#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aj8 n ALA 7 N 0.00 4.53 -1.86 -1.18 0.00 -1.26 -5.01 120.51 115.72 1aj8 n ALA 7 Ca 0.00 -4.50 -0.42 0.00 0.00 0.00 0.00 53.44 48.52 1aj8 n ALA 7 Cb 0.00 -2.72 -0.03 0.00 0.00 0.00 0.00 19.45 16.70 1aj8 n ALA 7 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1aj8 s LYS 8 N -0.41 4.18 0.00 0.00 1.02 -1.26 -0.58 119.74 122.68 1aj8 s LYS 8 Ca 0.36 2.40 0.00 0.00 0.02 0.00 0.00 55.97 58.75 1aj8 s LYS 8 Cb -0.01 -3.68 0.00 0.00 -0.52 0.00 0.00 37.83 33.62 1aj8 s LYS 8 CO -0.00 -0.79 0.00 0.41 -0.92 0.00 0.00 175.35 174.05 1aj8 n GLY 9 N 4.11 0.51 2.39 -3.33 0.00 -1.26 -2.93 105.19 104.67 1aj8 n GLY 9 Ca 0.17 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.02 1aj8 n GLY 9 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1aj8 n LEU 10 N 0.00 -1.49 -4.69 0.99 4.77 0.25 -4.86 117.00 111.97 1aj8 n LEU 10 Ca 0.00 0.16 -0.44 0.00 -0.03 0.00 0.00 56.01 55.71 1aj8 n LEU 10 Cb 0.08 -2.54 -0.03 0.00 -2.33 0.00 0.00 43.42 38.59 1aj8 n LEU 10 CO 0.00 -0.35 1.45 1.21 -1.33 0.00 0.00 177.39 178.37 1aj8 n GLU 11 N -2.72 2.63 -1.79 3.23 2.13 -1.15 -2.12 120.64 120.85 1aj8 n GLU 11 Ca -0.19 0.96 -0.17 0.00 0.66 0.00 0.00 57.16 58.42 1aj8 n GLU 11 Cb 0.63 -2.83 -0.05 0.00 0.27 0.00 0.00 31.44 29.46 1aj8 n GLU 11 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1aj8 n ASP 12 N 5.53 -4.97 -4.57 4.31 8.00 -1.26 -4.92 116.55 118.67 1aj8 n ASP 12 Ca 0.19 0.25 -0.38 0.00 0.71 0.00 0.00 54.79 55.56 1aj8 n ASP 12 Cb 0.35 -3.99 -0.11 0.00 -0.02 0.00 0.00 41.12 37.35 1aj8 n ASP 12 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1aj8 s VAL 13 N -2.70 5.15 -0.29 2.53 1.01 -0.90 -5.05 120.40 120.15 1aj8 s VAL 13 Ca 0.00 0.11 -0.19 0.00 0.00 0.00 0.00 61.98 61.91 1aj8 s VAL 13 Cb 0.00 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.92 1aj8 s VAL 13 CO 0.00 0.27 0.56 -0.31 0.00 0.00 0.00 175.10 175.62 1aj8 s TYR 14 N 1.72 3.23 -1.71 5.22 1.51 -1.26 -4.96 117.35 121.10 1aj8 s TYR 14 Ca 0.07 0.54 0.25 0.00 -1.01 0.00 0.00 57.07 56.92 1aj8 s TYR 14 Cb -0.16 -2.86 0.50 0.00 -0.11 0.00 0.00 41.96 39.33 1aj8 s TYR 14 CO 0.10 -0.40 1.40 0.44 -1.11 0.00 0.00 175.55 175.98 1aj8 n ILE 15 N 5.30 0.00 0.00 2.71 -5.35 -1.26 -5.00 119.36 115.75 1aj8 n ILE 15 Ca -0.03 -0.14 0.00 0.00 -0.27 0.00 0.00 62.75 62.31 1aj8 n ILE 15 Cb 0.49 0.62 0.00 0.00 -1.74 0.00 0.00 39.64 39.01 1aj8 n ILE 15 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1aj8 n ASP 16 N -0.62 0.00 -4.91 7.28 2.03 -1.26 -5.15 116.55 113.91 1aj8 n ASP 16 Ca 0.10 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.13 1aj8 n ASP 16 Cb 0.38 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.74 1aj8 n ASP 16 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1aj8 s GLN 17 N -2.00 3.59 -0.01 -0.67 -0.21 -1.26 -5.11 119.66 114.00 1aj8 s GLN 17 Ca 0.00 -0.12 -0.11 0.00 0.02 0.00 0.00 55.36 55.15 1aj8 s GLN 17 Cb 0.00 -2.71 0.01 0.00 1.00 0.00 0.00 33.01 31.31 1aj8 s GLN 17 CO 0.00 0.28 0.23 -0.08 -2.12 0.00 0.00 175.29 173.60 1aj8 s THR 18 N -2.02 0.07 0.00 -0.19 -1.32 -1.26 -5.01 115.64 105.91 1aj8 s THR 18 Ca 0.42 -0.58 0.00 0.00 -1.21 0.00 0.00 61.69 60.32 1aj8 s THR 18 Cb -0.11 -0.54 0.00 0.00 -1.51 0.00 0.00 72.50 70.34 1aj8 s THR 18 CO 0.30 -0.32 0.76 -3.20 -2.21 0.00 0.00 174.62 169.95 1aj8 n ASN 19 N 1.33 1.44 -0.06 8.08 5.15 -1.26 -4.84 115.26 125.10 1aj8 n ASN 19 Ca -0.22 -1.56 -0.04 0.00 -0.60 0.00 0.00 54.58 52.16 1aj8 n ASN 19 Cb 0.56 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.78 1aj8 n ASN 19 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 1aj8 h ILE 20 N 0.26 0.23 -3.36 -1.44 2.04 -1.95 -3.41 117.51 109.87 1aj8 h ILE 20 Ca 0.00 -1.20 -0.17 0.00 1.00 0.00 0.00 64.86 64.49 1aj8 h ILE 20 Cb 0.37 0.46 -0.24 0.00 -0.74 0.00 0.00 36.82 36.67 1aj8 h ILE 20 CO 0.00 0.08 -0.50 0.00 0.00 0.00 0.00 178.15 177.73 1aj8 s TYR 22 N -0.43 2.48 -0.06 0.00 5.04 -0.77 -4.74 117.35 118.87 1aj8 s TYR 22 Ca -0.05 -0.81 0.06 0.00 -2.44 0.00 0.00 57.07 53.83 1aj8 s TYR 22 Cb -0.03 -1.63 -0.01 0.00 0.35 0.00 0.00 41.96 40.63 1aj8 s TYR 22 CO 0.01 -0.27 -0.24 0.42 -1.34 0.00 0.00 175.55 174.13 1aj8 s ILE 23 N -0.02 1.98 -0.56 3.14 1.01 -1.26 -1.39 121.20 124.10 1aj8 s ILE 23 Ca -0.08 -1.02 -0.04 0.00 0.00 0.00 0.00 60.65 59.51 1aj8 s ILE 23 Cb -0.15 -1.68 0.14 0.00 0.01 0.00 0.00 42.46 40.79 1aj8 s ILE 23 CO 0.05 0.55 0.38 -0.62 0.00 0.00 0.00 174.94 175.30 1aj8 s ASP 24 N -0.13 5.35 0.29 3.58 -1.08 0.25 -4.97 116.67 119.97 1aj8 s ASP 24 Ca -0.04 -2.52 -0.01 0.00 -0.52 0.00 0.00 52.55 49.46 1aj8 s ASP 24 Cb -0.14 -1.88 0.43 0.00 -1.46 0.00 0.00 42.92 39.88 1aj8 s ASP 24 CO 0.04 -0.46 1.87 1.23 0.52 0.00 0.00 175.17 178.36 1aj8 h GLY 25 N 7.49 0.93 1.64 2.66 0.00 -1.84 0.27 103.07 114.23 1aj8 h GLY 25 Ca -0.06 -0.48 -0.21 0.00 0.00 0.00 0.00 47.33 46.57 1aj8 h GLY 25 CO 0.72 0.46 -0.91 0.50 0.00 0.00 0.00 176.54 177.31 1aj8 h LYS 26 N 0.85 0.32 0.00 4.80 1.57 -1.94 -0.91 116.57 121.27 1aj8 h LYS 26 Ca 0.20 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1aj8 h LYS 26 Cb 0.19 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1aj8 h LYS 26 CO -0.02 1.04 -0.99 0.39 -0.57 0.00 0.00 179.45 179.31 1aj8 n GLU 27 N -3.71 0.17 -2.78 3.15 -0.58 -1.18 -4.69 120.64 111.02 1aj8 n GLU 27 Ca -0.05 -0.02 -0.09 0.00 -0.42 0.00 0.00 57.16 56.58 1aj8 n GLU 27 Cb 0.82 -1.54 0.04 0.00 -0.57 0.00 0.00 31.44 30.20 1aj8 n GLU 27 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1aj8 n GLY 28 N 1.43 0.08 3.35 0.62 0.00 0.90 -5.00 105.19 106.57 1aj8 n GLY 28 Ca 0.03 -0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 1aj8 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aj8 s LYS 29 N -4.87 1.90 -0.02 1.61 1.02 -0.83 -4.15 119.74 114.39 1aj8 s LYS 29 Ca 0.06 -1.06 0.01 0.00 0.02 0.00 0.00 55.97 55.00 1aj8 s LYS 29 Cb -0.03 -2.02 0.01 0.00 -0.52 0.00 0.00 37.83 35.28 1aj8 s LYS 29 CO 0.36 0.53 -0.01 -1.17 -0.92 0.00 0.00 175.35 174.14 1aj8 s LEU 30 N -1.14 1.52 -0.02 3.17 2.96 -1.26 -0.58 118.68 123.33 1aj8 s LEU 30 Ca 0.12 -0.04 0.03 0.00 -0.22 0.00 0.00 54.13 54.02 1aj8 s LEU 30 Cb -0.10 -0.19 -0.00 0.00 0.50 0.00 0.00 46.19 46.39 1aj8 s LEU 30 CO 0.02 -0.04 -0.11 -0.31 -1.32 0.00 0.00 176.35 174.59 1aj8 s TYR 31 N 0.56 1.01 -0.36 5.38 1.51 -0.49 -1.24 117.35 123.73 1aj8 s TYR 31 Ca -0.06 -0.22 -0.08 0.00 -1.01 0.00 0.00 57.07 55.70 1aj8 s TYR 31 Cb -0.09 -0.68 0.04 0.00 -0.11 0.00 0.00 41.96 41.13 1aj8 s TYR 31 CO -0.01 -0.06 0.15 0.71 -1.11 0.00 0.00 175.55 175.24 1aj8 s TYR 32 N -0.07 3.27 -1.48 2.71 2.02 0.37 -1.85 117.35 122.32 1aj8 s TYR 32 Ca 0.01 -1.34 -0.11 0.00 -0.37 0.00 0.00 57.07 55.26 1aj8 s TYR 32 Cb -0.06 -2.42 0.07 0.00 -0.40 0.00 0.00 41.96 39.15 1aj8 s TYR 32 CO 0.00 -0.73 0.82 0.54 -1.57 0.00 0.00 175.55 174.61 1aj8 n ARG 33 N 4.87 -5.01 0.00 -0.62 5.12 0.13 -1.81 116.66 119.35 1aj8 n ARG 33 Ca -0.12 0.62 0.00 0.00 -1.93 0.00 0.00 57.85 56.42 1aj8 n ARG 33 Cb 0.45 -5.47 0.00 0.00 -1.16 0.00 0.00 32.46 26.27 1aj8 n ARG 33 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1aj8 n GLY 34 N -1.55 1.57 3.63 -0.13 0.00 -1.26 -4.98 105.19 102.46 1aj8 n GLY 34 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1aj8 n GLY 34 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1aj8 s TYR 35 N -2.33 3.25 0.54 1.61 2.02 -0.75 -5.00 117.35 116.70 1aj8 s TYR 35 Ca 0.00 0.07 -0.21 0.00 -0.37 0.00 0.00 57.07 56.56 1aj8 s TYR 35 Cb 0.00 -2.11 -0.06 0.00 -0.40 0.00 0.00 41.96 39.40 1aj8 s TYR 35 CO 0.00 0.13 1.22 -1.13 -1.57 0.00 0.00 175.55 174.20 1aj8 n SER 36 N 3.67 2.05 0.18 2.29 3.41 -1.26 -0.48 113.62 123.47 1aj8 n SER 36 Ca -0.16 0.94 0.04 0.00 -0.26 0.00 0.00 58.87 59.43 1aj8 n SER 36 Cb 0.52 -1.50 0.45 0.00 -0.26 0.00 0.00 64.21 63.42 1aj8 n SER 36 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1aj8 h VAL 37 N 1.22 1.16 0.13 -3.33 3.04 -1.54 -2.43 116.25 114.48 1aj8 h VAL 37 Ca -0.49 -0.71 -0.01 0.00 -1.01 0.00 0.00 66.70 64.48 1aj8 h VAL 37 Cb 1.32 1.30 0.00 0.00 -2.01 0.00 0.00 31.29 31.90 1aj8 h VAL 37 CO 0.56 0.21 -0.06 -0.33 -1.01 0.00 0.00 177.57 176.94 1aj8 h GLU 38 N 0.09 -0.16 -0.65 4.17 3.07 -1.90 0.21 114.58 119.41 1aj8 h GLU 38 Ca 0.02 0.01 0.03 0.00 -0.50 0.00 0.00 59.36 58.92 1aj8 h GLU 38 Cb 0.36 0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 28.26 1aj8 h GLU 38 CO 0.02 -0.07 0.40 0.93 -1.40 0.00 0.00 179.01 178.89 1aj8 h GLU 39 N -0.22 0.75 -0.32 2.33 5.08 -1.87 -1.41 114.58 118.93 1aj8 h GLU 39 Ca -0.02 -0.05 -0.17 0.00 -1.00 0.00 0.00 59.36 58.12 1aj8 h GLU 39 Cb 0.17 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1aj8 h GLU 39 CO 0.03 0.50 -0.48 -0.07 -1.00 0.00 0.00 179.01 177.99 1aj8 h LEU 40 N 0.78 0.98 -1.56 1.33 3.38 -1.24 0.94 115.31 119.92 1aj8 h LEU 40 Ca 0.26 -0.51 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 1aj8 h LEU 40 Cb 0.03 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1aj8 h LEU 40 CO -0.11 1.30 0.02 0.00 0.09 0.00 0.00 178.44 179.74 1aj8 h ALA 41 N 0.71 1.65 0.12 1.53 0.00 -0.31 0.24 119.26 123.19 1aj8 h ALA 41 Ca 0.03 -0.11 -0.33 0.00 0.00 0.00 0.00 54.91 54.50 1aj8 h ALA 41 Cb 1.09 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1aj8 h ALA 41 CO 0.11 0.27 -1.72 1.49 0.00 0.00 0.00 179.25 179.41 1aj8 h GLU 42 N 0.31 0.25 0.00 0.00 4.81 -1.08 -3.42 114.58 115.45 1aj8 h GLU 42 Ca 0.07 -0.43 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 1aj8 h GLU 42 Cb 0.17 0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1aj8 h GLU 42 CO 0.00 1.10 -0.75 1.28 -0.73 0.00 0.00 179.01 179.91 1aj8 n LEU 43 N -3.43 0.21 0.00 1.64 4.77 0.31 -5.07 117.00 115.43 1aj8 n LEU 43 Ca -0.22 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.46 1aj8 n LEU 43 Cb 1.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.14 1aj8 n LEU 43 CO 0.48 0.05 0.00 -0.24 -1.33 0.00 0.00 177.39 176.35 1aj8 n SER 44 N -1.41 0.35 -4.20 -1.43 2.88 0.06 -5.03 113.62 104.84 1aj8 n SER 44 Ca 0.00 -1.00 -0.12 0.00 -1.33 0.00 0.00 58.87 56.43 1aj8 n SER 44 Cb 0.15 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.51 1aj8 n SER 44 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1aj8 s THR 45 N 0.65 0.31 0.11 2.46 -4.23 -1.26 -4.88 115.64 108.80 1aj8 s THR 45 Ca 0.00 -1.95 -0.22 0.00 -1.18 0.00 0.00 61.69 58.34 1aj8 s THR 45 Cb 0.00 -2.21 -0.09 0.00 1.34 0.00 0.00 72.50 71.54 1aj8 s THR 45 CO 0.00 -0.34 1.72 0.15 -0.54 0.00 0.00 174.62 175.61 1aj8 h PHE 46 N 2.72 -0.04 -0.77 3.99 3.57 -1.96 -0.68 116.94 123.77 1aj8 h PHE 46 Ca -0.36 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.25 1aj8 h PHE 46 Cb 1.21 0.03 -0.08 0.00 2.79 0.00 0.00 35.95 39.91 1aj8 h PHE 46 CO 0.45 -0.04 0.40 0.93 -2.23 0.00 0.00 178.31 177.82 1aj8 h GLU 47 N 0.01 0.63 -0.30 1.11 3.07 -1.97 0.18 114.58 117.31 1aj8 h GLU 47 Ca 0.05 -0.04 -0.14 0.00 -0.50 0.00 0.00 59.36 58.73 1aj8 h GLU 47 Cb 0.07 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.83 1aj8 h GLU 47 CO -0.09 0.42 -0.38 1.49 -1.40 0.00 0.00 179.01 179.04 1aj8 h GLU 48 N 0.65 0.70 -0.53 2.33 4.81 -1.90 -1.83 114.58 118.81 1aj8 h GLU 48 Ca 0.38 -0.35 -0.08 0.00 -0.13 0.00 0.00 59.36 59.18 1aj8 h GLU 48 Cb 0.42 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 1aj8 h GLU 48 CO -0.28 0.96 0.01 0.28 -0.73 0.00 0.00 179.01 179.25 1aj8 h VAL 49 N 0.58 1.26 -0.57 0.32 2.07 -0.06 -0.19 116.25 119.66 1aj8 h VAL 49 Ca 0.05 -1.08 -0.02 0.00 0.82 0.00 0.00 66.70 66.47 1aj8 h VAL 49 Cb 0.91 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 1aj8 h VAL 49 CO 0.08 0.38 0.28 0.58 0.02 0.00 0.00 177.57 178.91 1aj8 h VAL 50 N 0.80 1.20 -0.31 2.57 2.07 -0.57 0.79 116.25 122.81 1aj8 h VAL 50 Ca 0.15 -0.57 0.02 0.00 0.82 0.00 0.00 66.70 67.12 1aj8 h VAL 50 Cb 0.51 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1aj8 h VAL 50 CO 0.02 0.23 0.16 0.22 0.02 0.00 0.00 177.57 178.23 1aj8 h TYR 51 N 0.77 0.30 -0.31 1.57 5.03 -1.02 -1.71 116.97 121.60 1aj8 h TYR 51 Ca 0.20 0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.53 1aj8 h TYR 51 Cb 0.11 -0.09 -0.02 0.00 1.55 0.00 0.00 36.73 38.28 1aj8 h TYR 51 CO -0.00 0.17 0.19 1.25 -1.32 0.00 0.00 178.16 178.44 1aj8 h LEU 52 N 0.34 0.31 -1.08 2.82 5.85 -0.55 -1.31 115.31 121.69 1aj8 h LEU 52 Ca 0.13 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1aj8 h LEU 52 Cb 0.03 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 1aj8 h LEU 52 CO -0.08 0.23 0.55 -0.07 -0.34 0.00 0.00 178.44 178.72 1aj8 h LEU 53 N 0.39 1.03 0.17 2.25 3.38 -0.55 0.78 115.31 122.76 1aj8 h LEU 53 Ca 0.12 -0.05 -0.33 0.00 0.09 0.00 0.00 57.88 57.71 1aj8 h LEU 53 Cb -0.01 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.49 1aj8 h LEU 53 CO -0.05 0.77 -1.61 -0.50 0.09 0.00 0.00 178.44 177.13 1aj8 h TRP 54 N 1.20 0.66 -0.02 1.13 6.55 -1.14 -3.39 115.95 120.95 1aj8 h TRP 54 Ca 0.32 -0.49 0.00 0.00 0.95 0.00 0.00 58.89 59.67 1aj8 h TRP 54 Cb -0.09 -0.03 0.00 0.00 -0.86 0.00 0.00 29.16 28.19 1aj8 h TRP 54 CO 0.00 1.54 -0.16 0.91 -1.05 0.00 0.00 178.44 179.69 1aj8 n TRP 55 N -3.56 0.00 -0.27 0.49 8.01 -0.51 -5.02 117.44 116.58 1aj8 n TRP 55 Ca -0.20 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 55.99 1aj8 n TRP 55 Cb 1.07 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.37 1aj8 n TRP 55 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1aj8 n GLY 56 N 1.04 1.56 3.35 6.99 0.00 0.27 -5.02 105.19 113.38 1aj8 n GLY 56 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 1aj8 n GLY 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1aj8 s LYS 57 N -0.32 1.14 0.28 1.61 -2.85 -1.24 -5.00 119.74 113.37 1aj8 s LYS 57 Ca 0.00 -1.05 -0.29 0.00 -1.00 0.00 0.00 55.97 53.63 1aj8 s LYS 57 Cb 0.00 0.40 -0.10 0.00 -2.06 0.00 0.00 37.83 36.08 1aj8 s LYS 57 CO 0.00 -0.43 1.26 -0.51 0.10 0.00 0.00 175.35 175.77 1aj8 s LEU 58 N -2.92 4.45 0.64 2.77 1.43 -1.26 -3.98 118.68 119.81 1aj8 s LEU 58 Ca 0.13 2.51 -0.13 0.00 -1.03 0.00 0.00 54.13 55.61 1aj8 s LEU 58 Cb 0.03 -3.63 -0.01 0.00 0.03 0.00 0.00 46.19 42.60 1aj8 s LEU 58 CO -0.03 -0.44 1.06 -2.16 0.23 0.00 0.00 176.35 175.00 1aj8 s PRO 59 N -1.22 3.14 0.84 1.29 0.04 -1.26 -5.04 135.00 132.79 1aj8 s PRO 59 Ca 0.50 1.06 -0.11 0.00 0.04 0.00 0.00 61.00 62.49 1aj8 s PRO 59 Cb -0.37 -2.01 0.13 0.00 0.04 0.00 0.00 34.50 32.28 1aj8 s PRO 59 CO 0.46 -0.94 1.18 -1.54 0.04 0.00 0.00 177.00 176.20 1aj8 s SER 60 N -3.32 4.01 0.15 6.66 1.04 -1.26 -4.77 113.70 116.21 1aj8 s SER 60 Ca 0.60 0.39 -0.21 0.00 0.48 0.00 0.00 55.95 57.22 1aj8 s SER 60 Cb -0.15 -0.73 0.04 0.00 0.10 0.00 0.00 66.02 65.29 1aj8 s SER 60 CO 0.46 -2.16 1.65 0.25 0.98 0.00 0.00 173.24 174.42 1aj8 h LEU 61 N -1.14 -0.58 -0.71 2.42 7.12 -2.00 -1.08 115.31 119.34 1aj8 h LEU 61 Ca -0.44 0.12 -0.14 0.00 0.13 0.00 0.00 57.88 57.56 1aj8 h LEU 61 Cb 1.28 0.30 -0.01 0.00 -0.53 0.00 0.00 40.66 41.70 1aj8 h LEU 61 CO 0.51 -0.22 -0.52 0.77 -0.13 0.00 0.00 178.44 178.85 1aj8 h SER 62 N -0.16 0.36 -0.52 1.25 4.64 -1.99 -2.22 113.55 114.92 1aj8 h SER 62 Ca 0.15 -0.19 -0.05 0.00 -0.47 0.00 0.00 61.79 61.23 1aj8 h SER 62 Cb 0.38 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.34 1aj8 h SER 62 CO -0.36 0.82 0.14 -0.33 -0.87 0.00 0.00 176.83 176.22 1aj8 h GLU 63 N 0.26 0.82 -0.23 4.77 5.08 -1.81 -1.25 114.58 122.23 1aj8 h GLU 63 Ca 0.01 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.11 1aj8 h GLU 63 Cb 1.01 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 1aj8 h GLU 63 CO 0.09 0.78 -0.13 1.25 -1.00 0.00 0.00 179.01 180.00 1aj8 h LEU 64 N 0.71 0.50 -0.80 1.33 5.85 -1.15 -1.69 115.31 120.06 1aj8 h LEU 64 Ca 0.16 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.46 1aj8 h LEU 64 Cb 0.32 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 1aj8 h LEU 64 CO -0.00 0.81 0.48 -0.33 -0.34 0.00 0.00 178.44 179.06 1aj8 h GLU 65 N 0.19 1.09 -0.30 1.25 4.39 -1.32 1.00 114.58 120.88 1aj8 h GLU 65 Ca 0.05 -0.10 -0.14 0.00 0.34 0.00 0.00 59.36 59.50 1aj8 h GLU 65 Cb 0.63 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 29.05 1aj8 h GLU 65 CO 0.04 0.77 -0.39 -0.97 -1.16 0.00 0.00 179.01 177.30 1aj8 h ASN 66 N 1.10 0.76 -0.32 1.42 -0.73 -1.21 -2.02 115.58 114.58 1aj8 h ASN 66 Ca 0.29 -0.34 -0.10 0.00 1.87 0.00 0.00 56.30 58.02 1aj8 h ASN 66 Cb -0.03 -0.21 -0.01 0.00 0.27 0.00 0.00 38.32 38.34 1aj8 h ASN 66 CO -0.05 1.06 -0.19 0.15 -0.37 0.00 0.00 177.43 178.03 1aj8 h PHE 67 N 0.59 0.81 -0.42 0.67 3.57 -0.91 -2.02 116.94 119.23 1aj8 h PHE 67 Ca 0.05 -0.21 0.02 0.00 3.53 0.00 0.00 57.97 61.36 1aj8 h PHE 67 Cb 0.93 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.46 1aj8 h PHE 67 CO 0.05 0.93 0.28 0.87 -2.23 0.00 0.00 178.31 178.20 1aj8 h LYS 68 N 0.46 0.47 -0.24 1.11 1.57 -0.73 -1.90 116.57 117.31 1aj8 h LYS 68 Ca 0.07 -0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.68 1aj8 h LYS 68 Cb 0.73 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.93 1aj8 h LYS 68 CO 0.05 0.31 -0.38 -0.22 -0.57 0.00 0.00 179.45 178.64 1aj8 h LYS 69 N 0.48 0.69 -0.53 3.15 3.64 -1.08 -1.27 116.57 121.65 1aj8 h LYS 69 Ca 0.17 -0.42 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 1aj8 h LYS 69 Cb 0.07 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 1aj8 h LYS 69 CO -0.04 1.03 0.35 0.93 -2.27 0.00 0.00 179.45 179.45 1aj8 h GLU 70 N 0.41 0.71 0.58 1.90 5.08 -0.75 -2.36 114.58 120.15 1aj8 h GLU 70 Ca 0.02 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 1aj8 h GLU 70 Cb 0.97 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 30.07 1aj8 h GLU 70 CO 0.09 0.48 -0.28 -0.07 -1.00 0.00 0.00 179.01 178.23 1aj8 h LEU 71 N 0.72 -0.66 -0.82 1.33 3.38 -1.35 -3.08 115.31 114.83 1aj8 h LEU 71 Ca 0.19 -0.03 0.20 0.00 0.09 0.00 0.00 57.88 58.34 1aj8 h LEU 71 Cb -0.07 0.17 -0.12 0.00 0.09 0.00 0.00 40.66 40.73 1aj8 h LEU 71 CO -0.04 -0.38 0.23 0.00 0.09 0.00 0.00 178.44 178.35 1aj8 h ALA 72 N -0.60 1.15 0.00 1.53 0.00 -1.13 0.51 119.26 120.72 1aj8 h ALA 72 Ca -0.08 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1aj8 h ALA 72 Cb 0.65 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1aj8 h ALA 72 CO 0.13 -0.38 0.00 0.36 0.00 0.00 0.00 179.25 179.36 1aj8 n LYS 73 N -5.16 0.92 0.00 0.00 2.85 -0.90 -3.04 118.16 112.83 1aj8 n LYS 73 Ca 0.18 0.00 0.06 0.00 -1.05 0.00 0.00 58.31 57.50 1aj8 n LYS 73 Cb 0.57 -1.36 0.02 0.00 -0.65 0.00 0.00 35.03 33.61 1aj8 n LYS 73 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1aj8 n SER 74 N -0.86 1.54 0.25 -5.58 7.64 0.18 -4.62 113.62 112.17 1aj8 n SER 74 Ca 0.16 -1.27 0.13 0.00 1.01 0.00 0.00 58.87 58.90 1aj8 n SER 74 Cb 0.07 0.31 0.62 0.00 -1.01 0.00 0.00 64.21 64.20 1aj8 n SER 74 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1aj8 h ARG 75 N 1.64 0.00 -7.17 1.43 3.08 -1.42 -3.36 114.38 108.57 1aj8 h ARG 75 Ca 0.00 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.55 1aj8 h ARG 75 Cb 0.42 0.00 0.09 0.00 0.08 0.00 0.00 29.97 30.56 1aj8 h ARG 75 CO 0.00 0.14 0.39 0.20 -1.07 0.00 0.00 179.97 179.62 1aj8 s GLY 76 N -4.23 2.24 -0.15 0.04 0.00 -1.26 -4.59 107.32 99.38 1aj8 s GLY 76 Ca -0.00 0.56 -0.01 0.00 0.00 0.00 0.00 44.72 45.27 1aj8 s GLY 76 CO 0.59 0.90 -0.11 1.08 0.00 0.00 0.00 173.10 175.56 1aj8 s LEU 77 N -4.55 2.77 0.69 0.66 1.43 -1.26 -4.96 118.68 113.46 1aj8 s LEU 77 Ca 0.67 -0.33 -0.17 0.00 -1.03 0.00 0.00 54.13 53.28 1aj8 s LEU 77 Cb -0.20 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.37 1aj8 s LEU 77 CO 0.37 0.14 0.94 -2.65 0.23 0.00 0.00 176.35 175.38 1aj8 n PRO 78 N 3.72 0.61 -0.24 1.29 -0.02 -1.26 -4.77 135.00 134.34 1aj8 n PRO 78 Ca -0.18 0.26 0.09 0.00 -2.02 0.00 0.00 63.50 61.65 1aj8 n PRO 78 Cb 0.52 -2.19 0.35 0.00 -0.02 0.00 0.00 33.50 32.17 1aj8 n PRO 78 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1aj8 h LYS 79 N -0.04 0.73 -0.20 -0.52 3.64 -2.00 -1.34 116.57 116.83 1aj8 h LYS 79 Ca -0.48 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 58.80 1aj8 h LYS 79 Cb 1.34 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.99 1aj8 h LYS 79 CO 0.48 0.48 -0.13 0.93 -2.27 0.00 0.00 179.45 178.94 1aj8 h GLU 80 N 0.75 0.33 -0.20 1.90 5.08 -1.99 -0.97 114.58 119.48 1aj8 h GLU 80 Ca 0.39 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.63 1aj8 h GLU 80 Cb 0.48 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1aj8 h GLU 80 CO -0.16 0.47 -0.01 0.28 -1.00 0.00 0.00 179.01 178.59 1aj8 h VAL 81 N 0.31 1.26 -0.75 3.13 2.07 -1.59 -1.68 116.25 119.00 1aj8 h VAL 81 Ca 0.06 -0.89 -0.00 0.00 0.82 0.00 0.00 66.70 66.69 1aj8 h VAL 81 Cb 0.42 1.45 -0.04 0.00 -1.52 0.00 0.00 31.29 31.60 1aj8 h VAL 81 CO 0.02 0.27 0.47 0.40 0.02 0.00 0.00 177.57 178.76 1aj8 h ILE 82 N 0.11 1.20 -0.81 4.57 2.04 -1.13 -1.32 117.51 122.19 1aj8 h ILE 82 Ca 0.06 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 65.47 1aj8 h ILE 82 Cb 0.41 0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 36.58 1aj8 h ILE 82 CO 0.01 0.21 0.41 -0.33 0.00 0.00 0.00 178.15 178.45 1aj8 h GLU 83 N 1.03 1.15 -0.50 2.37 5.08 -0.92 -0.15 114.58 122.64 1aj8 h GLU 83 Ca 0.27 -0.16 -0.11 0.00 -1.00 0.00 0.00 59.36 58.37 1aj8 h GLU 83 Cb -0.07 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 28.95 1aj8 h GLU 83 CO -0.05 0.87 -0.13 0.82 -1.00 0.00 0.00 179.01 179.52 1aj8 h ILE 84 N 1.13 1.27 -0.88 3.13 1.08 -0.58 -2.16 117.51 120.51 1aj8 h ILE 84 Ca 0.28 -1.26 0.00 0.00 -0.39 0.00 0.00 64.86 63.49 1aj8 h ILE 84 Cb 0.09 1.02 -0.04 0.00 -3.07 0.00 0.00 36.82 34.81 1aj8 h ILE 84 CO -0.04 0.44 0.56 0.24 -0.69 0.00 0.00 178.15 178.66 1aj8 h MET 85 N 0.84 1.17 0.00 2.37 2.86 -0.67 -0.44 114.93 121.06 1aj8 h MET 85 Ca 0.13 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1aj8 h MET 85 Cb 0.67 -0.26 0.00 0.00 0.06 0.00 0.00 31.60 32.08 1aj8 h MET 85 CO 0.05 0.79 0.00 0.93 1.06 0.00 0.00 176.91 179.74 1aj8 h GLU 86 N 1.20 0.00 -0.00 1.72 5.08 -0.65 -2.66 114.58 119.27 1aj8 h GLU 86 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1aj8 h GLU 86 Cb -0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.15 1aj8 h GLU 86 CO -0.06 0.00 -0.63 0.00 -1.00 0.00 0.00 179.01 177.31 1aj8 n ALA 87 N -1.81 3.91 -1.79 3.43 0.00 -0.21 -4.95 120.51 119.10 1aj8 n ALA 87 Ca 0.02 -0.51 -0.35 0.00 0.00 0.00 0.00 53.44 52.60 1aj8 n ALA 87 Cb 0.22 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 18.71 1aj8 n ALA 87 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1aj8 s LEU 88 N -2.81 3.92 0.11 0.00 1.43 -0.99 -4.93 118.68 115.40 1aj8 s LEU 88 Ca 0.14 2.04 -0.32 0.00 -1.03 0.00 0.00 54.13 54.96 1aj8 s LEU 88 Cb 0.17 -4.43 -0.11 0.00 0.03 0.00 0.00 46.19 41.84 1aj8 s LEU 88 CO 0.71 -0.80 1.80 -2.65 0.23 0.00 0.00 176.35 175.63 1aj8 n PRO 89 N -0.75 2.61 -0.03 1.29 -0.02 -1.26 -4.81 135.00 132.03 1aj8 n PRO 89 Ca 0.08 0.95 0.24 0.00 -2.02 0.00 0.00 63.50 62.76 1aj8 n PRO 89 Cb 0.51 -2.82 0.70 0.00 -0.02 0.00 0.00 33.50 31.88 1aj8 n PRO 89 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1aj8 h LYS 90 N 8.13 0.00 -0.05 -0.52 6.56 -1.91 0.20 116.57 128.98 1aj8 h LYS 90 Ca -0.46 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.13 1aj8 h LYS 90 Cb 1.23 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.89 1aj8 h LYS 90 CO 0.94 0.00 0.00 0.27 -2.06 0.00 0.00 179.45 178.60 1aj8 n ASN 91 N -3.78 1.26 -4.71 0.86 2.04 -1.26 -4.84 115.26 104.83 1aj8 n ASN 91 Ca 0.13 -1.48 -0.42 0.00 -0.44 0.00 0.00 54.58 52.36 1aj8 n ASN 91 Cb 0.86 -0.03 -0.03 0.00 -2.53 0.00 0.00 39.78 38.05 1aj8 n ASN 91 CO 0.00 0.00 0.00 0.41 -0.44 0.00 0.00 177.26 177.23 1aj8 n THR 92 N 0.01 0.13 -2.15 5.53 -1.04 0.71 -4.94 114.28 112.53 1aj8 n THR 92 Ca 0.19 -0.02 -0.38 0.00 -2.04 0.00 0.00 64.05 61.79 1aj8 n THR 92 Cb 0.30 -2.01 -0.00 0.00 -1.82 0.00 0.00 70.33 66.79 1aj8 n THR 92 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1aj8 s HIS 93 N 1.72 2.84 0.25 -1.42 3.76 -1.26 -4.77 115.29 116.42 1aj8 s HIS 93 Ca 0.78 1.48 -0.07 0.00 -0.15 0.00 0.00 55.06 57.11 1aj8 s HIS 93 Cb -0.51 -3.52 0.46 0.00 1.11 0.00 0.00 32.58 30.12 1aj8 s HIS 93 CO 0.34 -1.79 1.62 -1.35 -0.85 0.00 0.00 174.74 172.72 1aj8 h PRO 94 N 2.33 0.08 -0.69 8.40 0.11 -1.92 0.04 132.00 140.35 1aj8 h PRO 94 Ca -0.49 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 1aj8 h PRO 94 Cb 1.25 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 1aj8 h PRO 94 CO 0.61 0.05 0.19 0.52 -0.21 0.00 0.00 178.00 179.16 1aj8 h MET 95 N 0.08 1.09 -0.21 1.05 2.86 -1.92 0.15 114.93 118.03 1aj8 h MET 95 Ca 0.43 -0.24 -0.13 0.00 -2.06 0.00 0.00 59.70 57.70 1aj8 h MET 95 Cb 0.76 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 1aj8 h MET 95 CO -0.71 0.95 -0.42 0.78 1.06 0.00 0.00 176.91 178.57 1aj8 h GLY 96 N 1.08 0.53 0.86 8.32 0.00 -1.74 -0.83 103.07 111.29 1aj8 h GLY 96 Ca 0.22 -0.53 -0.07 0.00 0.00 0.00 0.00 47.33 46.95 1aj8 h GLY 96 CO -0.00 0.48 -0.13 0.00 0.00 0.00 0.00 176.54 176.89 1aj8 h ALA 97 N 1.15 0.35 -0.69 3.60 0.00 -0.58 -2.63 119.26 120.46 1aj8 h ALA 97 Ca 0.03 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.64 1aj8 h ALA 97 Cb 0.90 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 1aj8 h ALA 97 CO 0.08 0.23 0.45 1.25 0.00 0.00 0.00 179.25 181.26 1aj8 h LEU 98 N 0.25 0.77 -0.13 0.00 5.85 -0.57 -1.18 115.31 120.30 1aj8 h LEU 98 Ca 0.05 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.81 1aj8 h LEU 98 Cb 0.65 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.43 1aj8 h LEU 98 CO 0.04 0.55 -0.25 -0.09 -0.34 0.00 0.00 178.44 178.35 1aj8 h ARG 99 N 0.91 -0.30 -0.54 1.25 2.43 -1.03 0.23 114.38 117.33 1aj8 h ARG 99 Ca 0.26 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.41 1aj8 h ARG 99 Cb -0.07 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 1aj8 h ARG 99 CO -0.07 -0.20 0.16 1.15 -1.51 0.00 0.00 179.97 179.50 1aj8 h THR 100 N -0.31 1.24 -0.65 0.20 2.02 -1.15 -1.70 112.91 112.55 1aj8 h THR 100 Ca 0.10 -0.81 -0.06 0.00 0.77 0.00 0.00 66.41 66.42 1aj8 h THR 100 Cb 0.47 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 67.59 1aj8 h THR 100 CO -0.31 0.30 0.17 0.40 0.37 0.00 0.00 175.52 176.45 1aj8 h ILE 101 N 0.74 1.25 -0.33 3.11 1.08 -0.80 -0.22 117.51 122.35 1aj8 h ILE 101 Ca 0.17 -0.91 -0.08 0.00 -0.39 0.00 0.00 64.86 63.65 1aj8 h ILE 101 Cb 0.29 0.61 -0.02 0.00 -3.07 0.00 0.00 36.82 34.64 1aj8 h ILE 101 CO -0.00 0.35 -0.14 0.40 -0.69 0.00 0.00 178.15 178.06 1aj8 h ILE 102 N 0.95 1.24 -0.63 -0.67 2.04 -0.43 0.39 117.51 120.41 1aj8 h ILE 102 Ca 0.20 -1.10 -0.09 0.00 1.00 0.00 0.00 64.86 64.87 1aj8 h ILE 102 Cb 0.34 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 1aj8 h ILE 102 CO -0.00 0.36 0.04 -1.28 0.00 0.00 0.00 178.15 177.27 1aj8 h SER 103 N 0.52 1.05 -0.03 1.72 0.87 -0.76 -1.98 113.55 114.94 1aj8 h SER 103 Ca 0.09 -0.29 -0.12 0.00 -1.23 0.00 0.00 61.79 60.24 1aj8 h SER 103 Cb 0.55 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.22 1aj8 h SER 103 CO 0.03 1.08 -0.38 0.22 -0.53 0.00 0.00 176.83 177.26 1aj8 h TYR 104 N 0.99 0.62 -0.75 2.24 3.20 -0.62 -2.33 116.97 120.31 1aj8 h TYR 104 Ca 0.18 -0.17 0.01 0.00 3.14 0.00 0.00 58.73 61.89 1aj8 h TYR 104 Cb 0.52 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.61 1aj8 h TYR 104 CO 0.04 0.83 0.50 -0.07 -1.64 0.00 0.00 178.16 177.82 1aj8 h LEU 105 N 0.44 0.86 -0.55 2.82 3.38 -0.58 -1.86 115.31 119.82 1aj8 h LEU 105 Ca 0.04 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 1aj8 h LEU 105 Cb 0.86 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 1aj8 h LEU 105 CO 0.07 0.62 -0.07 1.23 0.09 0.00 0.00 178.44 180.38 1aj8 h GLY 106 N 1.01 1.09 1.57 0.83 0.00 -0.86 -2.28 103.07 104.43 1aj8 h GLY 106 Ca 0.28 -0.85 0.00 0.00 0.00 0.00 0.00 47.33 46.76 1aj8 h GLY 106 CO -0.06 0.78 0.27 3.43 0.00 0.00 0.00 176.54 180.96 1aj8 h ASN 107 N 0.89 0.50 0.28 0.19 2.35 -0.85 -2.57 115.58 116.36 1aj8 h ASN 107 Ca 0.15 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1aj8 h ASN 107 Cb 0.63 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.87 1aj8 h ASN 107 CO 0.04 0.38 -0.50 2.30 -1.65 0.00 0.00 177.43 177.99 1aj8 n ILE 108 N -4.46 0.00 -2.82 2.81 -5.35 -0.94 -4.89 119.36 103.70 1aj8 n ILE 108 Ca 0.03 -0.07 -0.41 0.00 -0.27 0.00 0.00 62.75 62.04 1aj8 n ILE 108 Cb 0.07 0.53 -0.04 0.00 -1.74 0.00 0.00 39.64 38.46 1aj8 n ILE 108 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1aj8 s ASP 109 N -2.79 7.36 0.53 7.28 -1.08 -0.87 -4.93 116.67 122.18 1aj8 s ASP 109 Ca 0.15 1.63 0.21 0.00 -0.52 0.00 0.00 52.55 54.02 1aj8 s ASP 109 Cb 0.18 -2.54 1.38 0.00 -1.46 0.00 0.00 42.92 40.48 1aj8 s ASP 109 CO 0.66 -0.07 2.10 0.44 0.52 0.00 0.00 175.17 178.82 1aj8 h ASP 110 N 5.85 0.00 -0.53 -0.34 5.19 -1.90 -0.84 116.42 123.86 1aj8 h ASP 110 Ca -0.43 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 55.96 1aj8 h ASP 110 Cb 1.21 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.70 1aj8 h ASP 110 CO 0.72 0.00 0.03 -1.20 -3.12 0.00 0.00 179.24 175.67 1aj8 n SER 111 N -4.38 5.24 0.32 6.45 7.64 -1.26 -4.63 113.62 123.00 1aj8 n SER 111 Ca 0.02 -3.00 0.21 0.00 1.01 0.00 0.00 58.87 57.11 1aj8 n SER 111 Cb 0.28 -0.66 1.08 0.00 -1.01 0.00 0.00 64.21 63.90 1aj8 n SER 111 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1aj8 h GLY 112 N 3.37 0.00 -0.14 0.23 0.00 -1.27 -2.97 103.07 102.29 1aj8 h GLY 112 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1aj8 h GLY 112 CO 0.47 0.00 -0.02 1.22 0.00 0.00 0.00 176.54 178.20 1aj8 n ASP 113 N -3.06 0.94 -4.72 0.19 8.00 -1.26 -4.75 116.55 111.88 1aj8 n ASP 113 Ca -0.02 -0.97 -0.42 0.00 0.71 0.00 0.00 54.79 54.09 1aj8 n ASP 113 Cb 0.13 0.23 -0.03 0.00 -0.02 0.00 0.00 41.12 41.42 1aj8 n ASP 113 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1aj8 s ILE 114 N -0.41 3.01 0.27 0.53 1.01 -1.12 -4.65 121.20 119.83 1aj8 s ILE 114 Ca 0.02 0.74 -0.31 0.00 0.00 0.00 0.00 60.65 61.11 1aj8 s ILE 114 Cb 0.02 -3.48 -0.12 0.00 0.01 0.00 0.00 42.46 38.89 1aj8 s ILE 114 CO 0.04 0.07 1.62 -2.65 0.00 0.00 0.00 174.94 174.02 1aj8 n PRO 115 N 3.69 2.70 -1.80 2.79 -0.02 -1.26 -4.15 135.00 136.94 1aj8 n PRO 115 Ca 0.11 0.96 -0.40 0.00 -2.02 0.00 0.00 63.50 62.15 1aj8 n PRO 115 Cb 0.41 -2.76 0.01 0.00 -0.02 0.00 0.00 33.50 31.14 1aj8 n PRO 115 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1aj8 s VAL 116 N 0.28 2.08 -0.00 -1.45 -7.23 -0.71 -4.97 120.40 108.39 1aj8 s VAL 116 Ca 0.67 0.07 -0.06 0.00 -1.81 0.00 0.00 61.98 60.85 1aj8 s VAL 116 Cb -0.50 -3.04 -0.00 0.00 0.56 0.00 0.00 36.38 33.39 1aj8 s VAL 116 CO 0.45 0.01 0.11 0.42 -0.31 0.00 0.00 175.10 175.78 1aj8 s THR 117 N -1.18 0.08 0.20 5.32 -4.23 -1.26 -4.97 115.64 109.59 1aj8 s THR 117 Ca 0.59 -0.63 -0.21 0.00 -1.18 0.00 0.00 61.69 60.25 1aj8 s THR 117 Cb -0.44 -0.37 0.13 0.00 1.34 0.00 0.00 72.50 73.16 1aj8 s THR 117 CO 0.58 -0.35 1.57 -0.65 -0.54 0.00 0.00 174.62 175.23 1aj8 h PRO 118 N 4.56 -0.10 -0.29 3.99 0.11 -1.87 -0.07 132.00 138.34 1aj8 h PRO 118 Ca -0.30 0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.85 1aj8 h PRO 118 Cb 1.20 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 1aj8 h PRO 118 CO 0.41 -0.07 0.07 0.93 -0.21 0.00 0.00 178.00 179.13 1aj8 h GLU 119 N -0.11 0.17 -0.18 1.05 3.07 -1.98 -2.48 114.58 114.12 1aj8 h GLU 119 Ca 0.26 -0.01 -0.08 0.00 -0.50 0.00 0.00 59.36 59.02 1aj8 h GLU 119 Cb 0.56 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.42 1aj8 h GLU 119 CO -0.81 0.12 -0.26 1.49 -1.40 0.00 0.00 179.01 178.14 1aj8 h GLU 120 N 0.18 0.33 -0.49 2.33 4.22 -1.83 -2.39 114.58 116.93 1aj8 h GLU 120 Ca 0.13 -0.12 -0.04 0.00 0.08 0.00 0.00 59.36 59.42 1aj8 h GLU 120 Cb 0.13 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1aj8 h GLU 120 CO -0.17 0.57 0.16 0.28 -2.18 0.00 0.00 179.01 177.67 1aj8 h VAL 121 N 0.30 1.23 -0.46 0.32 2.07 -0.60 -0.92 116.25 118.19 1aj8 h VAL 121 Ca 0.05 -0.76 -0.11 0.00 0.82 0.00 0.00 66.70 66.70 1aj8 h VAL 121 Cb 0.62 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1aj8 h VAL 121 CO 0.04 0.28 -0.15 1.88 0.02 0.00 0.00 177.57 179.64 1aj8 h TYR 122 N 0.66 0.96 0.36 1.57 0.05 -1.30 0.20 116.97 119.48 1aj8 h TYR 122 Ca 0.16 -0.20 -0.02 0.00 0.05 0.00 0.00 58.73 58.72 1aj8 h TYR 122 Cb 0.27 -0.24 0.00 0.00 1.01 0.00 0.00 36.73 37.77 1aj8 h TYR 122 CO 0.01 0.94 -0.17 -0.09 -1.05 0.00 0.00 178.16 177.80 1aj8 h ARG 123 N 0.76 -0.47 -0.53 4.88 2.43 -1.11 -1.62 114.38 118.73 1aj8 h ARG 123 Ca 0.12 0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.28 1aj8 h ARG 123 Cb 0.67 0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 30.30 1aj8 h ARG 123 CO 0.05 -0.29 0.15 0.82 -1.51 0.00 0.00 179.97 179.19 1aj8 h ILE 124 N -0.52 1.22 -0.95 1.20 1.08 -1.11 -2.65 117.51 115.78 1aj8 h ILE 124 Ca -0.05 -0.75 0.10 0.00 -0.39 0.00 0.00 64.86 63.77 1aj8 h ILE 124 Cb 0.39 0.64 -0.07 0.00 -3.07 0.00 0.00 36.82 34.72 1aj8 h ILE 124 CO 0.08 0.28 0.61 1.23 -0.69 0.00 0.00 178.15 179.66 1aj8 h GLY 125 N 0.95 1.44 1.00 5.37 0.00 -0.16 -1.07 103.07 110.59 1aj8 h GLY 125 Ca 0.18 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1aj8 h GLY 125 CO -0.01 0.21 0.40 -2.22 0.00 0.00 0.00 176.54 174.92 1aj8 h ILE 126 N 0.97 1.16 -0.18 2.60 2.04 -0.93 0.32 117.51 123.48 1aj8 h ILE 126 Ca 0.44 -0.31 -0.04 0.00 1.00 0.00 0.00 64.86 65.95 1aj8 h ILE 126 Cb 0.40 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 1aj8 h ILE 126 CO -0.20 0.16 -0.06 -1.28 0.00 0.00 0.00 178.15 176.77 1aj8 h SER 127 N 0.83 0.37 -0.14 1.72 0.87 -1.34 -1.93 113.55 113.93 1aj8 h SER 127 Ca 0.22 -0.38 -0.20 0.00 -1.23 0.00 0.00 61.79 60.20 1aj8 h SER 127 Cb -0.08 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 61.78 1aj8 h SER 127 CO -0.05 0.67 -0.66 0.58 -0.53 0.00 0.00 176.83 176.84 1aj8 h VAL 128 N 0.07 1.29 -0.17 2.23 2.07 -1.11 -1.76 116.25 118.87 1aj8 h VAL 128 Ca 0.04 -1.87 0.00 0.00 0.82 0.00 0.00 66.70 65.69 1aj8 h VAL 128 Cb 0.51 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 1aj8 h VAL 128 CO 0.02 0.60 0.11 0.74 0.02 0.00 0.00 177.57 179.06 1aj8 h THR 129 N 0.55 1.06 -0.42 2.57 2.02 -0.41 -1.98 112.91 116.31 1aj8 h THR 129 Ca -0.02 -0.13 -0.03 0.00 0.77 0.00 0.00 66.41 67.01 1aj8 h THR 129 Cb 1.26 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 68.49 1aj8 h THR 129 CO 0.14 0.05 0.15 0.00 0.37 0.00 0.00 175.52 176.23 1aj8 h ALA 130 N 1.04 1.47 0.00 6.16 0.00 -1.32 -3.25 119.26 123.37 1aj8 h ALA 130 Ca 0.06 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.66 1aj8 h ALA 130 Cb -0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1aj8 h ALA 130 CO -0.01 0.40 -0.89 0.87 0.00 0.00 0.00 179.25 179.62 1aj8 h LYS 131 N 0.60 0.00 -0.61 0.00 1.57 -0.95 -3.39 116.57 113.80 1aj8 h LYS 131 Ca 0.14 0.00 0.11 0.00 -1.87 0.00 0.00 60.65 59.04 1aj8 h LYS 131 Cb 0.16 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.38 1aj8 h LYS 131 CO -0.01 0.84 0.14 0.82 -0.57 0.00 0.00 179.45 180.67 1aj8 h ILE 132 N 0.00 0.64 -0.77 1.86 2.04 -1.40 -1.39 117.51 118.50 1aj8 h ILE 132 Ca -0.02 -0.09 0.01 0.00 1.00 0.00 0.00 64.86 65.76 1aj8 h ILE 132 Cb 1.67 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 38.06 1aj8 h ILE 132 CO 0.11 0.05 0.51 -0.65 0.00 0.00 0.00 178.15 178.17 1aj8 h PRO 133 N 0.27 1.01 -0.53 2.37 0.11 -1.79 -0.28 132.00 133.16 1aj8 h PRO 133 Ca 0.32 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 66.30 1aj8 h PRO 133 Cb 0.47 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 31.33 1aj8 h PRO 133 CO -0.40 0.67 0.05 1.15 -0.21 0.00 0.00 178.00 179.26 1aj8 h THR 134 N 1.04 1.24 -0.13 -1.15 2.02 -1.51 -1.12 112.91 113.30 1aj8 h THR 134 Ca 0.28 -0.96 -0.07 0.00 0.77 0.00 0.00 66.41 66.44 1aj8 h THR 134 Cb -0.12 0.78 -0.00 0.00 -1.74 0.00 0.00 68.15 67.07 1aj8 h THR 134 CO -0.06 0.35 -0.18 0.40 0.37 0.00 0.00 175.52 176.39 1aj8 h ILE 135 N 0.80 1.37 0.09 3.11 2.04 -0.70 -2.58 117.51 121.64 1aj8 h ILE 135 Ca 0.16 -1.41 -0.00 0.00 1.00 0.00 0.00 64.86 64.61 1aj8 h ILE 135 Cb 0.41 2.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.48 1aj8 h ILE 135 CO 0.01 0.41 -0.04 0.58 0.00 0.00 0.00 178.15 179.11 1aj8 h VAL 136 N -0.06 1.02 -0.24 1.67 2.07 -0.94 -0.01 116.25 119.76 1aj8 h VAL 136 Ca 0.01 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 1aj8 h VAL 136 Cb 0.75 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 1aj8 h VAL 136 CO 0.04 0.09 0.10 0.00 0.02 0.00 0.00 177.57 177.83 1aj8 h ALA 137 N 0.60 0.31 0.00 1.67 0.00 -1.33 -2.76 119.26 117.76 1aj8 h ALA 137 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1aj8 h ALA 137 Cb 0.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1aj8 h ALA 137 CO 0.02 -0.10 0.00 0.09 0.00 0.00 0.00 179.25 179.26 1aj8 n ASN 138 N -4.79 0.50 0.07 0.00 3.02 -0.97 -2.06 115.26 111.02 1aj8 n ASN 138 Ca -0.03 0.58 -0.19 0.00 -0.03 0.00 0.00 54.58 54.90 1aj8 n ASN 138 Cb 0.12 -0.70 -0.10 0.00 -0.61 0.00 0.00 39.78 38.50 1aj8 n ASN 138 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 1aj8 h TRP 139 N 0.00 0.91 -0.56 3.10 -0.00 -0.77 -0.47 115.95 118.16 1aj8 h TRP 139 Ca 0.00 -0.53 -0.03 0.00 -0.00 0.00 0.00 58.89 58.34 1aj8 h TRP 139 Cb 0.52 -0.09 -0.03 0.00 -0.00 0.00 0.00 29.16 29.56 1aj8 h TRP 139 CO 0.00 1.36 0.24 -0.92 -0.00 0.00 0.00 178.44 179.13 1aj8 h TYR 140 N 0.31 0.84 0.31 2.65 3.20 -1.17 -0.44 116.97 122.68 1aj8 h TYR 140 Ca -0.14 -0.06 -0.02 0.00 3.14 0.00 0.00 58.73 61.66 1aj8 h TYR 140 Cb 1.75 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 39.77 1aj8 h TYR 140 CO 0.09 0.67 -0.15 0.00 -1.64 0.00 0.00 178.16 177.13 1aj8 h ARG 141 N 0.77 -0.41 -0.70 1.82 3.08 -1.39 -2.87 114.38 114.68 1aj8 h ARG 141 Ca 0.19 0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.31 1aj8 h ARG 141 Cb 0.17 0.09 -0.05 0.00 0.08 0.00 0.00 29.97 30.27 1aj8 h ARG 141 CO -0.02 -0.11 0.43 0.82 -1.07 0.00 0.00 179.97 180.02 1aj8 h ILE 142 N -0.71 1.06 0.00 2.04 2.04 -1.04 0.27 117.51 121.17 1aj8 h ILE 142 Ca -0.04 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.53 1aj8 h ILE 142 Cb 0.49 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 1aj8 h ILE 142 CO 0.07 0.15 0.00 2.29 0.00 0.00 0.00 178.15 180.66 1aj8 n LYS 143 N -4.69 0.10 -0.21 2.37 2.85 -0.18 -2.08 118.16 116.32 1aj8 n LYS 143 Ca 0.08 0.39 0.06 0.00 -1.05 0.00 0.00 58.31 57.79 1aj8 n LYS 143 Cb 0.11 -1.70 0.16 0.00 -0.65 0.00 0.00 35.03 32.94 1aj8 n LYS 143 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1aj8 n ASN 144 N -1.89 2.94 -1.10 -5.58 4.13 -0.27 -4.92 115.26 108.58 1aj8 n ASN 144 Ca 0.02 -2.56 -0.12 0.00 1.68 0.00 0.00 54.58 53.60 1aj8 n ASN 144 Cb 0.16 -0.33 -0.03 0.00 -1.54 0.00 0.00 39.78 38.04 1aj8 n ASN 144 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1aj8 n GLY 145 N -0.43 0.71 3.95 7.41 0.00 -0.76 -5.01 105.19 111.07 1aj8 n GLY 145 Ca 0.13 -0.44 -0.23 0.00 0.00 0.00 0.00 46.02 45.49 1aj8 n GLY 145 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aj8 s LEU 146 N -3.00 3.95 0.32 0.99 1.43 0.80 -4.99 118.68 118.17 1aj8 s LEU 146 Ca 0.00 0.32 -0.28 0.00 -1.03 0.00 0.00 54.13 53.14 1aj8 s LEU 146 Cb 0.00 -3.18 -0.09 0.00 0.03 0.00 0.00 46.19 42.94 1aj8 s LEU 146 CO 0.00 -0.38 1.09 -1.61 0.23 0.00 0.00 176.35 175.68 1aj8 s GLU 147 N -4.33 4.48 0.22 1.70 2.02 -1.26 -4.13 118.70 117.41 1aj8 s GLU 147 Ca 0.42 1.74 -0.30 0.00 0.02 0.00 0.00 54.97 56.85 1aj8 s GLU 147 Cb -0.10 -3.00 -0.09 0.00 0.10 0.00 0.00 34.13 31.04 1aj8 s GLU 147 CO 0.35 0.09 1.35 -0.47 0.02 0.00 0.00 175.26 176.60 1aj8 s TYR 148 N -1.30 3.18 -0.32 1.61 6.14 -1.26 -4.87 117.35 120.53 1aj8 s TYR 148 Ca 0.48 1.17 -0.01 0.00 0.64 0.00 0.00 57.07 59.36 1aj8 s TYR 148 Cb -0.30 -3.67 0.07 0.00 0.42 0.00 0.00 41.96 38.48 1aj8 s TYR 148 CO 0.38 -2.10 0.04 0.08 0.64 0.00 0.00 175.55 174.59 1aj8 s VAL 149 N 0.01 2.96 0.72 3.14 1.01 -1.26 -5.10 120.40 121.88 1aj8 s VAL 149 Ca 0.57 -1.62 -0.15 0.00 0.00 0.00 0.00 61.98 60.78 1aj8 s VAL 149 Cb -0.38 -2.81 0.03 0.00 0.00 0.00 0.00 36.38 33.22 1aj8 s VAL 149 CO 0.40 -0.27 1.22 -2.84 0.00 0.00 0.00 175.10 173.62 1aj8 s PRO 150 N 1.19 2.19 0.83 2.72 0.02 -1.26 -4.81 135.00 135.89 1aj8 s PRO 150 Ca -0.01 1.81 -0.11 0.00 0.02 0.00 0.00 61.00 62.71 1aj8 s PRO 150 Cb -0.20 -1.83 0.10 0.00 0.02 0.00 0.00 34.50 32.58 1aj8 s PRO 150 CO -0.02 -1.81 1.13 -1.25 -0.33 0.00 0.00 177.00 174.72 1aj8 s PRO 151 N -3.82 1.66 -0.42 5.54 0.04 -1.26 -4.87 135.00 131.86 1aj8 s PRO 151 Ca 0.76 1.44 -0.04 0.00 0.04 0.00 0.00 61.00 63.19 1aj8 s PRO 151 Cb -0.30 -1.81 0.11 0.00 0.04 0.00 0.00 34.50 32.54 1aj8 s PRO 151 CO 0.44 -2.14 0.23 0.15 0.04 0.00 0.00 177.00 175.73 1aj8 s LYS 152 N -4.62 2.11 0.47 4.56 1.02 -1.26 -4.99 119.74 117.03 1aj8 s LYS 152 Ca 0.66 -1.80 0.35 0.00 0.02 0.00 0.00 55.97 55.19 1aj8 s LYS 152 Cb -0.22 -3.66 1.50 0.00 -0.52 0.00 0.00 37.83 34.93 1aj8 s LYS 152 CO 0.55 -1.10 1.62 1.49 -0.92 0.00 0.00 175.35 177.00 1aj8 h GLU 153 N 8.14 0.06 0.00 1.68 4.81 -1.95 -0.66 114.58 126.67 1aj8 h GLU 153 Ca -0.15 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 58.98 1aj8 h GLU 153 Cb 1.05 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.41 1aj8 h GLU 153 CO 0.73 0.04 -0.47 1.57 -0.73 0.00 0.00 179.01 180.15 1aj8 h LYS 154 N 0.06 0.00 -7.25 1.92 -0.00 -1.97 -3.46 116.57 105.88 1aj8 h LYS 154 Ca 0.83 0.00 -0.50 0.00 -0.00 0.00 0.00 60.65 60.98 1aj8 h LYS 154 Cb 2.80 0.00 0.06 0.00 -0.00 0.00 0.00 32.23 35.10 1aj8 h LYS 154 CO -0.31 0.47 0.38 -0.51 -0.00 0.00 0.00 179.45 179.48 1aj8 s LEU 155 N -6.83 3.39 0.93 7.07 1.43 -0.26 -5.03 118.68 119.38 1aj8 s LEU 155 Ca 0.01 1.69 -0.12 0.00 -1.03 0.00 0.00 54.13 54.68 1aj8 s LEU 155 Cb 0.10 -4.51 0.15 0.00 0.03 0.00 0.00 46.19 41.95 1aj8 s LEU 155 CO 0.72 -1.13 1.10 -0.94 0.23 0.00 0.00 176.35 176.33 1aj8 s SER 156 N -3.24 3.23 0.18 2.29 1.04 -1.26 -4.66 113.70 111.29 1aj8 s SER 156 Ca 0.60 1.27 -0.13 0.00 0.48 0.00 0.00 55.95 58.18 1aj8 s SER 156 Cb -0.14 -1.94 0.18 0.00 0.10 0.00 0.00 66.02 64.22 1aj8 s SER 156 CO 0.43 -2.76 1.73 -0.74 0.98 0.00 0.00 173.24 172.88 1aj8 h HIS 157 N -1.64 0.24 -0.25 5.02 2.76 -1.96 0.21 115.15 119.52 1aj8 h HIS 157 Ca -0.51 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 57.63 1aj8 h HIS 157 Cb 1.31 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 30.23 1aj8 h HIS 157 CO 0.36 0.05 -0.05 0.00 -1.30 0.00 0.00 177.93 176.98 1aj8 h ALA 158 N 1.36 0.34 -0.44 5.26 0.00 -1.91 -2.68 119.26 121.19 1aj8 h ALA 158 Ca 0.24 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1aj8 h ALA 158 Cb 0.30 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1aj8 h ALA 158 CO -0.28 0.13 0.08 0.00 0.00 0.00 0.00 179.25 179.18 1aj8 h ALA 159 N 0.77 0.58 -0.04 0.00 0.00 -1.78 -2.74 119.26 116.06 1aj8 h ALA 159 Ca 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1aj8 h ALA 159 Cb 0.51 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1aj8 h ALA 159 CO 0.02 0.29 -0.02 -0.97 0.00 0.00 0.00 179.25 178.58 1aj8 h ASN 160 N 0.58 0.05 -0.13 0.00 -0.73 -0.59 0.18 115.58 114.94 1aj8 h ASN 160 Ca 0.13 -0.00 -0.04 0.00 1.87 0.00 0.00 56.30 58.26 1aj8 h ASN 160 Cb 0.36 -0.01 -0.00 0.00 0.27 0.00 0.00 38.32 38.93 1aj8 h ASN 160 CO 0.01 0.08 -0.08 0.15 -0.37 0.00 0.00 177.43 177.22 1aj8 h PHE 161 N 0.06 0.34 -0.36 0.67 3.57 -1.18 -0.61 116.94 119.43 1aj8 h PHE 161 Ca 0.02 -0.09 -0.04 0.00 3.53 0.00 0.00 57.97 61.39 1aj8 h PHE 161 Cb 0.07 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 1aj8 h PHE 161 CO 0.00 0.64 0.05 -0.07 -2.23 0.00 0.00 178.31 176.70 1aj8 h LEU 162 N -0.07 0.50 0.01 0.59 4.07 -1.21 -1.23 115.31 117.97 1aj8 h LEU 162 Ca 0.03 -0.08 -0.00 0.00 0.08 0.00 0.00 57.88 57.91 1aj8 h LEU 162 Cb 0.56 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.17 1aj8 h LEU 162 CO 0.02 0.53 -0.00 0.22 -1.08 0.00 0.00 178.44 178.13 1aj8 h TYR 163 N 0.52 -0.01 -0.64 1.13 3.20 -0.43 -1.21 116.97 119.54 1aj8 h TYR 163 Ca 0.12 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.92 1aj8 h TYR 163 Cb 0.26 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 1aj8 h TYR 163 CO 0.01 0.28 0.14 0.52 -1.64 0.00 0.00 178.16 177.47 1aj8 h MET 164 N -0.30 1.01 -0.18 1.82 2.86 -0.94 0.60 114.93 119.80 1aj8 h MET 164 Ca -0.00 -0.24 -0.05 0.00 -2.06 0.00 0.00 59.70 57.35 1aj8 h MET 164 Cb 0.29 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 1aj8 h MET 164 CO 0.00 0.91 -0.08 1.25 1.06 0.00 0.00 176.91 180.05 1aj8 h LEU 165 N 0.96 0.39 0.00 1.22 5.85 -1.20 -3.31 115.31 119.22 1aj8 h LEU 165 Ca 0.20 -0.40 0.00 0.00 0.84 0.00 0.00 57.88 58.52 1aj8 h LEU 165 Cb 0.36 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1aj8 h LEU 165 CO 0.00 0.71 -1.04 1.41 -0.34 0.00 0.00 178.44 179.18 1aj8 n HIS 166 N -4.60 0.68 -1.01 1.25 8.25 -0.46 -4.95 115.22 114.38 1aj8 n HIS 166 Ca -0.05 0.20 -0.00 0.00 -0.26 0.00 0.00 57.72 57.60 1aj8 n HIS 166 Cb 0.31 -0.77 -0.00 0.00 1.12 0.00 0.00 29.99 30.65 1aj8 n HIS 166 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1aj8 n GLY 167 N 1.25 0.47 3.22 -1.41 0.00 0.21 -5.00 105.19 103.93 1aj8 n GLY 167 Ca 0.00 -0.16 -0.13 0.00 0.00 0.00 0.00 46.02 45.73 1aj8 n GLY 167 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1aj8 s GLU 168 N -0.49 0.39 0.38 1.61 -1.05 -1.12 -5.01 118.70 113.40 1aj8 s GLU 168 Ca 0.00 0.47 -0.28 0.00 -0.15 0.00 0.00 54.97 55.02 1aj8 s GLU 168 Cb 0.00 0.18 -0.11 0.00 -0.44 0.00 0.00 34.13 33.76 1aj8 s GLU 168 CO 0.00 -0.05 1.46 -1.21 0.95 0.00 0.00 175.26 176.41 1aj8 s GLU 169 N 0.23 4.08 0.59 -4.83 2.02 -1.26 -4.05 118.70 115.48 1aj8 s GLU 169 Ca -0.00 2.53 -0.08 0.00 0.02 0.00 0.00 54.97 57.43 1aj8 s GLU 169 Cb -0.03 -2.94 -0.02 0.00 0.10 0.00 0.00 34.13 31.25 1aj8 s GLU 169 CO -0.00 -0.54 0.94 -1.25 0.02 0.00 0.00 175.26 174.44 1aj8 s PRO 170 N -2.11 3.26 0.71 0.39 0.04 -1.26 -4.97 135.00 131.06 1aj8 s PRO 170 Ca 0.53 0.35 -0.11 0.00 0.04 0.00 0.00 61.00 61.81 1aj8 s PRO 170 Cb -0.46 -2.20 0.02 0.00 0.04 0.00 0.00 34.50 31.90 1aj8 s PRO 170 CO 0.62 -0.59 1.07 -1.25 0.04 0.00 0.00 177.00 176.88 1aj8 s PRO 171 N -5.04 2.79 0.21 0.56 0.04 -1.26 -4.79 135.00 127.51 1aj8 s PRO 171 Ca 0.53 0.98 -0.13 0.00 0.04 0.00 0.00 61.00 62.42 1aj8 s PRO 171 Cb -0.11 -1.97 0.24 0.00 0.04 0.00 0.00 34.50 32.70 1aj8 s PRO 171 CO 0.49 -1.21 1.63 -0.22 0.04 0.00 0.00 177.00 177.72 1aj8 h LYS 172 N -0.80 0.00 -0.06 4.56 3.11 -1.99 -0.23 116.57 121.16 1aj8 h LYS 172 Ca -0.44 -0.00 0.02 0.00 -2.81 0.00 0.00 60.65 57.42 1aj8 h LYS 172 Cb 1.22 -0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.44 1aj8 h LYS 172 CO 0.56 0.00 0.04 0.93 -2.81 0.00 0.00 179.45 178.17 1aj8 h GLU 173 N 0.00 0.00 0.14 1.90 3.07 -1.99 -0.78 114.58 116.92 1aj8 h GLU 173 Ca 0.30 0.00 -0.24 0.00 -0.50 0.00 0.00 59.36 58.92 1aj8 h GLU 173 Cb 0.46 0.00 0.03 0.00 -0.84 0.00 0.00 28.75 28.40 1aj8 h GLU 173 CO -0.65 0.00 -1.04 -1.49 -1.40 0.00 0.00 179.01 174.43 1aj8 h TRP 174 N 0.00 0.78 -0.90 4.33 4.06 -1.43 -2.05 115.95 120.73 1aj8 h TRP 174 Ca 0.03 -0.52 0.01 0.00 2.06 0.00 0.00 58.89 60.46 1aj8 h TRP 174 Cb 0.11 -0.05 -0.05 0.00 -1.00 0.00 0.00 29.16 28.18 1aj8 h TRP 174 CO 0.00 1.39 0.60 1.49 -3.56 0.00 0.00 178.44 178.35 1aj8 h GLU 175 N -0.05 1.18 0.07 0.49 4.22 -0.78 -0.53 114.58 119.17 1aj8 h GLU 175 Ca -0.17 -0.07 -0.00 0.00 0.08 0.00 0.00 59.36 59.20 1aj8 h GLU 175 Cb 1.78 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 30.77 1aj8 h GLU 175 CO 0.20 0.78 -0.03 -0.22 -2.18 0.00 0.00 179.01 177.55 1aj8 h LYS 176 N 1.21 -0.09 -0.65 1.92 1.63 -1.18 -0.36 116.57 119.04 1aj8 h LYS 176 Ca 0.33 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.14 1aj8 h LYS 176 Cb -0.13 0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.49 1aj8 h LYS 176 CO -0.07 0.22 0.42 0.00 -3.45 0.00 0.00 179.45 176.56 1aj8 h ALA 177 N 0.49 0.83 -0.24 5.00 0.00 -1.14 -0.47 119.26 123.73 1aj8 h ALA 177 Ca -0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1aj8 h ALA 177 Cb 0.35 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1aj8 h ALA 177 CO 0.02 0.27 0.09 1.98 0.00 0.00 0.00 179.25 181.61 1aj8 h MET 178 N 0.88 0.36 -0.50 0.00 1.85 -1.08 -0.38 114.93 116.06 1aj8 h MET 178 Ca 0.24 -0.06 -0.00 0.00 -0.61 0.00 0.00 59.70 59.26 1aj8 h MET 178 Cb -0.07 -0.06 -0.02 0.00 0.43 0.00 0.00 31.60 31.88 1aj8 h MET 178 CO -0.05 0.40 0.30 0.22 -0.40 0.00 0.00 176.91 177.39 1aj8 h ASP 179 N 0.23 0.59 -0.77 1.39 3.58 -0.84 -1.70 116.42 118.91 1aj8 h ASP 179 Ca 0.08 -0.05 -0.03 0.00 0.42 0.00 0.00 57.03 57.44 1aj8 h ASP 179 Cb 0.18 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 41.04 1aj8 h ASP 179 CO -0.01 0.47 0.35 0.58 -2.88 0.00 0.00 179.24 177.75 1aj8 h VAL 180 N 0.66 1.25 -0.69 2.25 2.07 -0.96 -1.81 116.25 119.02 1aj8 h VAL 180 Ca 0.18 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.97 1aj8 h VAL 180 Cb -0.02 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 29.99 1aj8 h VAL 180 CO -0.03 0.31 0.42 0.00 0.02 0.00 0.00 177.57 178.29 1aj8 h ALA 181 N 1.27 0.88 -0.58 1.67 0.00 -0.46 -0.37 119.26 121.66 1aj8 h ALA 181 Ca 0.27 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 1aj8 h ALA 181 Cb 0.15 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1aj8 h ALA 181 CO -0.03 0.35 0.04 -0.07 0.00 0.00 0.00 179.25 179.54 1aj8 h LEU 182 N 0.94 0.95 -0.39 0.00 4.07 -0.95 -1.71 115.31 118.22 1aj8 h LEU 182 Ca 0.25 -0.24 -0.04 0.00 0.08 0.00 0.00 57.88 57.93 1aj8 h LEU 182 Cb -0.04 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.43 1aj8 h LEU 182 CO -0.05 0.98 0.10 0.40 -1.08 0.00 0.00 178.44 178.79 1aj8 h ILE 183 N 0.91 1.23 0.00 1.22 2.04 -0.86 -0.36 117.51 121.69 1aj8 h ILE 183 Ca 0.17 -0.77 -0.04 0.00 1.00 0.00 0.00 64.86 65.22 1aj8 h ILE 183 Cb 0.47 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1aj8 h ILE 183 CO 0.02 0.27 -0.19 -0.07 0.00 0.00 0.00 178.15 178.17 1aj8 h LEU 184 N 0.48 0.00 -0.83 1.44 3.38 -0.85 -2.67 115.31 116.25 1aj8 h LEU 184 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1aj8 h LEU 184 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1aj8 h LEU 184 CO 0.00 0.19 -0.51 -1.22 0.09 0.00 0.00 178.44 176.99 1aj8 n TYR 185 N -3.81 0.00 -0.18 1.13 4.01 -0.66 -4.63 117.16 113.01 1aj8 n TYR 185 Ca -0.02 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.70 1aj8 n TYR 185 Cb 0.29 -0.02 0.07 0.00 -0.31 0.00 0.00 39.34 39.38 1aj8 n TYR 185 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1aj8 h ALA 186 N 3.76 0.69 -2.54 -0.72 0.00 -0.70 -2.83 119.26 116.93 1aj8 h ALA 186 Ca 0.00 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1aj8 h ALA 186 Cb 0.70 -0.01 -0.22 0.00 0.00 0.00 0.00 17.79 18.26 1aj8 h ALA 186 CO 0.00 -0.14 -0.17 -2.00 0.00 0.00 0.00 179.25 176.94 1aj8 s GLU 187 N -6.12 0.63 -0.40 0.00 2.56 -1.26 -0.66 118.70 113.45 1aj8 s GLU 187 Ca -0.13 0.35 0.10 0.00 0.00 0.00 0.00 54.97 55.29 1aj8 s GLU 187 Cb 0.15 0.30 0.38 0.00 2.00 0.00 0.00 34.13 36.96 1aj8 s GLU 187 CO 0.74 -0.13 1.20 1.58 -0.56 0.00 0.00 175.26 178.09 1aj8 n HIS 188 N 2.16 -1.82 -3.92 5.30 -0.00 -1.26 -5.06 115.22 110.62 1aj8 n HIS 188 Ca -0.16 -2.22 0.00 0.00 0.46 0.00 0.00 57.72 55.79 1aj8 n HIS 188 Cb 0.57 1.17 0.00 0.00 -0.12 0.00 0.00 29.99 31.61 1aj8 n HIS 188 CO 0.00 0.00 0.00 -1.91 0.46 0.00 0.00 176.34 174.89 1aj8 n GLU 189 N -0.25 0.00 -2.78 1.57 2.13 -1.26 -3.73 120.64 116.31 1aj8 n GLU 189 Ca 0.03 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.42 1aj8 n GLU 189 Cb 0.80 0.00 0.01 0.00 0.27 0.00 0.00 31.44 32.52 1aj8 n GLU 189 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 1aj8 n ILE 190 N 0.00 5.49 -1.35 6.31 3.06 -1.26 -4.81 119.36 126.81 1aj8 n ILE 190 Ca 0.00 -5.74 -0.30 0.00 -2.50 0.00 0.00 62.75 54.21 1aj8 n ILE 190 Cb 0.00 -1.94 0.21 0.00 0.54 0.00 0.00 39.64 38.44 1aj8 n ILE 190 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 1aj8 s ASN 191 N -1.33 1.92 0.18 9.51 2.20 -1.24 -4.62 114.94 121.55 1aj8 s ASN 191 Ca 0.35 0.64 -0.14 0.00 -0.94 0.00 0.00 52.86 52.77 1aj8 s ASN 191 Cb 0.10 -0.92 0.15 0.00 -2.00 0.00 0.00 41.25 38.57 1aj8 s ASN 191 CO 0.02 -3.51 1.71 0.00 -2.94 0.00 0.00 177.10 172.39 1aj8 h ALA 192 N -2.16 0.47 -0.68 3.54 0.00 -1.95 0.29 119.26 118.77 1aj8 h ALA 192 Ca -0.46 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.49 1aj8 h ALA 192 Cb 1.29 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 1aj8 h ALA 192 CO 0.41 -0.33 0.20 0.66 0.00 0.00 0.00 179.25 180.18 1aj8 h SER 193 N 0.19 1.01 -0.10 0.00 4.64 -1.87 -1.21 113.55 116.22 1aj8 h SER 193 Ca 0.22 -0.22 -0.11 0.00 -0.47 0.00 0.00 61.79 61.22 1aj8 h SER 193 Cb 0.29 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1aj8 h SER 193 CO -0.31 0.96 -0.27 0.74 -0.87 0.00 0.00 176.83 177.08 1aj8 h THR 194 N 1.01 1.27 -0.46 2.95 2.02 -1.77 -1.73 112.91 116.21 1aj8 h THR 194 Ca 0.22 -1.34 -0.03 0.00 0.77 0.00 0.00 66.41 66.02 1aj8 h THR 194 Cb 0.33 1.36 -0.02 0.00 -1.74 0.00 0.00 68.15 68.08 1aj8 h THR 194 CO -0.00 0.43 0.15 0.25 0.37 0.00 0.00 175.52 176.72 1aj8 h LEU 195 N 0.48 0.66 -0.85 2.58 5.85 -0.56 -0.92 115.31 122.55 1aj8 h LEU 195 Ca 0.06 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.60 1aj8 h LEU 195 Cb 0.73 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.54 1aj8 h LEU 195 CO 0.06 0.68 0.56 0.00 -0.34 0.00 0.00 178.44 179.40 1aj8 h ALA 196 N 1.00 1.08 -0.31 1.25 0.00 -0.95 0.19 119.26 121.53 1aj8 h ALA 196 Ca 0.15 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1aj8 h ALA 196 Cb 0.25 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1aj8 h ALA 196 CO -0.01 0.47 0.14 0.28 0.00 0.00 0.00 179.25 180.14 1aj8 h VAL 197 N 1.14 1.17 -0.36 0.00 2.07 -1.05 -2.46 116.25 116.76 1aj8 h VAL 197 Ca 0.31 -0.48 -0.09 0.00 0.82 0.00 0.00 66.70 67.26 1aj8 h VAL 197 Cb -0.12 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1aj8 h VAL 197 CO -0.07 0.17 -0.13 0.24 0.02 0.00 0.00 177.57 177.80 1aj8 h MET 198 N 0.37 0.64 -0.37 1.57 2.07 -0.55 -1.41 114.93 117.25 1aj8 h MET 198 Ca 0.11 -0.21 -0.03 0.00 -2.07 0.00 0.00 59.70 57.50 1aj8 h MET 198 Cb 0.14 -0.06 -0.02 0.00 -1.87 0.00 0.00 31.60 29.80 1aj8 h MET 198 CO -0.01 0.75 0.10 1.15 1.07 0.00 0.00 176.91 179.97 1aj8 h THR 199 N 0.58 1.22 -0.53 2.22 2.02 -0.48 0.88 112.91 118.82 1aj8 h THR 199 Ca 0.10 -0.72 -0.05 0.00 0.77 0.00 0.00 66.41 66.51 1aj8 h THR 199 Cb 0.57 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 1aj8 h THR 199 CO 0.04 0.25 0.15 0.58 0.37 0.00 0.00 175.52 176.90 1aj8 h VAL 200 N 0.44 1.24 -0.15 3.16 2.07 -1.36 -2.62 116.25 119.04 1aj8 h VAL 200 Ca 0.12 -0.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.77 1aj8 h VAL 200 Cb 0.28 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1aj8 h VAL 200 CO -0.00 0.30 -0.08 1.23 0.02 0.00 0.00 177.57 179.04 1aj8 h GLY 201 N 0.73 0.24 2.00 2.17 0.00 -0.92 -2.59 103.07 104.71 1aj8 h GLY 201 Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1aj8 h GLY 201 CO -0.00 0.13 0.00 -1.14 0.00 0.00 0.00 176.54 175.53 1aj8 n SER 202 N -4.32 0.06 -1.03 0.19 3.41 0.27 -0.42 113.62 111.79 1aj8 n SER 202 Ca -0.01 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.24 1aj8 n SER 202 Cb 0.23 -0.53 0.20 0.00 -0.26 0.00 0.00 64.21 63.84 1aj8 n SER 202 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1aj8 n THR 203 N -1.58 0.30 -2.33 6.66 -2.24 -0.98 -3.76 114.28 110.36 1aj8 n THR 203 Ca 0.02 -0.62 -0.13 0.00 -2.27 0.00 0.00 64.05 61.05 1aj8 n THR 203 Cb 0.11 1.10 -0.00 0.00 -2.10 0.00 0.00 70.33 69.44 1aj8 n THR 203 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1aj8 n LEU 204 N 1.33 -1.70 0.00 3.22 4.32 0.44 -5.03 117.00 119.58 1aj8 n LEU 204 Ca 0.17 -0.04 -0.11 0.00 -0.02 0.00 0.00 56.01 56.02 1aj8 n LEU 204 Cb 0.58 -2.02 0.09 0.00 -1.62 0.00 0.00 43.42 40.45 1aj8 n LEU 204 CO 0.15 -0.09 0.23 -0.24 -1.22 0.00 0.00 177.39 176.23 1aj8 n SER 205 N -0.55 -1.17 -4.91 -1.43 2.88 -1.23 -3.83 113.62 103.39 1aj8 n SER 205 Ca -0.14 -0.80 -0.27 0.00 -1.33 0.00 0.00 58.87 56.32 1aj8 n SER 205 Cb 0.61 -0.36 0.01 0.00 -0.75 0.00 0.00 64.21 63.72 1aj8 n SER 205 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 1aj8 s ASP 206 N -2.59 6.07 0.20 -3.46 -4.77 -1.26 -1.75 116.67 109.12 1aj8 s ASP 206 Ca 0.26 0.91 -0.11 0.00 -3.30 0.00 0.00 52.55 50.31 1aj8 s ASP 206 Cb -0.02 -2.12 0.25 0.00 -1.09 0.00 0.00 42.92 39.94 1aj8 s ASP 206 CO 0.19 -0.74 1.72 0.22 0.70 0.00 0.00 175.17 177.26 1aj8 h TYR 207 N 0.06 0.23 -0.51 2.11 5.03 -1.86 -2.58 116.97 119.46 1aj8 h TYR 207 Ca -0.46 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 60.85 1aj8 h TYR 207 Cb 1.22 -0.02 -0.02 0.00 1.55 0.00 0.00 36.73 39.46 1aj8 h TYR 207 CO 0.56 0.01 0.20 1.88 -1.32 0.00 0.00 178.16 179.49 1aj8 h TYR 208 N 0.28 0.77 -0.99 -3.82 -1.99 -1.93 -0.78 116.97 108.51 1aj8 h TYR 208 Ca 0.29 -0.06 0.03 0.00 2.00 0.00 0.00 58.73 60.99 1aj8 h TYR 208 Cb 0.40 -0.23 -0.06 0.00 2.00 0.00 0.00 36.73 38.84 1aj8 h TYR 208 CO -0.22 0.64 0.65 0.77 -0.00 0.00 0.00 178.16 180.00 1aj8 h SER 209 N 0.68 1.09 0.00 3.88 0.02 -1.84 0.20 113.55 117.59 1aj8 h SER 209 Ca 0.17 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1aj8 h SER 209 Cb 0.20 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.49 1aj8 h SER 209 CO -0.01 0.75 -0.00 0.00 -1.14 0.00 0.00 176.83 176.43 1aj8 h ALA 210 N 1.40 -0.01 -0.30 3.77 0.00 -1.05 -2.87 119.26 120.20 1aj8 h ALA 210 Ca 0.39 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1aj8 h ALA 210 Cb -0.03 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1aj8 h ALA 210 CO -0.12 -0.33 0.05 0.82 0.00 0.00 0.00 179.25 179.67 1aj8 h ILE 211 N -0.35 1.16 -0.29 0.00 5.03 -0.87 -2.02 117.51 120.16 1aj8 h ILE 211 Ca -0.00 -0.57 -0.03 0.00 -0.12 0.00 0.00 64.86 64.14 1aj8 h ILE 211 Cb 0.35 0.88 -0.02 0.00 -3.03 0.00 0.00 36.82 35.00 1aj8 h ILE 211 CO 0.00 0.20 0.06 -0.07 -0.68 0.00 0.00 178.15 177.66 1aj8 h LEU 212 N 0.43 0.39 -0.71 1.44 4.07 -0.86 -0.37 115.31 119.70 1aj8 h LEU 212 Ca 0.10 -0.05 -0.12 0.00 0.08 0.00 0.00 57.88 57.89 1aj8 h LEU 212 Cb 0.21 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 41.84 1aj8 h LEU 212 CO -0.00 0.41 -0.30 0.00 -1.08 0.00 0.00 178.44 177.47 1aj8 h ALA 213 N 1.65 0.89 -0.12 1.53 0.00 -1.15 -0.98 119.26 121.09 1aj8 h ALA 213 Ca 0.10 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1aj8 h ALA 213 Cb 0.19 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1aj8 h ALA 213 CO -0.00 0.63 0.04 0.78 0.00 0.00 0.00 179.25 180.70 1aj8 h GLY 214 N 1.00 0.19 0.61 0.00 0.00 -1.01 -1.09 103.07 102.77 1aj8 h GLY 214 Ca 0.07 -0.11 0.05 0.00 0.00 0.00 0.00 47.33 47.34 1aj8 h GLY 214 CO 0.07 0.10 0.09 -2.22 0.00 0.00 0.00 176.54 174.57 1aj8 h ILE 215 N 0.02 0.85 -0.71 2.60 1.08 -0.93 0.20 117.51 120.62 1aj8 h ILE 215 Ca 0.04 -0.07 0.02 0.00 -0.39 0.00 0.00 64.86 64.45 1aj8 h ILE 215 Cb 0.19 0.61 -0.04 0.00 -3.07 0.00 0.00 36.82 34.51 1aj8 h ILE 215 CO -0.00 0.04 0.46 1.23 -0.69 0.00 0.00 178.15 179.18 1aj8 h GLY 216 N 0.22 1.01 0.85 5.37 0.00 -1.02 -1.83 103.07 107.66 1aj8 h GLY 216 Ca 0.17 -0.35 -0.11 0.00 0.00 0.00 0.00 47.33 47.03 1aj8 h GLY 216 CO -0.20 0.32 -0.33 0.00 0.00 0.00 0.00 176.54 176.33 1aj8 h ALA 217 N 1.28 0.26 -0.38 3.60 0.00 -0.64 -3.16 119.26 120.21 1aj8 h ALA 217 Ca 0.27 -0.42 0.05 0.00 0.00 0.00 0.00 54.91 54.81 1aj8 h ALA 217 Cb -0.05 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1aj8 h ALA 217 CO -0.08 0.30 0.26 1.25 0.00 0.00 0.00 179.25 180.98 1aj8 h LEU 218 N 0.15 0.25 -1.71 0.00 5.85 -0.46 -2.07 115.31 117.32 1aj8 h LEU 218 Ca 0.01 -0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.78 1aj8 h LEU 218 Cb 0.92 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.88 1aj8 h LEU 218 CO 0.07 0.17 0.29 0.50 -0.34 0.00 0.00 178.44 179.13 1aj8 h LYS 219 N 0.29 0.35 -6.49 1.25 3.64 -1.30 -1.46 116.57 112.86 1aj8 h LYS 219 Ca 0.17 -0.02 -0.61 0.00 -1.27 0.00 0.00 60.65 58.92 1aj8 h LYS 219 Cb 0.29 -0.08 0.10 0.00 -0.41 0.00 0.00 32.23 32.13 1aj8 h LYS 219 CO -0.03 0.23 0.31 0.41 -2.27 0.00 0.00 179.45 178.10 1aj8 n GLY 220 N -1.52 0.13 0.31 5.01 0.00 -0.78 -3.82 105.19 104.53 1aj8 n GLY 220 Ca 0.05 0.42 0.17 0.00 0.00 0.00 0.00 46.02 46.66 1aj8 n GLY 220 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1aj8 h PRO 221 N 2.89 0.00 -0.64 1.61 0.13 -1.87 0.12 132.00 134.25 1aj8 h PRO 221 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1aj8 h PRO 221 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1aj8 h PRO 221 CO 0.66 0.00 0.00 0.44 -0.23 0.00 0.00 178.00 178.87 1aj8 n ILE 222 N -3.63 0.85 0.00 -3.56 -5.35 -1.26 -2.75 119.36 103.66 1aj8 n ILE 222 Ca -0.03 -0.91 0.00 0.00 -0.27 0.00 0.00 62.75 61.55 1aj8 n ILE 222 Cb 0.10 0.61 0.00 0.00 -1.74 0.00 0.00 39.64 38.61 1aj8 n ILE 222 CO 0.00 0.00 0.00 1.57 -1.76 0.00 0.00 176.55 176.36 1aj8 n HIS 223 N 1.58 0.00 0.04 4.28 -0.00 -0.17 -4.91 115.22 116.04 1aj8 n HIS 223 Ca 0.23 0.00 0.20 0.00 0.46 0.00 0.00 57.72 58.61 1aj8 n HIS 223 Cb 0.61 0.00 0.72 0.00 -0.12 0.00 0.00 29.99 31.20 1aj8 n HIS 223 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 1aj8 h GLY 224 N 0.00 0.00 2.00 1.57 0.00 -1.37 -1.31 103.07 103.96 1aj8 h GLY 224 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1aj8 h GLY 224 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.21 1aj8 h GLY 225 N 0.00 0.00 2.00 4.60 0.00 -0.07 -1.99 103.07 107.61 1aj8 h GLY 225 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 1aj8 h GLY 225 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 1aj8 h ALA 226 N 2.02 1.00 -0.54 3.60 0.00 -1.04 -1.95 119.26 122.35 1aj8 h ALA 226 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1aj8 h ALA 226 Cb 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1aj8 h ALA 226 CO 0.00 0.00 0.26 -0.24 0.00 0.00 0.00 179.25 179.27 1aj8 h VAL 227 N 0.00 1.18 0.17 0.00 3.04 -1.55 0.38 116.25 119.47 1aj8 h VAL 227 Ca 0.00 -0.51 -0.32 0.00 -1.01 0.00 0.00 66.70 64.86 1aj8 h VAL 227 Cb 0.25 0.50 0.01 0.00 -2.01 0.00 0.00 31.29 30.03 1aj8 h VAL 227 CO 0.00 0.21 -1.50 -0.33 -1.01 0.00 0.00 177.57 174.94 1aj8 h GLU 228 N 0.75 0.36 -0.29 4.17 5.08 -1.59 -3.29 114.58 119.78 1aj8 h GLU 228 Ca 0.19 -0.62 -0.09 0.00 -1.00 0.00 0.00 59.36 57.84 1aj8 h GLU 228 Cb 0.08 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1aj8 h GLU 228 CO -0.02 1.26 -0.21 0.93 -1.00 0.00 0.00 179.01 179.97 1aj8 h GLU 229 N 0.10 0.53 0.40 2.33 4.39 -1.12 -2.57 114.58 118.64 1aj8 h GLU 229 Ca -0.24 -0.19 -0.02 0.00 0.34 0.00 0.00 59.36 59.25 1aj8 h GLU 229 Cb 2.07 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 30.68 1aj8 h GLU 229 CO 0.20 0.71 -0.19 0.00 -1.16 0.00 0.00 179.01 178.58 1aj8 h ALA 230 N 1.30 -0.53 -0.65 3.43 0.00 -0.36 -0.68 119.26 121.76 1aj8 h ALA 230 Ca 0.08 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1aj8 h ALA 230 Cb 0.63 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1aj8 h ALA 230 CO 0.04 -0.78 0.18 0.97 0.00 0.00 0.00 179.25 179.66 1aj8 h ILE 231 N -0.57 1.25 0.00 0.00 2.10 -1.62 -1.57 117.51 117.09 1aj8 h ILE 231 Ca -0.05 -0.88 -0.04 0.00 1.08 0.00 0.00 64.86 64.96 1aj8 h ILE 231 Cb 0.43 0.55 -0.01 0.00 -1.09 0.00 0.00 36.82 36.71 1aj8 h ILE 231 CO 0.09 0.34 -0.21 0.11 -1.08 0.00 0.00 178.15 177.40 1aj8 h LYS 232 N 0.97 0.00 -0.36 2.19 1.57 -1.39 -2.15 116.57 117.40 1aj8 h LYS 232 Ca 0.21 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.91 1aj8 h LYS 232 Cb 0.31 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 1aj8 h LYS 232 CO -0.00 0.21 -0.10 0.37 -0.57 0.00 0.00 179.45 179.36 1aj8 h GLN 233 N 0.00 0.70 -0.52 3.15 4.15 -0.13 0.73 115.11 123.19 1aj8 h GLN 233 Ca -0.00 -0.28 -0.06 0.00 0.77 0.00 0.00 58.65 59.09 1aj8 h GLN 233 Cb 0.41 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.04 1aj8 h GLN 233 CO 0.03 0.87 0.11 0.74 -1.93 0.00 0.00 178.83 178.64 1aj8 h PHE 234 N 0.50 0.90 -0.51 3.99 0.04 -1.06 -1.37 116.94 119.42 1aj8 h PHE 234 Ca 0.09 -0.12 -0.04 0.00 2.80 0.00 0.00 57.97 60.71 1aj8 h PHE 234 Cb 0.61 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 38.49 1aj8 h PHE 234 CO 0.05 0.80 0.17 0.52 -0.60 0.00 0.00 178.31 179.25 1aj8 h MET 235 N 0.74 0.76 -0.49 1.51 2.86 -1.26 -2.08 114.93 116.98 1aj8 h MET 235 Ca 0.16 -0.13 -0.11 0.00 -2.06 0.00 0.00 59.70 57.56 1aj8 h MET 235 Cb 0.37 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.88 1aj8 h MET 235 CO 0.01 0.65 -0.14 1.49 1.06 0.00 0.00 176.91 179.98 1aj8 h GLU 236 N 0.74 0.93 -0.87 1.72 4.81 -0.39 -2.79 114.58 118.72 1aj8 h GLU 236 Ca 0.17 -0.35 -0.01 0.00 -0.13 0.00 0.00 59.36 59.05 1aj8 h GLU 236 Cb 0.20 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 1aj8 h GLU 236 CO -0.01 1.00 0.50 0.82 -0.73 0.00 0.00 179.01 180.60 1aj8 h ILE 237 N 0.82 1.25 0.00 2.32 2.04 -0.60 -3.47 117.51 119.87 1aj8 h ILE 237 Ca 0.13 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1aj8 h ILE 237 Cb 0.68 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 1aj8 h ILE 237 CO 0.05 0.27 0.00 0.61 0.00 0.00 0.00 178.15 179.08 1aj8 n GLY 238 N -1.18 2.33 3.07 5.37 0.00 -0.89 -4.76 105.19 109.13 1aj8 n GLY 238 Ca 0.09 -0.44 -0.09 0.00 0.00 0.00 0.00 46.02 45.58 1aj8 n GLY 238 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1aj8 s SER 239 N 0.00 0.22 0.55 1.61 1.04 -1.26 -5.00 113.70 110.86 1aj8 s SER 239 Ca 0.00 -0.54 0.25 0.00 0.48 0.00 0.00 55.95 56.14 1aj8 s SER 239 Cb 0.00 0.19 1.46 0.00 0.10 0.00 0.00 66.02 67.76 1aj8 s SER 239 CO 0.00 -0.45 2.03 -0.65 0.98 0.00 0.00 173.24 175.16 1aj8 h PRO 240 N 3.95 0.00 0.00 4.02 0.11 -1.89 -1.06 132.00 137.13 1aj8 h PRO 240 Ca -0.32 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.76 1aj8 h PRO 240 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 1aj8 h PRO 240 CO 0.49 0.00 -0.13 0.93 -0.21 0.00 0.00 178.00 179.07 1aj8 h GLU 241 N 0.00 0.00 -0.02 1.05 4.39 -1.96 -2.96 114.58 115.08 1aj8 h GLU 241 Ca 0.18 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.88 1aj8 h GLU 241 Cb 0.78 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.43 1aj8 h GLU 241 CO -0.00 0.13 -0.11 1.63 -1.16 0.00 0.00 179.01 179.51 1aj8 n LYS 242 N -3.41 1.80 0.38 2.33 5.02 -0.40 -4.55 118.16 119.32 1aj8 n LYS 242 Ca -0.01 -1.35 -0.19 0.00 -2.02 0.00 0.00 58.31 54.74 1aj8 n LYS 242 Cb 0.31 -1.47 -0.10 0.00 -0.02 0.00 0.00 35.03 33.75 1aj8 n LYS 242 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1aj8 h VAL 243 N 3.30 0.02 -0.54 -0.18 2.07 -1.55 -1.87 116.25 117.49 1aj8 h VAL 243 Ca 0.00 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 1aj8 h VAL 243 Cb 0.77 0.02 -0.09 0.00 -1.52 0.00 0.00 31.29 30.46 1aj8 h VAL 243 CO 0.00 0.00 -0.04 -0.08 0.02 0.00 0.00 177.57 177.47 1aj8 h GLU 244 N -1.12 0.08 -0.77 1.57 4.81 -1.80 0.22 114.58 117.57 1aj8 h GLU 244 Ca -0.09 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 1aj8 h GLU 244 Cb 0.93 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.25 1aj8 h GLU 244 CO 0.04 0.05 0.36 1.49 -0.73 0.00 0.00 179.01 180.22 1aj8 h GLU 245 N 0.08 1.11 -0.55 1.92 4.81 -1.84 -2.42 114.58 117.69 1aj8 h GLU 245 Ca 0.28 -0.16 -0.09 0.00 -0.13 0.00 0.00 59.36 59.26 1aj8 h GLU 245 Cb 0.43 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 1aj8 h GLU 245 CO -0.49 0.86 -0.00 2.35 -0.73 0.00 0.00 179.01 180.99 1aj8 h TRP 246 N 1.10 1.06 0.40 0.92 7.01 -0.21 -2.80 115.95 123.42 1aj8 h TRP 246 Ca 0.26 -0.19 -0.01 0.00 2.11 0.00 0.00 58.89 61.07 1aj8 h TRP 246 Cb 0.12 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 26.90 1aj8 h TRP 246 CO 0.01 0.96 -0.25 0.35 -2.79 0.00 0.00 178.44 176.73 1aj8 h PHE 247 N 0.85 -0.65 0.00 2.65 3.57 -0.21 -0.98 116.94 122.18 1aj8 h PHE 247 Ca 0.16 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.61 1aj8 h PHE 247 Cb 0.54 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.51 1aj8 h PHE 247 CO 0.04 -0.38 -0.20 0.74 -2.23 0.00 0.00 178.31 176.28 1aj8 h PHE 248 N -0.62 0.00 -0.25 0.41 0.04 -1.49 -0.79 116.94 114.24 1aj8 h PHE 248 Ca -0.04 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.58 1aj8 h PHE 248 Cb 0.51 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.66 1aj8 h PHE 248 CO -0.10 0.20 -0.43 -0.22 -0.60 0.00 0.00 178.31 177.16 1aj8 h LYS 249 N 0.00 0.73 -0.72 1.51 3.11 -1.27 -1.49 116.57 118.45 1aj8 h LYS 249 Ca -0.00 -0.45 -0.02 0.00 -2.81 0.00 0.00 60.65 57.36 1aj8 h LYS 249 Cb 0.44 0.05 -0.03 0.00 -1.00 0.00 0.00 32.23 31.69 1aj8 h LYS 249 CO 0.03 1.07 0.36 0.00 -2.81 0.00 0.00 179.45 178.10 1aj8 h ALA 250 N 0.65 0.92 -0.31 5.00 0.00 -0.36 0.95 119.26 126.11 1aj8 h ALA 250 Ca 0.02 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1aj8 h ALA 250 Cb 1.03 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1aj8 h ALA 250 CO 0.10 0.47 0.08 -0.07 0.00 0.00 0.00 179.25 179.83 1aj8 h LEU 251 N 1.00 0.46 -0.72 0.00 3.38 -1.10 0.21 115.31 118.53 1aj8 h LEU 251 Ca 0.25 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1aj8 h LEU 251 Cb 0.10 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 1aj8 h LEU 251 CO -0.03 0.56 0.47 -0.61 0.09 0.00 0.00 178.44 178.92 1aj8 h GLN 252 N 0.34 0.96 0.00 1.13 -0.00 -0.92 -1.74 115.11 114.88 1aj8 h GLN 252 Ca 0.10 -0.06 0.00 0.00 -0.00 0.00 0.00 58.65 58.69 1aj8 h GLN 252 Cb 0.27 -0.21 0.00 0.00 0.00 0.00 0.00 27.48 27.54 1aj8 h GLN 252 CO -0.00 0.64 0.00 1.04 0.00 0.00 0.00 178.83 180.51 1aj8 n GLN 253 N -4.57 0.18 -2.40 1.69 6.02 0.30 -4.88 117.38 113.71 1aj8 n GLN 253 Ca 0.07 0.08 -0.15 0.00 -0.01 0.00 0.00 57.00 56.98 1aj8 n GLN 253 Cb 0.02 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.78 1aj8 n GLN 253 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1aj8 n LYS 254 N -1.39 -1.72 -2.95 -1.09 4.76 -0.12 -4.98 118.16 110.67 1aj8 n LYS 254 Ca 0.09 0.72 -0.39 0.00 -2.87 0.00 0.00 58.31 55.85 1aj8 n LYS 254 Cb 0.23 -5.06 -0.06 0.00 -1.84 0.00 0.00 35.03 28.30 1aj8 n LYS 254 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1aj8 s ARG 255 N -4.89 4.58 0.08 1.97 3.52 0.54 -5.02 118.95 119.73 1aj8 s ARG 255 Ca 0.05 1.18 -0.30 0.00 -0.13 0.00 0.00 55.73 56.53 1aj8 s ARG 255 Cb -0.02 -3.22 -0.06 0.00 -1.56 0.00 0.00 34.95 30.10 1aj8 s ARG 255 CO 0.06 0.54 1.11 0.15 -0.81 0.00 0.00 175.30 176.35 1aj8 s LYS 256 N -1.25 4.52 -0.39 5.12 -0.14 -1.26 -4.65 119.74 121.68 1aj8 s LYS 256 Ca 0.37 1.66 -0.26 0.00 -1.36 0.00 0.00 55.97 56.38 1aj8 s LYS 256 Cb -0.23 -3.35 0.02 0.00 -1.68 0.00 0.00 37.83 32.59 1aj8 s LYS 256 CO 0.26 -0.09 0.93 0.42 -0.76 0.00 0.00 175.35 176.12 1aj8 s ILE 257 N 0.63 4.55 0.22 2.17 1.09 -1.26 -4.99 121.20 123.60 1aj8 s ILE 257 Ca 0.54 1.10 -0.30 0.00 -1.10 0.00 0.00 60.65 60.89 1aj8 s ILE 257 Cb -0.27 -4.37 -0.09 0.00 -1.06 0.00 0.00 42.46 36.67 1aj8 s ILE 257 CO 0.31 -0.62 1.38 -0.04 -0.10 0.00 0.00 174.94 175.87 1aj8 s MET 258 N 3.57 4.32 0.00 2.79 -1.94 -1.26 -2.38 119.30 124.40 1aj8 s MET 258 Ca 0.38 2.19 0.00 0.00 -1.71 0.00 0.00 55.69 56.55 1aj8 s MET 258 Cb -0.11 -3.15 0.00 0.00 2.01 0.00 0.00 34.83 33.58 1aj8 s MET 258 CO 0.21 -0.35 0.00 0.41 -0.01 0.00 0.00 175.02 175.28 1aj8 n GLY 259 N 2.34 0.64 3.38 -0.03 0.00 -1.26 -4.66 105.19 105.60 1aj8 n GLY 259 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 1aj8 n GLY 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aj8 s ALA 260 N -2.55 2.29 0.00 4.61 0.00 -1.00 -0.08 121.76 125.03 1aj8 s ALA 260 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 51.96 50.50 1aj8 s ALA 260 Cb 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.78 1aj8 s ALA 260 CO 0.00 0.48 0.00 0.41 0.00 0.00 0.00 175.76 176.65 1aj8 n GLY 261 N 0.81 -0.04 3.63 0.00 0.00 0.80 -4.84 105.19 105.54 1aj8 n GLY 261 Ca -0.17 -1.54 -0.11 0.00 0.00 0.00 0.00 46.02 44.20 1aj8 n GLY 261 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1aj8 s HIS 262 N -2.89 -0.54 0.24 1.61 2.46 -1.26 -4.62 115.29 110.28 1aj8 s HIS 262 Ca 0.00 1.28 -0.04 0.00 0.47 0.00 0.00 55.06 56.77 1aj8 s HIS 262 Cb 0.00 0.35 0.26 0.00 -0.13 0.00 0.00 32.58 33.06 1aj8 s HIS 262 CO 0.00 -0.29 1.75 -0.09 -2.47 0.00 0.00 174.74 173.64 1aj8 h ARG 263 N 4.18 0.91 0.00 2.88 9.65 -1.99 -3.37 114.38 126.64 1aj8 h ARG 263 Ca -0.27 -0.24 -0.15 0.00 -1.10 0.00 0.00 59.98 58.22 1aj8 h ARG 263 Cb 1.17 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 29.62 1aj8 h ARG 263 CO 0.12 0.87 -1.28 0.28 2.80 0.00 0.00 179.97 182.76 1aj8 n VAL 264 N -4.22 1.49 -2.17 0.20 0.31 -1.26 -4.93 118.33 107.75 1aj8 n VAL 264 Ca 0.03 0.01 -0.42 0.00 -0.01 0.00 0.00 64.34 63.95 1aj8 n VAL 264 Cb 0.29 -2.20 -0.03 0.00 -0.91 0.00 0.00 33.84 30.98 1aj8 n VAL 264 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1aj8 s TYR 265 N -2.56 3.13 -0.17 3.52 2.02 -1.26 -4.36 117.35 117.67 1aj8 s TYR 265 Ca -0.28 0.90 0.17 0.00 -0.37 0.00 0.00 57.07 57.49 1aj8 s TYR 265 Cb 0.06 -3.69 0.37 0.00 -0.40 0.00 0.00 41.96 38.31 1aj8 s TYR 265 CO 0.42 -2.44 1.25 1.63 -1.57 0.00 0.00 175.55 174.83 1aj8 n LYS 266 N 4.33 2.03 -4.00 -0.62 4.76 -0.34 -4.20 118.16 120.11 1aj8 n LYS 266 Ca 0.12 -2.62 -0.11 0.00 -2.87 0.00 0.00 58.31 52.83 1aj8 n LYS 266 Cb 0.43 -1.60 -0.04 0.00 -1.84 0.00 0.00 35.03 31.98 1aj8 n LYS 266 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1aj8 s THR 267 N -2.72 0.00 -0.03 -0.18 -1.32 -1.25 -4.61 115.64 105.53 1aj8 s THR 267 Ca 0.34 -1.41 -0.38 0.00 -1.21 0.00 0.00 61.69 59.02 1aj8 s THR 267 Cb 0.29 -2.46 -0.17 0.00 -1.51 0.00 0.00 72.50 68.65 1aj8 s THR 267 CO 0.05 0.00 1.42 0.00 -2.21 0.00 0.00 174.62 173.89 1aj8 n TYR 268 N -0.47 1.57 -1.98 9.09 4.19 -1.26 -4.70 117.16 123.60 1aj8 n TYR 268 Ca -0.02 0.67 -0.42 0.00 3.31 0.00 0.00 57.90 61.44 1aj8 n TYR 268 Cb 0.61 -2.34 -0.03 0.00 0.49 0.00 0.00 39.34 38.08 1aj8 n TYR 268 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 1aj8 s ASP 269 N 1.28 6.64 0.52 2.98 -1.08 -0.70 -4.67 116.67 121.64 1aj8 s ASP 269 Ca 0.89 2.48 0.18 0.00 -0.52 0.00 0.00 52.55 55.58 1aj8 s ASP 269 Cb -1.03 -2.57 1.30 0.00 -1.46 0.00 0.00 42.92 39.15 1aj8 s ASP 269 CO 0.54 -0.83 2.13 1.55 0.52 0.00 0.00 175.17 179.07 1aj8 h PRO 270 N 7.67 0.00 -0.01 4.34 0.13 -1.90 -0.72 132.00 141.51 1aj8 h PRO 270 Ca -0.42 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.54 1aj8 h PRO 270 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 1aj8 h PRO 270 CO 0.92 0.00 -0.76 0.00 -0.23 0.00 0.00 178.00 177.92 1aj8 h ARG 271 N 0.00 0.07 -0.17 0.86 3.08 -1.93 -3.13 114.38 113.15 1aj8 h ARG 271 Ca 0.04 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 59.92 1aj8 h ARG 271 Cb 0.15 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1aj8 h ARG 271 CO -0.00 0.80 -0.36 0.00 -1.07 0.00 0.00 179.97 179.34 1aj8 h ALA 272 N 1.18 1.07 -0.15 0.04 0.00 -1.41 -1.24 119.26 118.74 1aj8 h ALA 272 Ca -0.02 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 1aj8 h ALA 272 Cb 1.34 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1aj8 h ALA 272 CO 0.11 0.58 0.08 0.00 0.00 0.00 0.00 179.25 180.02 1aj8 h ARG 273 N 0.32 0.22 -0.50 0.00 3.08 -1.40 -0.42 114.38 115.67 1aj8 h ARG 273 Ca 0.04 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.96 1aj8 h ARG 273 Cb 0.78 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.77 1aj8 h ARG 273 CO 0.06 0.22 -0.06 0.82 -1.07 0.00 0.00 179.97 179.94 1aj8 h ILE 274 N 0.15 1.27 -0.75 2.04 2.04 -1.51 -2.71 117.51 118.04 1aj8 h ILE 274 Ca 0.05 -1.18 -0.06 0.00 1.00 0.00 0.00 64.86 64.67 1aj8 h ILE 274 Cb 0.07 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 1aj8 h ILE 274 CO -0.01 0.41 0.23 -0.26 0.00 0.00 0.00 178.15 178.52 1aj8 h PHE 275 N 0.79 1.21 -0.70 1.37 0.04 -1.10 -2.45 116.94 116.10 1aj8 h PHE 275 Ca 0.13 -0.12 0.00 0.00 2.80 0.00 0.00 57.97 60.78 1aj8 h PHE 275 Cb 0.61 -0.35 -0.03 0.00 2.20 0.00 0.00 35.95 38.37 1aj8 h PHE 275 CO 0.04 0.95 0.43 -0.22 -0.60 0.00 0.00 178.31 178.92 1aj8 h LYS 276 N 1.12 0.93 -0.44 1.51 3.64 -0.96 0.16 116.57 122.53 1aj8 h LYS 276 Ca 0.24 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 1aj8 h LYS 276 Cb 0.32 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1aj8 h LYS 276 CO -0.01 0.64 0.21 -0.22 -2.27 0.00 0.00 179.45 177.81 1aj8 h LYS 277 N 0.95 0.63 -0.02 1.90 3.64 -1.13 -0.23 116.57 122.32 1aj8 h LYS 277 Ca 0.25 -0.09 -0.13 0.00 -1.27 0.00 0.00 60.65 59.41 1aj8 h LYS 277 Cb -0.06 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.63 1aj8 h LYS 277 CO -0.05 0.53 -0.59 1.88 -2.27 0.00 0.00 179.45 178.95 1aj8 h TYR 278 N 0.57 0.10 -0.01 1.91 -1.99 -1.00 -2.73 116.97 113.81 1aj8 h TYR 278 Ca 0.15 -0.04 -0.11 0.00 2.00 0.00 0.00 58.73 60.73 1aj8 h TYR 278 Cb 0.11 -0.02 -0.02 0.00 2.00 0.00 0.00 36.73 38.80 1aj8 h TYR 278 CO -0.01 0.65 -0.52 0.00 -0.00 0.00 0.00 178.16 178.29 1aj8 h ALA 279 N 1.34 1.13 -0.42 3.88 0.00 -0.40 0.03 119.26 124.81 1aj8 h ALA 279 Ca -0.01 -0.47 -0.07 0.00 0.00 0.00 0.00 54.91 54.36 1aj8 h ALA 279 Cb 1.06 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1aj8 h ALA 279 CO 0.08 0.65 -0.02 1.03 0.00 0.00 0.00 179.25 180.99 1aj8 h SER 280 N 0.02 0.74 1.00 0.00 0.87 -0.74 0.45 113.55 115.89 1aj8 h SER 280 Ca -0.00 -0.32 -0.09 0.00 -1.23 0.00 0.00 61.79 60.15 1aj8 h SER 280 Cb 0.92 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 1aj8 h SER 280 CO 0.07 0.88 -1.05 0.07 -0.53 0.00 0.00 176.83 176.26 1aj8 h LYS 281 N 0.58 0.00 0.00 2.24 2.10 -1.38 -3.39 116.57 116.72 1aj8 h LYS 281 Ca 0.12 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.77 1aj8 h LYS 281 Cb 0.51 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.84 1aj8 h LYS 281 CO 0.02 0.19 -1.11 1.28 -2.00 0.00 0.00 179.45 177.84 1aj8 n LEU 282 N -2.87 0.07 -4.84 7.07 4.77 -0.02 -5.06 117.00 116.12 1aj8 n LEU 282 Ca -0.04 -0.10 -0.31 0.00 -0.03 0.00 0.00 56.01 55.53 1aj8 n LEU 282 Cb 0.70 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.84 1aj8 n LEU 282 CO 0.41 0.02 0.72 -0.83 -1.33 0.00 0.00 177.39 176.38 1aj8 s GLY 283 N -2.55 1.65 0.20 -0.72 0.00 0.16 -4.30 107.32 101.75 1aj8 s GLY 283 Ca -0.01 -0.11 -0.31 0.00 0.00 0.00 0.00 44.72 44.29 1aj8 s GLY 283 CO 0.28 0.23 1.56 -0.35 0.00 0.00 0.00 173.10 174.82 1aj8 s ASP 284 N -4.02 6.56 0.17 1.64 2.15 -1.26 -4.91 116.67 116.99 1aj8 s ASP 284 Ca 0.58 2.68 -0.15 0.00 0.43 0.00 0.00 52.55 56.08 1aj8 s ASP 284 Cb -0.13 -2.60 0.11 0.00 -0.30 0.00 0.00 42.92 40.00 1aj8 s ASP 284 CO 0.54 -0.82 1.71 0.50 -0.17 0.00 0.00 175.17 176.93 1aj8 h LYS 285 N 6.30 0.15 -0.18 4.34 3.11 -1.94 -0.59 116.57 127.76 1aj8 h LYS 285 Ca -0.44 -0.01 -0.03 0.00 -2.81 0.00 0.00 60.65 57.36 1aj8 h LYS 285 Cb 1.21 -0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 32.40 1aj8 h LYS 285 CO 0.88 0.10 -0.02 -0.22 -2.81 0.00 0.00 179.45 177.39 1aj8 h LYS 286 N 0.16 0.33 -0.56 1.90 3.64 -1.99 -1.49 116.57 118.56 1aj8 h LYS 286 Ca 0.20 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 1aj8 h LYS 286 Cb 0.26 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 1aj8 h LYS 286 CO -0.29 0.57 0.30 -0.07 -2.27 0.00 0.00 179.45 177.69 1aj8 h LEU 287 N 0.07 0.71 -0.84 5.20 4.07 -1.93 -0.13 115.31 122.45 1aj8 h LEU 287 Ca 0.05 -0.10 0.04 0.00 0.08 0.00 0.00 57.88 57.95 1aj8 h LEU 287 Cb 0.43 -0.18 -0.05 0.00 1.08 0.00 0.00 40.66 41.94 1aj8 h LEU 287 CO 0.01 0.60 0.54 0.15 -1.08 0.00 0.00 178.44 178.66 1aj8 h PHE 288 N 0.76 1.00 -0.53 1.13 3.04 -1.05 0.20 116.94 121.49 1aj8 h PHE 288 Ca 0.20 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.18 1aj8 h PHE 288 Cb 0.06 -0.33 -0.03 0.00 2.56 0.00 0.00 35.95 38.21 1aj8 h PHE 288 CO -0.01 0.56 0.34 1.49 -2.02 0.00 0.00 178.31 178.67 1aj8 h GLU 289 N 1.03 0.70 -0.30 1.11 4.81 -0.39 0.29 114.58 121.83 1aj8 h GLU 289 Ca 0.34 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.50 1aj8 h GLU 289 Cb 0.05 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 1aj8 h GLU 289 CO -0.13 0.47 0.07 0.82 -0.73 0.00 0.00 179.01 179.51 1aj8 h ILE 290 N 0.72 1.22 -0.67 2.32 2.04 -0.32 -1.56 117.51 121.26 1aj8 h ILE 290 Ca 0.19 -0.74 -0.02 0.00 1.00 0.00 0.00 64.86 65.29 1aj8 h ILE 290 Cb -0.07 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 1aj8 h ILE 290 CO -0.04 0.24 0.34 0.00 0.00 0.00 0.00 178.15 178.69 1aj8 h ALA 291 N 0.90 0.86 -0.38 1.87 0.00 -0.20 -1.45 119.26 120.85 1aj8 h ALA 291 Ca 0.09 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1aj8 h ALA 291 Cb 0.30 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1aj8 h ALA 291 CO 0.00 0.40 -0.24 1.49 0.00 0.00 0.00 179.25 180.91 1aj8 h GLU 292 N 0.92 0.77 -0.35 0.00 4.57 -0.36 0.05 114.58 120.18 1aj8 h GLU 292 Ca 0.23 -0.32 -0.03 0.00 -1.18 0.00 0.00 59.36 58.07 1aj8 h GLU 292 Cb 0.09 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 1aj8 h GLU 292 CO -0.03 0.93 0.11 0.00 -1.18 0.00 0.00 179.01 178.84 1aj8 h ARG 293 N 0.67 0.54 -0.31 1.92 2.47 -1.01 -2.07 114.38 116.59 1aj8 h ARG 293 Ca 0.09 -0.12 -0.10 0.00 -1.26 0.00 0.00 59.98 58.59 1aj8 h ARG 293 Cb 0.75 -0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 28.98 1aj8 h ARG 293 CO 0.06 0.56 -0.24 1.25 0.56 0.00 0.00 179.97 182.16 1aj8 h LEU 294 N 0.41 0.61 -0.85 3.04 5.85 -1.14 -2.92 115.31 120.32 1aj8 h LEU 294 Ca 0.11 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.64 1aj8 h LEU 294 Cb 0.25 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.06 1aj8 h LEU 294 CO -0.00 0.84 0.55 -0.08 -0.34 0.00 0.00 178.44 179.41 1aj8 h GLU 295 N 0.53 1.06 -0.44 1.25 4.81 -0.69 -1.48 114.58 119.62 1aj8 h GLU 295 Ca 0.08 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 1aj8 h GLU 295 Cb 0.70 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 1aj8 h GLU 295 CO 0.05 0.70 -0.01 0.00 -0.73 0.00 0.00 179.01 179.03 1aj8 h ARG 296 N 1.09 0.72 -0.37 1.92 3.08 -1.20 -1.74 114.38 117.88 1aj8 h ARG 296 Ca 0.33 -0.18 -0.15 0.00 0.07 0.00 0.00 59.98 60.05 1aj8 h ARG 296 Cb -0.04 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 1aj8 h ARG 296 CO -0.10 0.73 -0.35 -0.07 -1.07 0.00 0.00 179.97 179.11 1aj8 h LEU 297 N 0.67 0.92 -0.16 3.04 3.38 -1.31 -0.56 115.31 121.29 1aj8 h LEU 297 Ca 0.13 -0.40 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 1aj8 h LEU 297 Cb 0.43 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1aj8 h LEU 297 CO 0.02 1.17 0.09 0.58 0.09 0.00 0.00 178.44 180.39 1aj8 h VAL 298 N 0.72 1.10 -0.84 1.22 2.07 -1.01 -0.74 116.25 118.76 1aj8 h VAL 298 Ca 0.07 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 1aj8 h VAL 298 Cb 0.92 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.66 1aj8 h VAL 298 CO 0.09 0.10 0.40 -0.33 0.02 0.00 0.00 177.57 177.84 1aj8 h GLU 299 N 0.15 1.22 -0.15 1.57 5.08 -1.24 0.23 114.58 121.44 1aj8 h GLU 299 Ca 0.06 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.19 1aj8 h GLU 299 Cb 0.08 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 1aj8 h GLU 299 CO -0.01 0.94 -0.07 1.49 -1.00 0.00 0.00 179.01 180.36 1aj8 h GLU 300 N 1.21 0.31 0.00 2.33 4.81 -0.85 -3.29 114.58 119.10 1aj8 h GLU 300 Ca 0.29 -0.13 -0.24 0.00 -0.13 0.00 0.00 59.36 59.15 1aj8 h GLU 300 Cb 0.12 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 1aj8 h GLU 300 CO -0.04 0.63 -2.11 0.66 -0.73 0.00 0.00 179.01 177.42 1aj8 n TYR 301 N -4.65 0.00 0.79 0.92 4.01 -0.31 -4.68 117.16 113.25 1aj8 n TYR 301 Ca -0.06 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.77 1aj8 n TYR 301 Cb 0.29 -0.75 -0.06 0.00 -0.31 0.00 0.00 39.34 38.51 1aj8 n TYR 301 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1aj8 n LEU 302 N -2.52 1.10 -0.31 7.72 4.77 0.79 -4.61 117.00 123.94 1aj8 n LEU 302 Ca -0.22 -0.59 -0.04 0.00 -0.03 0.00 0.00 56.01 55.13 1aj8 n LEU 302 Cb 0.92 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 42.09 1aj8 n LEU 302 CO 0.37 0.24 1.23 0.77 -1.33 0.00 0.00 177.39 178.67 1aj8 h SER 303 N 0.65 0.98 0.16 -1.43 4.64 -1.56 -2.05 113.55 114.95 1aj8 h SER 303 Ca 0.00 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.26 1aj8 h SER 303 Cb 0.46 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1aj8 h SER 303 CO 0.00 0.71 -0.14 0.50 -0.87 0.00 0.00 176.83 177.03 1aj8 h LYS 304 N 1.15 0.00 0.00 4.77 3.64 -1.86 0.41 116.57 124.69 1aj8 h LYS 304 Ca 0.31 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 1aj8 h LYS 304 Cb -0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 1aj8 h LYS 304 CO -0.07 0.14 0.00 0.87 -2.27 0.00 0.00 179.45 178.13 1aj8 h LYS 305 N 0.00 0.00 0.00 1.90 1.57 -1.68 -3.46 116.57 114.90 1aj8 h LYS 305 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1aj8 h LYS 305 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1aj8 h LYS 305 CO 0.02 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.31 1aj8 n GLY 306 N 0.25 0.86 3.48 3.86 0.00 0.14 -5.05 105.19 108.72 1aj8 n GLY 306 Ca 0.03 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 1aj8 n GLY 306 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1aj8 s ILE 307 N -2.00 5.17 0.00 -0.61 1.01 -0.92 -4.29 121.20 119.56 1aj8 s ILE 307 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 60.65 60.22 1aj8 s ILE 307 Cb 0.00 -3.96 0.00 0.00 0.01 0.00 0.00 42.46 38.51 1aj8 s ILE 307 CO 0.00 -0.33 0.00 -0.24 0.00 0.00 0.00 174.94 174.37 1aj8 n SER 308 N 5.39 1.44 -4.74 3.58 2.88 -1.26 -3.56 113.62 117.36 1aj8 n SER 308 Ca -0.09 -0.53 -0.40 0.00 -1.33 0.00 0.00 58.87 56.51 1aj8 n SER 308 Cb 0.47 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.89 1aj8 n SER 308 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1aj8 s ILE 309 N -0.47 4.60 0.45 2.46 -1.09 -1.26 -0.14 121.20 125.75 1aj8 s ILE 309 Ca 0.00 1.86 0.06 0.00 -2.23 0.00 0.00 60.65 60.35 1aj8 s ILE 309 Cb 0.00 -4.22 -0.02 0.00 -1.58 0.00 0.00 42.46 36.64 1aj8 s ILE 309 CO 0.00 0.35 0.27 0.54 -1.23 0.00 0.00 174.94 174.86 1aj8 s ASN 310 N -0.06 4.59 0.55 3.58 2.20 0.88 -1.72 114.94 124.95 1aj8 s ASN 310 Ca 0.43 -1.09 0.38 0.00 -0.94 0.00 0.00 52.86 51.63 1aj8 s ASN 310 Cb -0.22 -0.20 1.57 0.00 -2.00 0.00 0.00 41.25 40.40 1aj8 s ASN 310 CO 0.27 -0.74 1.78 1.62 -2.94 0.00 0.00 177.10 177.09 1aj8 h VAL 311 N 1.16 0.37 -0.10 3.54 3.04 -1.89 -1.47 116.25 120.90 1aj8 h VAL 311 Ca -0.41 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.28 1aj8 h VAL 311 Cb 1.27 0.37 0.00 0.00 -2.01 0.00 0.00 31.29 30.92 1aj8 h VAL 311 CO 0.64 0.00 0.00 0.47 -1.01 0.00 0.00 177.57 177.67 1aj8 n ASP 312 N -4.14 1.35 -0.02 3.17 8.00 -1.26 -4.11 116.55 119.53 1aj8 n ASP 312 Ca 0.27 -1.58 -0.16 0.00 0.71 0.00 0.00 54.79 54.04 1aj8 n ASP 312 Cb 1.31 -0.06 -0.11 0.00 -0.02 0.00 0.00 41.12 42.25 1aj8 n ASP 312 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1aj8 h TYR 313 N 1.90 0.36 0.00 1.24 3.20 -1.41 -3.39 116.97 118.87 1aj8 h TYR 313 Ca 0.00 -0.19 0.00 0.00 3.14 0.00 0.00 58.73 61.68 1aj8 h TYR 313 Cb 0.41 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.64 1aj8 h TYR 313 CO 0.06 0.98 -1.83 0.91 -1.64 0.00 0.00 178.16 176.64 1aj8 n TRP 314 N -4.43 0.00 -0.19 -3.82 7.02 -1.26 -4.61 117.44 110.15 1aj8 n TRP 314 Ca -0.10 0.00 0.03 0.00 -1.02 0.00 0.00 57.50 56.41 1aj8 n TRP 314 Cb 0.54 -0.42 0.29 0.00 -2.42 0.00 0.00 31.31 29.30 1aj8 n TRP 314 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1aj8 h SER 315 N 0.00 0.77 -0.61 -0.99 4.64 -1.77 -2.77 113.55 112.82 1aj8 h SER 315 Ca 0.00 -0.01 0.03 0.00 -0.47 0.00 0.00 61.79 61.33 1aj8 h SER 315 Cb 0.88 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 62.75 1aj8 h SER 315 CO 0.00 0.54 0.38 1.23 -0.87 0.00 0.00 176.83 178.11 1aj8 h GLY 316 N 0.90 0.87 1.56 -0.77 0.00 -1.81 -1.54 103.07 102.29 1aj8 h GLY 316 Ca 0.28 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1aj8 h GLY 316 CO -0.07 0.24 0.28 1.41 0.00 0.00 0.00 176.54 178.40 1aj8 h LEU 317 N 0.75 0.51 -0.22 3.11 3.38 -1.79 0.89 115.31 121.94 1aj8 h LEU 317 Ca 0.24 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.12 1aj8 h LEU 317 Cb 0.01 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1aj8 h LEU 317 CO -0.10 0.39 -0.14 0.58 0.09 0.00 0.00 178.44 179.26 1aj8 h VAL 318 N 0.60 1.31 -0.44 1.22 2.07 -1.30 -1.48 116.25 118.23 1aj8 h VAL 318 Ca 0.16 -1.24 -0.10 0.00 0.82 0.00 0.00 66.70 66.34 1aj8 h VAL 318 Cb -0.04 1.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 1aj8 h VAL 318 CO -0.03 0.38 -0.13 -0.26 0.02 0.00 0.00 177.57 177.55 1aj8 h PHE 319 N 0.18 0.90 -0.69 1.57 0.04 -0.84 -2.62 116.94 115.48 1aj8 h PHE 319 Ca 0.04 -0.17 -0.05 0.00 2.80 0.00 0.00 57.97 60.60 1aj8 h PHE 319 Cb 0.66 -0.23 -0.03 0.00 2.20 0.00 0.00 35.95 38.55 1aj8 h PHE 319 CO 0.07 0.89 0.25 -0.92 -0.60 0.00 0.00 178.31 178.00 1aj8 h TYR 320 N 0.73 1.06 0.00 -0.55 3.20 -0.77 -1.36 116.97 119.28 1aj8 h TYR 320 Ca 0.12 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1aj8 h TYR 320 Cb 0.63 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.58 1aj8 h TYR 320 CO 0.03 0.82 0.00 0.41 -1.64 0.00 0.00 178.16 177.79 1aj8 n GLY 321 N -0.90 -1.17 1.63 1.82 0.00 -0.57 -1.97 105.19 104.04 1aj8 n GLY 321 Ca 0.06 0.02 0.04 0.00 0.00 0.00 0.00 46.02 46.14 1aj8 n GLY 321 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1aj8 n MET 322 N -1.92 3.95 -3.63 1.61 2.81 -0.56 -4.94 117.12 114.43 1aj8 n MET 322 Ca 0.03 -3.07 -0.22 0.00 -1.81 0.00 0.00 57.70 52.63 1aj8 n MET 322 Cb 0.21 -2.13 0.06 0.00 -0.71 0.00 0.00 33.22 30.65 1aj8 n MET 322 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1aj8 n LYS 323 N 0.04 -5.97 -4.60 0.03 4.76 -0.83 -5.00 118.16 106.59 1aj8 n LYS 323 Ca 0.30 0.72 -0.33 0.00 -2.87 0.00 0.00 58.31 56.12 1aj8 n LYS 323 Cb 1.17 -5.54 -0.14 0.00 -1.84 0.00 0.00 35.03 28.68 1aj8 n LYS 323 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1aj8 s ILE 324 N -3.47 3.28 0.31 -0.18 1.01 -0.92 -5.01 121.20 116.22 1aj8 s ILE 324 Ca 0.18 -0.57 -0.29 0.00 0.00 0.00 0.00 60.65 59.97 1aj8 s ILE 324 Cb -0.09 -2.41 -0.10 0.00 0.01 0.00 0.00 42.46 39.88 1aj8 s ILE 324 CO 0.78 0.51 1.40 -2.84 0.00 0.00 0.00 174.94 174.79 1aj8 s PRO 325 N 0.46 4.27 0.44 2.79 0.02 -1.26 -4.31 135.00 137.41 1aj8 s PRO 325 Ca -0.08 2.33 0.19 0.00 0.02 0.00 0.00 61.00 63.46 1aj8 s PRO 325 Cb -0.15 -3.07 1.13 0.00 0.02 0.00 0.00 34.50 32.43 1aj8 s PRO 325 CO 0.04 -0.36 1.88 0.82 -0.33 0.00 0.00 177.00 179.05 1aj8 h ILE 326 N 3.23 0.69 0.00 2.83 2.04 -1.97 -1.18 117.51 123.15 1aj8 h ILE 326 Ca -0.48 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.26 1aj8 h ILE 326 Cb 1.22 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 1aj8 h ILE 326 CO 0.71 0.06 0.00 -1.84 0.00 0.00 0.00 178.15 177.08 1aj8 n GLU 327 N -4.48 0.07 -0.01 2.37 0.28 -1.26 -1.91 120.64 115.71 1aj8 n GLU 327 Ca 0.18 0.55 0.10 0.00 -0.16 0.00 0.00 57.16 57.83 1aj8 n GLU 327 Cb 0.69 -1.72 0.09 0.00 1.43 0.00 0.00 31.44 31.93 1aj8 n GLU 327 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1aj8 n LEU 328 N -1.86 2.69 -0.12 -1.84 4.77 -0.45 -4.47 117.00 115.72 1aj8 n LEU 328 Ca -0.00 -1.02 -0.09 0.00 -0.03 0.00 0.00 56.01 54.86 1aj8 n LEU 328 Cb 0.03 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1aj8 n LEU 328 CO 0.06 0.47 0.92 1.88 -1.33 0.00 0.00 177.39 179.38 1aj8 h TYR 329 N 3.91 0.56 -0.16 -1.77 0.05 -1.53 -1.80 116.97 116.24 1aj8 h TYR 329 Ca 0.00 -0.04 -0.08 0.00 0.05 0.00 0.00 58.73 58.66 1aj8 h TYR 329 Cb 0.83 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 38.39 1aj8 h TYR 329 CO 0.01 0.51 -0.26 1.15 -1.05 0.00 0.00 178.16 178.52 1aj8 h THR 330 N 0.46 1.25 0.00 -2.88 2.02 -1.82 -1.61 112.91 110.33 1aj8 h THR 330 Ca 0.12 -1.17 -0.03 0.00 0.77 0.00 0.00 66.41 66.10 1aj8 h THR 330 Cb 0.18 1.42 -0.00 0.00 -1.74 0.00 0.00 68.15 68.00 1aj8 h THR 330 CO -0.01 0.36 -0.16 0.71 0.37 0.00 0.00 175.52 176.79 1aj8 h THR 331 N 0.27 0.49 -0.01 3.16 1.35 -1.78 -1.28 112.91 115.10 1aj8 h THR 331 Ca 0.04 -0.82 -0.23 0.00 -0.55 0.00 0.00 66.41 64.85 1aj8 h THR 331 Cb 0.61 1.56 0.01 0.00 -1.73 0.00 0.00 68.15 68.60 1aj8 h THR 331 CO 0.04 0.16 -0.95 0.40 -0.25 0.00 0.00 175.52 174.92 1aj8 h ILE 332 N 0.00 1.38 -0.47 6.82 2.04 -0.44 -0.46 117.51 126.38 1aj8 h ILE 332 Ca -0.00 -2.39 0.02 0.00 1.00 0.00 0.00 64.86 63.48 1aj8 h ILE 332 Cb 0.55 2.39 -0.03 0.00 -0.74 0.00 0.00 36.82 38.99 1aj8 h ILE 332 CO 0.02 0.72 0.28 0.15 0.00 0.00 0.00 178.15 179.32 1aj8 h PHE 333 N 0.26 0.53 -0.77 1.37 3.04 -0.65 -1.78 116.94 118.95 1aj8 h PHE 333 Ca -0.08 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.86 1aj8 h PHE 333 Cb 1.58 -0.17 -0.04 0.00 2.56 0.00 0.00 35.95 39.88 1aj8 h PHE 333 CO 0.07 0.31 0.39 0.00 -2.02 0.00 0.00 178.31 177.06 1aj8 h ALA 334 N 1.20 1.24 -0.39 2.41 0.00 -1.09 0.30 119.26 122.94 1aj8 h ALA 334 Ca 0.19 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.01 1aj8 h ALA 334 Cb 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1aj8 h ALA 334 CO -0.08 0.60 0.26 0.52 0.00 0.00 0.00 179.25 180.55 1aj8 h MET 335 N 1.09 0.29 0.02 0.00 2.86 -0.24 -1.79 114.93 117.17 1aj8 h MET 335 Ca 0.27 -0.02 -0.28 0.00 -2.06 0.00 0.00 59.70 57.62 1aj8 h MET 335 Cb 0.07 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 1aj8 h MET 335 CO -0.04 0.19 -1.50 0.41 1.06 0.00 0.00 176.91 177.03 1aj8 n GLY 336 N -1.53 -0.76 0.33 8.32 0.00 -0.77 -4.36 105.19 106.42 1aj8 n GLY 336 Ca 0.05 0.03 0.22 0.00 0.00 0.00 0.00 46.02 46.32 1aj8 n GLY 336 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1aj8 h ARG 337 N -0.82 0.00 -0.31 1.61 9.65 -0.17 -2.08 114.38 122.26 1aj8 h ARG 337 Ca -0.40 0.00 0.09 0.00 -1.10 0.00 0.00 59.98 58.58 1aj8 h ARG 337 Cb 1.46 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 30.02 1aj8 h ARG 337 CO -0.18 0.00 0.26 0.97 2.80 0.00 0.00 179.97 183.82 1aj8 h ILE 338 N 0.00 0.66 0.15 1.20 6.09 -1.52 0.42 117.51 124.49 1aj8 h ILE 338 Ca -0.00 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.48 1aj8 h ILE 338 Cb 0.03 0.81 0.00 0.00 0.47 0.00 0.00 36.82 38.13 1aj8 h ILE 338 CO 0.00 0.00 -0.07 0.00 -3.07 0.00 0.00 178.15 175.01 1aj8 h ALA 339 N 1.77 -0.20 -0.67 0.18 0.00 -1.56 -1.42 119.26 117.37 1aj8 h ALA 339 Ca 0.15 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1aj8 h ALA 339 Cb 0.67 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 1aj8 h ALA 339 CO -0.00 -0.49 0.16 0.78 0.00 0.00 0.00 179.25 179.70 1aj8 h GLY 340 N -0.45 1.15 0.99 0.00 0.00 0.56 -1.62 103.07 103.70 1aj8 h GLY 340 Ca -0.02 -0.72 -0.01 0.00 0.00 0.00 0.00 47.33 46.58 1aj8 h GLY 340 CO 0.03 0.67 0.34 1.49 0.00 0.00 0.00 176.54 179.07 1aj8 h TRP 341 N 1.02 0.81 -0.43 5.60 6.55 -0.95 -1.12 115.95 127.43 1aj8 h TRP 341 Ca 0.21 -0.01 -0.03 0.00 0.95 0.00 0.00 58.89 60.01 1aj8 h TRP 341 Cb 0.37 -0.26 -0.02 0.00 -0.86 0.00 0.00 29.16 28.39 1aj8 h TRP 341 CO 0.03 0.58 0.14 1.15 -1.05 0.00 0.00 178.44 179.29 1aj8 h THR 342 N 0.81 1.22 -0.41 1.49 2.02 -1.02 -1.12 112.91 115.91 1aj8 h THR 342 Ca 0.21 -0.70 -0.00 0.00 0.77 0.00 0.00 66.41 66.68 1aj8 h THR 342 Cb 0.02 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 1aj8 h THR 342 CO -0.04 0.25 0.24 0.00 0.37 0.00 0.00 175.52 176.35 1aj8 h ALA 343 N 0.99 0.52 -0.26 6.16 0.00 -1.04 -2.21 119.26 123.43 1aj8 h ALA 343 Ca 0.14 -0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 1aj8 h ALA 343 Cb 0.25 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1aj8 h ALA 343 CO -0.01 0.03 -0.44 0.45 0.00 0.00 0.00 179.25 179.28 1aj8 h HIS 344 N 0.53 0.79 -0.54 0.00 -0.00 -1.11 -1.29 115.15 113.53 1aj8 h HIS 344 Ca 0.15 -0.24 -0.03 0.00 -0.00 0.00 0.00 60.37 60.25 1aj8 h HIS 344 Cb 0.02 -0.16 -0.02 0.00 -0.00 0.00 0.00 27.41 27.24 1aj8 h HIS 344 CO -0.03 0.98 0.24 1.25 -0.00 0.00 0.00 177.93 180.36 1aj8 h LEU 345 N 0.52 0.73 -0.43 2.43 5.85 -1.08 0.25 115.31 123.59 1aj8 h LEU 345 Ca 0.04 -0.15 -0.11 0.00 0.84 0.00 0.00 57.88 58.50 1aj8 h LEU 345 Cb 0.98 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 1aj8 h LEU 345 CO 0.09 0.68 -0.15 0.00 -0.34 0.00 0.00 178.44 178.72 1aj8 h ALA 346 N 1.08 0.59 -0.23 1.25 0.00 -1.34 -2.66 119.26 117.95 1aj8 h ALA 346 Ca 0.18 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1aj8 h ALA 346 Cb 0.16 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1aj8 h ALA 346 CO -0.02 0.52 -0.00 1.49 0.00 0.00 0.00 179.25 181.23 1aj8 h GLU 347 N 0.68 0.42 -0.29 0.00 4.81 -1.00 -2.89 114.58 116.31 1aj8 h GLU 347 Ca 0.10 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 1aj8 h GLU 347 Cb 0.70 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 1aj8 h GLU 347 CO 0.05 0.60 0.11 -0.92 -0.73 0.00 0.00 179.01 178.12 1aj8 h TYR 348 N 0.19 0.45 0.00 0.92 3.20 -0.97 -2.88 116.97 117.87 1aj8 h TYR 348 Ca 0.07 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1aj8 h TYR 348 Cb 0.41 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.55 1aj8 h TYR 348 CO 0.04 0.44 0.00 1.33 -1.64 0.00 0.00 178.16 178.33 1aj8 n VAL 349 N -4.74 0.20 0.20 1.81 0.24 -1.00 -2.55 118.33 112.49 1aj8 n VAL 349 Ca -0.02 0.05 0.06 0.00 -2.04 0.00 0.00 64.34 62.39 1aj8 n VAL 349 Cb 0.14 -0.67 0.42 0.00 -1.47 0.00 0.00 33.84 32.25 1aj8 n VAL 349 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1aj8 h SER 350 N 0.00 0.00 -1.64 -1.34 4.64 -1.28 -3.23 113.55 110.70 1aj8 h SER 350 Ca 0.00 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.88 1aj8 h SER 350 Cb 0.16 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 61.89 1aj8 h SER 350 CO 0.00 0.33 -1.07 1.41 -0.87 0.00 0.00 176.83 176.62 1aj8 n HIS 351 N -3.69 -0.31 -1.59 4.77 8.25 -1.09 -5.08 115.22 116.49 1aj8 n HIS 351 Ca -0.01 -3.51 -0.36 0.00 -0.26 0.00 0.00 57.72 53.57 1aj8 n HIS 351 Cb 0.43 -0.08 0.08 0.00 1.12 0.00 0.00 29.99 31.54 1aj8 n HIS 351 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1aj8 n ASN 352 N 0.28 1.57 -3.63 0.41 5.15 -1.06 -5.01 115.26 112.97 1aj8 n ASN 352 Ca 0.21 0.77 -0.01 0.00 -0.60 0.00 0.00 54.58 54.96 1aj8 n ASN 352 Cb 0.67 -1.51 -0.04 0.00 -0.53 0.00 0.00 39.78 38.37 1aj8 n ASN 352 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1aj8 s ARG 353 N -3.39 0.56 0.28 1.20 3.52 -1.26 -5.06 118.95 114.80 1aj8 s ARG 353 Ca 0.80 1.40 -0.29 0.00 -0.13 0.00 0.00 55.73 57.50 1aj8 s ARG 353 Cb -0.37 0.82 -0.13 0.00 -1.56 0.00 0.00 34.95 33.71 1aj8 s ARG 353 CO 0.44 -0.19 1.22 1.51 -0.81 0.00 0.00 175.30 177.47 1aj8 n ILE 354 N 5.37 1.60 -3.12 4.11 3.06 -1.25 -4.87 119.36 124.26 1aj8 n ILE 354 Ca -0.12 -0.40 -0.43 0.00 -2.50 0.00 0.00 62.75 59.30 1aj8 n ILE 354 Cb 0.50 -1.29 -0.07 0.00 0.54 0.00 0.00 39.64 39.31 1aj8 n ILE 354 CO 0.00 0.00 0.00 -0.63 -2.50 0.00 0.00 176.55 173.42 1aj8 s ILE 355 N -0.71 4.84 -0.32 9.51 1.01 -1.26 -4.98 121.20 129.29 1aj8 s ILE 355 Ca 0.62 0.06 0.02 0.00 0.00 0.00 0.00 60.65 61.35 1aj8 s ILE 355 Cb -0.66 -4.20 0.15 0.00 0.01 0.00 0.00 42.46 37.76 1aj8 s ILE 355 CO 0.57 -0.60 0.38 -0.60 0.00 0.00 0.00 174.94 174.69 1aj8 s ARG 356 N 2.77 0.48 0.00 2.79 6.06 -1.26 -5.05 118.95 124.75 1aj8 s ARG 356 Ca 0.22 -0.30 0.00 0.00 -2.50 0.00 0.00 55.73 53.15 1aj8 s ARG 356 Cb -0.14 -0.52 0.00 0.00 0.06 0.00 0.00 34.95 34.34 1aj8 s ARG 356 CO 0.18 -1.10 0.00 -0.35 -2.50 0.00 0.00 175.30 171.54 1aj8 n PRO 357 N 4.93 2.03 -4.19 5.12 -0.04 -1.26 -5.14 135.00 136.45 1aj8 n PRO 357 Ca 0.04 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.38 1aj8 n PRO 357 Cb 0.47 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.83 1aj8 n PRO 357 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1aj8 s ARG 358 N 1.04 1.09 0.10 0.54 1.81 -1.26 -5.17 118.95 117.10 1aj8 s ARG 358 Ca 0.00 -1.55 0.07 0.00 -1.72 0.00 0.00 55.73 52.53 1aj8 s ARG 358 Cb 0.00 0.20 -0.03 0.00 -0.45 0.00 0.00 34.95 34.66 1aj8 s ARG 358 CO 0.00 -0.31 -0.18 -0.51 -0.68 0.00 0.00 175.30 173.62 1aj8 s LEU 359 N -3.12 2.31 -0.43 2.53 1.43 -1.26 -5.09 118.68 115.05 1aj8 s LEU 359 Ca 0.32 -0.69 -0.18 0.00 -1.03 0.00 0.00 54.13 52.55 1aj8 s LEU 359 Cb 0.07 -0.72 0.03 0.00 0.03 0.00 0.00 46.19 45.59 1aj8 s LEU 359 CO 0.07 -0.01 0.50 -1.58 0.23 0.00 0.00 176.35 175.56 1aj8 s GLN 360 N -1.98 3.14 0.18 1.70 0.74 -1.26 -5.04 119.66 117.14 1aj8 s GLN 360 Ca 0.04 -0.68 -0.30 0.00 0.05 0.00 0.00 55.36 54.47 1aj8 s GLN 360 Cb -0.09 -3.98 -0.08 0.00 1.10 0.00 0.00 33.01 29.96 1aj8 s GLN 360 CO 0.04 -0.92 1.19 -0.47 -0.55 0.00 0.00 175.29 174.57 1aj8 s TYR 361 N 2.33 3.44 -0.10 1.67 5.04 -1.26 -5.02 117.35 123.45 1aj8 s TYR 361 Ca 0.15 1.43 -0.01 0.00 -2.44 0.00 0.00 57.07 56.20 1aj8 s TYR 361 Cb -0.17 -3.42 0.03 0.00 0.35 0.00 0.00 41.96 38.75 1aj8 s TYR 361 CO 0.15 -1.16 -0.06 0.14 -1.34 0.00 0.00 175.55 173.27 1aj8 s VAL 362 N -0.04 0.87 -5.00 3.14 -7.23 -1.26 -5.08 120.40 105.80 1aj8 s VAL 362 Ca 0.53 -0.19 0.00 0.00 -1.81 0.00 0.00 61.98 60.50 1aj8 s VAL 362 Cb -0.32 -0.92 0.00 0.00 0.56 0.00 0.00 36.38 35.70 1aj8 s VAL 362 CO 0.36 0.34 0.00 0.61 -0.31 0.00 0.00 175.10 176.10 1aj8 n GLY 363 N 4.94 -0.50 3.82 2.32 0.00 -1.26 -5.12 105.19 109.39 1aj8 n GLY 363 Ca -0.12 -1.70 -0.34 0.00 0.00 0.00 0.00 46.02 43.86 1aj8 n GLY 363 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1aj8 s GLU 364 N -1.45 4.25 -0.02 1.61 2.02 -1.26 -5.08 118.70 118.77 1aj8 s GLU 364 Ca 0.00 1.02 0.03 0.00 0.02 0.00 0.00 54.97 56.04 1aj8 s GLU 364 Cb 0.00 -2.46 -0.00 0.00 0.10 0.00 0.00 34.13 31.77 1aj8 s GLU 364 CO 0.00 0.13 -0.11 0.96 0.02 0.00 0.00 175.26 176.26 1aj8 s ILE 365 N -1.93 0.90 0.00 -1.63 -4.36 -1.26 -4.78 121.20 108.14 1aj8 s ILE 365 Ca 0.55 -0.46 0.00 0.00 -0.26 0.00 0.00 60.65 60.48 1aj8 s ILE 365 Cb -0.12 -0.77 0.00 0.00 1.25 0.00 0.00 42.46 42.82 1aj8 s ILE 365 CO 0.17 0.26 0.00 0.61 0.24 0.00 0.00 174.94 176.23 1aj8 n GLY 366 N 2.99 0.98 3.76 6.27 0.00 -1.26 -5.06 105.19 112.86 1aj8 n GLY 366 Ca -0.16 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1aj8 n GLY 366 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aj8 s LYS 367 N -0.08 4.38 -0.06 1.61 1.02 -1.26 -4.99 119.74 120.36 1aj8 s LYS 367 Ca 0.00 2.16 -0.18 0.00 0.02 0.00 0.00 55.97 57.96 1aj8 s LYS 367 Cb 0.00 -3.11 -0.05 0.00 -0.52 0.00 0.00 37.83 34.15 1aj8 s LYS 367 CO 0.00 -0.20 0.50 0.15 -0.92 0.00 0.00 175.35 174.88 1aj8 s LYS 368 N -1.20 4.25 0.26 1.68 -0.14 -1.26 -5.03 119.74 118.29 1aj8 s LYS 368 Ca 0.52 0.52 -0.30 0.00 -1.36 0.00 0.00 55.97 55.34 1aj8 s LYS 368 Cb -0.39 -3.37 -0.11 0.00 -1.68 0.00 0.00 37.83 32.29 1aj8 s LYS 368 CO 0.47 0.32 1.55 -0.47 -0.76 0.00 0.00 175.35 176.46 1aj8 s TYR 369 N 0.07 2.89 -0.14 3.18 6.14 -1.26 -5.00 117.35 123.23 1aj8 s TYR 369 Ca 0.27 0.80 0.02 0.00 0.64 0.00 0.00 57.07 58.80 1aj8 s TYR 369 Cb -0.16 -3.98 0.01 0.00 0.42 0.00 0.00 41.96 38.25 1aj8 s TYR 369 CO 0.13 -3.34 -0.18 -1.17 0.64 0.00 0.00 175.55 171.62 1aj8 s LEU 370 N -0.11 1.93 0.33 6.97 2.96 -1.26 -5.10 118.68 124.40 1aj8 s LEU 370 Ca 0.64 -0.54 -0.26 0.00 -0.22 0.00 0.00 54.13 53.75 1aj8 s LEU 370 Cb -0.46 -1.30 -0.14 0.00 0.50 0.00 0.00 46.19 44.80 1aj8 s LEU 370 CO 0.43 0.03 0.82 -2.65 -1.32 0.00 0.00 176.35 173.66 1aj8 n PRO 371 N 4.29 0.96 -0.10 0.98 -0.02 -1.26 -4.84 135.00 135.01 1aj8 n PRO 371 Ca -0.19 0.34 0.15 0.00 -2.02 0.00 0.00 63.50 61.77 1aj8 n PRO 371 Cb 0.51 -1.66 0.53 0.00 -0.02 0.00 0.00 33.50 32.86 1aj8 n PRO 371 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1aj8 h ILE 372 N 1.47 0.83 0.00 4.25 2.10 -1.99 -1.39 117.51 122.78 1aj8 h ILE 372 Ca -0.39 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 65.43 1aj8 h ILE 372 Cb 1.37 0.45 0.00 0.00 -1.09 0.00 0.00 36.82 37.55 1aj8 h ILE 372 CO 0.57 0.06 0.00 1.05 -1.08 0.00 0.00 178.15 178.75 1aj8 h GLU 373 N 0.35 0.00 -0.25 2.19 9.09 -2.05 -2.35 114.58 121.57 1aj8 h GLU 373 Ca 0.31 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.72 1aj8 h GLU 373 Cb 0.75 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.85 1aj8 h GLU 373 CO -0.08 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.26 1aj8 n LEU 374 N -2.62 3.03 -4.87 3.06 4.77 -0.53 -4.91 117.00 114.94 1aj8 n LEU 374 Ca 0.02 -1.22 -0.33 0.00 -0.03 0.00 0.00 56.01 54.45 1aj8 n LEU 374 Cb 0.27 -0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.15 1aj8 n LEU 374 CO 0.23 0.61 0.22 -0.13 -1.33 0.00 0.00 177.39 176.99 1aj8 s ARG 375 N -1.69 3.84 0.00 3.23 0.52 -0.88 -5.01 118.95 118.96 1aj8 s ARG 375 Ca 0.35 0.33 0.30 0.00 -0.52 0.00 0.00 55.73 56.19 1aj8 s ARG 375 Cb 0.21 -2.71 1.58 0.00 0.52 0.00 0.00 34.95 34.55 1aj8 s ARG 375 CO 0.31 0.36 2.04 2.89 0.02 0.00 0.00 175.30 180.92