#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m12 s THR 2 N 0.00 0.22 -0.30 0.44 2.01 -1.26 -5.12 115.64 111.63 3m12 s THR 2 Ca 0.00 -0.64 -0.18 0.00 0.31 0.00 0.00 61.69 61.17 3m12 s THR 2 Cb 0.00 -0.99 -0.02 0.00 0.01 0.00 0.00 72.50 71.51 3m12 s THR 2 CO 0.00 -0.47 0.54 -2.28 -0.69 0.00 0.00 174.62 171.72 3m12 s HIS 3 N 1.98 3.22 0.45 4.92 5.65 -1.26 -4.45 115.29 125.80 3m12 s HIS 3 Ca 0.05 0.46 -0.03 0.00 0.25 0.00 0.00 55.06 55.79 3m12 s HIS 3 Cb -0.16 -2.85 -0.02 0.00 -1.18 0.00 0.00 32.58 28.36 3m12 s HIS 3 CO -0.20 -0.41 0.72 -0.06 -0.65 0.00 0.00 174.74 174.13 3m12 s PHE 4 N 2.40 3.45 -0.03 3.88 0.08 -0.55 -4.97 117.98 122.24 3m12 s PHE 4 Ca 0.21 0.57 -0.24 0.00 0.12 0.00 0.00 56.93 57.59 3m12 s PHE 4 Cb -0.15 -2.25 -0.21 0.00 -0.57 0.00 0.00 43.02 39.84 3m12 s PHE 4 CO 0.11 -0.26 1.14 -0.44 -0.10 0.00 0.00 175.22 175.68 3m12 h ASP 5 N 0.34 0.18 -3.72 1.36 3.45 -1.23 -2.85 116.42 113.95 3m12 h ASP 5 Ca -0.47 -0.65 -0.33 0.00 0.43 0.00 0.00 57.03 56.01 3m12 h ASP 5 Cb 1.22 -0.05 -0.31 0.00 -0.56 0.00 0.00 39.33 39.64 3m12 h ASP 5 CO 0.61 0.80 -0.75 -0.69 -1.57 0.00 0.00 179.24 177.64 3m12 s VAL 6 N -3.62 0.31 -0.14 -1.35 1.01 -0.88 -1.87 120.40 113.86 3m12 s VAL 6 Ca -0.16 -0.10 -0.03 0.00 0.00 0.00 0.00 61.98 61.70 3m12 s VAL 6 Cb 0.02 -0.31 -0.03 0.00 0.00 0.00 0.00 36.38 36.06 3m12 s VAL 6 CO 0.72 0.12 -0.06 -0.63 0.00 0.00 0.00 175.10 175.26 3m12 s ILE 7 N 0.33 3.72 -0.24 2.22 1.01 -0.39 -1.46 121.20 126.39 3m12 s ILE 7 Ca -0.03 -0.43 -0.06 0.00 0.00 0.00 0.00 60.65 60.13 3m12 s ILE 7 Cb -0.07 -2.61 -0.02 0.00 0.01 0.00 0.00 42.46 39.78 3m12 s ILE 7 CO -0.01 0.51 0.03 -0.69 0.00 0.00 0.00 174.94 174.78 3m12 s VAL 8 N 0.22 3.96 -0.34 2.92 1.01 0.52 -0.64 120.40 128.05 3m12 s VAL 8 Ca -0.04 -0.29 -0.11 0.00 0.00 0.00 0.00 61.98 61.54 3m12 s VAL 8 Cb -0.14 -2.83 -0.00 0.00 0.00 0.00 0.00 36.38 33.40 3m12 s VAL 8 CO 0.03 0.38 0.19 -0.69 0.00 0.00 0.00 175.10 175.01 3m12 s VAL 9 N 1.52 4.81 0.00 2.92 1.01 0.32 -0.87 120.40 130.10 3m12 s VAL 9 Ca 0.06 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.57 3m12 s VAL 9 Cb -0.15 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.72 3m12 s VAL 9 CO 0.01 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.69 3m12 n GLY 10 N 5.03 -0.59 2.86 4.51 0.00 0.42 -0.89 105.19 116.53 3m12 n GLY 10 Ca -0.13 -0.69 -0.39 0.00 0.00 0.00 0.00 46.02 44.81 3m12 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m12 n ALA 11 N 0.32 6.38 -1.87 4.61 0.00 -1.24 -3.81 120.51 124.90 3m12 n ALA 11 Ca 0.00 -4.20 0.00 0.00 0.00 0.00 0.00 53.44 49.24 3m12 n ALA 11 Cb 0.00 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 17.51 3m12 n ALA 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m12 n GLY 12 N -0.47 1.63 0.26 0.00 0.00 -1.26 -4.07 105.19 101.29 3m12 n GLY 12 Ca 0.52 -1.50 -0.09 0.00 0.00 0.00 0.00 46.02 44.96 3m12 n GLY 12 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3m12 h SER 13 N 0.00 -0.72 0.13 1.61 0.02 -1.92 -0.08 113.55 112.59 3m12 h SER 13 Ca 0.00 0.12 -0.20 0.00 -0.84 0.00 0.00 61.79 60.87 3m12 h SER 13 Cb 0.00 0.33 0.01 0.00 0.14 0.00 0.00 62.40 62.88 3m12 h SER 13 CO 0.00 -0.27 -0.93 0.24 -1.14 0.00 0.00 176.83 174.73 3m12 h MET 14 N -0.26 0.27 -0.55 3.45 2.07 -1.90 -3.27 114.93 114.73 3m12 h MET 14 Ca 0.12 -0.46 -0.03 0.00 -2.07 0.00 0.00 59.70 57.26 3m12 h MET 14 Cb 0.44 0.17 -0.02 0.00 -1.87 0.00 0.00 31.60 30.31 3m12 h MET 14 CO -0.33 1.22 0.25 0.78 1.07 0.00 0.00 176.91 179.89 3m12 h GLY 15 N -0.31 0.87 1.45 8.32 0.00 -1.64 -1.39 103.07 110.36 3m12 h GLY 15 Ca -0.18 -0.45 -0.13 0.00 0.00 0.00 0.00 47.33 46.57 3m12 h GLY 15 CO 0.12 0.43 -0.38 1.98 0.00 0.00 0.00 176.54 178.68 3m12 h MET 16 N 0.75 0.61 -0.49 4.80 4.05 -1.15 -0.43 114.93 123.07 3m12 h MET 16 Ca 0.19 -0.30 -0.02 0.00 -0.28 0.00 0.00 59.70 59.29 3m12 h MET 16 Cb 0.15 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.93 3m12 h MET 16 CO -0.02 0.89 0.23 0.00 0.23 0.00 0.00 176.91 178.25 3m12 h ALA 17 N 1.07 0.63 -0.75 0.39 0.00 -1.56 -1.35 119.26 117.69 3m12 h ALA 17 Ca 0.05 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.84 3m12 h ALA 17 Cb 0.89 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 3m12 h ALA 17 CO 0.08 0.19 0.49 0.00 0.00 0.00 0.00 179.25 180.01 3m12 h ALA 18 N 1.07 0.95 -0.48 0.00 0.00 -1.05 -1.93 119.26 117.83 3m12 h ALA 18 Ca 0.17 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.06 3m12 h ALA 18 Cb 0.12 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 3m12 h ALA 18 CO -0.02 0.38 0.26 0.78 0.00 0.00 0.00 179.25 180.65 3m12 h GLY 19 N 1.02 0.67 0.71 0.00 0.00 -0.75 -0.37 103.07 104.37 3m12 h GLY 19 Ca 0.28 -0.18 0.04 0.00 0.00 0.00 0.00 47.33 47.46 3m12 h GLY 19 CO -0.06 0.14 0.07 -1.82 0.00 0.00 0.00 176.54 174.87 3m12 h TYR 20 N 0.51 0.13 -0.58 5.60 5.03 -1.07 -0.30 116.97 126.29 3m12 h TYR 20 Ca 0.20 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.49 3m12 h TYR 20 Cb 0.08 -0.02 -0.03 0.00 1.55 0.00 0.00 36.73 38.32 3m12 h TYR 20 CO -0.09 0.05 0.21 1.96 -1.32 0.00 0.00 178.16 178.96 3m12 h GLN 21 N 0.19 0.89 -0.26 1.82 1.08 -0.90 -1.61 115.11 116.31 3m12 h GLN 21 Ca 0.13 -0.18 -0.04 0.00 -1.45 0.00 0.00 58.65 57.11 3m12 h GLN 21 Cb 0.12 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.40 3m12 h GLN 21 CO -0.15 0.79 -0.00 -0.07 -0.95 0.00 0.00 178.83 178.44 3m12 h LEU 22 N 0.82 0.46 -0.97 1.46 3.38 -0.96 -3.18 115.31 116.31 3m12 h LEU 22 Ca 0.19 -0.31 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 3m12 h LEU 22 Cb 0.25 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 3m12 h LEU 22 CO -0.01 0.66 0.17 0.00 0.09 0.00 0.00 178.44 179.34 3m12 h ALA 23 N 0.81 1.17 0.00 1.53 0.00 -0.88 -2.04 119.26 119.86 3m12 h ALA 23 Ca 0.07 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3m12 h ALA 23 Cb 0.43 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 3m12 h ALA 23 CO 0.01 0.57 -0.01 -0.22 0.00 0.00 0.00 179.25 179.61 3m12 h LYS 24 N 0.88 0.00 -0.42 0.00 3.64 -1.28 -0.93 116.57 118.46 3m12 h LYS 24 Ca 0.20 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 3m12 h LYS 24 Cb 0.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 3m12 h LYS 24 CO -0.01 0.01 0.00 1.04 -2.27 0.00 0.00 179.45 178.22 3m12 n GLN 25 N -4.12 2.17 -1.12 1.90 6.02 -0.83 -4.93 117.38 116.48 3m12 n GLN 25 Ca -0.03 -1.80 -0.04 0.00 -0.01 0.00 0.00 57.00 55.12 3m12 n GLN 25 Cb 0.09 -1.43 -0.02 0.00 1.02 0.00 0.00 30.24 29.90 3m12 n GLN 25 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3m12 n GLY 26 N 1.33 0.68 3.70 1.08 0.00 -0.35 -5.00 105.19 106.63 3m12 n GLY 26 Ca 0.18 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 3m12 n GLY 26 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m12 s VAL 27 N -2.04 4.41 -0.44 1.61 1.01 -0.87 -4.97 120.40 119.12 3m12 s VAL 27 Ca 0.00 1.72 -0.28 0.00 0.00 0.00 0.00 61.98 63.42 3m12 s VAL 27 Cb 0.00 -4.10 0.01 0.00 0.00 0.00 0.00 36.38 32.28 3m12 s VAL 27 CO 0.00 0.06 1.49 -0.75 0.00 0.00 0.00 175.10 175.90 3m12 s LYS 28 N 1.67 3.44 -0.03 2.72 2.20 -1.26 -4.27 119.74 124.21 3m12 s LYS 28 Ca 0.55 0.90 0.07 0.00 -0.36 0.00 0.00 55.97 57.12 3m12 s LYS 28 Cb -0.24 -4.09 -0.01 0.00 -1.51 0.00 0.00 37.83 31.98 3m12 s LYS 28 CO 0.24 -1.74 -0.23 0.99 -0.36 0.00 0.00 175.35 174.25 3m12 s THR 29 N 5.94 1.85 -0.14 3.43 2.01 -1.26 -0.70 115.64 126.77 3m12 s THR 29 Ca 0.62 -0.99 0.00 0.00 0.31 0.00 0.00 61.69 61.64 3m12 s THR 29 Cb -0.14 -1.55 -0.01 0.00 0.01 0.00 0.00 72.50 70.82 3m12 s THR 29 CO 0.31 0.52 -0.15 -0.22 -0.69 0.00 0.00 174.62 174.39 3m12 s LEU 30 N -0.41 2.53 -0.16 4.42 2.96 -0.54 -1.39 118.68 126.09 3m12 s LEU 30 Ca 0.05 -0.43 -0.04 0.00 -0.22 0.00 0.00 54.13 53.49 3m12 s LEU 30 Cb -0.10 -1.57 -0.03 0.00 0.50 0.00 0.00 46.19 44.99 3m12 s LEU 30 CO 0.00 0.12 -0.03 -0.76 -1.32 0.00 0.00 176.35 174.37 3m12 s LEU 31 N 0.61 3.31 -0.12 -0.68 1.02 0.78 -0.36 118.68 123.24 3m12 s LEU 31 Ca -0.09 -0.11 0.03 0.00 0.02 0.00 0.00 54.13 53.98 3m12 s LEU 31 Cb -0.16 -1.80 0.00 0.00 0.02 0.00 0.00 46.19 44.25 3m12 s LEU 31 CO 0.03 0.17 -0.22 -0.69 0.02 0.00 0.00 176.35 175.66 3m12 s VAL 32 N 0.37 2.21 0.01 -1.59 1.01 -0.05 -0.27 120.40 122.09 3m12 s VAL 32 Ca -0.03 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 61.02 3m12 s VAL 32 Cb -0.14 -1.87 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 3m12 s VAL 32 CO 0.03 0.55 -0.07 -0.62 0.00 0.00 0.00 175.10 174.99 3m12 s ASP 33 N 0.53 0.78 0.59 3.32 2.15 -0.58 -0.43 116.67 123.03 3m12 s ASP 33 Ca -0.13 -0.22 0.36 0.00 0.43 0.00 0.00 52.55 52.99 3m12 s ASP 33 Cb -0.17 -0.06 1.84 0.00 -0.30 0.00 0.00 42.92 44.24 3m12 s ASP 33 CO 0.05 0.01 2.18 0.00 -0.17 0.00 0.00 175.17 177.24 3m12 h ALA 34 N 5.63 1.13 -3.00 3.66 0.00 -1.84 0.60 119.26 125.44 3m12 h ALA 34 Ca -0.30 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3m12 h ALA 34 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3m12 h ALA 34 CO 0.48 0.05 0.00 1.19 0.00 0.00 0.00 179.25 180.96 3m12 n PHE 35 N -3.31 0.00 -3.61 0.00 3.72 -1.26 -3.59 117.46 109.40 3m12 n PHE 35 Ca -0.02 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.09 3m12 n PHE 35 Cb 0.18 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.60 3m12 n PHE 35 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3m12 s ASP 36 N 1.00 3.18 0.37 4.37 3.68 -1.26 -1.39 116.67 126.62 3m12 s ASP 36 Ca 0.00 -2.73 -0.27 0.00 2.13 0.00 0.00 52.55 51.67 3m12 s ASP 36 Cb 0.00 -0.83 -0.10 0.00 -1.45 0.00 0.00 42.92 40.54 3m12 s ASP 36 CO 0.00 -0.24 1.32 -2.84 0.13 0.00 0.00 175.17 173.54 3m12 s PRO 37 N 0.28 4.17 0.36 4.34 0.02 -1.26 -4.01 135.00 138.90 3m12 s PRO 37 Ca 0.21 2.22 -0.25 0.00 0.02 0.00 0.00 61.00 63.20 3m12 s PRO 37 Cb -0.17 -2.93 -0.10 0.00 0.02 0.00 0.00 34.50 31.33 3m12 s PRO 37 CO -0.05 -0.34 0.99 -1.25 -0.33 0.00 0.00 177.00 176.02 3m12 s PRO 38 N -2.01 4.38 0.20 5.54 0.04 -1.26 -4.76 135.00 137.13 3m12 s PRO 38 Ca 0.53 1.40 0.04 0.00 0.04 0.00 0.00 61.00 63.00 3m12 s PRO 38 Cb -0.39 -2.64 -0.02 0.00 0.04 0.00 0.00 34.50 31.49 3m12 s PRO 38 CO 0.52 0.08 0.15 -2.39 0.04 0.00 0.00 177.00 175.40 3m12 n HIS 39 N 0.20 -0.40 -0.98 0.56 1.44 -1.26 -5.07 115.22 109.72 3m12 n HIS 39 Ca 0.04 -1.60 0.09 0.00 -2.01 0.00 0.00 57.72 54.23 3m12 n HIS 39 Cb 0.50 0.15 0.24 0.00 0.12 0.00 0.00 29.99 31.00 3m12 n HIS 39 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 3m12 n THR 40 N -0.38 2.20 0.75 0.61 -2.24 -1.26 -4.34 114.28 109.62 3m12 n THR 40 Ca 0.04 -1.91 0.08 0.00 -2.27 0.00 0.00 64.05 59.99 3m12 n THR 40 Cb 0.35 -0.23 -0.10 0.00 -2.10 0.00 0.00 70.33 68.25 3m12 n THR 40 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3m12 n ASN 41 N -0.60 0.82 0.00 3.42 5.03 -1.26 -4.96 115.26 117.71 3m12 n ASN 41 Ca 0.20 -0.84 0.00 0.00 0.87 0.00 0.00 54.58 54.82 3m12 n ASN 41 Cb 0.85 1.06 0.00 0.00 -1.02 0.00 0.00 39.78 40.67 3m12 n ASN 41 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3m12 n GLY 42 N 1.41 2.48 0.31 7.41 0.00 -1.26 -4.95 105.19 110.59 3m12 n GLY 42 Ca 0.03 -0.77 0.03 0.00 0.00 0.00 0.00 46.02 45.31 3m12 n GLY 42 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3m12 n SER 43 N 0.00 2.49 -0.13 1.61 7.64 -1.26 -3.30 113.62 120.67 3m12 n SER 43 Ca 0.00 -2.10 0.02 0.00 1.01 0.00 0.00 58.87 57.80 3m12 n SER 43 Cb 0.00 -0.14 0.01 0.00 -1.01 0.00 0.00 64.21 63.07 3m12 n SER 43 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3m12 n HIS 44 N -0.12 0.00 -2.60 1.43 1.44 -1.26 -4.81 115.22 109.30 3m12 n HIS 44 Ca 0.07 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.68 3m12 n HIS 44 Cb 0.37 0.00 0.04 0.00 0.12 0.00 0.00 29.99 30.53 3m12 n HIS 44 CO 0.00 0.00 0.00 -2.39 -2.81 0.00 0.00 176.34 171.14 3m12 n HIS 45 N 0.18 -3.03 -0.51 -1.40 -0.00 -1.26 -4.01 115.22 105.19 3m12 n HIS 45 Ca 0.02 -0.80 0.00 0.00 -0.00 0.00 0.00 57.72 56.94 3m12 n HIS 45 Cb 0.08 -0.29 0.00 0.00 -0.00 0.00 0.00 29.99 29.78 3m12 n HIS 45 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3m12 n GLY 46 N 1.80 0.74 4.68 -1.39 0.00 -1.26 -4.71 105.19 105.05 3m12 n GLY 46 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3m12 n GLY 46 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3m12 n ASP 47 N 0.03 0.00 -4.22 1.61 8.00 -1.26 -4.88 116.55 115.82 3m12 n ASP 47 Ca 0.00 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.28 3m12 n ASP 47 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 40.97 3m12 n ASP 47 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3m12 s THR 48 N 0.00 1.42 0.00 -3.53 -4.23 -1.26 -1.48 115.64 106.56 3m12 s THR 48 Ca 0.00 -1.34 0.01 0.00 -1.18 0.00 0.00 61.69 59.18 3m12 s THR 48 Cb 0.00 -1.30 -0.00 0.00 1.34 0.00 0.00 72.50 72.53 3m12 s THR 48 CO 0.00 -0.07 -0.02 -0.13 -0.54 0.00 0.00 174.62 173.86 3m12 s ARG 49 N -1.65 0.17 0.13 3.99 1.81 -0.10 -4.86 118.95 118.44 3m12 s ARG 49 Ca 0.03 -0.14 -0.30 0.00 -1.72 0.00 0.00 55.73 53.60 3m12 s ARG 49 Cb -0.10 -0.12 -0.07 0.00 -0.45 0.00 0.00 34.95 34.22 3m12 s ARG 49 CO 0.03 0.03 1.08 0.42 -0.68 0.00 0.00 175.30 176.17 3m12 s ILE 50 N -0.22 4.11 -0.13 1.52 -1.09 -1.26 -0.24 121.20 123.88 3m12 s ILE 50 Ca -0.01 1.72 0.01 0.00 -2.23 0.00 0.00 60.65 60.14 3m12 s ILE 50 Cb -0.02 -4.10 -0.01 0.00 -1.58 0.00 0.00 42.46 36.75 3m12 s ILE 50 CO -0.00 0.25 -0.16 -0.51 -1.23 0.00 0.00 174.94 173.29 3m12 s ILE 51 N 0.12 2.72 0.13 2.92 2.07 -0.24 -4.40 121.20 124.52 3m12 s ILE 51 Ca 0.51 -0.77 0.01 0.00 -1.41 0.00 0.00 60.65 58.99 3m12 s ILE 51 Cb -0.27 -2.13 -0.04 0.00 0.13 0.00 0.00 42.46 40.15 3m12 s ILE 51 CO 0.32 0.53 -0.02 0.00 -1.91 0.00 0.00 174.94 173.86 3m12 s ARG 52 N 0.48 0.97 -0.07 3.50 1.70 -1.26 -1.79 118.95 122.47 3m12 s ARG 52 Ca -0.11 -1.43 0.07 0.00 -0.47 0.00 0.00 55.73 53.78 3m12 s ARG 52 Cb -0.16 -0.18 -0.10 0.00 -0.57 0.00 0.00 34.95 33.93 3m12 s ARG 52 CO 0.05 -0.09 0.04 0.72 -1.08 0.00 0.00 175.30 174.93 3m12 n HIS 53 N -0.14 0.00 -1.92 5.89 8.25 -1.26 -4.81 115.22 121.24 3m12 n HIS 53 Ca -0.09 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.95 3m12 n HIS 53 Cb 0.62 -0.37 -0.01 0.00 1.12 0.00 0.00 29.99 31.36 3m12 n HIS 53 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3m12 n ALA 54 N -2.25 4.63 -3.04 -1.41 0.00 -1.26 -4.69 120.51 112.49 3m12 n ALA 54 Ca -0.12 -3.78 -0.44 0.00 0.00 0.00 0.00 53.44 49.10 3m12 n ALA 54 Cb 0.71 -3.57 -0.04 0.00 0.00 0.00 0.00 19.45 16.55 3m12 n ALA 54 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3m12 s TYR 55 N 3.98 3.01 -1.63 0.00 6.14 -1.26 -4.52 117.35 123.07 3m12 s TYR 55 Ca 0.51 -1.04 0.25 0.00 0.64 0.00 0.00 57.07 57.42 3m12 s TYR 55 Cb 0.11 -4.11 1.32 0.00 0.42 0.00 0.00 41.96 39.70 3m12 s TYR 55 CO -0.01 -1.39 1.82 0.41 0.64 0.00 0.00 175.55 177.02 3m12 n GLY 56 N 5.22 -0.98 0.26 8.97 0.00 -1.26 -3.42 105.19 113.98 3m12 n GLY 56 Ca -0.00 -0.13 0.17 0.00 0.00 0.00 0.00 46.02 46.06 3m12 n GLY 56 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3m12 h GLU 57 N 0.00 0.00 0.00 1.61 3.07 -1.90 -3.47 114.58 113.90 3m12 h GLU 57 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3m12 h GLU 57 Cb 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 3m12 h GLU 57 CO 0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 3m12 n GLY 58 N 0.05 3.26 0.29 -3.84 0.00 -1.22 -5.02 105.19 98.71 3m12 n GLY 58 Ca 0.01 -0.30 0.08 0.00 0.00 0.00 0.00 46.02 45.81 3m12 n GLY 58 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3m12 h ARG 59 N 0.00 0.19 0.00 1.61 -0.00 -1.90 -1.98 114.38 112.30 3m12 h ARG 59 Ca 0.00 -0.01 -0.02 0.00 -0.00 0.00 0.00 59.98 59.94 3m12 h ARG 59 Cb 0.00 -0.04 -0.00 0.00 -0.00 0.00 0.00 29.97 29.92 3m12 h ARG 59 CO 0.00 0.13 -0.11 0.93 -0.00 0.00 0.00 179.97 180.91 3m12 h GLU 60 N 0.20 0.00 -0.00 0.08 3.07 -1.93 -2.50 114.58 113.50 3m12 h GLU 60 Ca 0.09 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 58.84 3m12 h GLU 60 Cb 0.12 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.01 3m12 h GLU 60 CO -0.02 0.11 -0.55 1.88 -1.40 0.00 0.00 179.01 179.04 3m12 h TYR 61 N 0.00 0.00 0.40 4.33 0.05 -1.69 -3.28 116.97 116.79 3m12 h TYR 61 Ca -0.00 -0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.76 3m12 h TYR 61 Cb 0.32 -0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.06 3m12 h TYR 61 CO 0.00 0.55 -0.19 0.28 -1.05 0.00 0.00 178.16 177.75 3m12 h VAL 62 N 0.00 0.59 -0.09 -2.88 2.07 -1.57 0.13 116.25 114.50 3m12 h VAL 62 Ca -0.01 -0.33 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 3m12 h VAL 62 Cb 0.98 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 3m12 h VAL 62 CO 0.07 0.06 -0.16 1.55 0.02 0.00 0.00 177.57 179.11 3m12 h PRO 63 N -0.74 0.15 -0.69 1.57 0.13 -1.72 -0.36 132.00 130.34 3m12 h PRO 63 Ca -0.06 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 64.98 3m12 h PRO 63 Cb 0.51 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 31.59 3m12 h PRO 63 CO 0.09 0.31 0.19 1.25 -0.23 0.00 0.00 178.00 179.61 3m12 h LEU 64 N 0.14 1.03 -0.47 1.56 5.85 -1.58 0.15 115.31 121.99 3m12 h LEU 64 Ca 0.03 -0.22 -0.05 0.00 0.84 0.00 0.00 57.88 58.48 3m12 h LEU 64 Cb 0.38 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 3m12 h LEU 64 CO 0.02 0.98 0.11 0.00 -0.34 0.00 0.00 178.44 179.21 3m12 h ALA 65 N 1.09 0.63 -0.41 1.25 0.00 0.00 -0.30 119.26 121.51 3m12 h ALA 65 Ca 0.22 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 3m12 h ALA 65 Cb 0.34 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3m12 h ALA 65 CO -0.00 0.32 -0.30 -0.07 0.00 0.00 0.00 179.25 179.19 3m12 h LEU 66 N 0.64 0.96 -0.53 0.00 3.38 -0.89 0.32 115.31 119.19 3m12 h LEU 66 Ca 0.15 -0.40 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 3m12 h LEU 66 Cb 0.33 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3m12 h LEU 66 CO 0.00 1.18 0.14 -0.09 0.09 0.00 0.00 178.44 179.77 3m12 h ARG 67 N 0.77 0.83 -0.68 1.13 9.65 -0.67 -2.33 114.38 123.09 3m12 h ARG 67 Ca 0.08 -0.19 0.01 0.00 -1.10 0.00 0.00 59.98 58.78 3m12 h ARG 67 Cb 0.88 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 29.31 3m12 h ARG 67 CO 0.08 0.78 0.45 0.77 2.80 0.00 0.00 179.97 184.85 3m12 h SER 68 N 0.73 0.77 -0.45 -3.80 0.02 -0.77 -0.96 113.55 109.09 3m12 h SER 68 Ca 0.17 -0.02 0.06 0.00 -0.84 0.00 0.00 61.79 61.16 3m12 h SER 68 Cb 0.31 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 62.61 3m12 h SER 68 CO -0.00 0.56 0.16 -0.61 -1.14 0.00 0.00 176.83 175.80 3m12 h GLN 69 N 0.91 0.33 -0.73 3.45 5.75 -0.76 0.11 115.11 124.16 3m12 h GLN 69 Ca 0.25 -0.02 -0.06 0.00 -0.15 0.00 0.00 58.65 58.67 3m12 h GLN 69 Cb -0.09 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.35 3m12 h GLN 69 CO -0.06 0.22 0.21 1.49 -2.65 0.00 0.00 178.83 178.04 3m12 h GLU 70 N 0.34 1.14 -0.39 1.69 4.57 -0.94 -1.76 114.58 119.22 3m12 h GLU 70 Ca 0.21 -0.25 -0.05 0.00 -1.18 0.00 0.00 59.36 58.09 3m12 h GLU 70 Cb 0.20 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.61 3m12 h GLU 70 CO -0.21 0.98 0.03 -0.07 -1.18 0.00 0.00 179.01 178.55 3m12 h LEU 71 N 1.09 0.56 -0.62 1.64 3.38 -0.50 -0.79 115.31 120.07 3m12 h LEU 71 Ca 0.23 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 3m12 h LEU 71 Cb 0.33 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 3m12 h LEU 71 CO -0.00 0.62 -0.04 -0.50 0.09 0.00 0.00 178.44 178.60 3m12 h TRP 72 N 0.58 1.15 -0.62 1.13 -0.00 -0.38 0.01 115.95 117.83 3m12 h TRP 72 Ca 0.12 -0.21 -0.04 0.00 -0.00 0.00 0.00 58.89 58.76 3m12 h TRP 72 Cb 0.33 -0.30 -0.03 0.00 -0.00 0.00 0.00 29.16 29.16 3m12 h TRP 72 CO 0.01 1.03 0.22 1.88 -0.00 0.00 0.00 178.44 181.59 3m12 h TYR 73 N 0.95 0.93 -0.25 0.49 0.05 -0.93 -0.14 116.97 118.08 3m12 h TYR 73 Ca 0.16 -0.06 -0.02 0.00 0.05 0.00 0.00 58.73 58.86 3m12 h TYR 73 Cb 0.60 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 38.05 3m12 h TYR 73 CO 0.04 0.73 0.09 0.93 -1.05 0.00 0.00 178.16 178.90 3m12 h GLU 74 N 0.90 0.38 -0.78 4.88 5.08 -0.81 -2.75 114.58 121.48 3m12 h GLU 74 Ca 0.21 -0.08 0.03 0.00 -1.00 0.00 0.00 59.36 58.52 3m12 h GLU 74 Cb 0.21 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.36 3m12 h GLU 74 CO -0.01 0.45 0.50 1.25 -1.00 0.00 0.00 179.01 180.19 3m12 h LEU 75 N 0.24 0.82 -0.88 1.33 5.85 -0.66 -1.65 115.31 120.37 3m12 h LEU 75 Ca 0.08 -0.00 0.14 0.00 0.84 0.00 0.00 57.88 58.94 3m12 h LEU 75 Cb 0.22 -0.18 -0.09 0.00 0.37 0.00 0.00 40.66 40.98 3m12 h LEU 75 CO -0.00 0.56 0.48 -0.08 -0.34 0.00 0.00 178.44 179.05 3m12 h GLU 76 N 0.97 0.67 0.00 1.25 4.57 -0.87 -0.49 114.58 120.67 3m12 h GLU 76 Ca 0.32 -0.04 -0.04 0.00 -1.18 0.00 0.00 59.36 58.41 3m12 h GLU 76 Cb 0.02 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 3m12 h GLU 76 CO -0.12 0.44 -0.21 0.87 -1.18 0.00 0.00 179.01 178.81 3m12 h LYS 77 N 0.69 0.00 0.00 1.92 1.57 -1.03 -3.28 116.57 116.44 3m12 h LYS 77 Ca 0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.25 3m12 h LYS 77 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 3m12 h LYS 77 CO -0.35 0.21 -0.84 0.39 -0.57 0.00 0.00 179.45 178.30 3m12 n GLU 78 N -3.29 0.25 -4.31 3.15 1.02 -0.23 -4.97 120.64 112.25 3m12 n GLU 78 Ca 0.01 0.02 -0.17 0.00 -0.02 0.00 0.00 57.16 57.01 3m12 n GLU 78 Cb 0.47 -1.61 -0.10 0.00 -0.02 0.00 0.00 31.44 30.18 3m12 n GLU 78 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 3m12 s THR 79 N -3.16 1.24 -0.72 2.62 -1.32 -0.97 -5.04 115.64 108.29 3m12 s THR 79 Ca 0.05 -2.08 0.25 0.00 -1.21 0.00 0.00 61.69 58.70 3m12 s THR 79 Cb 0.14 -2.12 0.06 0.00 -1.51 0.00 0.00 72.50 69.07 3m12 s THR 79 CO 0.77 -0.52 1.38 0.00 -2.21 0.00 0.00 174.62 174.03 3m12 n HIS 80 N -0.34 0.46 -2.38 9.09 1.44 -1.26 -4.89 115.22 117.33 3m12 n HIS 80 Ca -0.07 0.13 -0.39 0.00 -2.01 0.00 0.00 57.72 55.38 3m12 n HIS 80 Cb 0.62 -0.60 -0.03 0.00 0.12 0.00 0.00 29.99 30.10 3m12 n HIS 80 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 3m12 s HIS 81 N -3.13 3.30 0.08 -1.40 3.76 -1.26 -5.01 115.29 111.63 3m12 s HIS 81 Ca 0.07 1.61 -0.31 0.00 -0.15 0.00 0.00 55.06 56.29 3m12 s HIS 81 Cb 0.14 -3.34 -0.07 0.00 1.11 0.00 0.00 32.58 30.42 3m12 s HIS 81 CO 0.70 -0.97 1.32 0.21 -0.85 0.00 0.00 174.74 175.16 3m12 s LYS 82 N -1.92 4.35 -0.16 1.40 2.47 -1.26 -4.90 119.74 119.72 3m12 s LYS 82 Ca 0.51 1.95 -0.07 0.00 -1.56 0.00 0.00 55.97 56.80 3m12 s LYS 82 Cb -0.31 -3.33 -0.08 0.00 -1.46 0.00 0.00 37.83 32.66 3m12 s LYS 82 CO 0.40 -0.39 -0.20 -0.89 0.16 0.00 0.00 175.35 174.42 3m12 n ILE 83 N 4.05 0.90 -3.78 5.43 2.08 -1.26 -4.60 119.36 122.17 3m12 n ILE 83 Ca 0.11 -0.25 -0.13 0.00 0.56 0.00 0.00 62.75 63.04 3m12 n ILE 83 Cb 0.44 -1.62 -0.13 0.00 -0.75 0.00 0.00 39.64 37.58 3m12 n ILE 83 CO 0.00 0.00 0.00 0.12 0.56 0.00 0.00 176.55 177.23 3m12 s PHE 84 N -2.30 -0.22 -0.09 1.39 2.19 -1.26 -0.91 117.98 116.78 3m12 s PHE 84 Ca -0.23 0.55 0.03 0.00 0.33 0.00 0.00 56.93 57.61 3m12 s PHE 84 Cb 0.08 0.03 0.01 0.00 -1.31 0.00 0.00 43.02 41.83 3m12 s PHE 84 CO 0.30 -0.14 -0.20 0.99 1.83 0.00 0.00 175.22 178.01 3m12 s THR 85 N 0.56 1.73 -1.34 0.12 2.01 -0.26 -5.01 115.64 113.44 3m12 s THR 85 Ca -0.04 -0.82 -0.13 0.00 0.31 0.00 0.00 61.69 61.02 3m12 s THR 85 Cb -0.05 -1.52 0.11 0.00 0.01 0.00 0.00 72.50 71.05 3m12 s THR 85 CO -0.03 0.49 1.92 1.17 -0.69 0.00 0.00 174.62 177.48 3m12 n LYS 86 N 3.68 3.27 0.21 4.92 4.81 -1.26 -1.14 118.16 132.64 3m12 n LYS 86 Ca -0.20 -3.22 0.14 0.00 -0.87 0.00 0.00 58.31 54.16 3m12 n LYS 86 Cb 0.52 -3.14 0.45 0.00 0.02 0.00 0.00 35.03 32.88 3m12 n LYS 86 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 3m12 h THR 87 N 4.19 0.00 -0.60 3.15 1.35 -1.86 -3.48 112.91 115.66 3m12 h THR 87 Ca 0.45 -0.62 0.05 0.00 -0.55 0.00 0.00 66.41 65.75 3m12 h THR 87 Cb 0.70 1.57 -0.03 0.00 -1.73 0.00 0.00 68.15 68.66 3m12 h THR 87 CO 1.64 0.00 -0.21 0.61 -0.25 0.00 0.00 175.52 177.31 3m12 n GLY 88 N 0.55 -2.79 2.98 5.82 0.00 -0.42 -4.31 105.19 107.03 3m12 n GLY 88 Ca 0.03 -1.36 -0.27 0.00 0.00 0.00 0.00 46.02 44.42 3m12 n GLY 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m12 s VAL 89 N -3.35 1.19 -0.19 1.61 1.01 -0.44 -1.81 120.40 118.42 3m12 s VAL 89 Ca 0.00 -0.44 -0.09 0.00 0.00 0.00 0.00 61.98 61.44 3m12 s VAL 89 Cb 0.00 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 35.19 3m12 s VAL 89 CO 0.00 0.39 0.12 -0.22 0.00 0.00 0.00 175.10 175.38 3m12 s LEU 90 N 1.23 4.15 -0.14 3.92 2.96 0.33 -0.92 118.68 130.20 3m12 s LEU 90 Ca -0.03 0.21 0.02 0.00 -0.22 0.00 0.00 54.13 54.11 3m12 s LEU 90 Cb -0.14 -2.07 0.01 0.00 0.50 0.00 0.00 46.19 44.49 3m12 s LEU 90 CO -0.04 0.19 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.28 3m12 s VAL 91 N 0.30 2.16 0.11 1.68 1.01 -0.14 -1.55 120.40 123.97 3m12 s VAL 91 Ca 0.07 -0.95 -0.00 0.00 0.00 0.00 0.00 61.98 61.10 3m12 s VAL 91 Cb -0.11 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 3m12 s VAL 91 CO -0.01 0.54 0.00 0.72 0.00 0.00 0.00 175.10 176.35 3m12 s PHE 92 N 0.78 0.82 -0.07 5.22 -0.12 -1.25 -0.66 117.98 122.70 3m12 s PHE 92 Ca -0.07 -1.11 -0.32 0.00 -0.05 0.00 0.00 56.93 55.38 3m12 s PHE 92 Cb -0.16 -0.49 0.13 0.00 -0.63 0.00 0.00 43.02 41.87 3m12 s PHE 92 CO -0.01 -0.38 1.38 0.20 -0.05 0.00 0.00 175.22 176.37 3m12 s GLY 93 N -3.03 -0.41 0.17 1.99 0.00 -0.82 -1.43 107.32 103.80 3m12 s GLY 93 Ca 0.17 0.71 -0.31 0.00 0.00 0.00 0.00 44.72 45.29 3m12 s GLY 93 CO -0.02 1.52 1.49 2.56 0.00 0.00 0.00 173.10 178.65 3m12 s PRO 94 N -2.12 4.26 -0.14 2.90 0.04 -1.26 -1.10 135.00 137.57 3m12 s PRO 94 Ca 0.18 2.27 -0.39 0.00 0.04 0.00 0.00 61.00 63.11 3m12 s PRO 94 Cb 0.05 -3.17 -0.16 0.00 0.04 0.00 0.00 34.50 31.27 3m12 s PRO 94 CO -0.05 -0.51 1.61 1.63 0.04 0.00 0.00 177.00 179.72 3m12 n LYS 95 N 3.53 1.21 -0.96 4.56 5.02 0.39 -1.67 118.16 130.23 3m12 n LYS 95 Ca 0.11 0.44 0.00 0.00 -2.02 0.00 0.00 58.31 56.84 3m12 n LYS 95 Cb 0.40 -2.12 0.00 0.00 -0.02 0.00 0.00 35.03 33.29 3m12 n LYS 95 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3m12 n GLY 96 N 3.63 0.29 0.06 0.72 0.00 -1.26 -4.80 105.19 103.82 3m12 n GLY 96 Ca 0.23 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.27 3m12 n GLY 96 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3m12 n GLU 97 N -1.15 3.41 -4.09 1.61 1.02 -0.67 -4.98 120.64 115.80 3m12 n GLU 97 Ca 0.00 -0.28 -0.32 0.00 -0.02 0.00 0.00 57.16 56.53 3m12 n GLU 97 Cb 0.21 -0.82 -0.15 0.00 -0.02 0.00 0.00 31.44 30.66 3m12 n GLU 97 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3m12 s SER 98 N -0.92 3.84 0.23 1.62 0.15 -1.21 -4.94 113.70 112.47 3m12 s SER 98 Ca 0.02 -1.06 -0.03 0.00 0.70 0.00 0.00 55.95 55.58 3m12 s SER 98 Cb 0.03 -1.50 0.24 0.00 -1.71 0.00 0.00 66.02 63.08 3m12 s SER 98 CO 0.10 -0.11 1.68 0.00 1.20 0.00 0.00 173.24 176.11 3m12 h ALA 99 N 7.85 0.96 -0.30 5.45 0.00 -1.95 -1.83 119.26 129.44 3m12 h ALA 99 Ca -0.31 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.28 3m12 h ALA 99 Cb 1.08 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 3m12 h ALA 99 CO 0.53 0.61 0.19 0.35 0.00 0.00 0.00 179.25 180.94 3m12 h PHE 100 N 0.70 0.37 -0.28 0.00 3.57 -1.99 0.13 116.94 119.44 3m12 h PHE 100 Ca 0.11 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.58 3m12 h PHE 100 Cb 0.63 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 3m12 h PHE 100 CO 0.03 0.23 0.03 0.28 -2.23 0.00 0.00 178.31 176.65 3m12 h VAL 101 N 0.40 1.24 -0.58 1.41 2.07 -1.90 -1.90 116.25 117.00 3m12 h VAL 101 Ca 0.11 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 3m12 h VAL 101 Cb -0.03 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 3m12 h VAL 101 CO -0.03 0.27 0.34 0.00 0.02 0.00 0.00 177.57 178.17 3m12 h ALA 102 N 0.85 0.74 -0.41 1.67 0.00 -1.11 -1.17 119.26 119.83 3m12 h ALA 102 Ca 0.08 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3m12 h ALA 102 Cb 0.37 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3m12 h ALA 102 CO 0.01 0.22 -0.05 0.93 0.00 0.00 0.00 179.25 180.36 3m12 h GLU 103 N 0.78 0.69 -0.23 0.00 5.08 -0.72 -0.97 114.58 119.21 3m12 h GLU 103 Ca 0.21 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 3m12 h GLU 103 Cb -0.01 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 3m12 h GLU 103 CO -0.04 0.74 0.05 1.15 -1.00 0.00 0.00 179.01 179.92 3m12 h THR 104 N 0.64 1.21 -0.49 1.13 2.02 -0.91 -0.23 112.91 116.29 3m12 h THR 104 Ca 0.12 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.59 3m12 h THR 104 Cb 0.48 1.24 -0.02 0.00 -1.74 0.00 0.00 68.15 68.11 3m12 h THR 104 CO 0.02 0.22 0.28 0.24 0.37 0.00 0.00 175.52 176.66 3m12 h MET 105 N 0.19 0.67 -0.63 6.66 2.86 -1.05 -1.62 114.93 122.01 3m12 h MET 105 Ca 0.07 -0.07 0.02 0.00 -2.06 0.00 0.00 59.70 57.66 3m12 h MET 105 Cb 0.29 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.78 3m12 h MET 105 CO 0.00 0.50 0.40 0.93 1.06 0.00 0.00 176.91 179.81 3m12 h GLU 106 N 0.65 0.79 -0.70 1.72 4.39 -1.10 -2.41 114.58 117.92 3m12 h GLU 106 Ca 0.17 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.80 3m12 h GLU 106 Cb 0.01 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.45 3m12 h GLU 106 CO -0.03 0.52 0.35 0.00 -1.16 0.00 0.00 179.01 178.69 3m12 h ALA 107 N 1.25 0.90 -0.70 3.43 0.00 -0.74 -0.29 119.26 123.11 3m12 h ALA 107 Ca 0.24 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3m12 h ALA 107 Cb -0.05 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 3m12 h ALA 107 CO -0.07 0.45 0.29 0.00 0.00 0.00 0.00 179.25 179.92 3m12 h ALA 108 N 1.17 0.90 -0.21 0.00 0.00 -1.14 -1.91 119.26 118.07 3m12 h ALA 108 Ca 0.24 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3m12 h ALA 108 Cb 0.09 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3m12 h ALA 108 CO -0.03 0.51 0.08 0.87 0.00 0.00 0.00 179.25 180.67 3m12 h LYS 109 N 0.99 0.32 -0.06 0.00 1.57 -1.17 -0.44 116.57 117.77 3m12 h LYS 109 Ca 0.23 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.90 3m12 h LYS 109 Cb 0.19 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 3m12 h LYS 109 CO -0.02 0.40 -0.18 1.49 -0.57 0.00 0.00 179.45 180.57 3m12 h GLU 110 N 0.18 0.10 -0.20 3.15 4.81 -0.80 -3.04 114.58 118.77 3m12 h GLU 110 Ca 0.07 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 3m12 h GLU 110 Cb 0.20 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.57 3m12 h GLU 110 CO -0.00 0.28 0.00 0.72 -0.73 0.00 0.00 179.01 179.28 3m12 n HIS 111 N -4.28 0.43 -3.94 0.92 8.25 -0.74 -4.99 115.22 110.87 3m12 n HIS 111 Ca -0.02 -0.67 -0.26 0.00 -0.26 0.00 0.00 57.72 56.51 3m12 n HIS 111 Cb 0.27 -0.13 -0.01 0.00 1.12 0.00 0.00 29.99 31.24 3m12 n HIS 111 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3m12 n SER 112 N -0.24 -1.15 -4.83 0.41 7.64 -0.67 -4.96 113.62 109.83 3m12 n SER 112 Ca 0.12 -0.96 -0.34 0.00 1.01 0.00 0.00 58.87 58.70 3m12 n SER 112 Cb 0.54 -3.27 -0.06 0.00 -1.01 0.00 0.00 64.21 60.41 3m12 n SER 112 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3m12 s LEU 113 N -6.97 4.20 -0.32 -3.43 1.43 -0.26 -5.02 118.68 108.30 3m12 s LEU 113 Ca 0.14 1.41 -0.29 0.00 -1.03 0.00 0.00 54.13 54.36 3m12 s LEU 113 Cb -0.07 -3.89 0.02 0.00 0.03 0.00 0.00 46.19 42.28 3m12 s LEU 113 CO 0.87 -0.10 1.05 -0.89 0.23 0.00 0.00 176.35 177.52 3m12 s THR 114 N -1.77 4.53 0.04 5.49 2.01 -1.26 -4.81 115.64 119.87 3m12 s THR 114 Ca 0.49 1.69 -0.05 0.00 0.31 0.00 0.00 61.69 64.14 3m12 s THR 114 Cb -0.14 -4.40 -0.01 0.00 0.01 0.00 0.00 72.50 67.96 3m12 s THR 114 CO 0.19 -0.47 0.08 0.68 -0.69 0.00 0.00 174.62 174.42 3m12 s VAL 115 N 3.60 0.13 -0.13 3.82 -7.23 -1.26 -4.23 120.40 115.12 3m12 s VAL 115 Ca 0.44 -1.11 -0.04 0.00 -1.81 0.00 0.00 61.98 59.46 3m12 s VAL 115 Cb -0.12 -0.88 -0.04 0.00 0.56 0.00 0.00 36.38 35.91 3m12 s VAL 115 CO 0.15 -0.61 0.03 -1.81 -0.31 0.00 0.00 175.10 172.55 3m12 s ASP 116 N -2.11 5.43 -0.15 4.85 -0.00 0.13 -4.94 116.67 119.88 3m12 s ASP 116 Ca -0.05 0.13 -0.03 0.00 -0.00 0.00 0.00 52.55 52.60 3m12 s ASP 116 Cb -0.01 -1.72 -0.03 0.00 -0.00 0.00 0.00 42.92 41.16 3m12 s ASP 116 CO -0.04 0.30 -0.05 -0.76 -0.00 0.00 0.00 175.17 174.62 3m12 s LEU 117 N -0.40 3.20 0.14 1.23 1.43 -1.26 -0.47 118.68 122.54 3m12 s LEU 117 Ca 0.08 -0.14 -0.07 0.00 -1.03 0.00 0.00 54.13 52.97 3m12 s LEU 117 Cb -0.12 -1.76 -0.01 0.00 0.03 0.00 0.00 46.19 44.32 3m12 s LEU 117 CO 0.02 0.18 0.21 -1.48 0.23 0.00 0.00 176.35 175.51 3m12 s LEU 118 N 0.28 1.26 -0.00 1.79 2.34 -0.95 -5.02 118.68 118.37 3m12 s LEU 118 Ca -0.04 -0.89 -0.13 0.00 0.06 0.00 0.00 54.13 53.13 3m12 s LEU 118 Cb -0.14 0.96 0.02 0.00 -0.56 0.00 0.00 46.19 46.47 3m12 s LEU 118 CO 0.03 -0.82 0.27 -1.83 -1.06 0.00 0.00 176.35 172.94 3m12 s GLU 119 N -3.96 0.64 5.42 1.48 -1.05 -1.26 -0.22 118.70 119.75 3m12 s GLU 119 Ca 0.15 -0.27 0.00 0.00 -0.15 0.00 0.00 54.97 54.70 3m12 s GLU 119 Cb 0.05 0.28 0.00 0.00 -0.44 0.00 0.00 34.13 34.02 3m12 s GLU 119 CO -0.02 -0.17 0.00 0.41 0.95 0.00 0.00 175.26 176.42 3m12 n GLY 120 N 1.24 3.59 0.30 -3.83 0.00 0.83 -2.03 105.19 105.28 3m12 n GLY 120 Ca -0.22 0.16 0.16 0.00 0.00 0.00 0.00 46.02 46.13 3m12 n GLY 120 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3m12 h ASP 121 N 0.00 0.00 -0.80 1.61 -0.00 -1.86 -1.97 116.42 113.40 3m12 h ASP 121 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 3m12 h ASP 121 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 39.33 39.29 3m12 h ASP 121 CO 0.00 0.04 0.51 -0.33 -0.00 0.00 0.00 179.24 179.45 3m12 h GLU 122 N 0.00 1.07 0.02 0.28 5.08 -1.82 0.42 114.58 119.63 3m12 h GLU 122 Ca -0.00 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3m12 h GLU 122 Cb 0.13 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.15 3m12 h GLU 122 CO 0.00 0.73 -0.01 0.82 -1.00 0.00 0.00 179.01 179.55 3m12 h ILE 123 N 1.09 1.12 -0.39 3.13 2.04 -1.52 -1.29 117.51 121.69 3m12 h ILE 123 Ca 0.29 -0.43 -0.05 0.00 1.00 0.00 0.00 64.86 65.67 3m12 h ILE 123 Cb -0.09 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 3m12 h ILE 123 CO -0.06 0.11 0.03 0.78 0.00 0.00 0.00 178.15 179.01 3m12 h ASN 124 N -0.22 0.57 -0.15 1.72 -0.26 -1.53 -1.68 115.58 114.04 3m12 h ASN 124 Ca -0.00 -0.11 -0.08 0.00 -0.56 0.00 0.00 56.30 55.55 3m12 h ASN 124 Cb 0.20 -0.15 -0.00 0.00 -1.06 0.00 0.00 38.32 37.32 3m12 h ASN 124 CO 0.00 0.62 -0.22 0.50 -1.06 0.00 0.00 177.43 177.28 3m12 h LYS 125 N 0.58 0.42 -0.38 0.81 3.64 -0.83 -3.20 116.57 117.60 3m12 h LYS 125 Ca 0.13 -0.24 -0.08 0.00 -1.27 0.00 0.00 60.65 59.18 3m12 h LYS 125 Cb 0.33 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 3m12 h LYS 125 CO 0.01 0.83 -0.09 -0.09 -2.27 0.00 0.00 179.45 177.83 3m12 h ARG 126 N 0.04 0.73 -3.33 1.90 2.43 -1.08 -3.37 114.38 111.69 3m12 h ARG 126 Ca 0.02 -0.28 -0.64 0.00 -0.81 0.00 0.00 59.98 58.27 3m12 h ARG 126 Cb 0.78 -0.04 -0.41 0.00 -0.42 0.00 0.00 29.97 29.88 3m12 h ARG 126 CO 0.05 0.88 -0.62 -1.58 -1.51 0.00 0.00 179.97 177.18 3m12 s TRP 127 N -4.79 3.22 0.31 2.20 0.51 -0.64 -5.09 118.94 114.65 3m12 s TRP 127 Ca -0.13 -3.19 -0.29 0.00 -2.12 0.00 0.00 56.10 50.38 3m12 s TRP 127 Cb 0.10 -2.79 -0.13 0.00 -0.81 0.00 0.00 33.47 29.84 3m12 s TRP 127 CO 0.81 -0.71 1.25 -2.30 -0.51 0.00 0.00 176.95 175.49 3m12 n PRO 128 N 2.95 1.94 0.00 4.98 -0.02 -1.21 -1.72 135.00 141.92 3m12 n PRO 128 Ca 0.07 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 3m12 n PRO 128 Cb 0.32 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 3m12 n PRO 128 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m12 n GLY 129 N 1.13 2.67 3.68 -1.23 0.00 -1.26 -4.76 105.19 105.42 3m12 n GLY 129 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 3m12 n GLY 129 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m12 s ILE 130 N -2.59 5.18 -0.36 -0.61 1.01 -0.70 -4.21 121.20 118.91 3m12 s ILE 130 Ca 0.00 0.11 0.02 0.00 0.00 0.00 0.00 60.65 60.78 3m12 s ILE 130 Cb 0.00 -3.36 0.11 0.00 0.01 0.00 0.00 42.46 39.22 3m12 s ILE 130 CO 0.00 0.43 0.11 0.42 0.00 0.00 0.00 174.94 175.91 3m12 s THR 131 N 0.48 1.62 0.14 2.92 -4.23 0.46 -4.40 115.64 112.62 3m12 s THR 131 Ca 0.06 -2.08 0.07 0.00 -1.18 0.00 0.00 61.69 58.56 3m12 s THR 131 Cb -0.12 -2.19 -0.04 0.00 1.34 0.00 0.00 72.50 71.49 3m12 s THR 131 CO -0.00 -0.69 -0.01 0.68 -0.54 0.00 0.00 174.62 174.05 3m12 s VAL 132 N 1.01 3.75 0.85 2.29 -7.23 -1.26 -4.26 120.40 115.55 3m12 s VAL 132 Ca 0.12 -1.28 -0.11 0.00 -1.81 0.00 0.00 61.98 58.90 3m12 s VAL 132 Cb -0.20 -2.84 0.11 0.00 0.56 0.00 0.00 36.38 34.01 3m12 s VAL 132 CO -0.13 -0.01 1.15 -2.84 -0.31 0.00 0.00 175.10 172.96 3m12 s PRO 133 N -2.66 1.45 0.55 4.82 0.02 -1.26 -4.84 135.00 133.08 3m12 s PRO 133 Ca 0.26 1.55 0.29 0.00 0.02 0.00 0.00 61.00 63.12 3m12 s PRO 133 Cb -0.10 -1.77 1.59 0.00 0.02 0.00 0.00 34.50 34.23 3m12 s PRO 133 CO 0.18 -2.32 2.14 0.93 -0.33 0.00 0.00 177.00 177.60 3m12 h GLU 134 N -1.40 0.00 -0.10 5.54 5.08 -1.98 -2.12 114.58 119.59 3m12 h GLU 134 Ca -0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 3m12 h GLU 134 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3m12 h GLU 134 CO 0.45 0.08 0.00 0.27 -1.00 0.00 0.00 179.01 178.81 3m12 n ASN 135 N -3.69 0.87 -4.84 1.42 0.23 -1.26 -3.64 115.26 104.36 3m12 n ASN 135 Ca -0.02 -1.65 -0.35 0.00 -0.53 0.00 0.00 54.58 52.03 3m12 n ASN 135 Cb 0.18 -0.07 -0.06 0.00 -2.08 0.00 0.00 39.78 37.76 3m12 n ASN 135 CO 0.00 0.00 0.00 -0.31 -0.93 0.00 0.00 177.26 176.02 3m12 s TYR 136 N -1.87 3.54 0.35 -2.53 1.51 -0.80 -0.46 117.35 117.10 3m12 s TYR 136 Ca 0.27 1.23 0.06 0.00 -1.01 0.00 0.00 57.07 57.61 3m12 s TYR 136 Cb 0.13 -2.51 -0.07 0.00 -0.11 0.00 0.00 41.96 39.40 3m12 s TYR 136 CO 0.21 0.28 0.01 0.54 -1.11 0.00 0.00 175.55 175.48 3m12 s ASN 137 N -1.90 3.14 0.03 2.29 4.22 -0.26 -0.12 114.94 122.35 3m12 s ASN 137 Ca 0.45 -1.33 -0.11 0.00 -2.14 0.00 0.00 52.86 49.73 3m12 s ASN 137 Cb -0.14 -0.24 0.01 0.00 1.28 0.00 0.00 41.25 42.16 3m12 s ASN 137 CO 0.20 -0.47 0.23 0.00 -2.04 0.00 0.00 177.10 175.02 3m12 s ALA 138 N -2.96 -0.49 -0.09 3.54 0.00 0.70 -1.94 121.76 120.52 3m12 s ALA 138 Ca 0.35 -0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.19 3m12 s ALA 138 Cb 0.08 0.26 0.02 0.00 0.00 0.00 0.00 23.12 23.48 3m12 s ALA 138 CO 0.16 -0.36 -0.12 -1.50 0.00 0.00 0.00 175.76 173.95 3m12 s ILE 139 N -2.36 1.18 -0.14 0.00 2.07 0.17 -2.24 121.20 119.88 3m12 s ILE 139 Ca -0.07 -0.46 -0.00 0.00 -1.41 0.00 0.00 60.65 58.71 3m12 s ILE 139 Cb -0.02 -1.10 -0.01 0.00 0.13 0.00 0.00 42.46 41.46 3m12 s ILE 139 CO -0.03 0.37 -0.13 0.12 -1.91 0.00 0.00 174.94 173.37 3m12 s PHE 140 N 1.00 2.82 -0.46 3.50 5.36 0.38 -0.96 117.98 129.61 3m12 s PHE 140 Ca -0.08 -0.73 -0.13 0.00 -0.96 0.00 0.00 56.93 55.03 3m12 s PHE 140 Cb -0.15 -1.87 0.09 0.00 -0.34 0.00 0.00 43.02 40.75 3m12 s PHE 140 CO -0.00 -0.28 0.35 -1.21 -1.46 0.00 0.00 175.22 172.62 3m12 s GLU 141 N 0.51 2.79 0.47 10.12 2.02 -0.10 -0.69 118.70 133.81 3m12 s GLU 141 Ca -0.09 -1.47 0.22 0.00 0.02 0.00 0.00 54.97 53.66 3m12 s GLU 141 Cb -0.16 -4.00 1.15 0.00 0.10 0.00 0.00 34.13 31.22 3m12 s GLU 141 CO 0.04 -1.05 1.96 -1.00 0.02 0.00 0.00 175.26 175.23 3m12 h PRO 142 N 8.61 0.00 -0.03 0.39 0.13 -1.86 -1.16 132.00 138.08 3m12 h PRO 142 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3m12 h PRO 142 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3m12 h PRO 142 CO 0.85 0.21 -0.00 0.09 -0.23 0.00 0.00 178.00 178.91 3m12 n ASN 143 N -3.74 2.61 -2.17 1.44 4.13 -1.26 -3.88 115.26 112.39 3m12 n ASN 143 Ca -0.01 -1.87 -0.01 0.00 1.68 0.00 0.00 54.58 54.36 3m12 n ASN 143 Cb 0.32 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.57 3m12 n ASN 143 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 3m12 n SER 144 N 1.04 0.11 0.00 6.41 3.41 -1.23 -4.94 113.62 118.43 3m12 n SER 144 Ca 0.15 -1.09 0.00 0.00 -0.26 0.00 0.00 58.87 57.68 3m12 n SER 144 Cb 0.54 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 3m12 n SER 144 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3m12 n GLY 145 N 4.57 -0.76 3.10 5.00 0.00 -0.74 -1.30 105.19 115.07 3m12 n GLY 145 Ca 0.01 -0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 3m12 n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m12 s VAL 146 N -3.65 1.65 -0.02 1.61 1.01 -0.29 -1.08 120.40 119.62 3m12 s VAL 146 Ca 0.00 -0.75 -0.07 0.00 0.00 0.00 0.00 61.98 61.16 3m12 s VAL 146 Cb 0.00 -1.47 -0.05 0.00 0.00 0.00 0.00 36.38 34.86 3m12 s VAL 146 CO 0.00 0.47 0.25 -0.76 0.00 0.00 0.00 175.10 175.06 3m12 s LEU 147 N 0.77 4.39 -0.79 3.92 1.43 0.66 -1.11 118.68 127.94 3m12 s LEU 147 Ca -0.11 0.57 -0.18 0.00 -1.03 0.00 0.00 54.13 53.39 3m12 s LEU 147 Cb -0.16 -2.52 0.15 0.00 0.03 0.00 0.00 46.19 43.69 3m12 s LEU 147 CO 0.02 0.30 0.90 -0.36 0.23 0.00 0.00 176.35 177.43 3m12 s PHE 148 N -1.21 3.25 0.17 0.29 0.08 -0.09 -0.93 117.98 119.55 3m12 s PHE 148 Ca 0.24 -1.41 -0.12 0.00 0.12 0.00 0.00 56.93 55.76 3m12 s PHE 148 Cb -0.13 -4.07 0.07 0.00 -0.57 0.00 0.00 43.02 38.32 3m12 s PHE 148 CO 0.13 -1.30 1.71 0.66 -0.10 0.00 0.00 175.22 176.32 3m12 h SER 149 N 8.66 0.86 -0.64 1.36 4.64 -1.55 -0.15 113.55 126.73 3m12 h SER 149 Ca -0.00 -0.20 -0.07 0.00 -0.47 0.00 0.00 61.79 61.05 3m12 h SER 149 Cb 1.05 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.89 3m12 h SER 149 CO 1.01 0.83 0.14 -0.33 -0.87 0.00 0.00 176.83 177.61 3m12 h GLU 150 N 0.84 1.03 -0.96 4.77 5.08 -1.73 -2.26 114.58 121.36 3m12 h GLU 150 Ca 0.19 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3m12 h GLU 150 Cb 0.26 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.34 3m12 h GLU 150 CO -0.01 0.94 0.59 -0.91 -1.00 0.00 0.00 179.01 178.62 3m12 h ASN 151 N 0.95 1.14 -0.14 1.42 2.35 -1.72 -1.13 115.58 118.44 3m12 h ASN 151 Ca 0.20 -0.06 0.03 0.00 -0.55 0.00 0.00 56.30 55.92 3m12 h ASN 151 Cb 0.38 -0.29 -0.03 0.00 0.05 0.00 0.00 38.32 38.43 3m12 h ASN 151 CO 0.00 0.86 -0.03 0.00 -1.65 0.00 0.00 177.43 176.62 3m12 h ILE 153 N 0.01 1.25 -0.49 0.00 2.04 -1.24 -1.20 117.51 117.89 3m12 h ILE 153 Ca 0.07 -0.95 0.06 0.00 1.00 0.00 0.00 64.86 65.04 3m12 h ILE 153 Cb 0.10 1.09 -0.05 0.00 -0.74 0.00 0.00 36.82 37.22 3m12 h ILE 153 CO -0.14 0.32 0.20 -0.09 0.00 0.00 0.00 178.15 178.45 3m12 h ARG 154 N 0.52 0.39 -0.16 2.37 2.43 -1.08 -0.62 114.38 118.22 3m12 h ARG 154 Ca 0.12 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 3m12 h ARG 154 Cb 0.43 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 3m12 h ARG 154 CO 0.02 0.25 -0.00 0.00 -1.51 0.00 0.00 179.97 178.73 3m12 h ALA 155 N 1.30 0.21 -0.78 2.80 0.00 -0.81 -1.37 119.26 120.61 3m12 h ALA 155 Ca 0.23 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.98 3m12 h ALA 155 Cb 0.20 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 3m12 h ALA 155 CO -0.21 -0.08 0.52 1.88 0.00 0.00 0.00 179.25 181.36 3m12 h TYR 156 N 0.02 0.92 -0.01 0.00 0.05 -1.05 -1.11 116.97 115.80 3m12 h TYR 156 Ca 0.04 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.85 3m12 h TYR 156 Cb 0.38 -0.31 -0.00 0.00 1.01 0.00 0.00 36.73 37.82 3m12 h TYR 156 CO 0.04 0.53 -0.00 -0.09 -1.05 0.00 0.00 178.16 177.58 3m12 h ARG 157 N 0.94 0.01 -0.75 4.88 2.43 -0.90 0.09 114.38 121.08 3m12 h ARG 157 Ca 0.32 -0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.55 3m12 h ARG 157 Cb 0.08 -0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.57 3m12 h ARG 157 CO -0.10 0.41 0.43 0.93 -1.51 0.00 0.00 179.97 180.14 3m12 h GLU 158 N -0.39 0.75 -0.21 0.20 5.08 -1.00 -0.54 114.58 118.48 3m12 h GLU 158 Ca 0.00 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 3m12 h GLU 158 Cb 0.41 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 3m12 h GLU 158 CO 0.00 0.50 -0.15 -0.07 -1.00 0.00 0.00 179.01 178.28 3m12 h LEU 159 N 0.77 0.49 -0.44 1.33 3.38 -1.13 -1.85 115.31 117.86 3m12 h LEU 159 Ca 0.34 -0.45 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 3m12 h LEU 159 Cb 0.23 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 3m12 h LEU 159 CO -0.20 0.83 0.26 0.00 0.09 0.00 0.00 178.44 179.42 3m12 h ALA 160 N 0.67 0.56 -0.64 1.53 0.00 -0.72 -2.22 119.26 118.43 3m12 h ALA 160 Ca 0.04 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 3m12 h ALA 160 Cb 0.68 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3m12 h ALA 160 CO 0.04 0.05 0.14 0.93 0.00 0.00 0.00 179.25 180.42 3m12 h GLU 161 N 0.58 1.02 -0.29 0.00 5.08 -1.09 -1.24 114.58 118.63 3m12 h GLU 161 Ca 0.16 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3m12 h GLU 161 Cb 0.01 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 3m12 h GLU 161 CO -0.03 0.91 0.15 0.00 -1.00 0.00 0.00 179.01 179.04 3m12 h ALA 162 N 1.19 1.71 -0.01 3.43 0.00 -1.04 -1.39 119.26 123.15 3m12 h ALA 162 Ca 0.20 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3m12 h ALA 162 Cb 0.36 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3m12 h ALA 162 CO 0.00 0.24 -0.06 0.54 0.00 0.00 0.00 179.25 179.97 3m12 n ARG 163 N -4.45 0.97 0.00 0.00 5.12 -0.86 -4.91 116.66 112.53 3m12 n ARG 163 Ca 0.01 -0.34 0.00 0.00 -1.93 0.00 0.00 57.85 55.59 3m12 n ARG 163 Cb 0.11 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 29.91 3m12 n ARG 163 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3m12 n GLY 164 N 1.19 0.91 3.77 -0.13 0.00 -0.52 -4.91 105.19 105.50 3m12 n GLY 164 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3m12 n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m12 s ALA 165 N -2.00 3.47 -0.15 4.61 0.00 -0.53 -4.72 121.76 122.45 3m12 s ALA 165 Ca 0.00 1.44 -0.08 0.00 0.00 0.00 0.00 51.96 53.32 3m12 s ALA 165 Cb 0.00 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 3m12 s ALA 165 CO 0.00 -0.94 0.13 0.15 0.00 0.00 0.00 175.76 175.10 3m12 s LYS 166 N -2.09 3.67 -0.20 0.00 -0.14 -0.49 -4.30 119.74 116.20 3m12 s LYS 166 Ca 0.53 -0.18 0.01 0.00 -1.36 0.00 0.00 55.97 54.98 3m12 s LYS 166 Cb -0.43 -3.24 0.04 0.00 -1.68 0.00 0.00 37.83 32.51 3m12 s LYS 166 CO 0.58 0.61 -0.13 0.08 -0.76 0.00 0.00 175.35 175.73 3m12 s VAL 167 N -0.54 1.81 -0.42 3.17 1.01 -1.26 -0.16 120.40 124.01 3m12 s VAL 167 Ca 0.12 -1.05 -0.13 0.00 0.00 0.00 0.00 61.98 60.92 3m12 s VAL 167 Cb -0.12 -1.81 0.05 0.00 0.00 0.00 0.00 36.38 34.50 3m12 s VAL 167 CO 0.02 0.25 0.30 -0.22 0.00 0.00 0.00 175.10 175.46 3m12 s LEU 168 N 1.33 5.20 0.43 3.92 2.96 0.63 -4.98 118.68 128.17 3m12 s LEU 168 Ca -0.00 -1.17 0.01 0.00 -0.22 0.00 0.00 54.13 52.74 3m12 s LEU 168 Cb -0.16 -2.11 -0.01 0.00 0.50 0.00 0.00 46.19 44.42 3m12 s LEU 168 CO -0.09 -0.52 0.65 0.42 -1.32 0.00 0.00 176.35 175.49 3m12 s THR 169 N 1.59 4.12 -1.48 3.68 -4.23 -1.26 -1.53 115.64 116.53 3m12 s THR 169 Ca 0.04 -0.51 -0.12 0.00 -1.18 0.00 0.00 61.69 59.92 3m12 s THR 169 Cb -0.22 -3.52 0.07 0.00 1.34 0.00 0.00 72.50 70.18 3m12 s THR 169 CO 0.07 -0.35 0.85 1.41 -0.54 0.00 0.00 174.62 176.05 3m12 n HIS 170 N -2.03 -2.19 -3.72 3.99 8.25 -0.48 -4.88 115.22 114.15 3m12 n HIS 170 Ca 0.01 0.78 -0.28 0.00 -0.26 0.00 0.00 57.72 57.96 3m12 n HIS 170 Cb 0.57 -3.89 -0.16 0.00 1.12 0.00 0.00 29.99 27.64 3m12 n HIS 170 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3m12 s THR 171 N -3.21 0.59 -0.17 1.59 2.01 0.08 -4.88 115.64 111.65 3m12 s THR 171 Ca 0.57 -0.81 -0.26 0.00 0.31 0.00 0.00 61.69 61.50 3m12 s THR 171 Cb -0.28 -1.21 -0.01 0.00 0.01 0.00 0.00 72.50 71.01 3m12 s THR 171 CO 0.70 -0.37 0.88 -0.60 -0.69 0.00 0.00 174.62 174.53 3m12 s ARG 172 N 1.81 4.30 0.10 4.92 3.52 -1.26 -2.98 118.95 129.36 3m12 s ARG 172 Ca 0.02 1.09 -0.30 0.00 -0.13 0.00 0.00 55.73 56.41 3m12 s ARG 172 Cb -0.17 -3.58 -0.07 0.00 -1.56 0.00 0.00 34.95 29.57 3m12 s ARG 172 CO -0.15 -0.38 1.22 0.08 -0.81 0.00 0.00 175.30 175.26 3m12 s VAL 173 N 2.31 3.83 -0.07 7.11 1.01 -1.26 -4.14 120.40 129.18 3m12 s VAL 173 Ca 0.40 1.37 0.09 0.00 0.00 0.00 0.00 61.98 63.83 3m12 s VAL 173 Cb -0.16 -3.88 -0.13 0.00 0.00 0.00 0.00 36.38 32.21 3m12 s VAL 173 CO 0.12 0.14 0.08 -0.62 0.00 0.00 0.00 175.10 174.82 3m12 n GLU 174 N 3.55 1.90 -3.61 2.72 1.02 0.75 -5.00 120.64 121.96 3m12 n GLU 174 Ca 0.08 -0.03 -0.10 0.00 -0.02 0.00 0.00 57.16 57.09 3m12 n GLU 174 Cb 0.45 -1.24 -0.03 0.00 -0.02 0.00 0.00 31.44 30.61 3m12 n GLU 174 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3m12 s ASP 175 N -3.89 -0.40 0.03 1.62 3.68 -1.18 -5.01 116.67 111.52 3m12 s ASP 175 Ca -0.04 -0.28 0.05 0.00 2.13 0.00 0.00 52.55 54.41 3m12 s ASP 175 Cb 0.04 0.62 -0.02 0.00 -1.45 0.00 0.00 42.92 42.11 3m12 s ASP 175 CO 0.39 -1.07 -0.15 -0.36 0.13 0.00 0.00 175.17 174.11 3m12 s PHE 176 N -3.82 1.28 -0.23 -5.34 0.08 -1.26 -1.29 117.98 107.38 3m12 s PHE 176 Ca 0.05 -0.33 -0.01 0.00 0.12 0.00 0.00 56.93 56.77 3m12 s PHE 176 Cb -0.02 -0.77 0.07 0.00 -0.57 0.00 0.00 43.02 41.73 3m12 s PHE 176 CO -0.06 0.03 -0.00 0.34 -0.10 0.00 0.00 175.22 175.43 3m12 s ASP 177 N -0.97 3.59 -0.17 1.36 3.68 -0.07 -4.96 116.67 119.12 3m12 s ASP 177 Ca 0.03 -1.15 -0.06 0.00 2.13 0.00 0.00 52.55 53.50 3m12 s ASP 177 Cb -0.07 -0.96 -0.03 0.00 -1.45 0.00 0.00 42.92 40.40 3m12 s ASP 177 CO 0.01 -0.29 0.02 -0.63 0.13 0.00 0.00 175.17 174.41 3m12 s ILE 178 N 1.56 4.38 0.34 4.11 -1.09 -1.26 -1.03 121.20 128.20 3m12 s ILE 178 Ca -0.02 -0.18 0.09 0.00 -2.23 0.00 0.00 60.65 58.31 3m12 s ILE 178 Cb -0.18 -2.96 -0.05 0.00 -1.58 0.00 0.00 42.46 37.69 3m12 s ILE 178 CO -0.09 0.47 0.06 -0.44 -1.23 0.00 0.00 174.94 173.71 3m12 s SER 179 N 0.44 4.39 0.53 3.58 0.01 0.04 -5.03 113.70 117.65 3m12 s SER 179 Ca 0.00 -0.89 0.22 0.00 1.31 0.00 0.00 55.95 56.59 3m12 s SER 179 Cb -0.13 -0.62 1.35 0.00 0.21 0.00 0.00 66.02 66.83 3m12 s SER 179 CO 0.02 -0.24 2.05 -0.65 0.41 0.00 0.00 173.24 174.82 3m12 h PRO 180 N 1.72 0.00 0.00 12.44 0.11 -1.99 -3.17 132.00 141.11 3m12 h PRO 180 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3m12 h PRO 180 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3m12 h PRO 180 CO 0.65 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.04 3m12 n ASP 181 N -4.43 1.26 -3.69 -2.05 5.75 -1.26 -4.94 116.55 107.18 3m12 n ASP 181 Ca 0.05 -1.28 -0.09 0.00 -0.01 0.00 0.00 54.79 53.46 3m12 n ASP 181 Cb 0.42 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.49 3m12 n ASP 181 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3m12 s SER 182 N -0.28 -0.36 0.08 -1.12 1.04 -1.20 -4.78 113.70 107.08 3m12 s SER 182 Ca 0.00 -0.39 0.06 0.00 0.48 0.00 0.00 55.95 56.10 3m12 s SER 182 Cb 0.00 0.65 -0.03 0.00 0.10 0.00 0.00 66.02 66.74 3m12 s SER 182 CO 0.00 -1.16 -0.17 0.68 0.98 0.00 0.00 173.24 173.57 3m12 s VAL 183 N -3.86 1.37 -0.01 5.02 -7.23 0.17 -0.78 120.40 115.08 3m12 s VAL 183 Ca 0.08 -1.40 0.00 0.00 -1.81 0.00 0.00 61.98 58.85 3m12 s VAL 183 Cb -0.03 -1.27 0.01 0.00 0.56 0.00 0.00 36.38 35.64 3m12 s VAL 183 CO -0.01 -0.15 -0.01 -0.75 -0.31 0.00 0.00 175.10 173.87 3m12 s LYS 184 N -1.80 0.16 0.11 4.82 2.20 -0.20 -1.62 119.74 123.42 3m12 s LYS 184 Ca 0.02 -0.01 0.09 0.00 -0.36 0.00 0.00 55.97 55.70 3m12 s LYS 184 Cb -0.10 -0.22 -0.04 0.00 -1.51 0.00 0.00 37.83 35.96 3m12 s LYS 184 CO 0.03 -0.02 -0.17 0.96 -0.36 0.00 0.00 175.35 175.80 3m12 s ILE 185 N 0.29 2.92 -0.11 5.43 -4.36 -0.07 -0.89 121.20 124.41 3m12 s ILE 185 Ca -0.03 -1.47 0.04 0.00 -0.26 0.00 0.00 60.65 58.93 3m12 s ILE 185 Cb -0.05 -2.34 0.00 0.00 1.25 0.00 0.00 42.46 41.32 3m12 s ILE 185 CO -0.01 0.10 -0.24 -1.61 0.24 0.00 0.00 174.94 173.43 3m12 s GLU 186 N -2.15 3.04 0.10 0.37 2.02 -0.41 -1.80 118.70 119.87 3m12 s GLU 186 Ca 0.18 -0.87 0.00 0.00 0.02 0.00 0.00 54.97 54.30 3m12 s GLU 186 Cb -0.11 -2.32 -0.04 0.00 0.10 0.00 0.00 34.13 31.76 3m12 s GLU 186 CO 0.11 0.15 -0.02 0.95 0.02 0.00 0.00 175.26 176.46 3m12 s THR 187 N 0.42 0.44 0.18 3.63 -4.23 -0.85 -0.18 115.64 115.05 3m12 s THR 187 Ca -0.17 -1.90 0.35 0.00 -1.18 0.00 0.00 61.69 58.78 3m12 s THR 187 Cb -0.18 -1.79 0.37 0.00 1.34 0.00 0.00 72.50 72.25 3m12 s THR 187 CO 0.07 -0.76 2.04 0.00 -0.54 0.00 0.00 174.62 175.44 3m12 h ALA 188 N 2.95 1.00 -0.10 3.99 0.00 -1.98 -1.44 119.26 123.68 3m12 h ALA 188 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3m12 h ALA 188 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3m12 h ALA 188 CO 0.64 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.98 3m12 n ASN 189 N -2.88 2.18 0.00 0.00 5.03 -1.26 -5.05 115.26 113.28 3m12 n ASN 189 Ca -0.01 -1.74 0.00 0.00 0.87 0.00 0.00 54.58 53.71 3m12 n ASN 189 Cb 0.19 -0.05 0.00 0.00 -1.02 0.00 0.00 39.78 38.89 3m12 n ASN 189 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3m12 n GLY 190 N 1.25 2.94 3.88 7.41 0.00 -0.54 -5.09 105.19 115.04 3m12 n GLY 190 Ca 0.17 -1.92 -0.35 0.00 0.00 0.00 0.00 46.02 43.91 3m12 n GLY 190 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3m12 s SER 191 N 0.00 6.31 0.02 1.61 0.01 -1.26 -2.01 113.70 118.38 3m12 s SER 191 Ca 0.00 0.40 0.03 0.00 1.31 0.00 0.00 55.95 57.69 3m12 s SER 191 Cb 0.00 -2.00 -0.02 0.00 0.21 0.00 0.00 66.02 64.21 3m12 s SER 191 CO 0.00 0.35 -0.10 -0.31 0.41 0.00 0.00 173.24 173.59 3m12 s TYR 192 N -1.13 0.86 0.15 2.43 2.02 -0.74 -4.89 117.35 116.05 3m12 s TYR 192 Ca 0.19 -0.31 0.10 0.00 -0.37 0.00 0.00 57.07 56.68 3m12 s TYR 192 Cb -0.12 -0.52 -0.04 0.00 -0.40 0.00 0.00 41.96 40.87 3m12 s TYR 192 CO 0.09 -0.01 -0.22 0.95 -1.57 0.00 0.00 175.55 174.79 3m12 s THR 193 N -0.75 2.02 0.34 -0.71 -4.23 -1.26 -0.89 115.64 110.14 3m12 s THR 193 Ca -0.01 -1.82 -0.15 0.00 -1.18 0.00 0.00 61.69 58.53 3m12 s THR 193 Cb -0.07 -1.87 0.03 0.00 1.34 0.00 0.00 72.50 71.94 3m12 s THR 193 CO 0.00 -0.12 0.70 0.00 -0.54 0.00 0.00 174.62 174.67 3m12 s ALA 194 N -1.52 -0.64 0.07 3.99 0.00 -0.64 -1.49 121.76 121.53 3m12 s ALA 194 Ca 0.14 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.37 3m12 s ALA 194 Cb -0.08 0.82 -0.26 0.00 0.00 0.00 0.00 23.12 23.61 3m12 s ALA 194 CO 0.07 -0.96 1.12 -0.44 0.00 0.00 0.00 175.76 175.54 3m12 h ASP 195 N 2.04 0.25 -4.71 0.00 3.45 -1.22 0.52 116.42 116.76 3m12 h ASP 195 Ca -0.27 -0.29 -0.28 0.00 0.43 0.00 0.00 57.03 56.61 3m12 h ASP 195 Cb 1.25 -0.08 -0.20 0.00 -0.56 0.00 0.00 39.33 39.73 3m12 h ASP 195 CO 0.35 1.23 -0.73 -0.54 -1.57 0.00 0.00 179.24 177.98 3m12 s LYS 196 N -2.66 0.60 -0.04 3.56 -0.14 -0.78 -4.43 119.74 115.84 3m12 s LYS 196 Ca -0.03 -0.86 0.03 0.00 -1.36 0.00 0.00 55.97 53.75 3m12 s LYS 196 Cb 0.08 -0.33 0.00 0.00 -1.68 0.00 0.00 37.83 35.90 3m12 s LYS 196 CO 0.85 0.05 -0.12 -1.17 -0.76 0.00 0.00 175.35 174.20 3m12 s LEU 197 N -1.81 1.77 -0.17 3.17 2.96 -0.26 -1.26 118.68 123.08 3m12 s LEU 197 Ca -0.06 -0.27 -0.02 0.00 -0.22 0.00 0.00 54.13 53.56 3m12 s LEU 197 Cb -0.08 -0.76 -0.01 0.00 0.50 0.00 0.00 46.19 45.84 3m12 s LEU 197 CO -0.00 0.08 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.39 3m12 s ILE 198 N 0.30 3.19 -0.28 6.68 1.01 0.19 -0.26 121.20 132.02 3m12 s ILE 198 Ca -0.07 -0.59 -0.06 0.00 0.00 0.00 0.00 60.65 59.94 3m12 s ILE 198 Cb -0.12 -2.39 0.01 0.00 0.01 0.00 0.00 42.46 39.97 3m12 s ILE 198 CO 0.02 0.48 0.04 -0.69 0.00 0.00 0.00 174.94 174.79 3m12 s VAL 199 N 0.85 3.74 -0.42 2.92 1.01 0.85 -0.53 120.40 128.82 3m12 s VAL 199 Ca -0.03 -0.69 0.09 0.00 0.00 0.00 0.00 61.98 61.35 3m12 s VAL 199 Cb -0.15 -2.89 0.30 0.00 0.00 0.00 0.00 36.38 33.64 3m12 s VAL 199 CO 0.01 0.16 0.80 -1.54 0.00 0.00 0.00 175.10 174.53 3m12 n SER 200 N 4.83 -0.77 -1.40 3.32 3.41 -0.07 -1.19 113.62 121.75 3m12 n SER 200 Ca -0.15 -3.16 0.08 0.00 -0.26 0.00 0.00 58.87 55.38 3m12 n SER 200 Cb 0.48 0.44 0.31 0.00 -0.26 0.00 0.00 64.21 65.18 3m12 n SER 200 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3m12 n MET 201 N 0.81 3.35 0.00 4.33 2.81 -1.25 -4.31 117.12 122.86 3m12 n MET 201 Ca 0.17 -2.42 0.00 0.00 -1.81 0.00 0.00 57.70 53.64 3m12 n MET 201 Cb 0.63 -1.82 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 3m12 n MET 201 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3m12 n GLY 202 N 0.99 3.72 0.27 3.03 0.00 -1.26 -1.85 105.19 110.08 3m12 n GLY 202 Ca 0.22 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.36 3m12 n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m12 h ALA 203 N -0.90 1.39 0.00 4.61 0.00 -1.93 -1.59 119.26 120.84 3m12 h ALA 203 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3m12 h ALA 203 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3m12 h ALA 203 CO 0.00 0.11 0.00 0.91 0.00 0.00 0.00 179.25 180.27 3m12 n TRP 204 N -3.76 0.00 -0.00 0.00 8.01 -0.77 -2.84 117.44 118.07 3m12 n TRP 204 Ca -0.02 0.00 0.09 0.00 -1.31 0.00 0.00 57.50 56.26 3m12 n TRP 204 Cb 0.19 -0.42 0.50 0.00 -2.01 0.00 0.00 31.31 29.58 3m12 n TRP 204 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.69 175.77 3m12 h ASN 205 N 0.00 0.33 0.67 -0.99 -0.26 -1.36 -0.90 115.58 113.08 3m12 h ASN 205 Ca 0.00 -0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 3m12 h ASN 205 Cb 0.40 -0.07 0.00 0.00 -1.06 0.00 0.00 38.32 37.58 3m12 h ASN 205 CO 0.00 0.22 0.00 -1.54 -1.06 0.00 0.00 177.43 175.05 3m12 n SER 206 N -4.48 0.61 -0.03 5.81 3.41 -1.13 -2.25 113.62 115.57 3m12 n SER 206 Ca 0.06 0.66 -0.02 0.00 -0.26 0.00 0.00 58.87 59.31 3m12 n SER 206 Cb 0.24 -0.79 -0.06 0.00 -0.26 0.00 0.00 64.21 63.34 3m12 n SER 206 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3m12 n LYS 207 N -2.19 2.14 0.00 4.33 5.02 -0.77 -4.83 118.16 121.87 3m12 n LYS 207 Ca 0.02 -0.02 0.03 0.00 -2.02 0.00 0.00 58.31 56.32 3m12 n LYS 207 Cb 0.21 -1.19 -0.02 0.00 -0.02 0.00 0.00 35.03 34.01 3m12 n LYS 207 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3m12 n LEU 208 N -2.14 0.56 0.23 -0.35 4.32 -0.41 -4.41 117.00 114.80 3m12 n LEU 208 Ca -0.09 -0.59 0.15 0.00 -0.02 0.00 0.00 56.01 55.46 3m12 n LEU 208 Cb 0.60 0.00 0.59 0.00 -1.62 0.00 0.00 43.42 42.98 3m12 n LEU 208 CO 0.16 0.12 0.94 -0.07 -1.22 0.00 0.00 177.39 177.32 3m12 h LEU 209 N 0.28 0.00 -2.07 2.23 3.38 -1.67 -2.63 115.31 114.83 3m12 h LEU 209 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3m12 h LEU 209 Cb 0.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 3m12 h LEU 209 CO 0.00 0.00 -0.07 0.77 0.09 0.00 0.00 178.44 179.23 3m12 h SER 210 N 0.00 0.00 0.65 -0.43 4.64 -1.76 -0.42 113.55 116.24 3m12 h SER 210 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m12 h SER 210 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 3m12 h SER 210 CO 0.00 0.07 0.00 0.29 -0.87 0.00 0.00 176.83 176.32 3m12 n LYS 211 N -4.02 0.02 -0.60 4.77 4.76 -0.99 -1.87 118.16 120.23 3m12 n LYS 211 Ca -0.03 0.16 0.06 0.00 -2.87 0.00 0.00 58.31 55.64 3m12 n LYS 211 Cb 0.16 -1.50 0.29 0.00 -1.84 0.00 0.00 35.03 32.13 3m12 n LYS 211 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3m12 n LEU 212 N -1.49 4.41 -3.08 -0.35 4.77 -0.23 -4.47 117.00 116.57 3m12 n LEU 212 Ca 0.05 -3.08 -0.23 0.00 -0.03 0.00 0.00 56.01 52.72 3m12 n LEU 212 Cb 0.22 -0.59 0.04 0.00 -2.33 0.00 0.00 43.42 40.76 3m12 n LEU 212 CO 0.18 0.72 0.01 -3.20 -1.33 0.00 0.00 177.39 173.77 3m12 n ASN 213 N -0.34 -6.00 -4.47 -1.43 4.05 -0.78 -5.01 115.26 101.28 3m12 n ASN 213 Ca 0.25 -0.31 -0.33 0.00 0.45 0.00 0.00 54.58 54.64 3m12 n ASN 213 Cb 1.00 -4.85 -0.13 0.00 1.23 0.00 0.00 39.78 37.03 3m12 n ASN 213 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 3m12 s LEU 214 N -6.72 2.85 -0.63 1.20 1.43 -0.84 -5.00 118.68 110.96 3m12 s LEU 214 Ca 0.33 -0.20 0.05 0.00 -1.03 0.00 0.00 54.13 53.28 3m12 s LEU 214 Cb -0.15 -1.61 0.17 0.00 0.03 0.00 0.00 46.19 44.63 3m12 s LEU 214 CO 0.41 0.28 0.46 -0.62 0.23 0.00 0.00 176.35 177.10 3m12 s ASP 215 N -0.34 4.03 -0.16 2.29 3.68 -1.26 -3.23 116.67 121.68 3m12 s ASP 215 Ca 0.04 -3.66 -0.01 0.00 2.13 0.00 0.00 52.55 51.04 3m12 s ASP 215 Cb -0.13 -1.35 -0.01 0.00 -1.45 0.00 0.00 42.92 39.98 3m12 s ASP 215 CO 0.02 -0.11 -0.12 -0.63 0.13 0.00 0.00 175.17 174.47 3m12 s ILE 216 N -1.09 2.98 -0.23 4.11 1.01 -1.26 -5.04 121.20 121.68 3m12 s ILE 216 Ca 0.27 -0.67 -0.29 0.00 0.00 0.00 0.00 60.65 59.96 3m12 s ILE 216 Cb -0.03 -2.27 -0.06 0.00 0.01 0.00 0.00 42.46 40.11 3m12 s ILE 216 CO -0.17 0.50 2.22 -2.65 0.00 0.00 0.00 174.94 174.84 3m12 n PRO 217 N 3.95 1.89 -3.82 2.79 -0.02 -1.26 -4.92 135.00 133.60 3m12 n PRO 217 Ca -0.18 0.51 -0.26 0.00 -2.02 0.00 0.00 63.50 61.55 3m12 n PRO 217 Cb 0.52 -3.17 -0.17 0.00 -0.02 0.00 0.00 33.50 30.66 3m12 n PRO 217 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3m12 s LEU 218 N 8.23 1.03 -0.25 2.45 1.43 -1.26 -4.37 118.68 125.94 3m12 s LEU 218 Ca 1.02 -0.37 -0.05 0.00 -1.03 0.00 0.00 54.13 53.69 3m12 s LEU 218 Cb -0.38 -0.65 -0.00 0.00 0.03 0.00 0.00 46.19 45.19 3m12 s LEU 218 CO 0.36 -0.19 0.01 -1.58 0.23 0.00 0.00 176.35 175.18 3m12 s GLN 219 N 1.83 3.25 0.24 1.70 2.00 -0.60 -4.76 119.66 123.32 3m12 s GLN 219 Ca 0.03 -0.72 -0.30 0.00 -2.00 0.00 0.00 55.36 52.37 3m12 s GLN 219 Cb -0.14 -3.17 -0.09 0.00 0.80 0.00 0.00 33.01 30.42 3m12 s GLN 219 CO -0.07 -0.30 0.97 -2.14 -0.50 0.00 0.00 175.29 173.25 3m12 s PRO 220 N 1.48 4.81 -0.01 1.67 0.02 -1.26 -0.63 135.00 141.09 3m12 s PRO 220 Ca 0.04 1.55 0.06 0.00 0.02 0.00 0.00 61.00 62.67 3m12 s PRO 220 Cb -0.16 -3.27 -0.02 0.00 0.02 0.00 0.00 34.50 31.08 3m12 s PRO 220 CO -0.01 0.44 -0.19 0.71 -0.33 0.00 0.00 177.00 177.63 3m12 s TYR 221 N -1.09 1.68 -0.32 6.54 2.02 0.51 -1.98 117.35 124.70 3m12 s TYR 221 Ca 0.42 -0.32 -0.27 0.00 -0.37 0.00 0.00 57.07 56.53 3m12 s TYR 221 Cb -0.27 -1.07 0.01 0.00 -0.40 0.00 0.00 41.96 40.23 3m12 s TYR 221 CO 0.33 -0.02 0.96 0.50 -1.57 0.00 0.00 175.55 175.76 3m12 s ARG 222 N -0.50 4.00 -0.23 -0.62 3.52 0.95 -1.50 118.95 124.57 3m12 s ARG 222 Ca 0.07 0.85 0.00 0.00 -0.13 0.00 0.00 55.73 56.53 3m12 s ARG 222 Cb -0.07 -3.74 0.06 0.00 -1.56 0.00 0.00 34.95 29.63 3m12 s ARG 222 CO -0.01 -0.83 -0.05 -0.65 -0.81 0.00 0.00 175.30 172.95 3m12 s GLN 223 N 3.39 1.57 0.30 5.12 -1.52 0.75 -2.72 119.66 126.56 3m12 s GLN 223 Ca 0.40 -0.94 -0.07 0.00 -1.95 0.00 0.00 55.36 52.81 3m12 s GLN 223 Cb -0.13 -2.54 -0.06 0.00 -0.22 0.00 0.00 33.01 30.07 3m12 s GLN 223 CO 0.15 -0.59 0.60 0.14 -0.25 0.00 0.00 175.29 175.33 3m12 s VAL 224 N 1.43 4.96 -0.06 1.09 -7.23 -1.26 -1.32 120.40 118.01 3m12 s VAL 224 Ca -0.05 0.25 0.02 0.00 -1.81 0.00 0.00 61.98 60.39 3m12 s VAL 224 Cb -0.19 -3.71 0.01 0.00 0.56 0.00 0.00 36.38 33.05 3m12 s VAL 224 CO -0.06 -0.32 -0.11 -0.69 -0.31 0.00 0.00 175.10 173.61 3m12 s VAL 225 N -2.09 1.03 0.06 1.32 1.01 -0.57 -4.28 120.40 116.88 3m12 s VAL 225 Ca 0.46 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 62.02 3m12 s VAL 225 Cb -0.11 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 3m12 s VAL 225 CO 0.29 0.33 0.10 -0.83 0.00 0.00 0.00 175.10 174.99 3m12 s GLY 226 N 0.59 2.05 -0.16 4.51 0.00 -0.35 -0.70 107.32 113.27 3m12 s GLY 226 Ca -0.12 -0.95 0.01 0.00 0.00 0.00 0.00 44.72 43.65 3m12 s GLY 226 CO 0.03 -0.92 -0.18 -1.36 0.00 0.00 0.00 173.10 170.67 3m12 s PHE 227 N -1.38 2.76 0.00 1.90 2.99 -0.31 -1.29 117.98 122.66 3m12 s PHE 227 Ca 0.29 -1.29 0.07 0.00 0.00 0.00 0.00 56.93 56.01 3m12 s PHE 227 Cb -0.12 -1.89 -0.02 0.00 0.00 0.00 0.00 43.02 40.99 3m12 s PHE 227 CO 0.22 -0.61 -0.22 -0.06 -0.00 0.00 0.00 175.22 174.55 3m12 s PHE 228 N 0.98 1.97 0.10 0.36 0.08 0.18 -0.80 117.98 120.86 3m12 s PHE 228 Ca -0.03 -0.38 -0.31 0.00 0.12 0.00 0.00 56.93 56.34 3m12 s PHE 228 Cb -0.15 -1.24 -0.09 0.00 -0.57 0.00 0.00 43.02 40.98 3m12 s PHE 228 CO -0.04 0.01 1.61 -2.00 -0.10 0.00 0.00 175.22 174.70 3m12 s GLU 229 N -0.75 4.21 0.19 0.44 2.56 0.04 -1.61 118.70 123.78 3m12 s GLU 229 Ca 0.09 2.33 0.06 0.00 0.00 0.00 0.00 54.97 57.44 3m12 s GLU 229 Cb -0.09 -3.43 -0.05 0.00 2.00 0.00 0.00 34.13 32.57 3m12 s GLU 229 CO 0.00 -0.67 -0.10 -1.12 -0.56 0.00 0.00 175.26 172.81 3m12 s SER 230 N 1.90 2.13 -0.51 -1.70 0.01 -1.26 -2.35 113.70 111.92 3m12 s SER 230 Ca 0.72 -1.06 -0.27 0.00 1.31 0.00 0.00 55.95 56.64 3m12 s SER 230 Cb -0.41 -0.06 -0.02 0.00 0.21 0.00 0.00 66.02 65.74 3m12 s SER 230 CO 0.32 -0.31 1.84 -0.62 0.41 0.00 0.00 173.24 174.87 3m12 s ASP 231 N -3.26 5.49 0.51 2.44 3.68 -0.70 -4.87 116.67 119.97 3m12 s ASP 231 Ca 0.21 0.69 0.22 0.00 2.13 0.00 0.00 52.55 55.81 3m12 s ASP 231 Cb 0.02 -2.53 1.36 0.00 -1.45 0.00 0.00 42.92 40.32 3m12 s ASP 231 CO 0.05 -2.14 2.09 -0.33 0.13 0.00 0.00 175.17 174.97 3m12 h GLU 232 N 14.24 0.00 0.00 4.34 4.39 -1.95 -0.06 114.58 135.54 3m12 h GLU 232 Ca -0.28 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.42 3m12 h GLU 232 Cb 1.16 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 3m12 h GLU 232 CO 1.15 0.10 0.00 -1.13 -1.16 0.00 0.00 179.01 177.98 3m12 n SER 233 N -4.01 0.14 -0.02 1.42 3.41 -1.26 -3.02 113.62 110.28 3m12 n SER 233 Ca -0.02 0.53 -0.02 0.00 -0.26 0.00 0.00 58.87 59.10 3m12 n SER 233 Cb 0.19 -0.57 -0.02 0.00 -0.26 0.00 0.00 64.21 63.56 3m12 n SER 233 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3m12 n LYS 234 N -1.66 0.62 -0.07 4.33 5.02 -0.42 -4.86 118.16 121.12 3m12 n LYS 234 Ca 0.03 0.02 0.08 0.00 -2.02 0.00 0.00 58.31 56.42 3m12 n LYS 234 Cb 0.19 -1.08 0.11 0.00 -0.02 0.00 0.00 35.03 34.23 3m12 n LYS 234 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3m12 n TYR 235 N -2.54 0.19 -2.55 2.13 4.02 -0.17 -4.50 117.16 113.74 3m12 n TYR 235 Ca -0.07 -0.13 -0.38 0.00 -0.01 0.00 0.00 57.90 57.31 3m12 n TYR 235 Cb 0.58 -0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.85 3m12 n TYR 235 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 3m12 s SER 236 N -1.29 7.04 0.45 7.72 0.15 -1.17 -0.67 113.70 125.93 3m12 s SER 236 Ca 0.24 2.10 0.20 0.00 0.70 0.00 0.00 55.95 59.18 3m12 s SER 236 Cb 0.15 -2.60 1.17 0.00 -1.71 0.00 0.00 66.02 63.03 3m12 s SER 236 CO 0.22 -0.30 1.91 -1.13 1.20 0.00 0.00 173.24 175.14 3m12 h ASN 237 N 3.12 0.28 0.50 5.45 -1.24 -1.28 -2.07 115.58 120.34 3m12 h ASN 237 Ca -0.47 0.02 -0.03 0.00 0.71 0.00 0.00 56.30 56.53 3m12 h ASN 237 Cb 1.21 -0.03 -0.00 0.00 0.73 0.00 0.00 38.32 40.22 3m12 h ASN 237 CO 0.64 0.13 -0.15 0.44 -1.29 0.00 0.00 177.43 177.21 3m12 h ASP 238 N 0.30 0.00 -0.50 1.15 3.45 -1.91 -1.36 116.42 117.54 3m12 h ASP 238 Ca 0.39 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.85 3m12 h ASP 238 Cb 1.08 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.85 3m12 h ASP 238 CO -0.10 0.15 0.00 0.00 -1.57 0.00 0.00 179.24 177.72 3m12 n ILE 239 N -3.58 2.09 -1.87 0.35 0.13 -0.82 -4.96 119.36 110.70 3m12 n ILE 239 Ca -0.01 -1.41 -0.10 0.00 -1.10 0.00 0.00 62.75 60.13 3m12 n ILE 239 Cb 0.29 -0.03 -0.02 0.00 -0.84 0.00 0.00 39.64 39.04 3m12 n ILE 239 CO 0.00 0.00 0.00 0.47 2.80 0.00 0.00 176.55 179.82 3m12 n ASP 240 N 0.51 -3.67 -4.73 9.51 8.00 -0.51 -4.96 116.55 120.69 3m12 n ASP 240 Ca 0.24 0.08 -0.42 0.00 0.71 0.00 0.00 54.79 55.40 3m12 n ASP 240 Cb 0.92 -2.63 -0.03 0.00 -0.02 0.00 0.00 41.12 39.36 3m12 n ASP 240 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3m12 s PHE 241 N -2.46 3.07 0.48 1.24 2.19 -0.98 -4.99 117.98 116.52 3m12 s PHE 241 Ca 0.00 0.89 -0.01 0.00 0.33 0.00 0.00 56.93 58.14 3m12 s PHE 241 Cb 0.00 -3.83 -0.00 0.00 -1.31 0.00 0.00 43.02 37.87 3m12 s PHE 241 CO 0.00 -2.86 0.72 -1.25 1.83 0.00 0.00 175.22 173.66 3m12 s PRO 242 N 0.30 3.07 0.71 10.12 0.04 -1.26 -4.52 135.00 143.46 3m12 s PRO 242 Ca 0.63 -0.35 -0.13 0.00 0.04 0.00 0.00 61.00 61.19 3m12 s PRO 242 Cb -0.42 -2.49 0.03 0.00 0.04 0.00 0.00 34.50 31.66 3m12 s PRO 242 CO 0.38 -0.34 1.12 0.20 0.04 0.00 0.00 177.00 178.39 3m12 s GLY 243 N -4.22 2.01 -0.01 0.56 0.00 -0.75 -3.96 107.32 100.94 3m12 s GLY 243 Ca 0.49 0.50 -0.15 0.00 0.00 0.00 0.00 44.72 45.56 3m12 s GLY 243 CO 0.40 0.86 0.32 -0.11 0.00 0.00 0.00 173.10 174.57 3m12 s PHE 244 N -2.49 -0.19 -0.05 1.90 -0.71 -0.51 -0.51 117.98 115.41 3m12 s PHE 244 Ca 0.66 0.28 -0.02 0.00 -1.04 0.00 0.00 56.93 56.81 3m12 s PHE 244 Cb -0.20 0.11 0.04 0.00 -1.21 0.00 0.00 43.02 41.75 3m12 s PHE 244 CO 0.47 -0.40 0.09 1.41 -1.34 0.00 0.00 175.22 175.45 3m12 s MET 245 N -1.38 -0.04 0.06 1.99 1.75 -0.60 -1.15 119.30 119.93 3m12 s MET 245 Ca -0.13 0.44 0.03 0.00 -1.25 0.00 0.00 55.69 54.78 3m12 s MET 245 Cb -0.05 -0.43 -0.03 0.00 2.84 0.00 0.00 34.83 37.16 3m12 s MET 245 CO 0.04 -0.32 -0.10 0.14 -0.65 0.00 0.00 175.02 174.13 3m12 s VAL 246 N 2.21 0.78 -0.17 10.11 -7.23 0.34 -3.90 120.40 122.54 3m12 s VAL 246 Ca 0.04 -1.22 -0.01 0.00 -1.81 0.00 0.00 61.98 58.98 3m12 s VAL 246 Cb -0.12 -0.85 -0.01 0.00 0.56 0.00 0.00 36.38 35.96 3m12 s VAL 246 CO -0.04 -0.34 -0.11 -0.70 -0.31 0.00 0.00 175.10 173.60 3m12 s GLU 247 N -1.76 3.33 0.38 4.82 2.12 -0.51 -1.40 118.70 125.68 3m12 s GLU 247 Ca -0.06 -0.68 0.05 0.00 0.36 0.00 0.00 54.97 54.64 3m12 s GLU 247 Cb -0.09 -2.76 -0.06 0.00 0.26 0.00 0.00 34.13 31.47 3m12 s GLU 247 CO 0.01 0.00 0.04 0.14 -0.54 0.00 0.00 175.26 174.91 3m12 s VAL 248 N 0.89 1.49 0.45 3.70 -7.23 -0.06 -4.09 120.40 115.55 3m12 s VAL 248 Ca -0.03 -2.00 0.22 0.00 -1.81 0.00 0.00 61.98 58.36 3m12 s VAL 248 Cb -0.15 -2.81 0.41 0.00 0.56 0.00 0.00 36.38 34.39 3m12 s VAL 248 CO -0.00 0.00 1.85 -0.65 -0.31 0.00 0.00 175.10 175.99 3m12 h PRO 249 N 1.91 0.29 -0.66 4.82 0.11 -1.99 -1.03 132.00 135.44 3m12 h PRO 249 Ca -0.42 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3m12 h PRO 249 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3m12 h PRO 249 CO 0.74 0.19 0.00 0.09 -0.21 0.00 0.00 178.00 178.81 3m12 n ASN 250 N -4.47 4.14 0.00 -2.05 3.02 -1.26 -5.05 115.26 109.60 3m12 n ASN 250 Ca 0.20 -2.25 0.00 0.00 -0.03 0.00 0.00 54.58 52.50 3m12 n ASN 250 Cb 0.81 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 39.46 3m12 n ASN 250 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3m12 n GLY 251 N 1.28 0.90 3.46 7.41 0.00 -0.39 -5.00 105.19 112.85 3m12 n GLY 251 Ca 0.24 -1.95 -0.33 0.00 0.00 0.00 0.00 46.02 43.97 3m12 n GLY 251 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m12 s ILE 252 N -2.34 3.44 0.13 -0.61 1.01 -1.26 -0.88 121.20 120.69 3m12 s ILE 252 Ca 0.00 -0.54 0.09 0.00 0.00 0.00 0.00 60.65 60.20 3m12 s ILE 252 Cb 0.00 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.98 3m12 s ILE 252 CO 0.00 0.54 -0.22 -0.31 0.00 0.00 0.00 174.94 174.95 3m12 s TYR 253 N 0.02 1.94 0.09 3.97 2.02 -0.49 -0.10 117.35 124.80 3m12 s TYR 253 Ca -0.02 -0.42 0.02 0.00 -0.37 0.00 0.00 57.07 56.29 3m12 s TYR 253 Cb -0.14 -1.03 -0.04 0.00 -0.40 0.00 0.00 41.96 40.35 3m12 s TYR 253 CO 0.04 0.28 -0.08 1.52 -1.57 0.00 0.00 175.55 175.74 3m12 s TYR 254 N -1.37 0.89 0.19 2.71 1.13 -0.54 -0.50 117.35 119.86 3m12 s TYR 254 Ca 0.11 -0.75 -0.22 0.00 -1.41 0.00 0.00 57.07 54.80 3m12 s TYR 254 Cb -0.09 -0.51 0.08 0.00 -1.10 0.00 0.00 41.96 40.34 3m12 s TYR 254 CO 0.06 -0.09 1.04 0.20 -2.51 0.00 0.00 175.55 174.24 3m12 s GLY 255 N -2.57 0.14 0.01 5.49 0.00 -0.30 -0.75 107.32 109.34 3m12 s GLY 255 Ca 0.05 -0.37 0.01 0.00 0.00 0.00 0.00 44.72 44.41 3m12 s GLY 255 CO -0.02 2.59 -0.05 -1.36 0.00 0.00 0.00 173.10 174.25 3m12 s PHE 256 N -2.12 0.45 0.89 1.90 0.08 -0.43 -1.43 117.98 117.32 3m12 s PHE 256 Ca 0.22 -0.24 -0.11 0.00 0.12 0.00 0.00 56.93 56.92 3m12 s PHE 256 Cb -0.03 -0.28 0.13 0.00 -0.57 0.00 0.00 43.02 42.27 3m12 s PHE 256 CO 0.06 -0.05 1.10 -1.25 -0.10 0.00 0.00 175.22 174.98 3m12 s PRO 257 N -0.68 1.28 0.06 0.24 0.04 -1.25 -2.87 135.00 131.82 3m12 s PRO 257 Ca -0.04 1.20 -0.31 0.00 0.04 0.00 0.00 61.00 61.90 3m12 s PRO 257 Cb -0.05 -1.78 -0.07 0.00 0.04 0.00 0.00 34.50 32.64 3m12 s PRO 257 CO -0.00 -2.34 1.38 0.45 0.04 0.00 0.00 177.00 176.53 3m12 s SER 258 N -3.05 6.86 -0.23 6.66 0.15 0.15 -4.68 113.70 119.56 3m12 s SER 258 Ca 0.64 2.21 -0.06 0.00 0.70 0.00 0.00 55.95 59.44 3m12 s SER 258 Cb -0.20 -2.57 -0.03 0.00 -1.71 0.00 0.00 66.02 61.51 3m12 s SER 258 CO 0.58 -0.66 0.04 -0.36 1.20 0.00 0.00 173.24 174.03 3m12 s PHE 259 N 1.65 3.07 -1.58 3.44 0.40 -1.26 -0.96 117.98 122.74 3m12 s PHE 259 Ca 0.64 -0.43 0.00 0.00 -0.60 0.00 0.00 56.93 56.53 3m12 s PHE 259 Cb -0.34 -2.17 0.00 0.00 0.51 0.00 0.00 43.02 41.03 3m12 s PHE 259 CO 0.29 -0.29 0.00 0.41 0.70 0.00 0.00 175.22 176.32 3m12 n GLY 260 N 4.58 -0.43 2.12 4.36 0.00 -1.26 -1.53 105.19 113.03 3m12 n GLY 260 Ca -0.17 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.81 3m12 n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m12 n GLY 261 N -0.93 0.61 0.22 -0.02 0.00 -1.26 -4.95 105.19 98.86 3m12 n GLY 261 Ca -0.22 -0.84 0.09 0.00 0.00 0.00 0.00 46.02 45.06 3m12 n GLY 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m12 n GLY 263 N 0.03 2.33 3.75 0.00 0.00 -1.26 -4.80 105.19 105.24 3m12 n GLY 263 Ca -0.00 -1.89 -0.40 0.00 0.00 0.00 0.00 46.02 43.73 3m12 n GLY 263 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3m12 s LEU 264 N 0.00 4.59 -0.14 0.99 0.20 -0.63 -4.06 118.68 119.63 3m12 s LEU 264 Ca 0.00 2.02 -0.03 0.00 0.69 0.00 0.00 54.13 56.81 3m12 s LEU 264 Cb 0.00 -3.61 -0.03 0.00 -0.43 0.00 0.00 46.19 42.12 3m12 s LEU 264 CO 0.00 0.01 -0.02 -0.60 -0.29 0.00 0.00 176.35 175.45 3m12 s ARG 265 N -1.00 3.47 -0.01 1.98 3.52 -1.14 -0.64 118.95 125.14 3m12 s ARG 265 Ca 0.44 -0.48 0.01 0.00 -0.13 0.00 0.00 55.73 55.56 3m12 s ARG 265 Cb -0.28 -2.89 0.00 0.00 -1.56 0.00 0.00 34.95 30.23 3m12 s ARG 265 CO 0.34 0.38 -0.03 -1.17 -0.81 0.00 0.00 175.30 174.01 3m12 s LEU 266 N -0.01 1.90 0.10 -0.88 2.96 -0.41 -1.32 118.68 121.02 3m12 s LEU 266 Ca 0.02 -0.07 0.04 0.00 -0.22 0.00 0.00 54.13 53.90 3m12 s LEU 266 Cb -0.13 -0.21 -0.03 0.00 0.50 0.00 0.00 46.19 46.32 3m12 s LEU 266 CO 0.02 0.03 -0.11 -0.83 -1.32 0.00 0.00 176.35 174.14 3m12 s GLY 267 N 0.05 0.89 -0.28 7.98 0.00 0.07 -1.21 107.32 114.82 3m12 s GLY 267 Ca -0.00 -1.17 -0.10 0.00 0.00 0.00 0.00 44.72 43.45 3m12 s GLY 267 CO -0.00 -1.23 0.15 -0.47 0.00 0.00 0.00 173.10 171.54 3m12 s TYR 268 N -2.16 3.17 -0.07 1.90 5.04 -1.26 -1.46 117.35 122.50 3m12 s TYR 268 Ca 0.04 -0.16 -0.10 0.00 -2.44 0.00 0.00 57.07 54.42 3m12 s TYR 268 Cb -0.05 -2.33 -0.29 0.00 0.35 0.00 0.00 41.96 39.64 3m12 s TYR 268 CO 0.01 -0.27 0.58 1.25 -1.34 0.00 0.00 175.55 175.78 3m12 h HIS 269 N 8.33 0.66 -0.00 4.97 -0.00 -0.87 -3.39 115.15 124.85 3m12 h HIS 269 Ca -0.36 -0.48 0.00 0.00 -0.00 0.00 0.00 60.37 59.53 3m12 h HIS 269 Cb 1.18 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 28.56 3m12 h HIS 269 CO 0.71 1.71 -0.22 0.25 -0.00 0.00 0.00 177.93 180.38 3m12 n THR 270 N -3.56 0.00 -4.68 6.26 -2.24 -1.23 -4.77 114.28 104.06 3m12 n THR 270 Ca -0.27 -0.03 -0.23 0.00 -2.27 0.00 0.00 64.05 61.24 3m12 n THR 270 Cb 1.07 -0.03 -0.15 0.00 -2.10 0.00 0.00 70.33 69.13 3m12 n THR 270 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3m12 s PHE 271 N -2.76 1.45 0.15 4.78 5.36 -1.26 -5.02 117.98 120.66 3m12 s PHE 271 Ca 0.19 -0.30 -0.24 0.00 -0.96 0.00 0.00 56.93 55.62 3m12 s PHE 271 Cb 0.19 -0.91 0.07 0.00 -0.34 0.00 0.00 43.02 42.02 3m12 s PHE 271 CO 0.56 0.00 0.73 0.20 -1.46 0.00 0.00 175.22 175.26 3m12 s GLY 272 N -0.60 -0.43 0.11 13.12 0.00 -1.26 -4.88 107.32 113.38 3m12 s GLY 272 Ca 0.06 0.40 -0.30 0.00 0.00 0.00 0.00 44.72 44.88 3m12 s GLY 272 CO -0.00 0.13 1.02 1.20 0.00 0.00 0.00 173.10 175.45 3m12 s GLN 273 N -3.58 4.63 0.02 2.90 1.11 -1.10 -4.76 119.66 118.87 3m12 s GLN 273 Ca 0.05 1.55 -0.30 0.00 0.01 0.00 0.00 55.36 56.67 3m12 s GLN 273 Cb -0.02 -3.36 -0.07 0.00 -1.01 0.00 0.00 33.01 28.55 3m12 s GLN 273 CO -0.06 0.09 1.51 0.15 0.01 0.00 0.00 175.29 176.99 3m12 s LYS 274 N 0.15 4.25 0.28 2.91 1.02 -1.26 -0.03 119.74 127.05 3m12 s LYS 274 Ca 0.49 2.11 0.03 0.00 0.02 0.00 0.00 55.97 58.63 3m12 s LYS 274 Cb -0.25 -3.60 -0.04 0.00 -0.52 0.00 0.00 37.83 33.42 3m12 s LYS 274 CO 0.31 -0.65 0.19 0.96 -0.92 0.00 0.00 175.35 175.24 3m12 s ILE 275 N 2.56 0.12 -0.13 2.17 -5.25 -0.84 -4.91 121.20 114.92 3m12 s ILE 275 Ca 0.68 -2.00 -0.02 0.00 -0.99 0.00 0.00 60.65 58.32 3m12 s ILE 275 Cb -0.35 -2.50 -0.03 0.00 2.95 0.00 0.00 42.46 42.54 3m12 s ILE 275 CO 0.29 0.00 -0.06 -0.62 -1.79 0.00 0.00 174.94 172.76 3m12 s ASP 276 N -3.31 4.63 0.28 4.36 2.15 -1.26 -4.40 116.67 119.12 3m12 s ASP 276 Ca 0.38 -0.13 0.22 0.00 0.43 0.00 0.00 52.55 53.45 3m12 s ASP 276 Cb 0.05 -1.59 1.04 0.00 -0.30 0.00 0.00 42.92 42.12 3m12 s ASP 276 CO 0.19 0.22 1.66 -0.81 -0.17 0.00 0.00 175.17 176.26 3m12 n PRO 277 N 3.17 0.16 0.01 4.34 -0.04 -1.26 -0.90 135.00 140.48 3m12 n PRO 277 Ca -0.18 0.53 0.11 0.00 -0.04 0.00 0.00 63.50 63.93 3m12 n PRO 277 Cb 0.53 -1.90 0.13 0.00 -0.04 0.00 0.00 33.50 32.22 3m12 n PRO 277 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3m12 n ASP 278 N -2.22 0.63 0.00 3.54 10.43 -1.26 -4.37 116.55 123.31 3m12 n ASP 278 Ca 0.00 -0.36 0.00 0.00 2.57 0.00 0.00 54.79 57.01 3m12 n ASP 278 Cb 0.13 0.50 0.00 0.00 1.84 0.00 0.00 41.12 43.58 3m12 n ASP 278 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 3m12 n THR 279 N -1.64 0.03 -1.66 -3.53 -2.24 -0.64 -5.08 114.28 99.52 3m12 n THR 279 Ca 0.04 -0.30 -0.44 0.00 -2.27 0.00 0.00 64.05 61.08 3m12 n THR 279 Cb 0.36 1.39 -0.02 0.00 -2.10 0.00 0.00 70.33 69.96 3m12 n THR 279 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3m12 n ILE 280 N -0.01 1.41 -2.76 2.28 3.06 -0.08 -4.92 119.36 118.34 3m12 n ILE 280 Ca 0.00 -0.35 -0.43 0.00 -2.50 0.00 0.00 62.75 59.47 3m12 n ILE 280 Cb 0.12 -1.40 -0.03 0.00 0.54 0.00 0.00 39.64 38.86 3m12 n ILE 280 CO 0.00 0.00 0.00 0.21 -2.50 0.00 0.00 176.55 174.26 3m12 s ASN 281 N -0.03 6.57 -0.10 9.51 3.04 -1.26 -4.92 114.94 127.75 3m12 s ASN 281 Ca 0.63 0.30 0.13 0.00 0.04 0.00 0.00 52.86 53.96 3m12 s ASN 281 Cb -0.64 -2.48 0.57 0.00 -1.54 0.00 0.00 41.25 37.15 3m12 s ASN 281 CO 0.55 -1.07 1.43 0.54 -3.04 0.00 0.00 177.10 175.51 3m12 n ARG 282 N 7.27 3.23 -3.34 0.43 1.74 -1.26 -4.85 116.66 119.88 3m12 n ARG 282 Ca 0.08 -2.22 -0.38 0.00 -0.77 0.00 0.00 57.85 54.56 3m12 n ARG 282 Cb 0.49 -1.80 -0.07 0.00 -1.02 0.00 0.00 32.46 30.06 3m12 n ARG 282 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 3m12 s GLU 283 N -1.86 4.25 0.05 5.56 2.12 -1.26 -4.49 118.70 123.07 3m12 s GLU 283 Ca 0.40 0.33 -0.31 0.00 0.36 0.00 0.00 54.97 55.75 3m12 s GLU 283 Cb 0.26 -3.50 -0.06 0.00 0.26 0.00 0.00 34.13 31.10 3m12 s GLU 283 CO 0.18 0.03 1.20 0.12 -0.54 0.00 0.00 175.26 176.25 3m12 s PHE 284 N 1.06 3.42 0.00 5.30 2.19 -1.26 -3.71 117.98 124.98 3m12 s PHE 284 Ca 0.22 1.29 0.00 0.00 0.33 0.00 0.00 56.93 58.78 3m12 s PHE 284 Cb -0.15 -3.42 0.00 0.00 -1.31 0.00 0.00 43.02 38.14 3m12 s PHE 284 CO 0.09 -1.29 0.00 0.41 1.83 0.00 0.00 175.22 176.26 3m12 n GLY 285 N 3.23 0.58 0.25 13.12 0.00 -1.26 -4.95 105.19 116.16 3m12 n GLY 285 Ca 0.09 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.25 3m12 n GLY 285 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3m12 h VAL 286 N 0.00 0.29 -3.98 1.61 -1.51 -1.98 -3.41 116.25 107.28 3m12 h VAL 286 Ca 0.00 -0.81 -0.69 0.00 -1.23 0.00 0.00 66.70 63.97 3m12 h VAL 286 Cb 0.00 1.64 -0.22 0.00 -2.13 0.00 0.00 31.29 30.57 3m12 h VAL 286 CO 0.00 0.11 -0.77 -0.31 -1.23 0.00 0.00 177.57 175.37 3m12 s TYR 287 N -3.67 2.71 0.52 5.19 2.02 -1.26 -5.03 117.35 117.82 3m12 s TYR 287 Ca 0.01 -0.15 0.17 0.00 -0.37 0.00 0.00 57.07 56.73 3m12 s TYR 287 Cb 0.10 -1.61 1.28 0.00 -0.40 0.00 0.00 41.96 41.33 3m12 s TYR 287 CO 0.59 0.22 2.12 -1.00 -1.57 0.00 0.00 175.55 175.91 3m12 h PRO 288 N 5.15 0.02 -0.41 -1.71 0.13 -2.04 -2.07 132.00 131.06 3m12 h PRO 288 Ca -0.47 -0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.72 3m12 h PRO 288 Cb 1.15 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.26 3m12 h PRO 288 CO 0.50 0.01 0.28 0.93 -0.23 0.00 0.00 178.00 179.49 3m12 h GLU 289 N 0.02 0.31 -0.22 0.86 3.07 -1.95 -2.48 114.58 114.18 3m12 h GLU 289 Ca 0.05 -0.02 0.06 0.00 -0.50 0.00 0.00 59.36 58.95 3m12 h GLU 289 Cb 0.19 -0.07 -0.07 0.00 -0.84 0.00 0.00 28.75 27.96 3m12 h GLU 289 CO -0.00 0.20 -0.32 -0.44 -1.40 0.00 0.00 179.01 177.05 3m12 h ASP 290 N 0.31 -1.00 0.16 1.42 3.45 -1.74 -1.93 116.42 117.09 3m12 h ASP 290 Ca 0.18 0.16 -0.36 0.00 0.43 0.00 0.00 57.03 57.44 3m12 h ASP 290 Cb 0.32 0.44 -0.02 0.00 -0.56 0.00 0.00 39.33 39.51 3m12 h ASP 290 CO -0.04 -0.34 -1.99 1.21 -1.57 0.00 0.00 179.24 176.51 3m12 n GLU 291 N -5.41 0.74 -0.12 3.56 2.13 -1.21 -4.27 120.64 116.06 3m12 n GLU 291 Ca -0.02 0.26 -0.09 0.00 0.66 0.00 0.00 57.16 57.97 3m12 n GLU 291 Cb 0.33 -1.71 0.06 0.00 0.27 0.00 0.00 31.44 30.39 3m12 n GLU 291 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 3m12 h SER 292 N 0.06 0.88 -0.38 4.31 4.64 -1.43 -1.64 113.55 120.00 3m12 h SER 292 Ca -0.42 -0.31 -0.02 0.00 -0.47 0.00 0.00 61.79 60.57 3m12 h SER 292 Cb 2.03 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 63.86 3m12 h SER 292 CO 0.08 1.05 0.18 0.78 -0.87 0.00 0.00 176.83 178.05 3m12 h ASN 293 N 0.75 0.54 -0.02 4.97 -0.26 -1.56 -1.32 115.58 118.68 3m12 h ASN 293 Ca 0.11 -0.05 -0.10 0.00 -0.56 0.00 0.00 56.30 55.69 3m12 h ASN 293 Cb 0.73 -0.14 0.01 0.00 -1.06 0.00 0.00 38.32 37.87 3m12 h ASN 293 CO 0.06 0.48 -0.39 -0.07 -1.06 0.00 0.00 177.43 176.45 3m12 h LEU 294 N 0.60 0.38 -1.43 1.61 3.38 -1.67 -3.20 115.31 114.97 3m12 h LEU 294 Ca 0.15 -0.74 -0.04 0.00 0.09 0.00 0.00 57.88 57.34 3m12 h LEU 294 Cb 0.11 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3m12 h LEU 294 CO -0.02 1.06 -0.07 0.03 0.09 0.00 0.00 178.44 179.53 3m12 h ARG 295 N -0.27 0.29 -0.55 1.13 3.08 -1.17 -1.32 114.38 115.55 3m12 h ARG 295 Ca -0.04 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 3m12 h ARG 295 Cb 1.10 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 31.08 3m12 h ARG 295 CO 0.08 0.38 0.25 0.00 -1.07 0.00 0.00 179.97 179.61 3m12 h ALA 296 N 1.65 1.41 0.04 0.04 0.00 -1.30 -0.49 119.26 120.62 3m12 h ALA 296 Ca 0.06 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 3m12 h ALA 296 Cb 0.31 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3m12 h ALA 296 CO 0.01 0.46 -0.02 0.35 0.00 0.00 0.00 179.25 180.06 3m12 h PHE 297 N 0.78 -0.05 -0.32 0.00 3.57 -1.39 -3.30 116.94 116.22 3m12 h PHE 297 Ca 0.19 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.69 3m12 h PHE 297 Cb 0.10 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 3m12 h PHE 297 CO 0.01 0.50 0.19 -0.07 -2.23 0.00 0.00 178.31 176.70 3m12 h LEU 298 N -0.63 0.39 -2.13 0.59 3.38 -0.96 -0.51 115.31 115.45 3m12 h LEU 298 Ca -0.01 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3m12 h LEU 298 Cb 0.57 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 3m12 h LEU 298 CO 0.01 0.35 -0.02 1.05 0.09 0.00 0.00 178.44 179.91 3m12 h GLU 299 N 0.41 0.00 0.10 1.13 4.11 -1.25 0.72 114.58 119.79 3m12 h GLU 299 Ca 0.11 0.00 -0.29 0.00 0.07 0.00 0.00 59.36 59.25 3m12 h GLU 299 Cb 0.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 3m12 h GLU 299 CO -0.02 0.02 -1.52 1.49 0.07 0.00 0.00 179.01 179.06 3m12 h GLU 300 N 0.00 0.21 0.00 1.06 4.57 -1.54 -3.41 114.58 115.47 3m12 h GLU 300 Ca -0.00 -0.36 -0.10 0.00 -1.18 0.00 0.00 59.36 57.72 3m12 h GLU 300 Cb 0.05 0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.76 3m12 h GLU 300 CO 0.00 1.17 -1.58 0.66 -1.18 0.00 0.00 179.01 178.09 3m12 n TYR 301 N -3.90 0.00 -3.18 0.92 4.01 -0.23 -4.71 117.16 110.07 3m12 n TYR 301 Ca -0.27 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.26 3m12 n TYR 301 Cb 0.90 -0.37 -0.05 0.00 -0.31 0.00 0.00 39.34 39.51 3m12 n TYR 301 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 3m12 n MET 302 N -2.14 0.85 0.02 -0.72 2.81 0.17 -0.40 117.12 117.70 3m12 n MET 302 Ca -0.10 -3.26 0.04 0.00 -1.81 0.00 0.00 57.70 52.58 3m12 n MET 302 Cb 0.58 -1.46 0.43 0.00 -0.71 0.00 0.00 33.22 32.05 3m12 n MET 302 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 3m12 h PRO 303 N 3.49 0.49 0.00 0.03 0.13 -1.52 -1.21 132.00 133.41 3m12 h PRO 303 Ca 0.08 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 3m12 h PRO 303 Cb 0.93 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3m12 h PRO 303 CO 0.47 0.35 0.00 0.41 -0.23 0.00 0.00 178.00 179.00 3m12 n GLY 304 N -1.41 -1.11 1.00 1.56 0.00 -1.26 -2.53 105.19 101.44 3m12 n GLY 304 Ca 0.02 -0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.11 3m12 n GLY 304 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m12 n ALA 305 N -1.54 2.41 -1.08 4.61 0.00 -0.46 -1.72 120.51 122.74 3m12 n ALA 305 Ca 0.04 -0.91 -0.19 0.00 0.00 0.00 0.00 53.44 52.37 3m12 n ALA 305 Cb 0.20 -0.76 -0.00 0.00 0.00 0.00 0.00 19.45 18.89 3m12 n ALA 305 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3m12 n ASN 306 N 1.29 6.39 -1.70 0.00 4.05 -1.05 -4.62 115.26 119.62 3m12 n ASN 306 Ca 0.16 -3.07 0.00 0.00 0.45 0.00 0.00 54.58 52.13 3m12 n ASN 306 Cb 0.55 -1.13 0.00 0.00 1.23 0.00 0.00 39.78 40.43 3m12 n ASN 306 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3m12 n GLY 307 N 0.64 0.57 3.70 8.20 0.00 -0.99 -5.01 105.19 112.30 3m12 n GLY 307 Ca 0.36 -1.78 -0.43 0.00 0.00 0.00 0.00 46.02 44.16 3m12 n GLY 307 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3m12 n GLU 308 N 0.00 2.23 -2.27 1.61 1.02 -1.26 -4.52 120.64 117.45 3m12 n GLU 308 Ca 0.00 0.79 -0.43 0.00 -0.02 0.00 0.00 57.16 57.51 3m12 n GLU 308 Cb 0.00 -2.46 -0.02 0.00 -0.02 0.00 0.00 31.44 28.93 3m12 n GLU 308 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3m12 s LEU 309 N -0.35 4.13 -0.14 -4.62 2.96 -1.26 -0.78 118.68 118.62 3m12 s LEU 309 Ca 0.64 1.75 -0.25 0.00 -0.22 0.00 0.00 54.13 56.05 3m12 s LEU 309 Cb -0.59 -3.54 -0.25 0.00 0.50 0.00 0.00 46.19 42.31 3m12 s LEU 309 CO 0.53 -0.92 0.64 0.11 -1.32 0.00 0.00 176.35 175.39 3m12 h LYS 310 N 9.06 0.07 -2.30 1.98 1.57 -1.33 -3.48 116.57 122.14 3m12 h LYS 310 Ca -0.31 -0.13 0.22 0.00 -1.87 0.00 0.00 60.65 58.56 3m12 h LYS 310 Cb 1.13 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 33.43 3m12 h LYS 310 CO 0.98 1.06 0.65 -0.98 -0.57 0.00 0.00 179.45 180.59 3m12 s ARG 311 N -2.31 1.03 0.15 3.15 1.70 -1.23 -5.04 118.95 116.39 3m12 s ARG 311 Ca -0.20 -0.64 -0.03 0.00 -0.47 0.00 0.00 55.73 54.39 3m12 s ARG 311 Cb 0.00 0.30 -0.03 0.00 -0.57 0.00 0.00 34.95 34.65 3m12 s ARG 311 CO 0.70 -0.48 0.13 0.20 -1.08 0.00 0.00 175.30 174.77 3m12 s GLY 312 N -3.34 0.97 0.11 3.88 0.00 -1.26 -1.16 107.32 106.51 3m12 s GLY 312 Ca 0.20 -1.39 0.09 0.00 0.00 0.00 0.00 44.72 43.62 3m12 s GLY 312 CO 0.03 -1.25 -0.22 0.00 0.00 0.00 0.00 173.10 171.66 3m12 s ALA 313 N -4.05 1.88 -0.23 3.20 0.00 0.12 -4.74 121.76 117.93 3m12 s ALA 313 Ca 0.26 -1.27 0.01 0.00 0.00 0.00 0.00 51.96 50.95 3m12 s ALA 313 Cb 0.06 -0.26 0.04 0.00 0.00 0.00 0.00 23.12 22.96 3m12 s ALA 313 CO 0.04 0.38 -0.13 0.08 0.00 0.00 0.00 175.76 176.13 3m12 s VAL 314 N -1.15 2.29 0.38 0.00 1.01 -1.26 -1.52 120.40 120.15 3m12 s VAL 314 Ca 0.07 -1.24 0.04 0.00 0.00 0.00 0.00 61.98 60.86 3m12 s VAL 314 Cb -0.10 -2.16 -0.06 0.00 0.00 0.00 0.00 36.38 34.06 3m12 s VAL 314 CO 0.04 0.24 0.05 0.00 0.00 0.00 0.00 175.10 175.43 3m12 s MET 316 N -3.82 1.41 0.16 0.00 -1.94 -1.21 -0.18 119.30 113.73 3m12 s MET 316 Ca 0.30 -0.58 0.02 0.00 -1.71 0.00 0.00 55.69 53.73 3m12 s MET 316 Cb 0.07 -1.33 -0.04 0.00 2.01 0.00 0.00 34.83 35.55 3m12 s MET 316 CO 0.14 0.32 0.30 0.71 -0.01 0.00 0.00 175.02 176.49 3m12 s TYR 317 N -0.28 3.48 -0.24 -0.03 2.02 -0.56 -4.53 117.35 117.21 3m12 s TYR 317 Ca 0.04 0.14 0.01 0.00 -0.37 0.00 0.00 57.07 56.88 3m12 s TYR 317 Cb -0.07 -1.68 0.06 0.00 -0.40 0.00 0.00 41.96 39.87 3m12 s TYR 317 CO -0.00 0.49 -0.05 0.99 -1.57 0.00 0.00 175.55 175.41 3m12 s THR 318 N -1.78 1.58 -0.14 -0.71 2.01 -1.26 -0.36 115.64 114.98 3m12 s THR 318 Ca 0.35 -1.30 -0.09 0.00 0.31 0.00 0.00 61.69 60.95 3m12 s THR 318 Cb -0.11 -1.86 -0.05 0.00 0.01 0.00 0.00 72.50 70.50 3m12 s THR 318 CO 0.29 -0.14 0.18 -0.54 -0.69 0.00 0.00 174.62 173.72 3m12 s LYS 319 N 1.36 3.79 0.59 4.92 1.02 0.20 -0.48 119.74 131.13 3m12 s LYS 319 Ca -0.05 -0.08 -0.04 0.00 0.02 0.00 0.00 55.97 55.82 3m12 s LYS 319 Cb -0.19 -3.28 0.02 0.00 -0.52 0.00 0.00 37.83 33.86 3m12 s LYS 319 CO -0.07 0.58 0.88 0.95 -0.92 0.00 0.00 175.35 176.76 3m12 s THR 320 N -0.48 3.38 0.44 2.17 -4.23 -1.26 -1.56 115.64 114.11 3m12 s THR 320 Ca 0.14 -0.17 0.13 0.00 -1.18 0.00 0.00 61.69 60.60 3m12 s THR 320 Cb -0.12 -3.34 0.21 0.00 1.34 0.00 0.00 72.50 70.59 3m12 s THR 320 CO 0.03 -0.33 2.02 -0.07 -0.54 0.00 0.00 174.62 175.73 3m12 h LEU 321 N -0.14 0.12 -1.73 4.79 3.38 -1.81 -2.68 115.31 117.23 3m12 h LEU 321 Ca -0.45 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.50 3m12 h LEU 321 Cb 1.27 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.99 3m12 h LEU 321 CO 0.59 0.21 -0.03 -0.90 0.09 0.00 0.00 178.44 178.40 3m12 n ASP 322 N -4.38 2.66 -0.88 -0.43 5.68 -1.26 -4.97 116.55 112.96 3m12 n ASP 322 Ca -0.01 -1.83 -0.11 0.00 -0.50 0.00 0.00 54.79 52.33 3m12 n ASP 322 Cb 0.19 0.04 -0.05 0.00 -1.14 0.00 0.00 41.12 40.16 3m12 n ASP 322 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3m12 n GLU 323 N 1.07 -1.39 -3.77 0.11 1.02 -1.01 -5.00 120.64 111.67 3m12 n GLU 323 Ca 0.12 0.88 -0.27 0.00 -0.02 0.00 0.00 57.16 57.87 3m12 n GLU 323 Cb 0.51 -5.13 -0.03 0.00 -0.02 0.00 0.00 31.44 26.77 3m12 n GLU 323 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3m12 s HIS 324 N -2.13 3.48 0.86 -0.32 3.76 -1.26 -4.79 115.29 114.90 3m12 s HIS 324 Ca 0.00 0.27 -0.11 0.00 -0.15 0.00 0.00 55.06 55.06 3m12 s HIS 324 Cb 0.00 -1.79 0.11 0.00 1.11 0.00 0.00 32.58 32.01 3m12 s HIS 324 CO 0.00 0.42 1.09 -0.06 -0.85 0.00 0.00 174.74 175.34 3m12 s PHE 325 N -1.84 2.46 -0.28 1.40 0.08 -1.26 -4.68 117.98 113.87 3m12 s PHE 325 Ca 0.37 1.24 -0.04 0.00 0.12 0.00 0.00 56.93 58.63 3m12 s PHE 325 Cb -0.11 -3.15 0.03 0.00 -0.57 0.00 0.00 43.02 39.22 3m12 s PHE 325 CO 0.29 -2.20 0.01 0.42 -0.10 0.00 0.00 175.22 173.64 3m12 s ILE 326 N -2.99 3.31 -0.24 0.64 1.01 0.26 -4.36 121.20 118.83 3m12 s ILE 326 Ca 0.63 -1.00 -0.03 0.00 0.00 0.00 0.00 60.65 60.24 3m12 s ILE 326 Cb -0.17 -2.75 0.08 0.00 0.01 0.00 0.00 42.46 39.63 3m12 s ILE 326 CO 0.56 0.07 0.09 -0.63 0.00 0.00 0.00 174.94 175.03 3m12 s ILE 327 N 1.37 0.31 0.06 2.92 1.01 -0.62 -1.13 121.20 125.12 3m12 s ILE 327 Ca -0.00 -0.71 -0.28 0.00 0.00 0.00 0.00 60.65 59.66 3m12 s ILE 327 Cb -0.18 -1.06 0.09 0.00 0.01 0.00 0.00 42.46 41.33 3m12 s ILE 327 CO -0.01 -0.47 1.04 -0.62 0.00 0.00 0.00 174.94 174.89 3m12 s ASP 328 N 1.93 -0.18 0.53 3.58 3.68 -0.89 -4.52 116.67 120.81 3m12 s ASP 328 Ca 0.05 -0.25 -0.18 0.00 2.13 0.00 0.00 52.55 54.30 3m12 s ASP 328 Cb -0.17 0.37 -0.07 0.00 -1.45 0.00 0.00 42.92 41.61 3m12 s ASP 328 CO -0.20 -0.67 1.04 -0.76 0.13 0.00 0.00 175.17 174.72 3m12 s LEU 329 N -2.83 3.71 0.21 -1.34 1.43 -1.26 -0.44 118.68 118.16 3m12 s LEU 329 Ca 0.11 1.88 -0.32 0.00 -1.03 0.00 0.00 54.13 54.77 3m12 s LEU 329 Cb 0.00 -4.55 -0.12 0.00 0.03 0.00 0.00 46.19 41.56 3m12 s LEU 329 CO -0.02 -0.92 1.71 -2.28 0.23 0.00 0.00 176.35 175.07 3m12 s HIS 330 N -2.17 2.91 0.65 0.29 5.65 0.22 -4.82 115.29 118.02 3m12 s HIS 330 Ca 0.66 0.38 0.41 0.00 0.25 0.00 0.00 55.06 56.76 3m12 s HIS 330 Cb -0.16 -4.12 2.25 0.00 -1.18 0.00 0.00 32.58 29.37 3m12 s HIS 330 CO 0.27 -4.22 2.31 -1.00 -0.65 0.00 0.00 174.74 171.45 3m12 h PRO 331 N 6.71 0.00 0.00 2.88 0.13 -1.95 -2.22 132.00 137.56 3m12 h PRO 331 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3m12 h PRO 331 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3m12 h PRO 331 CO 0.95 0.00 -1.57 0.39 -0.23 0.00 0.00 178.00 177.53 3m12 n GLU 332 N -3.23 0.73 -3.66 0.86 1.02 -1.26 -4.91 120.64 110.19 3m12 n GLU 332 Ca -0.03 -0.12 -0.29 0.00 -0.02 0.00 0.00 57.16 56.70 3m12 n GLU 332 Cb 0.10 -1.39 -0.15 0.00 -0.02 0.00 0.00 31.44 29.98 3m12 n GLU 332 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3m12 s HIS 333 N -3.08 1.03 -0.17 -0.32 3.76 -0.83 -4.99 115.29 110.68 3m12 s HIS 333 Ca -0.03 -1.20 0.27 0.00 -0.15 0.00 0.00 55.06 53.94 3m12 s HIS 333 Cb 0.12 -1.25 1.27 0.00 1.11 0.00 0.00 32.58 33.82 3m12 s HIS 333 CO 0.72 -0.79 1.81 0.66 -0.85 0.00 0.00 174.74 176.29 3m12 h SER 334 N 8.24 0.00 -0.44 1.40 4.64 -1.91 -1.91 113.55 123.57 3m12 h SER 334 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 3m12 h SER 334 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 3m12 h SER 334 CO 0.42 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.92 3m12 n ASN 335 N -2.46 2.40 -4.06 4.97 6.94 -1.26 -4.81 115.26 116.99 3m12 n ASN 335 Ca 0.00 -2.01 -0.29 0.00 -0.02 0.00 0.00 54.58 52.25 3m12 n ASN 335 Cb 0.15 -0.30 -0.17 0.00 -2.36 0.00 0.00 39.78 37.10 3m12 n ASN 335 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3m12 s VAL 336 N -1.42 1.59 -0.12 3.53 1.01 -0.72 -1.10 120.40 123.17 3m12 s VAL 336 Ca 0.30 -0.68 -0.02 0.00 0.00 0.00 0.00 61.98 61.58 3m12 s VAL 336 Cb 0.16 -1.45 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 3m12 s VAL 336 CO 0.20 0.46 -0.05 -0.69 0.00 0.00 0.00 175.10 175.02 3m12 s VAL 337 N 1.09 3.86 -0.12 2.92 1.01 0.64 -0.61 120.40 129.19 3m12 s VAL 337 Ca -0.04 -0.39 -0.00 0.00 0.00 0.00 0.00 61.98 61.55 3m12 s VAL 337 Cb -0.14 -2.64 -0.02 0.00 0.00 0.00 0.00 36.38 33.58 3m12 s VAL 337 CO -0.04 0.54 -0.13 -0.63 0.00 0.00 0.00 175.10 174.85 3m12 s ILE 338 N -0.19 3.11 -0.23 2.22 -1.09 0.42 -0.10 121.20 125.34 3m12 s ILE 338 Ca 0.03 -0.65 -0.01 0.00 -2.23 0.00 0.00 60.65 57.80 3m12 s ILE 338 Cb -0.13 -2.30 0.07 0.00 -1.58 0.00 0.00 42.46 38.52 3m12 s ILE 338 CO 0.02 0.53 0.00 0.00 -1.23 0.00 0.00 174.94 174.27 3m12 s ALA 339 N 0.23 1.54 0.14 9.38 0.00 -0.33 -2.09 121.76 130.64 3m12 s ALA 339 Ca -0.08 -1.15 -0.14 0.00 0.00 0.00 0.00 51.96 50.59 3m12 s ALA 339 Cb -0.15 -1.36 0.02 0.00 0.00 0.00 0.00 23.12 21.62 3m12 s ALA 339 CO 0.05 -1.25 0.37 0.00 0.00 0.00 0.00 175.76 174.93 3m12 s ALA 340 N 1.60 -0.63 -0.86 0.00 0.00 -0.29 -4.33 121.76 117.26 3m12 s ALA 340 Ca -0.02 -0.35 -0.03 0.00 0.00 0.00 0.00 51.96 51.56 3m12 s ALA 340 Cb -0.18 0.73 0.00 0.00 0.00 0.00 0.00 23.12 23.67 3m12 s ALA 340 CO -0.09 -0.66 0.73 0.41 0.00 0.00 0.00 175.76 176.15 3m12 n GLY 341 N -0.22 -0.08 0.00 0.00 0.00 -1.26 -0.57 105.19 103.05 3m12 n GLY 341 Ca -0.13 -0.07 0.07 0.00 0.00 0.00 0.00 46.02 45.90 3m12 n GLY 341 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3m12 n PHE 342 N -3.58 0.00 -2.66 1.61 3.72 -1.16 -4.08 117.46 111.31 3m12 n PHE 342 Ca -0.11 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.11 3m12 n PHE 342 Cb 0.58 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 38.86 3m12 n PHE 342 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3m12 n SER 343 N -1.26 -5.03 -0.04 4.37 7.64 0.36 -1.68 113.62 117.97 3m12 n SER 343 Ca 0.08 -0.05 -0.01 0.00 1.01 0.00 0.00 58.87 59.90 3m12 n SER 343 Cb 0.12 -4.18 -0.00 0.00 -1.01 0.00 0.00 64.21 59.14 3m12 n SER 343 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3m12 n GLY 344 N -1.07 0.48 1.14 0.23 0.00 -1.26 -4.89 105.19 99.81 3m12 n GLY 344 Ca -0.16 -0.31 0.01 0.00 0.00 0.00 0.00 46.02 45.57 3m12 n GLY 344 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3m12 n HIS 345 N -2.93 0.00 0.06 1.61 -0.00 -0.68 -4.93 115.22 108.36 3m12 n HIS 345 Ca -0.01 -0.35 0.08 0.00 -0.00 0.00 0.00 57.72 57.45 3m12 n HIS 345 Cb 0.05 -0.03 -0.05 0.00 -0.00 0.00 0.00 29.99 29.96 3m12 n HIS 345 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3m12 n GLY 346 N 0.29 -1.32 0.25 -1.39 0.00 -1.22 -4.54 105.19 97.27 3m12 n GLY 346 Ca 0.00 -0.25 -0.06 0.00 0.00 0.00 0.00 46.02 45.71 3m12 n GLY 346 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3m12 h PHE 347 N 0.00 0.81 -0.46 1.61 3.57 -1.92 -1.49 116.94 119.05 3m12 h PHE 347 Ca -0.06 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.57 3m12 h PHE 347 Cb 1.18 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.64 3m12 h PHE 347 CO 0.00 0.56 0.37 1.57 -2.23 0.00 0.00 178.31 178.58 3m12 h LYS 348 N 0.82 0.00 -0.01 1.11 2.10 -1.80 -0.06 116.57 118.74 3m12 h LYS 348 Ca 0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.87 3m12 h LYS 348 Cb -0.01 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.32 3m12 h LYS 348 CO -0.04 0.00 -0.21 1.19 -2.00 0.00 0.00 179.45 178.39 3m12 n PHE 349 N -4.18 0.00 -0.05 0.07 3.72 -0.58 -4.53 117.46 111.90 3m12 n PHE 349 Ca 0.08 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.49 3m12 n PHE 349 Cb 0.57 -0.08 0.32 0.00 -0.94 0.00 0.00 39.48 39.35 3m12 n PHE 349 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3m12 h SER 350 N 1.67 0.58 -0.08 4.37 4.64 -0.83 0.28 113.55 124.19 3m12 h SER 350 Ca 0.00 -0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 61.26 3m12 h SER 350 Cb 0.54 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3m12 h SER 350 CO 0.00 0.52 0.05 0.77 -0.87 0.00 0.00 176.83 177.29 3m12 h SER 351 N 0.65 0.10 -0.50 4.97 4.64 -1.79 0.38 113.55 122.00 3m12 h SER 351 Ca 0.16 -0.08 -0.09 0.00 -0.47 0.00 0.00 61.79 61.31 3m12 h SER 351 Cb 0.10 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.14 3m12 h SER 351 CO -0.02 0.16 -0.01 1.23 -0.87 0.00 0.00 176.83 177.32 3m12 h GLY 352 N 0.04 1.01 1.22 -0.77 0.00 -1.57 -2.77 103.07 100.24 3m12 h GLY 352 Ca 0.03 -0.72 -0.07 0.00 0.00 0.00 0.00 47.33 46.57 3m12 h GLY 352 CO -0.00 0.67 0.09 -2.08 0.00 0.00 0.00 176.54 175.21 3m12 h VAL 353 N 0.86 1.25 -0.72 4.60 2.07 -0.35 -1.09 116.25 122.86 3m12 h VAL 353 Ca 0.16 -0.98 0.11 0.00 0.82 0.00 0.00 66.70 66.81 3m12 h VAL 353 Cb 0.53 0.70 -0.08 0.00 -1.52 0.00 0.00 31.29 30.92 3m12 h VAL 353 CO 0.03 0.36 0.34 1.23 0.02 0.00 0.00 177.57 179.55 3m12 h GLY 354 N 1.02 1.09 0.92 2.17 0.00 -0.65 0.18 103.07 107.80 3m12 h GLY 354 Ca 0.18 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.31 3m12 h GLY 354 CO 0.01 0.02 -0.00 -2.09 0.00 0.00 0.00 176.54 174.47 3m12 h GLU 355 N 0.56 -0.01 -0.45 4.80 4.81 -1.15 -1.93 114.58 121.21 3m12 h GLU 355 Ca 0.37 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.65 3m12 h GLU 355 Cb 0.44 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.78 3m12 h GLU 355 CO -0.30 0.07 0.20 0.28 -0.73 0.00 0.00 179.01 178.52 3m12 h VAL 356 N -0.09 0.91 -0.76 0.32 2.07 -0.48 -2.00 116.25 116.22 3m12 h VAL 356 Ca -0.00 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.34 3m12 h VAL 356 Cb 0.09 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 3m12 h VAL 356 CO 0.00 0.07 0.32 -0.07 0.02 0.00 0.00 177.57 177.91 3m12 h LEU 357 N 0.39 1.03 -0.75 2.57 3.38 -0.58 0.14 115.31 121.49 3m12 h LEU 357 Ca 0.20 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 3m12 h LEU 357 Cb 0.15 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3m12 h LEU 357 CO -0.17 0.91 0.30 0.77 0.09 0.00 0.00 178.44 180.34 3m12 h SER 358 N 1.09 1.04 -0.27 -0.43 4.64 -1.05 -0.12 113.55 118.45 3m12 h SER 358 Ca 0.25 -0.17 -0.06 0.00 -0.47 0.00 0.00 61.79 61.34 3m12 h SER 358 Cb 0.19 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 3m12 h SER 358 CO -0.02 0.93 -0.06 1.56 -0.87 0.00 0.00 176.83 178.37 3m12 h GLN 359 N 1.09 0.52 -0.62 4.77 4.20 -0.90 -1.42 115.11 122.75 3m12 h GLN 359 Ca 0.25 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 3m12 h GLN 359 Cb 0.22 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 3m12 h GLN 359 CO -0.02 0.72 0.33 -0.07 -0.67 0.00 0.00 178.83 179.12 3m12 h LEU 360 N 0.28 0.78 -0.66 1.46 3.38 -0.81 0.12 115.31 119.86 3m12 h LEU 360 Ca 0.07 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 3m12 h LEU 360 Cb 0.52 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 3m12 h LEU 360 CO 0.03 0.66 0.24 0.00 0.09 0.00 0.00 178.44 179.46 3m12 h ALA 361 N 1.15 0.86 0.02 1.53 0.00 -0.95 0.64 119.26 122.50 3m12 h ALA 361 Ca 0.22 -0.19 -0.25 0.00 0.00 0.00 0.00 54.91 54.68 3m12 h ALA 361 Cb 0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 3m12 h ALA 361 CO -0.03 0.50 -1.34 -0.07 0.00 0.00 0.00 179.25 178.30 3m12 h LEU 362 N 0.94 0.06 0.00 0.00 3.38 -1.04 -3.41 115.31 115.24 3m12 h LEU 362 Ca 0.22 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3m12 h LEU 362 Cb 0.24 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3m12 h LEU 362 CO -0.01 1.07 -0.09 0.35 0.09 0.00 0.00 178.44 179.84 3m12 n THR 363 N -3.25 0.00 -0.93 0.22 -2.24 0.38 -5.01 114.28 103.45 3m12 n THR 363 Ca -0.09 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 3m12 n THR 363 Cb 1.00 0.92 0.00 0.00 -2.10 0.00 0.00 70.33 70.14 3m12 n THR 363 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3m12 n GLY 364 N 0.83 0.58 3.21 3.38 0.00 0.21 -4.98 105.19 108.43 3m12 n GLY 364 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 3m12 n GLY 364 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m12 s LYS 365 N -0.36 0.96 0.03 1.61 1.02 -1.25 -4.91 119.74 116.83 3m12 s LYS 365 Ca 0.00 -1.29 0.01 0.00 0.02 0.00 0.00 55.97 54.71 3m12 s LYS 365 Cb 0.00 0.29 -0.02 0.00 -0.52 0.00 0.00 37.83 37.58 3m12 s LYS 365 CO 0.00 -0.30 -0.06 -0.08 -0.92 0.00 0.00 175.35 174.00 3m12 s THR 366 N -3.99 0.34 0.00 2.17 -1.32 -1.26 -2.96 115.64 108.62 3m12 s THR 366 Ca 0.18 -1.03 0.29 0.00 -1.21 0.00 0.00 61.69 59.92 3m12 s THR 366 Cb 0.06 -0.48 0.33 0.00 -1.51 0.00 0.00 72.50 70.90 3m12 s THR 366 CO -0.01 -0.45 1.86 1.05 -2.21 0.00 0.00 174.62 174.85 3m12 h GLU 367 N 4.52 0.00 -7.11 7.08 4.11 -1.97 -3.45 114.58 117.76 3m12 h GLU 367 Ca -0.34 0.00 -0.48 0.00 0.07 0.00 0.00 59.36 58.61 3m12 h GLU 367 Cb 1.20 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.49 3m12 h GLU 367 CO 0.42 0.07 0.38 -1.01 0.07 0.00 0.00 179.01 178.94 3m12 s HIS 368 N -3.56 3.03 -0.48 2.06 3.76 -1.26 -5.01 115.29 113.84 3m12 s HIS 368 Ca 0.02 1.55 -0.26 0.00 -0.15 0.00 0.00 55.06 56.22 3m12 s HIS 368 Cb 0.08 -3.03 0.03 0.00 1.11 0.00 0.00 32.58 30.78 3m12 s HIS 368 CO 0.60 -0.86 1.00 0.34 -0.85 0.00 0.00 174.74 174.96 3m12 s ASP 369 N -2.27 6.51 -0.14 1.40 -1.08 -1.26 -4.87 116.67 114.97 3m12 s ASP 369 Ca 0.66 0.16 0.16 0.00 -0.52 0.00 0.00 52.55 53.01 3m12 s ASP 369 Cb -0.16 -2.48 0.31 0.00 -1.46 0.00 0.00 42.92 39.13 3m12 s ASP 369 CO 0.25 -1.14 1.16 2.30 0.52 0.00 0.00 175.17 178.26 3m12 n ILE 370 N 6.53 1.80 -0.29 4.11 -5.35 -1.26 -4.83 119.36 120.06 3m12 n ILE 370 Ca 0.07 -2.35 0.05 0.00 -0.27 0.00 0.00 62.75 60.25 3m12 n ILE 370 Cb 0.49 -0.16 0.26 0.00 -1.74 0.00 0.00 39.64 38.49 3m12 n ILE 370 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 3m12 h SER 371 N 0.31 0.87 0.49 7.28 4.64 -1.94 -1.17 113.55 124.03 3m12 h SER 371 Ca -0.01 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m12 h SER 371 Cb 1.05 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 3m12 h SER 371 CO 0.00 0.55 0.00 2.30 -0.87 0.00 0.00 176.83 178.81 3m12 n ILE 372 N -4.50 0.22 -0.54 0.95 -5.35 -1.26 -2.82 119.36 106.07 3m12 n ILE 372 Ca 0.14 0.06 0.09 0.00 -0.27 0.00 0.00 62.75 62.77 3m12 n ILE 372 Cb 0.22 -0.65 0.31 0.00 -1.74 0.00 0.00 39.64 37.78 3m12 n ILE 372 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3m12 n PHE 373 N -1.30 1.18 -1.71 4.28 3.72 -0.44 -4.75 117.46 118.44 3m12 n PHE 373 Ca 0.11 -0.60 -0.43 0.00 -0.05 0.00 0.00 57.45 56.48 3m12 n PHE 373 Cb 0.20 -0.17 -0.02 0.00 -0.94 0.00 0.00 39.48 38.55 3m12 n PHE 373 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3m12 n SER 374 N 0.96 3.30 0.12 4.37 2.88 -1.13 -1.59 113.62 122.53 3m12 n SER 374 Ca 0.23 1.15 0.12 0.00 -1.33 0.00 0.00 58.87 59.03 3m12 n SER 374 Cb 0.77 -1.51 0.47 0.00 -0.75 0.00 0.00 64.21 63.19 3m12 n SER 374 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3m12 n ILE 375 N 1.99 0.77 0.66 2.46 3.06 -1.26 -3.16 119.36 123.87 3m12 n ILE 375 Ca 0.10 0.12 0.11 0.00 -2.50 0.00 0.00 62.75 60.57 3m12 n ILE 375 Cb 0.34 -1.02 0.13 0.00 0.54 0.00 0.00 39.64 39.63 3m12 n ILE 375 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64 3m12 n ASN 376 N -2.21 3.04 -4.77 9.51 4.13 -1.26 -5.00 115.26 118.70 3m12 n ASN 376 Ca 0.03 -1.93 -0.40 0.00 1.68 0.00 0.00 54.58 53.96 3m12 n ASN 376 Cb 0.27 -0.09 -0.01 0.00 -1.54 0.00 0.00 39.78 38.41 3m12 n ASN 376 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3m12 s ARG 377 N -1.66 4.11 0.44 3.52 1.70 -1.19 -4.92 118.95 120.95 3m12 s ARG 377 Ca 0.30 2.21 0.17 0.00 -0.47 0.00 0.00 55.73 57.95 3m12 s ARG 377 Cb 0.19 -2.88 1.03 0.00 -0.57 0.00 0.00 34.95 32.72 3m12 s ARG 377 CO 0.28 -0.39 1.96 -1.00 -1.08 0.00 0.00 175.30 175.07 3m12 h PRO 378 N 2.95 0.00 0.00 3.89 0.13 -1.94 -2.88 132.00 134.15 3m12 h PRO 378 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 3m12 h PRO 378 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3m12 h PRO 378 CO 0.64 0.22 0.00 0.00 -0.23 0.00 0.00 178.00 178.63 3m12 n ALA 379 N -2.43 1.63 0.12 -0.56 0.00 -1.26 -2.27 120.51 115.74 3m12 n ALA 379 Ca -0.02 0.05 -0.03 0.00 0.00 0.00 0.00 53.44 53.44 3m12 n ALA 379 Cb 0.30 -1.34 0.16 0.00 0.00 0.00 0.00 19.45 18.56 3m12 n ALA 379 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3m12 h LEU 380 N 0.00 0.09 0.00 0.00 5.85 -1.89 -3.38 115.31 115.97 3m12 h LEU 380 Ca 0.00 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.67 3m12 h LEU 380 Cb 0.32 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.32 3m12 h LEU 380 CO 0.00 0.68 0.00 1.17 -0.34 0.00 0.00 178.44 179.95