#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3eaj n GLY 2 N 0.00 4.37 2.82 0.46 0.00 -1.26 -4.99 105.19 106.58 3eaj n GLY 2 Ca 0.00 -1.54 -0.17 0.00 0.00 0.00 0.00 46.02 44.30 3eaj n GLY 2 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3eaj s PHE 3 N -1.85 -0.16 -0.07 1.61 5.36 -1.26 -4.84 117.98 116.77 3eaj s PHE 3 Ca 0.00 0.54 0.02 0.00 -0.96 0.00 0.00 56.93 56.53 3eaj s PHE 3 Cb 0.00 -0.29 0.02 0.00 -0.34 0.00 0.00 43.02 42.40 3eaj s PHE 3 CO 0.00 -0.30 -0.10 1.03 -1.46 0.00 0.00 175.22 174.39 3eaj s ARG 4 N 2.29 1.47 -0.51 10.12 1.81 -1.26 -5.08 118.95 127.79 3eaj s ARG 4 Ca 0.03 -0.32 -0.27 0.00 -1.72 0.00 0.00 55.73 53.46 3eaj s ARG 4 Cb -0.12 -1.30 -0.08 0.00 -0.45 0.00 0.00 34.95 33.00 3eaj s ARG 4 CO -0.06 -0.04 2.42 1.63 -0.68 0.00 0.00 175.30 178.57 3eaj n LYS 5 N 4.02 1.03 -3.86 3.54 5.02 -1.26 -4.93 118.16 121.72 3eaj n LYS 5 Ca -0.22 0.05 -0.24 0.00 -2.02 0.00 0.00 58.31 55.88 3eaj n LYS 5 Cb 0.51 -3.23 -0.02 0.00 -0.02 0.00 0.00 35.03 32.27 3eaj n LYS 5 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3eaj s MET 6 N 8.13 3.46 0.15 1.97 -1.94 -1.26 -4.76 119.30 125.05 3eaj s MET 6 Ca 1.02 -0.61 0.06 0.00 -1.71 0.00 0.00 55.69 54.45 3eaj s MET 6 Cb -0.31 -2.88 -0.04 0.00 2.01 0.00 0.00 34.83 33.62 3eaj s MET 6 CO 0.30 0.42 0.03 0.00 -0.01 0.00 0.00 175.02 175.76 3eaj s ALA 7 N -1.94 3.31 0.61 3.03 0.00 -1.26 -4.65 121.76 120.85 3eaj s ALA 7 Ca 0.35 -1.27 -0.19 0.00 0.00 0.00 0.00 51.96 50.85 3eaj s ALA 7 Cb -0.10 -1.13 -0.03 0.00 0.00 0.00 0.00 23.12 21.86 3eaj s ALA 7 CO 0.30 0.54 1.30 -0.06 0.00 0.00 0.00 175.76 177.83 3eaj s PHE 8 N -1.63 2.20 0.17 0.00 0.08 -1.26 -4.92 117.98 112.62 3eaj s PHE 8 Ca 0.28 1.46 -0.34 0.00 0.12 0.00 0.00 56.93 58.45 3eaj s PHE 8 Cb -0.10 -3.68 -0.14 0.00 -0.57 0.00 0.00 43.02 38.53 3eaj s PHE 8 CO 0.20 -2.77 1.54 -2.30 -0.10 0.00 0.00 175.22 171.78 3eaj n PRO 9 N -1.57 2.06 -0.02 0.24 -0.02 -1.26 -4.86 135.00 129.57 3eaj n PRO 9 Ca 0.14 0.74 0.13 0.00 -2.02 0.00 0.00 63.50 62.49 3eaj n PRO 9 Cb 0.47 -2.49 0.48 0.00 -0.02 0.00 0.00 33.50 31.95 3eaj n PRO 9 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3eaj n SER 10 N 3.17 1.59 0.07 2.55 3.41 -1.26 -4.49 113.62 118.67 3eaj n SER 10 Ca 0.16 -1.57 -0.13 0.00 -0.26 0.00 0.00 58.87 57.08 3eaj n SER 10 Cb 0.28 -0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.15 3eaj n SER 10 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3eaj h GLY 11 N 4.89 -0.65 1.48 5.00 0.00 -2.00 -0.84 103.07 110.96 3eaj h GLY 11 Ca 0.00 0.44 0.07 0.00 0.00 0.00 0.00 47.33 47.84 3eaj h GLY 11 CO 0.00 -0.25 0.19 0.50 0.00 0.00 0.00 176.54 176.98 3eaj h LYS 12 N -0.54 0.03 0.08 4.80 1.57 -1.97 -2.27 116.57 118.27 3eaj h LYS 12 Ca 0.05 -0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.52 3eaj h LYS 12 Cb 0.61 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 3eaj h LYS 12 CO -0.27 0.02 -1.66 0.28 -0.57 0.00 0.00 179.45 177.25 3eaj h VAL 13 N 0.03 0.97 -0.68 0.50 2.07 -1.76 -3.32 116.25 114.06 3eaj h VAL 13 Ca 0.13 -2.69 0.18 0.00 0.82 0.00 0.00 66.70 65.13 3eaj h VAL 13 Cb 0.47 2.61 -0.03 0.00 -1.52 0.00 0.00 31.29 32.82 3eaj h VAL 13 CO -0.00 0.75 0.48 -0.33 0.02 0.00 0.00 177.57 178.48 3eaj h GLU 14 N 0.05 0.10 0.00 1.57 5.08 -0.55 -0.04 114.58 120.78 3eaj h GLU 14 Ca -0.29 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 3eaj h GLU 14 Cb 2.01 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.24 3eaj h GLU 14 CO 0.12 0.07 0.00 0.41 -1.00 0.00 0.00 179.01 178.61 3eaj n GLY 15 N -1.63 -0.88 0.00 -3.84 0.00 -1.20 -3.02 105.19 94.62 3eaj n GLY 15 Ca 0.13 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3eaj n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3eaj s MET 17 N -0.65 4.17 0.26 0.00 1.00 -1.17 -0.18 119.30 122.74 3eaj s MET 17 Ca 0.00 1.45 0.00 0.00 0.00 0.00 0.00 55.69 57.14 3eaj s MET 17 Cb 0.00 -3.74 -0.00 0.00 0.00 0.00 0.00 34.83 31.09 3eaj s MET 17 CO 0.00 -0.77 0.00 1.33 0.00 0.00 0.00 175.02 175.58 3eaj n VAL 18 N 5.54 0.00 -5.14 -6.03 0.24 -0.21 -4.75 118.33 107.98 3eaj n VAL 18 Ca 0.13 -1.24 -0.29 0.00 -2.04 0.00 0.00 64.34 60.90 3eaj n VAL 18 Cb 0.46 0.25 -0.16 0.00 -1.47 0.00 0.00 33.84 32.92 3eaj n VAL 18 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3eaj s GLN 19 N -2.95 1.90 -0.24 7.34 0.74 -0.66 -1.64 119.66 124.16 3eaj s GLN 19 Ca 0.00 -0.82 0.00 0.00 0.05 0.00 0.00 55.36 54.60 3eaj s GLN 19 Cb 0.00 -1.81 0.06 0.00 1.10 0.00 0.00 33.01 32.36 3eaj s GLN 19 CO 0.00 0.48 -0.02 0.08 -0.55 0.00 0.00 175.29 175.28 3eaj s VAL 20 N -0.50 1.34 -0.13 1.34 1.01 -0.33 -1.67 120.40 121.46 3eaj s VAL 20 Ca 0.08 -1.15 -0.05 0.00 0.00 0.00 0.00 61.98 60.86 3eaj s VAL 20 Cb -0.09 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 3eaj s VAL 20 CO -0.01 -0.17 0.04 -0.89 0.00 0.00 0.00 175.10 174.07 3eaj s THR 21 N 1.47 4.59 -0.22 3.92 2.01 0.11 -1.93 115.64 125.59 3eaj s THR 21 Ca -0.03 -0.13 -0.04 0.00 0.31 0.00 0.00 61.69 61.80 3eaj s THR 21 Cb -0.18 -3.00 0.10 0.00 0.01 0.00 0.00 72.50 69.42 3eaj s THR 21 CO -0.08 0.55 0.21 0.00 -0.69 0.00 0.00 174.62 174.61 3eaj n GLY 23 N 5.31 3.47 1.23 0.00 0.00 -1.26 -1.91 105.19 112.03 3eaj n GLY 23 Ca -0.05 -0.11 0.05 0.00 0.00 0.00 0.00 46.02 45.91 3eaj n GLY 23 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3eaj n THR 24 N 0.00 1.43 -4.36 2.61 5.66 -1.26 -4.86 114.28 113.50 3eaj n THR 24 Ca 0.00 -0.80 -0.30 0.00 -3.05 0.00 0.00 64.05 59.91 3eaj n THR 24 Cb 0.00 -0.21 -0.17 0.00 -1.55 0.00 0.00 70.33 68.41 3eaj n THR 24 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 3eaj s THR 25 N -1.92 1.64 -0.00 1.09 2.01 -0.80 -5.12 115.64 112.53 3eaj s THR 25 Ca 0.33 -0.71 0.07 0.00 0.31 0.00 0.00 61.69 61.69 3eaj s THR 25 Cb 0.23 -1.50 -0.02 0.00 0.01 0.00 0.00 72.50 71.23 3eaj s THR 25 CO 0.12 0.47 -0.22 -0.89 -0.69 0.00 0.00 174.62 173.42 3eaj s THR 26 N 1.10 1.72 0.00 -0.82 2.01 -1.26 -0.48 115.64 117.91 3eaj s THR 26 Ca -0.03 -1.00 0.00 0.00 0.31 0.00 0.00 61.69 60.96 3eaj s THR 26 Cb -0.14 -1.44 0.00 0.00 0.01 0.00 0.00 72.50 70.92 3eaj s THR 26 CO -0.05 0.42 0.00 0.00 -0.69 0.00 0.00 174.62 174.30 3eaj n LEU 27 N 2.36 0.00 -4.76 4.42 -0.00 -0.81 -4.79 117.00 113.41 3eaj n LEU 27 Ca -0.16 0.00 -0.33 0.00 -0.00 0.00 0.00 56.01 55.52 3eaj n LEU 27 Cb 0.53 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.87 3eaj n LEU 27 CO 0.23 0.00 -0.26 0.20 -0.00 0.00 0.00 177.39 177.56 3eaj s ASN 28 N 0.89 5.56 0.14 1.45 0.01 -0.49 -1.18 114.94 121.31 3eaj s ASN 28 Ca 0.00 0.11 0.06 0.00 -0.71 0.00 0.00 52.86 52.32 3eaj s ASN 28 Cb 0.00 -1.56 -0.04 0.00 0.41 0.00 0.00 41.25 40.06 3eaj s ASN 28 CO 0.00 0.27 -0.13 -0.83 -1.51 0.00 0.00 177.10 174.90 3eaj s GLY 29 N -1.71 1.12 -0.36 0.66 0.00 -0.65 -4.21 107.32 102.17 3eaj s GLY 29 Ca 0.22 -1.38 -0.06 0.00 0.00 0.00 0.00 44.72 43.50 3eaj s GLY 29 CO 0.13 -1.46 0.14 -2.27 0.00 0.00 0.00 173.10 169.64 3eaj s LEU 30 N -2.72 4.54 -0.47 0.66 1.98 0.79 -1.05 118.68 122.41 3eaj s LEU 30 Ca 0.12 -1.31 -0.16 0.00 -2.89 0.00 0.00 54.13 49.89 3eaj s LEU 30 Cb -0.03 -1.87 0.06 0.00 0.66 0.00 0.00 46.19 45.01 3eaj s LEU 30 CO 0.03 -0.38 0.44 0.86 -1.89 0.00 0.00 176.35 175.40 3eaj s TRP 31 N 1.37 3.20 -0.13 5.38 -0.00 0.75 -1.00 118.94 128.52 3eaj s TRP 31 Ca -0.00 -0.80 0.00 0.00 -0.00 0.00 0.00 56.10 55.31 3eaj s TRP 31 Cb -0.21 -3.18 0.02 0.00 -0.00 0.00 0.00 33.47 30.10 3eaj s TRP 31 CO 0.02 -0.82 -0.11 -0.51 -0.00 0.00 0.00 176.95 175.52 3eaj s LEU 32 N 1.87 1.46 0.00 5.86 1.43 -0.77 -4.62 118.68 123.90 3eaj s LEU 32 Ca 0.07 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.77 3eaj s LEU 32 Cb -0.22 -1.01 0.00 0.00 0.03 0.00 0.00 46.19 44.98 3eaj s LEU 32 CO 0.08 -0.08 0.00 0.47 0.23 0.00 0.00 176.35 177.06 3eaj n ASP 33 N 4.78 0.00 -0.71 2.29 8.00 -1.26 -2.39 116.55 127.26 3eaj n ASP 33 Ca -0.15 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.41 3eaj n ASP 33 Cb 0.50 0.00 0.17 0.00 -0.02 0.00 0.00 41.12 41.77 3eaj n ASP 33 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3eaj n ASP 34 N 7.33 3.03 -4.65 -2.24 3.85 -1.26 -0.13 116.55 122.49 3eaj n ASP 34 Ca 0.00 -2.01 -0.35 0.00 -0.71 0.00 0.00 54.79 51.72 3eaj n ASP 34 Cb 0.00 -0.26 -0.10 0.00 -1.35 0.00 0.00 41.12 39.41 3eaj n ASP 34 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 3eaj s THR 35 N -1.02 4.34 -0.23 2.12 2.01 -1.01 -0.33 115.64 121.53 3eaj s THR 35 Ca 0.26 -0.22 -0.02 0.00 0.31 0.00 0.00 61.69 62.01 3eaj s THR 35 Cb 0.14 -2.86 0.01 0.00 0.01 0.00 0.00 72.50 69.79 3eaj s THR 35 CO 0.17 0.56 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.91 3eaj s VAL 36 N -0.48 3.02 0.27 3.82 1.01 -0.46 -1.85 120.40 125.73 3eaj s VAL 36 Ca 0.09 -0.77 -0.02 0.00 0.00 0.00 0.00 61.98 61.27 3eaj s VAL 36 Cb -0.12 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 3eaj s VAL 36 CO 0.02 0.34 0.50 -0.31 0.00 0.00 0.00 175.10 175.65 3eaj s TYR 37 N 1.39 3.48 -0.09 5.22 2.02 -0.17 -2.13 117.35 127.08 3eaj s TYR 37 Ca 0.03 0.48 -0.32 0.00 -0.37 0.00 0.00 57.07 56.89 3eaj s TYR 37 Cb -0.15 -1.98 0.13 0.00 -0.40 0.00 0.00 41.96 39.56 3eaj s TYR 37 CO -0.05 0.22 1.28 0.00 -1.57 0.00 0.00 175.55 175.44 3eaj s PRO 39 N -2.38 4.03 0.32 0.00 0.02 -1.26 -1.37 135.00 134.36 3eaj s PRO 39 Ca 0.13 2.09 0.26 0.00 0.02 0.00 0.00 61.00 63.50 3eaj s PRO 39 Cb 0.03 -2.78 0.95 0.00 0.02 0.00 0.00 34.50 32.73 3eaj s PRO 39 CO -0.04 -0.42 1.77 0.07 -0.33 0.00 0.00 177.00 178.05 3eaj h ARG 40 N 2.75 0.00 0.00 5.54 0.11 -0.94 -3.01 114.38 118.83 3eaj h ARG 40 Ca -0.49 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.59 3eaj h ARG 40 Cb 1.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.32 3eaj h ARG 40 CO 0.63 0.00 0.00 -2.39 0.10 0.00 0.00 179.97 178.31 3eaj n HIS 41 N -2.49 0.00 0.27 4.08 1.44 -1.26 -2.59 115.22 114.66 3eaj n HIS 41 Ca 0.03 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.86 3eaj n HIS 41 Cb 0.32 0.00 0.74 0.00 0.12 0.00 0.00 29.99 31.17 3eaj n HIS 41 CO 0.00 0.00 0.00 -0.24 -2.81 0.00 0.00 176.34 173.29 3eaj h VAL 42 N 0.00 0.59 -0.03 0.61 3.04 -1.92 -1.62 116.25 116.93 3eaj h VAL 42 Ca 0.00 -0.47 0.00 0.00 -1.01 0.00 0.00 66.70 65.22 3eaj h VAL 42 Cb 0.00 1.30 0.00 0.00 -2.01 0.00 0.00 31.29 30.58 3eaj h VAL 42 CO 0.00 0.11 0.00 2.30 -1.01 0.00 0.00 177.57 178.97 3eaj n ILE 43 N -3.70 0.03 -3.36 3.17 -5.35 -1.07 -4.59 119.36 104.49 3eaj n ILE 43 Ca -0.02 -0.16 -0.20 0.00 -0.27 0.00 0.00 62.75 62.10 3eaj n ILE 43 Cb 0.22 0.10 -0.00 0.00 -1.74 0.00 0.00 39.64 38.22 3eaj n ILE 43 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3eaj s THR 45 N -2.26 -0.23 0.00 0.00 -1.32 -1.26 -4.84 115.64 105.73 3eaj s THR 45 Ca 0.46 0.16 0.00 0.00 -1.21 0.00 0.00 61.69 61.10 3eaj s THR 45 Cb -0.10 -0.42 0.00 0.00 -1.51 0.00 0.00 72.50 70.47 3eaj s THR 45 CO 0.33 -0.01 0.00 0.00 -2.21 0.00 0.00 174.62 172.73 3eaj n ALA 46 N 5.31 0.00 1.12 11.08 0.00 -1.26 0.24 120.51 137.00 3eaj n ALA 46 Ca -0.05 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.50 3eaj n ALA 46 Cb 0.50 0.00 0.59 0.00 0.00 0.00 0.00 19.45 20.53 3eaj n ALA 46 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3eaj n GLU 47 N 0.00 0.37 -0.19 0.00 0.00 -1.26 -1.57 120.64 118.00 3eaj n GLU 47 Ca 0.00 0.06 -0.10 0.00 0.00 0.00 0.00 57.16 57.13 3eaj n GLU 47 Cb 0.00 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 29.95 3eaj n GLU 47 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 3eaj h ASP 48 N 0.00 0.96 -0.41 -1.84 3.32 0.26 -3.18 116.42 115.52 3eaj h ASP 48 Ca 0.00 -0.32 0.01 0.00 0.02 0.00 0.00 57.03 56.74 3eaj h ASP 48 Cb 0.19 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3eaj h ASP 48 CO 0.00 1.04 0.27 0.24 -1.72 0.00 0.00 179.24 179.08 3eaj h MET 49 N 0.85 0.51 -0.83 3.56 2.86 -1.43 -0.54 114.93 119.91 3eaj h MET 49 Ca 0.15 -0.03 0.20 0.00 -2.06 0.00 0.00 59.70 57.96 3eaj h MET 49 Cb 0.57 -0.12 -0.13 0.00 0.06 0.00 0.00 31.60 31.98 3eaj h MET 49 CO 0.03 0.34 0.22 -0.07 1.06 0.00 0.00 176.91 178.49 3eaj h LEU 50 N 0.53 0.01 -5.00 1.22 3.38 -1.66 -2.36 115.31 111.43 3eaj h LEU 50 Ca 0.16 0.18 -0.13 0.00 0.09 0.00 0.00 57.88 58.17 3eaj h LEU 50 Cb -0.01 0.24 -0.16 0.00 0.09 0.00 0.00 40.66 40.82 3eaj h LEU 50 CO -0.04 -0.10 -0.44 -3.20 0.09 0.00 0.00 178.44 174.76 3eaj n ASN 51 N -5.19 -3.12 -4.77 -0.43 5.15 -1.01 -4.66 115.26 101.23 3eaj n ASN 51 Ca 0.19 -2.69 -0.39 0.00 -0.60 0.00 0.00 54.58 51.09 3eaj n ASN 51 Cb 0.59 1.62 -0.02 0.00 -0.53 0.00 0.00 39.78 41.45 3eaj n ASN 51 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 3eaj s PRO 52 N 0.85 4.06 -0.34 1.20 0.02 -0.24 -5.01 135.00 135.54 3eaj s PRO 52 Ca 0.29 1.96 -0.01 0.00 0.02 0.00 0.00 61.00 63.26 3eaj s PRO 52 Cb 0.04 -2.74 0.08 0.00 0.02 0.00 0.00 34.50 31.90 3eaj s PRO 52 CO -0.08 -0.35 0.07 1.21 -0.33 0.00 0.00 177.00 177.52 3eaj s ASN 53 N -0.97 5.00 0.52 2.53 3.84 -1.26 -4.99 114.94 119.61 3eaj s ASN 53 Ca 0.56 -1.63 0.31 0.00 0.21 0.00 0.00 52.86 52.31 3eaj s ASN 53 Cb -0.34 -1.74 1.21 0.00 -0.55 0.00 0.00 41.25 39.84 3eaj s ASN 53 CO 0.43 -0.37 1.93 1.88 -2.79 0.00 0.00 177.10 178.18 3eaj h TYR 54 N 7.97 0.00 0.18 0.43 -1.99 -1.97 0.29 116.97 121.88 3eaj h TYR 54 Ca -0.16 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.56 3eaj h TYR 54 Cb 1.05 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.78 3eaj h TYR 54 CO 0.58 0.06 -0.09 0.93 -0.00 0.00 0.00 178.16 179.64 3eaj h GLU 55 N 0.00 -0.23 0.80 4.88 3.07 -1.98 -1.62 114.58 119.49 3eaj h GLU 55 Ca -0.00 0.02 -0.04 0.00 -0.50 0.00 0.00 59.36 58.84 3eaj h GLU 55 Cb 0.59 0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 28.55 3eaj h GLU 55 CO 0.01 0.16 -0.48 -0.44 -1.40 0.00 0.00 179.01 176.85 3eaj h ASP 56 N -0.72 -1.22 -1.02 1.42 5.19 -1.93 -1.69 116.42 116.46 3eaj h ASP 56 Ca -0.02 0.07 0.25 0.00 -0.62 0.00 0.00 57.03 56.70 3eaj h ASP 56 Cb 0.50 0.35 -0.11 0.00 0.18 0.00 0.00 39.33 40.25 3eaj h ASP 56 CO 0.04 -0.75 0.63 -0.07 -3.12 0.00 0.00 179.24 175.97 3eaj h LEU 57 N -1.20 0.57 0.12 1.55 3.38 -1.04 -1.85 115.31 116.84 3eaj h LEU 57 Ca -0.11 0.11 -0.28 0.00 0.09 0.00 0.00 57.88 57.68 3eaj h LEU 57 Cb 0.96 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.72 3eaj h LEU 57 CO 0.12 0.12 -1.34 0.25 0.09 0.00 0.00 178.44 177.68 3eaj h LEU 58 N 0.51 0.39 -2.29 1.67 5.85 -1.22 -3.23 115.31 116.99 3eaj h LEU 58 Ca 0.61 -0.46 0.03 0.00 0.84 0.00 0.00 57.88 58.91 3eaj h LEU 58 Cb 1.33 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.22 3eaj h LEU 58 CO -0.37 1.37 0.13 -0.29 -0.34 0.00 0.00 178.44 178.93 3eaj h ILE 59 N 0.07 0.53 -0.24 4.05 6.09 -0.44 -0.54 117.51 127.03 3eaj h ILE 59 Ca -0.17 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.32 3eaj h ILE 59 Cb 1.98 0.90 0.00 0.00 0.47 0.00 0.00 36.82 40.17 3eaj h ILE 59 CO 0.19 0.00 0.00 0.54 -3.07 0.00 0.00 178.15 175.81 3eaj n ARG 60 N -3.88 1.82 -4.44 2.19 1.74 -1.14 -4.86 116.66 108.09 3eaj n ARG 60 Ca -0.00 -0.96 -0.23 0.00 -0.77 0.00 0.00 57.85 55.89 3eaj n ARG 60 Cb 0.23 -1.37 -0.10 0.00 -1.02 0.00 0.00 32.46 30.20 3eaj n ARG 60 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3eaj s LYS 61 N -1.64 1.59 0.29 5.56 -0.14 -0.21 -5.12 119.74 120.06 3eaj s LYS 61 Ca 0.17 -1.74 0.02 0.00 -1.36 0.00 0.00 55.97 53.06 3eaj s LYS 61 Cb 0.10 -1.54 -0.04 0.00 -1.68 0.00 0.00 37.83 34.68 3eaj s LYS 61 CO 0.10 0.24 0.13 -1.54 -0.76 0.00 0.00 175.35 173.52 3eaj s SER 62 N -3.46 1.40 0.28 2.83 1.04 -1.26 -5.02 113.70 109.50 3eaj s SER 62 Ca 0.28 -1.48 0.00 0.00 0.48 0.00 0.00 55.95 55.23 3eaj s SER 62 Cb -0.02 0.29 0.65 0.00 0.10 0.00 0.00 66.02 67.04 3eaj s SER 62 CO 0.13 -0.82 1.65 0.78 0.98 0.00 0.00 173.24 175.96 3eaj h ASN 63 N 2.28 -0.03 0.30 7.02 2.35 -1.93 0.15 115.58 125.73 3eaj h ASN 63 Ca -0.36 0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 3eaj h ASN 63 Cb 1.25 0.27 0.00 0.00 0.05 0.00 0.00 38.32 39.88 3eaj h ASN 63 CO 0.56 -0.14 0.00 1.41 -1.65 0.00 0.00 177.43 177.61 3eaj n HIS 64 N -5.23 0.38 1.28 1.19 8.25 -1.26 -2.18 115.22 117.65 3eaj n HIS 64 Ca 0.20 0.17 0.10 0.00 -0.26 0.00 0.00 57.72 57.93 3eaj n HIS 64 Cb 0.63 -0.78 0.39 0.00 1.12 0.00 0.00 29.99 31.35 3eaj n HIS 64 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 3eaj n SER 65 N -1.87 1.55 -4.08 0.41 3.41 0.52 -4.72 113.62 108.85 3eaj n SER 65 Ca 0.01 -1.69 -0.32 0.00 -0.26 0.00 0.00 58.87 56.61 3eaj n SER 65 Cb 0.11 -0.10 -0.15 0.00 -0.26 0.00 0.00 64.21 63.81 3eaj n SER 65 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3eaj s PHE 66 N -1.81 3.37 -0.30 7.33 0.08 -0.93 -4.43 117.98 121.30 3eaj s PHE 66 Ca 0.32 -2.40 -0.20 0.00 0.12 0.00 0.00 56.93 54.77 3eaj s PHE 66 Cb 0.17 -2.18 -0.01 0.00 -0.57 0.00 0.00 43.02 40.43 3eaj s PHE 66 CO 0.26 -0.89 0.60 -1.17 -0.10 0.00 0.00 175.22 173.92 3eaj s LEU 67 N 1.08 4.14 -0.04 -0.37 2.96 0.01 -4.70 118.68 121.77 3eaj s LEU 67 Ca -0.04 0.43 0.07 0.00 -0.22 0.00 0.00 54.13 54.36 3eaj s LEU 67 Cb -0.20 -2.77 -0.01 0.00 0.50 0.00 0.00 46.19 43.71 3eaj s LEU 67 CO -0.05 -0.43 -0.24 0.68 -1.32 0.00 0.00 176.35 174.99 3eaj s VAL 68 N 2.52 1.93 -0.08 1.68 -7.23 -1.26 0.07 120.40 118.04 3eaj s VAL 68 Ca 0.24 -1.02 0.03 0.00 -1.81 0.00 0.00 61.98 59.42 3eaj s VAL 68 Cb -0.15 -1.62 0.01 0.00 0.56 0.00 0.00 36.38 35.17 3eaj s VAL 68 CO 0.11 0.54 -0.18 -1.10 -0.31 0.00 0.00 175.10 174.17 3eaj s GLN 69 N -0.32 2.28 -0.53 4.82 -0.21 -0.67 -1.41 119.66 123.62 3eaj s GLN 69 Ca 0.02 -0.63 -0.12 0.00 0.02 0.00 0.00 55.36 54.64 3eaj s GLN 69 Cb -0.12 -1.80 0.13 0.00 1.00 0.00 0.00 33.01 32.23 3eaj s GLN 69 CO 0.02 0.12 0.45 0.00 -2.12 0.00 0.00 175.29 173.75 3eaj s ALA 70 N 0.45 3.56 0.00 6.09 0.00 -0.48 -1.66 121.76 129.73 3eaj s ALA 70 Ca -0.15 -2.60 0.00 0.00 0.00 0.00 0.00 51.96 49.20 3eaj s ALA 70 Cb -0.16 -3.07 0.00 0.00 0.00 0.00 0.00 23.12 19.89 3eaj s ALA 70 CO 0.06 -1.99 0.00 0.41 0.00 0.00 0.00 175.76 174.24 3eaj n GLY 71 N 4.98 1.93 0.09 0.00 0.00 -1.26 -2.56 105.19 108.37 3eaj n GLY 71 Ca -0.09 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.39 3eaj n GLY 71 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 3eaj h ASN 72 N 0.00 0.12 -3.48 1.61 7.08 -2.01 -3.48 115.58 115.42 3eaj h ASN 72 Ca 0.00 -0.20 -0.55 0.00 -3.08 0.00 0.00 56.30 52.47 3eaj h ASN 72 Cb 0.00 -0.04 0.19 0.00 -2.08 0.00 0.00 38.32 36.39 3eaj h ASN 72 CO 0.00 1.17 -0.22 0.52 -2.08 0.00 0.00 177.43 176.82 3eaj n VAL 73 N -3.23 1.80 -4.50 6.14 0.31 -1.06 -4.98 118.33 112.81 3eaj n VAL 73 Ca -0.15 -0.34 -0.34 0.00 -0.01 0.00 0.00 64.34 63.51 3eaj n VAL 73 Cb 1.03 -0.86 -0.12 0.00 -0.91 0.00 0.00 33.84 32.98 3eaj n VAL 73 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3eaj s GLN 74 N -3.16 3.41 0.01 5.55 -0.21 -1.26 -1.38 119.66 122.62 3eaj s GLN 74 Ca 0.67 -0.54 -0.02 0.00 0.02 0.00 0.00 55.36 55.49 3eaj s GLN 74 Cb -0.32 -2.80 -0.04 0.00 1.00 0.00 0.00 33.01 30.85 3eaj s GLN 74 CO 0.57 0.35 0.17 -0.51 -2.12 0.00 0.00 175.29 173.75 3eaj s LEU 75 N 0.06 4.29 -0.31 2.90 1.43 -0.50 -4.91 118.68 121.64 3eaj s LEU 75 Ca -0.01 0.29 -0.10 0.00 -1.03 0.00 0.00 54.13 53.28 3eaj s LEU 75 Cb -0.14 -2.65 -0.01 0.00 0.03 0.00 0.00 46.19 43.42 3eaj s LEU 75 CO 0.03 0.24 0.16 -0.60 0.23 0.00 0.00 176.35 176.41 3eaj s ARG 76 N -2.06 3.44 -0.01 1.70 3.52 -1.26 -4.34 118.95 119.94 3eaj s ARG 76 Ca 0.29 -0.65 -0.28 0.00 -0.13 0.00 0.00 55.73 54.95 3eaj s ARG 76 Cb -0.13 -3.58 -0.03 0.00 -1.56 0.00 0.00 34.95 29.65 3eaj s ARG 76 CO 0.20 -0.38 0.89 0.54 -0.81 0.00 0.00 175.30 175.75 3eaj s VAL 77 N 1.64 4.90 -0.20 7.11 0.11 -1.26 -2.49 120.40 130.21 3eaj s VAL 77 Ca 0.05 1.88 0.17 0.00 -2.93 0.00 0.00 61.98 61.14 3eaj s VAL 77 Cb -0.17 -4.24 0.46 0.00 -1.53 0.00 0.00 36.38 30.90 3eaj s VAL 77 CO 0.07 0.20 1.17 2.30 -3.33 0.00 0.00 175.10 175.51 3eaj n ILE 78 N 3.79 1.55 0.00 7.04 -5.35 0.02 -4.66 119.36 121.76 3eaj n ILE 78 Ca 0.04 -2.93 0.00 0.00 -0.27 0.00 0.00 62.75 59.59 3eaj n ILE 78 Cb 0.51 0.21 0.00 0.00 -1.74 0.00 0.00 39.64 38.62 3eaj n ILE 78 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3eaj n GLY 79 N -0.50 3.86 3.20 3.28 0.00 -1.24 -4.82 105.19 108.97 3eaj n GLY 79 Ca 0.20 -0.33 -0.10 0.00 0.00 0.00 0.00 46.02 45.79 3eaj n GLY 79 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3eaj s HIS 80 N -1.28 0.85 0.04 1.61 -3.43 -1.26 -1.26 115.29 110.57 3eaj s HIS 80 Ca 0.00 -1.18 -0.28 0.00 -0.80 0.00 0.00 55.06 52.80 3eaj s HIS 80 Cb 0.00 -0.41 0.10 0.00 -1.43 0.00 0.00 32.58 30.83 3eaj s HIS 80 CO 0.00 -0.59 1.19 -1.54 -2.00 0.00 0.00 174.74 171.79 3eaj s SER 81 N -3.06 -0.07 -0.06 7.38 1.04 -0.76 -4.97 113.70 113.20 3eaj s SER 81 Ca 0.26 -0.27 0.05 0.00 0.48 0.00 0.00 55.95 56.47 3eaj s SER 81 Cb 0.06 0.27 -0.00 0.00 0.10 0.00 0.00 66.02 66.45 3eaj s SER 81 CO 0.04 -0.51 -0.20 -0.32 0.98 0.00 0.00 173.24 173.23 3eaj s MET 82 N -2.53 2.17 -0.24 4.02 1.75 -1.26 -1.66 119.30 121.55 3eaj s MET 82 Ca 0.17 -0.71 0.00 0.00 -1.25 0.00 0.00 55.69 53.90 3eaj s MET 82 Cb 0.02 -1.82 0.07 0.00 2.84 0.00 0.00 34.83 35.94 3eaj s MET 82 CO -0.01 0.25 -0.02 -1.14 -0.65 0.00 0.00 175.02 173.45 3eaj s GLN 83 N 0.08 1.40 3.25 4.11 0.74 0.26 -4.96 119.66 124.54 3eaj s GLN 83 Ca -0.07 -0.99 0.00 0.00 0.05 0.00 0.00 55.36 54.35 3eaj s GLN 83 Cb -0.13 -2.51 0.00 0.00 1.10 0.00 0.00 33.01 31.46 3eaj s GLN 83 CO 0.04 -0.67 0.00 0.09 -0.55 0.00 0.00 175.29 174.20 3eaj n ASN 84 N 4.71 0.00 -1.07 6.67 3.02 -1.26 0.19 115.26 127.52 3eaj n ASN 84 Ca -0.09 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.55 3eaj n ASN 84 Cb 0.44 0.00 0.24 0.00 -0.61 0.00 0.00 39.78 39.85 3eaj n ASN 84 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3eaj s LEU 86 N -1.07 3.68 -0.10 0.00 1.43 0.13 -0.30 118.68 122.44 3eaj s LEU 86 Ca 0.38 -0.05 -0.14 0.00 -1.03 0.00 0.00 54.13 53.29 3eaj s LEU 86 Cb 0.20 -2.33 -0.05 0.00 0.03 0.00 0.00 46.19 44.04 3eaj s LEU 86 CO 0.27 0.19 0.34 -0.76 0.23 0.00 0.00 176.35 176.62 3eaj s LEU 87 N -2.22 4.33 -0.29 1.79 1.43 -0.47 -0.57 118.68 122.68 3eaj s LEU 87 Ca 0.27 0.69 -0.05 0.00 -1.03 0.00 0.00 54.13 54.00 3eaj s LEU 87 Cb -0.12 -2.46 0.02 0.00 0.03 0.00 0.00 46.19 43.66 3eaj s LEU 87 CO 0.19 0.18 0.05 -0.13 0.23 0.00 0.00 176.35 176.87 3eaj s ARG 88 N -0.13 2.98 -0.28 1.70 0.52 -0.66 -2.87 118.95 120.21 3eaj s ARG 88 Ca 0.20 -0.92 -0.08 0.00 -0.52 0.00 0.00 55.73 54.41 3eaj s ARG 88 Cb -0.14 -3.28 -0.01 0.00 0.52 0.00 0.00 34.95 32.03 3eaj s ARG 88 CO 0.08 -0.45 0.10 -0.51 0.02 0.00 0.00 175.30 174.53 3eaj s LEU 89 N 1.45 3.74 0.41 2.53 1.43 -0.91 -1.84 118.68 125.49 3eaj s LEU 89 Ca 0.01 -0.41 -0.24 0.00 -1.03 0.00 0.00 54.13 52.46 3eaj s LEU 89 Cb -0.17 -1.94 -0.08 0.00 0.03 0.00 0.00 46.19 44.02 3eaj s LEU 89 CO 0.01 -0.12 1.13 -0.54 0.23 0.00 0.00 176.35 177.06 3eaj s LYS 90 N 1.59 4.04 0.15 1.70 -0.14 -0.39 -1.35 119.74 125.34 3eaj s LYS 90 Ca 0.05 1.72 0.01 0.00 -1.36 0.00 0.00 55.97 56.40 3eaj s LYS 90 Cb -0.16 -2.59 -0.04 0.00 -1.68 0.00 0.00 37.83 33.35 3eaj s LYS 90 CO 0.04 -0.30 -0.00 0.14 -0.76 0.00 0.00 175.35 174.47 3eaj s VAL 91 N -1.51 0.56 0.06 3.17 -7.23 0.55 -0.80 120.40 115.20 3eaj s VAL 91 Ca 0.58 -1.95 -0.20 0.00 -1.81 0.00 0.00 61.98 58.60 3eaj s VAL 91 Cb -0.28 -2.01 -0.12 0.00 0.56 0.00 0.00 36.38 34.54 3eaj s VAL 91 CO 0.34 -0.56 1.42 -2.24 -0.31 0.00 0.00 175.10 173.75 3eaj h ASP 92 N 2.79 0.37 -3.33 4.85 2.03 -1.78 -3.44 116.42 117.91 3eaj h ASP 92 Ca -0.36 -0.40 -0.56 0.00 -0.73 0.00 0.00 57.03 54.98 3eaj h ASP 92 Cb 1.19 -0.10 -0.04 0.00 -0.83 0.00 0.00 39.33 39.55 3eaj h ASP 92 CO 0.62 0.69 0.38 -0.89 -1.03 0.00 0.00 179.24 179.01 3eaj s THR 93 N -4.63 4.88 0.58 1.15 2.01 -1.26 -5.02 115.64 113.35 3eaj s THR 93 Ca -0.14 1.84 -0.15 0.00 0.31 0.00 0.00 61.69 63.55 3eaj s THR 93 Cb 0.06 -4.22 -0.05 0.00 0.01 0.00 0.00 72.50 68.30 3eaj s THR 93 CO 0.74 0.10 1.03 -0.55 -0.69 0.00 0.00 174.62 175.25 3eaj s SER 94 N 1.03 6.06 -0.28 3.53 0.15 -1.26 -4.36 113.70 118.57 3eaj s SER 94 Ca 0.45 1.67 -0.20 0.00 0.70 0.00 0.00 55.95 58.57 3eaj s SER 94 Cb -0.19 -2.51 -0.02 0.00 -1.71 0.00 0.00 66.02 61.59 3eaj s SER 94 CO 0.19 -0.98 0.60 0.21 1.20 0.00 0.00 173.24 174.47 3eaj s ASN 95 N -3.13 6.50 0.52 5.45 2.47 0.82 -4.91 114.94 122.66 3eaj s ASN 95 Ca 0.61 0.52 0.17 0.00 0.42 0.00 0.00 52.86 54.58 3eaj s ASN 95 Cb -0.13 -2.32 1.28 0.00 -1.45 0.00 0.00 41.25 38.62 3eaj s ASN 95 CO 0.39 -0.41 2.11 1.55 -3.72 0.00 0.00 177.10 177.02 3eaj h PRO 96 N 8.07 0.03 -0.38 0.43 0.13 -1.94 -2.32 132.00 136.02 3eaj h PRO 96 Ca -0.27 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3eaj h PRO 96 Cb 1.12 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3eaj h PRO 96 CO 0.77 0.02 0.00 1.63 -0.23 0.00 0.00 178.00 180.19 3eaj n LYS 97 N -4.50 2.12 -1.69 0.86 5.02 -1.26 -4.94 118.16 113.76 3eaj n LYS 97 Ca 0.00 -1.71 -0.43 0.00 -2.02 0.00 0.00 58.31 54.15 3eaj n LYS 97 Cb 0.20 -1.42 -0.03 0.00 -0.02 0.00 0.00 35.03 33.76 3eaj n LYS 97 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3eaj n THR 98 N 0.90 0.28 -3.36 -0.18 -1.04 -0.87 -4.87 114.28 105.15 3eaj n THR 98 Ca 0.17 -0.05 -0.22 0.00 -2.04 0.00 0.00 64.05 61.91 3eaj n THR 98 Cb 0.44 -2.03 -0.00 0.00 -1.82 0.00 0.00 70.33 66.92 3eaj n THR 98 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3eaj s PRO 99 N 2.38 3.27 -0.14 -2.82 0.05 -1.26 -5.02 135.00 131.46 3eaj s PRO 99 Ca 0.81 -0.59 -0.35 0.00 0.05 0.00 0.00 61.00 60.93 3eaj s PRO 99 Cb -0.52 -2.70 -0.12 0.00 0.05 0.00 0.00 34.50 31.22 3eaj s PRO 99 CO 0.37 0.04 1.91 1.63 0.05 0.00 0.00 177.00 181.00 3eaj n LYS 100 N -1.79 1.98 -4.21 4.56 5.02 -1.26 -4.90 118.16 117.55 3eaj n LYS 100 Ca -0.03 0.71 -0.15 0.00 -2.02 0.00 0.00 58.31 56.83 3eaj n LYS 100 Cb 0.57 -2.60 -0.09 0.00 -0.02 0.00 0.00 35.03 32.89 3eaj n LYS 100 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 3eaj s TYR 101 N 4.49 1.33 0.06 2.13 -0.85 -1.26 -0.06 117.35 123.18 3eaj s TYR 101 Ca 0.95 -1.44 -0.27 0.00 -0.52 0.00 0.00 57.07 55.79 3eaj s TYR 101 Cb -0.73 -0.54 0.09 0.00 0.38 0.00 0.00 41.96 41.16 3eaj s TYR 101 CO 0.52 -0.78 0.84 -1.59 -1.52 0.00 0.00 175.55 173.02 3eaj s LYS 102 N -3.81 0.99 -0.18 -3.49 -2.85 0.25 -4.86 119.74 105.79 3eaj s LYS 102 Ca 0.38 -0.40 -0.07 0.00 -1.00 0.00 0.00 55.97 54.87 3eaj s LYS 102 Cb 0.04 0.43 -0.04 0.00 -2.06 0.00 0.00 37.83 36.20 3eaj s LYS 102 CO 0.18 -0.44 0.07 -0.06 0.10 0.00 0.00 175.35 175.20 3eaj s PHE 103 N -3.29 3.27 0.01 1.78 2.99 -1.26 -0.13 117.98 121.34 3eaj s PHE 103 Ca 0.05 0.10 0.02 0.00 0.00 0.00 0.00 56.93 57.11 3eaj s PHE 103 Cb -0.01 -2.07 -0.01 0.00 0.00 0.00 0.00 43.02 40.92 3eaj s PHE 103 CO -0.08 0.19 -0.08 0.14 -0.00 0.00 0.00 175.22 175.39 3eaj s VAL 104 N 0.30 0.58 -0.36 -0.44 -7.23 -0.17 -4.94 120.40 108.13 3eaj s VAL 104 Ca 0.04 -0.52 -0.20 0.00 -1.81 0.00 0.00 61.98 59.48 3eaj s VAL 104 Cb -0.12 -0.53 0.00 0.00 0.56 0.00 0.00 36.38 36.29 3eaj s VAL 104 CO 0.00 0.02 0.64 -0.60 -0.31 0.00 0.00 175.10 174.84 3eaj s ARG 105 N -0.56 3.64 0.62 4.82 3.52 -1.26 -4.16 118.95 125.57 3eaj s ARG 105 Ca -0.00 0.02 -0.14 0.00 -0.13 0.00 0.00 55.73 55.48 3eaj s ARG 105 Cb -0.05 -3.82 -0.03 0.00 -1.56 0.00 0.00 34.95 29.49 3eaj s ARG 105 CO 0.00 -0.76 1.04 -1.50 -0.81 0.00 0.00 175.30 173.27 3eaj s ILE 106 N 2.72 4.09 0.14 4.11 2.07 -1.26 -5.06 121.20 128.01 3eaj s ILE 106 Ca 0.24 0.85 0.02 0.00 -1.41 0.00 0.00 60.65 60.35 3eaj s ILE 106 Cb -0.14 -3.49 -0.04 0.00 0.13 0.00 0.00 42.46 38.92 3eaj s ILE 106 CO 0.15 -0.72 0.27 -1.10 -1.91 0.00 0.00 174.94 171.63 3eaj s GLN 107 N -4.53 3.42 0.29 3.50 -1.52 -1.26 -5.06 119.66 114.50 3eaj s GLN 107 Ca 0.60 -0.60 -0.29 0.00 -1.95 0.00 0.00 55.36 53.12 3eaj s GLN 107 Cb -0.14 -2.96 -0.10 0.00 -0.22 0.00 0.00 33.01 29.59 3eaj s GLN 107 CO 0.44 0.53 1.43 -2.14 -0.25 0.00 0.00 175.29 175.30 3eaj s PRO 108 N -3.17 4.25 0.00 2.91 0.02 -1.26 -2.05 135.00 135.70 3eaj s PRO 108 Ca 0.34 2.35 0.00 0.00 0.02 0.00 0.00 61.00 63.71 3eaj s PRO 108 Cb -0.11 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.34 3eaj s PRO 108 CO 0.28 -0.41 0.00 0.41 -0.33 0.00 0.00 177.00 176.96 3eaj n GLY 109 N 1.63 2.66 3.78 0.52 0.00 0.04 -4.93 105.19 108.89 3eaj n GLY 109 Ca 0.04 -0.49 -0.33 0.00 0.00 0.00 0.00 46.02 45.25 3eaj n GLY 109 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3eaj s GLN 110 N 0.00 2.99 0.32 1.61 -0.21 -0.87 -4.75 119.66 118.75 3eaj s GLN 110 Ca 0.00 1.31 0.09 0.00 0.02 0.00 0.00 55.36 56.78 3eaj s GLN 110 Cb 0.00 -1.98 -0.05 0.00 1.00 0.00 0.00 33.01 31.98 3eaj s GLN 110 CO 0.00 -1.09 0.07 0.95 -2.12 0.00 0.00 175.29 173.11 3eaj s THR 111 N -2.40 3.03 0.25 -0.19 -4.23 -1.26 -1.70 115.64 109.14 3eaj s THR 111 Ca 0.65 -1.82 -0.22 0.00 -1.18 0.00 0.00 61.69 59.13 3eaj s THR 111 Cb -0.19 -2.90 0.03 0.00 1.34 0.00 0.00 72.50 70.78 3eaj s THR 111 CO 0.40 -0.23 0.75 0.72 -0.54 0.00 0.00 174.62 175.72 3eaj s PHE 112 N -2.42 -0.20 -0.15 3.99 -0.12 -0.42 -4.96 117.98 113.70 3eaj s PHE 112 Ca 0.35 -0.22 -0.08 0.00 -0.05 0.00 0.00 56.93 56.93 3eaj s PHE 112 Cb -0.03 0.69 -0.04 0.00 -0.63 0.00 0.00 43.02 43.01 3eaj s PHE 112 CO 0.21 -1.15 0.14 -1.12 -0.05 0.00 0.00 175.22 173.24 3eaj s SER 113 N -2.91 6.32 -0.14 1.98 0.01 -0.08 -1.24 113.70 117.63 3eaj s SER 113 Ca 0.11 0.39 -0.03 0.00 1.31 0.00 0.00 55.95 57.72 3eaj s SER 113 Cb -0.05 -2.07 -0.03 0.00 0.21 0.00 0.00 66.02 64.08 3eaj s SER 113 CO 0.05 0.33 -0.04 -0.69 0.41 0.00 0.00 173.24 173.30 3eaj s VAL 114 N -0.57 3.85 -0.56 3.43 1.01 0.10 -0.80 120.40 126.87 3eaj s VAL 114 Ca 0.13 -0.38 -0.11 0.00 0.00 0.00 0.00 61.98 61.62 3eaj s VAL 114 Cb -0.12 -2.67 0.14 0.00 0.00 0.00 0.00 36.38 33.73 3eaj s VAL 114 CO 0.02 0.51 0.45 -0.22 0.00 0.00 0.00 175.10 175.87 3eaj s LEU 115 N 0.19 5.92 -0.12 3.92 2.96 -0.65 -1.61 118.68 129.29 3eaj s LEU 115 Ca -0.02 -2.12 -0.29 0.00 -0.22 0.00 0.00 54.13 51.48 3eaj s LEU 115 Cb -0.14 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 3eaj s LEU 115 CO 0.03 -0.67 1.53 0.00 -1.32 0.00 0.00 176.35 175.92 3eaj s ALA 116 N 1.06 3.56 0.32 5.97 0.00 -0.32 -3.90 121.76 128.46 3eaj s ALA 116 Ca 0.08 0.71 0.10 0.00 0.00 0.00 0.00 51.96 52.85 3eaj s ALA 116 Cb -0.24 -3.73 -0.05 0.00 0.00 0.00 0.00 23.12 19.10 3eaj s ALA 116 CO -0.02 -1.44 -0.05 0.00 0.00 0.00 0.00 175.76 174.25 3eaj s TYR 118 N -2.52 -0.63 -1.20 0.00 2.02 -0.72 -3.99 117.35 110.32 3eaj s TYR 118 Ca 0.33 1.18 -0.07 0.00 -0.37 0.00 0.00 57.07 58.14 3eaj s TYR 118 Cb -0.01 0.11 0.01 0.00 -0.40 0.00 0.00 41.96 41.67 3eaj s TYR 118 CO 0.18 -0.46 1.05 0.09 -1.57 0.00 0.00 175.55 174.84 3eaj n ASN 119 N 5.37 -5.36 0.00 2.29 3.02 -1.26 -2.21 115.26 117.11 3eaj n ASN 119 Ca -0.07 -0.50 0.00 0.00 -0.03 0.00 0.00 54.58 53.98 3eaj n ASN 119 Cb 0.50 -4.61 0.00 0.00 -0.61 0.00 0.00 39.78 35.06 3eaj n ASN 119 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3eaj n GLY 120 N -1.75 0.50 3.13 7.41 0.00 -1.23 -4.66 105.19 108.59 3eaj n GLY 120 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 3eaj n GLY 120 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3eaj s SER 121 N -2.29 4.62 0.06 1.61 0.15 -0.94 -4.41 113.70 112.50 3eaj s SER 121 Ca 0.00 -1.29 -0.35 0.00 0.70 0.00 0.00 55.95 55.01 3eaj s SER 121 Cb 0.00 -1.63 -0.14 0.00 -1.71 0.00 0.00 66.02 62.54 3eaj s SER 121 CO 0.00 -0.21 1.63 -2.65 1.20 0.00 0.00 173.24 173.21 3eaj n PRO 122 N 4.54 1.96 -0.08 5.44 -0.02 -1.26 -1.75 135.00 143.83 3eaj n PRO 122 Ca -0.14 0.71 -0.11 0.00 -2.02 0.00 0.00 63.50 61.95 3eaj n PRO 122 Cb 0.43 -2.48 -0.15 0.00 -0.02 0.00 0.00 33.50 31.28 3eaj n PRO 122 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3eaj n SER 123 N 4.21 0.48 0.00 2.55 2.88 0.42 -4.92 113.62 119.24 3eaj n SER 123 Ca 0.19 0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.83 3eaj n SER 123 Cb 0.27 0.53 0.00 0.00 -0.75 0.00 0.00 64.21 64.26 3eaj n SER 123 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3eaj n GLY 124 N 1.76 2.08 3.36 0.46 0.00 -1.16 -5.01 105.19 106.68 3eaj n GLY 124 Ca -0.30 -0.70 -0.31 0.00 0.00 0.00 0.00 46.02 44.71 3eaj n GLY 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3eaj s VAL 125 N -2.00 2.30 0.08 1.61 0.11 -1.26 -1.17 120.40 120.07 3eaj s VAL 125 Ca 0.00 -1.16 -0.11 0.00 -2.93 0.00 0.00 61.98 57.78 3eaj s VAL 125 Cb 0.00 -1.87 0.01 0.00 -1.53 0.00 0.00 36.38 32.99 3eaj s VAL 125 CO 0.00 0.48 0.25 -0.72 -3.33 0.00 0.00 175.10 171.78 3eaj s TYR 126 N -0.73 0.02 0.15 1.54 -0.85 -0.63 -4.97 117.35 111.88 3eaj s TYR 126 Ca 0.11 -0.33 0.02 0.00 -0.52 0.00 0.00 57.07 56.35 3eaj s TYR 126 Cb -0.10 0.03 -0.04 0.00 0.38 0.00 0.00 41.96 42.24 3eaj s TYR 126 CO 0.01 -0.54 0.29 -1.14 -1.52 0.00 0.00 175.55 172.65 3eaj s GLN 127 N -3.35 3.45 0.29 -3.49 0.74 -1.26 0.01 119.66 116.06 3eaj s GLN 127 Ca 0.01 -0.54 -0.17 0.00 0.05 0.00 0.00 55.36 54.70 3eaj s GLN 127 Cb 0.02 -2.95 0.02 0.00 1.10 0.00 0.00 33.01 31.19 3eaj s GLN 127 CO -0.08 0.51 0.65 0.00 -0.55 0.00 0.00 175.29 175.82 3eaj s ALA 129 N -3.68 2.45 -0.66 0.00 0.00 -1.26 -1.30 121.76 117.30 3eaj s ALA 129 Ca 0.16 -1.13 -0.27 0.00 0.00 0.00 0.00 51.96 50.72 3eaj s ALA 129 Cb -0.04 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 22.37 3eaj s ALA 129 CO 0.09 0.55 1.60 1.41 0.00 0.00 0.00 175.76 179.41 3eaj s MET 130 N -1.02 2.90 0.94 0.00 0.00 -0.69 -4.53 119.30 116.90 3eaj s MET 130 Ca 0.12 0.27 -0.12 0.00 0.00 0.00 0.00 55.69 55.96 3eaj s MET 130 Cb -0.10 -4.29 0.06 0.00 0.00 0.00 0.00 34.83 30.50 3eaj s MET 130 CO 0.02 -2.44 0.59 0.54 0.00 0.00 0.00 175.02 173.73 3eaj n ARG 131 N 9.22 -0.31 0.27 4.11 5.12 -0.60 -0.78 116.66 133.69 3eaj n ARG 131 Ca 0.13 -0.04 0.12 0.00 -1.93 0.00 0.00 57.85 56.13 3eaj n ARG 131 Cb 0.51 -1.98 0.77 0.00 -1.16 0.00 0.00 32.46 30.59 3eaj n ARG 131 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 3eaj h PRO 132 N -1.60 0.00 -0.01 5.56 0.11 -1.87 -1.05 132.00 133.14 3eaj h PRO 132 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3eaj h PRO 132 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3eaj h PRO 132 CO 0.36 0.07 -0.02 0.27 -0.21 0.00 0.00 178.00 178.47 3eaj n ASN 133 N -3.91 0.76 0.00 -2.05 0.23 -1.26 -4.92 115.26 104.10 3eaj n ASN 133 Ca -0.03 -1.16 0.00 0.00 -0.53 0.00 0.00 54.58 52.86 3eaj n ASN 133 Cb 0.16 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 37.85 3eaj n ASN 133 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 3eaj n HIS 134 N -0.46 0.00 -4.04 -2.53 8.25 -0.40 -4.66 115.22 111.38 3eaj n HIS 134 Ca 0.20 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.40 3eaj n HIS 134 Cb 0.25 -0.10 -0.05 0.00 1.12 0.00 0.00 29.99 31.20 3eaj n HIS 134 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3eaj s THR 135 N -2.00 4.73 -0.08 1.59 -4.23 -1.26 -4.63 115.64 109.75 3eaj s THR 135 Ca 0.00 -0.93 0.00 0.00 -1.18 0.00 0.00 61.69 59.58 3eaj s THR 135 Cb 0.00 -3.40 -0.03 0.00 1.34 0.00 0.00 72.50 70.41 3eaj s THR 135 CO 0.00 -0.08 -0.07 0.27 -0.54 0.00 0.00 174.62 174.20 3eaj s ILE 136 N -1.71 3.66 -0.96 2.99 -4.36 -1.03 -1.56 121.20 118.23 3eaj s ILE 136 Ca 0.32 -0.49 -0.21 0.00 -0.26 0.00 0.00 60.65 60.01 3eaj s ILE 136 Cb -0.11 -2.51 0.09 0.00 1.25 0.00 0.00 42.46 41.18 3eaj s ILE 136 CO 0.25 0.58 1.29 -0.54 0.24 0.00 0.00 174.94 176.76 3eaj s LYS 137 N -0.62 3.57 0.04 0.37 1.02 -1.26 -1.32 119.74 121.55 3eaj s LYS 137 Ca 0.09 -1.39 0.00 0.00 0.02 0.00 0.00 55.97 54.70 3eaj s LYS 137 Cb -0.12 -5.11 0.00 0.00 -0.52 0.00 0.00 37.83 32.09 3eaj s LYS 137 CO 0.02 -2.00 0.02 0.41 -0.92 0.00 0.00 175.35 172.88 3eaj n GLY 138 N 6.19 3.39 2.84 -3.33 0.00 -1.26 -4.94 105.19 108.08 3eaj n GLY 138 Ca 0.27 -2.19 -0.30 0.00 0.00 0.00 0.00 46.02 43.80 3eaj n GLY 138 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3eaj s SER 139 N -1.23 4.20 -0.19 1.61 0.15 -1.26 -4.95 113.70 112.03 3eaj s SER 139 Ca 0.02 -1.72 -0.02 0.00 0.70 0.00 0.00 55.95 54.93 3eaj s SER 139 Cb -0.00 -1.12 0.06 0.00 -1.71 0.00 0.00 66.02 63.25 3eaj s SER 139 CO 0.01 -0.38 0.02 -0.36 1.20 0.00 0.00 173.24 173.72 3eaj s PHE 140 N 1.39 1.21 0.78 3.44 0.08 -1.26 -4.98 117.98 118.64 3eaj s PHE 140 Ca 0.08 -0.94 -0.05 0.00 0.12 0.00 0.00 56.93 56.14 3eaj s PHE 140 Cb -0.18 -1.10 0.14 0.00 -0.57 0.00 0.00 43.02 41.31 3eaj s PHE 140 CO -0.18 -0.61 1.08 -0.51 -0.10 0.00 0.00 175.22 174.90 3eaj s LEU 141 N 1.79 2.90 0.11 -0.37 1.02 -1.26 -4.97 118.68 117.91 3eaj s LEU 141 Ca -0.01 -0.12 -0.31 0.00 0.02 0.00 0.00 54.13 53.71 3eaj s LEU 141 Cb -0.17 -2.18 -0.08 0.00 0.02 0.00 0.00 46.19 43.78 3eaj s LEU 141 CO -0.08 -2.06 1.42 0.20 0.02 0.00 0.00 176.35 175.86 3eaj s ASN 142 N -4.75 6.79 0.00 2.29 -0.87 -1.26 -1.99 114.94 115.14 3eaj s ASN 142 Ca 0.68 2.36 0.00 0.00 -1.57 0.00 0.00 52.86 54.32 3eaj s ASN 142 Cb -0.05 -2.58 0.00 0.00 -0.02 0.00 0.00 41.25 38.59 3eaj s ASN 142 CO 0.47 -0.69 0.00 0.61 -2.57 0.00 0.00 177.10 174.92 3eaj n GLY 143 N 3.56 0.64 0.07 0.66 0.00 -1.26 -4.96 105.19 103.90 3eaj n GLY 143 Ca 0.12 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.28 3eaj n GLY 143 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3eaj n SER 144 N 0.00 0.37 -4.71 1.61 3.41 -0.84 -4.30 113.62 109.15 3eaj n SER 144 Ca 0.00 -0.29 -0.40 0.00 -0.26 0.00 0.00 58.87 57.92 3eaj n SER 144 Cb 0.00 -0.11 0.03 0.00 -0.26 0.00 0.00 64.21 63.86 3eaj n SER 144 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3eaj n GLY 146 N 0.81 1.58 3.76 0.00 0.00 -0.50 -1.39 105.19 109.45 3eaj n GLY 146 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 3eaj n GLY 146 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3eaj s SER 147 N -2.98 5.50 0.13 1.61 0.01 -0.92 -4.45 113.70 112.60 3eaj s SER 147 Ca 0.00 2.73 0.09 0.00 1.31 0.00 0.00 55.95 60.08 3eaj s SER 147 Cb 0.00 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.55 3eaj s SER 147 CO 0.00 -1.41 -0.15 0.68 0.41 0.00 0.00 173.24 172.77 3eaj s VAL 148 N -1.31 3.01 0.06 3.43 -7.23 -1.25 -0.99 120.40 116.11 3eaj s VAL 148 Ca 0.69 -1.53 0.05 0.00 -1.81 0.00 0.00 61.98 59.38 3eaj s VAL 148 Cb -0.39 -2.42 -0.04 0.00 0.56 0.00 0.00 36.38 34.09 3eaj s VAL 148 CO 0.47 0.04 -0.07 -0.83 -0.31 0.00 0.00 175.10 174.40 3eaj s GLY 149 N -2.36 1.80 0.28 2.32 0.00 0.29 -1.64 107.32 108.01 3eaj s GLY 149 Ca 0.21 -1.13 -0.20 0.00 0.00 0.00 0.00 44.72 43.59 3eaj s GLY 149 CO 0.12 -1.07 0.83 -0.11 0.00 0.00 0.00 173.10 172.87 3eaj s PHE 150 N -1.15 -0.04 0.01 1.90 -0.12 0.02 -1.44 117.98 117.17 3eaj s PHE 150 Ca 0.21 -0.46 -0.03 0.00 -0.05 0.00 0.00 56.93 56.59 3eaj s PHE 150 Cb -0.11 0.74 -0.01 0.00 -0.63 0.00 0.00 43.02 43.01 3eaj s PHE 150 CO 0.12 -1.24 0.04 -0.80 -0.05 0.00 0.00 175.22 173.30 3eaj s ASN 151 N -3.04 0.15 -0.26 1.98 0.01 -0.53 -0.90 114.94 112.35 3eaj s ASN 151 Ca 0.14 -0.37 -0.02 0.00 -0.71 0.00 0.00 52.86 51.90 3eaj s ASN 151 Cb -0.04 0.15 0.03 0.00 0.41 0.00 0.00 41.25 41.79 3eaj s ASN 151 CO 0.07 -0.33 -0.05 -0.63 -1.51 0.00 0.00 177.10 174.66 3eaj s ILE 152 N -1.43 2.96 -0.36 0.60 1.01 -1.26 -0.36 121.20 122.37 3eaj s ILE 152 Ca -0.15 -1.04 -0.03 0.00 0.00 0.00 0.00 60.65 59.43 3eaj s ILE 152 Cb -0.09 -2.52 0.07 0.00 0.01 0.00 0.00 42.46 39.93 3eaj s ILE 152 CO 0.00 0.16 0.11 -1.81 0.00 0.00 0.00 174.94 173.41 3eaj s ASP 153 N 1.33 5.15 0.90 3.58 -0.00 -0.89 -4.93 116.67 121.81 3eaj s ASP 153 Ca -0.00 -1.57 0.00 0.00 -0.00 0.00 0.00 52.55 50.97 3eaj s ASP 153 Cb -0.17 -1.80 0.00 0.00 -0.00 0.00 0.00 42.92 40.95 3eaj s ASP 153 CO -0.04 -0.40 0.00 -1.22 -0.00 0.00 0.00 175.17 173.51 3eaj n TYR 154 N 4.66 0.00 -0.56 4.23 4.02 -1.26 -2.76 117.16 125.49 3eaj n TYR 154 Ca -0.08 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.85 3eaj n TYR 154 Cb 0.43 0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.81 3eaj n TYR 154 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 3eaj n ASP 155 N 9.55 2.04 -4.19 7.72 5.75 -1.26 -5.02 116.55 131.14 3eaj n ASP 155 Ca 0.00 -2.45 -0.34 0.00 -0.01 0.00 0.00 54.79 51.99 3eaj n ASP 155 Cb 0.00 -0.20 -0.15 0.00 -1.03 0.00 0.00 41.12 39.74 3eaj n ASP 155 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3eaj s VAL 157 N 1.34 4.47 -0.53 0.00 1.01 0.91 -2.09 120.40 125.51 3eaj s VAL 157 Ca 0.03 1.11 -0.19 0.00 0.00 0.00 0.00 61.98 62.93 3eaj s VAL 157 Cb -0.15 -4.42 0.07 0.00 0.00 0.00 0.00 36.38 31.88 3eaj s VAL 157 CO -0.08 -0.71 0.65 -0.44 0.00 0.00 0.00 175.10 174.52 3eaj s SER 158 N 2.09 6.21 0.17 3.32 0.01 0.52 -0.58 113.70 125.44 3eaj s SER 158 Ca 0.40 -1.07 -0.30 0.00 1.31 0.00 0.00 55.95 56.29 3eaj s SER 158 Cb -0.10 -2.29 -0.07 0.00 0.21 0.00 0.00 66.02 63.76 3eaj s SER 158 CO 0.23 -0.96 1.01 -0.36 0.41 0.00 0.00 173.24 173.57 3eaj s PHE 159 N 2.64 3.77 0.00 2.43 0.08 0.81 -1.45 117.98 126.25 3eaj s PHE 159 Ca 0.14 1.76 0.00 0.00 0.12 0.00 0.00 56.93 58.95 3eaj s PHE 159 Cb -0.21 -3.12 0.00 0.00 -0.57 0.00 0.00 43.02 39.12 3eaj s PHE 159 CO 0.10 -0.03 0.02 0.00 -0.10 0.00 0.00 175.22 175.21 3eaj s TYR 161 N -0.08 -0.51 -0.03 0.00 5.04 -0.94 -4.15 117.35 116.68 3eaj s TYR 161 Ca 0.00 1.23 0.03 0.00 -2.44 0.00 0.00 57.07 55.89 3eaj s TYR 161 Cb 0.00 0.18 0.00 0.00 0.35 0.00 0.00 41.96 42.49 3eaj s TYR 161 CO 0.00 -0.25 -0.10 1.41 -1.34 0.00 0.00 175.55 175.27 3eaj s MET 162 N 0.33 1.04 0.30 4.97 -2.45 0.19 -0.55 119.30 123.13 3eaj s MET 162 Ca -0.01 -0.33 -0.27 0.00 -1.25 0.00 0.00 55.69 53.83 3eaj s MET 162 Cb -0.04 -0.96 -0.10 0.00 1.25 0.00 0.00 34.83 34.99 3eaj s MET 162 CO -0.00 0.13 0.95 -1.58 1.05 0.00 0.00 175.02 175.57 3eaj s HIS 163 N 0.17 3.75 0.15 4.11 2.46 -0.17 -1.27 115.29 124.50 3eaj s HIS 163 Ca -0.03 1.81 0.00 0.00 0.47 0.00 0.00 55.06 57.31 3eaj s HIS 163 Cb -0.09 -2.96 0.00 0.00 -0.13 0.00 0.00 32.58 29.41 3eaj s HIS 163 CO 0.01 0.22 0.00 0.72 -2.47 0.00 0.00 174.74 173.21 3eaj n HIS 164 N 0.79 -0.97 -4.30 3.88 8.25 -1.00 -1.41 115.22 120.46 3eaj n HIS 164 Ca 0.01 0.17 -0.20 0.00 -0.26 0.00 0.00 57.72 57.44 3eaj n HIS 164 Cb 0.49 0.27 -0.11 0.00 1.12 0.00 0.00 29.99 31.76 3eaj n HIS 164 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 3eaj s MET 165 N -2.00 1.18 -0.18 -0.41 -1.94 -0.66 -4.87 119.30 110.41 3eaj s MET 165 Ca 0.00 -1.36 -0.02 0.00 -1.71 0.00 0.00 55.69 52.60 3eaj s MET 165 Cb 0.00 -1.13 -0.01 0.00 2.01 0.00 0.00 34.83 35.70 3eaj s MET 165 CO 0.00 0.22 -0.09 -2.00 -0.01 0.00 0.00 175.02 173.14 3eaj s GLU 166 N -2.84 3.36 0.56 2.03 2.12 -1.26 -2.31 118.70 120.35 3eaj s GLU 166 Ca 0.14 -0.66 -0.16 0.00 0.36 0.00 0.00 54.97 54.64 3eaj s GLU 166 Cb -0.05 -2.81 -0.06 0.00 0.26 0.00 0.00 34.13 31.48 3eaj s GLU 166 CO 0.05 -0.01 1.02 -0.51 -0.54 0.00 0.00 175.26 175.27 3eaj s LEU 167 N 0.95 3.56 0.45 2.70 1.02 0.24 -4.92 118.68 122.68 3eaj s LEU 167 Ca -0.01 1.70 0.25 0.00 0.02 0.00 0.00 54.13 56.09 3eaj s LEU 167 Cb -0.15 -4.52 1.28 0.00 0.02 0.00 0.00 46.19 42.82 3eaj s LEU 167 CO -0.00 -0.89 1.78 -0.65 0.02 0.00 0.00 176.35 176.60 3eaj h PRO 168 N 0.67 0.23 0.00 1.29 0.11 -1.86 0.52 132.00 132.96 3eaj h PRO 168 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3eaj h PRO 168 Cb 1.20 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3eaj h PRO 168 CO 0.59 0.15 0.00 1.15 -0.21 0.00 0.00 178.00 179.69 3eaj h THR 169 N 0.24 0.00 0.00 -1.15 2.02 -1.93 -3.45 112.91 108.63 3eaj h THR 169 Ca 0.60 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.62 3eaj h THR 169 Cb 1.82 1.09 0.00 0.00 -1.74 0.00 0.00 68.15 69.32 3eaj h THR 169 CO -0.20 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.30 3eaj n GLY 170 N -0.75 0.74 3.67 2.16 0.00 0.18 -5.07 105.19 106.14 3eaj n GLY 170 Ca -0.02 -0.24 -0.24 0.00 0.00 0.00 0.00 46.02 45.53 3eaj n GLY 170 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3eaj s VAL 171 N -2.00 3.01 0.39 1.61 0.11 -1.24 -4.82 120.40 117.45 3eaj s VAL 171 Ca 0.00 -1.85 0.08 0.00 -2.93 0.00 0.00 61.98 57.28 3eaj s VAL 171 Cb 0.00 -2.88 -0.06 0.00 -1.53 0.00 0.00 36.38 31.92 3eaj s VAL 171 CO 0.00 -0.24 0.10 -1.00 -3.33 0.00 0.00 175.10 170.63 3eaj s HIS 172 N -2.43 2.58 -0.07 1.54 0.09 -0.43 -0.59 115.29 115.98 3eaj s HIS 172 Ca 0.35 -0.54 -0.21 0.00 -0.00 0.00 0.00 55.06 54.66 3eaj s HIS 172 Cb -0.03 -1.77 0.05 0.00 -0.00 0.00 0.00 32.58 30.83 3eaj s HIS 172 CO 0.21 0.32 0.49 0.00 -0.00 0.00 0.00 174.74 175.76 3eaj s ALA 173 N -2.58 -1.24 0.00 -1.40 0.00 -0.98 -2.45 121.76 113.10 3eaj s ALA 173 Ca 0.38 0.94 0.00 0.00 0.00 0.00 0.00 51.96 53.28 3eaj s ALA 173 Cb 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 23.12 22.98 3eaj s ALA 173 CO 0.21 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.08 3eaj n GLY 174 N 1.51 2.32 3.31 0.00 0.00 -1.26 -1.65 105.19 109.42 3eaj n GLY 174 Ca -0.19 -0.63 -0.16 0.00 0.00 0.00 0.00 46.02 45.04 3eaj n GLY 174 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3eaj s THR 175 N -2.26 0.75 1.06 2.61 -4.23 -0.39 -1.83 115.64 111.35 3eaj s THR 175 Ca 0.00 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.33 3eaj s THR 175 Cb 0.00 -2.45 0.26 0.00 1.34 0.00 0.00 72.50 71.65 3eaj s THR 175 CO 0.00 -0.20 1.08 -0.90 -0.54 0.00 0.00 174.62 174.06 3eaj n ASP 176 N -0.41 -1.33 -1.39 3.99 5.68 -0.37 -0.64 116.55 122.07 3eaj n ASP 176 Ca -0.03 -1.22 -0.07 0.00 -0.50 0.00 0.00 54.79 52.97 3eaj n ASP 176 Cb 0.65 -0.93 0.04 0.00 -1.14 0.00 0.00 41.12 39.74 3eaj n ASP 176 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3eaj n LEU 177 N 0.00 4.38 -0.09 -2.12 7.99 -1.26 -1.87 117.00 124.02 3eaj n LEU 177 Ca 0.14 -2.21 0.01 0.00 -0.01 0.00 0.00 56.01 53.94 3eaj n LEU 177 Cb 0.54 -0.70 0.02 0.00 -0.11 0.00 0.00 43.42 43.17 3eaj n LEU 177 CO 0.38 0.75 0.37 -0.62 -1.51 0.00 0.00 177.39 176.76 3eaj n GLU 178 N 0.27 1.12 -1.08 3.23 1.02 -1.26 -5.00 120.64 118.95 3eaj n GLU 178 Ca 0.15 -1.18 -0.03 0.00 -0.02 0.00 0.00 57.16 56.09 3eaj n GLU 178 Cb 0.73 -0.79 -0.01 0.00 -0.02 0.00 0.00 31.44 31.35 3eaj n GLU 178 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3eaj n GLY 179 N -0.35 0.56 3.68 0.62 0.00 -0.78 -4.38 105.19 104.53 3eaj n GLY 179 Ca 0.02 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.35 3eaj n GLY 179 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3eaj s LYS 180 N -1.39 4.29 0.37 1.61 2.47 -1.26 -1.65 119.74 124.18 3eaj s LYS 180 Ca 0.00 0.81 -0.28 0.00 -1.56 0.00 0.00 55.97 54.95 3eaj s LYS 180 Cb 0.00 -3.55 -0.10 0.00 -1.46 0.00 0.00 37.83 32.72 3eaj s LYS 180 CO 0.00 -0.21 1.39 -0.06 0.16 0.00 0.00 175.35 176.63 3eaj s PHE 181 N 1.76 2.78 -0.35 4.03 0.40 -1.26 -1.24 117.98 124.10 3eaj s PHE 181 Ca 0.34 1.30 -0.27 0.00 -0.60 0.00 0.00 56.93 57.70 3eaj s PHE 181 Cb -0.16 -3.84 0.02 0.00 0.51 0.00 0.00 43.02 39.55 3eaj s PHE 181 CO 0.13 -2.44 1.00 0.71 0.70 0.00 0.00 175.22 175.32 3eaj s TYR 182 N -1.16 3.10 0.00 0.36 2.02 -0.76 -4.86 117.35 116.06 3eaj s TYR 182 Ca 0.53 0.97 0.00 0.00 -0.37 0.00 0.00 57.07 58.20 3eaj s TYR 182 Cb -0.43 -3.70 0.00 0.00 -0.40 0.00 0.00 41.96 37.44 3eaj s TYR 182 CO 0.57 -0.81 0.00 0.41 -1.57 0.00 0.00 175.55 174.15 3eaj n GLY 183 N 4.17 -3.09 0.00 0.71 0.00 -1.26 -4.59 105.19 101.13 3eaj n GLY 183 Ca 0.09 -2.12 0.12 0.00 0.00 0.00 0.00 46.02 44.12 3eaj n GLY 183 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3eaj n PRO 184 N -0.05 0.12 -1.58 1.61 -0.02 -1.26 -4.93 135.00 128.88 3eaj n PRO 184 Ca 0.00 0.07 -0.34 0.00 -2.02 0.00 0.00 63.50 61.21 3eaj n PRO 184 Cb 0.00 -1.50 0.07 0.00 -0.02 0.00 0.00 33.50 32.05 3eaj n PRO 184 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3eaj s PHE 185 N -2.85 2.30 0.17 6.00 0.08 -1.26 -5.07 117.98 117.35 3eaj s PHE 185 Ca 0.16 1.58 0.06 0.00 0.12 0.00 0.00 56.93 58.85 3eaj s PHE 185 Cb 0.16 -3.34 -0.05 0.00 -0.57 0.00 0.00 43.02 39.23 3eaj s PHE 185 CO 0.42 -2.20 -0.11 0.14 -0.10 0.00 0.00 175.22 173.37 3eaj s VAL 186 N -2.13 1.37 -1.34 -0.44 -7.23 -1.26 -4.83 120.40 104.54 3eaj s VAL 186 Ca 0.71 -2.11 -0.09 0.00 -1.81 0.00 0.00 61.98 58.68 3eaj s VAL 186 Cb -0.25 -1.95 0.12 0.00 0.56 0.00 0.00 36.38 34.85 3eaj s VAL 186 CO 0.43 -0.66 2.14 -0.90 -0.31 0.00 0.00 175.10 175.80 3eaj n ASP 187 N -0.28 5.96 -3.97 4.85 5.75 -1.26 -4.89 116.55 122.71 3eaj n ASP 187 Ca -0.09 -3.04 -0.16 0.00 -0.01 0.00 0.00 54.79 51.49 3eaj n ASP 187 Cb 0.61 -1.48 -0.14 0.00 -1.03 0.00 0.00 41.12 39.07 3eaj n ASP 187 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3eaj s ARG 188 N 0.52 0.49 -1.21 0.11 0.52 -1.26 -4.85 118.95 113.25 3eaj s ARG 188 Ca 0.47 -0.23 -0.20 0.00 -0.52 0.00 0.00 55.73 55.25 3eaj s ARG 188 Cb 0.13 -0.46 0.05 0.00 0.52 0.00 0.00 34.95 35.19 3eaj s ARG 188 CO -0.04 0.13 1.69 -0.65 0.02 0.00 0.00 175.30 176.45 3eaj s GLN 189 N -0.18 3.74 0.00 3.54 -1.52 -0.89 -4.85 119.66 119.51 3eaj s GLN 189 Ca 0.02 -1.68 0.00 0.00 -1.95 0.00 0.00 55.36 51.74 3eaj s GLN 189 Cb -0.03 -5.46 0.00 0.00 -0.22 0.00 0.00 33.01 27.30 3eaj s GLN 189 CO -0.00 -2.41 0.00 0.25 -0.25 0.00 0.00 175.29 172.88 3eaj n THR 190 N 6.66 0.00 1.02 -0.19 -2.24 -1.26 -4.59 114.28 113.68 3eaj n THR 190 Ca 0.45 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.36 3eaj n THR 190 Cb 0.47 0.00 0.41 0.00 -2.10 0.00 0.00 70.33 69.11 3eaj n THR 190 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3eaj n ALA 191 N -3.00 3.06 -1.44 6.98 0.00 -1.26 -4.97 120.51 119.88 3eaj n ALA 191 Ca 0.00 -0.25 -0.48 0.00 0.00 0.00 0.00 53.44 52.70 3eaj n ALA 191 Cb 0.00 -1.26 -0.03 0.00 0.00 0.00 0.00 19.45 18.16 3eaj n ALA 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3eaj n GLN 192 N -1.46 0.22 -4.18 0.00 10.64 -1.26 -4.99 117.38 116.34 3eaj n GLN 192 Ca 0.07 0.08 -0.14 0.00 -1.83 0.00 0.00 57.00 55.17 3eaj n GLN 192 Cb 0.33 -1.17 -0.11 0.00 -0.86 0.00 0.00 30.24 28.43 3eaj n GLN 192 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3eaj s ALA 193 N -0.92 1.15 0.31 2.61 0.00 -1.26 -4.62 121.76 119.04 3eaj s ALA 193 Ca 0.65 -1.23 -0.28 0.00 0.00 0.00 0.00 51.96 51.11 3eaj s ALA 193 Cb -0.92 0.03 -0.09 0.00 0.00 0.00 0.00 23.12 22.14 3eaj s ALA 193 CO 0.57 -0.05 1.04 0.00 0.00 0.00 0.00 175.76 177.32 3eaj s ALA 194 N -2.57 3.28 1.27 0.00 0.00 -1.26 -5.05 121.76 117.42 3eaj s ALA 194 Ca 0.07 0.75 -0.17 0.00 0.00 0.00 0.00 51.96 52.60 3eaj s ALA 194 Cb -0.02 -3.27 0.26 0.00 0.00 0.00 0.00 23.12 20.09 3eaj s ALA 194 CO -0.00 -0.08 0.80 0.41 0.00 0.00 0.00 175.76 176.89 3eaj n GLY 195 N 0.92 -3.14 3.74 0.00 0.00 -1.26 -4.98 105.19 100.46 3eaj n GLY 195 Ca 0.01 -1.41 -0.41 0.00 0.00 0.00 0.00 46.02 44.21 3eaj n GLY 195 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3eaj s THR 196 N -2.32 4.07 -0.68 2.61 -4.23 -1.26 -4.95 115.64 108.88 3eaj s THR 196 Ca 0.55 1.84 -0.17 0.00 -1.18 0.00 0.00 61.69 62.73 3eaj s THR 196 Cb -0.07 -4.17 0.15 0.00 1.34 0.00 0.00 72.50 69.75 3eaj s THR 196 CO 0.43 0.34 0.72 -0.62 -0.54 0.00 0.00 174.62 174.95 3eaj s ASP 197 N -0.33 6.40 0.44 3.99 3.68 -1.26 -4.55 116.67 125.04 3eaj s ASP 197 Ca 0.47 -1.96 -0.21 0.00 2.13 0.00 0.00 52.55 52.98 3eaj s ASP 197 Cb -0.27 -2.26 -0.10 0.00 -1.45 0.00 0.00 42.92 38.83 3eaj s ASP 197 CO 0.33 -0.89 0.96 0.42 0.13 0.00 0.00 175.17 176.13 3eaj s THR 198 N 1.67 4.32 0.12 1.71 -4.23 -1.26 -5.02 115.64 112.94 3eaj s THR 198 Ca 0.13 1.42 -0.30 0.00 -1.18 0.00 0.00 61.69 61.77 3eaj s THR 198 Cb -0.20 -3.59 -0.07 0.00 1.34 0.00 0.00 72.50 69.99 3eaj s THR 198 CO -0.01 -0.33 1.16 -0.89 -0.54 0.00 0.00 174.62 174.01 3eaj s THR 199 N -2.18 3.91 -0.98 3.99 2.01 -0.31 -4.56 115.64 117.53 3eaj s THR 199 Ca 0.63 1.50 -0.24 0.00 0.31 0.00 0.00 61.69 63.89 3eaj s THR 199 Cb -0.10 -3.96 -0.02 0.00 0.01 0.00 0.00 72.50 68.43 3eaj s THR 199 CO 0.15 0.19 1.80 -0.63 -0.69 0.00 0.00 174.62 175.44 3eaj s ILE 200 N 0.42 3.62 0.20 1.82 1.01 -1.26 -1.64 121.20 125.36 3eaj s ILE 200 Ca 0.54 -0.60 -0.17 0.00 0.00 0.00 0.00 60.65 60.42 3eaj s ILE 200 Cb -0.30 -4.40 0.19 0.00 0.01 0.00 0.00 42.46 37.96 3eaj s ILE 200 CO 0.32 -1.27 1.60 0.74 0.00 0.00 0.00 174.94 176.34 3eaj h THR 201 N 6.95 0.25 -0.59 2.92 2.02 -1.91 -0.45 112.91 122.10 3eaj h THR 201 Ca 0.15 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.40 3eaj h THR 201 Cb 0.99 0.25 -0.04 0.00 -1.74 0.00 0.00 68.15 67.62 3eaj h THR 201 CO 1.28 0.00 0.39 0.25 0.37 0.00 0.00 175.52 177.81 3eaj h LEU 202 N -0.09 0.47 -0.37 2.58 5.85 -1.89 -1.71 115.31 120.16 3eaj h LEU 202 Ca 0.28 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.81 3eaj h LEU 202 Cb 0.52 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 3eaj h LEU 202 CO -0.68 0.30 -0.81 0.78 -0.34 0.00 0.00 178.44 177.69 3eaj h ASN 203 N 0.54 0.26 0.38 1.25 4.21 -1.35 -2.51 115.58 118.36 3eaj h ASN 203 Ca 0.26 -0.19 -0.09 0.00 1.21 0.00 0.00 56.30 57.48 3eaj h ASN 203 Cb 0.33 -0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 37.44 3eaj h ASN 203 CO -0.08 0.96 -0.42 0.58 -1.29 0.00 0.00 177.43 177.19 3eaj h VAL 204 N 0.12 1.30 0.02 2.81 2.07 -0.60 -2.44 116.25 119.55 3eaj h VAL 204 Ca -0.03 -1.46 -0.22 0.00 0.82 0.00 0.00 66.70 65.81 3eaj h VAL 204 Cb 1.41 1.76 0.02 0.00 -1.52 0.00 0.00 31.29 32.96 3eaj h VAL 204 CO 0.12 0.42 -0.88 -0.07 0.02 0.00 0.00 177.57 177.18 3eaj h LEU 205 N 0.04 0.73 -0.92 2.57 3.38 -1.40 -2.53 115.31 117.19 3eaj h LEU 205 Ca 0.00 -0.77 0.10 0.00 0.09 0.00 0.00 57.88 57.30 3eaj h LEU 205 Cb 0.76 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 41.21 3eaj h LEU 205 CO 0.06 1.41 0.56 0.00 0.09 0.00 0.00 178.44 180.56 3eaj h ALA 206 N 0.33 1.33 -0.28 1.53 0.00 -1.33 0.42 119.26 121.26 3eaj h ALA 206 Ca -0.12 0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.64 3eaj h ALA 206 Cb 1.57 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 3eaj h ALA 206 CO 0.17 0.20 -0.51 2.35 0.00 0.00 0.00 179.25 181.47 3eaj h TRP 207 N 0.93 0.98 -0.79 0.00 7.01 -1.45 -0.20 115.95 122.42 3eaj h TRP 207 Ca 0.44 -0.33 0.02 0.00 2.11 0.00 0.00 58.89 61.13 3eaj h TRP 207 Cb 0.38 -0.19 -0.04 0.00 -2.10 0.00 0.00 29.16 27.20 3eaj h TRP 207 CO -0.03 1.13 0.51 -0.07 -2.79 0.00 0.00 178.44 177.19 3eaj h LEU 208 N 0.62 0.86 -1.19 0.65 3.38 -0.88 0.11 115.31 118.85 3eaj h LEU 208 Ca 0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 3eaj h LEU 208 Cb 1.09 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 3eaj h LEU 208 CO 0.11 0.60 0.30 1.88 0.09 0.00 0.00 178.44 181.42 3eaj h TYR 209 N 1.01 0.85 -0.63 1.13 0.05 -0.51 -0.57 116.97 118.30 3eaj h TYR 209 Ca 0.31 -0.02 -0.03 0.00 0.05 0.00 0.00 58.73 59.03 3eaj h TYR 209 Cb -0.04 -0.27 -0.03 0.00 1.01 0.00 0.00 36.73 37.41 3eaj h TYR 209 CO -0.03 0.62 0.26 0.00 -1.05 0.00 0.00 178.16 177.96 3eaj h ALA 210 N 1.47 0.82 -0.29 3.88 0.00 0.12 -1.65 119.26 123.61 3eaj h ALA 210 Ca 0.21 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3eaj h ALA 210 Cb 0.08 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3eaj h ALA 210 CO -0.03 0.43 0.09 0.00 0.00 0.00 0.00 179.25 179.74 3eaj h ALA 211 N 1.10 0.38 -0.28 0.00 0.00 0.00 -1.98 119.26 118.49 3eaj h ALA 211 Ca 0.21 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.01 3eaj h ALA 211 Cb 0.19 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3eaj h ALA 211 CO -0.02 0.01 0.06 0.28 0.00 0.00 0.00 179.25 179.58 3eaj h VAL 212 N 0.31 0.87 -0.10 0.00 2.07 -1.05 0.36 116.25 118.71 3eaj h VAL 212 Ca 0.09 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.59 3eaj h VAL 212 Cb 0.25 0.69 -0.00 0.00 -1.52 0.00 0.00 31.29 30.71 3eaj h VAL 212 CO -0.00 0.03 0.14 0.40 0.02 0.00 0.00 177.57 178.15 3eaj h ILE 213 N 0.16 0.39 -0.78 4.57 2.04 -1.06 -1.19 117.51 121.64 3eaj h ILE 213 Ca 0.13 0.00 -0.36 0.00 1.00 0.00 0.00 64.86 65.63 3eaj h ILE 213 Cb 0.13 0.89 -0.22 0.00 -0.74 0.00 0.00 36.82 36.88 3eaj h ILE 213 CO -0.17 0.00 0.39 0.59 0.00 0.00 0.00 178.15 178.96 3eaj n ASN 214 N -3.66 3.70 0.00 1.72 3.02 -0.02 -4.93 115.26 115.09 3eaj n ASN 214 Ca -0.00 -3.55 0.00 0.00 -0.03 0.00 0.00 54.58 51.00 3eaj n ASN 214 Cb 0.24 -0.77 0.00 0.00 -0.61 0.00 0.00 39.78 38.64 3eaj n ASN 214 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3eaj n GLY 215 N -0.91 2.50 3.56 7.41 0.00 -0.45 -4.93 105.19 112.37 3eaj n GLY 215 Ca 0.49 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.11 3eaj n GLY 215 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3eaj s ASP 216 N -2.40 6.31 -0.05 1.61 2.15 -0.40 -4.73 116.67 119.16 3eaj s ASP 216 Ca 0.00 -1.11 0.11 0.00 0.43 0.00 0.00 52.55 51.98 3eaj s ASP 216 Cb 0.00 -2.57 0.20 0.00 -0.30 0.00 0.00 42.92 40.25 3eaj s ASP 216 CO 0.00 -1.68 1.09 -2.11 -0.17 0.00 0.00 175.17 172.30 3eaj n ARG 217 N 9.02 0.47 0.06 4.34 1.85 -1.26 -3.06 116.66 128.08 3eaj n ARG 217 Ca 0.25 -1.81 0.08 0.00 -1.00 0.00 0.00 57.85 55.37 3eaj n ARG 217 Cb 0.50 -0.75 0.34 0.00 -1.05 0.00 0.00 32.46 31.51 3eaj n ARG 217 CO 0.00 0.00 0.00 -2.67 -0.01 0.00 0.00 177.63 174.95 3eaj n TRP 218 N -0.35 0.34 0.93 2.89 4.27 -1.26 -2.96 117.44 121.30 3eaj n TRP 218 Ca 0.07 0.14 0.11 0.00 -3.89 0.00 0.00 57.50 53.94 3eaj n TRP 218 Cb 0.78 -0.73 0.13 0.00 -1.36 0.00 0.00 31.31 30.13 3eaj n TRP 218 CO 0.00 0.00 0.00 1.97 -2.29 0.00 0.00 177.69 177.37 3eaj n PHE 219 N -1.82 0.05 -1.11 -2.67 1.16 -1.26 -4.95 117.46 106.87 3eaj n PHE 219 Ca 0.02 0.02 -0.31 0.00 -1.87 0.00 0.00 57.45 55.31 3eaj n PHE 219 Cb 0.14 -0.23 0.12 0.00 -1.61 0.00 0.00 39.48 37.90 3eaj n PHE 219 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3eaj s LEU 220 N -3.16 2.80 0.20 5.98 1.43 -1.15 -4.74 118.68 120.03 3eaj s LEU 220 Ca 0.09 1.84 -0.15 0.00 -1.03 0.00 0.00 54.13 54.89 3eaj s LEU 220 Cb 0.17 -4.40 0.01 0.00 0.03 0.00 0.00 46.19 42.00 3eaj s LEU 220 CO 0.75 -2.43 0.45 0.54 0.23 0.00 0.00 176.35 175.90 3eaj s ASN 221 N -3.22 -0.15 0.48 2.29 2.20 -1.26 -5.04 114.94 110.24 3eaj s ASN 221 Ca 0.63 -0.66 0.28 0.00 -0.94 0.00 0.00 52.86 52.17 3eaj s ASN 221 Cb -0.19 0.54 0.85 0.00 -2.00 0.00 0.00 41.25 40.46 3eaj s ASN 221 CO 0.57 -1.03 1.79 0.08 -2.94 0.00 0.00 177.10 175.57 3eaj h ARG 222 N 2.30 0.00 -7.28 3.55 0.11 -1.98 -3.46 114.38 107.62 3eaj h ARG 222 Ca -0.29 0.00 -0.48 0.00 0.10 0.00 0.00 59.98 59.31 3eaj h ARG 222 Cb 1.25 0.00 0.17 0.00 1.11 0.00 0.00 29.97 32.50 3eaj h ARG 222 CO 0.40 0.05 0.20 -0.06 0.10 0.00 0.00 179.97 180.65 3eaj s PHE 223 N -3.45 2.00 0.26 4.08 0.08 -1.26 -5.08 117.98 114.61 3eaj s PHE 223 Ca 0.04 1.36 0.03 0.00 0.12 0.00 0.00 56.93 58.48 3eaj s PHE 223 Cb 0.07 -3.18 -0.03 0.00 -0.57 0.00 0.00 43.02 39.31 3eaj s PHE 223 CO 0.61 -2.75 0.21 -0.08 -0.10 0.00 0.00 175.22 173.11 3eaj s THR 224 N -2.78 0.00 -0.03 0.64 -1.32 -1.26 -4.68 115.64 106.20 3eaj s THR 224 Ca 0.65 -1.99 -0.15 0.00 -1.21 0.00 0.00 61.69 58.99 3eaj s THR 224 Cb -0.20 -2.50 0.02 0.00 -1.51 0.00 0.00 72.50 68.31 3eaj s THR 224 CO 0.59 0.00 0.32 0.28 -2.21 0.00 0.00 174.62 173.59 3eaj s THR 225 N -3.80 0.05 0.54 5.08 -1.32 -1.20 -4.90 115.64 110.08 3eaj s THR 225 Ca 0.40 -0.41 -0.19 0.00 -1.21 0.00 0.00 61.69 60.28 3eaj s THR 225 Cb 0.05 -0.60 -0.06 0.00 -1.51 0.00 0.00 72.50 70.38 3eaj s THR 225 CO 0.20 -0.22 1.07 0.42 -2.21 0.00 0.00 174.62 173.88 3eaj s THR 226 N -1.12 3.57 0.27 5.08 -4.23 -1.26 -4.82 115.64 113.13 3eaj s THR 226 Ca -0.12 0.91 0.00 0.00 -1.18 0.00 0.00 61.69 61.31 3eaj s THR 226 Cb -0.05 -3.36 0.26 0.00 1.34 0.00 0.00 72.50 70.69 3eaj s THR 226 CO 0.04 -0.28 1.72 0.25 -0.54 0.00 0.00 174.62 175.81 3eaj h LEU 227 N 1.11 0.37 0.62 4.79 5.85 -1.98 -2.57 115.31 123.51 3eaj h LEU 227 Ca -0.49 0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.33 3eaj h LEU 227 Cb 1.23 0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.36 3eaj h LEU 227 CO 0.58 0.09 -0.32 0.78 -0.34 0.00 0.00 178.44 179.23 3eaj h ASN 228 N 0.48 -0.77 -1.14 1.25 2.35 -1.94 -2.58 115.58 113.23 3eaj h ASN 228 Ca 0.50 0.03 0.33 0.00 -0.55 0.00 0.00 56.30 56.61 3eaj h ASN 228 Cb 0.83 0.21 -0.05 0.00 0.05 0.00 0.00 38.32 39.36 3eaj h ASN 228 CO -0.45 -0.52 0.81 0.44 -1.65 0.00 0.00 177.43 176.06 3eaj h ASP 229 N -0.86 0.04 0.21 5.81 3.32 -1.89 -0.75 116.42 122.30 3eaj h ASP 229 Ca -0.08 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 56.96 3eaj h ASP 229 Cb 0.66 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.22 3eaj h ASP 229 CO 0.12 0.01 -0.10 0.15 -1.72 0.00 0.00 179.24 177.70 3eaj h PHE 230 N 0.03 -0.27 -0.89 4.55 3.57 -1.32 -3.10 116.94 119.51 3eaj h PHE 230 Ca 0.55 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 62.14 3eaj h PHE 230 Cb 2.14 0.09 -0.06 0.00 2.79 0.00 0.00 35.95 40.90 3eaj h PHE 230 CO -0.00 0.13 0.57 -0.91 -2.23 0.00 0.00 178.31 175.87 3eaj h ASN 231 N -0.83 0.80 -0.58 0.41 2.35 -0.77 0.17 115.58 117.13 3eaj h ASN 231 Ca -0.03 0.02 0.09 0.00 -0.55 0.00 0.00 56.30 55.83 3eaj h ASN 231 Cb 0.51 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.70 3eaj h ASN 231 CO 0.05 0.47 0.39 -0.07 -1.65 0.00 0.00 177.43 176.62 3eaj h LEU 232 N 0.89 0.37 0.01 1.61 3.38 -1.35 0.60 115.31 120.82 3eaj h LEU 232 Ca 0.41 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.39 3eaj h LEU 232 Cb 0.40 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3eaj h LEU 232 CO -0.18 0.23 -0.01 0.58 0.09 0.00 0.00 178.44 179.15 3eaj h VAL 233 N 0.41 0.37 -0.85 1.22 2.07 -0.74 -3.32 116.25 115.41 3eaj h VAL 233 Ca 0.26 -1.26 0.14 0.00 0.82 0.00 0.00 66.70 66.67 3eaj h VAL 233 Cb 0.50 0.69 -0.14 0.00 -1.52 0.00 0.00 31.29 30.82 3eaj h VAL 233 CO -0.07 0.12 -0.31 0.00 0.02 0.00 0.00 177.57 177.34 3eaj n ALA 234 N -2.74 -0.04 -0.14 1.67 0.00 0.33 -0.91 120.51 118.68 3eaj n ALA 234 Ca -0.02 0.86 0.02 0.00 0.00 0.00 0.00 53.44 54.29 3eaj n ALA 234 Cb 0.10 -0.41 0.30 0.00 0.00 0.00 0.00 19.45 19.44 3eaj n ALA 234 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 3eaj h MET 235 N 0.00 0.83 -0.45 0.00 2.07 -1.03 0.30 114.93 116.65 3eaj h MET 235 Ca 0.32 -0.05 0.12 0.00 -2.07 0.00 0.00 59.70 58.01 3eaj h MET 235 Cb 0.53 -0.19 -0.02 0.00 -1.87 0.00 0.00 31.60 30.05 3eaj h MET 235 CO -0.85 0.56 0.32 0.87 1.07 0.00 0.00 176.91 178.88 3eaj h LYS 236 N 0.85 0.06 -0.44 1.72 1.79 -1.12 -2.78 116.57 116.66 3eaj h LYS 236 Ca 0.23 -0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.65 3eaj h LYS 236 Cb -0.09 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.52 3eaj h LYS 236 CO -0.05 0.04 0.04 0.66 -1.08 0.00 0.00 179.45 179.06 3eaj n TYR 237 N -4.42 1.54 -3.47 -1.35 4.01 0.99 -4.93 117.16 109.53 3eaj n TYR 237 Ca 0.07 -0.93 -0.20 0.00 -0.16 0.00 0.00 57.90 56.68 3eaj n TYR 237 Cb 0.47 -0.45 0.08 0.00 -0.31 0.00 0.00 39.34 39.14 3eaj n TYR 237 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3eaj n ASN 238 N -0.15 -4.81 -4.65 7.72 5.15 -1.05 -4.85 115.26 112.62 3eaj n ASN 238 Ca 0.27 -0.53 -0.32 0.00 -0.60 0.00 0.00 54.58 53.41 3eaj n ASN 238 Cb 1.08 -4.77 -0.09 0.00 -0.53 0.00 0.00 39.78 35.46 3eaj n ASN 238 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 3eaj s TYR 239 N -3.31 2.98 0.31 1.20 1.51 -0.91 -1.16 117.35 117.97 3eaj s TYR 239 Ca 0.37 0.00 -0.29 0.00 -1.01 0.00 0.00 57.07 56.15 3eaj s TYR 239 Cb -0.16 -1.61 -0.10 0.00 -0.11 0.00 0.00 41.96 39.98 3eaj s TYR 239 CO 0.68 0.44 1.42 -2.00 -1.11 0.00 0.00 175.55 174.98 3eaj s GLU 240 N -1.73 4.25 0.99 -0.62 2.12 -0.65 -4.27 118.70 118.78 3eaj s GLU 240 Ca 0.20 2.36 -0.12 0.00 0.36 0.00 0.00 54.97 57.77 3eaj s GLU 240 Cb -0.11 -3.06 0.14 0.00 0.26 0.00 0.00 34.13 31.35 3eaj s GLU 240 CO 0.12 -0.39 0.79 -2.30 -0.54 0.00 0.00 175.26 172.94 3eaj n PRO 241 N 1.43 -0.87 -4.55 4.30 -0.02 -1.26 -4.53 135.00 129.49 3eaj n PRO 241 Ca 0.03 -0.21 -0.33 0.00 -2.02 0.00 0.00 63.50 60.98 3eaj n PRO 241 Cb 0.40 -2.12 -0.15 0.00 -0.02 0.00 0.00 33.50 31.61 3eaj n PRO 241 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3eaj s LEU 242 N -4.56 2.54 0.17 2.45 2.96 -1.26 -4.90 118.68 116.08 3eaj s LEU 242 Ca 0.63 -0.44 0.03 0.00 -0.22 0.00 0.00 54.13 54.14 3eaj s LEU 242 Cb -0.22 -1.58 -0.03 0.00 0.50 0.00 0.00 46.19 44.86 3eaj s LEU 242 CO 0.63 0.10 0.27 0.42 -1.32 0.00 0.00 176.35 176.44 3eaj s THR 243 N 0.75 5.14 -0.57 3.68 -4.23 -1.26 -4.96 115.64 114.20 3eaj s THR 243 Ca -0.06 -0.82 0.09 0.00 -1.18 0.00 0.00 61.69 59.71 3eaj s THR 243 Cb -0.15 -3.67 0.09 0.00 1.34 0.00 0.00 72.50 70.10 3eaj s THR 243 CO 0.01 -0.14 1.22 1.67 -0.54 0.00 0.00 174.62 176.85 3eaj n GLN 244 N -0.66 0.06 -0.09 3.99 -0.06 -1.26 -1.70 117.38 117.66 3eaj n GLN 244 Ca -0.08 0.53 -0.17 0.00 -2.00 0.00 0.00 57.00 55.28 3eaj n GLN 244 Cb 0.55 -1.75 -0.12 0.00 -4.06 0.00 0.00 30.24 24.86 3eaj n GLN 244 CO 0.00 0.00 0.00 0.22 -0.20 0.00 0.00 177.06 177.08 3eaj h ASP 245 N 0.00 0.00 -0.52 1.69 3.58 -1.99 -2.38 116.42 116.80 3eaj h ASP 245 Ca 0.00 -0.73 0.10 0.00 0.42 0.00 0.00 57.03 56.83 3eaj h ASP 245 Cb 0.12 0.00 -0.09 0.00 1.72 0.00 0.00 39.33 41.08 3eaj h ASP 245 CO 0.00 1.21 -0.02 0.45 -2.88 0.00 0.00 179.24 178.00 3eaj h HIS 246 N -1.00 -0.07 -0.80 0.28 3.86 -1.72 -0.84 115.15 114.86 3eaj h HIS 246 Ca -0.16 0.04 0.12 0.00 -1.16 0.00 0.00 60.37 59.21 3eaj h HIS 246 Cb 1.10 0.11 -0.09 0.00 1.06 0.00 0.00 27.41 29.60 3eaj h HIS 246 CO 0.18 -0.14 0.41 0.28 0.86 0.00 0.00 177.93 179.52 3eaj h VAL 247 N 0.10 0.78 -0.60 2.45 2.07 -1.50 -1.37 116.25 118.17 3eaj h VAL 247 Ca 0.26 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 3eaj h VAL 247 Cb 0.40 0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.24 3eaj h VAL 247 CO -0.45 0.12 0.34 0.44 0.02 0.00 0.00 177.57 178.03 3eaj h ASP 248 N 0.63 0.74 -0.84 0.57 3.32 -0.64 -2.51 116.42 117.70 3eaj h ASP 248 Ca 0.42 -0.09 0.11 0.00 0.02 0.00 0.00 57.03 57.49 3eaj h ASP 248 Cb 0.53 -0.19 -0.08 0.00 0.22 0.00 0.00 39.33 39.81 3eaj h ASP 248 CO -0.32 0.61 0.47 0.40 -1.72 0.00 0.00 179.24 178.68 3eaj h ILE 249 N 0.81 0.86 0.00 0.35 1.08 -0.32 -0.19 117.51 120.10 3eaj h ILE 249 Ca 0.21 -0.26 0.00 0.00 -0.39 0.00 0.00 64.86 64.42 3eaj h ILE 249 Cb 0.03 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 33.82 3eaj h ILE 249 CO -0.04 0.14 0.00 0.18 -0.69 0.00 0.00 178.15 177.74 3eaj n LEU 250 N -4.77 0.00 0.05 1.44 4.77 -0.91 -4.17 117.00 113.40 3eaj n LEU 250 Ca 0.15 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 56.09 3eaj n LEU 250 Cb 0.33 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.40 3eaj n LEU 250 CO 0.25 0.00 0.50 1.23 -1.33 0.00 0.00 177.39 178.05 3eaj h GLY 251 N 3.19 -0.96 0.13 -0.72 0.00 -1.01 -1.52 103.07 102.18 3eaj h GLY 251 Ca 0.00 0.43 0.22 0.00 0.00 0.00 0.00 47.33 47.98 3eaj h GLY 251 CO 0.00 -0.34 0.63 -2.55 0.00 0.00 0.00 176.54 174.28 3eaj h PRO 252 N -0.18 0.45 -0.06 4.80 0.11 -1.81 0.33 132.00 135.64 3eaj h PRO 252 Ca -0.01 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 65.93 3eaj h PRO 252 Cb 0.17 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.16 3eaj h PRO 252 CO -0.03 0.30 -0.60 -0.07 -0.21 0.00 0.00 178.00 177.39 3eaj h LEU 253 N 0.46 0.22 -0.38 2.35 3.38 -1.82 -0.09 115.31 119.43 3eaj h LEU 253 Ca 0.53 -0.13 -0.13 0.00 0.09 0.00 0.00 57.88 58.24 3eaj h LEU 253 Cb 1.24 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 3eaj h LEU 253 CO -0.24 0.77 -0.28 0.77 0.09 0.00 0.00 178.44 179.55 3eaj h SER 254 N 0.15 0.91 0.12 -0.43 4.64 0.62 -2.86 113.55 116.70 3eaj h SER 254 Ca -0.01 -0.44 -0.10 0.00 -0.47 0.00 0.00 61.79 60.78 3eaj h SER 254 Cb 1.09 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.92 3eaj h SER 254 CO 0.09 1.15 -0.33 0.00 -0.87 0.00 0.00 176.83 176.87 3eaj h ALA 255 N 0.79 1.15 0.00 5.18 0.00 -0.69 0.74 119.26 126.42 3eaj h ALA 255 Ca 0.07 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 3eaj h ALA 255 Cb 0.85 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3eaj h ALA 255 CO 0.07 0.55 -0.14 0.37 0.00 0.00 0.00 179.25 180.11 3eaj h GLN 256 N 0.27 0.00 -0.00 0.00 4.15 -0.93 -3.29 115.11 115.31 3eaj h GLN 256 Ca 0.03 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.45 3eaj h GLN 256 Cb 0.73 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.42 3eaj h GLN 256 CO 0.06 0.14 -0.10 0.25 -1.93 0.00 0.00 178.83 177.25 3eaj n THR 257 N -3.19 0.00 -1.86 2.39 -2.24 -1.09 -4.98 114.28 103.31 3eaj n THR 257 Ca 0.02 -0.45 -0.21 0.00 -2.27 0.00 0.00 64.05 61.14 3eaj n THR 257 Cb 0.49 1.05 -0.06 0.00 -2.10 0.00 0.00 70.33 69.70 3eaj n THR 257 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3eaj n GLY 258 N 0.68 1.19 3.41 3.38 0.00 0.22 -4.97 105.19 109.10 3eaj n GLY 258 Ca 0.02 -0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 3eaj n GLY 258 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3eaj s ILE 259 N -2.87 3.74 0.21 -0.61 1.01 -0.98 -5.04 121.20 116.67 3eaj s ILE 259 Ca 0.00 -0.38 -0.30 0.00 0.00 0.00 0.00 60.65 59.97 3eaj s ILE 259 Cb 0.00 -2.69 -0.08 0.00 0.01 0.00 0.00 42.46 39.70 3eaj s ILE 259 CO 0.00 0.43 1.19 0.00 0.00 0.00 0.00 174.94 176.56 3eaj s ALA 260 N 1.07 3.44 0.41 9.38 0.00 -1.26 -4.31 121.76 130.49 3eaj s ALA 260 Ca 0.02 0.97 0.14 0.00 0.00 0.00 0.00 51.96 53.09 3eaj s ALA 260 Cb -0.14 -3.41 0.99 0.00 0.00 0.00 0.00 23.12 20.56 3eaj s ALA 260 CO 0.01 -0.36 1.90 -0.39 0.00 0.00 0.00 175.76 176.92 3eaj h VAL 261 N 3.59 0.80 0.00 0.00 -1.51 -1.93 0.19 116.25 117.38 3eaj h VAL 261 Ca -0.45 -0.17 -0.09 0.00 -1.23 0.00 0.00 66.70 64.76 3eaj h VAL 261 Cb 1.21 0.27 -0.01 0.00 -2.13 0.00 0.00 31.29 30.63 3eaj h VAL 261 CO 0.73 0.09 -0.42 -0.07 -1.23 0.00 0.00 177.57 176.66 3eaj h LEU 262 N 0.49 0.00 -0.21 4.19 3.38 -1.91 -0.02 115.31 121.22 3eaj h LEU 262 Ca 0.40 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.27 3eaj h LEU 262 Cb 0.83 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 3eaj h LEU 262 CO -0.14 0.42 -0.25 0.44 0.09 0.00 0.00 178.44 179.00 3eaj h ASP 263 N 0.00 0.59 -0.75 -0.43 3.32 -1.00 -2.58 116.42 115.57 3eaj h ASP 263 Ca -0.00 -0.49 -0.02 0.00 0.02 0.00 0.00 57.03 56.53 3eaj h ASP 263 Cb 1.02 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 40.37 3eaj h ASP 263 CO 0.06 0.96 0.39 -0.03 -1.72 0.00 0.00 179.24 178.90 3eaj h MET 264 N 0.23 1.07 -0.47 3.56 4.05 -0.71 -1.04 114.93 121.62 3eaj h MET 264 Ca 0.03 -0.13 0.02 0.00 -0.28 0.00 0.00 59.70 59.34 3eaj h MET 264 Cb 0.81 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 31.38 3eaj h MET 264 CO 0.06 0.80 0.28 0.00 0.23 0.00 0.00 176.91 178.28 3eaj h ALA 266 N 1.21 1.12 -0.04 0.00 0.00 -0.99 0.39 119.26 120.93 3eaj h ALA 266 Ca 0.19 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.16 3eaj h ALA 266 Cb 0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3eaj h ALA 266 CO -0.08 0.02 -0.07 0.00 0.00 0.00 0.00 179.25 179.11 3eaj h ALA 267 N 1.46 -0.04 -0.82 0.00 0.00 -0.17 -2.08 119.26 117.61 3eaj h ALA 267 Ca 0.39 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.35 3eaj h ALA 267 Cb 0.41 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 3eaj h ALA 267 CO -0.27 -0.55 0.53 1.25 0.00 0.00 0.00 179.25 180.21 3eaj h LEU 268 N -0.11 0.89 -0.69 0.00 5.85 -0.04 -2.15 115.31 119.06 3eaj h LEU 268 Ca 0.05 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.79 3eaj h LEU 268 Cb 0.17 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.95 3eaj h LEU 268 CO -0.11 0.63 0.43 0.50 -0.34 0.00 0.00 178.44 179.54 3eaj h LYS 269 N 1.05 0.81 -0.46 1.25 3.64 0.11 0.18 116.57 123.15 3eaj h LYS 269 Ca 0.32 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.64 3eaj h LYS 269 Cb -0.03 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.58 3eaj h LYS 269 CO -0.10 0.53 0.23 0.93 -2.27 0.00 0.00 179.45 178.77 3eaj h GLU 270 N 0.83 0.65 -0.83 1.90 5.08 -1.05 -0.17 114.58 121.00 3eaj h GLU 270 Ca 0.28 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 3eaj h GLU 270 Cb 0.05 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.14 3eaj h GLU 270 CO -0.12 0.55 0.50 -0.07 -1.00 0.00 0.00 179.01 178.87 3eaj h LEU 271 N 0.59 0.99 -0.54 1.33 3.38 -0.78 0.78 115.31 121.08 3eaj h LEU 271 Ca 0.16 -0.06 -0.15 0.00 0.09 0.00 0.00 57.88 57.92 3eaj h LEU 271 Cb 0.11 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3eaj h LEU 271 CO -0.02 0.76 -0.44 -0.07 0.09 0.00 0.00 178.44 178.77 3eaj h LEU 272 N 1.14 0.74 0.00 1.67 3.38 -0.32 -1.22 115.31 120.70 3eaj h LEU 272 Ca 0.30 -0.35 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 3eaj h LEU 272 Cb -0.04 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 3eaj h LEU 272 CO -0.06 1.08 -0.51 1.56 0.09 0.00 0.00 178.44 180.61 3eaj h GLN 273 N 0.56 0.00 -0.00 1.13 4.20 -0.76 -3.38 115.11 116.86 3eaj h GLN 273 Ca 0.04 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.75 3eaj h GLN 273 Cb 0.98 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.76 3eaj h GLN 273 CO 0.09 0.90 -0.08 0.09 -0.67 0.00 0.00 178.83 179.16 3eaj n ASN 274 N -4.55 0.09 -0.47 1.46 3.02 0.27 -5.04 115.26 110.04 3eaj n ASN 274 Ca -0.18 0.29 0.06 0.00 -0.03 0.00 0.00 54.58 54.73 3eaj n ASN 274 Cb 0.52 -0.35 -0.02 0.00 -0.61 0.00 0.00 39.78 39.32 3eaj n ASN 274 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3eaj n GLY 275 N 1.47 -1.81 0.04 7.41 0.00 -0.46 -4.52 105.19 107.32 3eaj n GLY 275 Ca 0.08 -1.39 0.12 0.00 0.00 0.00 0.00 46.02 44.82 3eaj n GLY 275 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3eaj n MET 276 N -2.56 0.20 -3.72 1.61 1.56 -1.26 -4.63 117.12 108.31 3eaj n MET 276 Ca -0.00 0.05 -0.27 0.00 -0.27 0.00 0.00 57.70 57.21 3eaj n MET 276 Cb 0.22 -1.62 0.03 0.00 2.15 0.00 0.00 33.22 33.99 3eaj n MET 276 CO 0.00 0.00 0.00 -1.71 -0.73 0.00 0.00 175.97 173.53 3eaj n ASN 277 N -1.90 -3.26 0.00 6.12 5.15 -1.26 -2.89 115.26 117.22 3eaj n ASN 277 Ca 0.04 -0.95 0.00 0.00 -0.60 0.00 0.00 54.58 53.07 3eaj n ASN 277 Cb 0.40 -3.57 0.00 0.00 -0.53 0.00 0.00 39.78 36.09 3eaj n ASN 277 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3eaj n GLY 278 N -1.70 1.68 3.35 8.20 0.00 -1.26 -4.98 105.19 110.49 3eaj n GLY 278 Ca -0.19 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 3eaj n GLY 278 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3eaj n ARG 279 N 0.00 -0.30 -5.12 1.61 1.74 -1.14 -4.94 116.66 108.51 3eaj n ARG 279 Ca 0.00 -0.05 -0.30 0.00 -0.77 0.00 0.00 57.85 56.72 3eaj n ARG 279 Cb 0.00 -1.73 -0.15 0.00 -1.02 0.00 0.00 32.46 29.55 3eaj n ARG 279 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3eaj s THR 280 N -2.34 2.07 -0.17 0.55 -4.23 -1.26 -4.73 115.64 105.53 3eaj s THR 280 Ca 0.54 -1.22 -0.04 0.00 -1.18 0.00 0.00 61.69 59.79 3eaj s THR 280 Cb -0.20 -1.74 -0.03 0.00 1.34 0.00 0.00 72.50 71.87 3eaj s THR 280 CO 0.69 0.48 -0.03 -0.63 -0.54 0.00 0.00 174.62 174.60 3eaj s ILE 281 N -0.69 3.90 -0.15 2.99 1.01 -0.73 -4.43 121.20 123.09 3eaj s ILE 281 Ca 0.11 -0.35 0.00 0.00 0.00 0.00 0.00 60.65 60.41 3eaj s ILE 281 Cb -0.10 -2.73 0.00 0.00 0.01 0.00 0.00 42.46 39.64 3eaj s ILE 281 CO 0.00 0.47 0.00 0.18 0.00 0.00 0.00 174.94 175.59 3eaj n LEU 282 N 3.78 -0.14 0.00 2.97 4.77 -1.26 0.22 117.00 127.33 3eaj n LEU 282 Ca -0.17 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 3eaj n LEU 282 Cb 0.52 -1.03 0.00 0.00 -2.33 0.00 0.00 43.42 40.58 3eaj n LEU 282 CO 0.32 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.96 3eaj n GLY 283 N -0.41 0.67 3.34 -0.72 0.00 -1.26 -5.06 105.19 101.74 3eaj n GLY 283 Ca -0.02 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.14 3eaj n GLY 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3eaj s ALA 284 N -2.00 2.40 -2.00 4.61 0.00 0.13 -4.97 121.76 119.94 3eaj s ALA 284 Ca 0.00 -0.98 0.19 0.00 0.00 0.00 0.00 51.96 51.17 3eaj s ALA 284 Cb 0.00 -0.90 1.14 0.00 0.00 0.00 0.00 23.12 23.36 3eaj s ALA 284 CO 0.00 0.39 1.64 0.00 0.00 0.00 0.00 175.76 177.79 3eaj n ALA 285 N 3.03 2.48 -2.89 0.00 0.00 -1.26 -1.78 120.51 120.09 3eaj n ALA 285 Ca -0.18 -0.12 -0.10 0.00 0.00 0.00 0.00 53.44 53.05 3eaj n ALA 285 Cb 0.52 -1.31 -0.06 0.00 0.00 0.00 0.00 19.45 18.61 3eaj n ALA 285 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3eaj s ALA 286 N -2.00 -0.53 -0.17 0.00 0.00 -1.26 -4.94 121.76 112.86 3eaj s ALA 286 Ca 0.29 -0.43 -0.29 0.00 0.00 0.00 0.00 51.96 51.52 3eaj s ALA 286 Cb 0.13 0.73 -0.00 0.00 0.00 0.00 0.00 23.12 23.97 3eaj s ALA 286 CO 0.22 -0.65 1.09 -0.51 0.00 0.00 0.00 175.76 175.91 3eaj s LEU 287 N -2.87 4.17 -0.04 0.00 1.02 -1.26 -4.90 118.68 114.80 3eaj s LEU 287 Ca 0.08 1.52 -0.29 0.00 0.02 0.00 0.00 54.13 55.47 3eaj s LEU 287 Cb 0.02 -3.55 -0.03 0.00 0.02 0.00 0.00 46.19 42.66 3eaj s LEU 287 CO -0.07 -0.62 0.96 -0.70 0.02 0.00 0.00 176.35 175.94 3eaj s GLU 288 N 2.87 4.50 -0.07 1.70 2.56 -1.26 -4.95 118.70 124.05 3eaj s GLU 288 Ca 0.48 1.35 0.10 0.00 0.00 0.00 0.00 54.97 56.91 3eaj s GLU 288 Cb -0.18 -3.49 0.16 0.00 2.00 0.00 0.00 34.13 32.62 3eaj s GLU 288 CO 0.12 -0.12 1.05 -0.40 -0.56 0.00 0.00 175.26 175.35 3eaj n ASP 289 N 4.24 1.70 -1.19 -1.70 5.75 -1.26 -3.81 116.55 120.28 3eaj n ASP 289 Ca 0.06 -2.53 -0.01 0.00 -0.01 0.00 0.00 54.79 52.30 3eaj n ASP 289 Cb 0.50 -0.27 0.23 0.00 -1.03 0.00 0.00 41.12 40.55 3eaj n ASP 289 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3eaj n GLU 290 N -0.89 2.39 -4.00 0.11 1.02 -1.26 -4.62 120.64 113.39 3eaj n GLU 290 Ca 0.09 -3.04 -0.30 0.00 -0.02 0.00 0.00 57.16 53.89 3eaj n GLU 290 Cb 0.56 -1.88 -0.16 0.00 -0.02 0.00 0.00 31.44 29.93 3eaj n GLU 290 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3eaj s ALA 291 N -3.08 1.78 0.41 0.62 0.00 -1.26 -4.72 121.76 115.52 3eaj s ALA 291 Ca 0.45 -0.88 -0.05 0.00 0.00 0.00 0.00 51.96 51.48 3eaj s ALA 291 Cb 0.39 -1.06 -0.04 0.00 0.00 0.00 0.00 23.12 22.41 3eaj s ALA 291 CO 0.05 -0.45 0.70 0.95 0.00 0.00 0.00 175.76 177.01 3eaj s THR 292 N 1.52 4.94 0.25 0.00 -4.23 -1.26 -4.52 115.64 112.33 3eaj s THR 292 Ca 0.04 0.13 -0.05 0.00 -1.18 0.00 0.00 61.69 60.64 3eaj s THR 292 Cb -0.13 -3.82 0.28 0.00 1.34 0.00 0.00 72.50 70.16 3eaj s THR 292 CO -0.10 -0.66 1.65 -0.65 -0.54 0.00 0.00 174.62 174.32 3eaj h PRO 293 N 0.73 0.14 -0.62 3.99 0.11 -1.90 0.82 132.00 135.27 3eaj h PRO 293 Ca -0.48 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.65 3eaj h PRO 293 Cb 1.20 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.24 3eaj h PRO 293 CO 0.63 0.10 0.39 0.35 -0.21 0.00 0.00 178.00 179.25 3eaj h PHE 294 N 0.15 0.73 -0.27 0.65 3.57 -1.96 0.10 116.94 119.90 3eaj h PHE 294 Ca 0.44 0.02 0.05 0.00 3.53 0.00 0.00 57.97 62.01 3eaj h PHE 294 Cb 0.80 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.26 3eaj h PHE 294 CO -0.37 0.43 0.01 -0.44 -2.23 0.00 0.00 178.31 175.71 3eaj h ASP 295 N 0.77 -0.09 -0.49 0.41 3.32 -1.29 -2.40 116.42 116.66 3eaj h ASP 295 Ca 0.25 0.06 -0.06 0.00 0.02 0.00 0.00 57.03 57.29 3eaj h ASP 295 Cb 0.00 0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 3eaj h ASP 295 CO -0.09 -0.01 0.05 0.58 -1.72 0.00 0.00 179.24 178.05 3eaj h VAL 296 N 0.09 1.25 -0.68 -1.35 2.07 -0.44 -3.16 116.25 114.03 3eaj h VAL 296 Ca 0.13 -0.97 -0.08 0.00 0.82 0.00 0.00 66.70 66.60 3eaj h VAL 296 Cb 0.17 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 3eaj h VAL 296 CO -0.21 0.34 0.12 0.58 0.02 0.00 0.00 177.57 178.42 3eaj h VAL 297 N 0.69 1.26 0.00 2.57 2.07 -0.87 0.21 116.25 122.19 3eaj h VAL 297 Ca 0.14 -1.03 0.00 0.00 0.82 0.00 0.00 66.70 66.63 3eaj h VAL 297 Cb 0.43 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.81 3eaj h VAL 297 CO 0.01 0.39 0.00 -1.14 0.02 0.00 0.00 177.57 176.85 3eaj n ARG 298 N -4.21 0.27 0.00 1.57 0.63 -0.91 -2.86 116.66 111.15 3eaj n ARG 298 Ca 0.05 0.11 0.00 0.00 -0.92 0.00 0.00 57.85 57.09 3eaj n ARG 298 Cb 0.29 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.70 3eaj n ARG 298 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 3eaj n GLN 299 N -1.26 4.94 -3.65 -0.14 7.27 -0.91 -4.92 117.38 118.72 3eaj n GLN 299 Ca 0.09 0.00 -0.29 0.00 0.07 0.00 0.00 57.00 56.86 3eaj n GLN 299 Cb 0.13 -0.56 -0.13 0.00 2.41 0.00 0.00 30.24 32.08 3eaj n GLN 299 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3eaj n SER 301 N 3.85 0.00 0.00 0.00 7.64 -1.26 -4.67 113.62 119.17 3eaj n SER 301 Ca 0.08 0.00 0.08 0.00 1.01 0.00 0.00 58.87 60.04 3eaj n SER 301 Cb 0.36 0.00 0.48 0.00 -1.01 0.00 0.00 64.21 64.04 3eaj n SER 301 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64