#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m13 s THR 2 N 0.00 4.15 0.05 0.44 2.01 -1.26 -5.01 115.64 116.02 3m13 s THR 2 Ca 0.00 0.40 0.04 0.00 0.31 0.00 0.00 61.69 62.44 3m13 s THR 2 Cb 0.00 -4.68 -0.04 0.00 0.01 0.00 0.00 72.50 67.79 3m13 s THR 2 CO 0.00 -1.36 -0.01 -2.28 -0.69 0.00 0.00 174.62 170.28 3m13 s HIS 3 N 4.57 3.00 0.32 4.92 5.65 -1.26 -3.29 115.29 129.20 3m13 s HIS 3 Ca 0.34 0.00 0.05 0.00 0.25 0.00 0.00 55.06 55.70 3m13 s HIS 3 Cb -0.11 -1.59 -0.06 0.00 -1.18 0.00 0.00 32.58 29.64 3m13 s HIS 3 CO 0.19 0.46 0.02 -0.06 -0.65 0.00 0.00 174.74 174.70 3m13 s PHE 4 N -1.20 2.01 0.00 3.88 0.08 0.11 -4.98 117.98 117.89 3m13 s PHE 4 Ca 0.23 -0.85 -0.22 0.00 0.12 0.00 0.00 56.93 56.21 3m13 s PHE 4 Cb -0.12 -1.28 -0.18 0.00 -0.57 0.00 0.00 43.02 40.87 3m13 s PHE 4 CO 0.14 0.14 1.23 -0.44 -0.10 0.00 0.00 175.22 176.19 3m13 h ASP 5 N 2.14 0.29 -4.10 1.36 3.45 -0.83 -3.13 116.42 115.60 3m13 h ASP 5 Ca -0.41 -0.58 -0.37 0.00 0.43 0.00 0.00 57.03 56.11 3m13 h ASP 5 Cb 1.24 -0.08 -0.27 0.00 -0.56 0.00 0.00 39.33 39.65 3m13 h ASP 5 CO 0.70 0.82 -0.77 -0.69 -1.57 0.00 0.00 179.24 177.73 3m13 s VAL 6 N -3.91 0.65 -0.07 -1.35 1.01 -0.75 -1.88 120.40 114.10 3m13 s VAL 6 Ca -0.15 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 61.37 3m13 s VAL 6 Cb 0.03 -0.57 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 3m13 s VAL 6 CO 0.74 0.10 -0.09 -0.63 0.00 0.00 0.00 175.10 175.22 3m13 s ILE 7 N -0.37 3.51 -0.17 2.22 1.01 -0.38 -1.23 121.20 125.79 3m13 s ILE 7 Ca 0.02 -0.54 0.01 0.00 0.00 0.00 0.00 60.65 60.13 3m13 s ILE 7 Cb -0.04 -2.43 0.02 0.00 0.01 0.00 0.00 42.46 40.01 3m13 s ILE 7 CO -0.00 0.59 -0.19 -0.69 0.00 0.00 0.00 174.94 174.64 3m13 s VAL 8 N -0.64 2.15 -0.32 2.92 1.01 -0.18 -1.18 120.40 124.15 3m13 s VAL 8 Ca 0.10 -0.92 -0.12 0.00 0.00 0.00 0.00 61.98 61.04 3m13 s VAL 8 Cb -0.11 -1.90 -0.02 0.00 0.00 0.00 0.00 36.38 34.35 3m13 s VAL 8 CO 0.02 0.53 0.22 -0.69 0.00 0.00 0.00 175.10 175.18 3m13 s VAL 9 N 1.20 5.17 0.00 2.92 1.01 0.64 -1.52 120.40 129.83 3m13 s VAL 9 Ca 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.84 3m13 s VAL 9 Cb -0.14 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.63 3m13 s VAL 9 CO -0.10 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.67 3m13 n GLY 10 N 5.08 -0.47 2.74 4.51 0.00 0.67 -0.15 105.19 117.57 3m13 n GLY 10 Ca -0.13 -0.72 -0.37 0.00 0.00 0.00 0.00 46.02 44.80 3m13 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m13 n ALA 11 N 0.61 5.59 -2.20 4.61 0.00 -1.22 -3.85 120.51 124.04 3m13 n ALA 11 Ca 0.00 -4.66 0.00 0.00 0.00 0.00 0.00 53.44 48.78 3m13 n ALA 11 Cb 0.00 -1.79 0.00 0.00 0.00 0.00 0.00 19.45 17.66 3m13 n ALA 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m13 n GLY 12 N 0.04 2.22 0.30 0.00 0.00 -1.26 -4.28 105.19 102.21 3m13 n GLY 12 Ca 0.41 -1.37 -0.08 0.00 0.00 0.00 0.00 46.02 44.98 3m13 n GLY 12 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3m13 h SER 13 N 0.00 -0.90 0.17 1.61 0.02 -1.93 0.39 113.55 112.91 3m13 h SER 13 Ca 0.00 0.16 -0.29 0.00 -0.84 0.00 0.00 61.79 60.82 3m13 h SER 13 Cb 0.00 0.42 0.01 0.00 0.14 0.00 0.00 62.40 62.98 3m13 h SER 13 CO 0.00 -0.30 -1.38 0.24 -1.14 0.00 0.00 176.83 174.25 3m13 h MET 14 N -0.26 0.35 -0.24 3.45 2.07 -1.90 -3.30 114.93 115.10 3m13 h MET 14 Ca 0.15 -0.60 -0.19 0.00 -2.07 0.00 0.00 59.70 56.99 3m13 h MET 14 Cb 0.50 0.22 0.00 0.00 -1.87 0.00 0.00 31.60 30.45 3m13 h MET 14 CO -0.45 1.29 -0.60 0.78 1.07 0.00 0.00 176.91 179.00 3m13 h GLY 15 N 0.13 0.89 1.74 8.32 0.00 -1.64 -2.01 103.07 110.50 3m13 h GLY 15 Ca -0.27 -1.08 -0.08 0.00 0.00 0.00 0.00 47.33 45.90 3m13 h GLY 15 CO 0.15 0.97 -0.25 1.98 0.00 0.00 0.00 176.54 179.38 3m13 h MET 16 N 0.61 0.31 -0.33 4.80 4.05 -1.09 -0.13 114.93 123.14 3m13 h MET 16 Ca -0.00 -0.11 -0.14 0.00 -0.28 0.00 0.00 59.70 59.17 3m13 h MET 16 Cb 1.20 -0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.97 3m13 h MET 16 CO 0.13 0.55 -0.34 0.00 0.23 0.00 0.00 176.91 177.47 3m13 h ALA 17 N 1.46 0.49 -0.52 0.39 0.00 -1.62 -1.64 119.26 117.82 3m13 h ALA 17 Ca 0.04 -0.43 0.03 0.00 0.00 0.00 0.00 54.91 54.56 3m13 h ALA 17 Cb 0.60 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 3m13 h ALA 17 CO 0.04 0.55 0.29 0.00 0.00 0.00 0.00 179.25 180.13 3m13 h ALA 18 N 0.73 0.67 -0.71 0.00 0.00 -1.13 -1.72 119.26 117.10 3m13 h ALA 18 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3m13 h ALA 18 Cb 0.92 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 3m13 h ALA 18 CO 0.08 -0.03 0.40 0.78 0.00 0.00 0.00 179.25 180.49 3m13 h GLY 19 N 0.57 1.04 0.83 0.00 0.00 -0.85 -0.95 103.07 103.71 3m13 h GLY 19 Ca 0.22 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 3m13 h GLY 19 CO -0.13 0.43 0.04 -1.82 0.00 0.00 0.00 176.54 175.06 3m13 h TYR 20 N 0.98 0.28 -0.97 5.60 5.03 -1.10 0.34 116.97 127.13 3m13 h TYR 20 Ca 0.25 -0.04 0.12 0.00 2.58 0.00 0.00 58.73 61.65 3m13 h TYR 20 Cb -0.00 -0.08 -0.08 0.00 1.55 0.00 0.00 36.73 38.12 3m13 h TYR 20 CO 0.01 0.42 0.61 1.96 -1.32 0.00 0.00 178.16 179.84 3m13 h GLN 21 N 0.07 0.90 0.19 1.82 1.08 -0.78 -0.32 115.11 118.07 3m13 h GLN 21 Ca 0.05 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 3m13 h GLN 21 Cb 0.28 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 3m13 h GLN 21 CO 0.00 0.59 -0.09 -0.07 -0.95 0.00 0.00 178.83 178.32 3m13 h LEU 22 N 0.92 -0.21 -1.60 1.46 3.38 -1.02 -3.24 115.31 115.00 3m13 h LEU 22 Ca 0.48 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 3m13 h LEU 22 Cb 0.52 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 3m13 h LEU 22 CO -0.24 0.31 0.13 0.00 0.09 0.00 0.00 178.44 178.73 3m13 h ALA 23 N -0.31 1.69 -0.30 1.53 0.00 -0.75 -1.28 119.26 119.84 3m13 h ALA 23 Ca -0.03 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3m13 h ALA 23 Cb 0.52 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3m13 h ALA 23 CO 0.04 0.25 0.12 -0.22 0.00 0.00 0.00 179.25 179.44 3m13 h LYS 24 N 0.39 0.41 -0.28 0.00 3.64 -1.13 -1.64 116.57 117.96 3m13 h LYS 24 Ca 0.10 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3m13 h LYS 24 Cb 0.06 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 3m13 h LYS 24 CO -0.01 0.34 0.00 1.04 -2.27 0.00 0.00 179.45 178.55 3m13 n GLN 25 N -4.42 1.59 -1.18 1.90 6.02 -0.54 -4.90 117.38 115.85 3m13 n GLN 25 Ca 0.01 -0.85 -0.06 0.00 -0.01 0.00 0.00 57.00 56.09 3m13 n GLN 25 Cb 0.13 -1.22 -0.03 0.00 1.02 0.00 0.00 30.24 30.14 3m13 n GLN 25 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3m13 n GLY 26 N 0.83 0.86 3.72 1.08 0.00 -0.62 -5.01 105.19 106.05 3m13 n GLY 26 Ca 0.08 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 3m13 n GLY 26 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m13 s VAL 27 N -2.21 4.50 -0.38 1.61 1.01 -0.90 -4.98 120.40 119.05 3m13 s VAL 27 Ca 0.00 1.89 -0.29 0.00 0.00 0.00 0.00 61.98 63.58 3m13 s VAL 27 Cb 0.00 -4.21 0.01 0.00 0.00 0.00 0.00 36.38 32.18 3m13 s VAL 27 CO 0.00 0.20 1.26 -0.75 0.00 0.00 0.00 175.10 175.81 3m13 s LYS 28 N 0.63 3.80 -0.03 2.72 2.20 -1.26 -4.15 119.74 123.65 3m13 s LYS 28 Ca 0.52 0.97 0.06 0.00 -0.36 0.00 0.00 55.97 57.16 3m13 s LYS 28 Cb -0.24 -3.90 -0.01 0.00 -1.51 0.00 0.00 37.83 32.16 3m13 s LYS 28 CO 0.29 -1.27 -0.20 0.99 -0.36 0.00 0.00 175.35 174.80 3m13 s THR 29 N 4.56 1.61 -0.11 3.43 2.01 -1.26 -0.11 115.64 125.77 3m13 s THR 29 Ca 0.54 -0.86 0.00 0.00 0.31 0.00 0.00 61.69 61.69 3m13 s THR 29 Cb -0.13 -1.35 -0.02 0.00 0.01 0.00 0.00 72.50 71.01 3m13 s THR 29 CO 0.27 0.46 -0.12 -0.22 -0.69 0.00 0.00 174.62 174.31 3m13 s LEU 30 N -0.32 2.81 -0.08 4.42 2.96 -0.37 -1.97 118.68 126.13 3m13 s LEU 30 Ca 0.04 -0.25 0.02 0.00 -0.22 0.00 0.00 54.13 53.72 3m13 s LEU 30 Cb -0.09 -1.62 -0.02 0.00 0.50 0.00 0.00 46.19 44.95 3m13 s LEU 30 CO 0.00 0.22 -0.13 -0.76 -1.32 0.00 0.00 176.35 174.36 3m13 s LEU 31 N 0.01 2.75 -0.05 -0.68 1.43 0.15 -1.01 118.68 121.27 3m13 s LEU 31 Ca -0.03 -0.24 0.02 0.00 -1.03 0.00 0.00 54.13 52.84 3m13 s LEU 31 Cb -0.14 -1.58 0.02 0.00 0.03 0.00 0.00 46.19 44.51 3m13 s LEU 31 CO 0.04 0.27 -0.09 -0.69 0.23 0.00 0.00 176.35 176.11 3m13 s VAL 32 N -0.29 0.86 -0.00 -1.59 1.01 -0.58 -0.80 120.40 119.01 3m13 s VAL 32 Ca 0.02 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 61.70 3m13 s VAL 32 Cb -0.13 -0.81 -0.00 0.00 0.00 0.00 0.00 36.38 35.44 3m13 s VAL 32 CO 0.03 0.29 -0.05 -0.62 0.00 0.00 0.00 175.10 174.75 3m13 s ASP 33 N 0.75 0.60 0.55 3.32 2.15 -0.26 -0.24 116.67 123.55 3m13 s ASP 33 Ca -0.13 -0.11 0.29 0.00 0.43 0.00 0.00 52.55 53.04 3m13 s ASP 33 Cb -0.15 -0.06 1.63 0.00 -0.30 0.00 0.00 42.92 44.03 3m13 s ASP 33 CO 0.02 0.05 2.15 0.00 -0.17 0.00 0.00 175.17 177.23 3m13 h ALA 34 N 5.98 1.35 -3.00 3.66 0.00 -1.79 -0.40 119.26 125.05 3m13 h ALA 34 Ca -0.28 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3m13 h ALA 34 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3m13 h ALA 34 CO 0.50 0.09 0.00 1.19 0.00 0.00 0.00 179.25 181.03 3m13 n PHE 35 N -3.68 0.00 -3.89 0.00 3.72 -1.26 -3.46 117.46 108.90 3m13 n PHE 35 Ca -0.02 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.08 3m13 n PHE 35 Cb 0.18 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.58 3m13 n PHE 35 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3m13 s ASP 36 N 1.00 4.21 0.44 4.37 3.68 -1.26 -1.12 116.67 127.99 3m13 s ASP 36 Ca 0.00 -2.64 -0.21 0.00 2.13 0.00 0.00 52.55 51.82 3m13 s ASP 36 Cb 0.00 -1.43 -0.10 0.00 -1.45 0.00 0.00 42.92 39.94 3m13 s ASP 36 CO 0.00 -0.28 0.98 -2.16 0.13 0.00 0.00 175.17 173.84 3m13 s PRO 37 N 0.25 4.13 0.45 4.34 0.05 -1.26 -4.02 135.00 138.94 3m13 s PRO 37 Ca 0.15 1.24 -0.22 0.00 0.05 0.00 0.00 61.00 62.22 3m13 s PRO 37 Cb -0.24 -2.23 -0.09 0.00 0.05 0.00 0.00 34.50 32.00 3m13 s PRO 37 CO -0.03 -0.13 1.05 -1.25 0.05 0.00 0.00 177.00 176.68 3m13 s PRO 38 N -3.05 3.96 0.08 0.56 0.04 -1.26 -4.83 135.00 130.49 3m13 s PRO 38 Ca 0.62 1.45 0.00 0.00 0.04 0.00 0.00 61.00 63.11 3m13 s PRO 38 Cb -0.13 -2.31 -0.00 0.00 0.04 0.00 0.00 34.50 32.10 3m13 s PRO 38 CO 0.17 -0.30 0.09 -2.39 0.04 0.00 0.00 177.00 174.61 3m13 n HIS 39 N -0.54 -0.49 -1.61 0.56 1.44 -1.26 -5.07 115.22 108.25 3m13 n HIS 39 Ca 0.07 -0.55 -0.01 0.00 -2.01 0.00 0.00 57.72 55.22 3m13 n HIS 39 Cb 0.51 0.10 0.18 0.00 0.12 0.00 0.00 29.99 30.90 3m13 n HIS 39 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 3m13 n THR 40 N -0.13 2.37 0.31 0.61 -2.24 -1.26 -4.30 114.28 109.63 3m13 n THR 40 Ca 0.01 -3.24 0.04 0.00 -2.27 0.00 0.00 64.05 58.59 3m13 n THR 40 Cb 0.13 -0.39 -0.05 0.00 -2.10 0.00 0.00 70.33 67.93 3m13 n THR 40 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3m13 n ASN 41 N -1.07 0.79 0.00 3.42 5.03 -1.26 -4.96 115.26 117.21 3m13 n ASN 41 Ca 0.27 -0.58 0.00 0.00 0.87 0.00 0.00 54.58 55.14 3m13 n ASN 41 Cb 0.82 1.05 0.00 0.00 -1.02 0.00 0.00 39.78 40.63 3m13 n ASN 41 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3m13 n GLY 42 N 1.31 3.18 0.72 7.41 0.00 -1.26 -4.97 105.19 111.57 3m13 n GLY 42 Ca 0.01 -1.75 0.07 0.00 0.00 0.00 0.00 46.02 44.35 3m13 n GLY 42 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3m13 n SER 43 N 0.00 3.33 -0.17 1.61 7.64 -1.26 -3.46 113.62 121.31 3m13 n SER 43 Ca 0.00 -2.53 0.02 0.00 1.01 0.00 0.00 58.87 57.37 3m13 n SER 43 Cb 0.00 -0.38 0.03 0.00 -1.01 0.00 0.00 64.21 62.85 3m13 n SER 43 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3m13 n HIS 44 N -0.09 0.05 -2.85 1.43 1.44 -1.26 -4.78 115.22 109.16 3m13 n HIS 44 Ca 0.16 -0.16 -0.03 0.00 -2.01 0.00 0.00 57.72 55.67 3m13 n HIS 44 Cb 0.65 -0.01 0.01 0.00 0.12 0.00 0.00 29.99 30.76 3m13 n HIS 44 CO 0.00 0.00 0.00 -2.39 -2.81 0.00 0.00 176.34 171.14 3m13 n HIS 45 N 0.09 -2.98 -0.33 -1.40 -0.00 -1.26 -4.16 115.22 105.18 3m13 n HIS 45 Ca 0.03 -0.32 0.00 0.00 -0.00 0.00 0.00 57.72 57.43 3m13 n HIS 45 Cb 0.16 -0.09 0.00 0.00 -0.00 0.00 0.00 29.99 30.06 3m13 n HIS 45 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3m13 n GLY 46 N 3.87 0.79 4.57 -1.39 0.00 -1.26 -4.71 105.19 107.06 3m13 n GLY 46 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3m13 n GLY 46 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3m13 n ASP 47 N 0.00 0.00 -4.09 1.61 8.00 -1.26 -4.89 116.55 115.91 3m13 n ASP 47 Ca 0.00 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.29 3m13 n ASP 47 Cb 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 41.12 40.95 3m13 n ASP 47 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3m13 s THR 48 N 0.00 1.01 -0.01 -3.53 -4.23 -1.26 -1.51 115.64 106.12 3m13 s THR 48 Ca 0.00 -0.59 0.02 0.00 -1.18 0.00 0.00 61.69 59.94 3m13 s THR 48 Cb 0.00 -0.85 -0.00 0.00 1.34 0.00 0.00 72.50 72.98 3m13 s THR 48 CO 0.00 0.26 -0.06 -0.13 -0.54 0.00 0.00 174.62 174.15 3m13 s ARG 49 N -0.38 0.50 0.13 3.99 1.81 -0.32 -4.90 118.95 119.79 3m13 s ARG 49 Ca 0.05 -0.21 -0.30 0.00 -1.72 0.00 0.00 55.73 53.55 3m13 s ARG 49 Cb -0.05 -0.49 -0.06 0.00 -0.45 0.00 0.00 34.95 33.90 3m13 s ARG 49 CO -0.00 0.12 1.04 0.42 -0.68 0.00 0.00 175.30 176.19 3m13 s ILE 50 N -0.08 4.20 -0.10 1.52 -1.09 -1.26 -0.10 121.20 124.30 3m13 s ILE 50 Ca 0.01 1.83 0.04 0.00 -2.23 0.00 0.00 60.65 60.31 3m13 s ILE 50 Cb -0.03 -4.17 0.00 0.00 -1.58 0.00 0.00 42.46 36.68 3m13 s ILE 50 CO -0.00 0.28 -0.23 -0.51 -1.23 0.00 0.00 174.94 173.25 3m13 s ILE 51 N -0.00 2.01 0.24 2.92 2.07 -0.58 -4.37 121.20 123.48 3m13 s ILE 51 Ca 0.49 -0.99 0.01 0.00 -1.41 0.00 0.00 60.65 58.75 3m13 s ILE 51 Cb -0.26 -1.74 -0.04 0.00 0.13 0.00 0.00 42.46 40.54 3m13 s ILE 51 CO 0.32 0.55 0.13 0.00 -1.91 0.00 0.00 174.94 174.03 3m13 s ARG 52 N 0.38 1.35 0.00 3.50 1.70 -1.26 -2.03 118.95 122.59 3m13 s ARG 52 Ca -0.18 -1.73 0.00 0.00 -0.47 0.00 0.00 55.73 53.34 3m13 s ARG 52 Cb -0.18 0.06 0.00 0.00 -0.57 0.00 0.00 34.95 34.27 3m13 s ARG 52 CO 0.08 -0.39 0.00 0.72 -1.08 0.00 0.00 175.30 174.64 3m13 n HIS 53 N -0.39 0.00 -1.71 5.89 8.25 -1.26 -4.84 115.22 121.16 3m13 n HIS 53 Ca 0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.06 3m13 n HIS 53 Cb 0.66 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.76 3m13 n HIS 53 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3m13 n ALA 54 N -1.54 5.59 -3.14 -1.41 0.00 -1.26 -4.69 120.51 114.07 3m13 n ALA 54 Ca 0.00 -3.86 -0.45 0.00 0.00 0.00 0.00 53.44 49.13 3m13 n ALA 54 Cb 0.21 -3.54 -0.03 0.00 0.00 0.00 0.00 19.45 16.09 3m13 n ALA 54 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3m13 s TYR 55 N 3.19 3.36 0.15 0.00 6.14 -1.26 -4.50 117.35 124.42 3m13 s TYR 55 Ca 0.48 -1.53 0.34 0.00 0.64 0.00 0.00 57.07 57.00 3m13 s TYR 55 Cb 0.14 -4.02 1.62 0.00 0.42 0.00 0.00 41.96 40.11 3m13 s TYR 55 CO -0.09 -1.23 2.02 0.78 0.64 0.00 0.00 175.55 177.68 3m13 h GLY 56 N 9.21 0.00 1.23 8.97 0.00 -1.86 -3.08 103.07 117.54 3m13 h GLY 56 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 3m13 h GLY 56 CO 0.96 0.00 0.29 0.83 0.00 0.00 0.00 176.54 178.62 3m13 h GLU 57 N 0.00 0.00 0.00 4.80 3.07 -1.91 -3.44 114.58 117.10 3m13 h GLU 57 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3m13 h GLU 57 Cb 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.18 3m13 h GLU 57 CO 0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 3m13 n GLY 58 N -1.27 3.73 0.23 -3.84 0.00 -1.17 -4.99 105.19 97.89 3m13 n GLY 58 Ca -0.01 -0.33 0.07 0.00 0.00 0.00 0.00 46.02 45.75 3m13 n GLY 58 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3m13 h ARG 59 N 0.00 0.00 0.00 1.61 -0.00 -1.86 -1.79 114.38 112.34 3m13 h ARG 59 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 59.98 59.96 3m13 h ARG 59 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 29.97 3m13 h ARG 59 CO 0.00 0.16 -0.10 0.93 -0.00 0.00 0.00 179.97 180.96 3m13 h GLU 60 N 0.00 0.00 -0.31 0.08 3.07 -1.93 -2.70 114.58 112.79 3m13 h GLU 60 Ca -0.00 0.00 -0.18 0.00 -0.50 0.00 0.00 59.36 58.68 3m13 h GLU 60 Cb 0.30 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.21 3m13 h GLU 60 CO 0.02 0.10 -0.52 1.88 -1.40 0.00 0.00 179.01 179.10 3m13 h TYR 61 N 0.00 1.12 -0.33 4.33 0.05 -1.64 -3.28 116.97 117.23 3m13 h TYR 61 Ca -0.00 -0.39 0.04 0.00 0.05 0.00 0.00 58.73 58.43 3m13 h TYR 61 Cb 0.41 -0.22 -0.07 0.00 1.01 0.00 0.00 36.73 37.86 3m13 h TYR 61 CO 0.00 1.22 -0.53 0.28 -1.05 0.00 0.00 178.16 178.09 3m13 h VAL 62 N 0.70 0.00 0.00 -2.88 2.07 -1.60 0.16 116.25 114.70 3m13 h VAL 62 Ca 0.02 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 3m13 h VAL 62 Cb 1.12 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 3m13 h VAL 62 CO 0.12 0.00 -0.07 1.55 0.02 0.00 0.00 177.57 179.18 3m13 h PRO 63 N -0.42 0.00 0.03 1.57 0.13 -1.73 -0.53 132.00 131.06 3m13 h PRO 63 Ca 0.06 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.94 3m13 h PRO 63 Cb 0.58 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.72 3m13 h PRO 63 CO -0.53 0.07 -1.04 1.25 -0.23 0.00 0.00 178.00 177.53 3m13 h LEU 64 N 0.00 0.66 -0.68 1.56 5.85 -1.19 -1.22 115.31 120.30 3m13 h LEU 64 Ca -0.00 -0.56 -0.04 0.00 0.84 0.00 0.00 57.88 58.12 3m13 h LEU 64 Cb 0.27 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 3m13 h LEU 64 CO 0.01 1.37 0.27 0.00 -0.34 0.00 0.00 178.44 179.74 3m13 h ALA 65 N 0.58 0.88 -0.32 1.25 0.00 -0.17 0.73 119.26 122.22 3m13 h ALA 65 Ca -0.11 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.49 3m13 h ALA 65 Cb 1.69 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 3m13 h ALA 65 CO 0.19 0.51 -0.29 -0.07 0.00 0.00 0.00 179.25 179.59 3m13 h LEU 66 N 0.97 0.80 -0.22 0.00 3.38 -1.04 -1.19 115.31 118.01 3m13 h LEU 66 Ca 0.23 -0.46 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 3m13 h LEU 66 Cb 0.21 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3m13 h LEU 66 CO -0.02 1.10 0.07 -0.09 0.09 0.00 0.00 178.44 179.58 3m13 h ARG 67 N 0.52 0.34 -0.53 1.13 9.65 -1.24 -2.54 114.38 121.71 3m13 h ARG 67 Ca 0.05 -0.07 0.10 0.00 -1.10 0.00 0.00 59.98 58.96 3m13 h ARG 67 Cb 0.86 -0.05 -0.11 0.00 -1.39 0.00 0.00 29.97 29.29 3m13 h ARG 67 CO 0.07 0.43 -0.25 0.77 2.80 0.00 0.00 179.97 183.79 3m13 h SER 68 N 0.18 -0.88 -0.48 -3.80 0.02 -0.79 -1.63 113.55 106.17 3m13 h SER 68 Ca 0.07 0.19 0.09 0.00 -0.84 0.00 0.00 61.79 61.30 3m13 h SER 68 Cb 0.24 0.47 -0.08 0.00 0.14 0.00 0.00 62.40 63.17 3m13 h SER 68 CO -0.00 -0.27 0.02 -0.61 -1.14 0.00 0.00 176.83 174.83 3m13 h GLN 69 N -0.13 0.13 -0.71 3.45 5.75 -1.18 0.13 115.11 122.55 3m13 h GLN 69 Ca 0.24 -0.01 0.08 0.00 -0.15 0.00 0.00 58.65 58.81 3m13 h GLN 69 Cb 0.50 -0.03 -0.07 0.00 1.07 0.00 0.00 27.48 28.96 3m13 h GLN 69 CO -0.60 0.09 0.37 0.93 -2.65 0.00 0.00 178.83 176.96 3m13 h GLU 70 N 0.14 0.63 -0.31 1.69 5.08 -1.00 -1.52 114.58 119.29 3m13 h GLU 70 Ca 0.24 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.46 3m13 h GLU 70 Cb 0.35 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3m13 h GLU 70 CO -0.38 0.42 -0.25 -0.07 -1.00 0.00 0.00 179.01 177.73 3m13 h LEU 71 N 0.65 0.61 -0.47 1.33 3.38 -0.35 -0.88 115.31 119.57 3m13 h LEU 71 Ca 0.34 -0.22 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 3m13 h LEU 71 Cb 0.30 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 3m13 h LEU 71 CO -0.24 0.84 -0.04 -0.50 0.09 0.00 0.00 178.44 178.60 3m13 h TRP 72 N 0.53 0.95 -0.73 1.13 -0.00 -0.44 0.25 115.95 117.64 3m13 h TRP 72 Ca 0.07 -0.18 -0.04 0.00 -0.00 0.00 0.00 58.89 58.74 3m13 h TRP 72 Cb 0.71 -0.24 -0.03 0.00 -0.00 0.00 0.00 29.16 29.59 3m13 h TRP 72 CO 0.03 0.92 0.28 1.88 -0.00 0.00 0.00 178.44 181.55 3m13 h TYR 73 N 0.71 1.10 -0.25 0.49 0.05 -1.12 -0.53 116.97 117.43 3m13 h TYR 73 Ca 0.13 -0.08 0.03 0.00 0.05 0.00 0.00 58.73 58.85 3m13 h TYR 73 Cb 0.57 -0.33 -0.03 0.00 1.01 0.00 0.00 36.73 37.95 3m13 h TYR 73 CO 0.04 0.84 0.08 0.93 -1.05 0.00 0.00 178.16 179.01 3m13 h GLU 74 N 1.06 0.19 0.12 4.88 5.08 -0.84 -2.85 114.58 122.22 3m13 h GLU 74 Ca 0.24 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.61 3m13 h GLU 74 Cb 0.21 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 3m13 h GLU 74 CO -0.02 0.12 -0.21 1.25 -1.00 0.00 0.00 179.01 179.16 3m13 h LEU 75 N 0.19 -0.58 -0.97 1.33 5.85 -0.27 -2.13 115.31 118.73 3m13 h LEU 75 Ca 0.11 0.07 0.34 0.00 0.84 0.00 0.00 57.88 59.23 3m13 h LEU 75 Cb 0.08 0.22 -0.18 0.00 0.37 0.00 0.00 40.66 41.15 3m13 h LEU 75 CO -0.11 -0.29 0.27 1.21 -0.34 0.00 0.00 178.44 179.17 3m13 n GLU 76 N -5.33 -0.07 0.16 1.25 4.07 -0.23 -0.70 120.64 119.79 3m13 n GLU 76 Ca -0.07 1.40 0.02 0.00 -0.06 0.00 0.00 57.16 58.45 3m13 n GLU 76 Cb 0.25 -2.36 0.24 0.00 -0.06 0.00 0.00 31.44 29.51 3m13 n GLU 76 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 3m13 h LYS 77 N 0.00 0.00 0.00 5.31 1.57 -1.16 -3.32 116.57 118.97 3m13 h LYS 77 Ca 0.71 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.49 3m13 h LYS 77 Cb 1.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.00 3m13 h LYS 77 CO -0.83 0.51 -0.75 0.93 -0.57 0.00 0.00 179.45 178.74 3m13 h GLU 78 N 0.00 0.00 -5.33 3.15 5.08 -0.51 -3.48 114.58 113.48 3m13 h GLU 78 Ca -0.01 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.91 3m13 h GLU 78 Cb 1.00 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.11 3m13 h GLU 78 CO 0.07 0.00 -0.67 -0.08 -1.00 0.00 0.00 179.01 177.33 3m13 s THR 79 N -3.28 1.40 -1.05 1.13 -1.32 -1.13 -5.04 115.64 106.35 3m13 s THR 79 Ca 0.03 -2.09 0.24 0.00 -1.21 0.00 0.00 61.69 58.66 3m13 s THR 79 Cb 0.10 -2.40 -0.04 0.00 -1.51 0.00 0.00 72.50 68.65 3m13 s THR 79 CO 0.75 -0.32 1.28 0.00 -2.21 0.00 0.00 174.62 174.13 3m13 n HIS 80 N -0.51 0.00 -2.52 9.09 1.44 -1.26 -4.88 115.22 116.58 3m13 n HIS 80 Ca -0.05 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.30 3m13 n HIS 80 Cb 0.64 -0.17 -0.04 0.00 0.12 0.00 0.00 29.99 30.53 3m13 n HIS 80 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 3m13 s HIS 81 N -2.97 3.17 0.05 -1.40 3.76 -1.26 -5.01 115.29 111.63 3m13 s HIS 81 Ca 0.11 1.62 -0.28 0.00 -0.15 0.00 0.00 55.06 56.36 3m13 s HIS 81 Cb 0.17 -3.14 -0.05 0.00 1.11 0.00 0.00 32.58 30.68 3m13 s HIS 81 CO 0.73 -0.75 0.89 0.21 -0.85 0.00 0.00 174.74 174.97 3m13 s LYS 82 N -2.67 4.58 -0.17 1.40 2.47 -1.26 -4.86 119.74 119.23 3m13 s LYS 82 Ca 0.60 1.29 -0.05 0.00 -1.56 0.00 0.00 55.97 56.26 3m13 s LYS 82 Cb -0.21 -3.40 -0.09 0.00 -1.46 0.00 0.00 37.83 32.66 3m13 s LYS 82 CO 0.27 0.14 -0.20 -0.89 0.16 0.00 0.00 175.35 174.83 3m13 n ILE 83 N 3.20 0.96 -3.75 5.43 2.08 -1.26 -4.57 119.36 121.45 3m13 n ILE 83 Ca 0.02 -0.29 -0.13 0.00 0.56 0.00 0.00 62.75 62.91 3m13 n ILE 83 Cb 0.50 -1.48 -0.13 0.00 -0.75 0.00 0.00 39.64 37.78 3m13 n ILE 83 CO 0.00 0.00 0.00 0.12 0.56 0.00 0.00 176.55 177.23 3m13 s PHE 84 N -2.33 -0.30 -0.10 1.39 2.19 -1.26 -0.81 117.98 116.77 3m13 s PHE 84 Ca -0.24 0.72 0.04 0.00 0.33 0.00 0.00 56.93 57.78 3m13 s PHE 84 Cb 0.08 0.05 -0.00 0.00 -1.31 0.00 0.00 43.02 41.84 3m13 s PHE 84 CO 0.34 -0.20 -0.23 0.99 1.83 0.00 0.00 175.22 177.95 3m13 s THR 85 N 0.95 2.17 -1.28 0.12 2.01 0.22 -4.99 115.64 114.83 3m13 s THR 85 Ca -0.07 -0.98 -0.16 0.00 0.31 0.00 0.00 61.69 60.79 3m13 s THR 85 Cb -0.08 -1.83 0.10 0.00 0.01 0.00 0.00 72.50 70.70 3m13 s THR 85 CO -0.06 0.56 1.69 1.17 -0.69 0.00 0.00 174.62 177.29 3m13 n LYS 86 N 3.52 3.25 0.15 4.92 4.81 -1.26 -0.42 118.16 133.13 3m13 n LYS 86 Ca -0.19 -3.42 0.08 0.00 -0.87 0.00 0.00 58.31 53.91 3m13 n LYS 86 Cb 0.53 -3.31 0.07 0.00 0.02 0.00 0.00 35.03 32.34 3m13 n LYS 86 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 3m13 h THR 87 N 5.06 0.29 0.00 3.15 1.35 -1.86 -3.47 112.91 117.41 3m13 h THR 87 Ca 0.42 -1.44 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 3m13 h THR 87 Cb 0.84 2.01 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 3m13 h THR 87 CO 1.44 0.16 0.00 0.61 -0.25 0.00 0.00 175.52 177.48 3m13 n GLY 88 N 1.18 -0.78 2.92 5.82 0.00 -0.08 -4.43 105.19 109.82 3m13 n GLY 88 Ca 0.01 -1.55 -0.25 0.00 0.00 0.00 0.00 46.02 44.23 3m13 n GLY 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m13 s VAL 89 N -3.11 0.94 -0.22 1.61 1.01 -0.54 -1.57 120.40 118.53 3m13 s VAL 89 Ca 0.00 -0.28 -0.09 0.00 0.00 0.00 0.00 61.98 61.61 3m13 s VAL 89 Cb 0.00 -0.95 -0.05 0.00 0.00 0.00 0.00 36.38 35.39 3m13 s VAL 89 CO 0.00 0.34 0.12 -0.22 0.00 0.00 0.00 175.10 175.34 3m13 s LEU 90 N 1.40 3.99 -0.21 3.92 2.96 -0.10 -0.50 118.68 130.14 3m13 s LEU 90 Ca -0.01 0.09 -0.01 0.00 -0.22 0.00 0.00 54.13 53.98 3m13 s LEU 90 Cb -0.13 -2.05 0.01 0.00 0.50 0.00 0.00 46.19 44.52 3m13 s LEU 90 CO -0.04 0.11 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.29 3m13 s VAL 91 N 0.80 2.71 0.12 1.68 1.01 -0.52 -1.02 120.40 125.18 3m13 s VAL 91 Ca 0.06 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.27 3m13 s VAL 91 Cb -0.13 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.97 3m13 s VAL 91 CO 0.02 0.41 -0.10 0.72 0.00 0.00 0.00 175.10 176.16 3m13 s PHE 92 N 1.36 1.14 0.20 5.22 -0.12 -1.25 -0.55 117.98 123.98 3m13 s PHE 92 Ca 0.04 -0.75 -0.22 0.00 -0.05 0.00 0.00 56.93 55.95 3m13 s PHE 92 Cb -0.14 -0.60 0.07 0.00 -0.63 0.00 0.00 43.02 41.71 3m13 s PHE 92 CO -0.07 0.02 0.98 0.20 -0.05 0.00 0.00 175.22 176.29 3m13 s GLY 93 N -2.91 0.04 0.10 1.99 0.00 -0.67 -0.37 107.32 105.50 3m13 s GLY 93 Ca 0.12 -0.25 -0.31 0.00 0.00 0.00 0.00 44.72 44.28 3m13 s GLY 93 CO -0.00 1.25 1.53 -4.14 0.00 0.00 0.00 173.10 171.74 3m13 s PRO 94 N -2.56 4.24 0.26 2.90 0.02 -1.25 -1.26 135.00 137.35 3m13 s PRO 94 Ca 0.18 2.23 -0.30 0.00 0.02 0.00 0.00 61.00 63.12 3m13 s PRO 94 Cb -0.03 -3.39 -0.14 0.00 0.02 0.00 0.00 34.50 30.97 3m13 s PRO 94 CO 0.05 -0.61 1.31 1.17 -0.33 0.00 0.00 177.00 178.59 3m13 n LYS 95 N 4.72 1.86 0.00 5.54 4.81 0.24 -1.35 118.16 133.98 3m13 n LYS 95 Ca 0.14 0.66 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 3m13 n LYS 95 Cb 0.41 -2.25 0.00 0.00 0.02 0.00 0.00 35.03 33.21 3m13 n LYS 95 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3m13 n GLY 96 N 1.75 1.97 1.72 3.14 0.00 -1.26 -4.82 105.19 107.70 3m13 n GLY 96 Ca 0.10 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.96 3m13 n GLY 96 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3m13 n GLU 97 N -1.41 2.23 -3.37 1.61 1.02 -0.46 -4.85 120.64 115.41 3m13 n GLU 97 Ca 0.00 -3.25 -0.11 0.00 -0.02 0.00 0.00 57.16 53.78 3m13 n GLU 97 Cb 0.00 -2.03 -0.09 0.00 -0.02 0.00 0.00 31.44 29.30 3m13 n GLU 97 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3m13 s SER 98 N -2.18 0.50 0.27 1.62 0.15 -1.25 -4.69 113.70 108.12 3m13 s SER 98 Ca 0.52 0.07 -0.02 0.00 0.70 0.00 0.00 55.95 57.21 3m13 s SER 98 Cb 0.44 0.97 0.36 0.00 -1.71 0.00 0.00 66.02 66.08 3m13 s SER 98 CO 0.03 -0.31 1.81 0.00 1.20 0.00 0.00 173.24 175.97 3m13 h ALA 99 N 8.21 1.17 0.04 5.45 0.00 -1.97 -2.04 119.26 130.12 3m13 h ALA 99 Ca -0.18 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.54 3m13 h ALA 99 Cb 1.15 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 3m13 h ALA 99 CO 0.28 0.56 -0.47 0.35 0.00 0.00 0.00 179.25 179.97 3m13 h PHE 100 N 0.84 -1.35 -0.18 0.00 3.57 -1.99 0.79 116.94 118.61 3m13 h PHE 100 Ca 0.18 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.77 3m13 h PHE 100 Cb 0.31 0.58 -0.05 0.00 2.79 0.00 0.00 35.95 39.59 3m13 h PHE 100 CO 0.02 -0.54 -0.12 0.28 -2.23 0.00 0.00 178.31 175.72 3m13 h VAL 101 N -0.65 0.65 -0.25 1.41 2.07 -1.90 -1.51 116.25 116.06 3m13 h VAL 101 Ca 0.03 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.58 3m13 h VAL 101 Cb 0.70 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 3m13 h VAL 101 CO -0.31 0.00 0.05 0.00 0.02 0.00 0.00 177.57 177.33 3m13 h ALA 102 N 1.03 0.26 -0.69 1.67 0.00 -1.16 -0.55 119.26 119.82 3m13 h ALA 102 Ca 0.11 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 3m13 h ALA 102 Cb 0.28 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3m13 h ALA 102 CO -0.26 -0.37 0.17 0.93 0.00 0.00 0.00 179.25 179.73 3m13 h GLU 103 N 0.14 1.09 -0.15 0.00 5.08 -0.66 -0.60 114.58 119.47 3m13 h GLU 103 Ca 0.12 -0.25 0.05 0.00 -1.00 0.00 0.00 59.36 58.27 3m13 h GLU 103 Cb 0.12 -0.15 -0.06 0.00 0.50 0.00 0.00 28.75 29.15 3m13 h GLU 103 CO -0.15 0.96 -0.30 1.15 -1.00 0.00 0.00 179.01 179.66 3m13 h THR 104 N 1.04 0.31 -0.72 1.13 2.02 -0.54 0.17 112.91 116.30 3m13 h THR 104 Ca 0.22 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.43 3m13 h THR 104 Cb 0.36 0.31 -0.04 0.00 -1.74 0.00 0.00 68.15 67.03 3m13 h THR 104 CO 0.00 0.00 0.45 0.24 0.37 0.00 0.00 175.52 176.59 3m13 h MET 105 N -0.37 0.86 -0.33 6.66 2.86 -0.86 -0.84 114.93 122.91 3m13 h MET 105 Ca 0.10 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.71 3m13 h MET 105 Cb 0.53 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 3m13 h MET 105 CO -0.36 0.57 0.19 0.93 1.06 0.00 0.00 176.91 179.30 3m13 h GLU 106 N 0.89 0.37 -0.34 1.72 4.39 -0.78 -2.01 114.58 118.82 3m13 h GLU 106 Ca 0.29 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.93 3m13 h GLU 106 Cb 0.02 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 3m13 h GLU 106 CO -0.11 0.25 0.06 0.00 -1.16 0.00 0.00 179.01 178.05 3m13 h ALA 107 N 1.15 1.48 -0.16 3.43 0.00 0.65 -0.07 119.26 125.75 3m13 h ALA 107 Ca 0.13 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 3m13 h ALA 107 Cb 0.01 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 3m13 h ALA 107 CO -0.07 0.38 -0.15 0.00 0.00 0.00 0.00 179.25 179.41 3m13 h ALA 108 N 1.59 0.23 -0.26 0.00 0.00 -1.08 -2.15 119.26 117.60 3m13 h ALA 108 Ca 0.11 -0.33 0.03 0.00 0.00 0.00 0.00 54.91 54.73 3m13 h ALA 108 Cb 0.22 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3m13 h ALA 108 CO -0.00 0.11 0.08 -0.22 0.00 0.00 0.00 179.25 179.22 3m13 h LYS 109 N 0.01 0.18 0.00 0.00 3.64 -1.11 0.24 116.57 119.53 3m13 h LYS 109 Ca 0.03 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.34 3m13 h LYS 109 Cb 0.68 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.45 3m13 h LYS 109 CO 0.04 0.12 -0.25 1.49 -2.27 0.00 0.00 179.45 178.58 3m13 h GLU 110 N 0.19 0.00 -0.36 1.90 4.81 -0.87 -1.46 114.58 118.78 3m13 h GLU 110 Ca 0.11 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 3m13 h GLU 110 Cb 0.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.47 3m13 h GLU 110 CO -0.13 0.25 0.00 0.72 -0.73 0.00 0.00 179.01 179.12 3m13 n HIS 111 N -3.72 0.48 -3.78 0.92 8.25 -0.82 -4.97 115.22 111.58 3m13 n HIS 111 Ca -0.01 -0.34 -0.25 0.00 -0.26 0.00 0.00 57.72 56.85 3m13 n HIS 111 Cb 0.36 -0.01 0.02 0.00 1.12 0.00 0.00 29.99 31.48 3m13 n HIS 111 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3m13 n SER 112 N 0.99 -2.07 -4.83 0.41 7.64 0.63 -4.94 113.62 111.44 3m13 n SER 112 Ca 0.15 -0.94 -0.32 0.00 1.01 0.00 0.00 58.87 58.76 3m13 n SER 112 Cb 0.48 -3.52 -0.03 0.00 -1.01 0.00 0.00 64.21 60.13 3m13 n SER 112 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3m13 s LEU 113 N -6.70 3.65 -0.41 -3.43 1.43 0.03 -5.01 118.68 108.25 3m13 s LEU 113 Ca 0.14 1.63 -0.28 0.00 -1.03 0.00 0.00 54.13 54.60 3m13 s LEU 113 Cb -0.05 -4.52 0.02 0.00 0.03 0.00 0.00 46.19 41.68 3m13 s LEU 113 CO 0.85 -0.66 1.03 -0.89 0.23 0.00 0.00 176.35 176.92 3m13 s THR 114 N -2.53 4.42 0.07 5.49 2.01 -1.26 -4.84 115.64 119.00 3m13 s THR 114 Ca 0.60 1.27 -0.10 0.00 0.31 0.00 0.00 61.69 63.77 3m13 s THR 114 Cb -0.11 -4.46 0.01 0.00 0.01 0.00 0.00 72.50 67.94 3m13 s THR 114 CO 0.30 -0.73 0.22 0.68 -0.69 0.00 0.00 174.62 174.40 3m13 s VAL 115 N 3.89 0.12 -0.10 3.82 -7.23 -1.26 -4.12 120.40 115.52 3m13 s VAL 115 Ca 0.43 -0.98 -0.03 0.00 -1.81 0.00 0.00 61.98 59.58 3m13 s VAL 115 Cb -0.10 -1.14 -0.03 0.00 0.56 0.00 0.00 36.38 35.66 3m13 s VAL 115 CO 0.23 -0.54 0.03 -1.81 -0.31 0.00 0.00 175.10 172.71 3m13 s ASP 116 N -2.51 5.50 -0.17 4.85 -0.00 -0.84 -4.97 116.67 118.53 3m13 s ASP 116 Ca 0.00 0.21 -0.06 0.00 -0.00 0.00 0.00 52.55 52.70 3m13 s ASP 116 Cb 0.02 -1.64 -0.04 0.00 -0.00 0.00 0.00 42.92 41.26 3m13 s ASP 116 CO -0.08 0.37 0.02 -0.76 -0.00 0.00 0.00 175.17 174.72 3m13 s LEU 117 N -0.80 3.60 0.09 1.23 1.43 -1.26 -0.84 118.68 122.12 3m13 s LEU 117 Ca 0.13 0.01 -0.02 0.00 -1.03 0.00 0.00 54.13 53.21 3m13 s LEU 117 Cb -0.12 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.17 3m13 s LEU 117 CO 0.03 0.18 0.02 -1.48 0.23 0.00 0.00 176.35 175.33 3m13 s LEU 118 N 0.34 2.11 0.03 1.79 2.34 -0.82 -5.01 118.68 119.46 3m13 s LEU 118 Ca 0.00 -1.05 -0.05 0.00 0.06 0.00 0.00 54.13 53.09 3m13 s LEU 118 Cb -0.13 0.31 -0.01 0.00 -0.56 0.00 0.00 46.19 45.80 3m13 s LEU 118 CO 0.01 -0.66 0.09 -1.83 -1.06 0.00 0.00 176.35 172.90 3m13 s GLU 119 N -3.97 0.57 0.44 1.48 -1.05 -1.26 -0.78 118.70 114.13 3m13 s GLU 119 Ca 0.14 -0.73 0.00 0.00 -0.15 0.00 0.00 54.97 54.23 3m13 s GLU 119 Cb 0.07 0.22 0.00 0.00 -0.44 0.00 0.00 34.13 33.99 3m13 s GLU 119 CO -0.05 -0.14 0.00 0.41 0.95 0.00 0.00 175.26 176.43 3m13 n GLY 120 N 0.85 2.17 0.30 -3.83 0.00 0.86 -0.74 105.19 104.80 3m13 n GLY 120 Ca -0.19 0.36 0.19 0.00 0.00 0.00 0.00 46.02 46.38 3m13 n GLY 120 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3m13 h ASP 121 N 0.00 0.00 -0.25 1.61 -0.00 -1.86 0.96 116.42 116.88 3m13 h ASP 121 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.03 56.99 3m13 h ASP 121 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 39.31 3m13 h ASP 121 CO 0.00 0.02 0.04 -0.33 -0.00 0.00 0.00 179.24 178.97 3m13 h GLU 122 N 0.00 0.52 0.40 0.28 5.08 -1.34 -1.73 114.58 117.79 3m13 h GLU 122 Ca -0.00 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 3m13 h GLU 122 Cb 0.25 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3m13 h GLU 122 CO 0.00 0.52 -0.19 0.82 -1.00 0.00 0.00 179.01 179.15 3m13 h ILE 123 N 0.50 0.61 -0.22 3.13 2.04 -0.90 -0.92 117.51 121.76 3m13 h ILE 123 Ca 0.11 -0.08 -0.09 0.00 1.00 0.00 0.00 64.86 65.80 3m13 h ILE 123 Cb 0.27 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 3m13 h ILE 123 CO 0.00 0.02 -0.26 0.78 0.00 0.00 0.00 178.15 178.69 3m13 h ASN 124 N -0.59 0.42 -0.26 1.72 -0.26 -1.60 -0.11 115.58 114.90 3m13 h ASN 124 Ca -0.06 -0.14 -0.15 0.00 -0.56 0.00 0.00 56.30 55.39 3m13 h ASN 124 Cb 0.44 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 37.58 3m13 h ASN 124 CO 0.09 0.68 -0.39 0.11 -1.06 0.00 0.00 177.43 176.85 3m13 h LYS 125 N 0.37 0.81 -0.38 0.81 1.57 -1.28 -2.95 116.57 115.51 3m13 h LYS 125 Ca 0.05 -0.42 -0.12 0.00 -1.87 0.00 0.00 60.65 58.29 3m13 h LYS 125 Cb 0.65 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 3m13 h LYS 125 CO 0.05 1.06 -0.22 -0.09 -0.57 0.00 0.00 179.45 179.67 3m13 h ARG 126 N 0.66 0.83 -3.18 3.15 2.43 -0.71 -3.38 114.38 114.19 3m13 h ARG 126 Ca 0.05 -0.38 -0.63 0.00 -0.81 0.00 0.00 59.98 58.22 3m13 h ARG 126 Cb 0.96 -0.02 -0.42 0.00 -0.42 0.00 0.00 29.97 30.08 3m13 h ARG 126 CO 0.09 1.01 -0.60 -1.58 -1.51 0.00 0.00 179.97 177.38 3m13 s TRP 127 N -4.57 3.39 0.31 2.20 0.51 -0.09 -5.08 118.94 115.61 3m13 s TRP 127 Ca -0.12 -3.26 -0.28 0.00 -2.12 0.00 0.00 56.10 50.32 3m13 s TRP 127 Cb 0.10 -2.72 -0.13 0.00 -0.81 0.00 0.00 33.47 29.91 3m13 s TRP 127 CO 0.84 -0.62 1.12 -2.30 -0.51 0.00 0.00 176.95 175.48 3m13 n PRO 128 N 2.40 1.65 0.00 4.98 -0.02 -1.12 -1.70 135.00 141.20 3m13 n PRO 128 Ca 0.14 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 3m13 n PRO 128 Cb 0.34 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 3m13 n PRO 128 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m13 n GLY 129 N 1.04 2.77 3.62 -1.23 0.00 -1.26 -4.76 105.19 105.37 3m13 n GLY 129 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 3m13 n GLY 129 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m13 s ILE 130 N -2.44 5.22 -0.39 -0.61 1.01 -0.69 -4.07 121.20 119.24 3m13 s ILE 130 Ca 0.00 0.14 0.03 0.00 0.00 0.00 0.00 60.65 60.82 3m13 s ILE 130 Cb 0.00 -3.45 0.11 0.00 0.01 0.00 0.00 42.46 39.13 3m13 s ILE 130 CO 0.00 0.32 0.13 0.42 0.00 0.00 0.00 174.94 175.80 3m13 s THR 131 N 1.31 2.14 0.20 2.92 -4.23 0.10 -4.26 115.64 113.83 3m13 s THR 131 Ca 0.07 -2.52 0.07 0.00 -1.18 0.00 0.00 61.69 58.13 3m13 s THR 131 Cb -0.14 -2.55 -0.04 0.00 1.34 0.00 0.00 72.50 71.11 3m13 s THR 131 CO 0.07 -0.69 0.07 0.68 -0.54 0.00 0.00 174.62 174.21 3m13 s VAL 132 N 0.61 3.99 1.00 2.29 -7.23 -1.26 -4.19 120.40 115.61 3m13 s VAL 132 Ca 0.13 -1.43 -0.12 0.00 -1.81 0.00 0.00 61.98 58.75 3m13 s VAL 132 Cb -0.21 -3.06 0.19 0.00 0.56 0.00 0.00 36.38 33.85 3m13 s VAL 132 CO -0.07 -0.20 1.09 -2.84 -0.31 0.00 0.00 175.10 172.77 3m13 s PRO 133 N -3.28 0.45 0.35 4.82 0.02 -1.26 -4.87 135.00 131.23 3m13 s PRO 133 Ca 0.30 0.55 0.27 0.00 0.02 0.00 0.00 61.00 62.13 3m13 s PRO 133 Cb -0.09 -1.74 1.12 0.00 0.02 0.00 0.00 34.50 33.81 3m13 s PRO 133 CO 0.21 -2.72 1.80 0.93 -0.33 0.00 0.00 177.00 176.89 3m13 h GLU 134 N -1.89 0.00 -0.30 5.54 5.08 -1.98 -2.63 114.58 118.40 3m13 h GLU 134 Ca -0.54 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.82 3m13 h GLU 134 Cb 1.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.58 3m13 h GLU 134 CO 0.57 0.00 0.00 0.27 -1.00 0.00 0.00 179.01 178.85 3m13 n ASN 135 N -2.50 1.78 -4.84 1.42 0.23 -1.26 -3.88 115.26 106.21 3m13 n ASN 135 Ca 0.02 -1.93 -0.36 0.00 -0.53 0.00 0.00 54.58 51.77 3m13 n ASN 135 Cb 0.25 -0.20 -0.06 0.00 -2.08 0.00 0.00 39.78 37.69 3m13 n ASN 135 CO 0.00 0.00 0.00 -0.31 -0.93 0.00 0.00 177.26 176.02 3m13 s TYR 136 N -1.60 3.65 0.35 -2.53 1.51 -0.99 0.82 117.35 118.56 3m13 s TYR 136 Ca 0.25 1.07 0.08 0.00 -1.01 0.00 0.00 57.07 57.46 3m13 s TYR 136 Cb 0.13 -2.37 -0.07 0.00 -0.11 0.00 0.00 41.96 39.54 3m13 s TYR 136 CO 0.18 0.48 -0.05 0.54 -1.11 0.00 0.00 175.55 175.59 3m13 s ASN 137 N -1.56 3.52 -0.04 2.29 2.20 -0.39 -0.10 114.94 120.86 3m13 s ASN 137 Ca 0.35 -1.26 -0.14 0.00 -0.94 0.00 0.00 52.86 50.87 3m13 s ASN 137 Cb -0.16 -0.31 0.03 0.00 -2.00 0.00 0.00 41.25 38.80 3m13 s ASN 137 CO 0.18 -0.33 0.31 0.00 -2.94 0.00 0.00 177.10 174.33 3m13 s ALA 138 N -2.75 -0.79 -0.09 3.54 0.00 0.04 -1.68 121.76 120.03 3m13 s ALA 138 Ca 0.33 0.46 0.01 0.00 0.00 0.00 0.00 51.96 52.77 3m13 s ALA 138 Cb 0.05 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.12 3m13 s ALA 138 CO 0.16 -0.24 -0.12 -1.50 0.00 0.00 0.00 175.76 174.07 3m13 s ILE 139 N -0.98 1.19 -0.12 0.00 2.07 0.28 -1.95 121.20 121.69 3m13 s ILE 139 Ca -0.10 -0.47 -0.01 0.00 -1.41 0.00 0.00 60.65 58.66 3m13 s ILE 139 Cb -0.05 -1.12 -0.02 0.00 0.13 0.00 0.00 42.46 41.40 3m13 s ILE 139 CO 0.03 0.38 -0.08 0.12 -1.91 0.00 0.00 174.94 173.49 3m13 s PHE 140 N 1.01 2.93 -0.63 3.50 5.36 -0.02 -1.44 117.98 128.68 3m13 s PHE 140 Ca -0.08 -0.29 -0.04 0.00 -0.96 0.00 0.00 56.93 55.57 3m13 s PHE 140 Cb -0.15 -1.84 0.16 0.00 -0.34 0.00 0.00 43.02 40.85 3m13 s PHE 140 CO -0.01 0.03 0.46 -2.00 -1.46 0.00 0.00 175.22 172.24 3m13 s GLU 141 N -0.03 2.62 0.56 10.12 2.12 0.34 -2.00 118.70 132.43 3m13 s GLU 141 Ca -0.01 -2.50 0.23 0.00 0.36 0.00 0.00 54.97 53.05 3m13 s GLU 141 Cb -0.14 -3.78 1.55 0.00 0.26 0.00 0.00 34.13 32.02 3m13 s GLU 141 CO 0.03 -1.18 2.18 -1.00 -0.54 0.00 0.00 175.26 174.75 3m13 h PRO 142 N 7.11 0.00 -0.28 4.30 0.13 -1.85 -1.33 132.00 140.07 3m13 h PRO 142 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 3m13 h PRO 142 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 3m13 h PRO 142 CO 0.72 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.58 3m13 n ASN 143 N -4.17 2.36 -4.94 1.44 5.03 -1.26 -4.09 115.26 109.63 3m13 n ASN 143 Ca -0.02 -1.85 -0.20 0.00 0.87 0.00 0.00 54.58 53.38 3m13 n ASN 143 Cb 0.14 -0.18 0.06 0.00 -1.02 0.00 0.00 39.78 38.79 3m13 n ASN 143 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 3m13 s SER 144 N -1.45 5.00 0.00 6.41 0.01 -0.99 -4.94 113.70 117.74 3m13 s SER 144 Ca 0.34 -0.63 0.00 0.00 1.31 0.00 0.00 55.95 56.97 3m13 s SER 144 Cb 0.19 0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.45 3m13 s SER 144 CO 0.27 -1.38 0.00 0.61 0.41 0.00 0.00 173.24 173.15 3m13 n GLY 145 N -2.34 0.95 3.06 3.44 0.00 -0.86 -0.91 105.19 108.53 3m13 n GLY 145 Ca 0.14 -0.36 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 3m13 n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m13 s VAL 146 N -1.33 1.20 -0.02 1.61 1.01 0.44 -1.53 120.40 121.79 3m13 s VAL 146 Ca 0.00 -0.55 -0.04 0.00 0.00 0.00 0.00 61.98 61.39 3m13 s VAL 146 Cb 0.00 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 3m13 s VAL 146 CO 0.00 0.36 0.20 -0.76 0.00 0.00 0.00 175.10 174.90 3m13 s LEU 147 N 0.43 4.37 -0.83 3.92 1.43 0.86 -0.61 118.68 128.25 3m13 s LEU 147 Ca -0.11 0.42 -0.14 0.00 -1.03 0.00 0.00 54.13 53.28 3m13 s LEU 147 Cb -0.14 -2.54 0.22 0.00 0.03 0.00 0.00 46.19 43.76 3m13 s LEU 147 CO 0.03 0.28 0.77 -0.36 0.23 0.00 0.00 176.35 177.31 3m13 s PHE 148 N -1.27 3.77 0.33 0.29 0.08 0.01 -1.17 117.98 120.02 3m13 s PHE 148 Ca 0.25 -2.00 0.04 0.00 0.12 0.00 0.00 56.93 55.35 3m13 s PHE 148 Cb -0.13 -3.82 0.57 0.00 -0.57 0.00 0.00 43.02 39.07 3m13 s PHE 148 CO 0.16 -0.99 1.84 0.66 -0.10 0.00 0.00 175.22 176.78 3m13 h SER 149 N 7.77 0.46 -0.31 1.36 4.64 -1.56 0.60 113.55 126.51 3m13 h SER 149 Ca 0.11 -0.10 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 3m13 h SER 149 Cb 1.04 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3m13 h SER 149 CO 0.75 0.59 -0.47 -0.33 -0.87 0.00 0.00 176.83 176.49 3m13 h GLU 150 N 0.46 0.89 -0.93 4.77 5.08 -1.72 -2.30 114.58 120.83 3m13 h GLU 150 Ca 0.09 -0.52 0.04 0.00 -1.00 0.00 0.00 59.36 57.97 3m13 h GLU 150 Cb 0.42 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.66 3m13 h GLU 150 CO 0.02 1.16 0.61 -0.91 -1.00 0.00 0.00 179.01 178.89 3m13 h ASN 151 N 0.71 1.00 -0.14 1.42 4.21 -1.68 -1.65 115.58 119.44 3m13 h ASN 151 Ca 0.04 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.54 3m13 h ASN 151 Cb 1.07 -0.23 -0.01 0.00 -1.12 0.00 0.00 38.32 38.04 3m13 h ASN 151 CO 0.11 0.68 0.09 0.00 -1.29 0.00 0.00 177.43 177.01 3m13 h ILE 153 N 0.17 1.31 -0.70 0.00 2.04 -1.28 0.11 117.51 119.17 3m13 h ILE 153 Ca 0.05 -1.46 0.01 0.00 1.00 0.00 0.00 64.86 64.46 3m13 h ILE 153 Cb 0.00 1.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.73 3m13 h ILE 153 CO -0.01 0.46 0.46 -0.09 0.00 0.00 0.00 178.15 178.97 3m13 h ARG 154 N 0.34 0.91 -0.05 2.37 2.43 -1.19 0.22 114.38 119.41 3m13 h ARG 154 Ca 0.04 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3m13 h ARG 154 Cb 0.85 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 30.19 3m13 h ARG 154 CO 0.07 0.60 0.02 0.00 -1.51 0.00 0.00 179.97 179.15 3m13 h ALA 155 N 1.26 0.06 -0.67 2.80 0.00 -0.57 0.14 119.26 122.29 3m13 h ALA 155 Ca 0.26 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.14 3m13 h ALA 155 Cb -0.10 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.62 3m13 h ALA 155 CO -0.06 -0.37 0.39 1.88 0.00 0.00 0.00 179.25 181.09 3m13 h TYR 156 N -0.06 0.71 -0.61 0.00 0.05 -0.63 0.18 116.97 116.62 3m13 h TYR 156 Ca 0.02 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.74 3m13 h TYR 156 Cb 0.13 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.63 3m13 h TYR 156 CO -0.03 0.37 0.09 -0.09 -1.05 0.00 0.00 178.16 177.45 3m13 h ARG 157 N 0.73 1.02 -0.37 4.88 2.43 -0.18 -0.91 114.38 121.98 3m13 h ARG 157 Ca 0.29 -0.28 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 3m13 h ARG 157 Cb 0.13 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 3m13 h ARG 157 CO -0.15 0.96 0.15 0.93 -1.51 0.00 0.00 179.97 180.35 3m13 h GLU 158 N 0.93 0.55 -0.54 0.20 5.08 -0.46 -0.78 114.58 119.56 3m13 h GLU 158 Ca 0.18 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.39 3m13 h GLU 158 Cb 0.44 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 3m13 h GLU 158 CO 0.01 0.52 0.09 -0.07 -1.00 0.00 0.00 179.01 178.57 3m13 h LEU 159 N 0.45 0.80 -0.09 1.33 3.38 -0.44 -1.88 115.31 118.87 3m13 h LEU 159 Ca 0.12 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 3m13 h LEU 159 Cb 0.18 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3m13 h LEU 159 CO -0.01 0.81 -0.08 0.00 0.09 0.00 0.00 178.44 179.25 3m13 h ALA 160 N 1.29 0.12 -0.70 1.53 0.00 -0.83 -2.89 119.26 117.78 3m13 h ALA 160 Ca 0.17 -0.29 0.06 0.00 0.00 0.00 0.00 54.91 54.86 3m13 h ALA 160 Cb 0.35 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 3m13 h ALA 160 CO 0.01 -0.06 0.39 0.93 0.00 0.00 0.00 179.25 180.52 3m13 h GLU 161 N -0.21 0.69 -0.81 0.00 5.08 -1.13 -1.12 114.58 117.08 3m13 h GLU 161 Ca 0.01 -0.04 0.22 0.00 -1.00 0.00 0.00 59.36 58.55 3m13 h GLU 161 Cb 0.58 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.64 3m13 h GLU 161 CO 0.02 0.46 0.57 0.00 -1.00 0.00 0.00 179.01 179.05 3m13 h ALA 162 N 1.37 2.57 -0.06 3.43 0.00 -1.27 0.50 119.26 125.80 3m13 h ALA 162 Ca 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3m13 h ALA 162 Cb 0.21 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3m13 h ALA 162 CO -0.19 -0.80 0.00 0.54 0.00 0.00 0.00 179.25 178.79 3m13 n ARG 163 N -4.37 1.74 0.00 0.00 5.12 -0.49 -4.91 116.66 113.76 3m13 n ARG 163 Ca 0.17 -1.08 0.00 0.00 -1.93 0.00 0.00 57.85 55.00 3m13 n ARG 163 Cb 0.79 -1.46 0.00 0.00 -1.16 0.00 0.00 32.46 30.63 3m13 n ARG 163 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3m13 n GLY 164 N 1.18 1.04 3.82 -0.13 0.00 0.18 -4.92 105.19 106.37 3m13 n GLY 164 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 3m13 n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m13 s ALA 165 N -2.00 3.08 -0.07 4.61 0.00 -0.83 -4.76 121.76 121.80 3m13 s ALA 165 Ca 0.00 0.34 0.03 0.00 0.00 0.00 0.00 51.96 52.33 3m13 s ALA 165 Cb 0.00 -3.10 -0.02 0.00 0.00 0.00 0.00 23.12 20.00 3m13 s ALA 165 CO 0.00 0.14 -0.14 0.15 0.00 0.00 0.00 175.76 175.92 3m13 s LYS 166 N -3.19 2.72 -0.07 0.00 -0.14 -0.83 -4.22 119.74 114.01 3m13 s LYS 166 Ca 0.61 -0.68 0.05 0.00 -1.36 0.00 0.00 55.97 54.59 3m13 s LYS 166 Cb -0.09 -2.45 -0.01 0.00 -1.68 0.00 0.00 37.83 33.60 3m13 s LYS 166 CO 0.14 0.53 -0.24 0.08 -0.76 0.00 0.00 175.35 175.10 3m13 s VAL 167 N -0.49 2.11 -0.24 3.17 1.01 -1.26 0.30 120.40 124.99 3m13 s VAL 167 Ca 0.06 -1.03 0.02 0.00 0.00 0.00 0.00 61.98 61.03 3m13 s VAL 167 Cb -0.12 -1.78 0.06 0.00 0.00 0.00 0.00 36.38 34.54 3m13 s VAL 167 CO 0.02 0.57 -0.10 -0.22 0.00 0.00 0.00 175.10 175.37 3m13 s LEU 168 N -0.01 3.05 0.40 3.92 2.96 0.02 -4.97 118.68 124.05 3m13 s LEU 168 Ca -0.08 -1.26 0.05 0.00 -0.22 0.00 0.00 54.13 52.62 3m13 s LEU 168 Cb -0.15 -1.42 0.00 0.00 0.50 0.00 0.00 46.19 45.12 3m13 s LEU 168 CO 0.05 -0.19 0.56 0.42 -1.32 0.00 0.00 176.35 175.87 3m13 s THR 169 N 1.22 3.69 -1.45 3.68 -4.23 -1.26 -1.10 115.64 116.19 3m13 s THR 169 Ca -0.07 -0.87 -0.01 0.00 -1.18 0.00 0.00 61.69 59.56 3m13 s THR 169 Cb -0.19 -3.29 0.01 0.00 1.34 0.00 0.00 72.50 70.36 3m13 s THR 169 CO -0.06 -0.14 0.36 1.41 -0.54 0.00 0.00 174.62 175.65 3m13 n HIS 170 N -1.84 -1.58 -3.58 3.99 8.25 -0.28 -4.88 115.22 115.31 3m13 n HIS 170 Ca 0.03 0.72 -0.26 0.00 -0.26 0.00 0.00 57.72 57.95 3m13 n HIS 170 Cb 0.58 -3.53 -0.16 0.00 1.12 0.00 0.00 29.99 28.00 3m13 n HIS 170 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3m13 s THR 171 N -4.00 -0.10 -0.40 1.59 2.01 -0.27 -4.93 115.64 109.54 3m13 s THR 171 Ca 0.04 -0.33 -0.26 0.00 0.31 0.00 0.00 61.69 61.45 3m13 s THR 171 Cb -0.02 -0.69 0.02 0.00 0.01 0.00 0.00 72.50 71.82 3m13 s THR 171 CO 0.91 -0.40 0.94 -0.60 -0.69 0.00 0.00 174.62 174.78 3m13 s ARG 172 N 2.14 3.74 0.29 4.92 3.52 -1.26 -2.61 118.95 129.69 3m13 s ARG 172 Ca 0.04 0.46 -0.29 0.00 -0.13 0.00 0.00 55.73 55.81 3m13 s ARG 172 Cb -0.16 -3.85 -0.10 0.00 -1.56 0.00 0.00 34.95 29.29 3m13 s ARG 172 CO -0.17 -1.06 1.18 0.08 -0.81 0.00 0.00 175.30 174.52 3m13 s VAL 173 N 3.63 3.21 -0.02 7.11 1.01 -1.26 -4.28 120.40 129.80 3m13 s VAL 173 Ca 0.39 1.20 0.01 0.00 0.00 0.00 0.00 61.98 63.57 3m13 s VAL 173 Cb -0.11 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 3m13 s VAL 173 CO 0.22 0.28 -0.00 -0.62 0.00 0.00 0.00 175.10 174.97 3m13 n GLU 174 N 1.17 2.55 -3.76 2.72 1.02 0.19 -4.99 120.64 119.54 3m13 n GLU 174 Ca -0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.06 3m13 n GLU 174 Cb 0.44 -1.04 -0.03 0.00 -0.02 0.00 0.00 31.44 30.79 3m13 n GLU 174 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3m13 s ASP 175 N -3.51 -0.31 -0.02 1.62 2.15 -1.02 -5.00 116.67 110.58 3m13 s ASP 175 Ca -0.01 -0.49 0.02 0.00 0.43 0.00 0.00 52.55 52.50 3m13 s ASP 175 Cb 0.01 0.67 0.00 0.00 -0.30 0.00 0.00 42.92 43.29 3m13 s ASP 175 CO 0.06 -1.21 -0.08 -0.36 -0.17 0.00 0.00 175.17 173.40 3m13 s PHE 176 N -3.89 0.85 -0.25 -5.34 0.08 -1.26 -0.68 117.98 107.49 3m13 s PHE 176 Ca 0.10 -0.19 0.01 0.00 0.12 0.00 0.00 56.93 56.97 3m13 s PHE 176 Cb -0.04 -0.60 0.05 0.00 -0.57 0.00 0.00 43.02 41.86 3m13 s PHE 176 CO 0.02 -0.07 -0.10 -0.51 -0.10 0.00 0.00 175.22 174.45 3m13 s ASP 177 N 0.10 4.27 -0.10 1.36 1.01 0.04 -4.97 116.67 118.38 3m13 s ASP 177 Ca -0.01 -1.19 0.01 0.00 0.71 0.00 0.00 52.55 52.07 3m13 s ASP 177 Cb -0.07 -1.57 -0.02 0.00 1.01 0.00 0.00 42.92 42.27 3m13 s ASP 177 CO 0.00 -0.16 -0.12 -0.63 0.21 0.00 0.00 175.17 174.47 3m13 s ILE 178 N 1.18 3.15 0.23 0.77 -1.09 -1.26 -1.09 121.20 123.09 3m13 s ILE 178 Ca -0.05 -0.65 0.05 0.00 -2.23 0.00 0.00 60.65 57.77 3m13 s ILE 178 Cb -0.18 -2.29 -0.05 0.00 -1.58 0.00 0.00 42.46 38.35 3m13 s ILE 178 CO -0.06 0.55 -0.06 -0.44 -1.23 0.00 0.00 174.94 173.70 3m13 s SER 179 N -0.12 2.24 0.00 3.58 0.01 -0.21 -5.03 113.70 114.17 3m13 s SER 179 Ca -0.01 -1.14 0.14 0.00 1.31 0.00 0.00 55.95 56.25 3m13 s SER 179 Cb -0.14 -0.07 0.61 0.00 0.21 0.00 0.00 66.02 66.63 3m13 s SER 179 CO 0.03 -0.37 1.46 -2.65 0.41 0.00 0.00 173.24 172.12 3m13 n PRO 180 N -0.43 0.00 0.00 12.44 -0.02 -1.26 -3.45 135.00 142.28 3m13 n PRO 180 Ca -0.06 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 3m13 n PRO 180 Cb 0.63 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.60 3m13 n PRO 180 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3m13 n ASP 181 N -1.51 0.04 -3.88 2.55 10.43 -1.26 -4.93 116.55 118.00 3m13 n ASP 181 Ca 0.03 -0.44 -0.09 0.00 2.57 0.00 0.00 54.79 56.86 3m13 n ASP 181 Cb 0.17 0.78 -0.08 0.00 1.84 0.00 0.00 41.12 43.82 3m13 n ASP 181 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 3m13 s SER 182 N -0.78 0.12 0.13 -2.24 0.15 -1.22 -4.76 113.70 105.10 3m13 s SER 182 Ca 0.00 -0.56 0.08 0.00 0.70 0.00 0.00 55.95 56.17 3m13 s SER 182 Cb 0.00 0.30 -0.04 0.00 -1.71 0.00 0.00 66.02 64.57 3m13 s SER 182 CO 0.00 -0.63 -0.19 0.68 1.20 0.00 0.00 173.24 174.30 3m13 s VAL 183 N -3.22 1.70 -0.11 4.45 -7.23 -0.53 -1.04 120.40 114.41 3m13 s VAL 183 Ca 0.00 -1.71 -0.13 0.00 -1.81 0.00 0.00 61.98 58.33 3m13 s VAL 183 Cb 0.02 -1.65 0.03 0.00 0.56 0.00 0.00 36.38 35.34 3m13 s VAL 183 CO -0.07 -0.21 0.35 -0.75 -0.31 0.00 0.00 175.10 174.10 3m13 s LYS 184 N -2.35 0.47 0.14 4.82 2.20 -0.25 -1.57 119.74 123.21 3m13 s LYS 184 Ca 0.10 0.35 0.09 0.00 -0.36 0.00 0.00 55.97 56.15 3m13 s LYS 184 Cb -0.08 0.22 -0.04 0.00 -1.51 0.00 0.00 37.83 36.43 3m13 s LYS 184 CO 0.05 -0.08 -0.21 0.96 -0.36 0.00 0.00 175.35 175.71 3m13 s ILE 185 N -0.13 1.92 -0.04 5.43 -4.36 -0.57 -0.78 121.20 122.67 3m13 s ILE 185 Ca -0.03 -1.78 0.03 0.00 -0.26 0.00 0.00 60.65 58.61 3m13 s ILE 185 Cb -0.03 -1.80 0.00 0.00 1.25 0.00 0.00 42.46 41.88 3m13 s ILE 185 CO 0.01 -0.14 -0.12 -1.61 0.24 0.00 0.00 174.94 173.32 3m13 s GLU 186 N -2.35 1.38 0.26 0.37 2.02 0.14 -2.09 118.70 118.42 3m13 s GLU 186 Ca 0.13 -0.42 0.02 0.00 0.02 0.00 0.00 54.97 54.72 3m13 s GLU 186 Cb -0.08 -1.22 -0.05 0.00 0.10 0.00 0.00 34.13 32.88 3m13 s GLU 186 CO 0.06 0.13 0.06 0.95 0.02 0.00 0.00 175.26 176.49 3m13 s THR 187 N 0.26 0.80 0.20 3.63 -4.23 0.25 0.56 115.64 117.11 3m13 s THR 187 Ca -0.06 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.32 3m13 s THR 187 Cb -0.11 -2.57 0.19 0.00 1.34 0.00 0.00 72.50 71.35 3m13 s THR 187 CO 0.02 -0.11 1.65 0.00 -0.54 0.00 0.00 174.62 175.64 3m13 h ALA 188 N 2.37 0.48 -0.01 3.99 0.00 -1.98 -1.31 119.26 122.79 3m13 h ALA 188 Ca -0.39 0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3m13 h ALA 188 Cb 1.24 0.37 -0.00 0.00 0.00 0.00 0.00 17.79 19.40 3m13 h ALA 188 CO 0.64 -0.42 0.16 -0.91 0.00 0.00 0.00 179.25 178.72 3m13 h ASN 189 N 0.06 0.00 0.00 0.00 -0.26 -1.96 -3.49 115.58 109.93 3m13 h ASN 189 Ca 0.29 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.03 3m13 h ASN 189 Cb 0.46 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.72 3m13 h ASN 189 CO -0.54 0.00 0.00 0.61 -1.06 0.00 0.00 177.43 176.44 3m13 n GLY 190 N -1.16 0.22 3.20 2.83 0.00 -0.50 -5.13 105.19 104.64 3m13 n GLY 190 Ca -0.02 -1.94 -0.13 0.00 0.00 0.00 0.00 46.02 43.93 3m13 n GLY 190 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3m13 s SER 191 N -4.00 -0.14 0.05 1.61 0.01 -1.26 0.87 113.70 110.84 3m13 s SER 191 Ca 0.00 0.04 -0.02 0.00 1.31 0.00 0.00 55.95 57.28 3m13 s SER 191 Cb 0.00 0.30 -0.03 0.00 0.21 0.00 0.00 66.02 66.50 3m13 s SER 191 CO 0.00 -0.40 -0.01 -0.31 0.41 0.00 0.00 173.24 172.93 3m13 s TYR 192 N -1.24 0.45 0.08 2.43 2.02 -0.89 -4.97 117.35 115.24 3m13 s TYR 192 Ca -0.13 -0.94 0.05 0.00 -0.37 0.00 0.00 57.07 55.68 3m13 s TYR 192 Cb -0.06 -0.33 -0.03 0.00 -0.40 0.00 0.00 41.96 41.14 3m13 s TYR 192 CO 0.03 -0.36 -0.14 0.95 -1.57 0.00 0.00 175.55 174.46 3m13 s THR 193 N -3.52 1.13 0.21 -0.71 -4.23 -1.21 -1.51 115.64 105.80 3m13 s THR 193 Ca 0.03 -1.43 -0.05 0.00 -1.18 0.00 0.00 61.69 59.07 3m13 s THR 193 Cb 0.05 -1.19 0.02 0.00 1.34 0.00 0.00 72.50 72.71 3m13 s THR 193 CO -0.09 -0.31 0.36 0.00 -0.54 0.00 0.00 174.62 174.05 3m13 n ALA 194 N 1.04 -0.60 0.05 3.99 0.00 -0.61 0.08 120.51 124.45 3m13 n ALA 194 Ca -0.19 -0.81 -0.07 0.00 0.00 0.00 0.00 53.44 52.37 3m13 n ALA 194 Cb 0.55 0.65 -0.11 0.00 0.00 0.00 0.00 19.45 20.53 3m13 n ALA 194 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3m13 h ASP 195 N 1.11 0.00 -4.76 0.00 3.45 -1.31 -1.40 116.42 113.50 3m13 h ASP 195 Ca -0.17 0.00 -0.16 0.00 0.43 0.00 0.00 57.03 57.13 3m13 h ASP 195 Cb 0.68 0.00 -0.22 0.00 -0.56 0.00 0.00 39.33 39.23 3m13 h ASP 195 CO 0.22 0.96 -0.56 -0.54 -1.57 0.00 0.00 179.24 177.75 3m13 s LYS 196 N -2.71 0.38 -0.01 3.56 -0.14 -1.02 -4.51 119.74 115.29 3m13 s LYS 196 Ca -0.00 -0.36 0.03 0.00 -1.36 0.00 0.00 55.97 54.28 3m13 s LYS 196 Cb 0.09 0.15 -0.01 0.00 -1.68 0.00 0.00 37.83 36.39 3m13 s LYS 196 CO 0.82 -0.08 -0.09 -1.17 -0.76 0.00 0.00 175.35 174.06 3m13 s LEU 197 N -1.15 1.99 -0.08 3.17 2.96 0.04 -1.25 118.68 124.37 3m13 s LEU 197 Ca -0.12 -0.17 0.05 0.00 -0.22 0.00 0.00 54.13 53.66 3m13 s LEU 197 Cb -0.07 -0.49 -0.00 0.00 0.50 0.00 0.00 46.19 46.13 3m13 s LEU 197 CO 0.01 0.11 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.29 3m13 s ILE 198 N -0.17 1.93 -0.25 6.68 1.01 -0.33 0.23 121.20 130.31 3m13 s ILE 198 Ca 0.03 -0.97 0.00 0.00 0.00 0.00 0.00 60.65 59.71 3m13 s ILE 198 Cb -0.04 -1.66 0.04 0.00 0.01 0.00 0.00 42.46 40.81 3m13 s ILE 198 CO -0.00 0.53 -0.09 -0.69 0.00 0.00 0.00 174.94 174.69 3m13 s VAL 199 N 0.15 2.57 -0.41 2.92 1.01 -0.54 -0.26 120.40 125.83 3m13 s VAL 199 Ca -0.12 -1.21 0.07 0.00 0.00 0.00 0.00 61.98 60.73 3m13 s VAL 199 Cb -0.16 -2.34 0.24 0.00 0.00 0.00 0.00 36.38 34.12 3m13 s VAL 199 CO 0.06 0.16 0.58 -1.54 0.00 0.00 0.00 175.10 174.36 3m13 n SER 200 N 4.59 -0.45 -1.09 3.32 3.41 0.79 -1.64 113.62 122.55 3m13 n SER 200 Ca -0.16 -2.79 0.08 0.00 -0.26 0.00 0.00 58.87 55.74 3m13 n SER 200 Cb 0.46 -0.16 0.25 0.00 -0.26 0.00 0.00 64.21 64.49 3m13 n SER 200 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3m13 n MET 201 N 1.53 2.56 0.00 4.33 2.81 -1.24 -4.23 117.12 122.88 3m13 n MET 201 Ca 0.19 -2.00 0.00 0.00 -1.81 0.00 0.00 57.70 54.08 3m13 n MET 201 Cb 0.55 -1.54 0.00 0.00 -0.71 0.00 0.00 33.22 31.51 3m13 n MET 201 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3m13 n GLY 202 N 1.17 2.82 0.37 3.03 0.00 -1.26 -2.19 105.19 109.13 3m13 n GLY 202 Ca 0.18 -0.34 0.20 0.00 0.00 0.00 0.00 46.02 46.06 3m13 n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m13 h ALA 203 N -0.84 2.11 0.00 4.61 0.00 -1.92 -1.19 119.26 122.02 3m13 h ALA 203 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3m13 h ALA 203 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3m13 h ALA 203 CO 0.00 -0.57 0.00 0.91 0.00 0.00 0.00 179.25 179.59 3m13 n TRP 204 N -3.85 0.72 0.11 0.00 8.01 -0.93 -3.01 117.44 118.50 3m13 n TRP 204 Ca 0.06 0.21 0.09 0.00 -1.31 0.00 0.00 57.50 56.56 3m13 n TRP 204 Cb 0.55 -0.85 0.57 0.00 -2.01 0.00 0.00 31.31 29.58 3m13 n TRP 204 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.69 175.77 3m13 h ASN 205 N 0.00 0.17 0.50 -0.99 -0.26 -1.31 0.13 115.58 113.81 3m13 h ASN 205 Ca 0.00 -0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 3m13 h ASN 205 Cb 0.68 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.90 3m13 h ASN 205 CO 0.00 0.11 0.00 0.77 -1.06 0.00 0.00 177.43 177.25 3m13 h SER 206 N 0.19 0.00 0.00 5.81 4.64 -1.72 -2.42 113.55 120.05 3m13 h SER 206 Ca 0.11 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.14 3m13 h SER 206 Cb 0.20 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.23 3m13 h SER 206 CO -0.02 0.00 -2.10 0.29 -0.87 0.00 0.00 176.83 174.14 3m13 n LYS 207 N -2.81 1.18 0.00 4.77 5.02 0.25 -4.73 118.16 121.83 3m13 n LYS 207 Ca -0.01 0.03 0.06 0.00 -2.02 0.00 0.00 58.31 56.37 3m13 n LYS 207 Cb 0.18 -1.40 -0.03 0.00 -0.02 0.00 0.00 35.03 33.75 3m13 n LYS 207 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3m13 n LEU 208 N -2.72 1.06 0.25 -0.35 4.32 -0.07 -4.35 117.00 115.14 3m13 n LEU 208 Ca -0.28 -0.65 0.17 0.00 -0.02 0.00 0.00 56.01 55.23 3m13 n LEU 208 Cb 0.97 0.00 0.70 0.00 -1.62 0.00 0.00 43.42 43.47 3m13 n LEU 208 CO 0.30 0.22 0.98 -0.07 -1.22 0.00 0.00 177.39 177.60 3m13 h LEU 209 N 0.82 0.00 -1.01 2.23 3.38 -1.66 -2.64 115.31 116.44 3m13 h LEU 209 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3m13 h LEU 209 Cb 0.38 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 3m13 h LEU 209 CO 0.00 0.00 0.11 0.77 0.09 0.00 0.00 178.44 179.41 3m13 h SER 210 N 0.00 0.78 0.00 -0.43 4.64 -1.75 0.71 113.55 117.50 3m13 h SER 210 Ca 0.00 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 3m13 h SER 210 Cb 0.41 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 3m13 h SER 210 CO 0.00 0.77 0.02 0.29 -0.87 0.00 0.00 176.83 177.05 3m13 n LYS 211 N -4.26 0.00 -0.20 4.77 4.76 -0.99 0.10 118.16 122.33 3m13 n LYS 211 Ca 0.04 0.34 0.06 0.00 -2.87 0.00 0.00 58.31 55.88 3m13 n LYS 211 Cb 0.24 -1.52 0.15 0.00 -1.84 0.00 0.00 35.03 32.06 3m13 n LYS 211 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3m13 n LEU 212 N -1.33 2.93 -1.58 -0.35 4.77 0.21 -4.48 117.00 117.17 3m13 n LEU 212 Ca 0.00 -2.47 -0.11 0.00 -0.03 0.00 0.00 56.01 53.41 3m13 n LEU 212 Cb 0.02 -0.31 0.02 0.00 -2.33 0.00 0.00 43.42 40.82 3m13 n LEU 212 CO 0.00 0.66 -0.00 -3.20 -1.33 0.00 0.00 177.39 173.52 3m13 n ASN 213 N -0.30 -3.75 -4.33 -1.43 4.05 0.28 -4.99 115.26 104.79 3m13 n ASN 213 Ca 0.13 -0.14 -0.32 0.00 0.45 0.00 0.00 54.58 54.70 3m13 n ASN 213 Cb 0.56 -2.65 -0.15 0.00 1.23 0.00 0.00 39.78 38.76 3m13 n ASN 213 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 3m13 s LEU 214 N -3.48 2.27 -0.31 1.20 1.43 -1.03 -5.01 118.68 113.75 3m13 s LEU 214 Ca 0.15 -0.42 0.02 0.00 -1.03 0.00 0.00 54.13 52.85 3m13 s LEU 214 Cb -0.06 -1.43 0.09 0.00 0.03 0.00 0.00 46.19 44.82 3m13 s LEU 214 CO 0.18 0.27 0.03 -0.62 0.23 0.00 0.00 176.35 176.44 3m13 s ASP 215 N -0.31 4.42 -0.09 2.29 -1.08 -1.26 -3.44 116.67 117.21 3m13 s ASP 215 Ca 0.01 -1.81 -0.01 0.00 -0.52 0.00 0.00 52.55 50.22 3m13 s ASP 215 Cb -0.13 -1.38 0.03 0.00 -1.46 0.00 0.00 42.92 39.99 3m13 s ASP 215 CO 0.02 -0.35 -0.01 -0.63 0.52 0.00 0.00 175.17 174.73 3m13 s ILE 216 N 1.16 0.52 -0.11 4.11 1.01 -1.26 -5.05 121.20 121.59 3m13 s ILE 216 Ca 0.06 -0.02 -0.29 0.00 0.00 0.00 0.00 60.65 60.40 3m13 s ILE 216 Cb -0.19 -0.68 -0.07 0.00 0.01 0.00 0.00 42.46 41.53 3m13 s ILE 216 CO -0.11 0.24 2.11 -2.65 0.00 0.00 0.00 174.94 174.52 3m13 n PRO 217 N 5.10 2.32 -3.64 2.79 -0.02 -1.26 -4.97 135.00 135.32 3m13 n PRO 217 Ca -0.08 0.75 -0.27 0.00 -2.02 0.00 0.00 63.50 61.88 3m13 n PRO 217 Cb 0.50 -3.09 -0.16 0.00 -0.02 0.00 0.00 33.50 30.73 3m13 n PRO 217 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3m13 s LEU 218 N 6.49 0.77 -0.35 2.45 1.43 -1.26 -4.16 118.68 124.04 3m13 s LEU 218 Ca 0.96 -0.89 -0.16 0.00 -1.03 0.00 0.00 54.13 53.01 3m13 s LEU 218 Cb -0.41 -0.41 -0.01 0.00 0.03 0.00 0.00 46.19 45.39 3m13 s LEU 218 CO 0.39 -0.36 0.39 -1.58 0.23 0.00 0.00 176.35 175.43 3m13 s GLN 219 N 2.01 3.50 0.28 1.70 2.00 -0.18 -4.70 119.66 124.27 3m13 s GLN 219 Ca 0.03 -0.44 -0.29 0.00 -2.00 0.00 0.00 55.36 52.66 3m13 s GLN 219 Cb -0.16 -3.83 -0.10 0.00 0.80 0.00 0.00 33.01 29.72 3m13 s GLN 219 CO -0.16 -0.59 1.18 -1.25 -0.50 0.00 0.00 175.29 173.98 3m13 s PRO 220 N 2.08 4.53 0.11 1.67 0.04 -1.26 -0.80 135.00 141.36 3m13 s PRO 220 Ca 0.13 1.95 0.07 0.00 0.04 0.00 0.00 61.00 63.18 3m13 s PRO 220 Cb -0.16 -3.16 -0.04 0.00 0.04 0.00 0.00 34.50 31.18 3m13 s PRO 220 CO 0.12 0.04 -0.17 0.71 0.04 0.00 0.00 177.00 177.74 3m13 s TYR 221 N -0.96 1.52 -0.35 0.56 2.02 0.29 -2.01 117.35 118.42 3m13 s TYR 221 Ca 0.47 -0.48 -0.15 0.00 -0.37 0.00 0.00 57.07 56.54 3m13 s TYR 221 Cb -0.35 -0.81 -0.01 0.00 -0.40 0.00 0.00 41.96 40.39 3m13 s TYR 221 CO 0.44 0.16 0.37 0.50 -1.57 0.00 0.00 175.55 175.45 3m13 s ARG 222 N -2.22 3.54 -0.17 -0.62 3.52 0.39 -1.96 118.95 121.43 3m13 s ARG 222 Ca 0.06 -0.43 0.01 0.00 -0.13 0.00 0.00 55.73 55.24 3m13 s ARG 222 Cb -0.08 -3.81 0.03 0.00 -1.56 0.00 0.00 34.95 29.53 3m13 s ARG 222 CO 0.04 -0.54 -0.14 -0.65 -0.81 0.00 0.00 175.30 173.19 3m13 s GLN 223 N 2.02 2.38 0.34 5.12 -1.52 0.14 -3.41 119.66 124.73 3m13 s GLN 223 Ca 0.12 -0.72 0.07 0.00 -1.95 0.00 0.00 55.36 52.88 3m13 s GLN 223 Cb -0.17 -2.31 -0.01 0.00 -0.22 0.00 0.00 33.01 30.30 3m13 s GLN 223 CO 0.12 -0.29 0.47 0.14 -0.25 0.00 0.00 175.29 175.48 3m13 s VAL 224 N 1.41 4.03 -0.03 1.09 -7.23 -1.26 -0.13 120.40 118.28 3m13 s VAL 224 Ca 0.03 -1.00 -0.01 0.00 -1.81 0.00 0.00 61.98 59.19 3m13 s VAL 224 Cb -0.14 -3.39 0.03 0.00 0.56 0.00 0.00 36.38 33.44 3m13 s VAL 224 CO -0.10 -0.15 0.05 -0.69 -0.31 0.00 0.00 175.10 173.89 3m13 s VAL 225 N -2.18 -0.07 -0.01 1.32 1.01 -0.72 -4.25 120.40 115.50 3m13 s VAL 225 Ca 0.45 0.24 -0.02 0.00 0.00 0.00 0.00 61.98 62.66 3m13 s VAL 225 Cb -0.09 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.14 3m13 s VAL 225 CO 0.31 0.10 0.12 -0.83 0.00 0.00 0.00 175.10 174.80 3m13 s GLY 226 N 1.24 2.08 -0.22 4.51 0.00 -0.23 -0.94 107.32 113.76 3m13 s GLY 226 Ca -0.07 -0.82 -0.04 0.00 0.00 0.00 0.00 44.72 43.79 3m13 s GLY 226 CO -0.03 -0.69 -0.02 -1.36 0.00 0.00 0.00 173.10 171.00 3m13 s PHE 227 N -1.23 2.99 -0.02 1.90 2.99 0.52 -1.67 117.98 123.46 3m13 s PHE 227 Ca 0.24 -0.75 0.05 0.00 0.00 0.00 0.00 56.93 56.46 3m13 s PHE 227 Cb -0.12 -2.11 -0.03 0.00 0.00 0.00 0.00 43.02 40.76 3m13 s PHE 227 CO 0.15 -0.45 -0.15 -0.06 -0.00 0.00 0.00 175.22 174.71 3m13 s PHE 228 N 1.37 2.66 0.27 0.36 0.08 -0.00 -0.01 117.98 122.71 3m13 s PHE 228 Ca 0.05 -0.19 -0.30 0.00 0.12 0.00 0.00 56.93 56.61 3m13 s PHE 228 Cb -0.14 -1.57 -0.10 0.00 -0.57 0.00 0.00 43.02 40.63 3m13 s PHE 228 CO -0.01 0.21 1.46 -2.00 -0.10 0.00 0.00 175.22 174.78 3m13 s GLU 229 N -0.98 4.24 0.03 0.44 2.56 -0.07 -1.85 118.70 123.07 3m13 s GLU 229 Ca 0.13 2.36 -0.01 0.00 0.00 0.00 0.00 54.97 57.45 3m13 s GLU 229 Cb -0.11 -3.08 -0.02 0.00 2.00 0.00 0.00 34.13 32.92 3m13 s GLU 229 CO 0.02 -0.45 -0.00 -1.12 -0.56 0.00 0.00 175.26 173.16 3m13 s SER 230 N 0.28 0.28 -0.62 -1.70 0.01 -1.26 -2.00 113.70 108.69 3m13 s SER 230 Ca 0.59 -0.61 -0.27 0.00 1.31 0.00 0.00 55.95 56.98 3m13 s SER 230 Cb -0.43 0.15 -0.02 0.00 0.21 0.00 0.00 66.02 65.93 3m13 s SER 230 CO 0.46 -0.41 1.82 -0.62 0.41 0.00 0.00 173.24 174.91 3m13 s ASP 231 N -1.90 5.33 0.51 2.44 3.68 -0.11 -4.87 116.67 121.75 3m13 s ASP 231 Ca -0.09 0.30 0.23 0.00 2.13 0.00 0.00 52.55 55.12 3m13 s ASP 231 Cb -0.04 -2.53 1.33 0.00 -1.45 0.00 0.00 42.92 40.23 3m13 s ASP 231 CO -0.03 -2.34 2.00 -0.33 0.13 0.00 0.00 175.17 174.60 3m13 h GLU 232 N 14.64 0.06 0.00 4.34 4.39 -1.95 0.12 114.58 136.18 3m13 h GLU 232 Ca -0.26 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.43 3m13 h GLU 232 Cb 1.16 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 3m13 h GLU 232 CO 1.22 0.04 0.00 -1.13 -1.16 0.00 0.00 179.01 177.98 3m13 n SER 233 N -4.40 0.20 0.00 1.42 3.41 -1.26 -3.14 113.62 109.84 3m13 n SER 233 Ca 0.09 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.26 3m13 n SER 233 Cb 0.55 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 3m13 n SER 233 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3m13 n LYS 234 N -1.73 0.84 -0.11 4.33 5.02 0.22 -4.87 118.16 121.86 3m13 n LYS 234 Ca 0.02 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.41 3m13 n LYS 234 Cb 0.13 -0.89 0.15 0.00 -0.02 0.00 0.00 35.03 34.41 3m13 n LYS 234 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3m13 n TYR 235 N -2.11 0.29 -2.23 2.13 4.02 -0.09 -4.47 117.16 114.71 3m13 n TYR 235 Ca 0.00 -0.18 -0.39 0.00 -0.01 0.00 0.00 57.90 57.32 3m13 n TYR 235 Cb 0.39 -0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.69 3m13 n TYR 235 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 3m13 s SER 236 N -1.42 6.53 0.45 7.72 0.15 -1.19 -0.65 113.70 125.29 3m13 s SER 236 Ca 0.30 2.45 0.12 0.00 0.70 0.00 0.00 55.95 59.52 3m13 s SER 236 Cb 0.18 -2.62 1.03 0.00 -1.71 0.00 0.00 66.02 62.90 3m13 s SER 236 CO 0.26 -0.68 2.04 -1.13 1.20 0.00 0.00 173.24 174.93 3m13 h ASN 237 N 2.78 0.32 0.21 5.45 -1.24 -1.22 -2.25 115.58 119.62 3m13 h ASN 237 Ca -0.49 -0.00 -0.02 0.00 0.71 0.00 0.00 56.30 56.50 3m13 h ASN 237 Cb 1.24 -0.07 -0.00 0.00 0.73 0.00 0.00 38.32 40.21 3m13 h ASN 237 CO 0.63 0.21 -0.10 0.44 -1.29 0.00 0.00 177.43 177.33 3m13 h ASP 238 N 0.37 0.00 -0.55 1.15 3.45 -1.91 0.14 116.42 119.06 3m13 h ASP 238 Ca 0.18 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.64 3m13 h ASP 238 Cb 0.25 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.02 3m13 h ASP 238 CO -0.04 0.10 0.00 0.00 -1.57 0.00 0.00 179.24 177.72 3m13 n ILE 239 N -3.90 2.22 -1.78 0.35 0.13 -0.95 -4.95 119.36 110.48 3m13 n ILE 239 Ca -0.02 -1.21 -0.17 0.00 -1.10 0.00 0.00 62.75 60.25 3m13 n ILE 239 Cb 0.19 -0.16 -0.05 0.00 -0.84 0.00 0.00 39.64 38.78 3m13 n ILE 239 CO 0.00 0.00 0.00 0.47 2.80 0.00 0.00 176.55 179.82 3m13 n ASP 240 N 0.74 -5.03 -4.69 9.51 8.00 0.48 -4.96 116.55 120.59 3m13 n ASP 240 Ca 0.25 0.27 -0.44 0.00 0.71 0.00 0.00 54.79 55.57 3m13 n ASP 240 Cb 1.02 -4.07 -0.04 0.00 -0.02 0.00 0.00 41.12 38.01 3m13 n ASP 240 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3m13 n PHE 241 N -3.03 2.46 -2.52 1.24 -0.00 -0.89 -4.97 117.46 109.76 3m13 n PHE 241 Ca -0.18 0.18 -0.29 0.00 -0.00 0.00 0.00 57.45 57.16 3m13 n PHE 241 Cb 0.59 -2.60 -0.00 0.00 -0.00 0.00 0.00 39.48 37.47 3m13 n PHE 241 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 3m13 s PRO 242 N 1.02 3.60 0.79 -7.13 0.04 -1.26 -4.45 135.00 127.61 3m13 s PRO 242 Ca 0.77 0.36 -0.11 0.00 0.04 0.00 0.00 61.00 62.06 3m13 s PRO 242 Cb -0.61 -2.32 0.07 0.00 0.04 0.00 0.00 34.50 31.68 3m13 s PRO 242 CO 0.36 -0.25 1.12 0.20 0.04 0.00 0.00 177.00 178.47 3m13 s GLY 243 N -3.95 1.82 0.08 0.56 0.00 -0.61 -3.81 107.32 101.41 3m13 s GLY 243 Ca 0.50 0.47 -0.13 0.00 0.00 0.00 0.00 44.72 45.55 3m13 s GLY 243 CO 0.44 0.84 0.31 -0.11 0.00 0.00 0.00 173.10 174.58 3m13 s PHE 244 N -2.65 -0.07 -0.23 1.90 -0.71 -0.24 -0.92 117.98 115.06 3m13 s PHE 244 Ca 0.65 -0.19 -0.07 0.00 -1.04 0.00 0.00 56.93 56.28 3m13 s PHE 244 Cb -0.21 0.11 0.11 0.00 -1.21 0.00 0.00 43.02 41.82 3m13 s PHE 244 CO 0.53 -0.58 0.47 1.41 -1.34 0.00 0.00 175.22 175.71 3m13 s MET 245 N -3.29 0.38 0.06 1.99 1.75 -0.18 -1.91 119.30 118.10 3m13 s MET 245 Ca 0.00 1.07 0.02 0.00 -1.25 0.00 0.00 55.69 55.53 3m13 s MET 245 Cb 0.02 0.38 -0.03 0.00 2.84 0.00 0.00 34.83 38.03 3m13 s MET 245 CO -0.08 -0.29 -0.07 0.14 -0.65 0.00 0.00 175.02 174.07 3m13 s VAL 246 N 2.67 0.54 -0.25 10.11 -7.23 -0.34 -3.83 120.40 122.08 3m13 s VAL 246 Ca -0.00 -1.34 -0.03 0.00 -1.81 0.00 0.00 61.98 58.80 3m13 s VAL 246 Cb -0.12 -0.93 0.02 0.00 0.56 0.00 0.00 36.38 35.91 3m13 s VAL 246 CO -0.15 -0.55 -0.03 -0.70 -0.31 0.00 0.00 175.10 173.36 3m13 s GLU 247 N -2.30 2.97 0.52 4.82 2.12 0.50 -1.66 118.70 125.67 3m13 s GLU 247 Ca -0.04 -0.90 0.04 0.00 0.36 0.00 0.00 54.97 54.44 3m13 s GLU 247 Cb -0.05 -3.05 0.02 0.00 0.26 0.00 0.00 34.13 31.30 3m13 s GLU 247 CO -0.02 -0.37 0.27 0.14 -0.54 0.00 0.00 175.26 174.74 3m13 s VAL 248 N 1.38 1.56 0.12 3.70 -7.23 0.16 -3.90 120.40 116.19 3m13 s VAL 248 Ca 0.02 -1.66 -0.26 0.00 -1.81 0.00 0.00 61.98 58.27 3m13 s VAL 248 Cb -0.16 -2.22 -0.07 0.00 0.56 0.00 0.00 36.38 34.49 3m13 s VAL 248 CO -0.03 0.00 1.64 -0.65 -0.31 0.00 0.00 175.10 175.75 3m13 h PRO 249 N 0.98 -0.38 -0.51 4.82 0.11 -1.99 -0.79 132.00 134.25 3m13 h PRO 249 Ca -0.39 0.03 0.15 0.00 0.11 0.00 0.00 66.00 65.89 3m13 h PRO 249 Cb 1.30 0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.48 3m13 h PRO 249 CO 0.63 -0.25 1.10 -1.71 -0.21 0.00 0.00 178.00 177.56 3m13 n ASN 250 N -5.36 0.00 0.00 -2.05 2.85 -1.26 -4.97 115.26 104.47 3m13 n ASN 250 Ca -0.06 0.62 0.00 0.00 -0.11 0.00 0.00 54.58 55.04 3m13 n ASN 250 Cb 0.27 -0.13 0.00 0.00 1.24 0.00 0.00 39.78 41.16 3m13 n ASN 250 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3m13 n GLY 251 N -1.60 0.58 3.43 8.20 0.00 -0.30 -4.99 105.19 110.50 3m13 n GLY 251 Ca 0.11 -1.91 -0.34 0.00 0.00 0.00 0.00 46.02 43.88 3m13 n GLY 251 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m13 s ILE 252 N -1.83 3.73 0.13 -0.61 1.01 -1.26 0.39 121.20 122.76 3m13 s ILE 252 Ca 0.00 -0.40 0.10 0.00 0.00 0.00 0.00 60.65 60.35 3m13 s ILE 252 Cb 0.00 -2.66 -0.04 0.00 0.01 0.00 0.00 42.46 39.77 3m13 s ILE 252 CO 0.00 0.46 -0.20 -0.31 0.00 0.00 0.00 174.94 174.89 3m13 s TYR 253 N 0.81 2.48 0.09 3.97 2.02 -0.67 -0.37 117.35 125.69 3m13 s TYR 253 Ca -0.01 -0.29 0.02 0.00 -0.37 0.00 0.00 57.07 56.42 3m13 s TYR 253 Cb -0.14 -1.30 -0.04 0.00 -0.40 0.00 0.00 41.96 40.07 3m13 s TYR 253 CO 0.02 0.40 -0.08 1.52 -1.57 0.00 0.00 175.55 175.84 3m13 s TYR 254 N -1.21 0.89 0.12 2.71 1.13 -0.61 -1.19 117.35 119.18 3m13 s TYR 254 Ca 0.18 -0.78 -0.26 0.00 -1.41 0.00 0.00 57.07 54.80 3m13 s TYR 254 Cb -0.10 -0.51 0.07 0.00 -1.10 0.00 0.00 41.96 40.32 3m13 s TYR 254 CO 0.10 -0.10 0.91 0.20 -2.51 0.00 0.00 175.55 174.15 3m13 s GLY 255 N -2.66 -0.30 0.00 5.49 0.00 -0.80 -1.00 107.32 108.04 3m13 s GLY 255 Ca 0.07 0.35 0.02 0.00 0.00 0.00 0.00 44.72 45.16 3m13 s GLY 255 CO -0.03 0.09 -0.07 -1.36 0.00 0.00 0.00 173.10 171.74 3m13 s PHE 256 N -3.30 0.58 1.01 1.90 0.08 -0.61 -1.08 117.98 116.56 3m13 s PHE 256 Ca 0.10 -0.16 -0.11 0.00 0.12 0.00 0.00 56.93 56.87 3m13 s PHE 256 Cb -0.01 -0.37 0.20 0.00 -0.57 0.00 0.00 43.02 42.27 3m13 s PHE 256 CO -0.01 -0.02 1.09 -1.25 -0.10 0.00 0.00 175.22 174.93 3m13 s PRO 257 N -0.36 0.27 0.12 0.24 0.04 -1.25 -2.81 135.00 131.25 3m13 s PRO 257 Ca 0.01 1.13 -0.30 0.00 0.04 0.00 0.00 61.00 61.87 3m13 s PRO 257 Cb -0.03 -1.67 -0.06 0.00 0.04 0.00 0.00 34.50 32.77 3m13 s PRO 257 CO -0.00 -3.01 1.07 0.45 0.04 0.00 0.00 177.00 175.55 3m13 s SER 258 N -2.75 7.30 -0.14 6.66 0.15 0.18 -4.67 113.70 120.43 3m13 s SER 258 Ca 0.67 1.95 -0.02 0.00 0.70 0.00 0.00 55.95 59.25 3m13 s SER 258 Cb -0.23 -2.59 -0.02 0.00 -1.71 0.00 0.00 66.02 61.47 3m13 s SER 258 CO 0.60 -0.24 -0.07 -0.36 1.20 0.00 0.00 173.24 174.38 3m13 s PHE 259 N 0.23 2.95 -1.37 3.44 0.40 -1.26 -0.86 117.98 121.51 3m13 s PHE 259 Ca 0.51 -0.35 -0.01 0.00 -0.60 0.00 0.00 56.93 56.48 3m13 s PHE 259 Cb -0.27 -1.89 0.01 0.00 0.51 0.00 0.00 43.02 41.38 3m13 s PHE 259 CO 0.32 -0.03 0.09 0.41 0.70 0.00 0.00 175.22 176.70 3m13 n GLY 260 N 3.34 -0.50 2.19 4.36 0.00 -1.26 -2.55 105.19 110.77 3m13 n GLY 260 Ca -0.18 0.02 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 3m13 n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m13 n GLY 261 N -0.97 0.56 0.61 -0.02 0.00 -1.26 -4.95 105.19 99.17 3m13 n GLY 261 Ca -0.17 -0.64 0.08 0.00 0.00 0.00 0.00 46.02 45.30 3m13 n GLY 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m13 n GLY 263 N 1.01 2.92 3.74 0.00 0.00 -1.26 -4.79 105.19 106.81 3m13 n GLY 263 Ca 0.09 -1.73 -0.41 0.00 0.00 0.00 0.00 46.02 43.97 3m13 n GLY 263 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3m13 s LEU 264 N 0.00 4.55 0.02 0.99 0.20 -0.77 -4.16 118.68 119.50 3m13 s LEU 264 Ca 0.00 1.95 -0.00 0.00 0.69 0.00 0.00 54.13 56.77 3m13 s LEU 264 Cb 0.00 -3.60 -0.04 0.00 -0.43 0.00 0.00 46.19 42.12 3m13 s LEU 264 CO 0.00 -0.04 0.12 -0.13 -0.29 0.00 0.00 176.35 176.01 3m13 s ARG 265 N -0.56 3.15 -0.11 1.98 0.52 -1.12 -0.82 118.95 121.98 3m13 s ARG 265 Ca 0.46 -0.49 -0.12 0.00 -0.52 0.00 0.00 55.73 55.06 3m13 s ARG 265 Cb -0.26 -2.90 0.03 0.00 0.52 0.00 0.00 34.95 32.33 3m13 s ARG 265 CO 0.33 0.63 0.33 -1.17 0.02 0.00 0.00 175.30 175.44 3m13 s LEU 266 N -2.00 0.75 0.09 2.53 2.96 -0.67 -1.58 118.68 120.76 3m13 s LEU 266 Ca 0.26 0.61 0.03 0.00 -0.22 0.00 0.00 54.13 54.82 3m13 s LEU 266 Cb -0.12 1.15 -0.03 0.00 0.50 0.00 0.00 46.19 47.68 3m13 s LEU 266 CO 0.18 -0.15 -0.09 -0.83 -1.32 0.00 0.00 176.35 174.14 3m13 s GLY 267 N 0.02 0.79 -0.32 7.98 0.00 -0.17 -1.07 107.32 114.55 3m13 s GLY 267 Ca -0.01 -1.15 -0.10 0.00 0.00 0.00 0.00 44.72 43.47 3m13 s GLY 267 CO 0.01 -1.22 0.15 -0.47 0.00 0.00 0.00 173.10 171.57 3m13 s TYR 268 N -2.41 3.19 0.04 1.90 5.04 -1.26 -1.58 117.35 122.28 3m13 s TYR 268 Ca 0.04 -0.71 -0.05 0.00 -2.44 0.00 0.00 57.07 53.90 3m13 s TYR 268 Cb -0.03 -2.36 -0.29 0.00 0.35 0.00 0.00 41.96 39.63 3m13 s TYR 268 CO -0.00 -0.51 1.01 1.25 -1.34 0.00 0.00 175.55 175.95 3m13 h HIS 269 N 8.35 0.54 0.00 4.97 -0.00 -1.05 -3.38 115.15 124.58 3m13 h HIS 269 Ca -0.30 -0.39 -0.06 0.00 -0.00 0.00 0.00 60.37 59.61 3m13 h HIS 269 Cb 1.13 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 28.51 3m13 h HIS 269 CO 0.62 1.36 -0.28 1.79 -0.00 0.00 0.00 177.93 181.42 3m13 h THR 270 N 0.08 0.52 -4.44 6.26 1.35 -1.93 -3.44 112.91 111.32 3m13 h THR 270 Ca -0.19 -1.53 -0.67 0.00 -0.55 0.00 0.00 66.41 63.47 3m13 h THR 270 Cb 2.01 2.09 -0.28 0.00 -1.73 0.00 0.00 68.15 70.24 3m13 h THR 270 CO 0.20 0.27 -0.88 0.12 -0.25 0.00 0.00 175.52 174.98 3m13 s PHE 271 N -3.25 2.17 0.26 4.73 5.36 -1.26 -5.05 117.98 120.95 3m13 s PHE 271 Ca 0.04 -0.41 -0.20 0.00 -0.96 0.00 0.00 56.93 55.40 3m13 s PHE 271 Cb 0.08 -1.36 0.02 0.00 -0.34 0.00 0.00 43.02 41.42 3m13 s PHE 271 CO 0.69 0.02 0.68 0.20 -1.46 0.00 0.00 175.22 175.35 3m13 s GLY 272 N -0.83 -0.08 -0.05 13.12 0.00 -1.26 -4.88 107.32 113.34 3m13 s GLY 272 Ca 0.10 -0.28 -0.30 0.00 0.00 0.00 0.00 44.72 44.23 3m13 s GLY 272 CO 0.00 -0.12 1.18 1.20 0.00 0.00 0.00 173.10 175.36 3m13 s GLN 273 N -3.91 4.37 -0.02 2.90 1.11 -1.22 -4.71 119.66 118.18 3m13 s GLN 273 Ca 0.11 1.65 -0.37 0.00 0.01 0.00 0.00 55.36 56.76 3m13 s GLN 273 Cb -0.05 -3.54 -0.15 0.00 -1.01 0.00 0.00 33.01 28.26 3m13 s GLN 273 CO 0.05 -0.41 1.56 1.63 0.01 0.00 0.00 175.29 178.12 3m13 n LYS 274 N 5.08 1.46 -4.12 2.91 5.02 -1.26 -0.46 118.16 126.78 3m13 n LYS 274 Ca 0.10 0.53 -0.11 0.00 -2.02 0.00 0.00 58.31 56.82 3m13 n LYS 274 Cb 0.47 -2.23 -0.08 0.00 -0.02 0.00 0.00 35.03 33.16 3m13 n LYS 274 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3m13 s ILE 275 N 1.80 0.01 -0.13 -0.18 -5.25 -0.85 -4.91 121.20 111.69 3m13 s ILE 275 Ca 0.88 -1.78 -0.05 0.00 -0.99 0.00 0.00 60.65 58.71 3m13 s ILE 275 Cb -0.90 -2.34 -0.04 0.00 2.95 0.00 0.00 42.46 42.13 3m13 s ILE 275 CO 0.51 -0.05 0.05 -0.62 -1.79 0.00 0.00 174.94 173.04 3m13 s ASP 276 N -3.10 5.61 0.18 4.36 3.68 -1.26 -4.44 116.67 121.70 3m13 s ASP 276 Ca 0.32 0.18 0.21 0.00 2.13 0.00 0.00 52.55 55.39 3m13 s ASP 276 Cb 0.05 -1.80 0.87 0.00 -1.45 0.00 0.00 42.92 40.59 3m13 s ASP 276 CO 0.10 0.30 1.64 -0.81 0.13 0.00 0.00 175.17 176.53 3m13 n PRO 277 N 2.68 0.14 0.00 4.34 -0.04 -1.26 -1.39 135.00 139.47 3m13 n PRO 277 Ca -0.18 0.36 0.13 0.00 -0.04 0.00 0.00 63.50 63.77 3m13 n PRO 277 Cb 0.53 -1.76 0.40 0.00 -0.04 0.00 0.00 33.50 32.63 3m13 n PRO 277 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3m13 n ASP 278 N -2.02 0.62 0.00 3.54 10.43 -1.26 -4.27 116.55 123.60 3m13 n ASP 278 Ca 0.03 -0.46 0.00 0.00 2.57 0.00 0.00 54.79 56.93 3m13 n ASP 278 Cb 0.22 0.08 0.00 0.00 1.84 0.00 0.00 41.12 43.26 3m13 n ASP 278 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 3m13 n THR 279 N -1.11 0.00 -1.56 -3.53 -2.24 -0.49 -5.06 114.28 100.29 3m13 n THR 279 Ca 0.10 -0.28 -0.50 0.00 -2.27 0.00 0.00 64.05 61.09 3m13 n THR 279 Cb 0.33 1.31 -0.05 0.00 -2.10 0.00 0.00 70.33 69.82 3m13 n THR 279 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3m13 n ILE 280 N -0.16 0.77 -2.60 2.28 3.06 -0.64 -4.93 119.36 117.14 3m13 n ILE 280 Ca 0.00 -0.19 -0.42 0.00 -2.50 0.00 0.00 62.75 59.64 3m13 n ILE 280 Cb 0.08 -0.70 -0.03 0.00 0.54 0.00 0.00 39.64 39.53 3m13 n ILE 280 CO 0.00 0.00 0.00 0.21 -2.50 0.00 0.00 176.55 174.26 3m13 s ASN 281 N -0.02 6.39 -0.10 9.51 3.04 -1.26 -4.90 114.94 127.61 3m13 s ASN 281 Ca 0.76 -0.03 0.09 0.00 0.04 0.00 0.00 52.86 53.72 3m13 s ASN 281 Cb -0.91 -2.54 0.44 0.00 -1.54 0.00 0.00 41.25 36.69 3m13 s ASN 281 CO 0.52 -1.51 1.22 0.54 -3.04 0.00 0.00 177.10 174.83 3m13 n ARG 282 N 8.49 2.89 -3.53 0.43 1.74 -1.26 -4.84 116.66 120.59 3m13 n ARG 282 Ca 0.07 -1.69 -0.37 0.00 -0.77 0.00 0.00 57.85 55.09 3m13 n ARG 282 Cb 0.49 -1.79 -0.07 0.00 -1.02 0.00 0.00 32.46 30.07 3m13 n ARG 282 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 3m13 s GLU 283 N -1.86 4.24 0.15 5.56 2.12 -1.26 -4.57 118.70 123.09 3m13 s GLU 283 Ca 0.30 0.09 -0.30 0.00 0.36 0.00 0.00 54.97 55.42 3m13 s GLU 283 Cb 0.21 -3.44 -0.07 0.00 0.26 0.00 0.00 34.13 31.09 3m13 s GLU 283 CO 0.11 0.20 1.00 0.12 -0.54 0.00 0.00 175.26 176.15 3m13 s PHE 284 N 0.58 3.78 0.00 5.30 2.19 -1.26 -3.92 117.98 124.65 3m13 s PHE 284 Ca 0.16 1.76 0.00 0.00 0.33 0.00 0.00 56.93 59.18 3m13 s PHE 284 Cb -0.13 -3.11 0.00 0.00 -1.31 0.00 0.00 43.02 38.47 3m13 s PHE 284 CO 0.04 0.00 0.00 0.41 1.83 0.00 0.00 175.22 177.51 3m13 n GLY 285 N 2.07 0.15 0.21 13.12 0.00 -1.26 -4.93 105.19 114.55 3m13 n GLY 285 Ca 0.02 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.08 3m13 n GLY 285 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3m13 h VAL 286 N 0.00 1.14 -2.71 1.61 -1.51 -1.98 -3.40 116.25 109.40 3m13 h VAL 286 Ca 0.00 -0.84 -0.66 0.00 -1.23 0.00 0.00 66.70 63.97 3m13 h VAL 286 Cb 0.00 1.46 -0.06 0.00 -2.13 0.00 0.00 31.29 30.55 3m13 h VAL 286 CO 0.00 0.24 -0.46 -0.31 -1.23 0.00 0.00 177.57 175.81 3m13 s TYR 287 N -4.46 3.60 0.03 5.19 2.02 -1.26 -4.98 117.35 117.49 3m13 s TYR 287 Ca -0.03 0.52 0.32 0.00 -0.37 0.00 0.00 57.07 57.52 3m13 s TYR 287 Cb 0.15 -1.94 1.33 0.00 -0.40 0.00 0.00 41.96 41.10 3m13 s TYR 287 CO 0.70 0.71 1.95 -1.00 -1.57 0.00 0.00 175.55 176.34 3m13 h PRO 288 N 4.67 0.00 0.00 -1.71 0.13 -2.03 -2.44 132.00 130.62 3m13 h PRO 288 Ca -0.53 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.59 3m13 h PRO 288 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 3m13 h PRO 288 CO 0.61 0.00 -0.05 0.93 -0.23 0.00 0.00 178.00 179.26 3m13 h GLU 289 N 0.00 0.00 -0.27 0.86 3.07 -1.93 -2.03 114.58 114.28 3m13 h GLU 289 Ca 0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 3m13 h GLU 289 Cb 0.48 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 3m13 h GLU 289 CO 0.00 0.05 0.15 -0.44 -1.40 0.00 0.00 179.01 177.37 3m13 h ASP 290 N 0.00 0.34 0.13 1.42 3.45 -1.80 -2.68 116.42 117.29 3m13 h ASP 290 Ca -0.00 -0.09 -0.36 0.00 0.43 0.00 0.00 57.03 57.00 3m13 h ASP 290 Cb 0.17 -0.09 -0.04 0.00 -0.56 0.00 0.00 39.33 38.81 3m13 h ASP 290 CO 0.01 0.34 -2.14 1.21 -1.57 0.00 0.00 179.24 177.08 3m13 n GLU 291 N -4.83 0.70 -0.20 3.56 2.13 -1.20 -4.30 120.64 116.50 3m13 n GLU 291 Ca -0.02 0.20 -0.09 0.00 0.66 0.00 0.00 57.16 57.91 3m13 n GLU 291 Cb 0.08 -1.64 0.02 0.00 0.27 0.00 0.00 31.44 30.17 3m13 n GLU 291 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 3m13 h SER 292 N 0.03 0.95 0.28 4.31 4.64 -1.40 -0.48 113.55 121.88 3m13 h SER 292 Ca -0.46 -0.28 -0.05 0.00 -0.47 0.00 0.00 61.79 60.52 3m13 h SER 292 Cb 2.02 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 63.84 3m13 h SER 292 CO 0.03 1.00 -0.25 0.78 -0.87 0.00 0.00 176.83 177.52 3m13 h ASN 293 N 0.88 0.00 0.17 4.97 -0.26 -1.70 0.22 115.58 119.86 3m13 h ASN 293 Ca 0.17 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.90 3m13 h ASN 293 Cb 0.47 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.74 3m13 h ASN 293 CO 0.02 0.25 -0.08 -0.07 -1.06 0.00 0.00 177.43 176.48 3m13 h LEU 294 N 0.00 -0.19 -1.39 1.61 3.38 -1.61 -3.21 115.31 113.89 3m13 h LEU 294 Ca -0.00 -0.29 0.05 0.00 0.09 0.00 0.00 57.88 57.74 3m13 h LEU 294 Cb 0.45 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 3m13 h LEU 294 CO 0.03 0.37 0.46 0.03 0.09 0.00 0.00 178.44 179.42 3m13 h ARG 295 N -0.95 0.73 -0.31 1.13 3.08 -1.01 -0.88 114.38 116.17 3m13 h ARG 295 Ca -0.02 -0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.05 3m13 h ARG 295 Cb 0.47 -0.16 -0.08 0.00 0.08 0.00 0.00 29.97 30.27 3m13 h ARG 295 CO 0.04 0.48 -0.40 0.00 -1.07 0.00 0.00 179.97 179.02 3m13 h ALA 296 N 1.61 -0.43 0.35 0.04 0.00 -1.04 0.16 119.26 119.96 3m13 h ALA 296 Ca 0.29 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 3m13 h ALA 296 Cb 0.20 0.81 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3m13 h ALA 296 CO -0.09 -0.85 -0.17 0.35 0.00 0.00 0.00 179.25 178.48 3m13 h PHE 297 N -0.37 -0.44 0.11 0.00 3.57 -1.39 -3.20 116.94 115.22 3m13 h PHE 297 Ca 0.12 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.63 3m13 h PHE 297 Cb 0.59 0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.45 3m13 h PHE 297 CO -0.56 -0.21 -0.20 -0.07 -2.23 0.00 0.00 178.31 175.05 3m13 h LEU 298 N -0.59 -0.55 -1.35 0.59 3.38 -0.85 -0.23 115.31 115.72 3m13 h LEU 298 Ca -0.05 0.06 0.22 0.00 0.09 0.00 0.00 57.88 58.21 3m13 h LEU 298 Cb 0.43 0.21 -0.08 0.00 0.09 0.00 0.00 40.66 41.30 3m13 h LEU 298 CO 0.08 -0.28 0.63 1.05 0.09 0.00 0.00 178.44 180.01 3m13 h GLU 299 N -0.37 0.47 0.10 1.13 4.11 -0.81 -0.79 114.58 118.42 3m13 h GLU 299 Ca 0.03 -0.03 -0.19 0.00 0.07 0.00 0.00 59.36 59.24 3m13 h GLU 299 Cb 0.39 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 29.54 3m13 h GLU 299 CO -0.11 0.31 -0.92 1.49 0.07 0.00 0.00 179.01 179.85 3m13 h GLU 300 N 0.48 0.21 0.00 1.06 4.57 -1.42 -3.40 114.58 116.07 3m13 h GLU 300 Ca 0.54 -0.35 -0.14 0.00 -1.18 0.00 0.00 59.36 58.22 3m13 h GLU 300 Cb 1.23 0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 29.93 3m13 h GLU 300 CO -0.26 1.17 -1.53 0.66 -1.18 0.00 0.00 179.01 177.86 3m13 n TYR 301 N -4.16 0.00 -3.33 0.92 4.01 -0.15 -4.72 117.16 109.73 3m13 n TYR 301 Ca -0.18 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.30 3m13 n TYR 301 Cb 0.78 -0.38 -0.08 0.00 -0.31 0.00 0.00 39.34 39.35 3m13 n TYR 301 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 3m13 n MET 302 N -2.33 1.09 0.26 -0.72 2.81 -0.36 0.01 117.12 117.89 3m13 n MET 302 Ca -0.13 -3.62 0.15 0.00 -1.81 0.00 0.00 57.70 52.29 3m13 n MET 302 Cb 0.75 -1.60 0.66 0.00 -0.71 0.00 0.00 33.22 32.31 3m13 n MET 302 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 3m13 h PRO 303 N 4.45 0.00 -0.02 0.03 0.13 -1.55 -2.06 132.00 132.98 3m13 h PRO 303 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3m13 h PRO 303 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 3m13 h PRO 303 CO 0.54 0.08 0.00 0.41 -0.23 0.00 0.00 178.00 178.80 3m13 n GLY 304 N -0.08 -0.23 1.11 1.56 0.00 -1.26 -3.03 105.19 103.25 3m13 n GLY 304 Ca -0.00 -0.38 0.11 0.00 0.00 0.00 0.00 46.02 45.74 3m13 n GLY 304 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m13 n ALA 305 N -0.10 2.39 -1.69 4.61 0.00 -0.77 -0.93 120.51 124.01 3m13 n ALA 305 Ca 0.20 -1.05 -0.34 0.00 0.00 0.00 0.00 53.44 52.24 3m13 n ALA 305 Cb 0.29 -0.81 0.01 0.00 0.00 0.00 0.00 19.45 18.95 3m13 n ALA 305 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3m13 n ASN 306 N 1.38 7.16 -1.99 0.00 4.05 -1.17 -4.68 115.26 120.02 3m13 n ASN 306 Ca 0.19 -3.60 0.00 0.00 0.45 0.00 0.00 54.58 51.62 3m13 n ASN 306 Cb 0.57 -1.12 0.00 0.00 1.23 0.00 0.00 39.78 40.47 3m13 n ASN 306 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3m13 n GLY 307 N -0.07 0.02 2.39 8.20 0.00 -0.85 -5.01 105.19 109.87 3m13 n GLY 307 Ca 0.52 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.30 3m13 n GLY 307 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3m13 n GLU 308 N -0.85 0.00 -2.23 1.61 1.02 -1.26 -4.49 120.64 114.44 3m13 n GLU 308 Ca 0.00 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.71 3m13 n GLU 308 Cb 0.00 -1.01 -0.02 0.00 -0.02 0.00 0.00 31.44 30.39 3m13 n GLU 308 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3m13 s LEU 309 N 0.52 3.55 0.11 -4.62 2.96 -1.26 -0.89 118.68 119.06 3m13 s LEU 309 Ca 0.63 0.98 -0.01 0.00 -0.22 0.00 0.00 54.13 55.51 3m13 s LEU 309 Cb -0.89 -3.53 -0.17 0.00 0.50 0.00 0.00 46.19 42.10 3m13 s LEU 309 CO 0.43 -1.53 1.25 0.11 -1.32 0.00 0.00 176.35 175.28 3m13 h LYS 310 N 11.43 0.23 -1.45 1.98 1.57 -0.78 -3.49 116.57 126.07 3m13 h LYS 310 Ca -0.30 -0.33 0.19 0.00 -1.87 0.00 0.00 60.65 58.34 3m13 h LYS 310 Cb 1.13 0.11 -0.22 0.00 0.08 0.00 0.00 32.23 33.33 3m13 h LYS 310 CO 1.07 1.10 0.75 0.50 -0.57 0.00 0.00 179.45 182.30 3m13 s ARG 311 N -2.90 0.37 0.18 3.15 3.52 -1.21 -5.01 118.95 117.04 3m13 s ARG 311 Ca -0.03 -0.02 0.02 0.00 -0.13 0.00 0.00 55.73 55.57 3m13 s ARG 311 Cb 0.09 0.17 -0.05 0.00 -1.56 0.00 0.00 34.95 33.60 3m13 s ARG 311 CO 0.86 -0.14 0.01 0.20 -0.81 0.00 0.00 175.30 175.43 3m13 s GLY 312 N -1.57 1.25 0.07 8.12 0.00 -1.26 -0.36 107.32 113.57 3m13 s GLY 312 Ca 0.06 -1.61 0.05 0.00 0.00 0.00 0.00 44.72 43.22 3m13 s GLY 312 CO -0.04 -1.52 -0.13 0.00 0.00 0.00 0.00 173.10 171.41 3m13 s ALA 313 N -3.69 1.07 -0.10 3.20 0.00 -0.12 -4.83 121.76 117.29 3m13 s ALA 313 Ca 0.25 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 51.23 3m13 s ALA 313 Cb 0.06 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.14 3m13 s ALA 313 CO 0.05 0.11 -0.10 0.08 0.00 0.00 0.00 175.76 175.90 3m13 s VAL 314 N -1.44 1.15 0.33 0.00 1.01 -1.26 -1.75 120.40 118.43 3m13 s VAL 314 Ca -0.02 -0.40 0.05 0.00 0.00 0.00 0.00 61.98 61.61 3m13 s VAL 314 Cb -0.09 -1.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.15 3m13 s VAL 314 CO 0.02 0.38 0.31 0.00 0.00 0.00 0.00 175.10 175.81 3m13 s MET 316 N -3.38 0.67 0.24 0.00 -1.94 -1.22 0.24 119.30 113.90 3m13 s MET 316 Ca 0.39 -0.15 -0.09 0.00 -1.71 0.00 0.00 55.69 54.12 3m13 s MET 316 Cb 0.02 -0.67 -0.07 0.00 2.01 0.00 0.00 34.83 36.12 3m13 s MET 316 CO 0.26 0.02 0.56 0.71 -0.01 0.00 0.00 175.02 176.55 3m13 s TYR 317 N 0.44 3.43 -0.30 -0.03 2.02 -0.83 -4.44 117.35 117.65 3m13 s TYR 317 Ca -0.05 0.86 0.01 0.00 -0.37 0.00 0.00 57.07 57.51 3m13 s TYR 317 Cb -0.09 -2.25 0.09 0.00 -0.40 0.00 0.00 41.96 39.30 3m13 s TYR 317 CO -0.00 0.24 0.05 0.99 -1.57 0.00 0.00 175.55 175.26 3m13 s THR 318 N -1.87 1.42 0.09 -0.71 2.01 -1.26 -0.55 115.64 114.77 3m13 s THR 318 Ca 0.47 -1.62 -0.19 0.00 0.31 0.00 0.00 61.69 60.66 3m13 s THR 318 Cb -0.11 -1.98 -0.07 0.00 0.01 0.00 0.00 72.50 70.35 3m13 s THR 318 CO 0.22 -0.51 0.59 -0.54 -0.69 0.00 0.00 174.62 173.69 3m13 s LYS 319 N 1.36 4.22 0.67 4.92 1.02 0.02 -1.76 119.74 130.19 3m13 s LYS 319 Ca 0.06 0.76 -0.04 0.00 0.02 0.00 0.00 55.97 56.77 3m13 s LYS 319 Cb -0.18 -3.21 0.06 0.00 -0.52 0.00 0.00 37.83 33.98 3m13 s LYS 319 CO -0.15 0.62 0.96 0.95 -0.92 0.00 0.00 175.35 176.80 3m13 s THR 320 N -1.14 2.36 0.28 2.17 -4.23 -1.26 -1.01 115.64 112.81 3m13 s THR 320 Ca 0.30 -0.40 -0.03 0.00 -1.18 0.00 0.00 61.69 60.38 3m13 s THR 320 Cb -0.19 -2.96 0.21 0.00 1.34 0.00 0.00 72.50 70.90 3m13 s THR 320 CO 0.20 0.00 1.89 -0.07 -0.54 0.00 0.00 174.62 176.10 3m13 h LEU 321 N -0.44 0.94 -2.05 4.79 3.38 -1.81 -2.84 115.31 117.27 3m13 h LEU 321 Ca -0.43 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.45 3m13 h LEU 321 Cb 1.30 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3m13 h LEU 321 CO 0.55 0.77 0.00 -0.90 0.09 0.00 0.00 178.44 178.95 3m13 n ASP 322 N -4.35 3.05 -0.83 -0.43 5.68 -1.26 -4.94 116.55 113.47 3m13 n ASP 322 Ca 0.07 -1.94 -0.10 0.00 -0.50 0.00 0.00 54.79 52.32 3m13 n ASP 322 Cb 0.11 -0.26 -0.04 0.00 -1.14 0.00 0.00 41.12 39.79 3m13 n ASP 322 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3m13 n GLU 323 N 1.21 -1.69 -3.71 0.11 1.02 -1.08 -4.98 120.64 111.52 3m13 n GLU 323 Ca 0.19 0.81 -0.28 0.00 -0.02 0.00 0.00 57.16 57.87 3m13 n GLU 323 Cb 0.53 -5.15 -0.03 0.00 -0.02 0.00 0.00 31.44 26.77 3m13 n GLU 323 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3m13 s HIS 324 N -1.82 3.48 0.82 -0.32 3.76 -1.26 -4.80 115.29 115.15 3m13 s HIS 324 Ca 0.00 0.34 -0.11 0.00 -0.15 0.00 0.00 55.06 55.13 3m13 s HIS 324 Cb 0.00 -1.85 0.08 0.00 1.11 0.00 0.00 32.58 31.92 3m13 s HIS 324 CO 0.00 0.39 1.09 -0.06 -0.85 0.00 0.00 174.74 175.31 3m13 s PHE 325 N -1.85 2.70 -0.30 1.40 0.08 -1.26 -4.67 117.98 114.08 3m13 s PHE 325 Ca 0.38 1.22 -0.08 0.00 0.12 0.00 0.00 56.93 58.57 3m13 s PHE 325 Cb -0.11 -3.11 0.00 0.00 -0.57 0.00 0.00 43.02 39.23 3m13 s PHE 325 CO 0.29 -1.90 0.12 0.42 -0.10 0.00 0.00 175.22 174.04 3m13 s ILE 326 N -3.08 4.27 -0.28 0.64 1.01 0.24 -4.41 121.20 119.60 3m13 s ILE 326 Ca 0.61 -0.57 -0.03 0.00 0.00 0.00 0.00 60.65 60.66 3m13 s ILE 326 Cb -0.15 -3.20 0.11 0.00 0.01 0.00 0.00 42.46 39.23 3m13 s ILE 326 CO 0.55 0.07 0.20 -0.63 0.00 0.00 0.00 174.94 175.12 3m13 s ILE 327 N 1.55 -0.22 0.09 2.92 1.01 -0.67 -1.18 121.20 124.70 3m13 s ILE 327 Ca 0.03 -0.59 -0.26 0.00 0.00 0.00 0.00 60.65 59.84 3m13 s ILE 327 Cb -0.17 -0.95 0.08 0.00 0.01 0.00 0.00 42.46 41.43 3m13 s ILE 327 CO 0.04 -0.58 0.74 -0.62 0.00 0.00 0.00 174.94 174.52 3m13 s ASP 328 N 2.22 -0.47 0.56 3.58 3.68 -1.01 -4.43 116.67 120.80 3m13 s ASP 328 Ca 0.09 -0.02 -0.21 0.00 2.13 0.00 0.00 52.55 54.54 3m13 s ASP 328 Cb -0.15 0.51 -0.05 0.00 -1.45 0.00 0.00 42.92 41.77 3m13 s ASP 328 CO -0.33 -0.82 1.19 0.18 0.13 0.00 0.00 175.17 175.52 3m13 n LEU 329 N -0.32 4.67 -4.72 -1.34 4.77 -1.26 -0.65 117.00 118.16 3m13 n LEU 329 Ca -0.13 0.92 -0.42 0.00 -0.03 0.00 0.00 56.01 56.35 3m13 n LEU 329 Cb 0.63 -1.49 -0.03 0.00 -2.33 0.00 0.00 43.42 40.20 3m13 n LEU 329 CO 0.11 -1.13 1.30 -2.28 -1.33 0.00 0.00 177.39 174.07 3m13 s HIS 330 N -1.37 2.93 0.54 -1.77 5.65 -0.72 -4.81 115.29 115.73 3m13 s HIS 330 Ca 0.73 0.48 0.24 0.00 0.25 0.00 0.00 55.06 56.76 3m13 s HIS 330 Cb -0.43 -4.02 1.41 0.00 -1.18 0.00 0.00 32.58 28.37 3m13 s HIS 330 CO 0.48 -3.84 2.03 -1.00 -0.65 0.00 0.00 174.74 171.76 3m13 h PRO 331 N 6.97 0.00 -0.23 2.88 0.13 -1.93 -0.58 132.00 139.24 3m13 h PRO 331 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 3m13 h PRO 331 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3m13 h PRO 331 CO 0.93 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 179.09 3m13 n GLU 332 N -4.30 2.05 -3.47 0.86 1.02 -1.26 -4.87 120.64 110.66 3m13 n GLU 332 Ca 0.07 -1.92 -0.14 0.00 -0.02 0.00 0.00 57.16 55.15 3m13 n GLU 332 Cb 0.50 -1.40 -0.11 0.00 -0.02 0.00 0.00 31.44 30.41 3m13 n GLU 332 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3m13 s HIS 333 N -1.37 -0.52 -0.94 -0.32 3.76 -0.23 -5.00 115.29 110.69 3m13 s HIS 333 Ca 0.28 0.60 0.19 0.00 -0.15 0.00 0.00 55.06 55.98 3m13 s HIS 333 Cb 0.18 -0.15 0.78 0.00 1.11 0.00 0.00 32.58 34.49 3m13 s HIS 333 CO 0.25 -0.61 1.59 -1.13 -0.85 0.00 0.00 174.74 173.99 3m13 n SER 334 N 5.34 0.10 -1.22 1.40 3.41 -1.26 -2.94 113.62 118.45 3m13 n SER 334 Ca -0.05 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.20 3m13 n SER 334 Cb 0.50 -0.54 0.24 0.00 -0.26 0.00 0.00 64.21 64.15 3m13 n SER 334 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3m13 n ASN 335 N -1.60 3.62 -4.28 4.04 6.94 -1.26 -4.85 115.26 117.87 3m13 n ASN 335 Ca 0.04 -2.00 -0.31 0.00 -0.02 0.00 0.00 54.58 52.30 3m13 n ASN 335 Cb 0.22 -0.31 -0.16 0.00 -2.36 0.00 0.00 39.78 37.16 3m13 n ASN 335 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3m13 s VAL 336 N -1.36 2.00 0.00 3.53 1.01 -1.17 -0.78 120.40 123.64 3m13 s VAL 336 Ca 0.42 -1.07 0.07 0.00 0.00 0.00 0.00 61.98 61.40 3m13 s VAL 336 Cb 0.24 -1.67 -0.02 0.00 0.00 0.00 0.00 36.38 34.93 3m13 s VAL 336 CO 0.32 0.56 -0.23 -0.69 0.00 0.00 0.00 175.10 175.07 3m13 s VAL 337 N -0.44 1.81 -0.07 2.92 1.01 0.14 -1.76 120.40 124.00 3m13 s VAL 337 Ca 0.05 -1.08 0.04 0.00 0.00 0.00 0.00 61.98 60.99 3m13 s VAL 337 Cb -0.11 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.74 3m13 s VAL 337 CO 0.01 0.42 -0.19 -0.63 0.00 0.00 0.00 175.10 174.71 3m13 s ILE 338 N -0.63 1.65 -0.28 2.22 -1.09 0.18 -1.47 121.20 121.79 3m13 s ILE 338 Ca 0.09 -0.80 0.01 0.00 -2.23 0.00 0.00 60.65 57.73 3m13 s ILE 338 Cb -0.09 -1.43 0.08 0.00 -1.58 0.00 0.00 42.46 39.43 3m13 s ILE 338 CO 0.00 0.47 -0.00 0.00 -1.23 0.00 0.00 174.94 174.17 3m13 s ALA 339 N 0.32 2.15 0.25 9.38 0.00 -0.65 -2.41 121.76 130.81 3m13 s ALA 339 Ca -0.13 -1.72 -0.11 0.00 0.00 0.00 0.00 51.96 50.00 3m13 s ALA 339 Cb -0.16 -1.61 -0.01 0.00 0.00 0.00 0.00 23.12 21.35 3m13 s ALA 339 CO 0.05 -1.40 0.44 0.00 0.00 0.00 0.00 175.76 174.86 3m13 s ALA 340 N 1.30 -0.00 -1.27 0.00 0.00 -0.33 -4.43 121.76 117.03 3m13 s ALA 340 Ca 0.01 -1.03 -0.03 0.00 0.00 0.00 0.00 51.96 50.91 3m13 s ALA 340 Cb -0.19 1.11 -0.01 0.00 0.00 0.00 0.00 23.12 24.04 3m13 s ALA 340 CO -0.10 -0.82 0.72 0.41 0.00 0.00 0.00 175.76 175.97 3m13 n GLY 341 N -0.39 -0.44 0.00 0.00 0.00 -1.26 -0.59 105.19 102.51 3m13 n GLY 341 Ca -0.01 0.20 0.12 0.00 0.00 0.00 0.00 46.02 46.33 3m13 n GLY 341 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3m13 n PHE 342 N -4.18 0.00 -3.30 1.61 3.72 -1.17 -4.14 117.46 110.00 3m13 n PHE 342 Ca -0.26 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 56.90 3m13 n PHE 342 Cb 0.66 -0.21 0.02 0.00 -0.94 0.00 0.00 39.48 39.01 3m13 n PHE 342 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3m13 n SER 343 N -1.21 -5.02 -0.25 4.37 7.64 -0.72 -1.32 113.62 117.11 3m13 n SER 343 Ca 0.14 -0.40 -0.03 0.00 1.01 0.00 0.00 58.87 59.58 3m13 n SER 343 Cb 0.17 -4.07 -0.01 0.00 -1.01 0.00 0.00 64.21 59.28 3m13 n SER 343 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3m13 n GLY 344 N -1.43 0.58 0.97 0.23 0.00 -1.26 -4.88 105.19 99.40 3m13 n GLY 344 Ca -0.05 -0.26 0.02 0.00 0.00 0.00 0.00 46.02 45.72 3m13 n GLY 344 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3m13 n HIS 345 N -2.67 0.00 0.57 1.61 -0.00 -0.43 -4.93 115.22 109.36 3m13 n HIS 345 Ca -0.03 -0.24 0.11 0.00 -0.00 0.00 0.00 57.72 57.55 3m13 n HIS 345 Cb 0.22 -0.07 -0.02 0.00 -0.00 0.00 0.00 29.99 30.13 3m13 n HIS 345 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3m13 n GLY 346 N 0.23 -1.16 0.18 -1.39 0.00 -1.17 -4.54 105.19 97.34 3m13 n GLY 346 Ca 0.02 -0.44 -0.04 0.00 0.00 0.00 0.00 46.02 45.55 3m13 n GLY 346 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3m13 h PHE 347 N 0.00 0.32 0.00 1.61 3.57 -1.91 -1.62 116.94 118.91 3m13 h PHE 347 Ca 0.00 -0.11 -0.01 0.00 3.53 0.00 0.00 57.97 61.38 3m13 h PHE 347 Cb 0.73 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.40 3m13 h PHE 347 CO 0.00 0.75 -0.05 1.57 -2.23 0.00 0.00 178.31 178.35 3m13 h LYS 348 N 0.20 0.00 -0.00 1.11 2.10 -1.80 0.56 116.57 118.74 3m13 h LYS 348 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3m13 h LYS 348 Cb 1.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.35 3m13 h LYS 348 CO 0.09 0.05 -0.49 1.19 -2.00 0.00 0.00 179.45 178.28 3m13 n PHE 349 N -3.87 0.00 0.30 0.07 3.72 -0.63 -4.48 117.46 112.57 3m13 n PHE 349 Ca -0.03 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.53 3m13 n PHE 349 Cb 0.14 -0.16 0.93 0.00 -0.94 0.00 0.00 39.48 39.45 3m13 n PHE 349 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3m13 h SER 350 N 0.54 0.00 -0.20 4.37 4.64 -0.68 0.13 113.55 122.34 3m13 h SER 350 Ca 0.00 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.12 3m13 h SER 350 Cb 0.52 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.62 3m13 h SER 350 CO 0.00 0.01 -0.65 0.77 -0.87 0.00 0.00 176.83 176.09 3m13 h SER 351 N 0.00 0.93 -0.24 4.97 4.64 -1.79 -0.88 113.55 121.18 3m13 h SER 351 Ca -0.00 -0.59 -0.15 0.00 -0.47 0.00 0.00 61.79 60.58 3m13 h SER 351 Cb 0.03 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.84 3m13 h SER 351 CO 0.00 1.35 -0.41 1.23 -0.87 0.00 0.00 176.83 178.13 3m13 h GLY 352 N 0.55 0.86 1.05 -0.77 0.00 -1.46 -2.55 103.07 100.75 3m13 h GLY 352 Ca -0.02 -0.89 -0.08 0.00 0.00 0.00 0.00 47.33 46.34 3m13 h GLY 352 CO 0.14 0.80 0.10 -2.08 0.00 0.00 0.00 176.54 175.50 3m13 h VAL 353 N 0.64 1.26 -0.57 4.60 2.07 -0.71 -0.05 116.25 123.48 3m13 h VAL 353 Ca 0.05 -1.02 -0.04 0.00 0.82 0.00 0.00 66.70 66.51 3m13 h VAL 353 Cb 0.98 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 3m13 h VAL 353 CO 0.09 0.38 0.20 1.23 0.02 0.00 0.00 177.57 179.50 3m13 h GLY 354 N 0.95 0.91 0.79 2.17 0.00 -0.76 -0.10 103.07 107.02 3m13 h GLY 354 Ca 0.19 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 3m13 h GLY 354 CO 0.01 0.45 -0.09 -2.09 0.00 0.00 0.00 176.54 174.82 3m13 h GLU 355 N 0.83 -0.25 -0.69 4.80 4.81 -1.11 -1.50 114.58 121.47 3m13 h GLU 355 Ca 0.19 0.02 0.13 0.00 -0.13 0.00 0.00 59.36 59.57 3m13 h GLU 355 Cb 0.20 0.06 -0.13 0.00 0.63 0.00 0.00 28.75 29.51 3m13 h GLU 355 CO -0.01 -0.00 -0.23 0.28 -0.73 0.00 0.00 179.01 178.31 3m13 h VAL 356 N -0.48 0.24 -0.68 0.32 2.07 -0.35 -2.38 116.25 114.99 3m13 h VAL 356 Ca -0.03 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.43 3m13 h VAL 356 Cb 0.37 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 3m13 h VAL 356 CO 0.04 0.00 0.17 -0.07 0.02 0.00 0.00 177.57 177.73 3m13 h LEU 357 N -0.05 1.01 -0.09 2.57 3.38 -0.97 -0.20 115.31 120.97 3m13 h LEU 357 Ca 0.31 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 3m13 h LEU 357 Cb 0.54 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 3m13 h LEU 357 CO -0.73 0.97 0.05 -1.28 0.09 0.00 0.00 178.44 177.54 3m13 h SER 358 N 1.02 0.11 0.45 -0.43 0.87 -1.01 0.08 113.55 114.63 3m13 h SER 358 Ca 0.21 -0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.70 3m13 h SER 358 Cb 0.35 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 3m13 h SER 358 CO 0.00 0.13 -0.21 1.56 -0.53 0.00 0.00 176.83 177.78 3m13 h GLN 359 N 0.08 -0.58 -0.60 2.24 4.20 -1.26 -0.15 115.11 119.05 3m13 h GLN 359 Ca 0.03 0.04 0.12 0.00 0.06 0.00 0.00 58.65 58.90 3m13 h GLN 359 Cb 0.04 0.13 -0.12 0.00 0.30 0.00 0.00 27.48 27.84 3m13 h GLN 359 CO -0.01 -0.38 -0.22 -0.07 -0.67 0.00 0.00 178.83 177.48 3m13 h LEU 360 N -0.61 -0.79 -0.19 1.46 3.38 -0.78 0.39 115.31 118.16 3m13 h LEU 360 Ca -0.06 0.20 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 3m13 h LEU 360 Cb 0.46 0.45 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 3m13 h LEU 360 CO 0.10 -0.25 -0.00 0.00 0.09 0.00 0.00 178.44 178.38 3m13 h ALA 361 N 1.37 0.26 0.00 1.53 0.00 -0.74 0.24 119.26 121.92 3m13 h ALA 361 Ca 0.27 -0.21 -0.17 0.00 0.00 0.00 0.00 54.91 54.80 3m13 h ALA 361 Cb 0.50 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3m13 h ALA 361 CO -0.65 -0.03 -0.82 -0.07 0.00 0.00 0.00 179.25 177.69 3m13 h LEU 362 N 0.09 0.06 -0.54 0.00 3.38 -0.85 -3.39 115.31 114.06 3m13 h LEU 362 Ca 0.05 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3m13 h LEU 362 Cb 0.39 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3m13 h LEU 362 CO 0.01 0.85 0.00 0.35 0.09 0.00 0.00 178.44 179.74 3m13 n THR 363 N -3.61 0.00 -0.41 0.22 -2.24 0.13 -5.02 114.28 103.36 3m13 n THR 363 Ca -0.01 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 3m13 n THR 363 Cb 0.78 1.27 0.00 0.00 -2.10 0.00 0.00 70.33 70.28 3m13 n THR 363 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3m13 n GLY 364 N 0.12 0.50 3.37 3.38 0.00 0.83 -4.96 105.19 108.42 3m13 n GLY 364 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 3m13 n GLY 364 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m13 s LYS 365 N -0.45 1.45 0.06 1.61 1.02 -1.26 -4.88 119.74 117.28 3m13 s LYS 365 Ca 0.00 -1.76 0.03 0.00 0.02 0.00 0.00 55.97 54.26 3m13 s LYS 365 Cb 0.00 -0.66 -0.03 0.00 -0.52 0.00 0.00 37.83 36.63 3m13 s LYS 365 CO 0.00 -0.15 -0.10 -0.08 -0.92 0.00 0.00 175.35 174.10 3m13 s THR 366 N -3.42 0.77 0.04 2.17 -1.32 -1.26 -2.63 115.64 109.99 3m13 s THR 366 Ca 0.32 -1.20 0.31 0.00 -1.21 0.00 0.00 61.69 59.92 3m13 s THR 366 Cb 0.07 -0.82 0.37 0.00 -1.51 0.00 0.00 72.50 70.61 3m13 s THR 366 CO 0.12 -0.34 1.92 1.05 -2.21 0.00 0.00 174.62 175.16 3m13 h GLU 367 N 4.37 0.00 -7.01 7.08 4.11 -1.97 -3.45 114.58 117.70 3m13 h GLU 367 Ca -0.38 0.00 -0.49 0.00 0.07 0.00 0.00 59.36 58.56 3m13 h GLU 367 Cb 1.20 0.00 0.04 0.00 0.50 0.00 0.00 28.75 30.49 3m13 h GLU 367 CO 0.41 0.03 0.16 -1.01 0.07 0.00 0.00 179.01 178.67 3m13 s HIS 368 N -3.61 3.56 -0.57 2.06 3.76 -1.26 -5.05 115.29 114.18 3m13 s HIS 368 Ca 0.02 0.89 -0.25 0.00 -0.15 0.00 0.00 55.06 55.56 3m13 s HIS 368 Cb 0.09 -2.39 0.04 0.00 1.11 0.00 0.00 32.58 31.43 3m13 s HIS 368 CO 0.57 -0.37 1.04 0.34 -0.85 0.00 0.00 174.74 175.47 3m13 s ASP 369 N -4.13 6.35 -0.21 1.40 -1.08 -1.26 -4.90 116.67 112.85 3m13 s ASP 369 Ca 0.49 -0.25 0.13 0.00 -0.52 0.00 0.00 52.55 52.40 3m13 s ASP 369 Cb -0.10 -2.48 0.43 0.00 -1.46 0.00 0.00 42.92 39.30 3m13 s ASP 369 CO 0.46 -1.35 1.29 2.30 0.52 0.00 0.00 175.17 178.40 3m13 n ILE 370 N 6.33 2.23 -0.04 4.11 -5.35 -1.26 -4.78 119.36 120.60 3m13 n ILE 370 Ca 0.04 -2.70 -0.10 0.00 -0.27 0.00 0.00 62.75 59.71 3m13 n ILE 370 Cb 0.48 -0.26 -0.04 0.00 -1.74 0.00 0.00 39.64 38.08 3m13 n ILE 370 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 3m13 h SER 371 N 0.85 0.22 0.23 7.28 4.64 -1.94 -0.00 113.55 124.83 3m13 h SER 371 Ca 0.06 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3m13 h SER 371 Cb 1.23 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3m13 h SER 371 CO 0.13 0.20 0.00 2.30 -0.87 0.00 0.00 176.83 178.60 3m13 n ILE 372 N -4.93 1.49 0.41 0.95 -5.35 -1.26 -2.13 119.36 108.53 3m13 n ILE 372 Ca -0.04 0.37 0.10 0.00 -0.27 0.00 0.00 62.75 62.91 3m13 n ILE 372 Cb 0.05 -1.25 0.15 0.00 -1.74 0.00 0.00 39.64 36.85 3m13 n ILE 372 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3m13 n PHE 373 N -1.49 0.30 -1.71 4.28 3.72 -0.03 -4.74 117.46 117.80 3m13 n PHE 373 Ca 0.02 -0.18 -0.42 0.00 -0.05 0.00 0.00 57.45 56.81 3m13 n PHE 373 Cb 0.08 -0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.61 3m13 n PHE 373 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3m13 n SER 374 N 1.19 2.87 0.00 4.37 2.88 -0.91 -1.67 113.62 122.35 3m13 n SER 374 Ca 0.15 1.20 0.13 0.00 -1.33 0.00 0.00 58.87 59.02 3m13 n SER 374 Cb 0.52 -1.50 0.65 0.00 -0.75 0.00 0.00 64.21 63.12 3m13 n SER 374 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3m13 n ILE 375 N 0.28 0.13 1.03 2.46 3.06 -1.26 -3.22 119.36 121.83 3m13 n ILE 375 Ca 0.04 0.03 0.12 0.00 -2.50 0.00 0.00 62.75 60.44 3m13 n ILE 375 Cb 0.37 -0.58 0.18 0.00 0.54 0.00 0.00 39.64 40.15 3m13 n ILE 375 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64 3m13 n ASN 376 N -1.37 0.72 -4.77 9.51 5.03 -1.26 -4.99 115.26 118.13 3m13 n ASN 376 Ca 0.11 -0.52 -0.40 0.00 0.87 0.00 0.00 54.58 54.63 3m13 n ASN 376 Cb 0.25 0.40 -0.02 0.00 -1.02 0.00 0.00 39.78 39.40 3m13 n ASN 376 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3m13 s ARG 377 N -2.92 4.24 0.36 3.52 1.70 -1.20 -4.97 118.95 119.68 3m13 s ARG 377 Ca 0.12 2.17 0.05 0.00 -0.47 0.00 0.00 55.73 57.60 3m13 s ARG 377 Cb 0.17 -2.97 0.68 0.00 -0.57 0.00 0.00 34.95 32.27 3m13 s ARG 377 CO 0.71 -0.27 1.94 -1.35 -1.08 0.00 0.00 175.30 175.25 3m13 h PRO 378 N 3.16 0.56 0.00 3.89 0.11 -1.94 -3.14 132.00 134.63 3m13 h PRO 378 Ca -0.49 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.54 3m13 h PRO 378 Cb 1.23 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3m13 h PRO 378 CO 0.64 0.50 0.00 0.00 -0.21 0.00 0.00 178.00 178.93 3m13 h ALA 379 N 1.58 1.00 0.00 -0.75 0.00 -1.99 0.15 119.26 119.26 3m13 h ALA 379 Ca 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 3m13 h ALA 379 Cb 0.18 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 3m13 h ALA 379 CO -0.01 0.00 -0.14 1.25 0.00 0.00 0.00 179.25 180.36 3m13 h LEU 380 N 0.00 0.00 0.00 0.00 5.85 -1.94 -3.38 115.31 115.85 3m13 h LEU 380 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3m13 h LEU 380 Cb 0.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.22 3m13 h LEU 380 CO 0.00 0.14 0.00 0.29 -0.34 0.00 0.00 178.44 178.53