.41 -0.08 0.00 -0.00 0.00 0.00 56.10 57.27 2oo3 s TRP 196 Cb -0.17 -2.64 0.00 0.00 -0.00 0.00 0.00 33.47 30.66 2oo3 s TRP 196 CO 0.07 0.30 0.16 1.52 -0.00 0.00 0.00 176.95 179.00 2oo3 s TYR 197 N -1.58 0.01 0.48 5.86 -0.85 -0.25 -4.47 117.35 116.55 2oo3 s TYR 197 Ca 0.45 -0.08 -0.02 0.00 -0.52 0.00 0.00 57.07 56.90 2oo3 s TYR 197 Cb -0.16 -0.03 -0.00 0.00 0.38 0.00 0.00 41.96 42.15 2oo3 s TYR 197 CO 0.21 -0.31 0.73 -1.25 -1.52 0.00 0.00 175.55 173.41 2oo3 s PRO 198 N -1.41 3.09 -0.48 -3.49 0.04 -1.26 -0.32 135.00 131.17 2oo3 s PRO 198 Ca -0.14 -0.29 -0.02 0.00 0.04 0.00 0.00 61.00 60.58 2oo3 s PRO 198 Cb -0.07 -2.47 0.13 0.00 0.04 0.00 0.00 34.50 32.12 2oo3 s PRO 198 CO 0.02 -0.35 0.28 0.08 0.04 0.00 0.00 177.00 177.06 2oo3 s VAL 199 N -2.67 3.34 -0.01 -0.36 1.01 -0.03 -4.80 120.40 116.89 2oo3 s VAL 199 Ca 0.49 -2.43 0.00 0.00 0.00 0.00 0.00 61.98 60.04 2oo3 s VAL 199 Cb -0.10 -3.26 -0.00 0.00 0.00 0.00 0.00 36.38 33.01 2oo3 s VAL 199 CO 0.40 -0.75 -0.01 1.33 0.00 0.00 0.00 175.10 176.07 2oo3 n VAL 200 N 4.14 0.03 -3.81 2.92 0.24 -1.26 -1.34 118.33 119.25 2oo3 n VAL 200 Ca 0.02 -0.01 -0.29 0.00 -2.04 0.00 0.00 64.34 62.02 2oo3 n VAL 200 Cb 0.40 -0.63 -0.16 0.00 -1.47 0.00 0.00 33.84 31.97 2oo3 n VAL 200 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2oo3 s ASN 201 N -4.17 3.41 0.35 -1.34 3.84 -1.26 -4.84 114.94 110.93 2oo3 s ASN 201 Ca -0.01 -1.07 0.12 0.00 0.21 0.00 0.00 52.86 52.11 2oo3 s ASN 201 Cb 0.00 -0.85 0.91 0.00 -0.55 0.00 0.00 41.25 40.76 2oo3 s ASN 201 CO 0.01 -0.29 1.79 0.50 -2.79 0.00 0.00 177.10 176.32 2oo3 h LYS 202 N 8.11 0.57 -0.48 0.43 1.63 -1.96 -1.32 116.57 123.55 2oo3 h LYS 202 Ca -0.16 -0.03 -0.07 0.00 -0.85 0.00 0.00 60.65 59.54 2oo3 h LYS 202 Cb 1.09 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 32.57 2oo3 h LYS 202 CO 0.38 0.38 0.05 0.00 -3.45 0.00 0.00 179.45 176.81 2oo3 h ALA 203 N 1.64 0.65 -0.18 5.00 0.00 -1.99 0.12 119.26 124.49 2oo3 h ALA 203 Ca 0.56 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 2oo3 h ALA 203 Cb 1.12 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2oo3 h ALA 203 CO -0.32 0.41 0.03 -1.49 0.00 0.00 0.00 179.25 177.87 2oo3 h TRP 204 N 0.69 0.33 -0.85 0.00 6.55 -1.71 -1.91 115.95 119.06 2oo3 h TRP 204 Ca 0.14 -0.05 0.05 0.00 0.95 0.00 0.00 58.89 59.98 2oo3 h TRP 204 Cb 0.44 -0.09 -0.06 0.00 -0.86 0.00 0.00 29.16 28.60 2oo3 h TRP 204 CO 0.03 0.47 0.53 1.15 -1.05 0.00 0.00 178.44 179.57 2oo3 h THR 205 N 0.09 1.08 -0.26 1.49 2.02 -1.20 -1.68 112.91 114.46 2oo3 h THR 205 Ca 0.06 -0.34 -0.07 0.00 0.77 0.00 0.00 66.41 66.82 2oo3 h THR 205 Cb 0.32 -0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.71 2oo3 h THR 205 CO 0.00 0.18 -0.15 -0.33 0.37 0.00 0.00 175.52 175.60 2oo3 h GLU 206 N 1.00 0.44 -0.38 6.66 4.39 -0.80 0.12 114.58 126.01 2oo3 h GLU 206 Ca 0.35 -0.13 -0.16 0.00 0.34 0.00 0.00 59.36 59.76 2oo3 h GLU 206 Cb 0.09 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 2oo3 h GLU 206 CO -0.15 0.58 -0.40 1.96 -1.16 0.00 0.00 179.01 179.85 2oo3 h GLN 207 N 0.41 0.93 0.09 2.33 4.20 -0.95 -1.63 115.11 120.49 2oo3 h GLN 207 Ca 0.08 -0.50 0.01 0.00 0.06 0.00 0.00 58.65 58.29 2oo3 h GLN 207 Cb 0.50 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 2oo3 h GLN 207 CO 0.03 1.15 -0.11 0.35 -0.67 0.00 0.00 178.83 179.59 2oo3 h PHE 208 N 0.76 -0.27 -0.27 2.96 3.57 -0.98 -2.84 116.94 119.85 2oo3 h PHE 208 Ca 0.06 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 2oo3 h PHE 208 Cb 1.00 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.83 2oo3 h PHE 208 CO 0.06 -0.17 0.07 -0.07 -2.23 0.00 0.00 178.31 175.97 2oo3 h LEU 209 N -0.23 0.35 -0.56 0.59 3.38 -0.68 -0.95 115.31 117.21 2oo3 h LEU 209 Ca 0.01 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 2oo3 h LEU 209 Cb 0.23 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2oo3 h LEU 209 CO -0.04 0.36 0.02 -0.09 0.09 0.00 0.00 178.44 178.78 2oo3 h ARG 210 N 0.39 0.98 -0.51 1.13 2.43 -1.19 0.27 114.38 117.87 2oo3 h ARG 210 Ca 0.09 -0.30 -0.07 0.00 -0.81 0.00 0.00 59.98 58.89 2oo3 h ARG 210 Cb 0.15 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 2oo3 h ARG 210 CO -0.00 0.97 0.05 0.87 -1.51 0.00 0.00 179.97 180.35 2oo3 h LYS 211 N 0.86 0.87 -0.91 0.20 1.79 -1.19 -2.73 116.57 115.47 2oo3 h LYS 211 Ca 0.16 -0.25 -0.00 0.00 -2.18 0.00 0.00 60.65 58.38 2oo3 h LYS 211 Cb 0.52 -0.09 -0.04 0.00 -1.58 0.00 0.00 32.23 31.03 2oo3 h LYS 211 CO 0.03 0.87 0.55 0.52 -1.08 0.00 0.00 179.45 180.34 2oo3 h MET 212 N 0.75 1.23 -0.34 3.15 2.86 -0.90 -2.73 114.93 118.94 2oo3 h MET 212 Ca 0.15 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.65 2oo3 h MET 212 Cb 0.44 -0.26 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 2oo3 h MET 212 CO 0.02 0.86 0.08 -0.09 1.06 0.00 0.00 176.91 178.84 2oo3 h ARG 213 N 1.25 0.49 0.00 1.72 2.43 -0.76 -2.44 114.38 117.07 2oo3 h ARG 213 Ca 0.33 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.41 2oo3 h ARG 213 Cb -0.06 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.40 2oo3 h ARG 213 CO -0.06 0.46 -0.05 0.93 -1.51 0.00 0.00 179.97 179.74 2oo3 h GLU 214 N 0.49 0.00 -0.14 0.20 5.08 -1.18 -3.28 114.58 115.75 2oo3 h GLU 214 Ca 0.12 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.39 2oo3 h GLU 214 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2oo3 h GLU 214 CO -0.00 0.05 -0.24 0.82 -1.00 0.00 0.00 179.01 178.64 2oo3 h ILE 215 N 0.00 1.37 -1.81 3.13 2.04 -1.50 -3.47 117.51 117.27 2oo3 h ILE 215 Ca -0.00 -1.49 0.00 0.00 1.00 0.00 0.00 64.86 64.37 2oo3 h ILE 215 Cb 0.34 2.01 -0.22 0.00 -0.74 0.00 0.00 36.82 38.21 2oo3 h ILE 215 CO 0.01 0.44 0.31 -0.55 0.00 0.00 0.00 178.15 178.36 2oo3 s SER 216 N -6.30 -0.58 0.00 1.72 0.15 -1.24 -5.02 113.70 102.43 2oo3 s SER 216 Ca -0.14 0.92 0.26 0.00 0.70 0.00 0.00 55.95 57.69 2oo3 s SER 216 Cb 0.05 0.86 0.59 0.00 -1.71 0.00 0.00 66.02 65.81 2oo3 s SER 216 CO 0.77 -0.33 1.47 -1.20 1.20 0.00 0.00 173.24 175.15 2oo3 n SER 217 N 1.74 1.87 -4.30 5.45 7.64 -1.26 -4.50 113.62 120.27 2oo3 n SER 217 Ca -0.14 -1.50 -0.44 0.00 1.01 0.00 0.00 58.87 57.80 2oo3 n SER 217 Cb 0.56 0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.87 2oo3 n SER 217 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2oo3 n LYS 218 N 0.26 3.53 -3.93 1.43 5.02 -1.26 -2.26 118.16 120.96 2oo3 n LYS 218 Ca 0.15 -3.97 -0.09 0.00 -2.02 0.00 0.00 58.31 52.38 2oo3 n LYS 218 Cb 0.44 -2.88 -0.09 0.00 -0.02 0.00 0.00 35.03 32.47 2oo3 n LYS 218 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2oo3 s SER 219 N 1.81 0.19 -0.00 4.39 1.04 -1.26 -1.00 113.70 118.87 2oo3 s SER 219 Ca 0.39 -0.57 0.02 0.00 0.48 0.00 0.00 55.95 56.27 2oo3 s SER 219 Cb -0.01 0.24 -0.01 0.00 0.10 0.00 0.00 66.02 66.34 2oo3 s SER 219 CO -0.01 -0.53 -0.06 0.54 0.98 0.00 0.00 173.24 174.16 2oo3 s VAL 220 N -2.80 0.47 -0.12 5.02 0.11 -0.07 -0.47 120.40 122.54 2oo3 s VAL 220 Ca -0.03 -0.33 0.01 0.00 -2.93 0.00 0.00 61.98 58.70 2oo3 s VAL 220 Cb -0.00 -0.41 -0.01 0.00 -1.53 0.00 0.00 36.38 34.43 2oo3 s VAL 220 CO -0.05 0.09 -0.16 -0.60 -3.33 0.00 0.00 175.10 171.04 2oo3 s ARG 221 N -0.27 3.30 0.01 1.54 3.52 0.77 -0.58 118.95 127.25 2oo3 s ARG 221 Ca 0.01 -0.73 0.07 0.00 -0.13 0.00 0.00 55.73 54.95 2oo3 s ARG 221 Cb -0.03 -2.55 -0.02 0.00 -1.56 0.00 0.00 34.95 30.79 2oo3 s ARG 221 CO -0.00 0.20 -0.23 0.96 -0.81 0.00 0.00 175.30 175.43 2oo3 s ILE 222 N 0.35 1.80 0.03 4.11 -4.36 -0.15 -0.83 121.20 122.16 2oo3 s ILE 222 Ca -0.13 -1.09 -0.03 0.00 -0.26 0.00 0.00 60.65 59.14 2oo3 s ILE 222 Cb -0.16 -1.52 -0.02 0.00 1.25 0.00 0.00 42.46 42.01 2oo3 s ILE 222 CO 0.06 0.40 0.03 -1.61 0.24 0.00 0.00 174.94 174.06 2oo3 s GLU 223 N -0.81 0.45 -0.07 0.37 2.02 -0.38 -0.59 118.70 119.69 2oo3 s GLU 223 Ca 0.09 -0.70 0.00 0.00 0.02 0.00 0.00 54.97 54.39 2oo3 s GLU 223 Cb -0.09 0.17 0.02 0.00 0.10 0.00 0.00 34.13 34.33 2oo3 s GLU 223 CO 0.00 -0.09 -0.06 -1.17 0.02 0.00 0.00 175.26 173.97 2oo3 s LEU 224 N -1.81 1.21 -0.11 1.80 2.96 -0.25 -1.86 118.68 120.61 2oo3 s LEU 224 Ca -0.10 -0.19 0.02 0.00 -0.22 0.00 0.00 54.13 53.64 2oo3 s LEU 224 Cb -0.05 -0.60 0.01 0.00 0.50 0.00 0.00 46.19 46.06 2oo3 s LEU 224 CO -0.03 -0.08 -0.17 -1.00 -1.32 0.00 0.00 176.35 173.75 2oo3 s HIS 225 N 1.25 2.15 0.07 5.38 3.76 0.47 -1.43 115.29 126.93 2oo3 s HIS 225 Ca -0.05 -1.02 0.17 0.00 -0.15 0.00 0.00 55.06 54.01 2oo3 s HIS 225 Cb -0.14 -1.52 0.44 0.00 1.11 0.00 0.00 32.58 32.48 2oo3 s HIS 225 CO -0.02 -0.50 1.62 -0.07 -0.85 0.00 0.00 174.74 174.92 2oo3 h LEU 226 N 7.36 0.00 -2.55 0.89 3.38 -1.34 -0.00 115.31 123.04 2oo3 h LEU 226 Ca -0.31 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.21 2oo3 h LEU 226 Cb 1.18 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.97 2oo3 h LEU 226 CO 0.50 0.45 -0.91 0.59 0.09 0.00 0.00 178.44 179.17 2oo3 n ASN 227 N -3.43 -2.97 -4.76 -0.43 3.02 -1.25 -3.94 115.26 101.50 2oo3 n ASN 227 Ca 0.00 -0.98 -0.29 0.00 -0.03 0.00 0.00 54.58 53.28 2oo3 n ASN 227 Cb 0.60 -3.37 0.13 0.00 -0.61 0.00 0.00 39.78 36.53 2oo3 n ASN 227 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2oo3 s PRO 228 N -6.17 1.39 0.06 3.52 0.04 -1.26 -4.85 135.00 127.72 2oo3 s PRO 228 Ca 0.24 0.55 0.26 0.00 0.04 0.00 0.00 61.00 62.10 2oo3 s PRO 228 Cb -0.09 -1.85 0.77 0.00 0.04 0.00 0.00 34.50 33.38 2oo3 s PRO 228 CO 0.86 -2.08 1.63 1.28 0.04 0.00 0.00 177.00 178.73 2oo3 n LEU 229 N -3.73 0.43 -4.40 -3.56 4.77 -1.26 -4.65 117.00 104.59 2oo3 n LEU 229 Ca 0.07 0.32 -0.34 0.00 -0.03 0.00 0.00 56.01 56.02 2oo3 n LEU 229 Cb 0.57 -0.33 -0.13 0.00 -2.33 0.00 0.00 43.42 41.20 2oo3 n LEU 229 CO 0.57 -0.01 -0.37 -0.63 -1.33 0.00 0.00 177.39 175.62 2oo3 s ILE 230 N -3.05 3.61 -1.29 -0.08 -1.09 -1.26 -5.04 121.20 112.99 2oo3 s ILE 230 Ca 0.11 -0.44 -0.12 0.00 -2.23 0.00 0.00 60.65 57.97 2oo3 s ILE 230 Cb 0.16 -2.61 0.14 0.00 -1.58 0.00 0.00 42.46 38.58 2oo3 s ILE 230 CO 0.63 0.46 1.78 0.59 -1.23 0.00 0.00 174.94 177.17 2oo3 n ASN 231 N 4.13 4.94 -4.10 3.58 3.02 -1.26 -4.92 115.26 120.64 2oo3 n ASN 231 Ca -0.18 -3.01 -0.26 0.00 -0.03 0.00 0.00 54.58 51.10 2oo3 n ASN 231 Cb 0.52 -1.56 -0.16 0.00 -0.61 0.00 0.00 39.78 37.96 2oo3 n ASN 231 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2oo3 s GLU 232 N 1.55 1.96 3.09 3.52 2.12 -1.26 -5.06 118.70 124.62 2oo3 s GLU 232 Ca 0.43 -0.57 0.00 0.00 0.36 0.00 0.00 54.97 55.19 2oo3 s GLU 232 Cb 0.06 -1.61 0.00 0.00 0.26 0.00 0.00 34.13 32.84 2oo3 s GLU 232 CO -0.00 0.14 0.00 0.41 -0.54 0.00 0.00 175.26 175.26 2oo3 n GLY 233 N 3.50 0.06 3.58 -1.50 0.00 -1.26 -4.63 105.19 104.94 2oo3 n GLY 233 Ca -0.20 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 2oo3 n GLY 233 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2oo3 s MET 234 N 0.00 3.61 0.00 1.61 -2.45 -1.26 -4.54 119.30 116.27 2oo3 s MET 234 Ca 0.00 0.33 0.24 0.00 -1.25 0.00 0.00 55.69 55.01 2oo3 s MET 234 Cb 0.00 -3.92 0.30 0.00 1.25 0.00 0.00 34.83 32.45 2oo3 s MET 234 CO 0.00 -1.32 1.27 0.25 1.05 0.00 0.00 175.02 176.27 2oo3 n THR 235 N 6.62 0.00 -3.93 10.11 -2.24 -0.45 -4.98 114.28 119.42 2oo3 n THR 235 Ca 0.09 -0.11 -0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2oo3 n THR 235 Cb 0.49 0.73 0.01 0.00 -2.10 0.00 0.00 70.33 69.46 2oo3 n THR 235 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2oo3 s GLY 236 N -2.69 -0.02 0.33 3.38 0.00 -1.22 -1.00 107.32 106.09 2oo3 s GLY 236 Ca 0.17 -0.12 -0.18 0.00 0.00 0.00 0.00 44.72 44.59 2oo3 s GLY 236 CO 0.64 3.94 0.74 0.00 0.00 0.00 0.00 173.10 178.42 2oo3 s GLY 238 N -3.00 0.56 0.01 0.00 0.00 0.57 -1.09 107.32 104.37 2oo3 s GLY 238 Ca 0.14 -0.87 0.03 0.00 0.00 0.00 0.00 44.72 44.02 2oo3 s GLY 238 CO 0.09 -0.54 -0.10 1.08 0.00 0.00 0.00 173.10 173.63 2oo3 s LEU 239 N -3.05 2.09 -0.19 0.66 1.02 0.24 -1.09 118.68 118.36 2oo3 s LEU 239 Ca 0.21 -0.29 -0.02 0.00 0.02 0.00 0.00 54.13 54.04 2oo3 s LEU 239 Cb -0.02 -0.47 -0.01 0.00 0.02 0.00 0.00 46.19 45.71 2oo3 s LEU 239 CO 0.11 0.05 -0.08 0.86 0.02 0.00 0.00 176.35 177.31 2oo3 s TRP 240 N -0.53 2.91 -0.13 0.29 -0.11 -0.15 -0.97 118.94 120.25 2oo3 s TRP 240 Ca 0.01 -0.91 0.02 0.00 1.22 0.00 0.00 56.10 56.44 2oo3 s TRP 240 Cb -0.05 -2.01 0.01 0.00 -1.50 0.00 0.00 33.47 29.91 2oo3 s TRP 240 CO 0.00 -0.47 -0.20 0.42 -4.62 0.00 0.00 176.95 172.08 2oo3 s ILE 241 N 1.13 1.93 -0.17 5.86 1.01 0.26 -1.39 121.20 129.83 2oo3 s ILE 241 Ca 0.01 -0.90 -0.10 0.00 0.00 0.00 0.00 60.65 59.66 2oo3 s ILE 241 Cb -0.14 -1.71 -0.05 0.00 0.01 0.00 0.00 42.46 40.57 2oo3 s ILE 241 CO -0.02 0.52 0.15 -0.63 0.00 0.00 0.00 174.94 174.97 2oo3 s ILE 242 N 0.83 5.42 -1.01 2.92 1.01 -0.04 -0.89 121.20 129.45 2oo3 s ILE 242 Ca -0.08 0.24 -0.00 0.00 0.00 0.00 0.00 60.65 60.81 2oo3 s ILE 242 Cb -0.15 -3.47 -0.00 0.00 0.01 0.00 0.00 42.46 38.85 2oo3 s ILE 242 CO -0.01 0.49 0.84 0.59 0.00 0.00 0.00 174.94 176.85 2oo3 n ASN 243 N 3.04 -2.10 -4.76 3.58 3.02 -0.17 -2.19 115.26 115.68 2oo3 n ASN 243 Ca -0.17 -0.52 -0.34 0.00 -0.03 0.00 0.00 54.58 53.52 2oo3 n ASN 243 Cb 0.53 -4.39 0.04 0.00 -0.61 0.00 0.00 39.78 35.34 2oo3 n ASN 243 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2oo3 s PRO 244 N -5.13 2.91 0.56 3.52 0.04 -1.26 -4.79 135.00 130.85 2oo3 s PRO 244 Ca 0.01 1.55 -0.20 0.00 0.04 0.00 0.00 61.00 62.40 2oo3 s PRO 244 Cb -0.00 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.54 2oo3 s PRO 244 CO 0.61 -1.19 1.20 -2.14 0.04 0.00 0.00 177.00 175.53 2oo3 s PRO 245 N -3.73 3.20 -0.41 0.56 0.02 -1.26 -4.95 135.00 128.43 2oo3 s PRO 245 Ca 0.71 1.82 -0.38 0.00 0.02 0.00 0.00 61.00 63.18 2oo3 s PRO 245 Cb -0.24 -2.06 -0.16 0.00 0.02 0.00 0.00 34.50 32.06 2oo3 s PRO 245 CO 0.36 -1.03 1.44 0.98 -0.33 0.00 0.00 177.00 178.43 2oo3 n TYR 246 N -1.29 1.29 -0.27 6.54 9.36 -1.26 -1.83 117.16 129.70 2oo3 n TYR 246 Ca 0.12 0.84 0.00 0.00 3.32 0.00 0.00 57.90 62.18 2oo3 n TYR 246 Cb 0.49 -1.84 0.00 0.00 -0.63 0.00 0.00 39.34 37.36 2oo3 n TYR 246 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 2oo3 n THR 247 N 3.90 0.00 -0.10 2.97 -2.24 -1.26 -4.95 114.28 112.60 2oo3 n THR 247 Ca 0.31 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 62.00 2oo3 n THR 247 Cb -0.04 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.16 2oo3 n THR 247 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 2oo3 h PHE 248 N 0.00 0.48 -0.75 4.78 3.57 -1.73 -2.05 116.94 121.24 2oo3 h PHE 248 Ca 0.00 -0.04 0.16 0.00 3.53 0.00 0.00 57.97 61.62 2oo3 h PHE 248 Cb 0.00 -0.14 -0.11 0.00 2.79 0.00 0.00 35.95 38.49 2oo3 h PHE 248 CO 0.00 0.47 0.19 -1.35 -2.23 0.00 0.00 178.31 175.39 2oo3 h PRO 249 N 0.36 0.27 0.00 6.41 0.11 -1.92 0.86 132.00 138.08 2oo3 h PRO 249 Ca 0.10 -0.02 -0.23 0.00 0.11 0.00 0.00 66.00 65.97 2oo3 h PRO 249 Cb 0.20 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.25 2oo3 h PRO 249 CO -0.01 0.18 -0.94 0.66 -0.21 0.00 0.00 178.00 177.68 2oo3 h SER 250 N 0.28 0.53 -0.22 -2.05 4.64 -1.93 -2.70 113.55 112.09 2oo3 h SER 250 Ca 0.42 -0.43 0.01 0.00 -0.47 0.00 0.00 61.79 61.32 2oo3 h SER 250 Cb 0.72 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 2oo3 h SER 250 CO -0.51 1.23 0.13 -0.33 -0.87 0.00 0.00 176.83 176.48 2oo3 h GLU 251 N 0.23 0.27 0.00 4.77 5.08 -1.03 -3.03 114.58 120.86 2oo3 h GLU 251 Ca -0.08 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 2oo3 h GLU 251 Cb 1.58 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.76 2oo3 h GLU 251 CO 0.16 0.18 -0.27 0.97 -1.00 0.00 0.00 179.01 179.05 2oo3 h ILE 252 N 0.27 0.91 -0.45 3.13 6.09 -0.81 -1.89 117.51 124.77 2oo3 h ILE 252 Ca 0.09 -1.02 -0.00 0.00 -1.37 0.00 0.00 64.86 62.56 2oo3 h ILE 252 Cb -0.01 1.59 -0.02 0.00 0.47 0.00 0.00 36.82 38.85 2oo3 h ILE 252 CO -0.04 0.26 0.27 0.50 -3.07 0.00 0.00 178.15 176.07 2oo3 h LYS 253 N 0.00 0.61 -0.64 2.19 3.64 -1.40 0.32 116.57 121.29 2oo3 h LYS 253 Ca -0.00 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2oo3 h LYS 253 Cb 0.57 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.23 2oo3 h LYS 253 CO 0.03 0.46 0.39 1.25 -2.27 0.00 0.00 179.45 179.31 2oo3 h LEU 254 N 0.60 0.78 0.23 5.20 5.85 -1.25 -0.50 115.31 126.22 2oo3 h LEU 254 Ca 0.16 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2oo3 h LEU 254 Cb 0.00 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.84 2oo3 h LEU 254 CO -0.03 0.61 -0.11 0.58 -0.34 0.00 0.00 178.44 179.15 2oo3 h VAL 255 N 0.87 0.80 -0.78 1.05 2.07 -1.04 -1.49 116.25 117.73 2oo3 h VAL 255 Ca 0.23 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.60 2oo3 h VAL 255 Cb -0.02 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 2oo3 h VAL 255 CO -0.04 0.03 0.47 -0.07 0.02 0.00 0.00 177.57 177.98 2oo3 h LEU 256 N -0.39 0.94 -0.31 2.57 3.38 -0.82 -0.21 115.31 120.47 2oo3 h LEU 256 Ca -0.03 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 57.90 2oo3 h LEU 256 Cb 0.30 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2oo3 h LEU 256 CO 0.05 0.73 0.11 -0.33 0.09 0.00 0.00 178.44 179.10 2oo3 h GLU 257 N 1.07 0.24 -0.37 1.13 5.08 -1.00 -2.03 114.58 118.71 2oo3 h GLU 257 Ca 0.28 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.67 2oo3 h GLU 257 Cb -0.03 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 2oo3 h GLU 257 CO -0.05 0.16 0.13 1.15 -1.00 0.00 0.00 179.01 179.40 2oo3 h THR 258 N 0.25 0.90 -0.63 1.13 2.02 -0.59 -2.97 112.91 113.02 2oo3 h THR 258 Ca 0.14 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.22 2oo3 h THR 258 Cb 0.10 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 2oo3 h THR 258 CO -0.14 0.05 0.40 -0.07 0.37 0.00 0.00 175.52 176.13 2oo3 h LEU 259 N 0.28 0.73 -1.20 2.58 3.38 -0.74 -1.27 115.31 119.08 2oo3 h LEU 259 Ca 0.17 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2oo3 h LEU 259 Cb 0.14 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2oo3 h LEU 259 CO -0.17 0.55 0.00 0.71 0.09 0.00 0.00 178.44 179.62 2oo3 h THR 260 N 0.86 0.00 0.00 0.22 1.35 -1.21 0.91 112.91 115.04 2oo3 h THR 260 Ca 0.23 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.84 2oo3 h THR 260 Cb -0.07 1.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.39 2oo3 h THR 260 CO -0.05 0.00 0.00 0.71 -0.25 0.00 0.00 175.52 175.93 2oo3 h THR 261 N 0.00 0.00 0.00 6.82 1.35 -1.19 -3.35 112.91 116.54 2oo3 h THR 261 Ca 0.00 -0.77 -0.38 0.00 -0.55 0.00 0.00 66.41 64.71 2oo3 h THR 261 Cb 0.32 1.76 -0.07 0.00 -1.73 0.00 0.00 68.15 68.43 2oo3 h THR 261 CO 0.00 0.00 -2.41 -1.22 -0.25 0.00 0.00 175.52 171.64 2oo3 n TYR 262 N -2.79 0.04 -3.54 4.73 4.01 -0.21 -4.57 117.16 114.82 2oo3 n TYR 262 Ca 0.04 0.01 -0.40 0.00 -0.16 0.00 0.00 57.90 57.39 2oo3 n TYR 262 Cb 0.47 -1.01 -0.11 0.00 -0.31 0.00 0.00 39.34 38.39 2oo3 n TYR 262 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2oo3 s PHE 263 N -2.51 3.22 -1.29 -0.72 0.08 0.14 -4.53 117.98 112.39 2oo3 s PHE 263 Ca -0.22 -0.30 -0.19 0.00 0.12 0.00 0.00 56.93 56.34 2oo3 s PHE 263 Cb 0.07 -2.47 0.02 0.00 -0.57 0.00 0.00 43.02 40.07 2oo3 s PHE 263 CO 0.72 -0.39 0.55 -1.71 -0.10 0.00 0.00 175.22 174.29 2oo3 n ASN 264 N 5.09 -2.90 -4.75 1.36 5.15 -1.26 -4.29 115.26 113.66 2oo3 n ASN 264 Ca -0.13 -1.18 -0.37 0.00 -0.60 0.00 0.00 54.58 52.30 2oo3 n ASN 264 Cb 0.49 -2.33 0.04 0.00 -0.53 0.00 0.00 39.78 37.45 2oo3 n ASN 264 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2oo3 s PRO 265 N -6.91 3.08 0.00 1.20 0.04 -1.26 -1.26 135.00 129.89 2oo3 s PRO 265 Ca 0.32 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.42 2oo3 s PRO 265 Cb -0.15 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.25 2oo3 s PRO 265 CO 0.94 -1.18 0.00 0.41 0.04 0.00 0.00 177.00 177.20 2oo3 n GLY 266 N 0.68 3.05 0.00 0.56 0.00 -1.26 -4.73 105.19 103.49 2oo3 n GLY 266 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2oo3 n GLY 266 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2oo3 n SER 267 N 0.20 4.84 -4.78 1.61 7.64 -0.39 -5.07 113.62 117.67 2oo3 n SER 267 Ca 0.00 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.56 2oo3 n SER 267 Cb 0.00 0.59 0.06 0.00 -1.01 0.00 0.00 64.21 63.86 2oo3 n SER 267 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2oo3 s SER 268 N -2.71 4.97 0.23 6.43 1.04 -0.53 -4.59 113.70 118.55 2oo3 s SER 268 Ca 0.00 1.85 -0.08 0.00 0.48 0.00 0.00 55.95 58.20 2oo3 s SER 268 Cb 0.00 -2.53 -0.02 0.00 0.10 0.00 0.00 66.02 63.57 2oo3 s SER 268 CO 0.00 -1.72 0.36 -0.94 0.98 0.00 0.00 173.24 171.92 2oo3 s SER 269 N -3.10 0.03 0.13 7.02 1.04 -0.02 -5.00 113.70 113.80 2oo3 s SER 269 Ca 0.63 -1.11 -0.06 0.00 0.48 0.00 0.00 55.95 55.90 2oo3 s SER 269 Cb -0.18 0.52 -0.02 0.00 0.10 0.00 0.00 66.02 66.44 2oo3 s SER 269 CO 0.49 -1.04 0.17 -0.72 0.98 0.00 0.00 173.24 173.11 2oo3 s TYR 270 N -4.04 0.53 0.08 5.02 -0.85 -1.26 -0.40 117.35 116.43 2oo3 s TYR 270 Ca 0.28 -0.92 -0.08 0.00 -0.52 0.00 0.00 57.07 55.83 2oo3 s TYR 270 Cb 0.02 -0.22 -0.00 0.00 0.38 0.00 0.00 41.96 42.13 2oo3 s TYR 270 CO 0.10 -0.60 0.17 0.00 -1.52 0.00 0.00 175.55 173.71 2oo3 s MET 271 N -3.98 0.80 -0.03 -3.49 0.23 -0.78 -4.99 119.30 107.07 2oo3 s MET 271 Ca 0.17 -0.92 -0.01 0.00 -1.03 0.00 0.00 55.69 53.90 2oo3 s MET 271 Cb 0.05 0.32 0.03 0.00 -1.53 0.00 0.00 34.83 33.71 2oo3 s MET 271 CO -0.02 -0.24 0.06 0.42 -2.03 0.00 0.00 175.02 173.21 2oo3 s ILE 272 N -3.65 -0.07 -0.04 3.16 1.01 -1.26 -1.25 121.20 119.10 2oo3 s ILE 272 Ca 0.03 0.24 -0.01 0.00 0.00 0.00 0.00 60.65 60.91 2oo3 s ILE 272 Cb 0.04 -0.13 0.03 0.00 0.01 0.00 0.00 42.46 42.41 2oo3 s ILE 272 CO -0.10 0.10 0.02 -0.70 0.00 0.00 0.00 174.94 174.26 2oo3 s GLU 273 N 1.24 0.22 0.14 2.79 2.12 -0.01 -4.99 118.70 120.21 2oo3 s GLU 273 Ca -0.07 0.17 0.04 0.00 0.36 0.00 0.00 54.97 55.47 2oo3 s GLU 273 Cb -0.13 -0.55 -0.04 0.00 0.26 0.00 0.00 34.13 33.67 2oo3 s GLU 273 CO -0.04 -0.22 0.12 -1.54 -0.54 0.00 0.00 175.26 173.04 2oo3 s SER 274 N 1.49 5.52 1.23 -1.70 1.04 -1.26 -0.16 113.70 119.86 2oo3 s SER 274 Ca -0.03 -0.09 -0.19 0.00 0.48 0.00 0.00 55.95 56.12 2oo3 s SER 274 Cb -0.13 -1.45 0.30 0.00 0.10 0.00 0.00 66.02 64.84 2oo3 s SER 274 CO -0.03 0.10 1.06 -0.83 0.98 0.00 0.00 173.24 174.52 2oo3 s GLY 275 N -2.89 1.53 0.30 7.32 0.00 0.38 -4.88 107.32 109.09 2oo3 s GLY 275 Ca 0.30 -0.78 0.24 0.00 0.00 0.00 0.00 44.72 44.48 2oo3 s GLY 275 CO 0.23 0.09 1.73 1.48 0.00 0.00 0.00 173.10 176.63 2oo3 h SER 276 N -2.72 0.00 -0.11 1.64 4.64 -1.89 -2.44 113.55 112.68 2oo3 h SER 276 Ca -0.47 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.80 2oo3 h SER 276 Cb 1.31 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.38 2oo3 h SER 276 CO 0.37 0.00 -0.28 0.29 -0.87 0.00 0.00 176.83 176.35 2oo3 n LYS 277 N -2.32 1.68 -4.04 4.77 5.02 -0.96 -5.01 118.16 117.31 2oo3 n LYS 277 Ca 0.01 -3.13 -0.18 0.00 -2.02 0.00 0.00 58.31 53.00 2oo3 n LYS 277 Cb 0.18 -1.66 -0.16 0.00 -0.02 0.00 0.00 35.03 33.37 2oo3 n LYS 277 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2oo3 s LEU 278 N -3.16 1.35 0.00 -0.35 1.98 -0.92 -4.66 118.68 112.93 2oo3 s LEU 278 Ca 0.39 -0.07 0.00 0.00 -2.89 0.00 0.00 54.13 51.56 2oo3 s LEU 278 Cb 0.36 -0.29 0.00 0.00 0.66 0.00 0.00 46.19 46.92 2oo3 s LEU 278 CO -0.03 -0.06 0.00 0.00 -1.89 0.00 0.00 176.35 174.37