#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ce6 s LEU 11 N 0.00 3.87 0.05 2.46 1.43 -1.26 -5.04 118.68 120.19 3ce6 s LEU 11 Ca 0.00 2.52 0.05 0.00 -1.03 0.00 0.00 54.13 55.66 3ce6 s LEU 11 Cb 0.00 -4.33 -0.02 0.00 0.03 0.00 0.00 46.19 41.86 3ce6 s LEU 11 CO 0.00 -1.34 -0.13 0.42 0.23 0.00 0.00 176.35 175.53 3ce6 s THR 12 N -1.45 1.04 0.56 5.49 -4.23 -1.26 -5.12 115.64 110.66 3ce6 s THR 12 Ca 0.70 -1.10 -0.20 0.00 -1.18 0.00 0.00 61.69 59.91 3ce6 s THR 12 Cb -0.34 -0.97 -0.04 0.00 1.34 0.00 0.00 72.50 72.48 3ce6 s THR 12 CO 0.40 -0.11 1.26 -2.84 -0.54 0.00 0.00 174.62 172.78 3ce6 s PRO 13 N -1.37 3.10 0.39 3.99 0.02 -1.26 -5.00 135.00 134.86 3ce6 s PRO 13 Ca -0.01 1.98 -0.22 0.00 0.02 0.00 0.00 61.00 62.77 3ce6 s PRO 13 Cb -0.09 -2.10 -0.11 0.00 0.02 0.00 0.00 34.50 32.23 3ce6 s PRO 13 CO 0.02 -1.15 0.93 -0.51 -0.33 0.00 0.00 177.00 175.96 3ce6 s ASP 14 N -1.32 7.04 -0.16 2.53 1.01 -0.04 -4.90 116.67 120.84 3ce6 s ASP 14 Ca 0.74 1.70 -0.00 0.00 0.71 0.00 0.00 52.55 55.70 3ce6 s ASP 14 Cb -0.34 -2.54 0.04 0.00 1.01 0.00 0.00 42.92 41.08 3ce6 s ASP 14 CO 0.39 -0.27 -0.07 -0.69 0.21 0.00 0.00 175.17 174.74 3ce6 s VAL 15 N -2.01 1.21 -0.05 -1.27 1.01 -1.26 -0.32 120.40 117.71 3ce6 s VAL 15 Ca 0.58 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.94 3ce6 s VAL 15 Cb -0.12 -1.32 0.02 0.00 0.00 0.00 0.00 36.38 34.96 3ce6 s VAL 15 CO 0.16 0.20 -0.06 -0.13 0.00 0.00 0.00 175.10 175.27 3ce6 s ARG 16 N 1.60 1.02 -1.35 2.72 1.81 0.09 -4.82 118.95 120.02 3ce6 s ARG 16 Ca 0.01 -0.17 -0.09 0.00 -1.72 0.00 0.00 55.73 53.76 3ce6 s ARG 16 Cb -0.15 -0.96 0.07 0.00 -0.45 0.00 0.00 34.95 33.46 3ce6 s ARG 16 CO -0.08 -0.05 0.54 -1.71 -0.68 0.00 0.00 175.30 173.32 3ce6 n ASN 17 N 3.98 -4.08 0.00 0.23 5.15 -1.26 -1.30 115.26 117.99 3ce6 n ASN 17 Ca -0.25 -0.42 0.00 0.00 -0.60 0.00 0.00 54.58 53.31 3ce6 n ASN 17 Cb 0.51 -3.35 0.00 0.00 -0.53 0.00 0.00 39.78 36.41 3ce6 n ASN 17 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3ce6 n GLY 18 N -1.26 1.29 3.69 8.20 0.00 -1.26 -4.96 105.19 110.89 3ce6 n GLY 18 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 3ce6 n GLY 18 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ce6 s ILE 19 N -3.56 5.36 -0.06 -0.61 1.01 -0.42 -5.07 121.20 117.85 3ce6 s ILE 19 Ca 0.00 0.26 -0.14 0.00 0.00 0.00 0.00 60.65 60.78 3ce6 s ILE 19 Cb 0.00 -3.52 -0.05 0.00 0.01 0.00 0.00 42.46 38.90 3ce6 s ILE 19 CO 0.00 0.37 0.36 1.51 0.00 0.00 0.00 174.94 177.19 3ce6 s ASP 20 N 0.76 6.68 0.19 3.58 -4.77 -1.26 -0.73 116.67 121.12 3ce6 s ASP 20 Ca 0.10 0.81 -0.24 0.00 -3.30 0.00 0.00 52.55 49.91 3ce6 s ASP 20 Cb -0.13 -2.22 0.05 0.00 -1.09 0.00 0.00 42.92 39.54 3ce6 s ASP 20 CO 0.02 0.26 0.91 0.72 0.70 0.00 0.00 175.17 177.78 3ce6 s PHE 21 N -0.63 -0.13 -0.25 2.11 -0.71 0.57 -4.01 117.98 114.93 3ce6 s PHE 21 Ca 0.22 -0.23 -0.03 0.00 -1.04 0.00 0.00 56.93 55.85 3ce6 s PHE 21 Cb -0.15 0.66 0.14 0.00 -1.21 0.00 0.00 43.02 42.46 3ce6 s PHE 21 CO 0.10 -0.94 0.41 0.21 -1.34 0.00 0.00 175.22 173.66 3ce6 s LYS 22 N -3.36 0.38 0.26 1.99 2.47 0.61 -0.86 119.74 121.22 3ce6 s LYS 22 Ca 0.12 0.63 0.02 0.00 -1.56 0.00 0.00 55.97 55.18 3ce6 s LYS 22 Cb -0.03 -0.29 -0.03 0.00 -1.46 0.00 0.00 37.83 36.02 3ce6 s LYS 22 CO 0.04 -0.62 0.21 0.96 0.16 0.00 0.00 175.35 176.10 3ce6 s ILE 23 N 2.59 0.00 -0.01 5.43 -4.36 -1.26 -0.75 121.20 122.84 3ce6 s ILE 23 Ca 0.13 -1.97 -0.25 0.00 -0.26 0.00 0.00 60.65 58.30 3ce6 s ILE 23 Cb -0.15 -2.50 -0.19 0.00 1.25 0.00 0.00 42.46 40.87 3ce6 s ILE 23 CO -0.16 0.00 1.26 0.00 0.24 0.00 0.00 174.94 176.28 3ce6 h ALA 24 N 2.41 -0.11 -0.83 2.27 0.00 -1.89 -3.46 119.26 117.64 3ce6 h ALA 24 Ca -0.31 -0.21 0.13 0.00 0.00 0.00 0.00 54.91 54.51 3ce6 h ALA 24 Cb 1.24 0.04 -0.21 0.00 0.00 0.00 0.00 17.79 18.86 3ce6 h ALA 24 CO 0.46 -0.35 -0.17 0.34 0.00 0.00 0.00 179.25 179.53 3ce6 s ASP 25 N -5.50 -1.16 0.45 0.00 2.15 -1.26 -5.02 116.67 106.33 3ce6 s ASP 25 Ca -0.15 0.70 0.12 0.00 0.43 0.00 0.00 52.55 53.66 3ce6 s ASP 25 Cb 0.02 1.96 1.02 0.00 -0.30 0.00 0.00 42.92 45.63 3ce6 s ASP 25 CO 0.63 -0.22 2.06 0.25 -0.17 0.00 0.00 175.17 177.71 3ce6 h LEU 26 N 7.99 0.17 -0.29 -1.34 5.85 -1.94 -1.67 115.31 124.09 3ce6 h LEU 26 Ca -0.20 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.51 3ce6 h LEU 26 Cb 1.16 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.15 3ce6 h LEU 26 CO 0.17 0.20 0.00 -1.54 -0.34 0.00 0.00 178.44 176.92 3ce6 n SER 27 N -4.44 0.17 0.00 1.25 3.41 -1.26 -1.48 113.62 111.27 3ce6 n SER 27 Ca -0.01 0.56 0.11 0.00 -0.26 0.00 0.00 58.87 59.26 3ce6 n SER 27 Cb 0.14 -0.59 0.62 0.00 -0.26 0.00 0.00 64.21 64.13 3ce6 n SER 27 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3ce6 n LEU 28 N -1.70 0.00 -0.07 1.04 4.77 -0.63 -4.20 117.00 116.21 3ce6 n LEU 28 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 3ce6 n LEU 28 Cb 0.10 0.00 0.29 0.00 -2.33 0.00 0.00 43.42 41.49 3ce6 n LEU 28 CO 0.09 0.00 1.05 0.00 -1.33 0.00 0.00 177.39 177.21 3ce6 h ALA 29 N 3.35 1.43 -0.39 -1.18 0.00 -1.48 0.26 119.26 121.26 3ce6 h ALA 29 Ca 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3ce6 h ALA 29 Cb 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3ce6 h ALA 29 CO 0.00 0.43 0.17 -0.44 0.00 0.00 0.00 179.25 179.42 3ce6 h ASP 30 N 0.68 0.52 -0.28 0.00 5.19 -1.85 0.32 116.42 121.00 3ce6 h ASP 30 Ca 0.16 -0.15 -0.07 0.00 -0.62 0.00 0.00 57.03 56.36 3ce6 h ASP 30 Cb 0.15 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.51 3ce6 h ASP 30 CO -0.02 0.52 -0.08 0.15 -3.12 0.00 0.00 179.24 176.70 3ce6 h PHE 31 N 0.49 0.62 -0.57 4.55 3.57 -1.73 -2.01 116.94 121.86 3ce6 h PHE 31 Ca 0.13 -0.14 0.08 0.00 3.53 0.00 0.00 57.97 61.58 3ce6 h PHE 31 Cb 0.15 -0.15 -0.07 0.00 2.79 0.00 0.00 35.95 38.67 3ce6 h PHE 31 CO -0.01 0.76 0.21 0.78 -2.23 0.00 0.00 178.31 177.82 3ce6 h GLY 32 N 0.30 0.78 1.24 2.40 0.00 -0.35 -2.47 103.07 104.97 3ce6 h GLY 32 Ca 0.07 -0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.25 3ce6 h GLY 32 CO 0.03 -0.01 0.27 -0.09 0.00 0.00 0.00 176.54 176.75 3ce6 h ARG 33 N 0.39 0.97 -0.62 4.80 9.65 -0.04 0.27 114.38 129.80 3ce6 h ARG 33 Ca 0.28 -0.16 0.00 0.00 -1.10 0.00 0.00 59.98 59.01 3ce6 h ARG 33 Cb 0.33 -0.17 -0.03 0.00 -1.39 0.00 0.00 29.97 28.71 3ce6 h ARG 33 CO -0.28 0.79 0.40 0.87 2.80 0.00 0.00 179.97 184.55 3ce6 h LYS 34 N 0.96 0.83 -0.27 0.20 1.57 -0.94 -0.73 116.57 118.18 3ce6 h LYS 34 Ca 0.23 -0.06 -0.15 0.00 -1.87 0.00 0.00 60.65 58.80 3ce6 h LYS 34 Cb 0.17 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 3ce6 h LYS 34 CO -0.02 0.56 -0.43 0.93 -0.57 0.00 0.00 179.45 179.92 3ce6 h GLU 35 N 0.85 0.68 -0.61 3.15 5.08 -0.90 -1.65 114.58 121.18 3ce6 h GLU 35 Ca 0.23 -0.36 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 3ce6 h GLU 35 Cb -0.08 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 3ce6 h GLU 35 CO -0.05 0.97 0.39 -0.07 -1.00 0.00 0.00 179.01 179.26 3ce6 h LEU 36 N 0.55 0.67 -0.52 1.33 4.07 -0.21 0.42 115.31 121.62 3ce6 h LEU 36 Ca 0.04 -0.01 -0.14 0.00 0.08 0.00 0.00 57.88 57.85 3ce6 h LEU 36 Cb 0.97 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.53 3ce6 h LEU 36 CO 0.09 0.48 -0.30 0.03 -1.08 0.00 0.00 178.44 177.66 3ce6 h ARG 37 N 0.80 0.88 -0.71 1.13 3.08 -0.95 0.85 114.38 119.46 3ce6 h ARG 37 Ca 0.23 -0.41 0.05 0.00 0.07 0.00 0.00 59.98 59.92 3ce6 h ARG 37 Cb -0.06 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 29.92 3ce6 h ARG 37 CO -0.06 1.06 0.41 0.82 -1.07 0.00 0.00 179.97 181.13 3ce6 h ILE 38 N 0.74 1.00 -0.69 2.04 2.04 -1.21 -2.91 117.51 118.52 3ce6 h ILE 38 Ca 0.08 -0.26 -0.07 0.00 1.00 0.00 0.00 64.86 65.61 3ce6 h ILE 38 Cb 0.87 0.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 3ce6 h ILE 38 CO 0.08 0.14 0.16 0.00 0.00 0.00 0.00 178.15 178.53 3ce6 h ALA 39 N 1.35 0.98 -0.89 1.87 0.00 -0.10 -2.02 119.26 120.46 3ce6 h ALA 39 Ca 0.31 -0.25 0.18 0.00 0.00 0.00 0.00 54.91 55.15 3ce6 h ALA 39 Cb 0.16 -0.26 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 3ce6 h ALA 39 CO -0.17 0.66 0.58 0.93 0.00 0.00 0.00 179.25 181.25 3ce6 h GLU 40 N 1.04 0.50 0.00 0.00 5.08 -0.66 0.25 114.58 120.79 3ce6 h GLU 40 Ca 0.22 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 3ce6 h GLU 40 Cb 0.37 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 3ce6 h GLU 40 CO 0.00 0.33 -0.05 0.45 -1.00 0.00 0.00 179.01 178.75 3ce6 h HIS 41 N 0.52 0.00 -0.53 4.33 3.86 -1.34 -2.63 115.15 119.36 3ce6 h HIS 41 Ca 0.46 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.67 3ce6 h HIS 41 Cb 1.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.47 3ce6 h HIS 41 CO -0.00 0.05 0.00 0.39 0.86 0.00 0.00 177.93 179.22 3ce6 n GLU 42 N -3.16 2.61 -3.23 2.45 -0.58 0.72 -4.61 120.64 114.85 3ce6 n GLU 42 Ca 0.00 -2.37 -0.25 0.00 -0.42 0.00 0.00 57.16 54.12 3ce6 n GLU 42 Cb 0.33 -1.47 -0.06 0.00 -0.57 0.00 0.00 31.44 29.67 3ce6 n GLU 42 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 3ce6 n MET 43 N 1.31 2.00 0.23 3.49 2.81 -0.28 -3.08 117.12 123.60 3ce6 n MET 43 Ca 0.20 -4.16 0.11 0.00 -1.81 0.00 0.00 57.70 52.04 3ce6 n MET 43 Cb 0.56 -1.91 0.53 0.00 -0.71 0.00 0.00 33.22 31.69 3ce6 n MET 43 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 3ce6 h PRO 44 N 3.71 0.00 -0.31 0.03 0.13 -1.82 -1.59 132.00 132.15 3ce6 h PRO 44 Ca 0.14 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.26 3ce6 h PRO 44 Cb 0.73 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 3ce6 h PRO 44 CO 0.69 0.18 0.16 0.78 -0.23 0.00 0.00 178.00 179.58 3ce6 h GLY 45 N 1.89 0.48 0.96 1.56 0.00 -1.91 0.69 103.07 106.73 3ce6 h GLY 45 Ca -0.00 -0.23 -0.14 0.00 0.00 0.00 0.00 47.33 46.96 3ce6 h GLY 45 CO 0.02 0.22 -0.41 1.41 0.00 0.00 0.00 176.54 177.78 3ce6 h LEU 46 N 0.38 0.72 -0.80 3.11 3.38 -1.62 -2.92 115.31 117.56 3ce6 h LEU 46 Ca 0.11 -0.55 -0.08 0.00 0.09 0.00 0.00 57.88 57.45 3ce6 h LEU 46 Cb 0.10 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 3ce6 h LEU 46 CO -0.01 1.13 -0.02 0.24 0.09 0.00 0.00 178.44 179.87 3ce6 h MET 47 N 0.34 0.88 -0.69 1.13 2.86 -1.27 -1.28 114.93 116.89 3ce6 h MET 47 Ca 0.01 -0.26 0.02 0.00 -2.06 0.00 0.00 59.70 57.41 3ce6 h MET 47 Cb 1.01 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.55 3ce6 h MET 47 CO 0.09 0.89 0.45 1.03 1.06 0.00 0.00 176.91 180.43 3ce6 h SER 48 N 0.81 0.75 -0.67 1.22 0.87 -0.92 -1.69 113.55 113.92 3ce6 h SER 48 Ca 0.15 -0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.63 3ce6 h SER 48 Cb 0.52 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.27 3ce6 h SER 48 CO 0.03 0.53 0.14 -0.07 -0.53 0.00 0.00 176.83 176.92 3ce6 h LEU 49 N 0.89 1.05 -0.81 2.23 3.38 -1.24 -0.07 115.31 120.74 3ce6 h LEU 49 Ca 0.27 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3ce6 h LEU 49 Cb -0.04 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.39 3ce6 h LEU 49 CO -0.08 1.02 0.52 0.03 0.09 0.00 0.00 178.44 180.02 3ce6 h ARG 50 N 1.04 1.08 -0.18 1.13 3.08 -0.51 -0.83 114.38 119.18 3ce6 h ARG 50 Ca 0.21 -0.08 -0.07 0.00 0.07 0.00 0.00 59.98 60.12 3ce6 h ARG 50 Cb 0.40 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 3ce6 h ARG 50 CO 0.01 0.73 -0.15 0.00 -1.07 0.00 0.00 179.97 179.49 3ce6 h ARG 51 N 1.10 0.42 -0.46 0.04 3.08 -1.12 -1.97 114.38 115.48 3ce6 h ARG 51 Ca 0.29 -0.21 -0.08 0.00 0.07 0.00 0.00 59.98 60.06 3ce6 h ARG 51 Cb -0.10 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 3ce6 h ARG 51 CO -0.06 0.76 -0.03 1.49 -1.07 0.00 0.00 179.97 181.06 3ce6 h GLU 52 N 0.08 0.79 -0.41 0.04 4.81 -0.80 -3.17 114.58 115.91 3ce6 h GLU 52 Ca 0.03 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.04 3ce6 h GLU 52 Cb 0.67 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.97 3ce6 h GLU 52 CO 0.04 0.82 0.00 0.66 -0.73 0.00 0.00 179.01 179.79 3ce6 n TYR 53 N -4.20 0.54 -0.00 0.92 4.01 -0.34 -4.65 117.16 113.44 3ce6 n TYR 53 Ca 0.02 -0.47 -0.09 0.00 -0.16 0.00 0.00 57.90 57.20 3ce6 n TYR 53 Cb 0.32 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.30 3ce6 n TYR 53 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3ce6 h ALA 54 N 2.52 -0.09 -0.07 -0.72 0.00 -1.33 -1.26 119.26 118.31 3ce6 h ALA 54 Ca 0.00 0.05 -0.24 0.00 0.00 0.00 0.00 54.91 54.72 3ce6 h ALA 54 Cb 0.78 0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.92 3ce6 h ALA 54 CO 0.00 -0.62 -0.90 1.49 0.00 0.00 0.00 179.25 179.22 3ce6 h GLU 55 N -0.21 0.71 -0.88 0.00 4.81 -1.83 -3.24 114.58 113.94 3ce6 h GLU 55 Ca 0.10 -0.66 0.01 0.00 -0.13 0.00 0.00 59.36 58.67 3ce6 h GLU 55 Cb 0.35 0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.85 3ce6 h GLU 55 CO -0.26 1.26 0.58 0.28 -0.73 0.00 0.00 179.01 180.14 3ce6 h VAL 56 N 0.44 1.23 -5.98 0.32 2.07 -1.83 -3.47 116.25 109.03 3ce6 h VAL 56 Ca -0.09 -0.42 -0.38 0.00 0.82 0.00 0.00 66.70 66.63 3ce6 h VAL 56 Cb 1.54 -0.07 0.10 0.00 -1.52 0.00 0.00 31.29 31.34 3ce6 h VAL 56 CO 0.18 0.22 -0.86 0.00 0.02 0.00 0.00 177.57 177.13 3ce6 n GLN 57 N -4.46 -3.46 0.30 1.57 1.13 -0.49 -4.86 117.38 107.12 3ce6 n GLN 57 Ca 0.10 0.63 0.18 0.00 -1.94 0.00 0.00 57.00 55.97 3ce6 n GLN 57 Cb 0.02 -5.06 0.97 0.00 0.11 0.00 0.00 30.24 26.28 3ce6 n GLN 57 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 3ce6 h PRO 58 N -1.72 0.00 -0.46 -1.09 0.13 -1.71 -2.41 132.00 124.74 3ce6 h PRO 58 Ca -0.62 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 3ce6 h PRO 58 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 3ce6 h PRO 58 CO 0.51 0.03 0.00 1.28 -0.23 0.00 0.00 178.00 179.59 3ce6 n LEU 59 N -3.42 3.47 -4.57 1.56 4.77 -0.19 -4.73 117.00 113.88 3ce6 n LEU 59 Ca -0.02 -1.66 -0.50 0.00 -0.03 0.00 0.00 56.01 53.80 3ce6 n LEU 59 Cb 0.14 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 40.88 3ce6 n LEU 59 CO 0.25 0.79 0.74 1.17 -1.33 0.00 0.00 177.39 179.01 3ce6 n LYS 60 N 1.39 1.09 0.00 3.23 4.81 -0.91 -0.98 118.16 126.79 3ce6 n LYS 60 Ca 0.19 0.39 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 3ce6 n LYS 60 Cb 0.58 -1.91 0.00 0.00 0.02 0.00 0.00 35.03 33.72 3ce6 n LYS 60 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3ce6 n GLY 61 N 2.10 2.06 3.76 3.14 0.00 -1.26 -4.98 105.19 110.00 3ce6 n GLY 61 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 3ce6 n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ce6 s ALA 62 N -2.32 3.33 -0.43 4.61 0.00 -0.15 -4.96 121.76 121.84 3ce6 s ALA 62 Ca 0.00 0.75 0.02 0.00 0.00 0.00 0.00 51.96 52.74 3ce6 s ALA 62 Cb 0.00 -3.27 0.12 0.00 0.00 0.00 0.00 23.12 19.97 3ce6 s ALA 62 CO 0.00 -0.01 0.20 1.03 0.00 0.00 0.00 175.76 176.98 3ce6 s ARG 63 N -1.52 1.43 -0.23 0.00 0.52 -1.26 -0.97 118.95 116.92 3ce6 s ARG 63 Ca 0.45 -2.03 -0.12 0.00 -0.52 0.00 0.00 55.73 53.52 3ce6 s ARG 63 Cb -0.28 -2.69 -0.05 0.00 0.52 0.00 0.00 34.95 32.45 3ce6 s ARG 63 CO 0.35 -1.09 0.21 0.42 0.02 0.00 0.00 175.30 175.21 3ce6 s ILE 64 N 0.43 5.33 -0.42 1.52 1.01 -0.06 -1.53 121.20 127.47 3ce6 s ILE 64 Ca 0.15 0.28 -0.18 0.00 0.00 0.00 0.00 60.65 60.91 3ce6 s ILE 64 Cb -0.23 -3.54 0.02 0.00 0.01 0.00 0.00 42.46 38.72 3ce6 s ILE 64 CO -0.04 0.33 0.47 -0.44 0.00 0.00 0.00 174.94 175.25 3ce6 s SER 65 N 1.04 6.21 -0.12 3.58 0.01 -0.55 -1.37 113.70 122.50 3ce6 s SER 65 Ca 0.10 -0.64 -0.01 0.00 1.31 0.00 0.00 55.95 56.70 3ce6 s SER 65 Cb -0.14 -2.24 -0.03 0.00 0.21 0.00 0.00 66.02 63.83 3ce6 s SER 65 CO 0.05 -0.61 -0.06 -0.83 0.41 0.00 0.00 173.24 172.19 3ce6 s GLY 66 N 1.85 1.68 -0.32 3.44 0.00 -0.17 -1.54 107.32 112.26 3ce6 s GLY 66 Ca 0.13 -0.86 0.02 0.00 0.00 0.00 0.00 44.72 44.02 3ce6 s GLY 66 CO 0.14 -0.33 0.05 -0.45 0.00 0.00 0.00 173.10 172.51 3ce6 s SER 67 N -0.12 4.43 -0.29 1.64 0.15 0.82 -1.48 113.70 118.86 3ce6 s SER 67 Ca 0.01 -1.86 -0.22 0.00 0.70 0.00 0.00 55.95 54.58 3ce6 s SER 67 Cb -0.13 -1.35 0.13 0.00 -1.71 0.00 0.00 66.02 62.96 3ce6 s SER 67 CO 0.03 -0.37 1.02 -0.22 1.20 0.00 0.00 173.24 174.90 3ce6 s LEU 68 N 1.18 -0.47 -0.31 3.45 0.20 -0.54 -1.29 118.68 120.91 3ce6 s LEU 68 Ca 0.08 0.84 -0.29 0.00 0.69 0.00 0.00 54.13 55.45 3ce6 s LEU 68 Cb -0.18 1.82 -0.12 0.00 -0.43 0.00 0.00 46.19 47.27 3ce6 s LEU 68 CO -0.13 -0.14 1.02 1.41 -0.29 0.00 0.00 176.35 178.22 3ce6 n HIS 69 N 2.75 1.05 -2.63 5.38 8.25 -1.26 -4.24 115.22 124.50 3ce6 n HIS 69 Ca -0.15 0.68 -0.43 0.00 -0.26 0.00 0.00 57.72 57.57 3ce6 n HIS 69 Cb 0.57 -1.38 0.00 0.00 1.12 0.00 0.00 29.99 30.30 3ce6 n HIS 69 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 3ce6 n MET 70 N 2.67 3.33 -4.03 -0.41 1.56 -1.26 -4.54 117.12 114.43 3ce6 n MET 70 Ca 0.21 -3.54 -0.25 0.00 -0.27 0.00 0.00 57.70 53.85 3ce6 n MET 70 Cb -0.04 -3.15 -0.06 0.00 2.15 0.00 0.00 33.22 32.12 3ce6 n MET 70 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 3ce6 s THR 71 N 2.13 2.20 0.28 1.12 -4.23 -1.26 -0.55 115.64 115.34 3ce6 s THR 71 Ca 0.45 -1.62 0.01 0.00 -1.18 0.00 0.00 61.69 59.35 3ce6 s THR 71 Cb 0.03 -2.82 0.29 0.00 1.34 0.00 0.00 72.50 71.33 3ce6 s THR 71 CO 0.01 0.00 1.67 0.58 -0.54 0.00 0.00 174.62 176.35 3ce6 h VAL 72 N 1.25 0.41 -0.56 2.29 2.07 -1.91 0.15 116.25 119.95 3ce6 h VAL 72 Ca -0.42 -0.10 -0.05 0.00 0.82 0.00 0.00 66.70 66.95 3ce6 h VAL 72 Cb 1.27 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 3ce6 h VAL 72 CO 0.66 0.05 0.14 1.56 0.02 0.00 0.00 177.57 180.01 3ce6 h GLN 73 N 0.29 0.89 -0.26 1.57 7.50 -1.94 -2.19 115.11 120.97 3ce6 h GLN 73 Ca 0.53 -0.21 -0.10 0.00 0.50 0.00 0.00 58.65 59.37 3ce6 h GLN 73 Cb 1.01 -0.12 -0.01 0.00 0.05 0.00 0.00 27.48 28.41 3ce6 h GLN 73 CO -0.58 0.83 -0.25 1.15 -1.50 0.00 0.00 178.83 178.47 3ce6 h THR 74 N 0.79 1.27 -0.74 -0.54 2.02 -1.62 -2.33 112.91 111.75 3ce6 h THR 74 Ca 0.18 -1.28 0.03 0.00 0.77 0.00 0.00 66.41 66.10 3ce6 h THR 74 Cb 0.33 1.35 -0.05 0.00 -1.74 0.00 0.00 68.15 68.04 3ce6 h THR 74 CO 0.00 0.41 0.47 0.00 0.37 0.00 0.00 175.52 176.77 3ce6 h ALA 75 N 1.29 0.97 -0.52 6.16 0.00 -0.27 0.12 119.26 127.02 3ce6 h ALA 75 Ca 0.06 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 3ce6 h ALA 75 Cb 0.68 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3ce6 h ALA 75 CO 0.05 0.26 0.04 0.28 0.00 0.00 0.00 179.25 179.88 3ce6 h VAL 76 N 0.91 1.24 0.03 0.00 2.07 -0.90 -1.09 116.25 118.52 3ce6 h VAL 76 Ca 0.30 -0.97 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 3ce6 h VAL 76 Cb 0.02 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 3ce6 h VAL 76 CO -0.11 0.35 -0.01 0.25 0.02 0.00 0.00 177.57 178.06 3ce6 h LEU 77 N 0.79 -0.03 -0.91 2.57 5.85 -0.96 -0.92 115.31 121.70 3ce6 h LEU 77 Ca 0.16 -0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.84 3ce6 h LEU 77 Cb 0.42 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 3ce6 h LEU 77 CO 0.01 0.05 0.59 0.40 -0.34 0.00 0.00 178.44 179.16 3ce6 h ILE 78 N -0.12 1.16 0.00 4.05 2.04 -0.43 -0.61 117.51 123.60 3ce6 h ILE 78 Ca -0.00 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.44 3ce6 h ILE 78 Cb 0.11 -0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.09 3ce6 h ILE 78 CO 0.01 0.21 -0.10 -0.33 0.00 0.00 0.00 178.15 177.93 3ce6 h GLU 79 N 1.15 0.00 -0.15 2.37 5.08 -0.99 -0.98 114.58 121.06 3ce6 h GLU 79 Ca 0.36 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.66 3ce6 h GLU 79 Cb -0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 3ce6 h GLU 79 CO -0.12 0.10 -0.17 1.15 -1.00 0.00 0.00 179.01 178.98 3ce6 h THR 80 N 0.00 1.35 -0.44 1.13 2.02 -0.28 -1.54 112.91 115.15 3ce6 h THR 80 Ca -0.00 -1.34 0.00 0.00 0.77 0.00 0.00 66.41 65.84 3ce6 h THR 80 Cb 0.89 1.89 -0.02 0.00 -1.74 0.00 0.00 68.15 69.17 3ce6 h THR 80 CO 0.01 0.40 0.29 -0.07 0.37 0.00 0.00 175.52 176.52 3ce6 h LEU 81 N 0.00 0.51 -0.53 2.58 3.38 -0.35 -1.91 115.31 118.99 3ce6 h LEU 81 Ca 0.02 -0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 3ce6 h LEU 81 Cb 0.71 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 3ce6 h LEU 81 CO 0.04 0.37 -0.36 0.71 0.09 0.00 0.00 178.44 179.29 3ce6 h THR 82 N 0.60 1.28 -0.29 0.22 1.35 -1.27 -1.71 112.91 113.09 3ce6 h THR 82 Ca 0.16 -1.53 0.08 0.00 -0.55 0.00 0.00 66.41 64.57 3ce6 h THR 82 Cb -0.06 1.41 -0.01 0.00 -1.73 0.00 0.00 68.15 67.75 3ce6 h THR 82 CO -0.03 0.50 0.25 0.00 -0.25 0.00 0.00 175.52 175.99 3ce6 h ALA 83 N 0.93 2.08 -0.24 6.62 0.00 -0.94 -0.16 119.26 127.54 3ce6 h ALA 83 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3ce6 h ALA 83 Cb 0.92 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3ce6 h ALA 83 CO 0.08 -0.40 0.00 1.28 0.00 0.00 0.00 179.25 180.21 3ce6 n LEU 84 N -4.07 2.84 0.00 0.00 4.77 -0.75 -4.85 117.00 114.94 3ce6 n LEU 84 Ca 0.04 -1.15 0.00 0.00 -0.03 0.00 0.00 56.01 54.87 3ce6 n LEU 84 Cb 0.41 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3ce6 n LEU 84 CO 0.31 0.58 0.00 0.61 -1.33 0.00 0.00 177.39 177.56 3ce6 n GLY 85 N 1.37 1.15 3.80 -0.72 0.00 -0.07 -1.03 105.19 109.69 3ce6 n GLY 85 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 3ce6 n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ce6 s ALA 86 N -2.00 2.64 0.07 4.61 0.00 -0.70 -3.71 121.76 122.66 3ce6 s ALA 86 Ca 0.00 0.37 0.01 0.00 0.00 0.00 0.00 51.96 52.34 3ce6 s ALA 86 Cb 0.00 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 3ce6 s ALA 86 CO 0.00 -1.05 0.21 -1.21 0.00 0.00 0.00 175.76 173.71 3ce6 s GLU 87 N -4.29 3.39 0.12 0.00 2.02 -0.15 -4.27 118.70 115.52 3ce6 s GLU 87 Ca 0.63 -0.48 0.04 0.00 0.02 0.00 0.00 54.97 55.18 3ce6 s GLU 87 Cb -0.17 -3.00 -0.04 0.00 0.10 0.00 0.00 34.13 31.02 3ce6 s GLU 87 CO 0.42 0.60 -0.10 0.14 0.02 0.00 0.00 175.26 176.34 3ce6 s VAL 88 N -1.53 0.99 -0.02 2.63 -7.23 -1.26 -0.89 120.40 113.10 3ce6 s VAL 88 Ca 0.34 -1.86 0.01 0.00 -1.81 0.00 0.00 61.98 58.66 3ce6 s VAL 88 Cb -0.13 -1.62 0.02 0.00 0.56 0.00 0.00 36.38 35.21 3ce6 s VAL 88 CO 0.28 -0.69 -0.01 -0.13 -0.31 0.00 0.00 175.10 174.24 3ce6 s ARG 89 N -3.36 0.28 0.20 4.82 0.52 -0.47 -4.24 118.95 116.69 3ce6 s ARG 89 Ca 0.11 0.02 0.10 0.00 -0.52 0.00 0.00 55.73 55.44 3ce6 s ARG 89 Cb 0.01 -0.39 -0.04 0.00 0.52 0.00 0.00 34.95 35.04 3ce6 s ARG 89 CO -0.01 -0.07 -0.20 -0.46 0.02 0.00 0.00 175.30 174.59 3ce6 s TRP 90 N 0.66 2.03 0.06 -0.53 -0.11 0.32 -1.00 118.94 120.37 3ce6 s TRP 90 Ca -0.07 -0.42 -0.16 0.00 1.22 0.00 0.00 56.10 56.66 3ce6 s TRP 90 Cb -0.10 -0.97 0.03 0.00 -1.50 0.00 0.00 33.47 30.94 3ce6 s TRP 90 CO -0.01 0.46 0.38 0.00 -4.62 0.00 0.00 176.95 173.16 3ce6 s ALA 91 N -2.18 -0.90 0.63 5.86 0.00 -0.55 -0.72 121.76 123.91 3ce6 s ALA 91 Ca 0.21 0.14 -0.13 0.00 0.00 0.00 0.00 51.96 52.18 3ce6 s ALA 91 Cb -0.05 0.42 -0.02 0.00 0.00 0.00 0.00 23.12 23.46 3ce6 s ALA 91 CO 0.09 -0.49 1.05 0.45 0.00 0.00 0.00 175.76 176.86 3ce6 s SER 92 N -2.21 5.70 -0.16 0.00 0.15 -1.25 -1.46 113.70 114.46 3ce6 s SER 92 Ca -0.03 1.69 0.16 0.00 0.70 0.00 0.00 55.95 58.47 3ce6 s SER 92 Cb -0.00 -2.51 0.75 0.00 -1.71 0.00 0.00 66.02 62.54 3ce6 s SER 92 CO -0.05 -1.22 1.66 0.00 1.20 0.00 0.00 173.24 174.83 3ce6 s ASN 94 N -0.93 -0.50 0.36 0.00 3.84 -1.26 -4.92 114.94 111.52 3ce6 s ASN 94 Ca 0.52 0.56 0.27 0.00 0.21 0.00 0.00 52.86 54.42 3ce6 s ASN 94 Cb 0.36 0.53 0.96 0.00 -0.55 0.00 0.00 41.25 42.56 3ce6 s ASN 94 CO 0.20 -0.52 1.79 0.16 -2.79 0.00 0.00 177.10 175.94 3ce6 h ILE 95 N 3.40 0.00 -0.02 -5.21 3.07 -1.92 -3.20 117.51 113.64 3ce6 h ILE 95 Ca -0.28 -0.48 0.00 0.00 1.55 0.00 0.00 64.86 65.65 3ce6 h ILE 95 Cb 1.15 1.38 0.00 0.00 -0.27 0.00 0.00 36.82 39.08 3ce6 h ILE 95 CO 0.37 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 177.96 3ce6 n PHE 96 N -2.61 0.02 0.29 0.16 3.72 -1.26 -0.57 117.46 117.20 3ce6 n PHE 96 Ca 0.03 -0.03 0.12 0.00 -0.05 0.00 0.00 57.45 57.52 3ce6 n PHE 96 Cb 0.34 -0.00 0.13 0.00 -0.94 0.00 0.00 39.48 39.00 3ce6 n PHE 96 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3ce6 h SER 97 N 1.61 0.00 -3.99 4.37 4.64 -1.76 -3.38 113.55 115.03 3ce6 h SER 97 Ca 0.00 -0.04 -0.52 0.00 -0.47 0.00 0.00 61.79 60.75 3ce6 h SER 97 Cb 0.36 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 62.54 3ce6 h SER 97 CO 0.00 0.02 0.56 -0.89 -0.87 0.00 0.00 176.83 175.65 3ce6 s THR 98 N -3.25 2.69 -0.37 2.95 2.01 -1.26 -4.36 115.64 114.06 3ce6 s THR 98 Ca 0.04 0.55 -0.07 0.00 0.31 0.00 0.00 61.69 62.53 3ce6 s THR 98 Cb 0.09 -3.30 0.06 0.00 0.01 0.00 0.00 72.50 69.36 3ce6 s THR 98 CO 0.72 0.02 0.15 -1.10 -0.69 0.00 0.00 174.62 173.73 3ce6 s GLN 99 N -2.60 2.55 0.37 4.92 -0.21 0.29 -4.28 119.66 120.71 3ce6 s GLN 99 Ca 0.63 -1.32 0.06 0.00 0.02 0.00 0.00 55.36 54.76 3ce6 s GLN 99 Cb -0.35 -3.55 0.76 0.00 1.00 0.00 0.00 33.01 30.88 3ce6 s GLN 99 CO 0.43 -0.78 1.98 -0.44 -2.12 0.00 0.00 175.29 174.35 3ce6 h ASP 100 N 8.25 0.63 -0.71 5.90 3.32 -1.94 -0.42 116.42 131.45 3ce6 h ASP 100 Ca -0.22 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.78 3ce6 h ASP 100 Cb 1.08 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.46 3ce6 h ASP 100 CO 0.65 0.42 0.25 1.12 -1.72 0.00 0.00 179.24 179.96 3ce6 h HIS 101 N 0.72 1.13 -0.23 4.55 2.07 -1.91 -1.27 115.15 120.22 3ce6 h HIS 101 Ca 0.28 -0.10 -0.14 0.00 -2.85 0.00 0.00 60.37 57.56 3ce6 h HIS 101 Cb 0.20 -0.33 -0.01 0.00 2.57 0.00 0.00 27.41 29.84 3ce6 h HIS 101 CO -0.00 0.88 -0.46 0.00 -3.07 0.00 0.00 177.93 175.28 3ce6 h ALA 102 N 1.20 0.78 -0.95 6.11 0.00 -1.43 -1.71 119.26 123.27 3ce6 h ALA 102 Ca 0.24 -0.47 0.01 0.00 0.00 0.00 0.00 54.91 54.70 3ce6 h ALA 102 Cb 0.26 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 3ce6 h ALA 102 CO -0.01 0.66 0.63 0.00 0.00 0.00 0.00 179.25 180.53 3ce6 h ALA 103 N 1.04 1.21 -0.33 0.00 0.00 -0.98 -1.65 119.26 118.55 3ce6 h ALA 103 Ca 0.03 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 3ce6 h ALA 103 Cb 0.98 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3ce6 h ALA 103 CO 0.09 0.58 -0.18 0.00 0.00 0.00 0.00 179.25 179.74 3ce6 h ALA 104 N 1.36 0.47 -0.82 0.00 0.00 -1.03 -2.11 119.26 117.12 3ce6 h ALA 104 Ca 0.35 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3ce6 h ALA 104 Cb -0.12 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 3ce6 h ALA 104 CO -0.08 0.40 0.41 0.00 0.00 0.00 0.00 179.25 179.97 3ce6 h ALA 105 N 0.77 1.16 -0.65 0.00 0.00 -1.09 -0.20 119.26 119.25 3ce6 h ALA 105 Ca 0.07 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3ce6 h ALA 105 Cb 0.72 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3ce6 h ALA 105 CO 0.05 0.64 0.30 0.28 0.00 0.00 0.00 179.25 180.53 3ce6 h VAL 106 N 1.17 1.23 -0.56 0.00 2.07 -0.97 0.94 116.25 120.12 3ce6 h VAL 106 Ca 0.28 -0.66 -0.11 0.00 0.82 0.00 0.00 66.70 67.04 3ce6 h VAL 106 Cb 0.10 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 3ce6 h VAL 106 CO -0.04 0.27 -0.08 0.58 0.02 0.00 0.00 177.57 178.32 3ce6 h VAL 107 N 0.91 1.27 0.06 2.57 2.07 -0.96 -2.45 116.25 119.71 3ce6 h VAL 107 Ca 0.22 -1.23 -0.24 0.00 0.82 0.00 0.00 66.70 66.27 3ce6 h VAL 107 Cb 0.14 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 30.82 3ce6 h VAL 107 CO -0.03 0.44 -1.06 0.58 0.02 0.00 0.00 177.57 177.52 3ce6 h VAL 108 N 0.93 1.50 -0.26 2.57 2.07 -0.95 0.13 116.25 122.25 3ce6 h VAL 108 Ca 0.15 -2.87 0.03 0.00 0.82 0.00 0.00 66.70 64.83 3ce6 h VAL 108 Cb 0.64 2.71 -0.01 0.00 -1.52 0.00 0.00 31.29 33.11 3ce6 h VAL 108 CO 0.04 0.84 -0.07 0.61 0.02 0.00 0.00 177.57 179.01 3ce6 n GLY 109 N 1.23 -2.01 0.25 2.17 0.00 0.31 -0.24 105.19 106.90 3ce6 n GLY 109 Ca -0.06 -1.47 0.14 0.00 0.00 0.00 0.00 46.02 44.63 3ce6 n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ce6 h PRO 110 N -0.11 0.00 -0.15 1.61 0.13 -1.88 -3.15 132.00 128.45 3ce6 h PRO 110 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 3ce6 h PRO 110 Cb 0.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.23 3ce6 h PRO 110 CO 0.00 0.10 0.00 0.72 -0.23 0.00 0.00 178.00 178.59 3ce6 n HIS 111 N -3.25 0.19 -2.84 1.56 8.25 -1.26 -5.03 115.22 112.84 3ce6 n HIS 111 Ca 0.00 -0.38 -0.18 0.00 -0.26 0.00 0.00 57.72 56.91 3ce6 n HIS 111 Cb 0.35 -0.03 0.08 0.00 1.12 0.00 0.00 29.99 31.51 3ce6 n HIS 111 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ce6 n GLY 112 N 0.14 1.44 3.32 -1.41 0.00 -1.14 -4.93 105.19 102.59 3ce6 n GLY 112 Ca 0.06 -2.14 -0.16 0.00 0.00 0.00 0.00 46.02 43.78 3ce6 n GLY 112 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ce6 s THR 113 N -2.30 0.57 0.25 2.61 -4.23 -0.35 -4.86 115.64 107.33 3ce6 s THR 113 Ca 0.54 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 59.01 3ce6 s THR 113 Cb -0.04 -2.63 0.22 0.00 1.34 0.00 0.00 72.50 71.39 3ce6 s THR 113 CO 0.35 -0.01 1.81 -0.65 -0.54 0.00 0.00 174.62 175.58 3ce6 h PRO 114 N 2.39 0.77 -0.10 3.99 0.11 -1.94 -0.96 132.00 136.25 3ce6 h PRO 114 Ca -0.38 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 65.55 3ce6 h PRO 114 Cb 1.25 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3ce6 h PRO 114 CO 0.61 0.51 -0.51 -0.44 -0.21 0.00 0.00 178.00 177.95 3ce6 h ASP 115 N 0.79 0.30 -2.35 -2.05 3.32 -1.97 -3.36 116.42 111.10 3ce6 h ASP 115 Ca 0.41 -0.15 -0.60 0.00 0.02 0.00 0.00 57.03 56.71 3ce6 h ASP 115 Cb 0.39 -0.08 -0.41 0.00 0.22 0.00 0.00 39.33 39.44 3ce6 h ASP 115 CO -0.26 0.76 -0.70 1.21 -1.72 0.00 0.00 179.24 178.54 3ce6 n GLU 116 N -3.95 1.94 -2.47 3.56 4.07 -0.76 -4.82 120.64 118.22 3ce6 n GLU 116 Ca -0.02 -4.30 -0.37 0.00 -0.06 0.00 0.00 57.16 52.41 3ce6 n GLU 116 Cb 0.56 -2.05 -0.03 0.00 -0.06 0.00 0.00 31.44 29.85 3ce6 n GLU 116 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 3ce6 s PRO 117 N -1.90 4.12 -0.07 5.31 0.04 -0.44 -1.22 135.00 140.84 3ce6 s PRO 117 Ca 0.36 1.61 0.12 0.00 0.04 0.00 0.00 61.00 63.12 3ce6 s PRO 117 Cb 0.11 -2.58 0.21 0.00 0.04 0.00 0.00 34.50 32.28 3ce6 s PRO 117 CO -0.07 -0.20 1.10 1.63 0.04 0.00 0.00 177.00 179.50 3ce6 n LYS 118 N -0.03 0.67 0.00 4.56 5.02 0.67 -4.87 118.16 124.17 3ce6 n LYS 118 Ca 0.05 -1.98 0.00 0.00 -2.02 0.00 0.00 58.31 54.36 3ce6 n LYS 118 Cb 0.49 -0.95 0.00 0.00 -0.02 0.00 0.00 35.03 34.55 3ce6 n LYS 118 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ce6 n GLY 119 N -0.61 2.66 3.20 0.72 0.00 0.46 -4.62 105.19 107.01 3ce6 n GLY 119 Ca 0.09 -1.67 -0.13 0.00 0.00 0.00 0.00 46.02 44.32 3ce6 n GLY 119 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ce6 s VAL 120 N 4.74 0.93 -0.02 1.61 -7.23 -0.92 -4.94 120.40 114.55 3ce6 s VAL 120 Ca 0.00 -1.95 -0.30 0.00 -1.81 0.00 0.00 61.98 57.92 3ce6 s VAL 120 Cb 0.00 -1.71 -0.07 0.00 0.56 0.00 0.00 36.38 35.16 3ce6 s VAL 120 CO 0.00 -0.78 1.82 -2.84 -0.31 0.00 0.00 175.10 173.00 3ce6 s PRO 121 N -3.65 4.10 -0.05 4.82 0.02 -1.26 -4.08 135.00 134.90 3ce6 s PRO 121 Ca 0.13 2.36 0.04 0.00 0.02 0.00 0.00 61.00 63.55 3ce6 s PRO 121 Cb 0.03 -4.09 0.00 0.00 0.02 0.00 0.00 34.50 30.46 3ce6 s PRO 121 CO -0.02 -0.97 -0.15 0.08 -0.33 0.00 0.00 177.00 175.61 3ce6 s VAL 122 N 4.46 1.31 -0.49 3.83 1.01 -1.26 -0.52 120.40 128.74 3ce6 s VAL 122 Ca 0.82 -0.64 0.03 0.00 0.00 0.00 0.00 61.98 62.19 3ce6 s VAL 122 Cb -0.37 -1.14 0.14 0.00 0.00 0.00 0.00 36.38 35.00 3ce6 s VAL 122 CO 0.35 0.38 0.28 -0.36 0.00 0.00 0.00 175.10 175.75 3ce6 s PHE 123 N 0.16 2.44 -0.29 5.22 0.40 0.10 -0.29 117.98 125.73 3ce6 s PHE 123 Ca -0.06 -2.73 -0.17 0.00 -0.60 0.00 0.00 56.93 53.37 3ce6 s PHE 123 Cb -0.12 -2.19 0.13 0.00 0.51 0.00 0.00 43.02 41.35 3ce6 s PHE 123 CO 0.02 -0.75 0.94 0.00 0.70 0.00 0.00 175.22 176.13 3ce6 s ALA 124 N -0.03 -2.17 0.18 5.36 0.00 0.07 -3.81 121.76 121.36 3ce6 s ALA 124 Ca 0.19 2.20 -0.11 0.00 0.00 0.00 0.00 51.96 54.23 3ce6 s ALA 124 Cb -0.21 -1.63 0.00 0.00 0.00 0.00 0.00 23.12 21.28 3ce6 s ALA 124 CO -0.03 -0.34 0.36 1.67 0.00 0.00 0.00 175.76 177.43 3ce6 s TRP 125 N 1.23 0.27 0.04 0.00 -2.14 -1.26 -4.24 118.94 112.84 3ce6 s TRP 125 Ca -0.07 -0.63 -0.30 0.00 2.66 0.00 0.00 56.10 57.76 3ce6 s TRP 125 Cb -0.04 0.07 -0.04 0.00 -3.10 0.00 0.00 33.47 30.36 3ce6 s TRP 125 CO -0.14 -0.79 0.99 0.21 -2.66 0.00 0.00 176.95 174.55 3ce6 s LYS 126 N -3.95 4.59 0.00 3.25 2.20 -1.26 -3.79 119.74 120.79 3ce6 s LYS 126 Ca 0.16 1.45 0.00 0.00 -0.36 0.00 0.00 55.97 57.22 3ce6 s LYS 126 Cb 0.02 -3.43 0.00 0.00 -1.51 0.00 0.00 37.83 32.91 3ce6 s LYS 126 CO 0.00 0.02 0.00 0.41 -0.36 0.00 0.00 175.35 175.42 3ce6 n GLY 127 N 2.71 0.93 3.74 5.54 0.00 0.26 -5.01 105.19 113.36 3ce6 n GLY 127 Ca 0.05 -0.55 -0.35 0.00 0.00 0.00 0.00 46.02 45.17 3ce6 n GLY 127 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ce6 s GLU 128 N -3.11 2.53 0.70 1.61 2.02 -0.69 -5.04 118.70 116.71 3ce6 s GLU 128 Ca 0.00 1.74 -0.08 0.00 0.02 0.00 0.00 54.97 56.65 3ce6 s GLU 128 Cb 0.00 -1.88 0.05 0.00 0.10 0.00 0.00 34.13 32.39 3ce6 s GLU 128 CO 0.00 -1.53 1.03 0.95 0.02 0.00 0.00 175.26 175.73 3ce6 s THR 129 N -1.88 2.69 0.23 3.63 -4.23 -1.26 -4.87 115.64 109.95 3ce6 s THR 129 Ca 0.75 -0.05 -0.07 0.00 -1.18 0.00 0.00 61.69 61.14 3ce6 s THR 129 Cb -0.29 -3.17 0.21 0.00 1.34 0.00 0.00 72.50 70.59 3ce6 s THR 129 CO 0.40 -0.19 1.88 -0.07 -0.54 0.00 0.00 174.62 176.10 3ce6 h LEU 130 N -0.61 0.92 -0.53 4.79 3.38 -1.99 0.04 115.31 121.31 3ce6 h LEU 130 Ca -0.45 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.49 3ce6 h LEU 130 Cb 1.30 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 3ce6 h LEU 130 CO 0.62 0.63 0.24 -0.33 0.09 0.00 0.00 178.44 179.68 3ce6 h GLU 131 N 1.07 0.77 -0.10 1.13 3.07 -1.97 -2.07 114.58 116.49 3ce6 h GLU 131 Ca 0.34 -0.13 -0.12 0.00 -0.50 0.00 0.00 59.36 58.95 3ce6 h GLU 131 Cb 0.01 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 27.78 3ce6 h GLU 131 CO -0.12 0.66 -0.49 0.93 -1.40 0.00 0.00 179.01 178.59 3ce6 h GLU 132 N 0.71 0.26 -0.26 2.33 5.08 -1.84 -1.68 114.58 119.17 3ce6 h GLU 132 Ca 0.18 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3ce6 h GLU 132 Cb 0.15 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 3ce6 h GLU 132 CO -0.02 0.70 0.14 -0.92 -1.00 0.00 0.00 179.01 177.91 3ce6 h TYR 133 N 0.21 0.35 -0.19 4.33 3.20 -0.65 0.27 116.97 124.49 3ce6 h TYR 133 Ca 0.01 -0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.73 3ce6 h TYR 133 Cb 0.94 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 39.09 3ce6 h TYR 133 CO 0.02 0.30 -0.47 -1.49 -1.64 0.00 0.00 178.16 174.88 3ce6 h TRP 134 N 0.30 0.59 -0.17 -3.82 4.06 -1.34 -0.55 115.95 115.03 3ce6 h TRP 134 Ca 0.09 -0.19 0.02 0.00 2.06 0.00 0.00 58.89 60.88 3ce6 h TRP 134 Cb 0.06 -0.12 -0.02 0.00 -1.00 0.00 0.00 29.16 28.08 3ce6 h TRP 134 CO -0.03 0.87 0.02 2.35 -3.56 0.00 0.00 178.44 178.08 3ce6 h TRP 135 N 0.39 0.03 -0.74 0.49 7.01 -1.18 -0.18 115.95 121.78 3ce6 h TRP 135 Ca 0.02 0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.00 3ce6 h TRP 135 Cb 0.97 0.01 -0.03 0.00 -2.10 0.00 0.00 29.16 28.01 3ce6 h TRP 135 CO 0.03 0.00 0.33 0.00 -2.79 0.00 0.00 178.44 176.02 3ce6 h ALA 136 N 1.13 1.19 -0.69 2.65 0.00 -0.79 -0.34 119.26 122.42 3ce6 h ALA 136 Ca 0.08 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3ce6 h ALA 136 Cb 0.08 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 3ce6 h ALA 136 CO -0.11 0.60 0.38 0.00 0.00 0.00 0.00 179.25 180.12 3ce6 h ALA 137 N 1.31 0.88 -0.44 0.00 0.00 -0.70 0.24 119.26 120.55 3ce6 h ALA 137 Ca 0.25 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3ce6 h ALA 137 Cb 0.14 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3ce6 h ALA 137 CO -0.03 0.38 0.12 1.49 0.00 0.00 0.00 179.25 181.22 3ce6 h GLU 138 N 0.94 0.70 -0.42 0.00 4.81 -0.38 -1.65 114.58 118.57 3ce6 h GLU 138 Ca 0.24 -0.16 0.08 0.00 -0.13 0.00 0.00 59.36 59.39 3ce6 h GLU 138 Cb 0.03 -0.10 -0.07 0.00 0.63 0.00 0.00 28.75 29.24 3ce6 h GLU 138 CO -0.04 0.69 -0.04 1.96 -0.73 0.00 0.00 179.01 180.86 3ce6 h GLN 139 N 0.58 0.07 -0.17 1.92 1.08 -0.76 -1.45 115.11 116.38 3ce6 h GLN 139 Ca 0.14 -0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.33 3ce6 h GLN 139 Cb 0.30 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 3ce6 h GLN 139 CO -0.00 0.04 0.09 1.98 -0.95 0.00 0.00 178.83 180.00 3ce6 h MET 140 N 0.07 0.23 -0.00 1.46 4.05 -0.57 -2.75 114.93 117.41 3ce6 h MET 140 Ca 0.21 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.61 3ce6 h MET 140 Cb 0.31 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.06 3ce6 h MET 140 CO -0.38 0.17 -0.46 1.28 0.23 0.00 0.00 176.91 177.75 3ce6 n LEU 141 N -4.49 0.60 -4.18 3.39 4.77 -0.65 -4.70 117.00 111.74 3ce6 n LEU 141 Ca -0.00 -0.05 -0.40 0.00 -0.03 0.00 0.00 56.01 55.53 3ce6 n LEU 141 Cb 0.09 -0.22 -0.09 0.00 -2.33 0.00 0.00 43.42 40.87 3ce6 n LEU 141 CO 0.35 0.14 -0.00 -0.89 -1.33 0.00 0.00 177.39 175.65 3ce6 s THR 142 N -2.91 4.04 0.55 -5.08 2.01 -0.60 -4.50 115.64 109.14 3ce6 s THR 142 Ca 0.13 -2.12 -0.15 0.00 0.31 0.00 0.00 61.69 59.86 3ce6 s THR 142 Cb 0.18 -3.66 -0.06 0.00 0.01 0.00 0.00 72.50 68.97 3ce6 s THR 142 CO 0.67 -0.80 1.00 0.26 -0.69 0.00 0.00 174.62 175.06 3ce6 s TRP 143 N 0.95 3.43 0.29 4.92 0.52 -1.26 -4.91 118.94 122.87 3ce6 s TRP 143 Ca 0.09 1.44 0.08 0.00 0.02 0.00 0.00 56.10 57.73 3ce6 s TRP 143 Cb -0.23 -2.80 0.44 0.00 -1.15 0.00 0.00 33.47 29.72 3ce6 s TRP 143 CO -0.03 -0.53 1.68 -1.00 0.02 0.00 0.00 176.95 177.09 3ce6 h PRO 144 N 0.59 0.16 -5.63 4.98 0.13 -1.97 -3.39 132.00 126.87 3ce6 h PRO 144 Ca -0.46 -0.09 -0.64 0.00 -0.87 0.00 0.00 66.00 63.95 3ce6 h PRO 144 Cb 1.19 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.19 3ce6 h PRO 144 CO 0.61 0.61 0.26 0.34 -0.23 0.00 0.00 178.00 179.59 3ce6 s ASP 145 N -6.89 6.39 0.47 1.44 -1.08 -1.26 -4.92 116.67 110.82 3ce6 s ASP 145 Ca -0.04 -0.16 0.24 0.00 -0.52 0.00 0.00 52.55 52.08 3ce6 s ASP 145 Cb 0.13 -2.36 1.33 0.00 -1.46 0.00 0.00 42.92 40.56 3ce6 s ASP 145 CO 0.77 -0.84 1.72 1.55 0.52 0.00 0.00 175.17 178.88 3ce6 h PRO 146 N 8.89 0.00 -0.03 4.34 0.13 -2.02 0.24 132.00 143.55 3ce6 h PRO 146 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 3ce6 h PRO 146 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 3ce6 h PRO 146 CO 0.93 0.00 -0.05 -0.25 -0.23 0.00 0.00 178.00 178.40 3ce6 n ASP 147 N -2.48 2.63 -3.19 1.44 8.00 -1.26 -4.43 116.55 117.26 3ce6 n ASP 147 Ca -0.02 -1.85 -0.23 0.00 0.71 0.00 0.00 54.79 53.41 3ce6 n ASP 147 Cb 0.23 0.05 -0.05 0.00 -0.02 0.00 0.00 41.12 41.32 3ce6 n ASP 147 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3ce6 n LYS 148 N 0.99 1.40 -0.85 -1.24 5.02 0.83 -5.12 118.16 119.21 3ce6 n LYS 148 Ca 0.14 -3.70 -0.29 0.00 -2.02 0.00 0.00 58.31 52.44 3ce6 n LYS 148 Cb 0.54 -1.68 0.23 0.00 -0.02 0.00 0.00 35.03 34.11 3ce6 n LYS 148 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 3ce6 s PRO 149 N -2.13 -0.81 0.22 1.97 0.02 -1.23 -4.50 135.00 128.54 3ce6 s PRO 149 Ca 0.39 0.45 -0.31 0.00 0.02 0.00 0.00 61.00 61.55 3ce6 s PRO 149 Cb 0.25 -1.60 -0.15 0.00 0.02 0.00 0.00 34.50 33.02 3ce6 s PRO 149 CO -0.09 -3.55 1.11 0.00 -0.33 0.00 0.00 177.00 174.14 3ce6 n ALA 150 N -4.74 -0.51 0.11 -1.55 0.00 -1.26 -4.89 120.51 107.68 3ce6 n ALA 150 Ca 0.06 0.43 0.01 0.00 0.00 0.00 0.00 53.44 53.95 3ce6 n ALA 150 Cb 0.57 -2.03 0.00 0.00 0.00 0.00 0.00 19.45 17.99 3ce6 n ALA 150 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3ce6 n ASN 151 N 1.74 0.78 -3.82 0.00 0.23 -0.58 -3.76 115.26 109.85 3ce6 n ASN 151 Ca 0.13 -0.89 -0.11 0.00 -0.53 0.00 0.00 54.58 53.18 3ce6 n ASN 151 Cb 0.28 0.40 -0.08 0.00 -2.08 0.00 0.00 39.78 38.29 3ce6 n ASN 151 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 3ce6 s MET 152 N -0.63 0.71 -0.02 -3.83 -1.94 -1.03 -0.60 119.30 111.96 3ce6 s MET 152 Ca 0.02 -0.57 0.07 0.00 -1.71 0.00 0.00 55.69 53.51 3ce6 s MET 152 Cb 0.02 0.30 -0.02 0.00 2.01 0.00 0.00 34.83 37.14 3ce6 s MET 152 CO 0.06 -0.21 -0.24 0.42 -0.01 0.00 0.00 175.02 175.05 3ce6 s ILE 153 N -2.43 1.87 -0.24 2.53 1.01 -0.56 -1.48 121.20 121.89 3ce6 s ILE 153 Ca -0.06 -1.01 0.02 0.00 0.00 0.00 0.00 60.65 59.60 3ce6 s ILE 153 Cb -0.02 -1.55 0.06 0.00 0.01 0.00 0.00 42.46 40.96 3ce6 s ILE 153 CO -0.03 0.53 -0.10 -0.22 0.00 0.00 0.00 174.94 175.12 3ce6 s LEU 154 N -0.53 3.01 0.10 2.97 0.20 -0.59 -1.75 118.68 122.10 3ce6 s LEU 154 Ca 0.08 -1.25 0.07 0.00 0.69 0.00 0.00 54.13 53.73 3ce6 s LEU 154 Cb -0.09 -1.40 -0.03 0.00 -0.43 0.00 0.00 46.19 44.23 3ce6 s LEU 154 CO -0.01 -0.19 -0.19 -0.62 -0.29 0.00 0.00 176.35 175.05 3ce6 s ASP 155 N 1.23 2.34 -0.26 3.68 -1.08 0.59 -0.13 116.67 123.04 3ce6 s ASP 155 Ca -0.07 -0.70 -0.04 0.00 -0.52 0.00 0.00 52.55 51.23 3ce6 s ASP 155 Cb -0.19 -0.12 0.09 0.00 -1.46 0.00 0.00 42.92 41.24 3ce6 s ASP 155 CO -0.06 0.01 0.11 -0.62 0.52 0.00 0.00 175.17 175.12 3ce6 s ASP 156 N -2.00 3.27 0.00 -0.34 -1.08 -0.41 -1.04 116.67 115.07 3ce6 s ASP 156 Ca 0.06 -1.13 0.00 0.00 -0.52 0.00 0.00 52.55 50.96 3ce6 s ASP 156 Cb -0.09 -0.42 0.00 0.00 -1.46 0.00 0.00 42.92 40.95 3ce6 s ASP 156 CO 0.04 -0.40 0.00 0.61 0.52 0.00 0.00 175.17 175.94 3ce6 n GLY 157 N 5.18 0.92 2.11 2.66 0.00 -1.26 -4.62 105.19 110.18 3ce6 n GLY 157 Ca -0.06 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.94 3ce6 n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ce6 n GLY 158 N -1.27 0.55 0.21 -0.02 0.00 -1.26 -4.19 105.19 99.21 3ce6 n GLY 158 Ca 0.00 -0.62 -0.11 0.00 0.00 0.00 0.00 46.02 45.29 3ce6 n GLY 158 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3ce6 h ASP 159 N 0.00 0.64 -0.03 1.61 3.32 -1.94 0.27 116.42 120.29 3ce6 h ASP 159 Ca -0.04 -0.37 -0.01 0.00 0.02 0.00 0.00 57.03 56.63 3ce6 h ASP 159 Cb 0.18 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 3ce6 h ASP 159 CO 0.06 1.10 -0.00 0.00 -1.72 0.00 0.00 179.24 178.68 3ce6 h ALA 160 N 0.90 0.04 -0.85 3.45 0.00 -1.93 -1.33 119.26 119.54 3ce6 h ALA 160 Ca -0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 3ce6 h ALA 160 Cb 1.18 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 3ce6 h ALA 160 CO 0.12 -0.28 0.49 1.15 0.00 0.00 0.00 179.25 180.72 3ce6 h THR 161 N -0.27 1.24 -0.39 0.00 2.02 -1.94 -2.18 112.91 111.39 3ce6 h THR 161 Ca 0.01 -0.57 -0.01 0.00 0.77 0.00 0.00 66.41 66.61 3ce6 h THR 161 Cb 0.35 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 3ce6 h THR 161 CO 0.00 0.26 0.20 -0.03 0.37 0.00 0.00 175.52 176.32 3ce6 h MET 162 N 1.18 0.56 -0.50 6.66 -1.53 -0.77 0.17 114.93 120.71 3ce6 h MET 162 Ca 0.30 -0.08 -0.01 0.00 -3.44 0.00 0.00 59.70 56.48 3ce6 h MET 162 Cb -0.01 -0.10 -0.02 0.00 -0.55 0.00 0.00 31.60 30.92 3ce6 h MET 162 CO -0.05 0.48 0.29 1.25 0.14 0.00 0.00 176.91 179.02 3ce6 h LEU 163 N 0.50 0.61 0.09 3.39 5.85 -1.01 0.76 115.31 125.49 3ce6 h LEU 163 Ca 0.14 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 3ce6 h LEU 163 Cb 0.10 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.98 3ce6 h LEU 163 CO -0.02 0.50 -0.04 0.58 -0.34 0.00 0.00 178.44 179.12 3ce6 h VAL 164 N 0.66 1.12 -0.43 1.05 2.07 -1.11 0.74 116.25 120.35 3ce6 h VAL 164 Ca 0.18 -0.83 -0.15 0.00 0.82 0.00 0.00 66.70 66.72 3ce6 h VAL 164 Cb 0.02 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 3ce6 h VAL 164 CO -0.03 0.20 -0.32 -0.07 0.02 0.00 0.00 177.57 177.37 3ce6 h LEU 165 N -0.51 1.02 -0.57 2.57 3.38 -0.53 -0.71 115.31 119.97 3ce6 h LEU 165 Ca -0.01 -0.44 -0.16 0.00 0.09 0.00 0.00 57.88 57.36 3ce6 h LEU 165 Cb 0.42 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3ce6 h LEU 165 CO 0.02 1.24 -0.60 0.03 0.09 0.00 0.00 178.44 179.22 3ce6 h ARG 166 N 0.80 0.39 -0.74 1.13 2.47 -0.93 -0.66 114.38 116.84 3ce6 h ARG 166 Ca 0.08 -0.27 -0.04 0.00 -1.26 0.00 0.00 59.98 58.50 3ce6 h ARG 166 Cb 0.91 0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 29.23 3ce6 h ARG 166 CO 0.08 0.87 0.32 0.78 0.56 0.00 0.00 179.97 182.59 3ce6 h GLY 167 N 1.26 1.17 1.52 0.04 0.00 -0.67 -1.58 103.07 104.81 3ce6 h GLY 167 Ca -0.00 -0.62 -0.18 0.00 0.00 0.00 0.00 47.33 46.53 3ce6 h GLY 167 CO 0.10 0.58 -0.70 1.98 0.00 0.00 0.00 176.54 178.51 3ce6 h MET 168 N 1.05 0.48 -0.11 4.80 1.85 -0.76 -2.24 114.93 120.00 3ce6 h MET 168 Ca 0.25 -0.37 0.01 0.00 -0.61 0.00 0.00 59.70 58.98 3ce6 h MET 168 Cb 0.18 0.07 -0.01 0.00 0.43 0.00 0.00 31.60 32.27 3ce6 h MET 168 CO -0.02 1.00 0.03 0.37 -0.40 0.00 0.00 176.91 177.88 3ce6 h GLN 169 N 0.34 0.08 -0.33 0.39 4.15 -0.59 -0.84 115.11 118.30 3ce6 h GLN 169 Ca -0.03 -0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.28 3ce6 h GLN 169 Cb 1.27 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.93 3ce6 h GLN 169 CO 0.12 0.05 -0.26 1.88 -1.93 0.00 0.00 178.83 178.70 3ce6 h TYR 170 N 0.08 0.77 -0.17 3.99 0.05 -1.22 -0.89 116.97 119.58 3ce6 h TYR 170 Ca 0.05 -0.18 0.03 0.00 0.05 0.00 0.00 58.73 58.68 3ce6 h TYR 170 Cb 0.03 -0.18 -0.03 0.00 1.01 0.00 0.00 36.73 37.56 3ce6 h TYR 170 CO -0.10 0.87 -0.02 0.93 -1.05 0.00 0.00 178.16 178.79 3ce6 h GLU 171 N 0.59 0.03 -0.35 4.88 5.08 -1.21 0.04 114.58 123.64 3ce6 h GLU 171 Ca 0.08 -0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.34 3ce6 h GLU 171 Cb 0.75 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 3ce6 h GLU 171 CO 0.06 0.02 -0.18 0.87 -1.00 0.00 0.00 179.01 178.79 3ce6 h LYS 172 N 0.03 0.65 0.00 2.33 1.57 -0.86 -2.00 116.57 118.30 3ce6 h LYS 172 Ca 0.08 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 3ce6 h LYS 172 Cb 0.11 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3ce6 h LYS 172 CO -0.15 0.79 0.00 0.00 -0.57 0.00 0.00 179.45 179.52 3ce6 h ALA 173 N 1.22 1.00 -0.23 3.86 0.00 -0.86 -3.47 119.26 120.78 3ce6 h ALA 173 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 3ce6 h ALA 173 Cb 0.63 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 3ce6 h ALA 173 CO 0.04 0.00 -0.09 0.41 0.00 0.00 0.00 179.25 179.61 3ce6 n GLY 174 N 0.24 0.68 3.63 0.00 0.00 -0.08 -5.00 105.19 104.67 3ce6 n GLY 174 Ca 0.02 -0.26 -0.11 0.00 0.00 0.00 0.00 46.02 45.67 3ce6 n GLY 174 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ce6 s VAL 175 N -1.92 0.00 -0.32 1.61 0.11 -0.70 -5.00 120.40 114.18 3ce6 s VAL 175 Ca 0.00 0.00 -0.24 0.00 -2.93 0.00 0.00 61.98 58.81 3ce6 s VAL 175 Cb 0.00 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 3ce6 s VAL 175 CO 0.00 0.00 0.81 -0.69 -3.33 0.00 0.00 175.10 171.89 3ce6 s VAL 176 N 0.98 4.76 0.60 2.04 1.01 -1.26 -4.64 120.40 123.89 3ce6 s VAL 176 Ca -0.05 1.18 -0.19 0.00 0.00 0.00 0.00 61.98 62.92 3ce6 s VAL 176 Cb -0.05 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 3ce6 s VAL 176 CO -0.09 -0.29 1.10 -0.81 0.00 0.00 0.00 175.10 175.01 3ce6 n PRO 177 N 6.28 1.07 -1.70 2.72 -0.04 -1.26 -4.95 135.00 137.13 3ce6 n PRO 177 Ca 0.04 0.41 -0.34 0.00 -0.04 0.00 0.00 63.50 63.57 3ce6 n PRO 177 Cb 0.48 -2.31 0.06 0.00 -0.04 0.00 0.00 33.50 31.69 3ce6 n PRO 177 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3ce6 s PRO 178 N -2.91 2.57 0.39 0.54 0.04 -1.26 -5.00 135.00 129.37 3ce6 s PRO 178 Ca 0.77 1.66 -0.08 0.00 0.04 0.00 0.00 61.00 63.39 3ce6 s PRO 178 Cb -0.41 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.18 3ce6 s PRO 178 CO 0.46 -1.48 0.71 0.00 0.04 0.00 0.00 177.00 176.73 3ce6 s ALA 179 N -1.99 3.44 0.23 8.56 0.00 -1.26 -5.08 121.76 125.67 3ce6 s ALA 179 Ca 0.73 -0.38 -0.22 0.00 0.00 0.00 0.00 51.96 52.10 3ce6 s ALA 179 Cb -0.27 -2.55 -0.09 0.00 0.00 0.00 0.00 23.12 20.21 3ce6 s ALA 179 CO 0.40 -0.01 0.77 -1.21 0.00 0.00 0.00 175.76 175.72 3ce6 s GLU 180 N -3.95 4.35 0.43 0.00 0.41 -1.26 -4.96 118.70 113.72 3ce6 s GLU 180 Ca 0.48 0.99 0.25 0.00 -0.41 0.00 0.00 54.97 56.28 3ce6 s GLU 180 Cb -0.10 -2.91 1.28 0.00 -1.78 0.00 0.00 34.13 30.61 3ce6 s GLU 180 CO 0.34 0.39 1.72 1.05 -0.49 0.00 0.00 175.26 178.27 3ce6 h GLU 181 N 3.48 0.23 -0.66 1.61 4.11 -2.02 0.09 114.58 121.42 3ce6 h GLU 181 Ca -0.48 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.94 3ce6 h GLU 181 Cb 1.19 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.39 3ce6 h GLU 181 CO 0.65 0.15 0.00 -0.40 0.07 0.00 0.00 179.01 179.48 3ce6 n ASP 182 N -4.59 4.25 -4.76 3.06 5.75 -1.26 -4.93 116.55 114.07 3ce6 n ASP 182 Ca 0.30 -2.30 -0.35 0.00 -0.01 0.00 0.00 54.79 52.43 3ce6 n ASP 182 Cb 1.13 -0.53 0.04 0.00 -1.03 0.00 0.00 41.12 40.73 3ce6 n ASP 182 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 3ce6 s ASP 183 N -0.90 5.18 0.64 -1.12 1.01 0.02 -4.98 116.67 116.52 3ce6 s ASP 183 Ca 0.47 2.28 -0.18 0.00 0.71 0.00 0.00 52.55 55.83 3ce6 s ASP 183 Cb 0.29 -2.59 -0.01 0.00 1.01 0.00 0.00 42.92 41.62 3ce6 s ASP 183 CO 0.25 -1.59 1.23 -2.84 0.21 0.00 0.00 175.17 172.43 3ce6 s PRO 184 N -3.51 2.65 0.33 8.23 0.02 -1.26 -4.85 135.00 136.61 3ce6 s PRO 184 Ca 0.74 1.87 0.07 0.00 0.02 0.00 0.00 61.00 63.70 3ce6 s PRO 184 Cb -0.27 -1.88 0.77 0.00 0.02 0.00 0.00 34.50 33.13 3ce6 s PRO 184 CO 0.34 -1.47 1.83 0.00 -0.33 0.00 0.00 177.00 177.38 3ce6 h ALA 185 N 0.49 1.76 -0.11 -1.55 0.00 -1.96 -0.51 119.26 117.37 3ce6 h ALA 185 Ca -0.50 0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.30 3ce6 h ALA 185 Cb 1.31 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 3ce6 h ALA 185 CO 0.53 -0.05 -0.58 1.49 0.00 0.00 0.00 179.25 180.64 3ce6 h GLU 186 N 0.75 0.37 -0.80 0.00 4.81 -2.00 -2.33 114.58 115.39 3ce6 h GLU 186 Ca 0.50 -0.25 -0.03 0.00 -0.13 0.00 0.00 59.36 59.46 3ce6 h GLU 186 Cb 0.78 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.16 3ce6 h GLU 186 CO -0.27 0.85 0.39 2.35 -0.73 0.00 0.00 179.01 181.60 3ce6 h TRP 187 N 0.28 1.15 -0.65 0.92 2.91 -1.45 0.13 115.95 119.24 3ce6 h TRP 187 Ca -0.00 -0.06 -0.05 0.00 1.13 0.00 0.00 58.89 59.92 3ce6 h TRP 187 Cb 1.10 -0.36 -0.03 0.00 -0.51 0.00 0.00 29.16 29.37 3ce6 h TRP 187 CO 0.03 0.84 0.22 0.87 -1.03 0.00 0.00 178.44 179.37 3ce6 h LYS 188 N 1.13 1.00 -0.09 2.65 1.57 -1.29 0.26 116.57 121.81 3ce6 h LYS 188 Ca 0.27 -0.20 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 3ce6 h LYS 188 Cb 0.12 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 3ce6 h LYS 188 CO -0.03 0.87 0.04 0.28 -0.57 0.00 0.00 179.45 180.03 3ce6 h VAL 189 N 0.94 1.11 0.18 0.50 2.07 -1.09 0.34 116.25 120.29 3ce6 h VAL 189 Ca 0.21 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 3ce6 h VAL 189 Cb 0.27 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 3ce6 h VAL 189 CO -0.01 0.09 -0.08 0.15 0.02 0.00 0.00 177.57 177.74 3ce6 h PHE 190 N 0.02 -0.22 -0.68 1.57 3.57 -0.74 -0.85 116.94 119.61 3ce6 h PHE 190 Ca 0.03 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 3ce6 h PHE 190 Cb 0.11 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.89 3ce6 h PHE 190 CO -0.03 -0.13 0.28 -0.07 -2.23 0.00 0.00 178.31 176.13 3ce6 h LEU 191 N -0.25 0.91 -0.76 0.59 3.38 -0.91 -2.53 115.31 115.75 3ce6 h LEU 191 Ca -0.02 -0.12 0.08 0.00 0.09 0.00 0.00 57.88 57.90 3ce6 h LEU 191 Cb 0.19 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.64 3ce6 h LEU 191 CO 0.04 0.81 0.43 0.78 0.09 0.00 0.00 178.44 180.59 3ce6 h ASN 192 N 0.98 0.61 -0.08 -0.43 2.35 -0.49 0.54 115.58 119.07 3ce6 h ASN 192 Ca 0.23 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 56.02 3ce6 h ASN 192 Cb 0.17 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.46 3ce6 h ASN 192 CO -0.02 0.37 0.04 0.25 -1.65 0.00 0.00 177.43 176.42 3ce6 h LEU 193 N 0.74 0.10 -0.33 1.61 6.46 -0.76 -0.47 115.31 122.66 3ce6 h LEU 193 Ca 0.36 -0.09 -0.07 0.00 -0.12 0.00 0.00 57.88 57.96 3ce6 h LEU 193 Cb 0.29 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.19 3ce6 h LEU 193 CO -0.22 0.17 -0.05 -0.07 -0.62 0.00 0.00 178.44 177.64 3ce6 h LEU 194 N 0.03 0.62 -0.65 2.25 3.38 -1.06 -2.49 115.31 117.39 3ce6 h LEU 194 Ca 0.03 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 3ce6 h LEU 194 Cb 0.09 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 3ce6 h LEU 194 CO -0.00 0.82 0.31 -0.09 0.09 0.00 0.00 178.44 179.56 3ce6 h ARG 195 N 0.41 0.93 -0.43 1.13 2.43 0.28 -1.36 114.38 117.77 3ce6 h ARG 195 Ca 0.09 -0.14 -0.10 0.00 -0.81 0.00 0.00 59.98 59.02 3ce6 h ARG 195 Cb 0.53 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 3ce6 h ARG 195 CO 0.03 0.75 -0.11 1.15 -1.51 0.00 0.00 179.97 180.28 3ce6 h THR 196 N 0.89 1.27 -0.03 0.20 2.02 -1.09 -2.89 112.91 113.29 3ce6 h THR 196 Ca 0.22 -1.22 -0.12 0.00 0.77 0.00 0.00 66.41 66.06 3ce6 h THR 196 Cb 0.13 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 3ce6 h THR 196 CO -0.03 0.41 -0.56 -0.09 0.37 0.00 0.00 175.52 175.63 3ce6 h ARG 197 N 0.67 0.09 0.00 6.66 9.65 -1.31 -2.33 114.38 127.81 3ce6 h ARG 197 Ca 0.11 -0.06 -0.03 0.00 -1.10 0.00 0.00 59.98 58.90 3ce6 h ARG 197 Cb 0.64 0.01 -0.00 0.00 -1.39 0.00 0.00 29.97 29.23 3ce6 h ARG 197 CO 0.04 0.63 -0.14 0.35 2.80 0.00 0.00 179.97 183.65 3ce6 h PHE 198 N 0.07 0.00 -0.51 2.20 3.57 -1.05 0.03 116.94 121.26 3ce6 h PHE 198 Ca -0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 3ce6 h PHE 198 Cb 1.00 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.72 3ce6 h PHE 198 CO 0.01 0.14 0.28 0.93 -2.23 0.00 0.00 178.31 177.44 3ce6 h GLU 199 N 0.00 0.70 0.00 1.11 5.08 -1.27 -3.31 114.58 116.89 3ce6 h GLU 199 Ca -0.00 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3ce6 h GLU 199 Cb 0.44 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3ce6 h GLU 199 CO 0.02 0.52 -0.26 0.25 -1.00 0.00 0.00 179.01 178.53 3ce6 n THR 200 N -4.41 0.00 -3.50 1.13 -2.24 -0.90 -4.98 114.28 99.38 3ce6 n THR 200 Ca 0.04 -0.38 -0.16 0.00 -2.27 0.00 0.00 64.05 61.28 3ce6 n THR 200 Cb 0.10 0.91 -0.12 0.00 -2.10 0.00 0.00 70.33 69.12 3ce6 n THR 200 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ce6 s ASP 201 N -1.38 0.97 0.09 3.42 -1.08 -0.05 -5.03 116.67 113.61 3ce6 s ASP 201 Ca 0.01 0.02 0.23 0.00 -0.52 0.00 0.00 52.55 52.29 3ce6 s ASP 201 Cb 0.02 0.57 0.16 0.00 -1.46 0.00 0.00 42.92 42.21 3ce6 s ASP 201 CO 0.09 -0.30 1.14 0.29 0.52 0.00 0.00 175.17 176.91 3ce6 n LYS 202 N 5.33 0.33 -0.56 4.34 4.76 -1.26 -4.15 118.16 126.95 3ce6 n LYS 202 Ca -0.05 0.04 0.04 0.00 -2.87 0.00 0.00 58.31 55.47 3ce6 n LYS 202 Cb 0.50 -1.65 0.07 0.00 -1.84 0.00 0.00 35.03 32.10 3ce6 n LYS 202 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 3ce6 n ASP 203 N -2.10 1.03 0.26 4.39 5.75 -1.26 -4.84 116.55 119.78 3ce6 n ASP 203 Ca 0.02 -2.52 -0.17 0.00 -0.01 0.00 0.00 54.79 52.12 3ce6 n ASP 203 Cb 0.45 -0.32 -0.08 0.00 -1.03 0.00 0.00 41.12 40.14 3ce6 n ASP 203 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 3ce6 h LYS 204 N 0.28 -0.81 -0.23 0.11 3.64 -1.97 -1.16 116.57 116.42 3ce6 h LYS 204 Ca -0.04 0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.30 3ce6 h LYS 204 Cb 1.33 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 33.32 3ce6 h LYS 204 CO 0.02 -0.54 -0.27 -1.49 -2.27 0.00 0.00 179.45 174.89 3ce6 h TRP 205 N -0.84 0.50 -0.54 1.91 4.06 -1.90 -1.58 115.95 117.56 3ce6 h TRP 205 Ca -0.04 -0.11 -0.04 0.00 2.06 0.00 0.00 58.89 60.76 3ce6 h TRP 205 Cb 0.73 -0.12 -0.02 0.00 -1.00 0.00 0.00 29.16 28.75 3ce6 h TRP 205 CO -0.20 0.68 0.19 1.15 -3.56 0.00 0.00 178.44 176.71 3ce6 h THR 206 N 0.39 1.23 -0.27 1.49 2.02 -1.81 0.55 112.91 116.51 3ce6 h THR 206 Ca 0.06 -0.74 -0.11 0.00 0.77 0.00 0.00 66.41 66.38 3ce6 h THR 206 Cb 0.69 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 3ce6 h THR 206 CO 0.05 0.28 -0.30 0.11 0.37 0.00 0.00 175.52 176.03 3ce6 h LYS 207 N 0.75 0.56 0.12 6.66 1.57 -1.00 0.35 116.57 125.57 3ce6 h LYS 207 Ca 0.18 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 3ce6 h LYS 207 Cb 0.24 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3ce6 h LYS 207 CO -0.01 0.80 -0.06 0.82 -0.57 0.00 0.00 179.45 180.44 3ce6 h ILE 208 N 0.49 0.95 -0.75 1.86 2.04 -0.89 -0.95 117.51 120.25 3ce6 h ILE 208 Ca 0.06 -0.24 0.07 0.00 1.00 0.00 0.00 64.86 65.75 3ce6 h ILE 208 Cb 0.77 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.89 3ce6 h ILE 208 CO 0.06 0.06 0.43 0.00 0.00 0.00 0.00 178.15 178.70 3ce6 h ALA 209 N 0.60 1.03 0.00 1.87 0.00 -0.78 -0.14 119.26 121.83 3ce6 h ALA 209 Ca -0.02 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3ce6 h ALA 209 Cb 0.22 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3ce6 h ALA 209 CO 0.03 0.11 -0.24 0.93 0.00 0.00 0.00 179.25 180.07 3ce6 h GLU 210 N 0.77 0.00 0.00 0.00 5.08 -0.76 -3.14 114.58 116.53 3ce6 h GLU 210 Ca 0.34 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.47 3ce6 h GLU 210 Cb 0.23 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 3ce6 h GLU 210 CO -0.20 0.24 -1.20 1.03 -1.00 0.00 0.00 179.01 177.88 3ce6 h SER 211 N 0.00 0.01 -2.87 1.42 0.87 0.32 -3.45 113.55 109.84 3ce6 h SER 211 Ca -0.00 -0.01 -0.55 0.00 -1.23 0.00 0.00 61.79 60.00 3ce6 h SER 211 Cb 0.50 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 3ce6 h SER 211 CO 0.03 1.01 0.88 -0.69 -0.53 0.00 0.00 176.83 177.53 3ce6 s VAL 212 N -2.68 3.81 -0.33 2.23 1.01 -0.23 -4.51 120.40 119.69 3ce6 s VAL 212 Ca -0.01 1.13 0.23 0.00 0.00 0.00 0.00 61.98 63.33 3ce6 s VAL 212 Cb 0.09 -3.73 -0.07 0.00 0.00 0.00 0.00 36.38 32.68 3ce6 s VAL 212 CO 0.82 -0.03 0.99 0.29 0.00 0.00 0.00 175.10 177.17 3ce6 n LYS 213 N 5.82 0.51 0.00 2.72 5.02 0.23 -4.82 118.16 127.64 3ce6 n LYS 213 Ca 0.14 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 3ce6 n LYS 213 Cb 0.44 -1.72 0.00 0.00 -0.02 0.00 0.00 35.03 33.73 3ce6 n LYS 213 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ce6 n GLY 214 N 1.25 0.81 3.24 0.72 0.00 -1.26 -4.26 105.19 105.69 3ce6 n GLY 214 Ca 0.00 -0.76 -0.24 0.00 0.00 0.00 0.00 46.02 45.03 3ce6 n GLY 214 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ce6 s VAL 215 N -2.00 1.55 -0.10 1.61 0.11 -0.41 -1.50 120.40 119.66 3ce6 s VAL 215 Ca 0.00 -1.26 -0.00 0.00 -2.93 0.00 0.00 61.98 57.79 3ce6 s VAL 215 Cb 0.00 -1.38 -0.03 0.00 -1.53 0.00 0.00 36.38 33.45 3ce6 s VAL 215 CO 0.00 0.08 -0.07 0.42 -3.33 0.00 0.00 175.10 172.20 3ce6 s THR 216 N -0.93 3.68 -0.08 5.04 -4.23 -0.72 -0.83 115.64 117.58 3ce6 s THR 216 Ca 0.06 -0.47 0.02 0.00 -1.18 0.00 0.00 61.69 60.12 3ce6 s THR 216 Cb -0.09 -2.54 0.01 0.00 1.34 0.00 0.00 72.50 71.23 3ce6 s THR 216 CO 0.02 0.56 -0.13 -0.70 -0.54 0.00 0.00 174.62 173.84 3ce6 s GLU 217 N -0.38 1.86 0.06 3.99 2.56 -0.41 -0.30 118.70 126.08 3ce6 s GLU 217 Ca 0.06 -0.45 0.22 0.00 0.00 0.00 0.00 54.97 54.80 3ce6 s GLU 217 Cb -0.12 -1.58 -0.15 0.00 2.00 0.00 0.00 34.13 34.28 3ce6 s GLU 217 CO 0.02 -0.02 0.78 -1.91 -0.56 0.00 0.00 175.26 173.57 3ce6 n GLU 218 N 4.01 0.53 -4.22 4.30 0.00 -0.20 -0.85 120.64 124.22 3ce6 n GLU 218 Ca -0.21 -0.05 -0.18 0.00 0.00 0.00 0.00 57.16 56.72 3ce6 n GLU 218 Cb 0.51 -1.63 -0.11 0.00 0.00 0.00 0.00 31.44 30.22 3ce6 n GLU 218 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.13 177.05 3ce6 s THR 219 N -3.38 1.26 0.28 6.31 -1.32 -1.26 -3.49 115.64 114.03 3ce6 s THR 219 Ca -0.03 -1.62 0.00 0.00 -1.21 0.00 0.00 61.69 58.84 3ce6 s THR 219 Cb 0.13 -1.42 0.28 0.00 -1.51 0.00 0.00 72.50 69.97 3ce6 s THR 219 CO 0.85 -0.38 1.84 0.74 -2.21 0.00 0.00 174.62 175.46 3ce6 h THR 220 N 3.70 0.94 -0.39 5.08 2.02 -1.94 -0.72 112.91 121.60 3ce6 h THR 220 Ca -0.40 -0.35 0.02 0.00 0.77 0.00 0.00 66.41 66.45 3ce6 h THR 220 Cb 1.19 -0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.42 3ce6 h THR 220 CO 0.48 0.18 0.23 0.74 0.37 0.00 0.00 175.52 177.53 3ce6 h THR 221 N 1.01 1.04 -0.35 3.16 2.02 -1.94 -1.39 112.91 116.47 3ce6 h THR 221 Ca 0.48 -0.16 -0.08 0.00 0.77 0.00 0.00 66.41 67.43 3ce6 h THR 221 Cb 0.44 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 3ce6 h THR 221 CO -0.25 0.08 -0.10 1.23 0.37 0.00 0.00 175.52 176.85 3ce6 h GLY 222 N 0.46 0.64 1.39 2.16 0.00 -1.41 -2.25 103.07 104.07 3ce6 h GLY 222 Ca 0.15 -0.45 -0.16 0.00 0.00 0.00 0.00 47.33 46.87 3ce6 h GLY 222 CO -0.07 0.41 -0.52 -2.08 0.00 0.00 0.00 176.54 174.28 3ce6 h VAL 223 N 0.55 1.31 -0.43 4.60 2.07 -0.63 -1.18 116.25 122.54 3ce6 h VAL 223 Ca 0.10 -1.74 0.08 0.00 0.82 0.00 0.00 66.70 65.96 3ce6 h VAL 223 Cb 0.50 1.69 -0.07 0.00 -1.52 0.00 0.00 31.29 31.90 3ce6 h VAL 223 CO 0.03 0.55 0.03 0.25 0.02 0.00 0.00 177.57 178.45 3ce6 h LEU 224 N 0.50 -0.12 -1.11 2.57 5.85 -1.05 -0.08 115.31 121.87 3ce6 h LEU 224 Ca 0.02 0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 3ce6 h LEU 224 Cb 1.08 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.24 3ce6 h LEU 224 CO 0.10 -0.03 -0.11 0.03 -0.34 0.00 0.00 178.44 178.10 3ce6 h ARG 225 N 0.14 0.50 -0.52 1.25 3.08 -0.98 -1.35 114.38 116.50 3ce6 h ARG 225 Ca 0.21 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 3ce6 h ARG 225 Cb 0.29 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 3ce6 h ARG 225 CO -0.33 0.61 0.10 -0.07 -1.07 0.00 0.00 179.97 179.21 3ce6 h LEU 226 N 0.46 0.82 -0.89 3.04 3.38 -0.38 -0.06 115.31 121.68 3ce6 h LEU 226 Ca 0.09 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 3ce6 h LEU 226 Cb 0.47 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 3ce6 h LEU 226 CO 0.03 0.86 0.55 1.88 0.09 0.00 0.00 178.44 181.85 3ce6 h TYR 227 N 0.74 1.15 -0.49 1.13 0.05 -0.19 -0.34 116.97 119.02 3ce6 h TYR 227 Ca 0.16 0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.91 3ce6 h TYR 227 Cb 0.38 -0.38 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 3ce6 h TYR 227 CO 0.03 0.75 0.17 1.96 -1.05 0.00 0.00 178.16 180.02 3ce6 h GLN 228 N 1.21 0.75 -0.40 4.88 4.20 -1.08 0.15 115.11 124.82 3ce6 h GLN 228 Ca 0.32 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.88 3ce6 h GLN 228 Cb -0.08 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.56 3ce6 h GLN 228 CO -0.06 0.69 0.25 0.74 -0.67 0.00 0.00 178.83 179.78 3ce6 h PHE 229 N 0.66 0.52 -0.11 2.96 0.04 -0.61 -2.95 116.94 117.45 3ce6 h PHE 229 Ca 0.16 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.93 3ce6 h PHE 229 Cb 0.24 -0.17 -0.00 0.00 2.20 0.00 0.00 35.95 38.21 3ce6 h PHE 229 CO 0.01 0.35 0.04 0.00 -0.60 0.00 0.00 178.31 178.12 3ce6 h ALA 230 N 1.13 0.15 -0.92 2.45 0.00 -0.88 0.21 119.26 121.39 3ce6 h ALA 230 Ca 0.15 -0.11 0.26 0.00 0.00 0.00 0.00 54.91 55.21 3ce6 h ALA 230 Cb -0.03 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 17.57 3ce6 h ALA 230 CO -0.03 -0.25 0.34 0.00 0.00 0.00 0.00 179.25 179.30 3ce6 h ALA 231 N 0.87 1.48 -0.05 0.00 0.00 -0.72 -1.93 119.26 118.92 3ce6 h ALA 231 Ca 0.04 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3ce6 h ALA 231 Cb 0.19 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3ce6 h ALA 231 CO -0.00 -0.49 0.00 0.00 0.00 0.00 0.00 179.25 178.75 3ce6 n ALA 232 N -2.58 2.60 -1.39 0.00 0.00 -0.91 -4.91 120.51 113.31 3ce6 n ALA 232 Ca 0.25 -0.31 -0.07 0.00 0.00 0.00 0.00 53.44 53.31 3ce6 n ALA 232 Cb 0.77 -1.26 -0.03 0.00 0.00 0.00 0.00 19.45 18.93 3ce6 n ALA 232 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ce6 n GLY 233 N 1.00 0.77 0.32 0.00 0.00 -0.73 -4.94 105.19 101.62 3ce6 n GLY 233 Ca 0.18 -0.70 0.03 0.00 0.00 0.00 0.00 46.02 45.53 3ce6 n GLY 233 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ce6 n ASP 234 N 0.79 2.30 -4.56 1.61 8.00 0.01 -4.90 116.55 119.81 3ce6 n ASP 234 Ca -0.07 -1.85 -0.43 0.00 0.71 0.00 0.00 54.79 53.14 3ce6 n ASP 234 Cb 0.30 -0.10 -0.04 0.00 -0.02 0.00 0.00 41.12 41.26 3ce6 n ASP 234 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3ce6 s LEU 235 N -0.90 3.96 0.00 0.64 2.96 -1.21 -4.86 118.68 119.27 3ce6 s LEU 235 Ca 0.11 0.11 0.28 0.00 -0.22 0.00 0.00 54.13 54.40 3ce6 s LEU 235 Cb 0.06 -3.20 0.97 0.00 0.50 0.00 0.00 46.19 44.52 3ce6 s LEU 235 CO 0.08 -1.10 1.69 0.00 -1.32 0.00 0.00 176.35 175.70 3ce6 n ALA 236 N 7.31 2.78 -3.11 5.97 0.00 -1.26 -4.80 120.51 127.41 3ce6 n ALA 236 Ca 0.06 -0.41 -0.10 0.00 0.00 0.00 0.00 53.44 52.99 3ce6 n ALA 236 Cb 0.48 -1.17 -0.04 0.00 0.00 0.00 0.00 19.45 18.72 3ce6 n ALA 236 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3ce6 s PHE 237 N -2.22 -0.12 0.59 0.00 -0.12 -1.26 -4.97 117.98 109.88 3ce6 s PHE 237 Ca 0.32 -0.21 -0.20 0.00 -0.05 0.00 0.00 56.93 56.79 3ce6 s PHE 237 Cb 0.20 0.29 -0.03 0.00 -0.63 0.00 0.00 43.02 42.85 3ce6 s PHE 237 CO 0.42 -0.80 1.34 -2.30 -0.05 0.00 0.00 175.22 173.83 3ce6 n PRO 238 N -0.28 1.49 -4.63 1.99 -0.02 -1.26 -4.46 135.00 127.83 3ce6 n PRO 238 Ca -0.13 0.56 -0.23 0.00 -2.02 0.00 0.00 63.50 61.68 3ce6 n PRO 238 Cb 0.63 -2.57 -0.14 0.00 -0.02 0.00 0.00 33.50 31.40 3ce6 n PRO 238 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ce6 s ALA 239 N -1.32 1.39 -0.22 3.55 0.00 -0.83 -1.29 121.76 123.04 3ce6 s ALA 239 Ca 0.76 -0.81 -0.04 0.00 0.00 0.00 0.00 51.96 51.86 3ce6 s ALA 239 Cb -0.40 -0.30 -0.01 0.00 0.00 0.00 0.00 23.12 22.41 3ce6 s ALA 239 CO 0.46 0.32 -0.03 0.42 0.00 0.00 0.00 175.76 176.92 3ce6 s ILE 240 N -0.60 3.55 -0.69 0.00 1.01 -0.01 -0.99 121.20 123.47 3ce6 s ILE 240 Ca 0.05 -0.44 -0.27 0.00 0.00 0.00 0.00 60.65 60.00 3ce6 s ILE 240 Cb -0.07 -2.61 0.03 0.00 0.01 0.00 0.00 42.46 39.82 3ce6 s ILE 240 CO 0.00 0.42 1.21 0.21 0.00 0.00 0.00 174.94 176.79 3ce6 s ASN 241 N 1.36 6.23 0.13 3.58 3.84 0.83 -1.28 114.94 129.62 3ce6 s ASN 241 Ca 0.04 -0.38 0.04 0.00 0.21 0.00 0.00 52.86 52.77 3ce6 s ASN 241 Cb -0.14 -2.54 -0.16 0.00 -0.55 0.00 0.00 41.25 37.86 3ce6 s ASN 241 CO -0.01 -1.69 1.29 0.58 -2.79 0.00 0.00 177.10 174.47 3ce6 h VAL 242 N 6.05 1.62 -0.92 -5.21 2.07 -1.29 -3.34 116.25 115.23 3ce6 h VAL 242 Ca -0.27 -3.13 0.22 0.00 0.82 0.00 0.00 66.70 64.33 3ce6 h VAL 242 Cb 1.05 2.77 -0.12 0.00 -1.52 0.00 0.00 31.29 33.47 3ce6 h VAL 242 CO 1.24 0.90 0.46 -1.13 0.02 0.00 0.00 177.57 179.06 3ce6 h ASN 243 N 0.03 0.46 -0.49 0.57 -0.73 -1.55 -2.18 115.58 111.69 3ce6 h ASN 243 Ca -0.04 0.14 0.00 0.00 1.87 0.00 0.00 56.30 58.27 3ce6 h ASN 243 Cb 1.73 0.09 0.00 0.00 0.27 0.00 0.00 38.32 40.41 3ce6 h ASN 243 CO 0.14 0.06 0.00 0.47 -0.37 0.00 0.00 177.43 177.74 3ce6 n ASP 244 N -4.97 3.36 -4.76 1.15 8.00 -1.25 -1.53 116.55 116.55 3ce6 n ASP 244 Ca 0.23 -2.22 -0.39 0.00 0.71 0.00 0.00 54.79 53.12 3ce6 n ASP 244 Cb 0.65 -0.45 0.02 0.00 -0.02 0.00 0.00 41.12 41.32 3ce6 n ASP 244 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3ce6 s SER 245 N -0.85 5.68 0.21 -2.24 0.01 -0.82 -4.87 113.70 110.81 3ce6 s SER 245 Ca 0.37 2.73 -0.08 0.00 1.31 0.00 0.00 55.95 60.28 3ce6 s SER 245 Cb 0.22 -2.64 0.15 0.00 0.21 0.00 0.00 66.02 63.97 3ce6 s SER 245 CO 0.20 -1.29 1.77 0.58 0.41 0.00 0.00 173.24 174.91 3ce6 h VAL 246 N 1.85 1.26 0.00 3.43 2.07 -1.90 -1.31 116.25 121.65 3ce6 h VAL 246 Ca -0.50 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.21 3ce6 h VAL 246 Cb 1.28 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 3ce6 h VAL 246 CO 0.59 0.33 0.00 0.35 0.02 0.00 0.00 177.57 178.86 3ce6 n THR 247 N -4.30 0.00 0.00 2.57 -2.24 -1.26 -2.79 114.28 106.26 3ce6 n THR 247 Ca 0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 3ce6 n THR 247 Cb 0.18 -0.40 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 3ce6 n THR 247 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3ce6 n LYS 248 N -0.86 0.00 -0.22 -0.78 0.00 -0.53 -4.36 118.16 111.41 3ce6 n LYS 248 Ca 0.16 0.00 0.01 0.00 0.00 0.00 0.00 58.31 58.48 3ce6 n LYS 248 Cb 0.07 -0.43 0.13 0.00 0.00 0.00 0.00 35.03 34.80 3ce6 n LYS 248 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 3ce6 h SER 249 N 0.00 0.29 0.32 3.14 4.64 -0.90 0.35 113.55 121.39 3ce6 h SER 249 Ca 0.00 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3ce6 h SER 249 Cb 0.00 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 3ce6 h SER 249 CO 0.00 0.16 -0.05 0.29 -0.87 0.00 0.00 176.83 176.36 3ce6 n LYS 250 N -4.97 0.74 0.02 4.77 4.76 -1.12 -3.03 118.16 119.33 3ce6 n LYS 250 Ca 0.10 -0.16 -0.00 0.00 -2.87 0.00 0.00 58.31 55.38 3ce6 n LYS 250 Cb 0.30 -1.50 -0.00 0.00 -1.84 0.00 0.00 35.03 32.00 3ce6 n LYS 250 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 3ce6 n PHE 251 N -0.99 0.00 0.48 2.13 3.72 -0.44 -4.49 117.46 117.87 3ce6 n PHE 251 Ca 0.17 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.37 3ce6 n PHE 251 Cb 0.24 -0.01 -0.10 0.00 -0.94 0.00 0.00 39.48 38.67 3ce6 n PHE 251 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 3ce6 h ASP 252 N -0.02 -1.13 -0.99 4.37 1.82 -0.57 0.33 116.42 120.24 3ce6 h ASP 252 Ca 0.00 0.05 0.05 0.00 -0.39 0.00 0.00 57.03 56.73 3ce6 h ASP 252 Cb 0.02 0.31 -0.06 0.00 0.68 0.00 0.00 39.33 40.27 3ce6 h ASP 252 CO 0.00 -0.76 0.65 0.78 -1.61 0.00 0.00 179.24 178.30 3ce6 h ASN 253 N -1.24 1.07 0.00 2.28 4.21 -1.46 -0.57 115.58 119.86 3ce6 h ASN 253 Ca -0.12 -0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.39 3ce6 h ASN 253 Cb 0.97 -0.24 0.00 0.00 -1.12 0.00 0.00 38.32 37.93 3ce6 h ASN 253 CO 0.17 0.72 -0.06 0.50 -1.29 0.00 0.00 177.43 177.47 3ce6 h LYS 254 N 1.23 0.00 0.00 0.81 3.64 -1.60 -3.27 116.57 117.38 3ce6 h LYS 254 Ca 0.40 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.65 3ce6 h LYS 254 Cb 0.05 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 3ce6 h LYS 254 CO -0.14 0.00 -0.65 1.88 -2.27 0.00 0.00 179.45 178.27 3ce6 h TYR 255 N -0.17 0.00 -0.61 1.91 0.05 -0.49 -0.60 116.97 117.06 3ce6 h TYR 255 Ca 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 3ce6 h TYR 255 Cb 0.06 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.77 3ce6 h TYR 255 CO -0.02 0.65 0.35 0.78 -1.05 0.00 0.00 178.16 178.87 3ce6 h GLY 256 N 2.49 0.89 1.58 3.88 0.00 -0.12 -2.77 103.07 109.02 3ce6 h GLY 256 Ca -0.01 -0.39 -0.17 0.00 0.00 0.00 0.00 47.33 46.77 3ce6 h GLY 256 CO 0.08 0.37 -0.64 -0.84 0.00 0.00 0.00 176.54 175.52 3ce6 h THR 257 N 0.82 1.36 -0.74 4.70 2.02 -1.36 0.01 112.91 119.71 3ce6 h THR 257 Ca 0.22 -1.98 0.14 0.00 0.77 0.00 0.00 66.41 65.55 3ce6 h THR 257 Cb 0.01 1.97 -0.05 0.00 -1.74 0.00 0.00 68.15 68.34 3ce6 h THR 257 CO -0.04 0.60 0.50 -0.09 0.37 0.00 0.00 175.52 176.86 3ce6 h ARG 258 N 0.31 0.44 0.03 6.66 2.43 -0.95 -0.33 114.38 122.97 3ce6 h ARG 258 Ca -0.01 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3ce6 h ARG 258 Cb 1.19 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 3ce6 h ARG 258 CO 0.11 0.29 -0.01 1.25 -1.51 0.00 0.00 179.97 180.10 3ce6 h HIS 259 N 0.46 -0.03 0.00 2.20 2.76 -1.03 -3.41 115.15 116.09 3ce6 h HIS 259 Ca 0.36 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.53 3ce6 h HIS 259 Cb 0.76 0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.74 3ce6 h HIS 259 CO -0.00 0.66 -0.66 0.66 -1.30 0.00 0.00 177.93 177.29 3ce6 h SER 260 N -0.93 0.00 -0.10 3.26 4.64 -0.67 -3.16 113.55 116.60 3ce6 h SER 260 Ca -0.00 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3ce6 h SER 260 Cb 0.70 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.79 3ce6 h SER 260 CO 0.01 0.01 0.04 0.25 -0.87 0.00 0.00 176.83 176.27 3ce6 h LEU 261 N 0.00 0.13 -0.95 5.97 5.85 -1.30 -1.31 115.31 123.69 3ce6 h LEU 261 Ca 0.00 -0.13 -0.09 0.00 0.84 0.00 0.00 57.88 58.50 3ce6 h LEU 261 Cb 0.98 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 3ce6 h LEU 261 CO 0.00 0.22 -0.21 0.16 -0.34 0.00 0.00 178.44 178.27 3ce6 h ILE 262 N 0.02 1.26 -0.06 4.05 -0.00 -1.79 -0.91 117.51 120.08 3ce6 h ILE 262 Ca 0.03 -1.20 0.03 0.00 -0.00 0.00 0.00 64.86 63.72 3ce6 h ILE 262 Cb 0.13 1.27 -0.04 0.00 -0.00 0.00 0.00 36.82 38.18 3ce6 h ILE 262 CO -0.00 0.39 -0.13 -0.78 -0.00 0.00 0.00 178.15 177.62 3ce6 h ASP 263 N 0.47 -0.40 -0.50 2.16 3.58 -1.49 0.17 116.42 120.40 3ce6 h ASP 263 Ca 0.07 0.07 -0.07 0.00 0.42 0.00 0.00 57.03 57.53 3ce6 h ASP 263 Cb 0.62 0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.83 3ce6 h ASP 263 CO 0.04 -0.18 0.08 1.23 -2.88 0.00 0.00 179.24 177.53 3ce6 h GLY 264 N -0.19 0.95 1.02 -0.78 0.00 -0.80 -1.17 103.07 102.09 3ce6 h GLY 264 Ca 0.07 -0.60 -0.05 0.00 0.00 0.00 0.00 47.33 46.75 3ce6 h GLY 264 CO -0.18 0.56 0.22 -2.22 0.00 0.00 0.00 176.54 174.91 3ce6 h ILE 265 N 0.83 1.25 0.07 2.60 2.04 -0.94 -2.17 117.51 121.19 3ce6 h ILE 265 Ca 0.17 -0.83 0.02 0.00 1.00 0.00 0.00 64.86 65.22 3ce6 h ILE 265 Cb 0.39 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 3ce6 h ILE 265 CO 0.01 0.32 -0.19 0.78 0.00 0.00 0.00 178.15 179.07 3ce6 h ASN 266 N 0.93 -0.54 0.14 1.72 2.35 -0.44 -0.40 115.58 119.33 3ce6 h ASN 266 Ca 0.21 0.07 -0.11 0.00 -0.55 0.00 0.00 56.30 55.92 3ce6 h ASN 266 Cb 0.27 0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.84 3ce6 h ASN 266 CO -0.01 -0.27 -0.38 0.03 -1.65 0.00 0.00 177.43 175.15 3ce6 h ARG 267 N -0.35 0.32 -0.00 0.81 3.08 -1.16 0.23 114.38 117.32 3ce6 h ARG 267 Ca 0.04 -0.15 -0.23 0.00 0.07 0.00 0.00 59.98 59.71 3ce6 h ARG 267 Cb 0.38 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.43 3ce6 h ARG 267 CO -0.13 0.66 -0.94 0.78 -1.07 0.00 0.00 179.97 179.27 3ce6 h GLY 268 N 1.15 0.47 0.00 0.04 0.00 -1.24 -3.41 103.07 100.09 3ce6 h GLY 268 Ca 0.03 -0.83 0.00 0.00 0.00 0.00 0.00 47.33 46.53 3ce6 h GLY 268 CO 0.06 0.73 -0.63 -1.30 0.00 0.00 0.00 176.54 175.41 3ce6 n THR 269 N -3.75 0.00 -2.33 4.70 -2.24 -0.18 -4.93 114.28 105.55 3ce6 n THR 269 Ca -0.07 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.59 3ce6 n THR 269 Cb 0.83 -0.31 -0.01 0.00 -2.10 0.00 0.00 70.33 68.75 3ce6 n THR 269 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3ce6 n ASP 270 N -1.27 -3.79 -4.72 3.42 8.00 0.81 -4.93 116.55 114.08 3ce6 n ASP 270 Ca 0.00 0.21 -0.40 0.00 0.71 0.00 0.00 54.79 55.31 3ce6 n ASP 270 Cb 0.21 -3.25 -0.04 0.00 -0.02 0.00 0.00 41.12 38.01 3ce6 n ASP 270 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ce6 s ALA 271 N -2.55 3.30 0.19 2.24 0.00 -1.26 -4.99 121.76 118.70 3ce6 s ALA 271 Ca 0.00 0.24 -0.32 0.00 0.00 0.00 0.00 51.96 51.87 3ce6 s ALA 271 Cb 0.00 -3.04 -0.15 0.00 0.00 0.00 0.00 23.12 19.93 3ce6 s ALA 271 CO 0.00 -0.11 1.33 -0.11 0.00 0.00 0.00 175.76 176.87 3ce6 n LEU 272 N 3.68 2.42 -0.12 0.00 7.94 -1.26 -4.90 117.00 124.77 3ce6 n LEU 272 Ca 0.00 1.13 -0.19 0.00 -1.11 0.00 0.00 56.01 55.85 3ce6 n LEU 272 Cb 0.51 -1.33 -0.12 0.00 0.53 0.00 0.00 43.42 43.01 3ce6 n LEU 272 CO 0.48 -0.80 -1.29 -0.38 -1.11 0.00 0.00 177.39 174.29 3ce6 n ILE 273 N 1.97 1.52 -1.69 1.96 5.41 -1.26 -4.76 119.36 122.50 3ce6 n ILE 273 Ca 0.14 -0.57 -0.44 0.00 1.00 0.00 0.00 62.75 62.89 3ce6 n ILE 273 Cb 0.28 -1.48 -0.02 0.00 -0.71 0.00 0.00 39.64 37.71 3ce6 n ILE 273 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3ce6 n GLY 274 N 2.18 0.89 2.57 7.39 0.00 -1.05 -1.67 105.19 115.50 3ce6 n GLY 274 Ca -0.45 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3ce6 n GLY 274 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ce6 n GLY 275 N 1.92 2.54 3.87 -0.02 0.00 -0.30 -4.86 105.19 108.34 3ce6 n GLY 275 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 3ce6 n GLY 275 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ce6 s LYS 276 N -0.19 3.80 -0.16 1.61 -0.14 -0.67 -4.76 119.74 119.23 3ce6 s LYS 276 Ca 0.00 0.49 -0.23 0.00 -1.36 0.00 0.00 55.97 54.87 3ce6 s LYS 276 Cb 0.00 -2.40 -0.02 0.00 -1.68 0.00 0.00 37.83 33.73 3ce6 s LYS 276 CO 0.00 -0.01 0.74 0.15 -0.76 0.00 0.00 175.35 175.47 3ce6 s LYS 277 N -3.75 4.30 -0.09 1.68 1.02 -1.26 -0.40 119.74 121.24 3ce6 s LYS 277 Ca 0.51 0.86 0.04 0.00 0.02 0.00 0.00 55.97 57.40 3ce6 s LYS 277 Cb -0.10 -3.55 0.00 0.00 -0.52 0.00 0.00 37.83 33.66 3ce6 s LYS 277 CO 0.30 -0.21 -0.22 0.08 -0.92 0.00 0.00 175.35 174.38 3ce6 s VAL 278 N 1.78 1.88 -0.30 3.17 1.01 -0.25 -0.34 120.40 127.34 3ce6 s VAL 278 Ca 0.35 -0.92 -0.08 0.00 0.00 0.00 0.00 61.98 61.33 3ce6 s VAL 278 Cb -0.17 -1.63 0.00 0.00 0.00 0.00 0.00 36.38 34.59 3ce6 s VAL 278 CO 0.13 0.52 0.11 -0.22 0.00 0.00 0.00 175.10 175.64 3ce6 s LEU 279 N 0.34 3.99 -0.22 3.92 2.96 0.25 -0.80 118.68 129.12 3ce6 s LEU 279 Ca -0.16 -0.66 -0.08 0.00 -0.22 0.00 0.00 54.13 53.00 3ce6 s LEU 279 Cb -0.17 -1.93 -0.04 0.00 0.50 0.00 0.00 46.19 44.55 3ce6 s LEU 279 CO 0.07 -0.20 0.08 -0.63 -1.32 0.00 0.00 176.35 174.35 3ce6 s ILE 280 N 1.54 4.69 -0.43 6.68 -1.09 -0.20 -1.02 121.20 131.36 3ce6 s ILE 280 Ca 0.03 -0.06 -0.15 0.00 -2.23 0.00 0.00 60.65 58.25 3ce6 s ILE 280 Cb -0.17 -3.16 0.04 0.00 -1.58 0.00 0.00 42.46 37.60 3ce6 s ILE 280 CO 0.04 0.39 0.33 0.00 -1.23 0.00 0.00 174.94 174.46 3ce6 n GLY 282 N 5.15 2.40 2.60 0.00 0.00 -0.04 -0.23 105.19 115.08 3ce6 n GLY 282 Ca -0.12 -1.51 -0.11 0.00 0.00 0.00 0.00 46.02 44.29 3ce6 n GLY 282 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3ce6 n TYR 283 N 1.74 1.75 -0.36 1.61 9.36 -1.26 -4.20 117.16 125.80 3ce6 n TYR 283 Ca 0.00 -2.53 0.00 0.00 3.32 0.00 0.00 57.90 58.69 3ce6 n TYR 283 Cb 0.00 -0.28 0.00 0.00 -0.63 0.00 0.00 39.34 38.43 3ce6 n TYR 283 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3ce6 n GLY 284 N -0.40 1.36 0.23 2.98 0.00 -1.26 -4.52 105.19 103.58 3ce6 n GLY 284 Ca 0.18 -1.65 -0.09 0.00 0.00 0.00 0.00 46.02 44.46 3ce6 n GLY 284 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3ce6 h ASP 285 N 0.00 0.71 -0.10 1.61 3.32 -1.91 0.87 116.42 120.92 3ce6 h ASP 285 Ca 0.00 -0.34 -0.04 0.00 0.02 0.00 0.00 57.03 56.68 3ce6 h ASP 285 Cb 0.00 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.35 3ce6 h ASP 285 CO 0.00 1.05 -0.08 0.58 -1.72 0.00 0.00 179.24 179.07 3ce6 h VAL 286 N 0.53 1.35 -0.21 -1.35 2.07 -1.87 -1.88 116.25 114.88 3ce6 h VAL 286 Ca 0.04 -1.20 -0.03 0.00 0.82 0.00 0.00 66.70 66.33 3ce6 h VAL 286 Cb 0.98 1.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.66 3ce6 h VAL 286 CO 0.09 0.34 0.01 1.23 0.02 0.00 0.00 177.57 179.26 3ce6 h GLY 287 N -0.17 0.33 0.99 2.17 0.00 -1.68 -0.76 103.07 103.94 3ce6 h GLY 287 Ca 0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 47.33 47.16 3ce6 h GLY 287 CO 0.02 0.15 0.27 0.50 0.00 0.00 0.00 176.54 177.49 3ce6 h LYS 288 N 0.30 0.82 -0.74 4.80 1.57 -0.71 0.16 116.57 122.77 3ce6 h LYS 288 Ca 0.07 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 3ce6 h LYS 288 Cb 0.19 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 3ce6 h LYS 288 CO 0.00 0.67 0.27 0.78 -0.57 0.00 0.00 179.45 180.60 3ce6 h GLY 289 N 0.77 1.20 0.84 3.86 0.00 -0.57 -1.55 103.07 107.62 3ce6 h GLY 289 Ca 0.20 -0.67 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 3ce6 h GLY 289 CO -0.02 0.63 0.04 0.00 0.00 0.00 0.00 176.54 177.19 3ce6 h ALA 291 N 0.84 1.18 -0.28 0.00 0.00 -0.37 -1.33 119.26 119.31 3ce6 h ALA 291 Ca 0.05 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 3ce6 h ALA 291 Cb 0.25 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3ce6 h ALA 291 CO -0.00 0.53 -0.16 1.49 0.00 0.00 0.00 179.25 181.12 3ce6 h GLU 292 N 0.29 0.60 0.04 0.00 4.81 -0.98 0.47 114.58 119.81 3ce6 h GLU 292 Ca 0.04 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 59.00 3ce6 h GLU 292 Cb 0.67 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 3ce6 h GLU 292 CO 0.05 0.85 -0.05 0.00 -0.73 0.00 0.00 179.01 179.14 3ce6 h ALA 293 N 0.74 -0.08 -0.27 2.92 0.00 -0.79 -0.73 119.26 121.05 3ce6 h ALA 293 Ca 0.06 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3ce6 h ALA 293 Cb 0.68 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3ce6 h ALA 293 CO 0.05 -0.55 -0.10 0.52 0.00 0.00 0.00 179.25 179.16 3ce6 h MET 294 N -0.10 0.53 -0.95 0.00 2.86 -1.07 -2.57 114.93 113.64 3ce6 h MET 294 Ca 0.01 -0.22 0.16 0.00 -2.06 0.00 0.00 59.70 57.58 3ce6 h MET 294 Cb 0.10 -0.02 -0.08 0.00 0.06 0.00 0.00 31.60 31.66 3ce6 h MET 294 CO -0.02 0.77 0.60 -0.22 1.06 0.00 0.00 176.91 179.10 3ce6 h LYS 295 N 0.28 0.72 0.00 1.72 3.64 -0.81 -1.20 116.57 120.92 3ce6 h LYS 295 Ca 0.06 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3ce6 h LYS 295 Cb 0.59 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 3ce6 h LYS 295 CO 0.03 0.47 0.00 0.78 -2.27 0.00 0.00 179.45 178.47 3ce6 h GLY 296 N 0.74 0.00 -1.20 5.01 0.00 -0.80 -1.03 103.07 105.79 3ce6 h GLY 296 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.82 3ce6 h GLY 296 CO -0.26 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.22 3ce6 n GLN 297 N -3.06 1.92 -0.56 4.80 1.13 -0.54 -4.95 117.38 116.12 3ce6 n GLN 297 Ca 0.03 -1.39 0.00 0.00 -1.94 0.00 0.00 57.00 53.70 3ce6 n GLN 297 Cb 0.46 -1.42 0.00 0.00 0.11 0.00 0.00 30.24 29.39 3ce6 n GLN 297 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3ce6 n GLY 298 N 1.22 0.69 3.79 1.08 0.00 -0.39 -2.52 105.19 109.05 3ce6 n GLY 298 Ca 0.17 -0.29 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 3ce6 n GLY 298 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ce6 s ALA 299 N -2.00 2.34 -0.42 4.61 0.00 -0.67 -1.14 121.76 124.46 3ce6 s ALA 299 Ca 0.00 0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.91 3ce6 s ALA 299 Cb 0.00 -3.19 0.07 0.00 0.00 0.00 0.00 23.12 20.00 3ce6 s ALA 299 CO 0.00 -1.62 0.28 1.03 0.00 0.00 0.00 175.76 175.46 3ce6 s ARG 300 N -5.01 2.72 -0.17 0.00 0.52 0.46 -4.55 118.95 112.92 3ce6 s ARG 300 Ca 0.60 -1.38 -0.07 0.00 -0.52 0.00 0.00 55.73 54.36 3ce6 s ARG 300 Cb -0.15 -3.85 -0.04 0.00 0.52 0.00 0.00 34.95 31.42 3ce6 s ARG 300 CO 0.55 -0.94 0.07 0.08 0.02 0.00 0.00 175.30 175.09 3ce6 s VAL 301 N 1.49 4.87 0.31 3.52 1.01 -1.26 -1.08 120.40 129.26 3ce6 s VAL 301 Ca 0.03 -0.01 0.11 0.00 0.00 0.00 0.00 61.98 62.11 3ce6 s VAL 301 Cb -0.23 -3.18 -0.06 0.00 0.00 0.00 0.00 36.38 32.92 3ce6 s VAL 301 CO 0.04 0.49 -0.15 -0.44 0.00 0.00 0.00 175.10 175.04 3ce6 s SER 302 N 0.08 3.67 -0.00 3.32 0.01 0.02 -4.10 113.70 116.70 3ce6 s SER 302 Ca 0.06 -1.10 0.03 0.00 1.31 0.00 0.00 55.95 56.25 3ce6 s SER 302 Cb -0.12 -0.33 -0.01 0.00 0.21 0.00 0.00 66.02 65.77 3ce6 s SER 302 CO 0.01 -0.07 -0.09 -0.69 0.41 0.00 0.00 173.24 172.81 3ce6 s VAL 303 N -2.55 0.68 0.01 3.43 1.01 -0.20 -1.04 120.40 121.74 3ce6 s VAL 303 Ca 0.31 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.89 3ce6 s VAL 303 Cb -0.02 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 3ce6 s VAL 303 CO 0.16 0.16 0.04 0.42 0.00 0.00 0.00 175.10 175.88 3ce6 s THR 304 N -0.27 4.43 -0.17 3.92 -4.23 0.19 -0.86 115.64 118.65 3ce6 s THR 304 Ca 0.03 -0.56 -0.24 0.00 -1.18 0.00 0.00 61.69 59.74 3ce6 s THR 304 Cb -0.04 -3.02 0.06 0.00 1.34 0.00 0.00 72.50 70.84 3ce6 s THR 304 CO -0.00 0.32 0.62 -1.61 -0.54 0.00 0.00 174.62 173.41 3ce6 s GLU 305 N -1.77 0.81 0.12 3.99 0.41 -1.26 -0.86 118.70 120.15 3ce6 s GLU 305 Ca 0.22 0.64 0.22 0.00 -0.41 0.00 0.00 54.97 55.64 3ce6 s GLU 305 Cb -0.12 0.39 -0.11 0.00 -1.78 0.00 0.00 34.13 32.52 3ce6 s GLU 305 CO 0.14 -0.16 0.86 0.44 -0.49 0.00 0.00 175.26 176.05 3ce6 n ILE 306 N 2.17 0.54 -3.62 -1.63 -6.64 -1.26 -4.93 119.36 103.99 3ce6 n ILE 306 Ca -0.16 -0.56 -0.38 0.00 -1.77 0.00 0.00 62.75 59.89 3ce6 n ILE 306 Cb 0.56 -0.30 -0.11 0.00 -1.44 0.00 0.00 39.64 38.35 3ce6 n ILE 306 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 3ce6 s ASP 307 N -5.19 5.88 0.47 7.28 -1.08 -1.26 -4.97 116.67 117.79 3ce6 s ASP 307 Ca -0.03 -0.04 0.21 0.00 -0.52 0.00 0.00 52.55 52.17 3ce6 s ASP 307 Cb 0.10 -2.09 1.17 0.00 -1.46 0.00 0.00 42.92 40.65 3ce6 s ASP 307 CO 0.82 -0.04 2.00 1.55 0.52 0.00 0.00 175.17 180.02 3ce6 h PRO 308 N 8.31 0.00 0.28 4.34 0.13 -1.98 -0.41 132.00 142.66 3ce6 h PRO 308 Ca -0.36 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.76 3ce6 h PRO 308 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3ce6 h PRO 308 CO 0.56 0.19 -0.13 0.82 -0.23 0.00 0.00 178.00 179.20 3ce6 h ILE 309 N 0.00 0.69 -0.66 -3.56 2.04 -1.99 -0.08 117.51 113.94 3ce6 h ILE 309 Ca -0.00 -0.75 -0.00 0.00 1.00 0.00 0.00 64.86 65.10 3ce6 h ILE 309 Cb 0.40 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 3ce6 h ILE 309 CO 0.02 0.14 0.41 0.78 0.00 0.00 0.00 178.15 179.50 3ce6 h ASN 310 N -0.82 0.79 -0.64 1.72 2.35 -1.84 -1.40 115.58 115.75 3ce6 h ASN 310 Ca -0.04 -0.05 0.08 0.00 -0.55 0.00 0.00 56.30 55.74 3ce6 h ASN 310 Cb 0.51 -0.20 -0.06 0.00 0.05 0.00 0.00 38.32 38.62 3ce6 h ASN 310 CO 0.06 0.61 0.30 0.00 -1.65 0.00 0.00 177.43 176.76 3ce6 h ALA 311 N 1.21 0.85 -0.50 -0.83 0.00 -1.06 -1.69 119.26 117.24 3ce6 h ALA 311 Ca 0.24 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 3ce6 h ALA 311 Cb -0.04 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3ce6 h ALA 311 CO -0.05 -0.08 0.22 1.25 0.00 0.00 0.00 179.25 180.59 3ce6 h LEU 312 N 0.54 0.64 -0.54 0.00 5.85 -0.39 -0.62 115.31 120.80 3ce6 h LEU 312 Ca 0.30 -0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.91 3ce6 h LEU 312 Cb 0.29 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 3ce6 h LEU 312 CO -0.24 0.57 0.15 1.56 -0.34 0.00 0.00 178.44 180.13 3ce6 h GLN 313 N 0.71 0.85 -0.21 1.25 4.20 -0.80 -1.31 115.11 119.80 3ce6 h GLN 313 Ca 0.17 -0.20 0.03 0.00 0.06 0.00 0.00 58.65 58.72 3ce6 h GLN 313 Cb 0.12 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.75 3ce6 h GLN 313 CO -0.02 0.80 0.02 0.00 -0.67 0.00 0.00 178.83 178.96 3ce6 h ALA 314 N 1.02 0.20 -0.55 3.87 0.00 -0.59 -1.44 119.26 121.77 3ce6 h ALA 314 Ca 0.17 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 3ce6 h ALA 314 Cb 0.32 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3ce6 h ALA 314 CO -0.00 -0.41 0.15 0.52 0.00 0.00 0.00 179.25 179.51 3ce6 h MET 315 N 0.10 0.84 0.00 0.00 2.86 -0.73 -1.38 114.93 116.61 3ce6 h MET 315 Ca 0.10 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 3ce6 h MET 315 Cb 0.11 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.64 3ce6 h MET 315 CO -0.15 0.75 0.00 0.52 1.06 0.00 0.00 176.91 179.09 3ce6 h MET 316 N 0.81 0.00 -0.63 1.72 2.07 -0.82 -0.86 114.93 117.22 3ce6 h MET 316 Ca 0.18 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.81 3ce6 h MET 316 Cb 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.01 3ce6 h MET 316 CO -0.00 0.00 0.00 0.39 1.07 0.00 0.00 176.91 178.37 3ce6 n GLU 317 N -2.76 2.87 -0.12 1.72 1.02 -0.58 -4.96 120.64 117.83 3ce6 n GLU 317 Ca 0.00 -2.54 0.00 0.00 -0.02 0.00 0.00 57.16 54.60 3ce6 n GLU 317 Cb 0.23 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.12 3ce6 n GLU 317 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ce6 n GLY 318 N 1.29 0.94 3.33 0.62 0.00 -0.33 -5.05 105.19 105.99 3ce6 n GLY 318 Ca 0.21 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 3ce6 n GLY 318 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ce6 s PHE 319 N -2.00 2.61 0.64 1.61 0.08 -0.69 -4.96 117.98 115.27 3ce6 s PHE 319 Ca 0.00 -0.62 -0.18 0.00 0.12 0.00 0.00 56.93 56.25 3ce6 s PHE 319 Cb 0.00 -1.69 -0.02 0.00 -0.57 0.00 0.00 43.02 40.74 3ce6 s PHE 319 CO 0.00 -0.16 1.19 -0.25 -0.10 0.00 0.00 175.22 175.90 3ce6 n ASP 320 N 3.04 1.65 -4.23 1.36 8.00 -1.26 -3.61 116.55 121.51 3ce6 n ASP 320 Ca -0.18 0.82 -0.35 0.00 0.71 0.00 0.00 54.79 55.80 3ce6 n ASP 320 Cb 0.52 -1.50 -0.14 0.00 -0.02 0.00 0.00 41.12 39.98 3ce6 n ASP 320 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3ce6 s VAL 321 N -1.43 3.01 0.13 2.53 1.01 -1.26 -1.04 120.40 123.36 3ce6 s VAL 321 Ca 0.81 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.93 3ce6 s VAL 321 Cb -0.39 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 3ce6 s VAL 321 CO 0.42 0.26 -0.04 0.68 0.00 0.00 0.00 175.10 176.42 3ce6 s VAL 322 N 1.37 0.75 0.30 2.92 -7.23 -0.04 -4.97 120.40 113.50 3ce6 s VAL 322 Ca 0.02 -1.97 -0.06 0.00 -1.81 0.00 0.00 61.98 58.16 3ce6 s VAL 322 Cb -0.16 -1.88 -0.06 0.00 0.56 0.00 0.00 36.38 34.84 3ce6 s VAL 322 CO -0.04 -0.70 0.59 0.42 -0.31 0.00 0.00 175.10 175.06 3ce6 s THR 323 N -3.60 4.97 0.33 5.32 -4.23 -1.26 -4.04 115.64 113.14 3ce6 s THR 323 Ca 0.17 0.20 0.08 0.00 -1.18 0.00 0.00 61.69 60.96 3ce6 s THR 323 Cb 0.05 -3.72 0.32 0.00 1.34 0.00 0.00 72.50 70.49 3ce6 s THR 323 CO -0.01 -0.33 1.83 0.58 -0.54 0.00 0.00 174.62 176.15 3ce6 h VAL 324 N 1.37 0.79 -0.85 2.29 2.07 -1.96 -2.58 116.25 117.38 3ce6 h VAL 324 Ca -0.47 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 3ce6 h VAL 324 Cb 1.19 -0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 3ce6 h VAL 324 CO 0.66 0.14 0.49 -0.33 0.02 0.00 0.00 177.57 178.55 3ce6 h GLU 325 N 0.74 1.17 0.00 1.57 3.07 -1.97 -0.64 114.58 118.53 3ce6 h GLU 325 Ca 0.50 -0.12 -0.03 0.00 -0.50 0.00 0.00 59.36 59.22 3ce6 h GLU 325 Cb 0.79 -0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 28.45 3ce6 h GLU 325 CO -0.27 0.84 -0.57 1.05 -1.40 0.00 0.00 179.01 178.66 3ce6 h GLU 326 N 1.19 0.00 0.00 2.33 4.11 -1.88 -3.38 114.58 116.95 3ce6 h GLU 326 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.73 3ce6 h GLU 326 Cb -0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.23 3ce6 h GLU 326 CO -0.05 0.09 -0.64 0.00 0.07 0.00 0.00 179.01 178.48 3ce6 n ALA 327 N -2.17 2.99 -0.16 1.06 0.00 -0.97 -4.66 120.51 116.60 3ce6 n ALA 327 Ca 0.01 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.21 3ce6 n ALA 327 Cb 0.59 -0.32 0.26 0.00 0.00 0.00 0.00 19.45 19.98 3ce6 n ALA 327 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 3ce6 h ILE 328 N 0.00 1.19 0.00 0.00 6.09 -1.31 -1.60 117.51 121.88 3ce6 h ILE 328 Ca 0.00 -0.47 0.00 0.00 -1.37 0.00 0.00 64.86 63.02 3ce6 h ILE 328 Cb 0.26 0.34 0.00 0.00 0.47 0.00 0.00 36.82 37.88 3ce6 h ILE 328 CO 0.00 0.21 0.00 0.61 -3.07 0.00 0.00 178.15 175.90 3ce6 n GLY 329 N -1.25 -1.49 0.38 8.18 0.00 -1.26 -3.04 105.19 106.72 3ce6 n GLY 329 Ca 0.06 -0.05 0.09 0.00 0.00 0.00 0.00 46.02 46.13 3ce6 n GLY 329 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ce6 n ASP 330 N -1.86 1.71 -4.72 1.61 8.00 -0.62 -4.13 116.55 116.55 3ce6 n ASP 330 Ca 0.05 -1.36 -0.42 0.00 0.71 0.00 0.00 54.79 53.78 3ce6 n ASP 330 Cb 0.34 0.53 -0.03 0.00 -0.02 0.00 0.00 41.12 41.93 3ce6 n ASP 330 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ce6 s ALA 331 N -2.21 3.22 0.07 2.24 0.00 -1.09 -4.75 121.76 119.24 3ce6 s ALA 331 Ca 0.15 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.70 3ce6 s ALA 331 Cb 0.15 -3.33 -0.26 0.00 0.00 0.00 0.00 23.12 19.68 3ce6 s ALA 331 CO 0.50 -0.19 1.10 -0.44 0.00 0.00 0.00 175.76 176.73 3ce6 h ASP 332 N 6.33 0.28 -3.86 0.00 3.32 -1.04 -3.40 116.42 118.04 3ce6 h ASP 332 Ca -0.42 -0.32 -0.34 0.00 0.02 0.00 0.00 57.03 55.97 3ce6 h ASP 332 Cb 1.22 -0.09 -0.29 0.00 0.22 0.00 0.00 39.33 40.38 3ce6 h ASP 332 CO 0.74 1.26 -0.76 -0.63 -1.72 0.00 0.00 179.24 178.13 3ce6 s ILE 333 N -2.66 0.44 -0.12 0.35 1.01 -1.00 -1.12 121.20 118.11 3ce6 s ILE 333 Ca -0.04 -0.22 0.00 0.00 0.00 0.00 0.00 60.65 60.40 3ce6 s ILE 333 Cb 0.08 -0.39 0.02 0.00 0.01 0.00 0.00 42.46 42.18 3ce6 s ILE 333 CO 0.86 0.14 -0.11 -0.69 0.00 0.00 0.00 174.94 175.13 3ce6 s VAL 334 N 0.02 1.26 -0.06 2.92 1.01 -0.07 -0.58 120.40 124.89 3ce6 s VAL 334 Ca 0.00 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 61.57 3ce6 s VAL 334 Cb -0.04 -1.21 -0.00 0.00 0.00 0.00 0.00 36.38 35.13 3ce6 s VAL 334 CO -0.00 0.40 -0.19 -0.69 0.00 0.00 0.00 175.10 174.62 3ce6 s VAL 335 N 1.43 1.64 -0.17 2.92 1.01 -0.19 -1.19 120.40 125.86 3ce6 s VAL 335 Ca 0.01 -0.81 -0.12 0.00 0.00 0.00 0.00 61.98 61.06 3ce6 s VAL 335 Cb -0.13 -1.42 -0.05 0.00 0.00 0.00 0.00 36.38 34.78 3ce6 s VAL 335 CO -0.07 0.47 0.24 0.42 0.00 0.00 0.00 175.10 176.16 3ce6 s THR 336 N 0.20 5.34 -0.18 3.92 -4.23 -0.79 -0.73 115.64 119.17 3ce6 s THR 336 Ca -0.10 0.43 0.23 0.00 -1.18 0.00 0.00 61.69 61.07 3ce6 s THR 336 Cb -0.14 -3.57 0.48 0.00 1.34 0.00 0.00 72.50 70.60 3ce6 s THR 336 CO 0.04 0.42 1.14 0.00 -0.54 0.00 0.00 174.62 175.68 3ce6 n ALA 337 N 3.44 2.68 -0.05 3.99 0.00 0.68 -0.60 120.51 130.65 3ce6 n ALA 337 Ca -0.14 -2.70 -0.02 0.00 0.00 0.00 0.00 53.44 50.59 3ce6 n ALA 337 Cb 0.52 -0.79 -0.15 0.00 0.00 0.00 0.00 19.45 19.03 3ce6 n ALA 337 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3ce6 n THR 338 N -0.29 0.93 -0.92 0.00 -2.24 -1.22 -4.33 114.28 106.21 3ce6 n THR 338 Ca 0.09 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.15 3ce6 n THR 338 Cb 0.91 -0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 3ce6 n THR 338 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ce6 n GLY 339 N 1.53 0.74 3.95 3.38 0.00 -1.26 -5.01 105.19 108.52 3ce6 n GLY 339 Ca -0.20 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 3ce6 n GLY 339 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3ce6 s ASN 340 N -2.67 4.86 0.30 1.61 3.84 -1.26 -4.96 114.94 116.66 3ce6 s ASN 340 Ca 0.00 -1.04 0.07 0.00 0.21 0.00 0.00 52.86 52.10 3ce6 s ASN 340 Cb 0.00 0.27 -0.03 0.00 -0.55 0.00 0.00 41.25 40.94 3ce6 s ASN 340 CO 0.00 -1.15 0.26 -1.59 -2.79 0.00 0.00 177.10 171.83 3ce6 s LYS 341 N -4.41 2.82 -1.03 0.43 -2.85 -1.26 -3.83 119.74 109.60 3ce6 s LYS 341 Ca 0.46 -1.19 -0.02 0.00 -1.00 0.00 0.00 55.97 54.22 3ce6 s LYS 341 Cb -0.04 -2.52 0.00 0.00 -2.06 0.00 0.00 37.83 33.21 3ce6 s LYS 341 CO 0.28 0.22 0.87 -0.25 0.10 0.00 0.00 175.35 176.58 3ce6 n ASP 342 N -1.30 -2.94 -0.06 0.03 8.00 -0.53 -4.90 116.55 114.85 3ce6 n ASP 342 Ca -0.04 -0.50 -0.22 0.00 0.71 0.00 0.00 54.79 54.74 3ce6 n ASP 342 Cb 0.59 -4.34 -0.13 0.00 -0.02 0.00 0.00 41.12 37.22 3ce6 n ASP 342 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3ce6 n ILE 343 N -3.86 1.65 -4.00 0.53 2.08 0.40 -4.69 119.36 111.46 3ce6 n ILE 343 Ca -0.18 -0.30 -0.32 0.00 0.56 0.00 0.00 62.75 62.51 3ce6 n ILE 343 Cb 0.62 -1.91 -0.15 0.00 -0.75 0.00 0.00 39.64 37.45 3ce6 n ILE 343 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 3ce6 s ILE 344 N -2.45 2.36 0.61 1.39 -1.09 -0.86 -5.00 121.20 116.17 3ce6 s ILE 344 Ca -0.26 -2.28 -0.02 0.00 -2.23 0.00 0.00 60.65 55.86 3ce6 s ILE 344 Cb 0.06 -2.72 0.05 0.00 -1.58 0.00 0.00 42.46 38.27 3ce6 s ILE 344 CO 0.67 -0.57 0.87 -0.04 -1.23 0.00 0.00 174.94 174.64 3ce6 s MET 345 N 0.93 2.38 0.22 2.79 -1.94 -1.26 -0.56 119.30 121.86 3ce6 s MET 345 Ca 0.10 -0.60 -0.09 0.00 -1.71 0.00 0.00 55.69 53.39 3ce6 s MET 345 Cb -0.19 -2.36 0.35 0.00 2.01 0.00 0.00 34.83 34.64 3ce6 s MET 345 CO -0.07 -0.93 1.68 1.25 -0.01 0.00 0.00 175.02 176.93 3ce6 h LEU 346 N -0.20 -0.14 -1.37 -0.03 5.85 -1.94 0.95 115.31 118.43 3ce6 h LEU 346 Ca -0.43 0.15 0.10 0.00 0.84 0.00 0.00 57.88 58.53 3ce6 h LEU 346 Cb 1.30 0.23 -0.05 0.00 0.37 0.00 0.00 40.66 42.51 3ce6 h LEU 346 CO 0.55 -0.07 0.51 -0.08 -0.34 0.00 0.00 178.44 179.00 3ce6 h GLU 347 N 0.19 0.68 -0.20 1.25 4.81 -1.99 -0.32 114.58 119.01 3ce6 h GLU 347 Ca 0.35 -0.04 -0.18 0.00 -0.13 0.00 0.00 59.36 59.37 3ce6 h GLU 347 Cb 0.58 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.81 3ce6 h GLU 347 CO -0.51 0.45 -0.56 0.45 -0.73 0.00 0.00 179.01 178.11 3ce6 h HIS 348 N 0.70 0.95 -0.98 0.92 3.86 -1.37 -1.99 115.15 117.24 3ce6 h HIS 348 Ca 0.36 -0.37 0.07 0.00 -1.16 0.00 0.00 60.37 59.27 3ce6 h HIS 348 Cb 0.45 -0.16 -0.07 0.00 1.06 0.00 0.00 27.41 28.69 3ce6 h HIS 348 CO -0.00 1.18 0.63 0.82 0.86 0.00 0.00 177.93 181.42 3ce6 h ILE 349 N 0.45 1.05 0.00 2.45 2.04 -0.25 0.60 117.51 123.85 3ce6 h ILE 349 Ca -0.01 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.46 3ce6 h ILE 349 Cb 1.18 -0.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 3ce6 h ILE 349 CO 0.12 0.20 0.00 0.11 0.00 0.00 0.00 178.15 178.58 3ce6 h LYS 350 N 1.12 0.00 0.00 2.37 1.57 -0.99 -1.98 116.57 118.66 3ce6 h LYS 350 Ca 0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.22 3ce6 h LYS 350 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3ce6 h LYS 350 CO -0.19 0.00 -0.31 0.00 -0.57 0.00 0.00 179.45 178.38 3ce6 n ALA 351 N -1.97 3.07 -1.54 3.86 0.00 0.16 -4.96 120.51 119.14 3ce6 n ALA 351 Ca 0.01 -0.25 -0.33 0.00 0.00 0.00 0.00 53.44 52.87 3ce6 n ALA 351 Cb 0.26 -1.25 0.04 0.00 0.00 0.00 0.00 19.45 18.49 3ce6 n ALA 351 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3ce6 s MET 352 N -3.01 2.93 0.71 0.00 -1.94 -0.75 -4.10 119.30 113.15 3ce6 s MET 352 Ca 0.12 1.28 -0.11 0.00 -1.71 0.00 0.00 55.69 55.27 3ce6 s MET 352 Cb 0.18 -1.97 0.02 0.00 2.01 0.00 0.00 34.83 35.06 3ce6 s MET 352 CO 0.64 -1.13 1.07 -1.59 -0.01 0.00 0.00 175.02 173.99 3ce6 s LYS 353 N -4.23 2.80 0.17 2.03 -2.85 -1.26 -4.92 119.74 111.48 3ce6 s LYS 353 Ca 0.65 0.89 -0.32 0.00 -1.00 0.00 0.00 55.97 56.19 3ce6 s LYS 353 Cb -0.18 -1.98 -0.11 0.00 -2.06 0.00 0.00 37.83 33.50 3ce6 s LYS 353 CO 0.42 -1.18 1.66 0.34 0.10 0.00 0.00 175.35 176.69 3ce6 s ASP 354 N -3.83 6.48 -0.70 0.03 2.15 -1.26 -1.55 116.67 117.98 3ce6 s ASP 354 Ca 0.58 2.73 0.00 0.00 0.43 0.00 0.00 52.55 56.29 3ce6 s ASP 354 Cb -0.14 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.89 3ce6 s ASP 354 CO 0.55 -0.91 0.00 1.41 -0.17 0.00 0.00 175.17 176.05 3ce6 n HIS 355 N 4.23 0.00 -1.26 -5.34 8.25 0.16 -4.95 115.22 116.31 3ce6 n HIS 355 Ca 0.15 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.27 3ce6 n HIS 355 Cb 0.37 -1.67 0.11 0.00 1.12 0.00 0.00 29.99 29.93 3ce6 n HIS 355 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3ce6 s ALA 356 N -2.04 1.96 -0.09 -1.41 0.00 -0.60 -4.65 121.76 114.93 3ce6 s ALA 356 Ca 0.00 0.94 -0.02 0.00 0.00 0.00 0.00 51.96 52.88 3ce6 s ALA 356 Cb 0.00 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.58 3ce6 s ALA 356 CO 0.00 -2.14 0.01 0.42 0.00 0.00 0.00 175.76 174.05 3ce6 s ILE 357 N -1.95 4.35 -0.08 0.00 1.01 -0.27 -0.68 121.20 123.57 3ce6 s ILE 357 Ca 0.76 -0.23 0.02 0.00 0.00 0.00 0.00 60.65 61.20 3ce6 s ILE 357 Cb -0.31 -2.84 0.01 0.00 0.01 0.00 0.00 42.46 39.33 3ce6 s ILE 357 CO 0.48 0.59 -0.13 -0.22 0.00 0.00 0.00 174.94 175.67 3ce6 s LEU 358 N -0.77 1.60 0.18 2.97 2.96 0.34 -0.89 118.68 125.08 3ce6 s LEU 358 Ca 0.12 -0.34 -0.11 0.00 -0.22 0.00 0.00 54.13 53.58 3ce6 s LEU 358 Cb -0.12 -0.90 0.00 0.00 0.50 0.00 0.00 46.19 45.67 3ce6 s LEU 358 CO 0.02 0.01 0.36 -0.83 -1.32 0.00 0.00 176.35 174.60 3ce6 s GLY 359 N 0.89 0.35 -0.02 7.98 0.00 -0.34 -1.71 107.32 114.47 3ce6 s GLY 359 Ca -0.10 -0.73 0.05 0.00 0.00 0.00 0.00 44.72 43.95 3ce6 s GLY 359 CO 0.01 -0.67 -0.19 0.21 0.00 0.00 0.00 173.10 172.46 3ce6 s ASN 360 N -2.95 2.21 0.00 1.64 2.47 -1.26 -1.88 114.94 115.16 3ce6 s ASN 360 Ca 0.16 -0.35 0.02 0.00 0.42 0.00 0.00 52.86 53.11 3ce6 s ASN 360 Cb 0.02 -0.33 0.01 0.00 -1.45 0.00 0.00 41.25 39.49 3ce6 s ASN 360 CO 0.00 0.21 0.44 0.00 -3.72 0.00 0.00 177.10 174.04 3ce6 n ILE 361 N 2.74 0.00 -1.31 -5.21 3.06 0.23 -0.68 119.36 118.18 3ce6 n ILE 361 Ca -0.16 -0.49 -0.30 0.00 -2.50 0.00 0.00 62.75 59.30 3ce6 n ILE 361 Cb 0.53 1.03 0.12 0.00 0.54 0.00 0.00 39.64 41.86 3ce6 n ILE 361 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 3ce6 s GLY 362 N -0.35 1.62 0.22 4.50 0.00 -1.19 -4.82 107.32 107.29 3ce6 s GLY 362 Ca 0.02 -0.13 -0.09 0.00 0.00 0.00 0.00 44.72 44.52 3ce6 s GLY 362 CO 0.03 0.35 1.86 0.84 0.00 0.00 0.00 173.10 176.18 3ce6 h HIS 363 N -1.42 1.10 -2.73 1.90 2.76 -1.95 -3.37 115.15 111.44 3ce6 h HIS 363 Ca -0.49 -0.01 -0.58 0.00 -2.20 0.00 0.00 60.37 57.09 3ce6 h HIS 363 Cb 1.28 -0.36 -0.09 0.00 1.55 0.00 0.00 27.41 29.79 3ce6 h HIS 363 CO 0.43 0.74 -0.62 -0.06 -1.30 0.00 0.00 177.93 177.12 3ce6 s PHE 364 N -5.95 2.95 -0.81 5.26 0.08 -1.26 -4.61 117.98 113.63 3ce6 s PHE 364 Ca -0.13 -0.10 0.23 0.00 0.12 0.00 0.00 56.93 57.04 3ce6 s PHE 364 Cb 0.16 -1.41 0.90 0.00 -0.57 0.00 0.00 43.02 42.10 3ce6 s PHE 364 CO 0.81 0.53 1.70 -0.40 -0.10 0.00 0.00 175.22 177.75 3ce6 n ASP 365 N -0.32 0.34 0.00 1.36 5.75 -1.26 -3.40 116.55 119.02 3ce6 n ASP 365 Ca -0.09 0.56 0.09 0.00 -0.01 0.00 0.00 54.79 55.34 3ce6 n ASP 365 Cb 0.55 -0.64 0.49 0.00 -1.03 0.00 0.00 41.12 40.49 3ce6 n ASP 365 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 3ce6 n ASN 366 N -1.85 0.00 0.02 -1.12 0.23 -1.26 -2.22 115.26 109.06 3ce6 n ASN 366 Ca 0.04 -0.24 0.10 0.00 -0.53 0.00 0.00 54.58 53.95 3ce6 n ASN 366 Cb 0.28 -0.16 0.53 0.00 -2.08 0.00 0.00 39.78 38.34 3ce6 n ASN 366 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3ce6 h GLU 367 N 0.00 0.32 -5.26 -3.83 5.08 -1.66 -1.41 114.58 107.82 3ce6 h GLU 367 Ca 0.00 -0.02 -0.63 0.00 -1.00 0.00 0.00 59.36 57.71 3ce6 h GLU 367 Cb 0.09 -0.07 -0.21 0.00 0.50 0.00 0.00 28.75 29.06 3ce6 h GLU 367 CO 0.00 0.21 -0.64 0.42 -1.00 0.00 0.00 179.01 178.00 3ce6 s ILE 368 N -5.32 4.10 -0.93 3.13 1.01 -0.94 -0.45 121.20 121.79 3ce6 s ILE 368 Ca -0.07 -0.28 -0.13 0.00 0.00 0.00 0.00 60.65 60.17 3ce6 s ILE 368 Cb 0.18 -2.82 -0.09 0.00 0.01 0.00 0.00 42.46 39.75 3ce6 s ILE 368 CO 0.73 0.47 2.09 -0.67 0.00 0.00 0.00 174.94 177.56 3ce6 n ASP 369 N 3.67 4.11 -0.17 3.58 2.03 0.27 -4.66 116.55 125.38 3ce6 n ASP 369 Ca -0.17 -2.51 0.00 0.00 0.52 0.00 0.00 54.79 52.63 3ce6 n ASP 369 Cb 0.52 -1.17 0.26 0.00 -0.72 0.00 0.00 41.12 40.01 3ce6 n ASP 369 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 3ce6 h MET 370 N 6.84 0.89 -0.42 -0.67 2.86 -1.87 -1.92 114.93 120.64 3ce6 h MET 370 Ca 0.49 -0.08 0.05 0.00 -2.06 0.00 0.00 59.70 58.11 3ce6 h MET 370 Cb 0.40 -0.19 -0.05 0.00 0.06 0.00 0.00 31.60 31.82 3ce6 h MET 370 CO 1.70 0.63 0.14 0.00 1.06 0.00 0.00 176.91 180.44 3ce6 h ALA 371 N 1.52 0.49 -0.59 6.32 0.00 -1.96 -0.84 119.26 124.20 3ce6 h ALA 371 Ca 0.24 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.15 3ce6 h ALA 371 Cb -0.02 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3ce6 h ALA 371 CO -0.04 -0.25 0.16 0.78 0.00 0.00 0.00 179.25 179.89 3ce6 h GLY 372 N 0.30 0.97 0.91 0.00 0.00 -1.89 -1.78 103.07 101.59 3ce6 h GLY 372 Ca 0.19 -0.56 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 3ce6 h GLY 372 CO -0.20 0.53 0.11 -2.00 0.00 0.00 0.00 176.54 174.97 3ce6 h LEU 373 N 0.87 0.46 -1.24 3.11 5.85 -1.02 -1.03 115.31 122.32 3ce6 h LEU 373 Ca 0.19 -0.19 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 3ce6 h LEU 373 Cb 0.29 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 3ce6 h LEU 373 CO -0.00 0.53 -0.37 -0.33 -0.34 0.00 0.00 178.44 177.93 3ce6 h GLU 374 N 0.37 0.03 -0.03 1.25 5.08 -0.96 -2.72 114.58 117.59 3ce6 h GLU 374 Ca 0.11 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3ce6 h GLU 374 Cb 0.23 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3ce6 h GLU 374 CO -0.01 0.39 -0.01 0.54 -1.00 0.00 0.00 179.01 178.93 3ce6 n ARG 375 N -4.10 2.19 0.22 2.33 1.74 -0.69 -4.61 116.66 113.75 3ce6 n ARG 375 Ca -0.02 -1.75 0.10 0.00 -0.77 0.00 0.00 57.85 55.42 3ce6 n ARG 375 Cb 0.41 -1.46 0.43 0.00 -1.02 0.00 0.00 32.46 30.81 3ce6 n ARG 375 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3ce6 h SER 376 N 4.26 0.00 0.00 0.55 4.64 -0.85 -3.47 113.55 118.68 3ce6 h SER 376 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ce6 h SER 376 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3ce6 h SER 376 CO 0.00 0.22 0.00 0.61 -0.87 0.00 0.00 176.83 176.79 3ce6 n GLY 377 N 0.28 0.48 3.72 -0.77 0.00 -1.26 -5.08 105.19 102.56 3ce6 n GLY 377 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 3ce6 n GLY 377 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ce6 n ALA 378 N -1.66 1.42 -2.85 4.61 0.00 -1.26 -4.80 120.51 115.97 3ce6 n ALA 378 Ca 0.00 0.18 -0.34 0.00 0.00 0.00 0.00 53.44 53.28 3ce6 n ALA 378 Cb 0.00 -2.31 -0.06 0.00 0.00 0.00 0.00 19.45 17.08 3ce6 n ALA 378 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3ce6 s THR 379 N -1.26 5.20 -0.12 0.00 -4.23 -0.16 -4.87 115.64 110.20 3ce6 s THR 379 Ca 0.66 -0.12 -0.01 0.00 -1.18 0.00 0.00 61.69 61.05 3ce6 s THR 379 Cb -0.45 -3.35 -0.02 0.00 1.34 0.00 0.00 72.50 70.01 3ce6 s THR 379 CO 0.53 0.44 -0.08 -0.60 -0.54 0.00 0.00 174.62 174.38 3ce6 s ARG 380 N -1.54 3.27 -0.18 3.99 3.52 -1.26 -0.39 118.95 126.37 3ce6 s ARG 380 Ca 0.21 -0.58 -0.00 0.00 -0.13 0.00 0.00 55.73 55.23 3ce6 s ARG 380 Cb -0.12 -2.72 0.01 0.00 -1.56 0.00 0.00 34.95 30.56 3ce6 s ARG 380 CO 0.12 0.37 -0.15 0.08 -0.81 0.00 0.00 175.30 174.91 3ce6 s VAL 381 N -0.03 2.51 0.06 7.11 1.01 0.44 -4.98 120.40 126.51 3ce6 s VAL 381 Ca -0.01 -0.80 -0.31 0.00 0.00 0.00 0.00 61.98 60.87 3ce6 s VAL 381 Cb -0.14 -2.07 -0.06 0.00 0.00 0.00 0.00 36.38 34.11 3ce6 s VAL 381 CO 0.03 0.51 1.35 0.21 0.00 0.00 0.00 175.10 177.20 3ce6 s ASN 382 N 1.16 6.89 -0.18 3.32 3.84 -1.26 -0.25 114.94 128.46 3ce6 s ASN 382 Ca 0.01 2.17 -0.12 0.00 0.21 0.00 0.00 52.86 55.13 3ce6 s ASN 382 Cb -0.14 -2.57 -0.22 0.00 -0.55 0.00 0.00 41.25 37.77 3ce6 s ASN 382 CO -0.06 -0.64 0.20 0.52 -2.79 0.00 0.00 177.10 174.33 3ce6 n VAL 383 N 4.24 1.65 -3.74 -5.21 0.31 0.57 -4.95 118.33 111.19 3ce6 n VAL 383 Ca 0.12 -0.39 -0.01 0.00 -0.01 0.00 0.00 64.34 64.05 3ce6 n VAL 383 Cb 0.44 -1.84 -0.00 0.00 -0.91 0.00 0.00 33.84 31.53 3ce6 n VAL 383 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 3ce6 s LYS 384 N -2.48 0.83 0.27 5.55 -2.85 -1.13 -5.03 119.74 114.90 3ce6 s LYS 384 Ca -0.27 -0.48 -0.30 0.00 -1.00 0.00 0.00 55.97 53.91 3ce6 s LYS 384 Cb 0.07 0.27 -0.13 0.00 -2.06 0.00 0.00 37.83 35.98 3ce6 s LYS 384 CO 0.67 -0.38 1.39 -2.30 0.10 0.00 0.00 175.35 174.82 3ce6 n PRO 385 N -0.55 2.11 -1.24 1.78 -0.02 -1.26 -0.98 135.00 134.83 3ce6 n PRO 385 Ca -0.06 0.75 -0.08 0.00 -2.02 0.00 0.00 63.50 62.09 3ce6 n PRO 385 Cb 0.61 -2.39 -0.03 0.00 -0.02 0.00 0.00 33.50 31.66 3ce6 n PRO 385 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3ce6 n GLN 386 N 1.69 -1.31 -3.84 -0.52 3.00 -1.26 -4.96 117.38 110.17 3ce6 n GLN 386 Ca 0.10 0.73 -0.26 0.00 -0.01 0.00 0.00 57.00 57.56 3ce6 n GLN 386 Cb 0.33 -4.89 -0.17 0.00 0.00 0.00 0.00 30.24 25.51 3ce6 n GLN 386 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3ce6 s VAL 387 N -1.93 0.78 0.00 5.09 1.01 -0.15 -0.61 120.40 124.58 3ce6 s VAL 387 Ca 0.00 -0.29 0.06 0.00 0.00 0.00 0.00 61.98 61.75 3ce6 s VAL 387 Cb 0.00 -0.95 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 3ce6 s VAL 387 CO 0.00 0.19 -0.20 -1.81 0.00 0.00 0.00 175.10 173.28 3ce6 s ASP 388 N 1.79 2.33 -0.27 3.32 1.01 -0.77 -0.31 116.67 123.77 3ce6 s ASP 388 Ca 0.03 -0.40 -0.08 0.00 0.71 0.00 0.00 52.55 52.81 3ce6 s ASP 388 Cb -0.14 -0.24 -0.01 0.00 1.01 0.00 0.00 42.92 43.54 3ce6 s ASP 388 CO -0.07 0.21 0.09 -0.22 0.21 0.00 0.00 175.17 175.39 3ce6 s LEU 389 N -0.67 3.67 -0.16 1.23 2.96 0.65 -0.50 118.68 125.84 3ce6 s LEU 389 Ca 0.07 -0.40 -0.06 0.00 -0.22 0.00 0.00 54.13 53.53 3ce6 s LEU 389 Cb -0.08 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.65 3ce6 s LEU 389 CO -0.00 -0.11 0.02 0.26 -1.32 0.00 0.00 176.35 175.21 3ce6 s TRP 390 N 1.58 3.17 -0.06 5.38 0.52 -0.01 -0.42 118.94 129.11 3ce6 s TRP 390 Ca 0.05 -0.04 0.06 0.00 0.02 0.00 0.00 56.10 56.18 3ce6 s TRP 390 Cb -0.16 -2.01 -0.01 0.00 -1.15 0.00 0.00 33.47 30.14 3ce6 s TRP 390 CO 0.04 0.12 -0.24 0.99 0.02 0.00 0.00 176.95 177.88 3ce6 s THR 391 N 0.24 2.14 -0.39 2.01 2.01 0.48 -0.05 115.64 122.08 3ce6 s THR 391 Ca 0.01 -1.04 -0.13 0.00 0.31 0.00 0.00 61.69 60.85 3ce6 s THR 391 Cb -0.13 -1.78 0.02 0.00 0.01 0.00 0.00 72.50 70.63 3ce6 s THR 391 CO 0.01 0.57 0.25 -0.36 -0.69 0.00 0.00 174.62 174.40 3ce6 s PHE 392 N -0.20 3.24 0.44 4.92 0.08 -0.21 -0.99 117.98 125.26 3ce6 s PHE 392 Ca -0.02 -0.80 0.12 0.00 0.12 0.00 0.00 56.93 56.35 3ce6 s PHE 392 Cb -0.13 -2.51 0.98 0.00 -0.57 0.00 0.00 43.02 40.79 3ce6 s PHE 392 CO 0.03 -0.62 2.01 0.78 -0.10 0.00 0.00 175.22 177.33 3ce6 h GLY 393 N 8.52 0.15 1.86 4.36 0.00 -1.88 0.25 103.07 116.34 3ce6 h GLY 393 Ca -0.26 -0.08 -0.06 0.00 0.00 0.00 0.00 47.33 46.93 3ce6 h GLY 393 CO 0.70 0.07 -0.21 1.29 0.00 0.00 0.00 176.54 178.39 3ce6 h ASP 394 N 0.14 0.17 0.00 0.19 2.03 -1.97 -3.28 116.42 113.69 3ce6 h ASP 394 Ca 0.03 -0.04 -0.07 0.00 -0.73 0.00 0.00 57.03 56.22 3ce6 h ASP 394 Cb 0.22 -0.04 -0.01 0.00 -0.83 0.00 0.00 39.33 38.66 3ce6 h ASP 394 CO 0.01 0.39 -1.56 0.35 -1.03 0.00 0.00 179.24 177.40 3ce6 n THR 395 N -4.22 0.28 -0.59 1.15 -2.24 -1.08 -5.00 114.28 102.58 3ce6 n THR 395 Ca -0.01 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 3ce6 n THR 395 Cb 0.32 -0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 3ce6 n THR 395 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ce6 n GLY 396 N 2.11 0.79 3.85 3.38 0.00 0.86 -5.03 105.19 111.15 3ce6 n GLY 396 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 3ce6 n GLY 396 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ce6 s ARG 397 N -0.41 3.98 0.08 1.61 0.52 -1.22 -4.80 118.95 118.70 3ce6 s ARG 397 Ca 0.00 0.53 0.08 0.00 -0.52 0.00 0.00 55.73 55.81 3ce6 s ARG 397 Cb 0.00 -2.77 -0.04 0.00 0.52 0.00 0.00 34.95 32.66 3ce6 s ARG 397 CO 0.00 0.37 -0.18 -1.12 0.02 0.00 0.00 175.30 174.40 3ce6 s SER 398 N -1.96 3.88 0.09 0.23 0.01 -1.26 -1.05 113.70 113.65 3ce6 s SER 398 Ca 0.44 -0.49 0.09 0.00 1.31 0.00 0.00 55.95 57.30 3ce6 s SER 398 Cb -0.14 -0.60 -0.03 0.00 0.21 0.00 0.00 66.02 65.47 3ce6 s SER 398 CO 0.20 0.21 -0.23 -0.63 0.41 0.00 0.00 173.24 173.21 3ce6 s ILE 399 N -1.05 1.85 -0.20 1.44 -1.09 0.93 0.38 121.20 123.46 3ce6 s ILE 399 Ca 0.17 -1.50 -0.13 0.00 -2.23 0.00 0.00 60.65 56.95 3ce6 s ILE 399 Cb -0.11 -1.64 -0.04 0.00 -1.58 0.00 0.00 42.46 39.09 3ce6 s ILE 399 CO 0.08 0.06 0.29 -0.63 -1.23 0.00 0.00 174.94 173.51 3ce6 s ILE 400 N -1.04 5.29 -0.14 2.92 1.01 0.14 -0.83 121.20 128.56 3ce6 s ILE 400 Ca 0.09 0.49 0.00 0.00 0.00 0.00 0.00 60.65 61.23 3ce6 s ILE 400 Cb -0.10 -3.62 -0.01 0.00 0.01 0.00 0.00 42.46 38.74 3ce6 s ILE 400 CO 0.04 0.33 -0.15 -0.69 0.00 0.00 0.00 174.94 174.47 3ce6 s VAL 401 N 0.90 2.77 -0.15 2.92 1.01 0.34 -0.50 120.40 127.69 3ce6 s VAL 401 Ca 0.15 -0.75 -0.14 0.00 0.00 0.00 0.00 61.98 61.23 3ce6 s VAL 401 Cb -0.14 -2.16 -0.05 0.00 0.00 0.00 0.00 36.38 34.04 3ce6 s VAL 401 CO 0.05 0.52 0.32 -0.76 0.00 0.00 0.00 175.10 175.23 3ce6 s LEU 402 N 0.61 4.25 -1.56 3.92 1.43 -0.69 -1.84 118.68 124.80 3ce6 s LEU 402 Ca -0.08 0.56 -0.01 0.00 -1.03 0.00 0.00 54.13 53.57 3ce6 s LEU 402 Cb -0.16 -2.43 0.00 0.00 0.03 0.00 0.00 46.19 43.64 3ce6 s LEU 402 CO 0.03 0.09 0.10 -1.20 0.23 0.00 0.00 176.35 175.60 3ce6 n SER 403 N 3.54 -5.38 -3.95 2.29 7.64 0.22 -1.08 113.62 116.90 3ce6 n SER 403 Ca -0.11 -0.01 -0.31 0.00 1.01 0.00 0.00 58.87 59.44 3ce6 n SER 403 Cb 0.52 -4.48 -0.04 0.00 -1.01 0.00 0.00 64.21 59.20 3ce6 n SER 403 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3ce6 n GLU 404 N -3.13 -2.21 -0.33 1.43 1.02 -1.26 -0.50 120.64 115.66 3ce6 n GLU 404 Ca -0.20 0.25 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 3ce6 n GLU 404 Cb 0.66 -4.89 0.00 0.00 -0.02 0.00 0.00 31.44 27.19 3ce6 n GLU 404 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ce6 n GLY 405 N -1.09 1.84 3.87 0.62 0.00 -0.24 -4.96 105.19 105.22 3ce6 n GLY 405 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 3ce6 n GLY 405 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ce6 s ARG 406 N -0.18 3.55 -0.29 1.61 0.52 0.35 -4.08 118.95 120.42 3ce6 s ARG 406 Ca 0.00 0.71 -0.38 0.00 -0.52 0.00 0.00 55.73 55.54 3ce6 s ARG 406 Cb 0.00 -2.09 -0.14 0.00 0.52 0.00 0.00 34.95 33.24 3ce6 s ARG 406 CO 0.00 -0.59 1.92 1.47 0.02 0.00 0.00 175.30 178.12 3ce6 n LEU 407 N -2.75 2.35 0.12 2.53 -0.00 -1.25 -4.53 117.00 113.46 3ce6 n LEU 407 Ca 0.06 0.84 0.00 0.00 -0.00 0.00 0.00 56.01 56.91 3ce6 n LEU 407 Cb 0.54 -1.19 0.01 0.00 -0.00 0.00 0.00 43.42 42.78 3ce6 n LEU 407 CO 0.58 -0.49 0.40 0.17 -0.00 0.00 0.00 177.39 178.05 3ce6 h LEU 408 N 9.16 0.00 -0.66 1.47 8.10 -1.22 -1.38 115.31 130.78 3ce6 h LEU 408 Ca -0.39 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.59 3ce6 h LEU 408 Cb 1.32 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 41.51 3ce6 h LEU 408 CO 0.99 0.63 0.36 -0.55 -4.11 0.00 0.00 178.44 175.76 3ce6 h ASN 409 N 0.00 0.82 0.96 0.17 -1.07 -1.83 0.07 115.58 114.69 3ce6 h ASN 409 Ca -0.01 -0.09 -0.21 0.00 0.07 0.00 0.00 56.30 56.06 3ce6 h ASN 409 Cb 1.45 -0.21 -0.03 0.00 -2.07 0.00 0.00 38.32 37.46 3ce6 h ASN 409 CO 0.08 0.68 -1.09 -0.07 0.07 0.00 0.00 177.43 177.10 3ce6 h LEU 410 N 0.90 0.00 0.01 6.14 3.38 -1.81 -1.05 115.31 122.88 3ce6 h LEU 410 Ca 0.23 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 3ce6 h LEU 410 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3ce6 h LEU 410 CO -0.04 0.90 -0.13 1.23 0.09 0.00 0.00 178.44 180.49 3ce6 h GLY 411 N 3.22 0.07 1.03 0.83 0.00 -1.14 -3.37 103.07 103.71 3ce6 h GLY 411 Ca -0.07 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.10 3ce6 h GLY 411 CO 0.11 0.14 -0.88 3.43 0.00 0.00 0.00 176.54 179.33 3ce6 h ASN 412 N -0.76 0.00 0.00 0.19 2.35 -1.15 -3.47 115.58 112.73 3ce6 h ASN 412 Ca -0.02 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.64 3ce6 h ASN 412 Cb 0.99 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.36 3ce6 h ASN 412 CO 0.02 0.05 0.00 0.00 -1.65 0.00 0.00 177.43 175.85 3ce6 n ALA 413 N -2.05 0.00 -1.06 -0.83 0.00 -0.89 -4.49 120.51 111.20 3ce6 n ALA 413 Ca 0.01 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.51 3ce6 n ALA 413 Cb 0.51 0.00 0.09 0.00 0.00 0.00 0.00 19.45 20.04 3ce6 n ALA 413 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3ce6 n THR 414 N 0.00 1.33 -4.41 0.00 -2.24 -1.03 -4.65 114.28 103.28 3ce6 n THR 414 Ca 0.00 -1.56 0.00 0.00 -2.27 0.00 0.00 64.05 60.22 3ce6 n THR 414 Cb 0.00 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 3ce6 n THR 414 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ce6 n GLY 415 N -0.97 -1.28 3.74 3.38 0.00 -0.45 -4.83 105.19 104.79 3ce6 n GLY 415 Ca 0.10 -1.21 -0.35 0.00 0.00 0.00 0.00 46.02 44.56 3ce6 n GLY 415 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3ce6 s HIS 416 N 0.00 2.23 0.55 1.61 3.76 -1.26 -4.70 115.29 117.47 3ce6 s HIS 416 Ca 0.00 1.56 -0.19 0.00 -0.15 0.00 0.00 55.06 56.28 3ce6 s HIS 416 Cb 0.00 -3.45 -0.06 0.00 1.11 0.00 0.00 32.58 30.19 3ce6 s HIS 416 CO 0.00 -2.39 1.11 -1.25 -0.85 0.00 0.00 174.74 171.36 3ce6 s PRO 417 N -3.73 3.38 0.27 8.40 0.04 -1.26 -4.83 135.00 137.26 3ce6 s PRO 417 Ca 0.75 1.52 -0.10 0.00 0.04 0.00 0.00 61.00 63.20 3ce6 s PRO 417 Cb -0.29 -2.02 0.40 0.00 0.04 0.00 0.00 34.50 32.64 3ce6 s PRO 417 CO 0.41 -0.81 1.56 0.77 0.04 0.00 0.00 177.00 178.97 3ce6 h SER 418 N 1.10 -1.02 -0.07 6.66 0.02 -1.94 -1.10 113.55 117.21 3ce6 h SER 418 Ca -0.49 0.30 -0.04 0.00 -0.84 0.00 0.00 61.79 60.71 3ce6 h SER 418 Cb 1.25 0.64 -0.01 0.00 0.14 0.00 0.00 62.40 64.41 3ce6 h SER 418 CO 0.57 -0.32 -0.07 0.15 -1.14 0.00 0.00 176.83 176.02 3ce6 h PHE 419 N -0.00 0.33 -0.10 3.45 3.57 -1.90 0.19 116.94 122.47 3ce6 h PHE 419 Ca 0.44 -0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.86 3ce6 h PHE 419 Cb 0.69 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.33 3ce6 h PHE 419 CO -0.78 0.40 -0.13 0.28 -2.23 0.00 0.00 178.31 175.85 3ce6 h VAL 420 N 0.31 1.37 0.00 1.41 2.07 -1.66 -3.17 116.25 116.58 3ce6 h VAL 420 Ca 0.07 -1.34 0.00 0.00 0.82 0.00 0.00 66.70 66.25 3ce6 h VAL 420 Cb 0.33 2.01 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 3ce6 h VAL 420 CO 0.02 0.38 0.00 0.24 0.02 0.00 0.00 177.57 178.23 3ce6 h MET 421 N -0.15 0.00 -0.27 1.57 2.86 -0.37 -2.10 114.93 116.48 3ce6 h MET 421 Ca 0.01 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.62 3ce6 h MET 421 Cb 0.67 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 3ce6 h MET 421 CO 0.03 0.00 0.01 1.03 1.06 0.00 0.00 176.91 179.04 3ce6 h SER 422 N 0.00 0.36 0.05 1.22 0.87 -0.62 0.29 113.55 115.73 3ce6 h SER 422 Ca 0.00 -0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.50 3ce6 h SER 422 Cb 0.28 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 3ce6 h SER 422 CO 0.00 0.42 -0.03 0.78 -0.53 0.00 0.00 176.83 177.47 3ce6 h ASN 423 N 0.38 -0.06 -0.63 6.23 4.21 -1.50 -1.16 115.58 123.06 3ce6 h ASN 423 Ca 0.09 -0.32 -0.01 0.00 1.21 0.00 0.00 56.30 57.27 3ce6 h ASN 423 Cb 0.24 0.02 -0.03 0.00 -1.12 0.00 0.00 38.32 37.43 3ce6 h ASN 423 CO 0.00 0.29 0.36 0.28 -1.29 0.00 0.00 177.43 177.07 3ce6 h SER 424 N -0.42 0.78 1.41 5.81 0.02 -1.44 -1.66 113.55 118.05 3ce6 h SER 424 Ca -0.01 -0.08 -0.08 0.00 -0.84 0.00 0.00 61.79 60.77 3ce6 h SER 424 Cb 0.38 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 3ce6 h SER 424 CO 0.01 0.63 -0.61 -0.26 -1.14 0.00 0.00 176.83 175.46 3ce6 h PHE 425 N 0.86 0.00 -0.34 3.45 0.04 -0.47 -0.53 116.94 119.94 3ce6 h PHE 425 Ca 0.22 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.96 3ce6 h PHE 425 Cb 0.02 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.16 3ce6 h PHE 425 CO -0.01 0.36 0.10 0.00 -0.60 0.00 0.00 178.31 178.16 3ce6 h ALA 426 N 1.64 0.44 -0.24 2.45 0.00 -0.96 0.18 119.26 122.78 3ce6 h ALA 426 Ca -0.03 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3ce6 h ALA 426 Cb 1.30 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 3ce6 h ALA 426 CO 0.04 0.09 0.16 -0.91 0.00 0.00 0.00 179.25 178.63 3ce6 h ASN 427 N 0.39 0.27 -0.94 0.00 -0.26 -1.03 -0.50 115.58 113.52 3ce6 h ASN 427 Ca 0.11 -0.01 -0.00 0.00 -0.56 0.00 0.00 56.30 55.84 3ce6 h ASN 427 Cb 0.26 -0.07 -0.05 0.00 -1.06 0.00 0.00 38.32 37.41 3ce6 h ASN 427 CO -0.00 0.20 0.58 -0.61 -1.06 0.00 0.00 177.43 176.54 3ce6 h GLN 428 N 0.32 1.27 -0.35 0.81 4.15 -0.95 -0.43 115.11 119.94 3ce6 h GLN 428 Ca 0.09 -0.11 -0.08 0.00 0.77 0.00 0.00 58.65 59.32 3ce6 h GLN 428 Cb -0.03 -0.27 -0.01 0.00 0.21 0.00 0.00 27.48 27.37 3ce6 h GLN 428 CO -0.02 0.88 -0.09 1.15 -1.93 0.00 0.00 178.83 178.82 3ce6 h THR 429 N 1.30 1.28 -0.55 2.39 2.02 -0.35 -0.12 112.91 118.88 3ce6 h THR 429 Ca 0.34 -1.16 -0.02 0.00 0.77 0.00 0.00 66.41 66.34 3ce6 h THR 429 Cb -0.08 1.32 -0.03 0.00 -1.74 0.00 0.00 68.15 67.62 3ce6 h THR 429 CO -0.07 0.38 0.27 0.40 0.37 0.00 0.00 175.52 176.87 3ce6 h ILE 430 N 0.47 1.20 -0.62 3.11 2.04 -0.92 0.08 117.51 122.86 3ce6 h ILE 430 Ca 0.09 -0.56 0.02 0.00 1.00 0.00 0.00 64.86 65.40 3ce6 h ILE 430 Cb 0.60 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 3ce6 h ILE 430 CO 0.04 0.23 0.40 0.00 0.00 0.00 0.00 178.15 178.81 3ce6 h ALA 431 N 1.10 0.80 -0.33 1.87 0.00 -0.75 0.83 119.26 122.79 3ce6 h ALA 431 Ca 0.19 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3ce6 h ALA 431 Cb 0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3ce6 h ALA 431 CO -0.02 0.17 0.12 0.37 0.00 0.00 0.00 179.25 179.89 3ce6 h GLN 432 N 0.80 0.51 -0.06 0.00 5.75 -0.41 -0.87 115.11 120.83 3ce6 h GLN 432 Ca 0.24 -0.10 0.03 0.00 -0.15 0.00 0.00 58.65 58.67 3ce6 h GLN 432 Cb -0.04 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.40 3ce6 h GLN 432 CO -0.08 0.52 -0.11 0.82 -2.65 0.00 0.00 178.83 177.33 3ce6 h ILE 433 N 0.39 0.69 -0.27 2.39 2.04 -0.60 -0.35 117.51 121.81 3ce6 h ILE 433 Ca 0.11 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.97 3ce6 h ILE 433 Cb 0.21 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 3ce6 h ILE 433 CO -0.01 0.00 0.18 -0.33 0.00 0.00 0.00 178.15 177.99 3ce6 h GLU 434 N -0.16 0.36 -0.03 2.37 4.39 -0.61 -0.74 114.58 120.14 3ce6 h GLU 434 Ca 0.06 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.62 3ce6 h GLU 434 Cb 0.25 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 3ce6 h GLU 434 CO -0.16 0.24 -0.52 1.25 -1.16 0.00 0.00 179.01 178.66 3ce6 h LEU 435 N 0.36 0.10 0.17 1.33 5.85 -1.01 -1.69 115.31 120.42 3ce6 h LEU 435 Ca 0.10 -0.05 -0.26 0.00 0.84 0.00 0.00 57.88 58.51 3ce6 h LEU 435 Cb -0.04 -0.03 0.02 0.00 0.37 0.00 0.00 40.66 40.99 3ce6 h LEU 435 CO -0.02 0.60 -1.22 -0.25 -0.34 0.00 0.00 178.44 177.21 3ce6 h TRP 436 N 0.07 0.66 0.00 1.25 2.91 -0.76 -3.16 115.95 116.92 3ce6 h TRP 436 Ca -0.00 -0.48 -0.02 0.00 1.13 0.00 0.00 58.89 59.52 3ce6 h TRP 436 Cb 0.95 -0.03 -0.00 0.00 -0.51 0.00 0.00 29.16 29.57 3ce6 h TRP 436 CO 0.01 1.47 -0.91 1.79 -1.03 0.00 0.00 178.44 179.77 3ce6 h THR 437 N -0.17 0.06 0.00 2.65 1.35 -1.16 -3.33 112.91 112.31 3ce6 h THR 437 Ca -0.23 -1.11 -0.04 0.00 -0.55 0.00 0.00 66.41 64.48 3ce6 h THR 437 Cb 1.86 1.62 -0.08 0.00 -1.73 0.00 0.00 68.15 69.82 3ce6 h THR 437 CO 0.17 0.03 -0.50 0.29 -0.25 0.00 0.00 175.52 175.26 3ce6 n LYS 438 N -2.76 1.05 -0.32 4.72 5.02 -0.64 -4.92 118.16 120.31 3ce6 n LYS 438 Ca -0.00 -2.66 0.21 0.00 -2.02 0.00 0.00 58.31 53.83 3ce6 n LYS 438 Cb 0.58 -1.16 0.48 0.00 -0.02 0.00 0.00 35.03 34.91 3ce6 n LYS 438 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 3ce6 h ASN 439 N 0.69 0.50 0.38 4.39 -0.73 -1.67 -0.96 115.58 118.18 3ce6 h ASN 439 Ca -0.05 0.09 -0.00 0.00 1.87 0.00 0.00 56.30 58.20 3ce6 h ASN 439 Cb 1.22 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 39.82 3ce6 h ASN 439 CO 0.02 0.12 -0.02 0.44 -0.37 0.00 0.00 177.43 177.62 3ce6 h ASP 440 N 0.45 0.00 0.24 1.15 3.32 -1.91 -2.18 116.42 117.50 3ce6 h ASP 440 Ca 0.59 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.64 3ce6 h ASP 440 Cb 1.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.93 3ce6 h ASP 440 CO -0.31 0.02 0.00 -0.62 -1.72 0.00 0.00 179.24 176.61 3ce6 n GLU 441 N -3.21 0.56 -4.90 3.56 1.02 -0.36 -4.83 120.64 112.49 3ce6 n GLU 441 Ca -0.02 0.03 -0.33 0.00 -0.02 0.00 0.00 57.16 56.83 3ce6 n GLU 441 Cb 0.17 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 29.95 3ce6 n GLU 441 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3ce6 s TYR 442 N -2.30 2.71 0.68 -0.32 1.51 -0.82 -5.12 117.35 113.69 3ce6 s TYR 442 Ca 0.30 -0.34 0.04 0.00 -1.01 0.00 0.00 57.07 56.06 3ce6 s TYR 442 Cb 0.17 -1.68 0.13 0.00 -0.11 0.00 0.00 41.96 40.46 3ce6 s TYR 442 CO 0.34 0.04 0.94 -0.51 -1.11 0.00 0.00 175.55 175.25 3ce6 s ASP 443 N -0.39 4.53 -1.39 2.29 1.01 -1.26 -4.91 116.67 116.54 3ce6 s ASP 443 Ca 0.04 -0.65 -0.12 0.00 0.71 0.00 0.00 52.55 52.54 3ce6 s ASP 443 Cb -0.12 0.28 -0.05 0.00 1.01 0.00 0.00 42.92 44.04 3ce6 s ASP 443 CO 0.02 -1.75 2.52 0.59 0.21 0.00 0.00 175.17 176.76 3ce6 n ASN 444 N -2.65 6.14 -4.24 0.27 3.02 -1.26 -4.04 115.26 112.50 3ce6 n ASN 444 Ca 0.17 -2.63 -0.13 0.00 -0.03 0.00 0.00 54.58 51.96 3ce6 n ASN 444 Cb 0.61 -1.48 -0.10 0.00 -0.61 0.00 0.00 39.78 38.20 3ce6 n ASN 444 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3ce6 s GLU 445 N 2.93 1.25 -0.16 3.52 2.02 -1.26 -4.82 118.70 122.16 3ce6 s GLU 445 Ca 0.57 -1.66 -0.19 0.00 0.02 0.00 0.00 54.97 53.72 3ce6 s GLU 445 Cb 0.15 0.07 -0.03 0.00 0.10 0.00 0.00 34.13 34.42 3ce6 s GLU 445 CO -0.05 -0.34 0.53 0.08 0.02 0.00 0.00 175.26 175.50 3ce6 s VAL 446 N -4.00 5.12 0.19 2.63 1.01 -1.26 -1.97 120.40 122.12 3ce6 s VAL 446 Ca 0.37 1.01 0.10 0.00 0.00 0.00 0.00 61.98 63.46 3ce6 s VAL 446 Cb 0.07 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 3ce6 s VAL 446 CO 0.12 0.23 -0.15 -0.31 0.00 0.00 0.00 175.10 174.98 3ce6 s TYR 447 N 1.27 2.50 0.22 5.22 1.51 -0.16 -4.96 117.35 122.95 3ce6 s TYR 447 Ca 0.26 -0.28 0.09 0.00 -1.01 0.00 0.00 57.07 56.14 3ce6 s TYR 447 Cb -0.15 -1.22 -0.04 0.00 -0.11 0.00 0.00 41.96 40.43 3ce6 s TYR 447 CO 0.10 0.51 -0.05 1.03 -1.11 0.00 0.00 175.55 176.03 3ce6 s ARG 448 N -2.80 2.17 0.46 -0.62 0.52 -1.26 -0.12 118.95 117.30 3ce6 s ARG 448 Ca 0.24 -1.34 -0.23 0.00 -0.52 0.00 0.00 55.73 53.88 3ce6 s ARG 448 Cb -0.08 -2.16 -0.07 0.00 0.52 0.00 0.00 34.95 33.15 3ce6 s ARG 448 CO 0.13 0.40 1.20 -0.51 0.02 0.00 0.00 175.30 176.55 3ce6 s LEU 449 N -3.21 4.02 0.62 2.53 1.43 -1.26 -4.97 118.68 117.84 3ce6 s LEU 449 Ca 0.28 2.39 -0.19 0.00 -1.03 0.00 0.00 54.13 55.58 3ce6 s LEU 449 Cb -0.08 -4.21 -0.02 0.00 0.03 0.00 0.00 46.19 41.91 3ce6 s LEU 449 CO 0.17 -0.99 1.30 -2.84 0.23 0.00 0.00 176.35 174.23 3ce6 s PRO 450 N -2.67 2.74 0.42 1.29 0.02 -1.26 -4.90 135.00 130.65 3ce6 s PRO 450 Ca 0.64 2.09 0.11 0.00 0.02 0.00 0.00 61.00 63.85 3ce6 s PRO 450 Cb -0.31 -1.96 0.96 0.00 0.02 0.00 0.00 34.50 33.21 3ce6 s PRO 450 CO 0.38 -1.46 2.01 -0.22 -0.33 0.00 0.00 177.00 177.38 3ce6 h LYS 451 N 0.81 0.46 -0.57 5.54 3.64 -1.99 -1.81 116.57 122.65 3ce6 h LYS 451 Ca -0.51 -0.03 0.08 0.00 -1.27 0.00 0.00 60.65 58.92 3ce6 h LYS 451 Cb 1.32 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 33.01 3ce6 h LYS 451 CO 0.54 0.30 0.38 1.12 -2.27 0.00 0.00 179.45 179.53 3ce6 h HIS 452 N 0.47 0.49 0.07 1.91 2.07 -1.97 -0.65 115.15 117.55 3ce6 h HIS 452 Ca 0.23 0.01 -0.26 0.00 -2.85 0.00 0.00 60.37 57.51 3ce6 h HIS 452 Cb 0.31 -0.16 0.01 0.00 2.57 0.00 0.00 27.41 30.14 3ce6 h HIS 452 CO -0.00 0.25 -1.10 -0.07 -3.07 0.00 0.00 177.93 173.94 3ce6 h LEU 453 N 0.48 0.54 -0.63 6.12 3.38 -1.70 -0.90 115.31 122.60 3ce6 h LEU 453 Ca 0.26 -0.49 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 3ce6 h LEU 453 Cb 0.39 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 3ce6 h LEU 453 CO -0.07 1.33 0.24 0.44 0.09 0.00 0.00 178.44 180.47 3ce6 h ASP 454 N 0.17 0.88 -0.62 -0.43 3.32 -1.27 -2.55 116.42 115.92 3ce6 h ASP 454 Ca -0.12 -0.18 0.05 0.00 0.02 0.00 0.00 57.03 56.81 3ce6 h ASP 454 Cb 1.78 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 41.05 3ce6 h ASP 454 CO 0.19 0.82 0.34 -0.33 -1.72 0.00 0.00 179.24 178.54 3ce6 h GLU 455 N 0.89 0.62 -0.84 3.56 5.08 -1.07 0.05 114.58 122.87 3ce6 h GLU 455 Ca 0.21 -0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.62 3ce6 h GLU 455 Cb 0.22 -0.14 -0.07 0.00 0.50 0.00 0.00 28.75 29.26 3ce6 h GLU 455 CO -0.02 0.41 0.50 -0.22 -1.00 0.00 0.00 179.01 178.68 3ce6 h LYS 456 N 0.64 0.82 -0.13 2.33 3.64 -0.94 0.55 116.57 123.49 3ce6 h LYS 456 Ca 0.28 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.57 3ce6 h LYS 456 Cb 0.16 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 3ce6 h LYS 456 CO -0.17 0.54 -0.07 0.28 -2.27 0.00 0.00 179.45 177.77 3ce6 h VAL 457 N 0.85 1.32 -0.75 2.00 2.07 -1.15 -2.65 116.25 117.93 3ce6 h VAL 457 Ca 0.40 -1.11 0.01 0.00 0.82 0.00 0.00 66.70 66.81 3ce6 h VAL 457 Cb 0.32 1.78 -0.04 0.00 -1.52 0.00 0.00 31.29 31.84 3ce6 h VAL 457 CO -0.23 0.32 0.49 0.00 0.02 0.00 0.00 177.57 178.17 3ce6 h ALA 458 N 0.65 0.95 -0.83 1.67 0.00 -0.36 -2.84 119.26 118.51 3ce6 h ALA 458 Ca 0.03 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.92 3ce6 h ALA 458 Cb 0.54 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 3ce6 h ALA 458 CO 0.02 0.38 0.53 -0.09 0.00 0.00 0.00 179.25 180.08 3ce6 h ARG 459 N 1.02 0.98 -0.88 0.00 2.43 -0.76 0.47 114.38 117.65 3ce6 h ARG 459 Ca 0.27 -0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.47 3ce6 h ARG 459 Cb -0.11 -0.22 -0.06 0.00 -0.42 0.00 0.00 29.97 29.16 3ce6 h ARG 459 CO -0.06 0.65 0.57 0.82 -1.51 0.00 0.00 179.97 180.44 3ce6 h ILE 460 N 1.01 1.01 0.16 1.20 2.04 -1.24 -1.77 117.51 119.93 3ce6 h ILE 460 Ca 0.34 -0.32 -0.29 0.00 1.00 0.00 0.00 64.86 65.59 3ce6 h ILE 460 Cb 0.04 0.01 0.02 0.00 -0.74 0.00 0.00 36.82 36.15 3ce6 h ILE 460 CO -0.13 0.17 -1.30 0.45 0.00 0.00 0.00 178.15 177.35 3ce6 h HIS 461 N 0.92 0.67 -0.59 1.37 3.86 -0.98 -0.99 115.15 119.42 3ce6 h HIS 461 Ca 0.39 -0.48 0.07 0.00 -1.16 0.00 0.00 60.37 59.19 3ce6 h HIS 461 Cb 0.31 -0.03 -0.06 0.00 1.06 0.00 0.00 27.41 28.69 3ce6 h HIS 461 CO -0.00 1.37 0.26 0.28 0.86 0.00 0.00 177.93 180.70 3ce6 h VAL 462 N 0.12 0.86 -0.63 2.45 2.07 -0.83 -1.70 116.25 118.58 3ce6 h VAL 462 Ca -0.17 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.19 3ce6 h VAL 462 Cb 2.01 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 32.08 3ce6 h VAL 462 CO 0.23 0.09 0.40 -0.08 0.02 0.00 0.00 177.57 178.22 3ce6 h GLU 463 N 0.48 0.84 -0.36 1.57 4.57 -1.25 -0.62 114.58 119.82 3ce6 h GLU 463 Ca 0.28 -0.07 -0.06 0.00 -1.18 0.00 0.00 59.36 58.34 3ce6 h GLU 463 Cb 0.27 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 3ce6 h GLU 463 CO -0.24 0.58 -0.02 0.00 -1.18 0.00 0.00 179.01 178.15 3ce6 h ALA 464 N 1.21 1.29 -0.00 2.92 0.00 -0.91 -1.68 119.26 122.08 3ce6 h ALA 464 Ca 0.23 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3ce6 h ALA 464 Cb -0.06 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.58 3ce6 h ALA 464 CO -0.05 0.48 -0.06 1.28 0.00 0.00 0.00 179.25 180.90 3ce6 n LEU 465 N -4.25 0.10 0.00 0.00 4.77 -0.66 -4.93 117.00 112.03 3ce6 n LEU 465 Ca 0.02 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.35 3ce6 n LEU 465 Cb 0.27 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 3ce6 n LEU 465 CO 0.40 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 3ce6 n GLY 466 N 1.43 0.55 3.81 -0.72 0.00 -0.63 -5.06 105.19 104.58 3ce6 n GLY 466 Ca 0.09 -0.83 -0.31 0.00 0.00 0.00 0.00 46.02 44.96 3ce6 n GLY 466 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ce6 s GLY 467 N -2.78 1.76 -0.29 -0.02 0.00 -0.31 -5.01 107.32 100.67 3ce6 s GLY 467 Ca 0.00 0.16 0.03 0.00 0.00 0.00 0.00 44.72 44.90 3ce6 s GLY 467 CO 0.00 0.47 -0.02 0.30 0.00 0.00 0.00 173.10 173.84 3ce6 s HIS 468 N -2.92 3.29 0.29 1.90 3.76 -1.26 -4.47 115.29 115.88 3ce6 s HIS 468 Ca 0.59 -2.51 -0.29 0.00 -0.15 0.00 0.00 55.06 52.70 3ce6 s HIS 468 Cb -0.14 -2.30 -0.10 0.00 1.11 0.00 0.00 32.58 31.15 3ce6 s HIS 468 CO 0.51 -0.90 1.26 -0.51 -0.85 0.00 0.00 174.74 174.25 3ce6 s LEU 469 N 1.08 4.46 0.33 0.89 1.43 -1.26 -5.05 118.68 120.56 3ce6 s LEU 469 Ca 0.01 2.52 -0.23 0.00 -1.03 0.00 0.00 54.13 55.40 3ce6 s LEU 469 Cb -0.19 -3.63 -0.10 0.00 0.03 0.00 0.00 46.19 42.29 3ce6 s LEU 469 CO -0.08 -0.44 0.89 -0.89 0.23 0.00 0.00 176.35 176.07 3ce6 s THR 470 N -0.86 4.36 -0.17 5.49 2.01 -1.26 -5.06 115.64 120.15 3ce6 s THR 470 Ca 0.50 1.58 -0.06 0.00 0.31 0.00 0.00 61.69 64.01 3ce6 s THR 470 Cb -0.37 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.25 3ce6 s THR 470 CO 0.47 0.01 0.04 -0.75 -0.69 0.00 0.00 174.62 173.69 3ce6 s LYS 471 N -2.40 3.87 0.37 4.92 2.20 -1.26 -5.07 119.74 122.37 3ce6 s LYS 471 Ca 0.52 -0.39 -0.28 0.00 -0.36 0.00 0.00 55.97 55.47 3ce6 s LYS 471 Cb -0.15 -3.12 -0.10 0.00 -1.51 0.00 0.00 37.83 32.94 3ce6 s LYS 471 CO 0.20 0.29 1.37 -0.51 -0.36 0.00 0.00 175.35 176.33 3ce6 s LEU 472 N 0.31 4.34 0.77 5.43 1.43 -1.26 -5.01 118.68 124.68 3ce6 s LEU 472 Ca 0.02 2.81 -0.12 0.00 -1.03 0.00 0.00 54.13 55.81 3ce6 s LEU 472 Cb -0.13 -3.72 0.05 0.00 0.03 0.00 0.00 46.19 42.43 3ce6 s LEU 472 CO 0.01 -0.74 1.11 0.42 0.23 0.00 0.00 176.35 177.38 3ce6 s THR 473 N -1.16 3.08 0.20 5.49 -4.23 -1.26 -4.86 115.64 112.89 3ce6 s THR 473 Ca 0.52 0.35 -0.11 0.00 -1.18 0.00 0.00 61.69 61.27 3ce6 s THR 473 Cb -0.42 -3.22 0.12 0.00 1.34 0.00 0.00 72.50 70.32 3ce6 s THR 473 CO 0.56 -0.46 1.76 0.50 -0.54 0.00 0.00 174.62 176.44 3ce6 h LYS 474 N -0.94 0.42 -0.58 3.99 3.64 -1.99 0.53 116.57 121.65 3ce6 h LYS 474 Ca -0.46 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 58.88 3ce6 h LYS 474 Cb 1.27 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.97 3ce6 h LYS 474 CO 0.62 0.28 0.33 0.93 -2.27 0.00 0.00 179.45 179.34 3ce6 h GLU 475 N 0.43 0.79 -0.65 1.90 5.08 -1.99 -0.99 114.58 119.16 3ce6 h GLU 475 Ca 0.27 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.48 3ce6 h GLU 475 Cb 0.28 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 3ce6 h GLU 475 CO -0.25 0.59 0.14 1.96 -1.00 0.00 0.00 179.01 180.45 3ce6 h GLN 476 N 0.78 1.06 -0.59 2.33 4.20 -1.84 0.74 115.11 121.78 3ce6 h GLN 476 Ca 0.20 -0.27 -0.02 0.00 0.06 0.00 0.00 58.65 58.63 3ce6 h GLN 476 Cb 0.02 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.64 3ce6 h GLN 476 CO -0.04 0.96 0.28 0.00 -0.67 0.00 0.00 178.83 179.37 3ce6 h ALA 477 N 1.05 0.76 -0.74 3.87 0.00 -0.60 -0.85 119.26 122.75 3ce6 h ALA 477 Ca 0.20 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3ce6 h ALA 477 Cb 0.39 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 3ce6 h ALA 477 CO 0.01 0.32 0.26 1.49 0.00 0.00 0.00 179.25 181.33 3ce6 h GLU 478 N 0.80 1.13 -0.74 0.00 4.81 -0.83 0.11 114.58 119.87 3ce6 h GLU 478 Ca 0.20 -0.23 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 3ce6 h GLU 478 Cb 0.12 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 3ce6 h GLU 478 CO -0.03 0.95 0.35 -0.92 -0.73 0.00 0.00 179.01 178.63 3ce6 h TYR 479 N 1.09 1.07 0.00 0.92 3.20 -0.38 -1.91 116.97 120.96 3ce6 h TYR 479 Ca 0.24 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 62.06 3ce6 h TYR 479 Cb 0.26 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.20 3ce6 h TYR 479 CO 0.02 0.79 0.00 -0.07 -1.64 0.00 0.00 178.16 177.26 3ce6 h LEU 480 N 1.04 0.00 -1.06 2.82 3.38 -0.80 -3.48 115.31 117.21 3ce6 h LEU 480 Ca 0.25 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.97 3ce6 h LEU 480 Cb 0.12 0.00 0.10 0.00 0.09 0.00 0.00 40.66 40.97 3ce6 h LEU 480 CO -0.03 0.00 -0.45 0.61 0.09 0.00 0.00 178.44 178.65 3ce6 n GLY 481 N 1.16 -0.04 3.42 0.83 0.00 -0.06 -5.05 105.19 105.45 3ce6 n GLY 481 Ca 0.05 -0.07 -0.21 0.00 0.00 0.00 0.00 46.02 45.78 3ce6 n GLY 481 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ce6 s VAL 482 N -3.21 1.53 0.34 1.61 -7.23 -0.68 -5.03 120.40 107.73 3ce6 s VAL 482 Ca 0.31 -2.10 -0.20 0.00 -1.81 0.00 0.00 61.98 58.18 3ce6 s VAL 482 Cb -0.14 -2.48 -0.10 0.00 0.56 0.00 0.00 36.38 34.23 3ce6 s VAL 482 CO 0.48 -0.27 0.86 -0.62 -0.31 0.00 0.00 175.10 175.23 3ce6 s ASP 483 N -3.43 7.00 0.44 4.85 2.15 -1.26 -4.40 116.67 122.02 3ce6 s ASP 483 Ca 0.30 1.57 0.14 0.00 0.43 0.00 0.00 52.55 54.99 3ce6 s ASP 483 Cb 0.05 -2.49 1.05 0.00 -0.30 0.00 0.00 42.92 41.23 3ce6 s ASP 483 CO 0.12 -0.19 1.99 0.58 -0.17 0.00 0.00 175.17 177.50 3ce6 h VAL 484 N 2.22 0.91 -0.09 1.11 2.07 -1.93 -0.20 116.25 120.34 3ce6 h VAL 484 Ca -0.48 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 66.91 3ce6 h VAL 484 Cb 1.18 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 3ce6 h VAL 484 CO 0.64 0.07 0.00 -0.62 0.02 0.00 0.00 177.57 177.68 3ce6 n GLU 485 N -4.47 1.47 -0.09 1.57 -0.58 -1.26 -4.75 120.64 112.53 3ce6 n GLU 485 Ca 0.09 -0.70 0.01 0.00 -0.42 0.00 0.00 57.16 56.14 3ce6 n GLU 485 Cb 0.35 -1.38 -0.00 0.00 -0.57 0.00 0.00 31.44 29.83 3ce6 n GLU 485 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ce6 n GLY 486 N 1.03 -2.19 3.73 0.62 0.00 -0.09 -4.95 105.19 103.33 3ce6 n GLY 486 Ca 0.16 -1.49 -0.33 0.00 0.00 0.00 0.00 46.02 44.37 3ce6 n GLY 486 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ce6 s PRO 487 N -0.85 2.07 -0.00 1.61 0.04 -1.26 -4.55 135.00 132.06 3ce6 s PRO 487 Ca 0.00 1.57 0.17 0.00 0.04 0.00 0.00 61.00 62.78 3ce6 s PRO 487 Cb 0.00 -1.84 -0.19 0.00 0.04 0.00 0.00 34.50 32.51 3ce6 s PRO 487 CO 0.00 -1.85 0.70 0.66 0.04 0.00 0.00 177.00 176.55 3ce6 n TYR 488 N -3.06 0.00 -4.17 0.56 4.01 -1.26 -4.45 117.16 108.79 3ce6 n TYR 488 Ca 0.12 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.69 3ce6 n TYR 488 Cb 0.51 -0.02 -0.12 0.00 -0.31 0.00 0.00 39.34 39.40 3ce6 n TYR 488 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 3ce6 s LYS 489 N -2.64 0.82 0.91 -0.72 -0.14 -1.26 -5.02 119.74 111.69 3ce6 s LYS 489 Ca 0.06 -1.00 -0.11 0.00 -1.36 0.00 0.00 55.97 53.56 3ce6 s LYS 489 Cb 0.13 -0.74 0.14 0.00 -1.68 0.00 0.00 37.83 35.68 3ce6 s LYS 489 CO 0.70 0.15 1.12 -1.25 -0.76 0.00 0.00 175.35 175.31 3ce6 s PRO 490 N -1.99 1.05 0.41 -1.68 0.04 -1.26 -4.92 135.00 126.67 3ce6 s PRO 490 Ca -0.00 1.34 0.11 0.00 0.04 0.00 0.00 61.00 62.48 3ce6 s PRO 490 Cb -0.08 -1.75 0.88 0.00 0.04 0.00 0.00 34.50 33.59 3ce6 s PRO 490 CO 0.02 -2.53 1.96 0.22 0.04 0.00 0.00 177.00 176.70 3ce6 h ASP 491 N -1.79 0.16 -0.16 6.66 3.58 -2.03 -0.83 116.42 122.01 3ce6 h ASP 491 Ca -0.46 -0.03 0.00 0.00 0.42 0.00 0.00 57.03 56.96 3ce6 h ASP 491 Cb 1.27 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 42.28 3ce6 h ASP 491 CO 0.45 0.30 0.00 0.00 -2.88 0.00 0.00 179.24 177.11 3ce6 n HIS 492 N -4.32 0.21 -1.72 0.28 1.44 -1.26 -4.95 115.22 104.90 3ce6 n HIS 492 Ca -0.01 -0.10 -0.43 0.00 -2.01 0.00 0.00 57.72 55.17 3ce6 n HIS 492 Cb 0.24 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.33 3ce6 n HIS 492 CO 0.00 0.00 0.00 0.98 -2.81 0.00 0.00 176.34 174.51 3ce6 n TYR 493 N 0.15 2.61 0.90 -1.40 9.36 -0.32 -4.91 117.16 123.55 3ce6 n TYR 493 Ca 0.15 0.36 0.10 0.00 3.32 0.00 0.00 57.90 61.83 3ce6 n TYR 493 Cb 0.27 -2.53 -0.01 0.00 -0.63 0.00 0.00 39.34 36.44 3ce6 n TYR 493 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 3ce6 n ARG 494 N 1.71 1.32 -0.12 2.98 1.74 -1.26 -5.03 116.66 117.99 3ce6 n ARG 494 Ca 0.08 -0.85 0.00 0.00 -0.77 0.00 0.00 57.85 56.31 3ce6 n ARG 494 Cb 0.35 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.39 3ce6 n ARG 494 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77