#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ra7 s GLU 2 N 0.00 0.57 -0.06 1.61 2.12 -0.17 -0.28 118.70 122.48 1ra7 s GLU 2 Ca 0.00 0.97 -0.30 0.00 0.36 0.00 0.00 54.97 56.00 1ra7 s GLU 2 Cb 0.00 0.10 -0.03 0.00 0.26 0.00 0.00 34.13 34.46 1ra7 s GLU 2 CO 0.00 -0.14 1.18 0.42 -0.54 0.00 0.00 175.26 176.17 1ra7 s ILE 3 N 1.32 4.31 -0.01 -3.70 1.01 -1.26 -0.19 121.20 122.69 1ra7 s ILE 3 Ca -0.08 1.63 -0.03 0.00 0.00 0.00 0.00 60.65 62.17 1ra7 s ILE 3 Cb -0.06 -4.05 -0.27 0.00 0.01 0.00 0.00 42.46 38.08 1ra7 s ILE 3 CO -0.14 0.00 0.82 1.56 0.00 0.00 0.00 174.94 177.19 1ra7 h GLN 4 N 7.40 0.24 -1.72 2.79 1.08 -1.94 -3.48 115.11 119.48 1ra7 h GLN 4 Ca -0.34 -0.41 0.03 0.00 -1.45 0.00 0.00 58.65 56.48 1ra7 h GLN 4 Cb 1.16 0.15 -0.22 0.00 -0.05 0.00 0.00 27.48 28.52 1ra7 h GLN 4 CO 0.88 1.09 0.40 1.67 -0.95 0.00 0.00 178.83 181.92 1ra7 s TRP 5 N -2.61 -0.50 -0.02 2.96 1.48 -1.26 -5.11 118.94 113.88 1ra7 s TRP 5 Ca -0.10 0.96 0.00 0.00 -1.06 0.00 0.00 56.10 55.91 1ra7 s TRP 5 Cb 0.07 0.41 0.03 0.00 -1.16 0.00 0.00 33.47 32.82 1ra7 s TRP 5 CO 0.85 -0.39 0.02 1.41 -4.06 0.00 0.00 176.95 174.77 1ra7 s MET 6 N -0.77 0.06 0.18 3.25 1.75 -1.26 -4.33 119.30 118.18 1ra7 s MET 6 Ca -0.03 0.16 -0.15 0.00 -1.25 0.00 0.00 55.69 54.41 1ra7 s MET 6 Cb -0.02 -0.32 0.02 0.00 2.84 0.00 0.00 34.83 37.35 1ra7 s MET 6 CO 0.02 -0.16 0.44 -0.98 -0.65 0.00 0.00 175.02 173.70 1ra7 s ARG 7 N 1.07 1.28 -0.16 4.11 1.70 0.59 -4.96 118.95 122.58 1ra7 s ARG 7 Ca -0.09 -0.92 -0.38 0.00 -0.47 0.00 0.00 55.73 53.87 1ra7 s ARG 7 Cb -0.13 0.48 -0.15 0.00 -0.57 0.00 0.00 34.95 34.57 1ra7 s ARG 7 CO -0.03 -0.52 1.67 -2.30 -1.08 0.00 0.00 175.30 173.04 1ra7 n PRO 8 N -0.29 1.31 0.28 3.89 -0.02 -1.26 0.34 135.00 139.25 1ra7 n PRO 8 Ca -0.10 0.48 0.18 0.00 -2.02 0.00 0.00 63.50 62.04 1ra7 n PRO 8 Cb 0.63 -2.18 0.96 0.00 -0.02 0.00 0.00 33.50 32.89 1ra7 n PRO 8 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1ra7 h SER 9 N 6.85 0.00 -0.14 2.55 0.02 -0.02 -1.30 113.55 121.51 1ra7 h SER 9 Ca -0.47 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.33 1ra7 h SER 9 Cb 1.31 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.85 1ra7 h SER 9 CO 0.92 0.00 -0.45 0.07 -1.14 0.00 0.00 176.83 176.22 1ra7 h LYS 10 N 0.00 0.70 -0.53 3.45 2.10 -1.74 0.53 116.57 121.08 1ra7 h LYS 10 Ca 0.03 -0.39 0.15 0.00 -2.00 0.00 0.00 60.65 58.44 1ra7 h LYS 10 Cb 0.24 0.02 -0.02 0.00 -0.90 0.00 0.00 32.23 31.57 1ra7 h LYS 10 CO -0.00 1.00 0.40 0.93 -2.00 0.00 0.00 179.45 179.78 1ra7 h GLU 11 N 0.56 0.00 -0.29 0.07 5.08 -1.56 -1.90 114.58 116.53 1ra7 h GLU 11 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1ra7 h GLU 11 Cb 1.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 1ra7 h GLU 11 CO 0.09 0.00 0.00 1.33 -1.00 0.00 0.00 179.01 179.43 1ra7 n VAL 12 N -4.28 1.27 -1.08 3.13 0.24 -1.11 -4.98 118.33 111.52 1ra7 n VAL 12 Ca 0.10 -1.19 0.00 0.00 -2.04 0.00 0.00 64.34 61.20 1ra7 n VAL 12 Cb 0.62 0.34 0.00 0.00 -1.47 0.00 0.00 33.84 33.33 1ra7 n VAL 12 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ra7 n GLY 13 N 0.18 0.65 3.44 7.63 0.00 -0.71 -5.07 105.19 111.31 1ra7 n GLY 13 Ca 0.12 -0.75 -0.33 0.00 0.00 0.00 0.00 46.02 45.07 1ra7 n GLY 13 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ra7 s TYR 14 N -2.00 2.77 0.49 1.61 1.51 0.18 -5.00 117.35 116.91 1ra7 s TYR 14 Ca 0.00 -0.34 -0.22 0.00 -1.01 0.00 0.00 57.07 55.51 1ra7 s TYR 14 Cb 0.00 -1.73 -0.07 0.00 -0.11 0.00 0.00 41.96 40.05 1ra7 s TYR 14 CO 0.00 0.03 1.14 -1.25 -1.11 0.00 0.00 175.55 174.36 1ra7 s PRO 15 N -0.28 3.65 0.29 -1.71 0.04 -1.26 -3.25 135.00 132.48 1ra7 s PRO 15 Ca 0.02 1.67 -0.29 0.00 0.04 0.00 0.00 61.00 62.44 1ra7 s PRO 15 Cb -0.13 -2.25 -0.10 0.00 0.04 0.00 0.00 34.50 32.06 1ra7 s PRO 15 CO 0.03 -0.62 1.29 0.42 0.04 0.00 0.00 177.00 178.16 1ra7 s ILE 16 N -1.66 2.91 -0.24 0.56 1.01 -1.26 -4.94 121.20 117.57 1ra7 s ILE 16 Ca 0.67 0.87 -0.14 0.00 0.00 0.00 0.00 60.65 62.04 1ra7 s ILE 16 Cb -0.26 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 1ra7 s ILE 16 CO 0.30 0.19 0.32 -0.63 0.00 0.00 0.00 174.94 175.12 1ra7 s ILE 17 N -0.82 5.23 -0.08 2.92 -1.09 0.23 -4.98 121.20 122.62 1ra7 s ILE 17 Ca 0.51 0.50 -0.26 0.00 -2.23 0.00 0.00 60.65 59.17 1ra7 s ILE 17 Cb -0.38 -3.65 -0.03 0.00 -1.58 0.00 0.00 42.46 36.82 1ra7 s ILE 17 CO 0.48 0.24 0.82 0.20 -1.23 0.00 0.00 174.94 175.44 1ra7 s ASN 18 N 1.31 7.08 -0.06 3.58 0.01 -1.26 -4.07 114.94 121.53 1ra7 s ASN 18 Ca 0.14 1.31 0.00 0.00 -0.71 0.00 0.00 52.86 53.60 1ra7 s ASN 18 Cb -0.15 -2.47 0.02 0.00 0.41 0.00 0.00 41.25 39.07 1ra7 s ASN 18 CO 0.08 -0.24 -0.03 0.00 -1.51 0.00 0.00 177.10 175.40 1ra7 s ALA 19 N 1.27 0.75 0.49 0.60 0.00 -1.26 -5.07 121.76 118.53 1ra7 s ALA 19 Ca 0.42 -0.13 -0.19 0.00 0.00 0.00 0.00 51.96 52.06 1ra7 s ALA 19 Cb -0.18 -0.57 -0.13 0.00 0.00 0.00 0.00 23.12 22.24 1ra7 s ALA 19 CO 0.19 -0.18 0.23 -2.30 0.00 0.00 0.00 175.76 173.70 1ra7 n PRO 20 N 4.46 0.26 0.00 0.00 -0.02 -1.26 -4.89 135.00 133.55 1ra7 n PRO 20 Ca -0.18 0.10 0.05 0.00 -2.02 0.00 0.00 63.50 61.44 1ra7 n PRO 20 Cb 0.51 -1.31 0.02 0.00 -0.02 0.00 0.00 33.50 32.70 1ra7 n PRO 20 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ra7 n SER 21 N 1.64 1.55 -4.26 2.55 3.41 -1.26 -4.95 113.62 112.30 1ra7 n SER 21 Ca 0.10 -1.27 -0.32 0.00 -0.26 0.00 0.00 58.87 57.12 1ra7 n SER 21 Cb 0.45 0.18 -0.16 0.00 -0.26 0.00 0.00 64.21 64.41 1ra7 n SER 21 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1ra7 s LYS 22 N -0.97 3.14 0.51 4.33 2.20 -1.26 -4.70 119.74 122.99 1ra7 s LYS 22 Ca 0.10 -0.83 -0.22 0.00 -0.36 0.00 0.00 55.97 54.65 1ra7 s LYS 22 Cb 0.08 -2.39 -0.06 0.00 -1.51 0.00 0.00 37.83 33.95 1ra7 s LYS 22 CO 0.16 0.19 1.29 -0.08 -0.36 0.00 0.00 175.35 176.55 1ra7 s THR 23 N 0.34 2.44 -2.48 3.43 -1.32 -1.26 -4.91 115.64 111.89 1ra7 s THR 23 Ca -0.17 0.34 0.24 0.00 -1.21 0.00 0.00 61.69 60.89 1ra7 s THR 23 Cb -0.17 -3.17 0.45 0.00 -1.51 0.00 0.00 72.50 68.10 1ra7 s THR 23 CO 0.08 0.00 1.57 0.29 -2.21 0.00 0.00 174.62 174.35 1ra7 n LYS 24 N -0.77 1.88 -3.23 7.08 5.02 -1.26 -4.87 118.16 122.01 1ra7 n LYS 24 Ca 0.09 -1.30 -0.38 0.00 -2.02 0.00 0.00 58.31 54.70 1ra7 n LYS 24 Cb 0.46 -1.45 -0.06 0.00 -0.02 0.00 0.00 35.03 33.96 1ra7 n LYS 24 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ra7 s LEU 25 N -1.78 4.29 0.03 -0.35 1.43 -1.26 -4.09 118.68 116.95 1ra7 s LEU 25 Ca 0.35 0.94 -0.05 0.00 -1.03 0.00 0.00 54.13 54.34 1ra7 s LEU 25 Cb 0.20 -2.82 -0.01 0.00 0.03 0.00 0.00 46.19 43.58 1ra7 s LEU 25 CO 0.30 -0.03 0.08 -1.61 0.23 0.00 0.00 176.35 175.31 1ra7 s GLU 26 N 0.66 0.54 0.24 1.70 2.02 -0.36 -4.96 118.70 118.54 1ra7 s GLU 26 Ca 0.30 -0.71 -0.30 0.00 0.02 0.00 0.00 54.97 54.27 1ra7 s GLU 26 Cb -0.16 0.21 -0.14 0.00 0.10 0.00 0.00 34.13 34.13 1ra7 s GLU 26 CO 0.13 -0.13 1.13 -2.30 0.02 0.00 0.00 175.26 174.11 1ra7 n PRO 27 N 0.94 1.41 -3.07 0.39 -0.02 -1.26 -1.43 135.00 131.96 1ra7 n PRO 27 Ca -0.20 0.50 -0.18 0.00 -2.02 0.00 0.00 63.50 61.60 1ra7 n PRO 27 Cb 0.58 -1.96 0.02 0.00 -0.02 0.00 0.00 33.50 32.12 1ra7 n PRO 27 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1ra7 s SER 28 N -0.24 5.42 0.53 2.55 1.04 -0.96 -4.70 113.70 117.33 1ra7 s SER 28 Ca 0.65 -0.60 0.22 0.00 0.48 0.00 0.00 55.95 56.70 1ra7 s SER 28 Cb -0.74 -0.31 1.21 0.00 0.10 0.00 0.00 66.02 66.28 1ra7 s SER 28 CO 0.56 -0.96 1.64 0.00 0.98 0.00 0.00 173.24 175.47 1ra7 h ALA 29 N 0.51 1.30 -0.32 5.32 0.00 -1.90 0.43 119.26 124.60 1ra7 h ALA 29 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1ra7 h ALA 29 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1ra7 h ALA 29 CO 0.45 -0.30 0.00 1.19 0.00 0.00 0.00 179.25 180.59 1ra7 n PHE 30 N -2.54 0.42 -0.35 0.00 3.01 -1.26 -4.67 117.46 112.07 1ra7 n PHE 30 Ca -0.01 -0.36 0.15 0.00 1.01 0.00 0.00 57.45 58.24 1ra7 n PHE 30 Cb 0.37 -0.02 0.35 0.00 -0.01 0.00 0.00 39.48 40.18 1ra7 n PHE 30 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1ra7 h HIS 31 N 2.60 1.04 -0.02 1.38 2.76 -0.31 -1.44 115.15 121.16 1ra7 h HIS 31 Ca 0.00 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1ra7 h HIS 31 Cb 0.73 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 29.38 1ra7 h HIS 31 CO 0.21 0.15 -0.27 0.66 -1.30 0.00 0.00 177.93 177.38 1ra7 n TYR 32 N -4.83 0.00 0.11 5.26 4.02 -1.26 -4.18 117.16 116.28 1ra7 n TYR 32 Ca 0.25 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 58.18 1ra7 n TYR 32 Cb 0.65 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.98 1ra7 n TYR 32 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1ra7 h VAL 33 N 3.44 0.52 -2.85 -0.72 2.07 -1.56 -3.46 116.25 113.68 1ra7 h VAL 33 Ca 0.00 -1.82 -0.49 0.00 0.82 0.00 0.00 66.70 65.21 1ra7 h VAL 33 Cb 0.86 2.11 -0.15 0.00 -1.52 0.00 0.00 31.29 32.60 1ra7 h VAL 33 CO 0.00 0.29 -0.75 -0.36 0.02 0.00 0.00 177.57 176.78 1ra7 s PHE 34 N -3.04 1.82 0.18 1.57 0.08 -1.11 -5.05 117.98 112.44 1ra7 s PHE 34 Ca 0.02 -0.52 -0.10 0.00 0.12 0.00 0.00 56.93 56.45 1ra7 s PHE 34 Cb 0.08 -0.84 -0.07 0.00 -0.57 0.00 0.00 43.02 41.62 1ra7 s PHE 34 CO 0.76 0.41 0.51 -1.21 -0.10 0.00 0.00 175.22 175.60 1ra7 s GLU 35 N -3.47 3.81 -0.28 0.44 2.02 -1.26 -4.89 118.70 115.08 1ra7 s GLU 35 Ca 0.22 0.27 -0.26 0.00 0.02 0.00 0.00 54.97 55.22 1ra7 s GLU 35 Cb -0.02 -2.77 0.16 0.00 0.10 0.00 0.00 34.13 31.60 1ra7 s GLU 35 CO 0.08 0.40 1.26 0.20 0.02 0.00 0.00 175.26 177.22 1ra7 s GLY 36 N -2.15 0.10 0.00 -1.39 0.00 -1.26 -4.36 107.32 98.26 1ra7 s GLY 36 Ca 0.43 3.02 0.06 0.00 0.00 0.00 0.00 44.72 48.23 1ra7 s GLY 36 CO 0.21 1.70 1.10 3.33 0.00 0.00 0.00 173.10 179.43 1ra7 n VAL 37 N 1.53 0.90 -3.40 1.40 0.24 -1.26 -5.04 118.33 112.69 1ra7 n VAL 37 Ca -0.09 -0.95 -0.29 0.00 -2.04 0.00 0.00 64.34 60.97 1ra7 n VAL 37 Cb 0.57 0.57 -0.03 0.00 -1.47 0.00 0.00 33.84 33.47 1ra7 n VAL 37 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1ra7 s LYS 38 N -0.95 3.62 0.20 7.34 1.02 -1.26 -4.27 119.74 125.44 1ra7 s LYS 38 Ca 0.13 -0.04 0.00 0.00 0.02 0.00 0.00 55.97 56.08 1ra7 s LYS 38 Cb 0.07 -2.68 -0.05 0.00 -0.52 0.00 0.00 37.83 34.65 1ra7 s LYS 38 CO 0.09 0.25 0.08 -1.21 -0.92 0.00 0.00 175.35 173.64 1ra7 s GLU 39 N -3.47 1.21 0.63 1.68 2.02 -0.78 -4.89 118.70 115.10 1ra7 s GLU 39 Ca 0.43 -1.62 -0.18 0.00 0.02 0.00 0.00 54.97 53.61 1ra7 s GLU 39 Cb -0.11 -0.04 -0.02 0.00 0.10 0.00 0.00 34.13 34.06 1ra7 s GLU 39 CO 0.29 -0.28 1.27 -2.14 0.02 0.00 0.00 175.26 174.43 1ra7 s PRO 40 N -4.04 2.68 0.50 0.39 0.02 -1.26 -0.25 135.00 133.03 1ra7 s PRO 40 Ca 0.33 2.00 -0.18 0.00 0.02 0.00 0.00 61.00 63.16 1ra7 s PRO 40 Cb 0.07 -1.87 -0.08 0.00 0.02 0.00 0.00 34.50 32.64 1ra7 s PRO 40 CO 0.09 -1.48 1.00 0.00 -0.33 0.00 0.00 177.00 176.28 1ra7 s ALA 41 N -1.45 2.96 0.29 -1.55 0.00 0.38 -4.70 121.76 117.69 1ra7 s ALA 41 Ca 0.81 0.37 -0.30 0.00 0.00 0.00 0.00 51.96 52.85 1ra7 s ALA 41 Cb -0.35 -3.18 -0.11 0.00 0.00 0.00 0.00 23.12 19.48 1ra7 s ALA 41 CO 0.38 -0.25 1.56 0.08 0.00 0.00 0.00 175.76 177.53 1ra7 s VAL 42 N -2.33 2.19 -0.09 0.00 1.01 -1.26 -4.86 120.40 115.06 1ra7 s VAL 42 Ca 0.62 0.16 0.07 0.00 0.00 0.00 0.00 61.98 62.83 1ra7 s VAL 42 Cb -0.12 -3.10 -0.10 0.00 0.00 0.00 0.00 36.38 33.06 1ra7 s VAL 42 CO 0.25 0.03 0.18 0.18 0.00 0.00 0.00 175.10 175.73 1ra7 n LEU 43 N 2.18 0.08 -3.96 3.92 4.32 -1.26 -4.81 117.00 117.47 1ra7 n LEU 43 Ca 0.08 -0.13 -0.08 0.00 -0.02 0.00 0.00 56.01 55.85 1ra7 n LEU 43 Cb 0.38 0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 42.09 1ra7 n LEU 43 CO 0.63 0.02 -0.22 0.42 -1.22 0.00 0.00 177.39 177.02 1ra7 s THR 44 N -2.25 0.16 0.59 -5.08 -4.23 -1.26 -4.92 115.64 98.65 1ra7 s THR 44 Ca -0.01 -1.35 0.30 0.00 -1.18 0.00 0.00 61.69 59.45 1ra7 s THR 44 Cb 0.04 -1.23 0.36 0.00 1.34 0.00 0.00 72.50 73.02 1ra7 s THR 44 CO 0.28 -0.74 2.21 0.11 -0.54 0.00 0.00 174.62 175.93 1ra7 h LYS 45 N 3.22 0.00 -0.00 3.99 6.56 -1.98 -2.68 116.57 125.68 1ra7 h LYS 45 Ca -0.33 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.26 1ra7 h LYS 45 Cb 1.18 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.84 1ra7 h LYS 45 CO 0.57 0.00 -0.15 0.09 -2.06 0.00 0.00 179.45 177.90 1ra7 n ASN 46 N -3.79 0.16 -4.60 0.86 3.02 -1.26 -4.84 115.26 104.82 1ra7 n ASN 46 Ca -0.02 0.24 -0.51 0.00 -0.03 0.00 0.00 54.58 54.26 1ra7 n ASN 46 Cb 0.16 -0.27 -0.06 0.00 -0.61 0.00 0.00 39.78 39.01 1ra7 n ASN 46 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1ra7 n ASP 47 N -1.48 2.67 0.22 6.41 -0.08 -1.01 -4.81 116.55 118.47 1ra7 n ASP 47 Ca 0.07 0.76 0.17 0.00 -1.51 0.00 0.00 54.79 54.28 1ra7 n ASP 47 Cb 0.34 -1.28 0.77 0.00 2.34 0.00 0.00 41.12 43.28 1ra7 n ASP 47 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1ra7 h PRO 48 N 10.15 0.00 0.00 -0.67 0.11 -1.92 -1.14 132.00 138.53 1ra7 h PRO 48 Ca -0.40 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.68 1ra7 h PRO 48 Cb 1.30 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.41 1ra7 h PRO 48 CO 0.98 0.00 -0.17 0.00 -0.21 0.00 0.00 178.00 178.60 1ra7 h ARG 49 N 0.00 0.00 -6.69 1.05 3.08 -1.93 -3.45 114.38 106.43 1ra7 h ARG 49 Ca 0.09 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.59 1ra7 h ARG 49 Cb 0.90 0.00 0.08 0.00 0.08 0.00 0.00 29.97 31.03 1ra7 h ARG 49 CO -0.00 0.17 0.81 1.28 -1.07 0.00 0.00 179.97 181.15 1ra7 n LEU 50 N -3.24 3.83 -0.07 3.04 4.77 -0.43 -4.39 117.00 120.50 1ra7 n LEU 50 Ca 0.01 1.13 0.06 0.00 -0.03 0.00 0.00 56.01 57.19 1ra7 n LEU 50 Cb 0.46 -1.53 0.10 0.00 -2.33 0.00 0.00 43.42 40.12 1ra7 n LEU 50 CO 0.33 -0.08 0.55 0.29 -1.33 0.00 0.00 177.39 177.15 1ra7 n LYS 51 N 2.44 1.93 -3.60 3.23 5.02 -0.57 -5.04 118.16 121.57 1ra7 n LYS 51 Ca 0.11 -2.21 -0.05 0.00 -2.02 0.00 0.00 58.31 54.14 1ra7 n LYS 51 Cb 0.34 -1.33 -0.02 0.00 -0.02 0.00 0.00 35.03 34.00 1ra7 n LYS 51 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1ra7 s THR 52 N -2.21 0.00 0.21 -0.18 -1.32 -1.25 -4.99 115.64 105.89 1ra7 s THR 52 Ca 0.21 -0.20 -0.32 0.00 -1.21 0.00 0.00 61.69 60.17 1ra7 s THR 52 Cb 0.18 -1.36 -0.12 0.00 -1.51 0.00 0.00 72.50 69.69 1ra7 s THR 52 CO 0.02 0.00 1.71 -0.62 -2.21 0.00 0.00 174.62 173.53 1ra7 s ASP 53 N -2.61 6.39 0.04 8.08 2.15 -1.26 -4.82 116.67 124.64 1ra7 s ASP 53 Ca 0.08 2.86 -0.26 0.00 0.43 0.00 0.00 52.55 55.66 1ra7 s ASP 53 Cb -0.00 -2.60 -0.17 0.00 -0.30 0.00 0.00 42.92 39.84 1ra7 s ASP 53 CO -0.05 -0.97 1.45 0.15 -0.17 0.00 0.00 175.17 175.59 1ra7 h PHE 54 N 6.80 -0.25 -0.22 -5.34 3.57 -1.93 -2.47 116.94 117.10 1ra7 h PHE 54 Ca -0.43 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.10 1ra7 h PHE 54 Cb 1.20 0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.99 1ra7 h PHE 54 CO 0.64 0.01 0.02 1.49 -2.23 0.00 0.00 178.31 178.24 1ra7 h GLU 55 N -0.49 0.09 -0.62 1.11 4.81 -1.94 0.27 114.58 117.80 1ra7 h GLU 55 Ca -0.03 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1ra7 h GLU 55 Cb 0.37 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.69 1ra7 h GLU 55 CO 0.05 0.06 0.41 1.49 -0.73 0.00 0.00 179.01 180.29 1ra7 h GLU 56 N 0.10 0.67 0.15 1.92 4.81 -1.97 -2.51 114.58 117.76 1ra7 h GLU 56 Ca 0.10 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1ra7 h GLU 56 Cb 0.12 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.35 1ra7 h GLU 56 CO -0.16 0.45 -0.07 0.00 -0.73 0.00 0.00 179.01 178.50 1ra7 h ALA 57 N 1.65 -0.21 0.00 2.92 0.00 -0.74 -1.88 119.26 121.00 1ra7 h ALA 57 Ca 0.26 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ra7 h ALA 57 Cb 0.14 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1ra7 h ALA 57 CO -0.07 -0.35 -0.05 -0.84 0.00 0.00 0.00 179.25 177.93 1ra7 h ILE 58 N -0.73 0.82 -0.02 0.00 3.07 -0.87 -2.36 117.51 117.41 1ra7 h ILE 58 Ca -0.02 -0.19 0.00 0.00 1.55 0.00 0.00 64.86 66.20 1ra7 h ILE 58 Cb 0.52 1.11 0.00 0.00 -0.27 0.00 0.00 36.82 38.18 1ra7 h ILE 58 CO 0.03 0.05 -0.25 0.49 -1.05 0.00 0.00 178.15 177.43 1ra7 n PHE 59 N -4.16 0.00 0.31 0.16 0.99 -0.96 -4.33 117.46 109.47 1ra7 n PHE 59 Ca -0.03 0.00 0.10 0.00 -0.00 0.00 0.00 57.45 57.52 1ra7 n PHE 59 Cb 0.14 -0.00 0.44 0.00 -1.00 0.00 0.00 39.48 39.06 1ra7 n PHE 59 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1ra7 n SER 60 N 0.63 0.47 0.28 4.37 3.41 -0.71 -2.28 113.62 119.79 1ra7 n SER 60 Ca 0.12 0.65 0.14 0.00 -0.26 0.00 0.00 58.87 59.52 1ra7 n SER 60 Cb 0.53 -0.74 0.82 0.00 -0.26 0.00 0.00 64.21 64.56 1ra7 n SER 60 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1ra7 h LYS 61 N 0.00 0.00 -4.86 4.33 2.10 -1.75 -3.31 116.57 113.07 1ra7 h LYS 61 Ca 0.00 0.00 -0.70 0.00 -2.00 0.00 0.00 60.65 57.95 1ra7 h LYS 61 Cb 0.21 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 31.48 1ra7 h LYS 61 CO 0.00 0.07 2.63 0.66 -2.00 0.00 0.00 179.45 180.80 1ra7 n TYR 62 N -3.70 4.08 0.76 0.07 0.53 -0.97 -4.39 117.16 113.54 1ra7 n TYR 62 Ca -0.02 -2.92 0.07 0.00 -1.02 0.00 0.00 57.90 54.01 1ra7 n TYR 62 Cb 0.17 -2.57 0.39 0.00 -1.03 0.00 0.00 39.34 36.30 1ra7 n TYR 62 CO 0.00 0.00 0.00 1.33 -1.02 0.00 0.00 176.86 177.17 1ra7 n VAL 63 N 5.63 0.43 0.00 -0.72 0.24 -1.22 -4.64 118.33 118.04 1ra7 n VAL 63 Ca 0.50 0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.91 1ra7 n VAL 63 Cb 0.42 -0.87 0.00 0.00 -1.47 0.00 0.00 33.84 31.92 1ra7 n VAL 63 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ra7 n GLY 64 N -0.06 1.68 3.11 7.63 0.00 0.61 -4.96 105.19 113.20 1ra7 n GLY 64 Ca 0.08 -2.18 -0.35 0.00 0.00 0.00 0.00 46.02 43.57 1ra7 n GLY 64 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ra7 s ASN 65 N 0.00 5.07 0.36 1.61 0.01 -1.26 -1.64 114.94 119.10 1ra7 s ASN 65 Ca 0.00 -1.90 0.12 0.00 -0.71 0.00 0.00 52.86 50.37 1ra7 s ASN 65 Cb 0.00 -1.76 0.70 0.00 0.41 0.00 0.00 41.25 40.60 1ra7 s ASN 65 CO 0.00 -0.45 1.82 0.50 -1.51 0.00 0.00 177.10 177.46 1ra7 h LYS 66 N 7.94 0.05 -5.88 -0.60 1.63 -1.87 -3.45 116.57 114.39 1ra7 h LYS 66 Ca -0.13 -0.02 -0.52 0.00 -0.85 0.00 0.00 60.65 59.14 1ra7 h LYS 66 Cb 1.04 -0.00 -0.16 0.00 -0.60 0.00 0.00 32.23 32.51 1ra7 h LYS 66 CO 0.62 0.40 -0.76 0.96 -3.45 0.00 0.00 179.45 177.22 1ra7 s ILE 67 N -4.24 1.94 -0.06 2.00 -4.36 -1.26 -4.87 121.20 110.36 1ra7 s ILE 67 Ca -0.03 -2.13 -0.09 0.00 -0.26 0.00 0.00 60.65 58.14 1ra7 s ILE 67 Cb 0.14 -2.02 -0.03 0.00 1.25 0.00 0.00 42.46 41.80 1ra7 s ILE 67 CO 0.73 -0.43 -0.19 0.41 0.24 0.00 0.00 174.94 175.71 1ra7 n THR 68 N -0.14 1.34 -2.74 8.37 -1.04 -1.26 -4.60 114.28 114.21 1ra7 n THR 68 Ca -0.10 0.23 -0.20 0.00 -2.04 0.00 0.00 64.05 61.95 1ra7 n THR 68 Cb 0.59 -1.97 0.03 0.00 -1.82 0.00 0.00 70.33 67.16 1ra7 n THR 68 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1ra7 s GLU 69 N -2.47 2.59 -0.41 -2.82 2.02 -1.26 -4.25 118.70 112.10 1ra7 s GLU 69 Ca -0.16 -0.93 -0.20 0.00 0.02 0.00 0.00 54.97 53.71 1ra7 s GLU 69 Cb 0.03 -2.56 0.02 0.00 0.10 0.00 0.00 34.13 31.71 1ra7 s GLU 69 CO 0.23 -0.62 0.58 0.08 0.02 0.00 0.00 175.26 175.55 1ra7 s VAL 70 N -2.66 4.92 0.59 2.63 1.01 -1.26 -4.88 120.40 120.74 1ra7 s VAL 70 Ca 0.57 0.13 -0.10 0.00 0.00 0.00 0.00 61.98 62.58 1ra7 s VAL 70 Cb -0.10 -4.11 0.14 0.00 0.00 0.00 0.00 36.38 32.30 1ra7 s VAL 70 CO 0.37 -0.46 0.77 -0.90 0.00 0.00 0.00 175.10 174.88 1ra7 n ASP 71 N 6.02 -0.07 -0.23 3.32 5.68 -1.26 -4.81 116.55 125.19 1ra7 n ASP 71 Ca -0.03 -1.25 -0.05 0.00 -0.50 0.00 0.00 54.79 52.95 1ra7 n ASP 71 Cb 0.48 -0.60 0.05 0.00 -1.14 0.00 0.00 41.12 39.91 1ra7 n ASP 71 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1ra7 h GLU 72 N 0.00 0.85 0.22 0.11 4.11 -1.99 -1.66 114.58 116.23 1ra7 h GLU 72 Ca -0.25 -0.05 -0.01 0.00 0.07 0.00 0.00 59.36 59.12 1ra7 h GLU 72 Cb 0.70 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1ra7 h GLU 72 CO 0.18 0.56 -0.11 1.88 0.07 0.00 0.00 179.01 181.59 1ra7 h TYR 73 N 0.87 -0.28 -0.64 2.06 -1.99 -1.93 -0.76 116.97 114.30 1ra7 h TYR 73 Ca 0.24 -0.01 0.10 0.00 2.00 0.00 0.00 58.73 61.07 1ra7 h TYR 73 Cb -0.09 0.09 -0.07 0.00 2.00 0.00 0.00 36.73 38.66 1ra7 h TYR 73 CO -0.03 -0.14 0.26 0.52 -0.00 0.00 0.00 178.16 178.76 1ra7 h MET 74 N -0.34 0.43 -0.63 4.88 2.86 -1.87 0.17 114.93 120.42 1ra7 h MET 74 Ca -0.03 -0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1ra7 h MET 74 Cb 0.26 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.79 1ra7 h MET 74 CO 0.05 0.29 0.39 0.87 1.06 0.00 0.00 176.91 179.57 1ra7 h LYS 75 N 0.44 0.75 -0.32 1.72 1.57 -0.89 0.34 116.57 120.18 1ra7 h LYS 75 Ca 0.33 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.94 1ra7 h LYS 75 Cb 0.41 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1ra7 h LYS 75 CO -0.31 0.49 -0.30 1.49 -0.57 0.00 0.00 179.45 180.26 1ra7 h GLU 76 N 0.77 0.68 -0.53 3.15 4.81 -0.14 -1.33 114.58 121.99 1ra7 h GLU 76 Ca 0.25 -0.30 0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1ra7 h GLU 76 Cb 0.02 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 1ra7 h GLU 76 CO -0.10 0.90 0.33 0.00 -0.73 0.00 0.00 179.01 179.41 1ra7 h ALA 77 N 1.09 0.68 -0.36 2.92 0.00 0.39 -0.94 119.26 123.03 1ra7 h ALA 77 Ca 0.07 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1ra7 h ALA 77 Cb 0.80 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1ra7 h ALA 77 CO 0.07 0.06 0.21 0.28 0.00 0.00 0.00 179.25 179.86 1ra7 h VAL 78 N 0.67 1.03 -0.33 0.00 2.07 0.01 -1.31 116.25 118.39 1ra7 h VAL 78 Ca 0.21 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.59 1ra7 h VAL 78 Cb -0.02 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 1ra7 h VAL 78 CO -0.08 0.08 0.21 0.44 0.02 0.00 0.00 177.57 178.25 1ra7 h ASP 79 N 0.42 0.38 -0.42 0.57 3.32 -0.64 -0.50 116.42 119.55 1ra7 h ASP 79 Ca 0.15 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.13 1ra7 h ASP 79 Cb 0.02 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1ra7 h ASP 79 CO -0.07 0.28 0.06 -0.74 -1.72 0.00 0.00 179.24 177.04 1ra7 h HIS 80 N 0.44 0.75 -0.14 4.55 2.76 -0.97 -0.94 115.15 121.61 1ra7 h HIS 80 Ca 0.12 -0.11 -0.03 0.00 -2.20 0.00 0.00 60.37 58.15 1ra7 h HIS 80 Cb -0.05 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 28.71 1ra7 h HIS 80 CO -0.05 0.73 -0.04 -0.92 -1.30 0.00 0.00 177.93 176.34 1ra7 h TYR 81 N 0.55 0.30 -0.64 5.26 3.20 -1.15 -1.91 116.97 122.59 1ra7 h TYR 81 Ca 0.13 -0.07 0.10 0.00 3.14 0.00 0.00 58.73 62.03 1ra7 h TYR 81 Cb 0.39 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.55 1ra7 h TYR 81 CO 0.03 0.57 0.43 0.00 -1.64 0.00 0.00 178.16 177.54 1ra7 h ALA 82 N 0.69 1.97 -0.05 1.82 0.00 -1.10 -0.62 119.26 121.97 1ra7 h ALA 82 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ra7 h ALA 82 Cb 0.48 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1ra7 h ALA 82 CO 0.02 -0.11 0.03 0.78 0.00 0.00 0.00 179.25 179.97 1ra7 h GLY 83 N 0.47 0.08 0.99 0.00 0.00 -0.57 -2.01 103.07 102.03 1ra7 h GLY 83 Ca 0.29 -0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.59 1ra7 h GLY 83 CO -0.09 0.03 0.33 1.46 0.00 0.00 0.00 176.54 178.27 1ra7 h GLN 84 N 0.05 0.79 0.00 4.80 4.20 -0.39 -2.36 115.11 122.20 1ra7 h GLN 84 Ca 0.02 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 1ra7 h GLN 84 Cb 0.02 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.64 1ra7 h GLN 84 CO -0.00 0.60 -0.07 -0.07 -0.67 0.00 0.00 178.83 178.61 1ra7 h LEU 85 N 0.78 0.00 -1.50 1.46 3.38 -1.18 -2.40 115.31 115.86 1ra7 h LEU 85 Ca 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 1ra7 h LEU 85 Cb 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1ra7 h LEU 85 CO -0.03 0.07 0.29 -0.03 0.09 0.00 0.00 178.44 178.83 1ra7 h MET 86 N 0.00 0.63 0.00 1.13 4.05 -0.80 -1.94 114.93 118.00 1ra7 h MET 86 Ca -0.00 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1ra7 h MET 86 Cb 0.17 -0.14 0.00 0.00 -0.80 0.00 0.00 31.60 30.84 1ra7 h MET 86 CO 0.01 0.44 0.00 -1.13 0.23 0.00 0.00 176.91 176.45 1ra7 n SER 87 N -4.45 0.00 -0.09 1.39 3.41 -0.90 -2.47 113.62 110.52 1ra7 n SER 87 Ca 0.04 -0.01 0.12 0.00 -0.26 0.00 0.00 58.87 58.76 1ra7 n SER 87 Cb 0.07 -0.23 0.21 0.00 -0.26 0.00 0.00 64.21 64.00 1ra7 n SER 87 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ra7 n LEU 88 N -1.23 0.79 -3.83 1.04 4.77 -0.73 -4.95 117.00 112.85 1ra7 n LEU 88 Ca 0.07 -0.18 -0.29 0.00 -0.03 0.00 0.00 56.01 55.58 1ra7 n LEU 88 Cb 0.10 -0.17 0.02 0.00 -2.33 0.00 0.00 43.42 41.04 1ra7 n LEU 88 CO 0.10 0.17 0.09 0.47 -1.33 0.00 0.00 177.39 176.90 1ra7 n ASP 89 N -1.21 -4.80 -4.68 -1.43 8.00 -1.03 -4.82 116.55 106.58 1ra7 n ASP 89 Ca 0.07 -0.72 -0.49 0.00 0.71 0.00 0.00 54.79 54.36 1ra7 n ASP 89 Cb 0.34 -3.84 -0.05 0.00 -0.02 0.00 0.00 41.12 37.56 1ra7 n ASP 89 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1ra7 n ILE 90 N -4.61 0.45 -1.62 0.53 5.41 -1.26 -4.85 119.36 113.41 1ra7 n ILE 90 Ca 0.03 -0.08 -0.43 0.00 1.00 0.00 0.00 62.75 63.27 1ra7 n ILE 90 Cb 0.53 -1.73 -0.03 0.00 -0.71 0.00 0.00 39.64 37.70 1ra7 n ILE 90 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 1ra7 n ASN 91 N 5.93 3.53 -0.03 4.38 2.85 -1.26 -4.84 115.26 125.82 1ra7 n ASN 91 Ca 0.22 0.44 0.16 0.00 -0.11 0.00 0.00 54.58 55.29 1ra7 n ASN 91 Cb 0.27 -1.54 0.87 0.00 1.24 0.00 0.00 39.78 40.63 1ra7 n ASN 91 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1ra7 n THR 92 N 6.99 0.00 -0.86 -0.44 -2.24 -1.26 -4.55 114.28 111.92 1ra7 n THR 92 Ca 0.27 -0.01 -0.30 0.00 -2.27 0.00 0.00 64.05 61.73 1ra7 n THR 92 Cb 0.43 -0.44 0.17 0.00 -2.10 0.00 0.00 70.33 68.38 1ra7 n THR 92 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1ra7 s GLU 93 N -2.15 0.85 0.17 -0.78 2.02 -1.26 -4.90 118.70 112.65 1ra7 s GLU 93 Ca 0.42 1.18 -0.19 0.00 0.02 0.00 0.00 54.97 56.41 1ra7 s GLU 93 Cb 0.21 -1.73 -0.08 0.00 0.10 0.00 0.00 34.13 32.63 1ra7 s GLU 93 CO 0.39 -2.62 0.65 -1.14 0.02 0.00 0.00 175.26 172.57 1ra7 s GLN 94 N -4.71 4.20 0.00 1.61 0.74 -1.26 -4.61 119.66 115.62 1ra7 s GLN 94 Ca 0.65 0.77 0.00 0.00 0.05 0.00 0.00 55.36 56.83 1ra7 s GLN 94 Cb -0.21 -2.99 0.00 0.00 1.10 0.00 0.00 33.01 30.91 1ra7 s GLN 94 CO 0.59 0.47 0.00 -0.12 -0.55 0.00 0.00 175.29 175.68 1ra7 n MET 95 N 0.99 3.70 -0.04 1.67 0.00 0.15 -5.01 117.12 118.58 1ra7 n MET 95 Ca -0.05 0.00 -0.08 0.00 -0.00 0.00 0.00 57.70 57.57 1ra7 n MET 95 Cb 0.51 0.00 -0.14 0.00 0.00 0.00 0.00 33.22 33.59 1ra7 n MET 95 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 1ra7 n LEU 97 N 0.00 0.63 0.22 -0.89 7.94 -1.26 -4.50 117.00 119.15 1ra7 n LEU 97 Ca 0.00 0.30 -0.10 0.00 -1.11 0.00 0.00 56.01 55.10 1ra7 n LEU 97 Cb 0.00 0.25 -0.05 0.00 0.53 0.00 0.00 43.42 44.15 1ra7 n LEU 97 CO 0.00 0.39 0.26 -0.08 -1.11 0.00 0.00 177.39 176.85 1ra7 h GLU 98 N 0.00 -0.61 -0.98 1.96 4.81 -1.99 -2.69 114.58 115.08 1ra7 h GLU 98 Ca -0.34 0.04 0.11 0.00 -0.13 0.00 0.00 59.36 59.04 1ra7 h GLU 98 Cb 2.02 0.14 -0.08 0.00 0.63 0.00 0.00 28.75 31.46 1ra7 h GLU 98 CO 0.06 -0.40 0.63 -0.44 -0.73 0.00 0.00 179.01 178.12 1ra7 h ASP 99 N -1.11 0.92 0.21 1.04 3.32 -1.93 0.86 116.42 119.73 1ra7 h ASP 99 Ca -0.06 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 1ra7 h ASP 99 Cb 0.48 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.88 1ra7 h ASP 99 CO 0.11 0.52 -0.12 0.00 -1.72 0.00 0.00 179.24 178.02 1ra7 h ALA 100 N 1.53 1.54 0.00 3.45 0.00 -1.85 0.36 119.26 124.28 1ra7 h ALA 100 Ca 0.47 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 55.09 1ra7 h ALA 100 Cb 0.43 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1ra7 h ALA 100 CO -0.23 0.15 -1.05 0.52 0.00 0.00 0.00 179.25 178.64 1ra7 h MET 101 N 0.00 0.00 -0.45 0.00 2.86 -0.59 -3.42 114.93 113.34 1ra7 h MET 101 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1ra7 h MET 101 Cb 0.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.92 1ra7 h MET 101 CO 0.02 0.86 0.00 0.66 1.06 0.00 0.00 176.91 179.50 1ra7 n TYR 102 N -4.47 0.59 0.00 -0.22 4.02 0.08 -2.01 117.16 115.13 1ra7 n TYR 102 Ca -0.27 -0.36 0.00 0.00 -0.01 0.00 0.00 57.90 57.26 1ra7 n TYR 102 Cb 0.60 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.92 1ra7 n TYR 102 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ra7 n GLY 103 N 1.23 -0.71 2.77 2.72 0.00 0.13 -4.14 105.19 107.18 1ra7 n GLY 103 Ca 0.18 -1.70 -0.02 0.00 0.00 0.00 0.00 46.02 44.48 1ra7 n GLY 103 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1ra7 n THR 104 N -0.78 0.00 -1.69 2.61 5.66 -0.28 -4.51 114.28 115.28 1ra7 n THR 104 Ca 0.00 -0.37 -0.44 0.00 -3.05 0.00 0.00 64.05 60.19 1ra7 n THR 104 Cb 0.00 0.54 -0.04 0.00 -1.55 0.00 0.00 70.33 69.28 1ra7 n THR 104 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1ra7 n ASP 105 N -1.06 3.70 0.00 1.09 2.03 -1.26 -1.46 116.55 119.59 1ra7 n ASP 105 Ca -0.01 1.04 0.00 0.00 0.52 0.00 0.00 54.79 56.34 1ra7 n ASP 105 Cb 0.42 -1.51 0.00 0.00 -0.72 0.00 0.00 41.12 39.31 1ra7 n ASP 105 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ra7 n GLY 106 N 3.90 2.11 2.75 0.27 0.00 -1.26 -4.90 105.19 108.06 1ra7 n GLY 106 Ca 0.17 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.02 1ra7 n GLY 106 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ra7 s LEU 107 N 0.00 0.48 0.53 0.99 2.96 -0.54 -4.05 118.68 119.05 1ra7 s LEU 107 Ca 0.00 0.13 -0.14 0.00 -0.22 0.00 0.00 54.13 53.89 1ra7 s LEU 107 Cb 0.00 -0.01 -0.07 0.00 0.50 0.00 0.00 46.19 46.62 1ra7 s LEU 107 CO 0.00 -0.20 0.97 -1.61 -1.32 0.00 0.00 176.35 174.19 1ra7 s GLU 108 N 1.72 3.84 0.86 1.98 2.02 -1.26 -1.13 118.70 126.73 1ra7 s GLU 108 Ca -0.01 0.84 -0.10 0.00 0.02 0.00 0.00 54.97 55.71 1ra7 s GLU 108 Cb -0.12 -2.16 0.11 0.00 0.10 0.00 0.00 34.13 32.06 1ra7 s GLU 108 CO -0.04 -0.31 1.13 0.00 0.02 0.00 0.00 175.26 176.06 1ra7 s ALA 109 N -2.73 1.76 0.45 5.21 0.00 -1.26 -4.44 121.76 120.75 1ra7 s ALA 109 Ca 0.57 0.49 -0.25 0.00 0.00 0.00 0.00 51.96 52.77 1ra7 s ALA 109 Cb -0.10 -3.39 -0.09 0.00 0.00 0.00 0.00 23.12 19.54 1ra7 s ALA 109 CO 0.37 -2.39 1.35 1.28 0.00 0.00 0.00 175.76 176.36 1ra7 n LEU 110 N -3.94 4.64 -4.68 0.00 4.77 -0.85 -4.90 117.00 112.05 1ra7 n LEU 110 Ca 0.11 1.10 -0.42 0.00 -0.03 0.00 0.00 56.01 56.77 1ra7 n LEU 110 Cb 0.52 -1.55 -0.03 0.00 -2.33 0.00 0.00 43.42 40.03 1ra7 n LEU 110 CO 0.51 -0.43 0.69 -0.62 -1.33 0.00 0.00 177.39 176.20 1ra7 s ASP 111 N -0.54 7.06 0.00 -1.43 -1.08 -1.26 -4.93 116.67 114.49 1ra7 s ASP 111 Ca 0.62 1.30 0.28 0.00 -0.52 0.00 0.00 52.55 54.24 1ra7 s ASP 111 Cb -0.47 -2.49 1.11 0.00 -1.46 0.00 0.00 42.92 39.60 1ra7 s ASP 111 CO 0.57 -0.43 1.84 0.18 0.52 0.00 0.00 175.17 177.85 1ra7 n LEU 112 N 5.20 0.10 0.10 -1.34 4.77 -1.26 -3.78 117.00 120.79 1ra7 n LEU 112 Ca 0.06 0.40 -0.15 0.00 -0.03 0.00 0.00 56.01 56.29 1ra7 n LEU 112 Cb 0.49 -0.44 -0.14 0.00 -2.33 0.00 0.00 43.42 40.99 1ra7 n LEU 112 CO 0.50 0.02 -0.05 0.77 -1.33 0.00 0.00 177.39 177.30 1ra7 h SER 113 N 0.01 0.37 -3.97 -1.43 4.64 -2.02 -3.45 113.55 107.70 1ra7 h SER 113 Ca 0.00 -0.40 -0.48 0.00 -0.47 0.00 0.00 61.79 60.43 1ra7 h SER 113 Cb 0.49 -0.12 0.02 0.00 -0.31 0.00 0.00 62.40 62.48 1ra7 h SER 113 CO 0.00 1.32 0.42 0.42 -0.87 0.00 0.00 176.83 178.11 1ra7 s THR 114 N -2.66 3.69 0.65 2.95 -4.23 -1.25 -4.98 115.64 109.81 1ra7 s THR 114 Ca -0.04 1.28 -0.18 0.00 -1.18 0.00 0.00 61.69 61.57 1ra7 s THR 114 Cb 0.07 -3.65 -0.15 0.00 1.34 0.00 0.00 72.50 70.11 1ra7 s THR 114 CO 0.87 -0.01 -0.32 -0.24 -0.54 0.00 0.00 174.62 174.39 1ra7 n SER 115 N -0.14 -4.35 0.02 3.99 2.88 -1.26 -4.88 113.62 109.87 1ra7 n SER 115 Ca 0.05 0.52 0.11 0.00 -1.33 0.00 0.00 58.87 58.22 1ra7 n SER 115 Cb 0.50 -0.82 0.05 0.00 -0.75 0.00 0.00 64.21 63.18 1ra7 n SER 115 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ra7 n ALA 116 N -1.80 3.63 -0.29 -1.46 0.00 -1.26 -4.84 120.51 114.49 1ra7 n ALA 116 Ca 0.05 -0.42 0.01 0.00 0.00 0.00 0.00 53.44 53.08 1ra7 n ALA 116 Cb 0.50 -0.98 -0.00 0.00 0.00 0.00 0.00 19.45 18.97 1ra7 n ALA 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ra7 n GLY 117 N 1.42 -1.84 3.79 0.00 0.00 -1.26 -0.77 105.19 106.53 1ra7 n GLY 117 Ca 0.03 -1.33 -0.35 0.00 0.00 0.00 0.00 46.02 44.37 1ra7 n GLY 117 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ra7 s TYR 118 N -0.20 3.33 -1.34 1.61 5.04 -1.26 -0.70 117.35 123.83 1ra7 s TYR 118 Ca 0.00 1.66 0.27 0.00 -2.44 0.00 0.00 57.07 56.55 1ra7 s TYR 118 Cb 0.00 -3.01 0.79 0.00 0.35 0.00 0.00 41.96 40.09 1ra7 s TYR 118 CO 0.00 -0.36 1.59 -0.35 -1.34 0.00 0.00 175.55 175.10 1ra7 n PRO 119 N -0.19 0.37 -0.35 4.97 -0.04 -1.26 -4.60 135.00 133.91 1ra7 n PRO 119 Ca 0.05 -0.19 0.27 0.00 -0.04 0.00 0.00 63.50 63.60 1ra7 n PRO 119 Cb 0.51 -1.50 0.57 0.00 -0.04 0.00 0.00 33.50 33.05 1ra7 n PRO 119 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1ra7 h TYR 120 N 0.46 0.53 0.00 0.54 0.99 -1.71 0.33 116.97 118.10 1ra7 h TYR 120 Ca 0.00 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.75 1ra7 h TYR 120 Cb 0.48 -0.15 0.00 0.00 1.00 0.00 0.00 36.73 38.06 1ra7 h TYR 120 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 178.16 179.71 1ra7 n VAL 121 N -4.57 0.74 -0.07 -2.88 3.14 0.13 -0.04 118.33 114.77 1ra7 n VAL 121 Ca 0.28 0.15 -0.06 0.00 -2.96 0.00 0.00 64.34 61.75 1ra7 n VAL 121 Cb 1.04 -0.91 -0.14 0.00 -1.06 0.00 0.00 33.84 32.77 1ra7 n VAL 121 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1ra7 n ALA 122 N -1.59 1.75 0.11 1.55 0.00 0.11 -4.38 120.51 118.05 1ra7 n ALA 122 Ca 0.04 -1.05 -0.17 0.00 0.00 0.00 0.00 53.44 52.26 1ra7 n ALA 122 Cb 0.24 -0.21 -0.14 0.00 0.00 0.00 0.00 19.45 19.34 1ra7 n ALA 122 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1ra7 h MET 123 N 0.00 0.33 0.00 0.00 2.07 -0.96 -3.48 114.93 112.89 1ra7 h MET 123 Ca -0.40 -0.54 0.00 0.00 -2.07 0.00 0.00 59.70 56.69 1ra7 h MET 123 Cb 1.89 0.20 0.00 0.00 -1.87 0.00 0.00 31.60 31.82 1ra7 h MET 123 CO 0.02 1.25 0.00 0.41 1.07 0.00 0.00 176.91 179.66 1ra7 n GLY 124 N 1.51 2.17 3.68 8.32 0.00 0.94 -5.07 105.19 116.74 1ra7 n GLY 124 Ca -0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.48 1ra7 n GLY 124 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ra7 n LYS 125 N -0.40 2.06 -4.45 1.61 4.81 -1.15 -4.93 118.16 115.70 1ra7 n LYS 125 Ca 0.00 0.73 -0.31 0.00 -0.87 0.00 0.00 58.31 57.86 1ra7 n LYS 125 Cb 0.00 -2.36 -0.05 0.00 0.02 0.00 0.00 35.03 32.64 1ra7 n LYS 125 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1ra7 s LYS 126 N -0.92 2.22 0.10 1.64 1.02 -1.26 -4.50 119.74 118.03 1ra7 s LYS 126 Ca 0.64 -2.26 -0.14 0.00 0.02 0.00 0.00 55.97 54.22 1ra7 s LYS 126 Cb -0.62 -1.73 -0.11 0.00 -0.52 0.00 0.00 37.83 34.85 1ra7 s LYS 126 CO 0.54 -0.45 1.38 0.87 -0.92 0.00 0.00 175.35 176.77 1ra7 h LYS 127 N 1.14 0.74 0.00 1.68 1.57 -1.92 -3.01 116.57 116.78 1ra7 h LYS 127 Ca -0.41 -0.46 0.00 0.00 -1.87 0.00 0.00 60.65 57.90 1ra7 h LYS 127 Cb 1.31 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.67 1ra7 h LYS 127 CO 0.68 1.09 0.27 0.00 -0.57 0.00 0.00 179.45 180.92 1ra7 h ARG 128 N 0.48 0.00 0.00 3.15 3.08 -1.86 -2.73 114.38 116.50 1ra7 h ARG 128 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1ra7 h ARG 128 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.09 1ra7 h ARG 128 CO 0.10 0.00 0.00 -0.25 -1.07 0.00 0.00 179.97 178.75 1ra7 n ASP 129 N -2.88 0.00 -0.33 7.04 8.00 -1.14 -4.41 116.55 122.83 1ra7 n ASP 129 Ca -0.02 0.22 0.31 0.00 0.71 0.00 0.00 54.79 56.01 1ra7 n ASP 129 Cb 0.32 -0.23 0.55 0.00 -0.02 0.00 0.00 41.12 41.74 1ra7 n ASP 129 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1ra7 n ILE 130 N -1.24 -0.33 -4.13 0.53 5.41 -1.09 -4.62 119.36 113.89 1ra7 n ILE 130 Ca 0.00 1.76 -0.09 0.00 1.00 0.00 0.00 62.75 65.42 1ra7 n ILE 130 Cb 0.00 -2.87 -0.10 0.00 -0.71 0.00 0.00 39.64 35.96 1ra7 n ILE 130 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 1ra7 s LEU 131 N -9.74 1.92 -0.22 1.39 0.05 -1.05 -4.20 118.68 106.83 1ra7 s LEU 131 Ca -0.08 -1.15 -0.11 0.00 0.05 0.00 0.00 54.13 52.85 1ra7 s LEU 131 Cb 0.30 0.30 0.08 0.00 -2.05 0.00 0.00 46.19 44.82 1ra7 s LEU 131 CO 0.71 -0.70 0.52 0.54 -0.55 0.00 0.00 176.35 176.87 1ra7 s ASN 132 N -3.01 -0.67 0.03 1.48 6.03 -1.26 -4.56 114.94 112.98 1ra7 s ASN 132 Ca 0.20 1.16 -0.06 0.00 -1.03 0.00 0.00 52.86 53.13 1ra7 s ASN 132 Cb 0.07 1.19 -0.01 0.00 -3.03 0.00 0.00 41.25 39.47 1ra7 s ASN 132 CO -0.01 -0.22 1.08 0.29 -2.03 0.00 0.00 177.10 176.21 1ra7 n LYS 133 N 4.56 -0.08 -0.34 3.55 4.76 -1.26 -2.36 118.16 126.99 1ra7 n LYS 133 Ca -0.19 1.07 -0.09 0.00 -2.87 0.00 0.00 58.31 56.23 1ra7 n LYS 133 Cb 0.55 -1.60 -0.08 0.00 -1.84 0.00 0.00 35.03 32.06 1ra7 n LYS 133 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ra7 n GLN 134 N -3.40 -0.36 0.23 1.97 0.00 -1.26 -1.49 117.38 113.08 1ra7 n GLN 134 Ca 0.00 1.37 0.12 0.00 0.00 0.00 0.00 57.00 58.49 1ra7 n GLN 134 Cb 0.05 -2.01 0.47 0.00 0.00 0.00 0.00 30.24 28.74 1ra7 n GLN 134 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.06 178.85 1ra7 h THR 135 N 0.00 0.32 -6.39 -0.39 1.35 -2.01 -3.47 112.91 102.32 1ra7 h THR 135 Ca 0.13 -0.98 -0.49 0.00 -0.55 0.00 0.00 66.41 64.53 1ra7 h THR 135 Cb 0.34 1.76 -0.06 0.00 -1.73 0.00 0.00 68.15 68.45 1ra7 h THR 135 CO -0.77 0.14 -0.80 0.54 -0.25 0.00 0.00 175.52 174.38 1ra7 n ARG 136 N -3.24 -4.67 -2.97 4.72 1.74 -0.55 -4.91 116.66 106.77 1ra7 n ARG 136 Ca 0.01 0.53 -0.40 0.00 -0.77 0.00 0.00 57.85 57.22 1ra7 n ARG 136 Cb 0.42 -5.25 -0.05 0.00 -1.02 0.00 0.00 32.46 26.57 1ra7 n ARG 136 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1ra7 s ASP 137 N -3.59 7.16 -0.17 0.55 2.15 -1.26 -4.96 116.67 116.55 1ra7 s ASP 137 Ca 0.50 1.39 0.11 0.00 0.43 0.00 0.00 52.55 54.98 1ra7 s ASP 137 Cb -0.26 -2.46 -0.23 0.00 -0.30 0.00 0.00 42.92 39.67 1ra7 s ASP 137 CO 0.86 -0.07 0.18 0.35 -0.17 0.00 0.00 175.17 176.32 1ra7 n THR 138 N 3.29 1.50 -0.05 1.71 -2.24 -1.26 -4.70 114.28 112.53 1ra7 n THR 138 Ca -0.01 -0.77 -0.01 0.00 -2.27 0.00 0.00 64.05 60.99 1ra7 n THR 138 Cb 0.51 -0.92 -0.01 0.00 -2.10 0.00 0.00 70.33 67.81 1ra7 n THR 138 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1ra7 n LYS 139 N -3.00 -0.06 -0.03 -0.78 5.02 -1.26 0.28 118.16 118.34 1ra7 n LYS 139 Ca -0.32 0.26 -0.11 0.00 -2.02 0.00 0.00 58.31 56.13 1ra7 n LYS 139 Cb 1.09 -0.38 -0.05 0.00 -0.02 0.00 0.00 35.03 35.67 1ra7 n LYS 139 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1ra7 h GLU 140 N 0.00 0.22 0.75 1.97 4.57 -1.84 -1.26 114.58 118.99 1ra7 h GLU 140 Ca 0.02 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.14 1ra7 h GLU 140 Cb 0.05 -0.04 0.01 0.00 -0.16 0.00 0.00 28.75 28.61 1ra7 h GLU 140 CO -0.12 0.24 -0.36 1.98 -1.18 0.00 0.00 179.01 179.57 1ra7 h MET 141 N 0.13 -0.97 -1.50 1.92 4.05 -0.90 -0.24 114.93 117.42 1ra7 h MET 141 Ca 0.05 0.07 0.44 0.00 -0.28 0.00 0.00 59.70 59.98 1ra7 h MET 141 Cb 0.09 0.22 -0.07 0.00 -0.80 0.00 0.00 31.60 31.05 1ra7 h MET 141 CO -0.01 -0.63 1.07 0.37 0.23 0.00 0.00 176.91 177.94 1ra7 h GLN 142 N -1.09 0.02 0.00 0.39 5.75 -0.15 0.26 115.11 120.29 1ra7 h GLN 142 Ca -0.10 -0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.38 1ra7 h GLN 142 Cb 0.79 -0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.33 1ra7 h GLN 142 CO 0.17 0.01 -0.08 -0.22 -2.65 0.00 0.00 178.83 176.06 1ra7 h LYS 143 N 0.02 0.00 -0.30 1.69 3.64 -0.73 -3.32 116.57 117.57 1ra7 h LYS 143 Ca 0.73 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 60.20 1ra7 h LYS 143 Cb 2.85 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 34.66 1ra7 h LYS 143 CO -0.04 0.94 0.31 -0.07 -2.27 0.00 0.00 179.45 178.31 1ra7 h LEU 144 N -1.00 0.00 0.10 5.20 3.38 0.13 -0.95 115.31 122.17 1ra7 h LEU 144 Ca -0.02 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1ra7 h LEU 144 Cb 0.96 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1ra7 h LEU 144 CO -0.01 0.00 -0.05 -0.07 0.09 0.00 0.00 178.44 178.40 1ra7 h LEU 145 N 0.00 -0.12 -1.32 1.67 3.38 -1.24 -1.42 115.31 116.27 1ra7 h LEU 145 Ca 0.14 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 1ra7 h LEU 145 Cb 0.76 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1ra7 h LEU 145 CO -0.00 0.23 -0.25 0.44 0.09 0.00 0.00 178.44 178.94 1ra7 h ASP 146 N -0.47 0.13 -0.00 -0.43 3.32 -1.39 0.87 116.42 118.44 1ra7 h ASP 146 Ca -0.01 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 1ra7 h ASP 146 Cb 0.39 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.91 1ra7 h ASP 146 CO 0.02 0.39 -0.00 0.74 -1.72 0.00 0.00 179.24 178.68 1ra7 h THR 147 N 0.12 1.28 -0.00 0.35 2.02 -1.06 -3.37 112.91 112.25 1ra7 h THR 147 Ca 0.02 -0.83 0.00 0.00 0.77 0.00 0.00 66.41 66.37 1ra7 h THR 147 Cb 0.52 1.83 0.00 0.00 -1.74 0.00 0.00 68.15 68.77 1ra7 h THR 147 CO 0.04 0.22 -0.39 -1.22 0.37 0.00 0.00 175.52 174.53 1ra7 n TYR 148 N -4.92 0.00 -4.54 3.16 4.02 -0.55 -5.09 117.16 109.24 1ra7 n TYR 148 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.81 1ra7 n TYR 148 Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.51 1ra7 n TYR 148 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ra7 n GLY 149 N 1.18 -0.44 0.00 2.72 0.00 0.30 -4.96 105.19 103.99 1ra7 n GLY 149 Ca 0.02 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.96 1ra7 n GLY 149 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ra7 n ILE 150 N -0.23 0.00 -3.81 -0.61 -5.35 -1.26 -4.75 119.36 103.35 1ra7 n ILE 150 Ca 0.00 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.20 1ra7 n ILE 150 Cb 0.00 -0.11 0.04 0.00 -1.74 0.00 0.00 39.64 37.84 1ra7 n ILE 150 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1ra7 n ASN 151 N -0.62 -5.36 -4.83 7.28 2.85 -1.26 -4.96 115.26 108.36 1ra7 n ASN 151 Ca 0.00 -0.70 -0.34 0.00 -0.11 0.00 0.00 54.58 53.43 1ra7 n ASN 151 Cb 0.00 -4.26 -0.06 0.00 1.24 0.00 0.00 39.78 36.69 1ra7 n ASN 151 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1ra7 s LEU 152 N -7.30 4.14 0.96 1.20 1.43 -1.26 -5.04 118.68 112.81 1ra7 s LEU 152 Ca 0.64 1.46 -0.14 0.00 -1.03 0.00 0.00 54.13 55.06 1ra7 s LEU 152 Cb -0.31 -4.05 -0.04 0.00 0.03 0.00 0.00 46.19 41.83 1ra7 s LEU 152 CO 0.80 -0.16 -0.05 -2.65 0.23 0.00 0.00 176.35 174.52 1ra7 n PRO 153 N -0.05 -0.17 -3.87 1.29 -0.02 -1.26 -4.67 135.00 126.25 1ra7 n PRO 153 Ca 0.03 -0.02 -0.36 0.00 -2.02 0.00 0.00 63.50 61.12 1ra7 n PRO 153 Cb 0.52 -1.53 -0.12 0.00 -0.02 0.00 0.00 33.50 32.35 1ra7 n PRO 153 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1ra7 s LEU 154 N 2.35 3.43 -0.21 2.45 1.43 0.13 -4.35 118.68 123.92 1ra7 s LEU 154 Ca 0.51 -0.18 -0.29 0.00 -1.03 0.00 0.00 54.13 53.14 1ra7 s LEU 154 Cb -0.20 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.12 1ra7 s LEU 154 CO 0.73 0.01 1.08 -0.69 0.23 0.00 0.00 176.35 177.71 1ra7 s VAL 155 N 1.32 4.61 -0.24 -1.59 1.01 -0.41 -0.45 120.40 124.65 1ra7 s VAL 155 Ca 0.05 1.94 -0.12 0.00 0.00 0.00 0.00 61.98 63.85 1ra7 s VAL 155 Cb -0.15 -4.25 -0.05 0.00 0.00 0.00 0.00 36.38 31.94 1ra7 s VAL 155 CO 0.03 -0.16 0.21 -0.89 0.00 0.00 0.00 175.10 174.30 1ra7 s THR 156 N 3.14 5.32 0.18 3.92 2.01 0.15 -0.10 115.64 130.27 1ra7 s THR 156 Ca 0.46 0.29 0.10 0.00 0.31 0.00 0.00 61.69 62.86 1ra7 s THR 156 Cb -0.17 -3.55 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 1ra7 s THR 156 CO 0.09 0.31 -0.22 -0.31 -0.69 0.00 0.00 174.62 173.79 1ra7 s TYR 157 N 1.24 2.13 0.05 4.92 1.51 -0.52 -4.52 117.35 122.16 1ra7 s TYR 157 Ca 0.10 -0.40 -0.25 0.00 -1.01 0.00 0.00 57.07 55.51 1ra7 s TYR 157 Cb -0.14 -1.06 -0.05 0.00 -0.11 0.00 0.00 41.96 40.60 1ra7 s TYR 157 CO 0.06 0.44 0.78 0.08 -1.11 0.00 0.00 175.55 175.80 1ra7 s VAL 158 N -1.78 4.72 -0.13 0.71 1.01 -1.26 0.18 120.40 123.85 1ra7 s VAL 158 Ca 0.19 1.66 -0.29 0.00 0.00 0.00 0.00 61.98 63.53 1ra7 s VAL 158 Cb -0.07 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 32.16 1ra7 s VAL 158 CO 0.09 0.36 1.20 -0.75 0.00 0.00 0.00 175.10 175.99 1ra7 s LYS 159 N -0.03 4.29 -0.66 2.72 2.20 0.83 -4.84 119.74 124.26 1ra7 s LYS 159 Ca 0.39 1.61 -0.27 0.00 -0.36 0.00 0.00 55.97 57.34 1ra7 s LYS 159 Cb -0.21 -3.66 0.03 0.00 -1.51 0.00 0.00 37.83 32.49 1ra7 s LYS 159 CO 0.23 -0.58 1.19 0.34 -0.36 0.00 0.00 175.35 176.18 1ra7 s ASP 160 N 1.64 6.29 0.30 1.43 2.15 -1.26 -4.70 116.67 122.53 1ra7 s ASP 160 Ca 0.53 -0.27 -0.19 0.00 0.43 0.00 0.00 52.55 53.06 1ra7 s ASP 160 Cb -0.22 -2.54 0.06 0.00 -0.30 0.00 0.00 42.92 39.92 1ra7 s ASP 160 CO 0.16 -1.62 0.85 -1.83 -0.17 0.00 0.00 175.17 172.57 1ra7 s GLU 161 N 5.16 1.87 0.20 4.34 -1.05 -1.26 -5.01 118.70 122.95 1ra7 s GLU 161 Ca 0.37 -1.17 -0.26 0.00 -0.15 0.00 0.00 54.97 53.76 1ra7 s GLU 161 Cb -0.09 0.55 -0.08 0.00 -0.44 0.00 0.00 34.13 34.06 1ra7 s GLU 161 CO 0.19 -0.87 0.82 -0.51 0.95 0.00 0.00 175.26 175.84 1ra7 s LEU 162 N -3.12 4.56 0.04 1.83 1.43 -1.26 -0.47 118.68 121.69 1ra7 s LEU 162 Ca 0.16 1.70 -0.03 0.00 -1.03 0.00 0.00 54.13 54.92 1ra7 s LEU 162 Cb -0.04 -3.45 -0.02 0.00 0.03 0.00 0.00 46.19 42.71 1ra7 s LEU 162 CO 0.09 0.16 0.04 -0.13 0.23 0.00 0.00 176.35 176.73 1ra7 s ARG 163 N -1.33 0.53 1.00 1.70 1.81 0.66 -4.86 118.95 118.47 1ra7 s ARG 163 Ca 0.39 -0.83 -0.11 0.00 -1.72 0.00 0.00 55.73 53.45 1ra7 s ARG 163 Cb -0.23 0.20 0.20 0.00 -0.45 0.00 0.00 34.95 34.67 1ra7 s ARG 163 CO 0.27 -0.12 1.10 -1.54 -0.68 0.00 0.00 175.30 174.32 1ra7 s SER 164 N -2.17 2.24 0.27 0.23 1.04 -1.26 -1.87 113.70 112.18 1ra7 s SER 164 Ca -0.05 1.90 -0.04 0.00 0.48 0.00 0.00 55.95 58.24 1ra7 s SER 164 Cb -0.01 -2.45 0.34 0.00 0.10 0.00 0.00 66.02 64.00 1ra7 s SER 164 CO -0.05 -3.48 1.91 0.50 0.98 0.00 0.00 173.24 173.10 1ra7 h LYS 165 N -2.13 1.14 0.09 4.02 3.64 -1.95 -2.22 116.57 119.16 1ra7 h LYS 165 Ca -0.50 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 58.76 1ra7 h LYS 165 Cb 1.29 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1ra7 h LYS 165 CO 0.46 0.81 -0.04 1.15 -2.27 0.00 0.00 179.45 179.55 1ra7 h THR 166 N 1.15 0.95 -0.15 1.00 2.02 -1.96 -0.79 112.91 115.14 1ra7 h THR 166 Ca 0.30 -0.14 0.04 0.00 0.77 0.00 0.00 66.41 67.38 1ra7 h THR 166 Cb -0.02 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 1ra7 h THR 166 CO -0.05 0.03 0.15 0.11 0.37 0.00 0.00 175.52 176.13 1ra7 h LYS 167 N -0.19 0.00 0.00 6.66 1.79 -1.82 0.17 116.57 123.18 1ra7 h LYS 167 Ca -0.01 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1ra7 h LYS 167 Cb 0.15 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.80 1ra7 h LYS 167 CO 0.02 0.00 -0.00 0.28 -1.08 0.00 0.00 179.45 178.67 1ra7 h VAL 168 N 0.00 1.58 -0.46 0.50 2.07 -0.77 0.46 116.25 119.63 1ra7 h VAL 168 Ca 0.07 -1.74 -0.08 0.00 0.82 0.00 0.00 66.70 65.76 1ra7 h VAL 168 Cb 0.37 2.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.88 1ra7 h VAL 168 CO -0.00 0.45 -0.04 -0.33 0.02 0.00 0.00 177.57 177.67 1ra7 h GLU 169 N -0.75 0.78 -0.29 1.57 5.08 -0.32 -2.42 114.58 118.23 1ra7 h GLU 169 Ca -0.00 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 1ra7 h GLU 169 Cb 0.74 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1ra7 h GLU 169 CO 0.00 0.82 0.00 1.04 -1.00 0.00 0.00 179.01 179.87 1ra7 n GLN 170 N -4.20 1.66 -1.23 2.33 6.02 0.51 -1.51 117.38 120.96 1ra7 n GLN 170 Ca 0.02 -1.00 -0.09 0.00 -0.01 0.00 0.00 57.00 55.92 1ra7 n GLN 170 Cb 0.32 -1.23 -0.04 0.00 1.02 0.00 0.00 30.24 30.31 1ra7 n GLN 170 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ra7 n GLY 171 N 0.92 0.85 2.92 1.08 0.00 -0.91 -4.79 105.19 105.27 1ra7 n GLY 171 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 1ra7 n GLY 171 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ra7 n LYS 172 N -0.53 1.44 -3.38 1.61 4.76 0.14 -3.99 118.16 118.22 1ra7 n LYS 172 Ca -0.09 -1.47 -0.38 0.00 -2.87 0.00 0.00 58.31 53.50 1ra7 n LYS 172 Cb 0.55 -2.59 -0.06 0.00 -1.84 0.00 0.00 35.03 31.09 1ra7 n LYS 172 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1ra7 s SER 173 N 4.53 6.92 0.40 4.39 0.01 -1.26 -4.82 113.70 123.87 1ra7 s SER 173 Ca 0.45 1.11 -0.18 0.00 1.31 0.00 0.00 55.95 58.64 1ra7 s SER 173 Cb 0.11 -2.30 -0.10 0.00 0.21 0.00 0.00 66.02 63.94 1ra7 s SER 173 CO 0.06 0.26 0.86 -0.13 0.41 0.00 0.00 173.24 174.71 1ra7 s ARG 174 N -1.27 4.08 0.14 12.44 0.52 -1.26 -4.74 118.95 128.86 1ra7 s ARG 174 Ca 0.29 0.89 0.07 0.00 -0.52 0.00 0.00 55.73 56.45 1ra7 s ARG 174 Cb -0.18 -2.28 -0.04 0.00 0.52 0.00 0.00 34.95 32.97 1ra7 s ARG 174 CO 0.17 0.01 -0.02 -0.51 0.02 0.00 0.00 175.30 174.97 1ra7 s LEU 175 N -3.25 3.30 -0.34 2.53 1.43 -1.26 -0.12 118.68 120.97 1ra7 s LEU 175 Ca 0.58 -0.33 -0.01 0.00 -1.03 0.00 0.00 54.13 53.34 1ra7 s LEU 175 Cb -0.10 -2.01 0.08 0.00 0.03 0.00 0.00 46.19 44.20 1ra7 s LEU 175 CO 0.18 0.13 0.07 -0.63 0.23 0.00 0.00 176.35 176.33 1ra7 s ILE 176 N -1.51 2.96 -1.03 -0.59 1.01 0.13 -4.81 121.20 117.36 1ra7 s ILE 176 Ca 0.26 -1.75 -0.18 0.00 0.00 0.00 0.00 60.65 58.97 1ra7 s ILE 176 Cb -0.10 -2.88 0.13 0.00 0.01 0.00 0.00 42.46 39.62 1ra7 s ILE 176 CO 0.18 -0.37 1.27 -1.61 0.00 0.00 0.00 174.94 174.41 1ra7 s GLU 177 N 1.16 3.75 0.10 2.79 2.02 -1.26 -1.44 118.70 125.83 1ra7 s GLU 177 Ca 0.01 -1.93 -0.31 0.00 0.02 0.00 0.00 54.97 52.76 1ra7 s GLU 177 Cb -0.21 -5.03 -0.08 0.00 0.10 0.00 0.00 34.13 28.91 1ra7 s GLU 177 CO -0.03 -1.84 1.42 0.00 0.02 0.00 0.00 175.26 174.83 1ra7 s ALA 178 N 2.70 3.61 0.06 5.21 0.00 0.86 -2.11 121.76 132.08 1ra7 s ALA 178 Ca 0.38 1.12 -0.21 0.00 0.00 0.00 0.00 51.96 53.24 1ra7 s ALA 178 Cb -0.03 -3.56 -0.06 0.00 0.00 0.00 0.00 23.12 19.47 1ra7 s ALA 178 CO -0.06 -0.68 0.64 0.45 0.00 0.00 0.00 175.76 176.10 1ra7 s SER 179 N 1.26 7.11 0.57 0.00 0.15 -0.91 -1.28 113.70 120.59 1ra7 s SER 179 Ca 0.65 1.32 -0.21 0.00 0.70 0.00 0.00 55.95 58.41 1ra7 s SER 179 Cb -0.37 -2.40 -0.04 0.00 -1.71 0.00 0.00 66.02 61.50 1ra7 s SER 179 CO 0.30 0.18 1.29 -0.24 1.20 0.00 0.00 173.24 175.96 1ra7 n SER 180 N 2.15 2.28 -0.08 5.45 2.88 -1.26 -4.32 113.62 120.71 1ra7 n SER 180 Ca -0.08 0.93 0.08 0.00 -1.33 0.00 0.00 58.87 58.48 1ra7 n SER 180 Cb 0.50 -1.54 0.45 0.00 -0.75 0.00 0.00 64.21 62.87 1ra7 n SER 180 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1ra7 h LEU 181 N 1.13 0.46 0.81 2.46 5.85 -1.20 -1.13 115.31 123.69 1ra7 h LEU 181 Ca -0.50 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.18 1ra7 h LEU 181 Cb 1.32 -0.10 0.01 0.00 0.37 0.00 0.00 40.66 42.26 1ra7 h LEU 181 CO 0.55 0.30 -0.39 0.78 -0.34 0.00 0.00 178.44 179.34 1ra7 h ASN 182 N 0.52 -0.92 -0.35 1.25 4.21 -1.89 -0.51 115.58 117.89 1ra7 h ASN 182 Ca 0.24 0.03 0.06 0.00 1.21 0.00 0.00 56.30 57.84 1ra7 h ASN 182 Cb 0.30 0.24 -0.05 0.00 -1.12 0.00 0.00 38.32 37.68 1ra7 h ASN 182 CO -0.07 -0.65 0.02 0.44 -1.29 0.00 0.00 177.43 175.88 1ra7 h ASP 183 N -1.11 -0.09 -0.92 5.81 3.32 -1.76 0.17 116.42 121.83 1ra7 h ASP 183 Ca -0.11 0.07 0.16 0.00 0.02 0.00 0.00 57.03 57.17 1ra7 h ASP 183 Cb 0.84 0.12 -0.08 0.00 0.22 0.00 0.00 39.33 40.44 1ra7 h ASP 183 CO 0.18 -0.01 0.59 -1.28 -1.72 0.00 0.00 179.24 177.00 1ra7 h SER 184 N 0.12 0.65 -0.06 6.45 0.87 -1.11 0.23 113.55 120.71 1ra7 h SER 184 Ca 0.17 0.05 -0.17 0.00 -1.23 0.00 0.00 61.79 60.60 1ra7 h SER 184 Cb 0.22 -0.07 0.01 0.00 -0.44 0.00 0.00 62.40 62.12 1ra7 h SER 184 CO -0.26 0.30 -0.64 0.58 -0.53 0.00 0.00 176.83 176.28 1ra7 h VAL 185 N 0.67 1.37 0.57 2.23 2.07 0.53 -2.70 116.25 120.99 1ra7 h VAL 185 Ca 0.48 -1.99 -0.03 0.00 0.82 0.00 0.00 66.70 65.98 1ra7 h VAL 185 Cb 0.82 2.34 0.01 0.00 -1.52 0.00 0.00 31.29 32.93 1ra7 h VAL 185 CO -0.23 0.60 -0.27 0.00 0.02 0.00 0.00 177.57 177.68 1ra7 h ALA 186 N 0.42 -0.76 -0.69 1.67 0.00 0.51 -1.72 119.26 118.69 1ra7 h ALA 186 Ca -0.06 -0.17 0.10 0.00 0.00 0.00 0.00 54.91 54.78 1ra7 h ALA 186 Cb 1.31 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 19.35 1ra7 h ALA 186 CO 0.13 -0.92 0.46 0.52 0.00 0.00 0.00 179.25 179.44 1ra7 h MET 187 N -0.78 0.50 0.00 0.00 2.86 -0.70 0.29 114.93 117.10 1ra7 h MET 187 Ca -0.08 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.51 1ra7 h MET 187 Cb 0.59 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 32.13 1ra7 h MET 187 CO 0.13 0.33 -0.12 0.00 1.06 0.00 0.00 176.91 178.31 1ra7 h ARG 188 N 0.52 0.00 0.19 1.72 3.08 -1.18 0.29 114.38 119.01 1ra7 h ARG 188 Ca 0.32 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 60.07 1ra7 h ARG 188 Cb 0.55 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.62 1ra7 h ARG 188 CO -0.10 0.12 -1.38 0.52 -1.07 0.00 0.00 179.97 178.06 1ra7 h MET 189 N 0.00 0.41 -0.03 0.04 2.86 0.26 0.67 114.93 119.13 1ra7 h MET 189 Ca -0.00 -0.70 -0.00 0.00 -2.06 0.00 0.00 59.70 56.94 1ra7 h MET 189 Cb 0.78 0.26 -0.00 0.00 0.06 0.00 0.00 31.60 32.70 1ra7 h MET 189 CO 0.02 1.33 0.01 0.00 1.06 0.00 0.00 176.91 179.33 1ra7 h ALA 190 N 0.09 0.04 -0.20 6.32 0.00 -0.30 0.42 119.26 125.64 1ra7 h ALA 190 Ca -0.26 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1ra7 h ALA 190 Cb 1.97 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1ra7 h ALA 190 CO 0.19 -0.40 0.00 1.19 0.00 0.00 0.00 179.25 180.23 1ra7 n PHE 191 N -5.01 0.26 -0.34 0.00 3.72 0.10 -4.72 117.46 111.46 1ra7 n PHE 191 Ca -0.07 -0.36 0.04 0.00 -0.05 0.00 0.00 57.45 57.01 1ra7 n PHE 191 Cb 0.08 -0.02 0.11 0.00 -0.94 0.00 0.00 39.48 38.72 1ra7 n PHE 191 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1ra7 h GLY 192 N 1.60 0.59 2.00 1.37 0.00 -0.96 0.31 103.07 107.98 1ra7 h GLY 192 Ca 0.00 0.34 -0.05 0.00 0.00 0.00 0.00 47.33 47.62 1ra7 h GLY 192 CO 0.00 -0.34 -0.24 3.43 0.00 0.00 0.00 176.54 179.39 1ra7 h ASN 193 N -0.00 0.00 -0.10 0.19 2.35 -1.81 -2.03 115.58 114.17 1ra7 h ASN 193 Ca 0.44 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 56.15 1ra7 h ASN 193 Cb 0.68 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.04 1ra7 h ASN 193 CO -0.97 0.24 -0.08 0.25 -1.65 0.00 0.00 177.43 175.22 1ra7 h LEU 194 N 0.00 0.24 -0.71 1.61 5.85 -0.67 -1.61 115.31 120.02 1ra7 h LEU 194 Ca -0.00 -0.47 0.08 0.00 0.84 0.00 0.00 57.88 58.33 1ra7 h LEU 194 Cb 0.67 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.57 1ra7 h LEU 194 CO 0.03 0.66 0.37 1.88 -0.34 0.00 0.00 178.44 181.04 1ra7 h TYR 195 N -0.17 0.67 -0.71 1.25 0.05 -0.95 -1.45 116.97 115.66 1ra7 h TYR 195 Ca 0.02 0.03 -0.06 0.00 0.05 0.00 0.00 58.73 58.77 1ra7 h TYR 195 Cb 0.59 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 38.11 1ra7 h TYR 195 CO 0.08 0.27 0.21 0.00 -1.05 0.00 0.00 178.16 177.67 1ra7 h ALA 196 N 1.41 0.93 -0.75 3.88 0.00 -1.28 -0.70 119.26 122.74 1ra7 h ALA 196 Ca 0.34 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1ra7 h ALA 196 Cb 0.32 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1ra7 h ALA 196 CO -0.24 0.62 0.30 0.00 0.00 0.00 0.00 179.25 179.92 1ra7 h ALA 197 N 1.10 1.12 -0.08 0.00 0.00 -0.31 -0.68 119.26 120.41 1ra7 h ALA 197 Ca 0.23 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1ra7 h ALA 197 Cb 0.32 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1ra7 h ALA 197 CO -0.01 0.63 -0.07 0.74 0.00 0.00 0.00 179.25 180.54 1ra7 h PHE 198 N 1.08 0.23 -1.00 0.00 -1.00 -0.95 -2.01 116.94 113.29 1ra7 h PHE 198 Ca 0.25 -0.07 0.07 0.00 2.81 0.00 0.00 57.97 61.03 1ra7 h PHE 198 Cb 0.20 -0.05 -0.07 0.00 3.61 0.00 0.00 35.95 39.64 1ra7 h PHE 198 CO 0.02 0.62 0.65 0.45 -1.61 0.00 0.00 178.31 178.43 1ra7 h HIS 199 N -0.23 1.20 -0.00 -0.55 3.86 -0.98 -1.00 115.15 117.45 1ra7 h HIS 199 Ca 0.01 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 1ra7 h HIS 199 Cb 0.57 -0.39 0.00 0.00 1.06 0.00 0.00 27.41 28.65 1ra7 h HIS 199 CO 0.09 0.62 -0.06 1.63 0.86 0.00 0.00 177.93 181.06 1ra7 n LYS 200 N -4.50 0.39 -2.72 2.45 5.02 -0.28 -4.21 118.16 114.31 1ra7 n LYS 200 Ca 0.16 -0.06 -0.15 0.00 -2.02 0.00 0.00 58.31 56.23 1ra7 n LYS 200 Cb 0.19 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.71 1ra7 n LYS 200 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1ra7 n ASN 201 N -1.25 2.20 -4.77 4.39 3.02 -0.39 -5.07 115.26 113.39 1ra7 n ASN 201 Ca 0.12 -3.02 -0.41 0.00 -0.03 0.00 0.00 54.58 51.24 1ra7 n ASN 201 Cb 0.28 -0.53 -0.01 0.00 -0.61 0.00 0.00 39.78 38.90 1ra7 n ASN 201 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1ra7 s PRO 202 N -3.12 4.27 0.00 3.52 0.04 -1.13 -4.39 135.00 134.18 1ra7 s PRO 202 Ca 0.35 2.34 0.00 0.00 0.04 0.00 0.00 61.00 63.73 1ra7 s PRO 202 Cb 0.42 -3.04 0.00 0.00 0.04 0.00 0.00 34.50 31.92 1ra7 s PRO 202 CO -0.04 -0.32 0.00 0.41 0.04 0.00 0.00 177.00 177.09 1ra7 n GLY 203 N 0.77 -0.15 0.56 0.56 0.00 0.73 -4.94 105.19 102.73 1ra7 n GLY 203 Ca 0.01 -1.23 0.14 0.00 0.00 0.00 0.00 46.02 44.93 1ra7 n GLY 203 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ra7 n VAL 204 N 9.00 0.00 -0.05 1.61 0.24 -1.26 -0.96 118.33 126.91 1ra7 n VAL 204 Ca 0.00 -0.29 -0.22 0.00 -2.04 0.00 0.00 64.34 61.79 1ra7 n VAL 204 Cb 0.00 0.68 -0.13 0.00 -1.47 0.00 0.00 33.84 32.93 1ra7 n VAL 204 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 1ra7 h ILE 205 N 2.77 0.82 0.00 1.34 1.08 -1.87 -3.33 117.51 118.31 1ra7 h ILE 205 Ca 0.00 -2.26 0.00 0.00 -0.39 0.00 0.00 64.86 62.21 1ra7 h ILE 205 Cb 0.59 2.38 0.00 0.00 -3.07 0.00 0.00 36.82 36.73 1ra7 h ILE 205 CO 0.00 0.57 -0.55 0.71 -0.69 0.00 0.00 178.15 178.19 1ra7 h THR 206 N -0.53 0.00 -3.09 -0.27 1.35 -1.77 -3.39 112.91 105.21 1ra7 h THR 206 Ca -0.37 -0.99 -0.35 0.00 -0.55 0.00 0.00 66.41 64.15 1ra7 h THR 206 Cb 1.62 1.71 0.01 0.00 -1.73 0.00 0.00 68.15 69.77 1ra7 h THR 206 CO -0.07 0.00 -0.48 0.61 -0.25 0.00 0.00 175.52 175.33 1ra7 n GLY 207 N 1.15 -0.35 3.11 5.82 0.00 -0.13 -4.92 105.19 109.86 1ra7 n GLY 207 Ca 0.02 -0.08 -0.15 0.00 0.00 0.00 0.00 46.02 45.80 1ra7 n GLY 207 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ra7 s SER 208 N -2.43 1.23 0.00 1.61 0.15 -0.80 -1.68 113.70 111.78 1ra7 s SER 208 Ca 0.11 -0.59 0.00 0.00 0.70 0.00 0.00 55.95 56.17 1ra7 s SER 208 Cb -0.05 -0.00 0.00 0.00 -1.71 0.00 0.00 66.02 64.26 1ra7 s SER 208 CO 0.13 -0.15 0.56 0.00 1.20 0.00 0.00 173.24 174.99 1ra7 n ALA 209 N 1.36 2.19 -1.68 5.45 0.00 0.04 -0.19 120.51 127.67 1ra7 n ALA 209 Ca -0.22 -0.56 -0.44 0.00 0.00 0.00 0.00 53.44 52.22 1ra7 n ALA 209 Cb 0.54 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.97 1ra7 n ALA 209 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ra7 n VAL 210 N -0.10 1.20 -1.72 0.00 0.31 -1.26 -4.86 118.33 111.90 1ra7 n VAL 210 Ca 0.00 -0.30 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1ra7 n VAL 210 Cb 0.08 -1.53 0.00 0.00 -0.91 0.00 0.00 33.84 31.48 1ra7 n VAL 210 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ra7 n GLY 211 N 1.84 0.54 2.86 2.92 0.00 -1.26 -4.29 105.19 107.79 1ra7 n GLY 211 Ca 0.10 -0.41 -0.12 0.00 0.00 0.00 0.00 46.02 45.59 1ra7 n GLY 211 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ra7 s ASP 213 N -2.83 0.80 0.36 1.61 2.15 -1.26 -5.01 116.67 112.50 1ra7 s ASP 213 Ca 0.00 -0.56 0.17 0.00 0.43 0.00 0.00 52.55 52.59 1ra7 s ASP 213 Cb 0.00 0.90 1.10 0.00 -0.30 0.00 0.00 42.92 44.63 1ra7 s ASP 213 CO 0.00 -0.36 1.70 -0.65 -0.17 0.00 0.00 175.17 175.69 1ra7 h PRO 214 N 8.14 0.35 -0.01 4.34 0.11 -1.98 0.14 132.00 143.07 1ra7 h PRO 214 Ca -0.09 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1ra7 h PRO 214 Cb 1.10 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1ra7 h PRO 214 CO 0.28 0.23 0.01 -0.44 -0.21 0.00 0.00 178.00 177.87 1ra7 h ASP 215 N 0.36 0.00 0.00 -2.05 3.32 -1.96 -2.60 116.42 113.49 1ra7 h ASP 215 Ca 0.70 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 57.47 1ra7 h ASP 215 Cb 1.68 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 41.18 1ra7 h ASP 215 CO -0.48 0.00 -2.06 0.18 -1.72 0.00 0.00 179.24 175.16 1ra7 n LEU 216 N -4.47 1.86 0.07 1.55 4.77 0.05 -4.63 117.00 116.20 1ra7 n LEU 216 Ca -0.03 -0.06 -0.02 0.00 -0.03 0.00 0.00 56.01 55.87 1ra7 n LEU 216 Cb 0.10 -0.28 0.22 0.00 -2.33 0.00 0.00 43.42 41.14 1ra7 n LEU 216 CO 0.33 0.65 0.67 0.15 -1.33 0.00 0.00 177.39 177.86 1ra7 h PHE 217 N 0.00 0.35 -0.15 -1.77 3.57 -0.85 -3.16 116.94 114.93 1ra7 h PHE 217 Ca -0.42 -0.09 0.04 0.00 3.53 0.00 0.00 57.97 61.04 1ra7 h PHE 217 Cb 1.75 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 40.41 1ra7 h PHE 217 CO 0.01 0.64 0.12 -1.49 -2.23 0.00 0.00 178.31 175.36 1ra7 h TRP 218 N 0.26 0.00 0.00 0.41 -0.00 -1.70 -0.86 115.95 114.07 1ra7 h TRP 218 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.92 1ra7 h TRP 218 Cb 0.77 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.93 1ra7 h TRP 218 CO 0.02 0.00 0.00 0.77 -0.00 0.00 0.00 178.44 179.23 1ra7 h SER 219 N 0.00 0.00 0.41 -3.49 0.02 -1.72 -3.25 113.55 105.52 1ra7 h SER 219 Ca 0.07 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.72 1ra7 h SER 219 Cb 0.30 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.79 1ra7 h SER 219 CO -0.00 0.00 -1.82 0.29 -1.14 0.00 0.00 176.83 174.16 1ra7 n LYS 220 N -2.84 0.64 0.08 3.45 5.02 -0.37 -4.55 118.16 119.60 1ra7 n LYS 220 Ca 0.03 0.25 -0.12 0.00 -2.02 0.00 0.00 58.31 56.45 1ra7 n LYS 220 Cb 0.43 -1.75 -0.05 0.00 -0.02 0.00 0.00 35.03 33.63 1ra7 n LYS 220 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1ra7 h ILE 221 N 0.00 0.30 -0.96 -0.18 2.04 -1.47 -2.62 117.51 114.62 1ra7 h ILE 221 Ca -0.33 0.00 0.21 0.00 1.00 0.00 0.00 64.86 65.74 1ra7 h ILE 221 Cb 2.05 0.30 -0.11 0.00 -0.74 0.00 0.00 36.82 38.31 1ra7 h ILE 221 CO 0.07 0.00 0.54 -0.65 0.00 0.00 0.00 178.15 178.11 1ra7 h PRO 222 N -0.50 0.61 -0.54 2.37 0.11 -1.80 -0.64 132.00 131.61 1ra7 h PRO 222 Ca 0.05 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 66.03 1ra7 h PRO 222 Cb 0.57 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.52 1ra7 h PRO 222 CO -0.25 0.40 -0.02 0.28 -0.21 0.00 0.00 178.00 178.21 1ra7 h VAL 223 N 0.63 1.27 0.00 3.15 2.07 -1.76 -3.01 116.25 118.59 1ra7 h VAL 223 Ca 0.58 -1.13 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 1ra7 h VAL 223 Cb 0.99 0.92 -0.00 0.00 -1.52 0.00 0.00 31.29 31.68 1ra7 h VAL 223 CO -0.43 0.40 -0.09 -0.07 0.02 0.00 0.00 177.57 177.40 1ra7 h LEU 224 N 0.83 0.00-10.28 2.57 3.38 -0.77 -3.45 115.31 107.59 1ra7 h LEU 224 Ca 0.15 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.63 1ra7 h LEU 224 Cb 0.56 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.34 1ra7 h LEU 224 CO 0.03 0.09 0.39 -0.04 0.09 0.00 0.00 178.44 178.99 1ra7 s MET 225 N -3.68 3.76 0.77 1.13 -1.94 -0.83 -4.89 119.30 113.62 1ra7 s MET 225 Ca 0.01 0.82 -0.07 0.00 -1.71 0.00 0.00 55.69 54.74 1ra7 s MET 225 Cb 0.09 -2.12 0.11 0.00 2.01 0.00 0.00 34.83 34.93 1ra7 s MET 225 CO 0.58 -0.41 1.08 -1.21 -0.01 0.00 0.00 175.02 175.04 1ra7 s GLU 226 N -4.64 1.71 0.15 2.03 0.41 -1.26 -5.01 118.70 112.09 1ra7 s GLU 226 Ca 0.56 -0.52 -0.21 0.00 -0.41 0.00 0.00 54.97 54.39 1ra7 s GLU 226 Cb -0.10 -2.14 0.03 0.00 -1.78 0.00 0.00 34.13 30.14 1ra7 s GLU 226 CO 0.43 -1.56 1.64 1.49 -0.49 0.00 0.00 175.26 176.78 1ra7 h GLU 227 N -0.81 -0.19 -5.03 1.61 4.57 -1.86 -3.42 114.58 109.44 1ra7 h GLU 227 Ca -0.42 0.01 -0.63 0.00 -1.18 0.00 0.00 59.36 57.14 1ra7 h GLU 227 Cb 1.28 0.04 -0.15 0.00 -0.16 0.00 0.00 28.75 29.76 1ra7 h GLU 227 CO 0.50 -0.13 -0.48 0.15 -1.18 0.00 0.00 179.01 177.87 1ra7 s LYS 228 N -6.12 4.02 0.16 1.92 -0.14 -0.12 -4.96 119.74 114.51 1ra7 s LYS 228 Ca -0.15 -0.24 -0.11 0.00 -1.36 0.00 0.00 55.97 54.11 1ra7 s LYS 228 Cb 0.12 -3.59 -0.07 0.00 -1.68 0.00 0.00 37.83 32.61 1ra7 s LYS 228 CO 0.68 -0.06 0.50 -0.51 -0.76 0.00 0.00 175.35 175.20 1ra7 s LEU 229 N 1.42 4.27 -0.03 3.17 1.43 -1.26 0.34 118.68 128.01 1ra7 s LEU 229 Ca 0.08 0.91 -0.14 0.00 -1.03 0.00 0.00 54.13 53.95 1ra7 s LEU 229 Cb -0.15 -3.36 0.02 0.00 0.03 0.00 0.00 46.19 42.74 1ra7 s LEU 229 CO 0.08 0.05 0.30 0.72 0.23 0.00 0.00 176.35 177.73 1ra7 s PHE 230 N -1.60 -0.19 0.33 0.29 -0.71 -0.22 -4.32 117.98 111.57 1ra7 s PHE 230 Ca 0.41 0.33 -0.16 0.00 -1.04 0.00 0.00 56.93 56.46 1ra7 s PHE 230 Cb -0.13 0.09 0.03 0.00 -1.21 0.00 0.00 43.02 41.80 1ra7 s PHE 230 CO 0.20 -0.35 0.71 0.00 -1.34 0.00 0.00 175.22 174.44 1ra7 s ALA 231 N -1.11 -0.73 -0.21 1.99 0.00 -1.26 -2.56 121.76 117.87 1ra7 s ALA 231 Ca -0.12 -0.68 -0.36 0.00 0.00 0.00 0.00 51.96 50.81 1ra7 s ALA 231 Cb -0.05 0.81 0.14 0.00 0.00 0.00 0.00 23.12 24.02 1ra7 s ALA 231 CO 0.04 -0.98 1.25 -0.59 0.00 0.00 0.00 175.76 175.48 1ra7 s PHE 232 N -3.07 -0.10 0.20 0.00 -0.12 -1.26 -4.36 117.98 109.25 1ra7 s PHE 232 Ca 0.16 0.07 0.05 0.00 -0.05 0.00 0.00 56.93 57.16 1ra7 s PHE 232 Cb -0.05 0.51 -0.04 0.00 -0.63 0.00 0.00 43.02 42.82 1ra7 s PHE 232 CO 0.10 -0.16 0.22 -0.51 -0.05 0.00 0.00 175.22 174.82 1ra7 s ASP 233 N -2.10 5.82 0.07 1.98 1.01 0.35 -4.79 116.67 119.01 1ra7 s ASP 233 Ca 0.10 -0.07 0.05 0.00 0.71 0.00 0.00 52.55 53.34 1ra7 s ASP 233 Cb -0.01 -1.60 -0.04 0.00 1.01 0.00 0.00 42.92 42.29 1ra7 s ASP 233 CO -0.04 0.02 -0.05 -0.31 0.21 0.00 0.00 175.17 175.00 1ra7 s TYR 234 N -1.88 2.89 -0.26 4.23 1.51 -1.26 -0.53 117.35 122.05 1ra7 s TYR 234 Ca 0.33 -0.06 -0.05 0.00 -1.01 0.00 0.00 57.07 56.27 1ra7 s TYR 234 Cb -0.10 -1.53 0.00 0.00 -0.11 0.00 0.00 41.96 40.23 1ra7 s TYR 234 CO 0.26 0.43 0.02 0.99 -1.11 0.00 0.00 175.55 176.15 1ra7 s THR 235 N -1.19 3.67 -1.25 -0.71 2.01 -0.10 -4.57 115.64 113.51 1ra7 s THR 235 Ca 0.22 -0.64 -0.03 0.00 0.31 0.00 0.00 61.69 61.55 1ra7 s THR 235 Cb -0.11 -2.82 0.00 0.00 0.01 0.00 0.00 72.50 69.58 1ra7 s THR 235 CO 0.14 0.21 1.06 0.61 -0.69 0.00 0.00 174.62 175.95 1ra7 n GLY 236 N 4.82 -0.42 0.31 4.40 0.00 -1.26 -4.51 105.19 108.53 1ra7 n GLY 236 Ca -0.16 0.15 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 1ra7 n GLY 236 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1ra7 h TYR 237 N -2.15 -1.03 -0.49 1.61 3.20 -1.92 -0.60 116.97 115.59 1ra7 h TYR 237 Ca -0.58 0.03 0.09 0.00 3.14 0.00 0.00 58.73 61.41 1ra7 h TYR 237 Cb 1.35 0.45 -0.10 0.00 1.54 0.00 0.00 36.73 39.97 1ra7 h TYR 237 CO 0.46 -0.37 -0.35 -0.44 -1.64 0.00 0.00 178.16 175.81 1ra7 h ASP 238 N -0.43 -1.20 0.75 -2.11 5.19 -1.91 -1.50 116.42 115.21 1ra7 h ASP 238 Ca 0.01 0.21 -0.05 0.00 -0.62 0.00 0.00 57.03 56.59 1ra7 h ASP 238 Cb 0.46 0.57 -0.01 0.00 0.18 0.00 0.00 39.33 40.54 1ra7 h ASP 238 CO -0.24 -0.32 -0.22 0.00 -3.12 0.00 0.00 179.24 175.34 1ra7 h ALA 239 N 0.79 1.09 0.00 3.45 0.00 -1.79 -0.96 119.26 121.84 1ra7 h ALA 239 Ca 0.19 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ra7 h ALA 239 Cb 0.55 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1ra7 h ALA 239 CO -0.61 0.27 0.00 0.66 0.00 0.00 0.00 179.25 179.57 1ra7 h SER 240 N 0.00 0.00 -3.05 0.00 4.64 -0.03 0.51 113.55 115.61 1ra7 h SER 240 Ca -0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1ra7 h SER 240 Cb 0.65 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.81 1ra7 h SER 240 CO 0.03 0.00 0.92 -0.76 -0.87 0.00 0.00 176.83 176.15 1ra7 s LEU 241 N -4.78 4.36 0.39 5.97 1.43 -1.08 -3.29 118.68 121.67 1ra7 s LEU 241 Ca 0.10 2.86 -0.00 0.00 -1.03 0.00 0.00 54.13 56.06 1ra7 s LEU 241 Cb 0.11 -3.62 -0.02 0.00 0.03 0.00 0.00 46.19 42.69 1ra7 s LEU 241 CO 0.60 -0.90 0.61 -0.44 0.23 0.00 0.00 176.35 176.45 1ra7 s SER 242 N 0.79 6.15 0.34 2.29 0.01 -1.26 -1.49 113.70 120.52 1ra7 s SER 242 Ca 0.68 0.44 0.09 0.00 1.31 0.00 0.00 55.95 58.46 1ra7 s SER 242 Cb -0.47 -1.89 0.81 0.00 0.21 0.00 0.00 66.02 64.68 1ra7 s SER 242 CO 0.40 -0.45 1.82 -0.65 0.41 0.00 0.00 173.24 174.77 1ra7 h PRO 243 N 0.60 0.68 -0.70 12.44 0.11 -1.88 -1.61 132.00 141.63 1ra7 h PRO 243 Ca -0.48 -0.04 0.10 0.00 0.11 0.00 0.00 66.00 65.68 1ra7 h PRO 243 Cb 1.23 -0.15 -0.05 0.00 0.11 0.00 0.00 31.00 32.14 1ra7 h PRO 243 CO 0.60 0.45 0.47 0.00 -0.21 0.00 0.00 178.00 179.31 1ra7 h ALA 244 N 1.61 1.88 0.00 -0.75 0.00 -1.81 0.70 119.26 120.88 1ra7 h ALA 244 Ca 0.52 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.35 1ra7 h ALA 244 Cb 0.88 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1ra7 h ALA 244 CO -0.29 -0.02 -0.34 -1.49 0.00 0.00 0.00 179.25 177.11 1ra7 h TRP 245 N 0.59 0.00 -0.12 0.00 4.06 -1.67 0.43 115.95 119.24 1ra7 h TRP 245 Ca 0.32 0.00 -0.21 0.00 2.06 0.00 0.00 58.89 61.06 1ra7 h TRP 245 Cb 0.49 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.65 1ra7 h TRP 245 CO -0.00 0.34 -0.77 0.74 -3.56 0.00 0.00 178.44 175.19 1ra7 h PHE 246 N 0.00 0.88 -0.50 0.49 0.04 -0.97 -1.97 116.94 114.91 1ra7 h PHE 246 Ca -0.00 -0.39 -0.06 0.00 2.80 0.00 0.00 57.97 60.31 1ra7 h PHE 246 Cb 0.61 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.61 1ra7 h PHE 246 CO 0.00 1.20 0.08 0.93 -0.60 0.00 0.00 178.31 179.92 1ra7 h GLU 247 N 0.44 0.83 -0.67 1.51 4.39 -0.67 -0.05 114.58 120.36 1ra7 h GLU 247 Ca -0.05 -0.22 0.05 0.00 0.34 0.00 0.00 59.36 59.48 1ra7 h GLU 247 Cb 1.38 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 29.88 1ra7 h GLU 247 CO 0.15 0.83 0.39 0.00 -1.16 0.00 0.00 179.01 179.21 1ra7 h ALA 248 N 0.97 0.89 -0.89 3.43 0.00 -0.87 0.26 119.26 123.05 1ra7 h ALA 248 Ca 0.15 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ra7 h ALA 248 Cb 0.39 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1ra7 h ALA 248 CO 0.01 0.09 0.54 1.25 0.00 0.00 0.00 179.25 181.14 1ra7 h LEU 249 N 0.73 1.07 -0.78 0.00 5.85 -0.72 -1.63 115.31 119.83 1ra7 h LEU 249 Ca 0.29 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 1ra7 h LEU 249 Cb 0.14 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 1ra7 h LEU 249 CO -0.16 0.82 0.41 0.11 -0.34 0.00 0.00 178.44 179.28 1ra7 h LYS 250 N 1.23 1.10 -0.78 1.25 1.57 0.15 -1.02 116.57 120.07 1ra7 h LYS 250 Ca 0.32 -0.14 0.04 0.00 -1.87 0.00 0.00 60.65 58.99 1ra7 h LYS 250 Cb -0.05 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 32.00 1ra7 h LYS 250 CO -0.06 0.83 0.50 0.52 -0.57 0.00 0.00 179.45 180.66 1ra7 h MET 251 N 1.09 0.93 -0.35 3.15 2.86 -0.17 0.12 114.93 122.56 1ra7 h MET 251 Ca 0.27 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.85 1ra7 h MET 251 Cb 0.06 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.50 1ra7 h MET 251 CO -0.04 0.62 0.18 0.28 1.06 0.00 0.00 176.91 179.01 1ra7 h VAL 252 N 0.96 1.15 -0.94 -2.22 2.07 -0.67 -1.84 116.25 114.76 1ra7 h VAL 252 Ca 0.32 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1ra7 h VAL 252 Cb 0.03 0.78 -0.05 0.00 -1.52 0.00 0.00 31.29 30.54 1ra7 h VAL 252 CO -0.12 0.15 0.60 -0.07 0.02 0.00 0.00 177.57 178.15 1ra7 h LEU 253 N 0.43 1.10 -0.29 2.57 3.38 -0.33 -2.54 115.31 119.63 1ra7 h LEU 253 Ca 0.12 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1ra7 h LEU 253 Cb 0.08 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1ra7 h LEU 253 CO -0.02 0.81 0.11 -0.08 0.09 0.00 0.00 178.44 179.36 1ra7 h GLU 254 N 1.28 0.43 0.00 1.13 4.22 -0.55 0.17 114.58 121.26 1ra7 h GLU 254 Ca 0.34 -0.08 0.00 0.00 0.08 0.00 0.00 59.36 59.70 1ra7 h GLU 254 Cb -0.11 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.07 1ra7 h GLU 254 CO -0.07 0.45 0.00 0.87 -2.18 0.00 0.00 179.01 178.08 1ra7 h LYS 255 N 0.31 0.00 -0.35 1.92 1.57 -0.94 -2.75 116.57 116.33 1ra7 h LYS 255 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1ra7 h LYS 255 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1ra7 h LYS 255 CO -0.01 0.00 0.00 0.44 -0.57 0.00 0.00 179.45 179.31 1ra7 n ILE 256 N -2.72 1.28 0.00 1.86 -5.35 -1.01 -4.98 119.36 108.45 1ra7 n ILE 256 Ca -0.00 -1.18 0.00 0.00 -0.27 0.00 0.00 62.75 61.30 1ra7 n ILE 256 Cb 0.18 0.34 0.00 0.00 -1.74 0.00 0.00 39.64 38.42 1ra7 n ILE 256 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ra7 n GLY 257 N 0.36 1.10 0.22 3.28 0.00 -1.04 -4.85 105.19 104.27 1ra7 n GLY 257 Ca 0.14 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.25 1ra7 n GLY 257 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ra7 n PHE 258 N -1.72 0.00 0.27 1.61 3.01 0.59 -4.68 117.46 116.54 1ra7 n PHE 258 Ca 0.00 -1.11 0.11 0.00 1.01 0.00 0.00 57.45 57.47 1ra7 n PHE 258 Cb 0.00 -0.17 0.73 0.00 -0.01 0.00 0.00 39.48 40.03 1ra7 n PHE 258 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1ra7 h GLY 259 N 0.26 0.00 -0.06 1.37 0.00 -1.74 -2.37 103.07 100.53 1ra7 h GLY 259 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ra7 h GLY 259 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 176.54 178.63 1ra7 n ASP 260 N -4.02 0.04 -1.06 0.19 5.75 -1.26 -3.26 116.55 112.92 1ra7 n ASP 260 Ca -0.03 -1.24 -0.06 0.00 -0.01 0.00 0.00 54.79 53.45 1ra7 n ASP 260 Cb 0.16 -0.02 -0.06 0.00 -1.03 0.00 0.00 41.12 40.17 1ra7 n ASP 260 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1ra7 n ARG 261 N -0.46 0.03 0.00 0.11 0.00 -0.90 -4.91 116.66 110.54 1ra7 n ARG 261 Ca 0.00 -1.05 0.08 0.00 -0.00 0.00 0.00 57.85 56.88 1ra7 n ARG 261 Cb 0.01 0.47 0.37 0.00 -0.00 0.00 0.00 32.46 33.31 1ra7 n ARG 261 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 1ra7 n VAL 262 N -0.01 0.80 -0.17 8.89 0.24 -1.20 -2.77 118.33 124.10 1ra7 n VAL 262 Ca -0.26 0.20 0.08 0.00 -2.04 0.00 0.00 64.34 62.32 1ra7 n VAL 262 Cb 0.72 -0.91 0.38 0.00 -1.47 0.00 0.00 33.84 32.57 1ra7 n VAL 262 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1ra7 h ASP 263 N 0.00 0.61 -0.97 -1.34 5.19 -1.91 -1.18 116.42 116.82 1ra7 h ASP 263 Ca 0.00 0.01 0.10 0.00 -0.62 0.00 0.00 57.03 56.52 1ra7 h ASP 263 Cb 0.28 -0.12 -0.08 0.00 0.18 0.00 0.00 39.33 39.59 1ra7 h ASP 263 CO 0.00 0.38 0.60 1.88 -3.12 0.00 0.00 179.24 178.99 1ra7 h TYR 264 N 0.69 1.10 -0.03 4.55 0.05 -1.95 -0.03 116.97 121.35 1ra7 h TYR 264 Ca 0.32 0.03 0.01 0.00 0.05 0.00 0.00 58.73 59.14 1ra7 h TYR 264 Cb 0.34 -0.35 -0.00 0.00 1.01 0.00 0.00 36.73 37.73 1ra7 h TYR 264 CO -0.00 0.48 0.03 0.82 -1.05 0.00 0.00 178.16 178.43 1ra7 h ILE 265 N 1.00 0.88 -0.29 -2.88 1.08 -1.44 -1.40 117.51 114.47 1ra7 h ILE 265 Ca 0.46 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.90 1ra7 h ILE 265 Cb 0.38 0.98 -0.02 0.00 -3.07 0.00 0.00 36.82 35.09 1ra7 h ILE 265 CO -0.24 0.00 0.06 0.44 -0.69 0.00 0.00 178.15 177.72 1ra7 h ASP 266 N 0.00 0.38 0.99 1.72 3.32 -1.03 -2.02 116.42 119.77 1ra7 h ASP 266 Ca 0.02 -0.05 -0.09 0.00 0.02 0.00 0.00 57.03 56.93 1ra7 h ASP 266 Cb 0.07 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1ra7 h ASP 266 CO -0.00 0.40 -0.41 0.22 -1.72 0.00 0.00 179.24 177.72 1ra7 h TYR 267 N 0.41 0.00 -0.17 4.55 3.20 -1.31 0.41 116.97 124.06 1ra7 h TYR 267 Ca 0.10 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.89 1ra7 h TYR 267 Cb 0.18 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.45 1ra7 h TYR 267 CO 0.01 0.41 -0.21 -0.07 -1.64 0.00 0.00 178.16 176.66 1ra7 h LEU 268 N 0.00 0.48 0.50 2.82 3.38 -1.43 -3.28 115.31 117.78 1ra7 h LEU 268 Ca -0.00 -0.50 -0.02 0.00 0.09 0.00 0.00 57.88 57.44 1ra7 h LEU 268 Cb 1.02 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1ra7 h LEU 268 CO 0.05 0.88 -0.24 -1.13 0.09 0.00 0.00 178.44 178.09 1ra7 h ASN 269 N 0.08 -0.57 -3.20 -0.43 -1.24 -1.19 -3.40 115.58 105.63 1ra7 h ASN 269 Ca 0.02 0.02 -0.76 0.00 0.71 0.00 0.00 56.30 56.29 1ra7 h ASN 269 Cb 0.76 0.15 -0.25 0.00 0.73 0.00 0.00 38.32 39.71 1ra7 h ASN 269 CO 0.05 -0.22 -0.20 -2.28 -1.29 0.00 0.00 177.43 173.50 1ra7 s HIS 270 N -3.82 3.33 0.12 0.67 2.46 0.14 -0.13 115.29 118.07 1ra7 s HIS 270 Ca -0.10 -1.44 0.10 0.00 0.47 0.00 0.00 55.06 54.10 1ra7 s HIS 270 Cb 0.01 -3.77 -0.04 0.00 -0.13 0.00 0.00 32.58 28.65 1ra7 s HIS 270 CO 0.30 -1.01 -0.24 -1.54 -2.47 0.00 0.00 174.74 169.78 1ra7 s SER 271 N 3.33 3.54 -0.25 9.88 1.04 -0.22 -4.37 113.70 126.66 1ra7 s SER 271 Ca 0.05 -0.68 -0.11 0.00 0.48 0.00 0.00 55.95 55.70 1ra7 s SER 271 Cb -0.27 -0.35 -0.05 0.00 0.10 0.00 0.00 66.02 65.45 1ra7 s SER 271 CO 0.01 0.18 0.18 -2.28 0.98 0.00 0.00 173.24 172.31 1ra7 s HIS 272 N -1.09 3.30 0.12 5.02 2.46 -1.26 -0.47 115.29 123.37 1ra7 s HIS 272 Ca 0.16 0.23 0.11 0.00 0.47 0.00 0.00 55.06 56.02 1ra7 s HIS 272 Cb -0.10 -2.31 -0.04 0.00 -0.13 0.00 0.00 32.58 30.00 1ra7 s HIS 272 CO 0.08 0.02 -0.27 -1.01 -2.47 0.00 0.00 174.74 171.09 1ra7 s HIS 273 N 1.21 2.28 -0.14 3.88 3.76 0.64 -0.69 115.29 126.22 1ra7 s HIS 273 Ca 0.08 -0.38 0.00 0.00 -0.15 0.00 0.00 55.06 54.61 1ra7 s HIS 273 Cb -0.14 -1.24 0.02 0.00 1.11 0.00 0.00 32.58 32.33 1ra7 s HIS 273 CO 0.06 0.32 -0.14 -0.51 -0.85 0.00 0.00 174.74 173.62 1ra7 s LEU 274 N -2.00 1.65 -0.14 0.89 1.43 0.40 -1.17 118.68 119.74 1ra7 s LEU 274 Ca 0.13 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 52.73 1ra7 s LEU 274 Cb -0.10 -1.14 0.05 0.00 0.03 0.00 0.00 46.19 45.03 1ra7 s LEU 274 CO 0.06 -0.05 0.07 -0.47 0.23 0.00 0.00 176.35 176.18 1ra7 s TYR 275 N 1.43 0.37 0.00 0.29 5.04 -0.57 0.35 117.35 124.26 1ra7 s TYR 275 Ca 0.03 -0.31 0.00 0.00 -2.44 0.00 0.00 57.07 54.36 1ra7 s TYR 275 Cb -0.13 -0.73 0.00 0.00 0.35 0.00 0.00 41.96 41.45 1ra7 s TYR 275 CO -0.09 -0.46 0.00 1.63 -1.34 0.00 0.00 175.55 175.29 1ra7 n LYS 276 N 5.23 0.00 0.00 4.97 4.01 -1.26 -1.59 118.16 129.52 1ra7 n LYS 276 Ca -0.07 0.00 0.09 0.00 -0.51 0.00 0.00 58.31 57.82 1ra7 n LYS 276 Cb 0.49 0.00 -0.05 0.00 -0.51 0.00 0.00 35.03 34.96 1ra7 n LYS 276 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1ra7 n ASN 277 N 9.63 1.39 -4.97 4.39 6.94 -1.26 0.74 115.26 132.12 1ra7 n ASN 277 Ca 0.00 -1.20 -0.21 0.00 -0.02 0.00 0.00 54.58 53.16 1ra7 n ASN 277 Cb 0.00 0.70 -0.02 0.00 -2.36 0.00 0.00 39.78 38.10 1ra7 n ASN 277 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1ra7 s LYS 278 N -2.39 3.40 -0.01 -3.83 1.02 -0.62 0.66 119.74 117.96 1ra7 s LYS 278 Ca 0.12 -0.79 0.03 0.00 0.02 0.00 0.00 55.97 55.34 1ra7 s LYS 278 Cb 0.15 -2.88 -0.01 0.00 -0.52 0.00 0.00 37.83 34.57 1ra7 s LYS 278 CO 0.59 0.38 -0.10 -0.08 -0.92 0.00 0.00 175.35 175.22 1ra7 s THR 279 N -2.01 0.80 0.00 2.17 -1.32 0.15 -1.52 115.64 113.92 1ra7 s THR 279 Ca 0.35 -0.43 0.00 0.00 -1.21 0.00 0.00 61.69 60.40 1ra7 s THR 279 Cb -0.09 -0.67 0.00 0.00 -1.51 0.00 0.00 72.50 70.23 1ra7 s THR 279 CO 0.29 0.22 0.00 0.00 -2.21 0.00 0.00 174.62 172.93 1ra7 n TYR 280 N 2.83 0.00 -3.65 9.09 0.18 -0.32 -0.30 117.16 125.00 1ra7 n TYR 280 Ca -0.14 0.00 -0.00 0.00 1.88 0.00 0.00 57.90 59.64 1ra7 n TYR 280 Cb 0.57 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.46 1ra7 n TYR 280 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1ra7 s VAL 282 N 0.71 -0.00 -0.40 -3.48 1.01 0.38 -0.26 120.40 118.36 1ra7 s VAL 282 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 61.98 61.82 1ra7 s VAL 282 Cb 0.00 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.39 1ra7 s VAL 282 CO 0.00 0.00 0.36 -0.75 0.00 0.00 0.00 175.10 174.71 1ra7 s LYS 283 N 1.21 3.16 0.07 2.72 2.20 0.74 -1.06 119.74 128.78 1ra7 s LYS 283 Ca -0.09 -0.79 0.00 0.00 -0.36 0.00 0.00 55.97 54.73 1ra7 s LYS 283 Cb -0.03 -3.93 0.00 0.00 -1.51 0.00 0.00 37.83 32.36 1ra7 s LYS 283 CO -0.13 -0.73 0.00 0.41 -0.36 0.00 0.00 175.35 174.54 1ra7 n GLY 284 N 5.10 -3.12 0.32 5.54 0.00 0.81 -1.00 105.19 112.84 1ra7 n GLY 284 Ca -0.09 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.12 1ra7 n GLY 284 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ra7 n GLY 285 N -0.45 -2.74 3.67 -0.02 0.00 -0.69 -4.57 105.19 100.39 1ra7 n GLY 285 Ca 0.00 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.70 1ra7 n GLY 285 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ra7 s MET 286 N -3.28 4.29 0.29 1.61 1.75 -0.37 -4.50 119.30 119.09 1ra7 s MET 286 Ca 0.00 1.17 -0.29 0.00 -1.25 0.00 0.00 55.69 55.31 1ra7 s MET 286 Cb 0.00 -3.60 -0.10 0.00 2.84 0.00 0.00 34.83 33.97 1ra7 s MET 286 CO 0.00 -0.43 1.34 -2.14 -0.65 0.00 0.00 175.02 173.14 1ra7 s PRO 287 N 2.49 4.34 0.36 4.11 0.02 -1.26 -4.59 135.00 140.47 1ra7 s PRO 287 Ca 0.41 2.22 0.07 0.00 0.02 0.00 0.00 61.00 63.72 1ra7 s PRO 287 Cb -0.16 -3.10 0.69 0.00 0.02 0.00 0.00 34.50 31.95 1ra7 s PRO 287 CO 0.11 -0.26 1.89 0.66 -0.33 0.00 0.00 177.00 179.07 1ra7 h SER 288 N 4.11 0.35 -3.85 2.53 4.64 -1.87 -3.46 113.55 116.00 1ra7 h SER 288 Ca -0.48 -0.07 -0.67 0.00 -0.47 0.00 0.00 61.79 60.10 1ra7 h SER 288 Cb 1.22 -0.09 -0.38 0.00 -0.31 0.00 0.00 62.40 62.84 1ra7 h SER 288 CO 0.70 0.48 -0.61 -0.83 -0.87 0.00 0.00 176.83 175.70 1ra7 s GLY 289 N -3.96 2.14 -0.36 -0.77 0.00 -0.90 -4.87 107.32 98.61 1ra7 s GLY 289 Ca -0.06 -2.80 -0.10 0.00 0.00 0.00 0.00 44.72 41.75 1ra7 s GLY 289 CO 0.75 1.00 0.19 -0.45 0.00 0.00 0.00 173.10 174.59 1ra7 s SER 291 N 0.86 5.67 0.00 1.64 0.15 -1.26 -2.15 113.70 118.61 1ra7 s SER 291 Ca 0.12 -0.88 0.00 0.00 0.70 0.00 0.00 55.95 55.90 1ra7 s SER 291 Cb -0.22 -2.01 0.00 0.00 -1.71 0.00 0.00 66.02 62.08 1ra7 s SER 291 CO -0.05 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 174.67 1ra7 n GLY 292 N 4.99 0.67 0.24 9.45 0.00 -1.26 -4.88 105.19 114.41 1ra7 n GLY 292 Ca -0.12 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.91 1ra7 n GLY 292 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1ra7 h THR 293 N 0.00 0.43 0.34 2.61 2.02 -1.90 0.26 112.91 116.67 1ra7 h THR 293 Ca 0.00 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 1ra7 h THR 293 Cb 0.00 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 66.76 1ra7 h THR 293 CO 0.00 0.01 -0.18 0.28 0.37 0.00 0.00 175.52 176.00 1ra7 h SER 294 N 0.08 -0.45 -0.68 4.18 0.02 -1.94 0.10 113.55 114.86 1ra7 h SER 294 Ca 0.33 0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.25 1ra7 h SER 294 Cb 0.54 0.13 -0.03 0.00 0.14 0.00 0.00 62.40 63.17 1ra7 h SER 294 CO -0.59 -0.30 0.24 0.40 -1.14 0.00 0.00 176.83 175.44 1ra7 h ILE 295 N -0.48 1.25 -0.04 3.27 2.04 -1.84 -0.23 117.51 121.47 1ra7 h ILE 295 Ca -0.04 -0.83 -0.12 0.00 1.00 0.00 0.00 64.86 64.87 1ra7 h ILE 295 Cb 0.39 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1ra7 h ILE 295 CO 0.06 0.32 -0.52 -0.26 0.00 0.00 0.00 178.15 177.75 1ra7 h PHE 296 N 0.98 0.14 -0.36 1.37 0.04 -0.43 -0.32 116.94 118.36 1ra7 h PHE 296 Ca 0.22 -0.05 -0.13 0.00 2.80 0.00 0.00 57.97 60.81 1ra7 h PHE 296 Cb 0.26 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.37 1ra7 h PHE 296 CO 0.02 0.61 -0.31 -0.91 -0.60 0.00 0.00 178.31 177.12 1ra7 h ASN 297 N 0.09 0.82 -0.37 2.17 2.35 -0.42 -0.82 115.58 119.41 1ra7 h ASN 297 Ca 0.00 -0.33 -0.14 0.00 -0.55 0.00 0.00 56.30 55.28 1ra7 h ASN 297 Cb 0.94 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 39.08 1ra7 h ASN 297 CO 0.07 1.06 -0.30 0.28 -1.65 0.00 0.00 177.43 176.90 1ra7 h SER 298 N 0.67 0.94 -0.23 5.81 0.02 -0.73 -0.72 113.55 119.30 1ra7 h SER 298 Ca 0.07 -0.39 -0.03 0.00 -0.84 0.00 0.00 61.79 60.61 1ra7 h SER 298 Cb 0.84 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 1ra7 h SER 298 CO 0.07 1.16 0.03 0.24 -1.14 0.00 0.00 176.83 177.19 1ra7 h MET 299 N 0.76 0.39 -0.63 3.45 2.86 -0.92 -1.05 114.93 119.79 1ra7 h MET 299 Ca 0.08 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 1ra7 h MET 299 Cb 0.87 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.45 1ra7 h MET 299 CO 0.08 0.54 0.32 0.82 1.06 0.00 0.00 176.91 179.72 1ra7 h ILE 300 N 0.18 1.20 -0.62 -1.22 2.04 -1.04 -1.37 117.51 116.68 1ra7 h ILE 300 Ca 0.07 -0.54 -0.06 0.00 1.00 0.00 0.00 64.86 65.33 1ra7 h ILE 300 Cb 0.34 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.78 1ra7 h ILE 300 CO 0.01 0.23 0.17 -1.13 0.00 0.00 0.00 178.15 177.43 1ra7 h ASN 301 N 0.88 0.90 0.10 1.72 -0.73 -0.73 0.12 115.58 117.85 1ra7 h ASN 301 Ca 0.22 -0.17 -0.03 0.00 1.87 0.00 0.00 56.30 58.20 1ra7 h ASN 301 Cb 0.07 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.42 1ra7 h ASN 301 CO -0.03 0.86 -0.12 0.78 -0.37 0.00 0.00 177.43 178.55 1ra7 h ASN 302 N 0.93 0.04 0.34 1.15 2.35 -0.14 -1.86 115.58 118.39 1ra7 h ASN 302 Ca 0.20 -0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.65 1ra7 h ASN 302 Cb 0.31 -0.01 0.02 0.00 0.05 0.00 0.00 38.32 38.69 1ra7 h ASN 302 CO -0.00 0.16 -1.27 -0.07 -1.65 0.00 0.00 177.43 174.60 1ra7 h LEU 303 N 0.04 0.69 -0.12 1.61 3.38 -0.36 -3.19 115.31 117.36 1ra7 h LEU 303 Ca 0.01 -0.68 -0.02 0.00 0.09 0.00 0.00 57.88 57.28 1ra7 h LEU 303 Cb 0.24 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1ra7 h LEU 303 CO 0.02 1.51 0.02 0.40 0.09 0.00 0.00 178.44 180.48 1ra7 h ILE 304 N 0.18 1.23 -0.53 1.22 2.04 -0.37 -0.76 117.51 120.50 1ra7 h ILE 304 Ca -0.18 -0.72 -0.02 0.00 1.00 0.00 0.00 64.86 64.94 1ra7 h ILE 304 Cb 1.96 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 39.49 1ra7 h ILE 304 CO 0.23 0.21 0.24 0.40 0.00 0.00 0.00 178.15 179.23 1ra7 h ILE 305 N -0.03 1.21 -0.38 -0.67 1.08 -1.50 -0.47 117.51 116.75 1ra7 h ILE 305 Ca 0.04 -0.61 0.00 0.00 -0.39 0.00 0.00 64.86 63.90 1ra7 h ILE 305 Cb 0.31 0.62 -0.02 0.00 -3.07 0.00 0.00 36.82 34.66 1ra7 h ILE 305 CO 0.00 0.24 0.25 0.03 -0.69 0.00 0.00 178.15 177.98 1ra7 h ARG 306 N 0.72 0.50 0.18 2.37 3.08 -1.52 -1.54 114.38 118.17 1ra7 h ARG 306 Ca 0.18 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.20 1ra7 h ARG 306 Cb 0.15 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1ra7 h ARG 306 CO -0.02 0.33 -0.13 1.15 -1.07 0.00 0.00 179.97 180.23 1ra7 h THR 307 N 0.51 0.71 -0.22 2.04 2.02 -0.75 -0.36 112.91 116.87 1ra7 h THR 307 Ca 0.14 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.32 1ra7 h THR 307 Cb -0.06 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1ra7 h THR 307 CO -0.03 0.00 0.14 -0.07 0.37 0.00 0.00 175.52 175.93 1ra7 h LEU 308 N -0.31 0.25 -0.25 2.58 3.38 -0.95 -0.75 115.31 119.26 1ra7 h LEU 308 Ca -0.01 -0.01 -0.20 0.00 0.09 0.00 0.00 57.88 57.76 1ra7 h LEU 308 Cb 0.28 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1ra7 h LEU 308 CO -0.00 0.18 -0.60 -0.07 0.09 0.00 0.00 178.44 178.03 1ra7 h LEU 309 N 0.29 0.97 -0.68 1.67 3.38 -0.70 -1.75 115.31 118.50 1ra7 h LEU 309 Ca 0.08 -0.56 -0.12 0.00 0.09 0.00 0.00 57.88 57.37 1ra7 h LEU 309 Cb -0.03 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.42 1ra7 h LEU 309 CO -0.02 1.35 -0.23 -0.07 0.09 0.00 0.00 178.44 179.57 1ra7 h LEU 310 N 0.63 0.80 -0.16 1.67 3.38 -0.36 0.92 115.31 122.18 1ra7 h LEU 310 Ca -0.00 -0.29 -0.13 0.00 0.09 0.00 0.00 57.88 57.55 1ra7 h LEU 310 Cb 1.22 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 1ra7 h LEU 310 CO 0.13 1.00 -0.60 0.50 0.09 0.00 0.00 178.44 179.56 1ra7 h LYS 311 N 0.68 0.00 0.01 1.13 3.64 -1.15 -3.32 116.57 117.57 1ra7 h LYS 311 Ca 0.09 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.14 1ra7 h LYS 311 Cb 0.74 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.51 1ra7 h LYS 311 CO 0.06 0.60 -2.04 2.41 -2.27 0.00 0.00 179.45 178.21 1ra7 n THR 312 N -3.31 1.54 -3.50 1.00 -1.04 -0.66 -4.75 114.28 103.56 1ra7 n THR 312 Ca 0.01 -0.79 -0.27 0.00 -2.04 0.00 0.00 64.05 60.97 1ra7 n THR 312 Cb 0.74 -0.94 -0.10 0.00 -1.82 0.00 0.00 70.33 68.22 1ra7 n THR 312 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1ra7 n TYR 313 N -3.00 1.27 -1.62 -1.42 4.01 0.31 -5.08 117.16 111.63 1ra7 n TYR 313 Ca -0.26 -3.81 -0.46 0.00 -0.16 0.00 0.00 57.90 53.20 1ra7 n TYR 313 Cb 1.09 -0.28 -0.03 0.00 -0.31 0.00 0.00 39.34 39.81 1ra7 n TYR 313 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1ra7 n LYS 314 N 1.90 1.54 0.00 -0.72 4.81 -1.25 -1.07 118.16 123.37 1ra7 n LYS 314 Ca 0.25 0.55 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 1ra7 n LYS 314 Cb 0.44 -2.06 0.00 0.00 0.02 0.00 0.00 35.03 33.43 1ra7 n LYS 314 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ra7 n GLY 315 N 1.76 1.07 3.60 3.14 0.00 -1.26 -5.04 105.19 108.46 1ra7 n GLY 315 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1ra7 n GLY 315 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1ra7 n ILE 316 N -2.00 2.58 -3.37 -0.61 0.13 -0.23 -4.92 119.36 110.93 1ra7 n ILE 316 Ca 0.00 -0.50 -0.45 0.00 -1.10 0.00 0.00 62.75 60.70 1ra7 n ILE 316 Cb 0.00 -1.11 -0.04 0.00 -0.84 0.00 0.00 39.64 37.66 1ra7 n ILE 316 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 1ra7 s ASP 317 N -0.84 6.43 0.55 9.51 2.15 -1.26 -4.92 116.67 128.28 1ra7 s ASP 317 Ca 0.65 -2.46 0.27 0.00 0.43 0.00 0.00 52.55 51.44 1ra7 s ASP 317 Cb -0.53 -2.17 1.44 0.00 -0.30 0.00 0.00 42.92 41.37 1ra7 s ASP 317 CO 0.55 -0.62 1.99 -0.07 -0.17 0.00 0.00 175.17 176.84 1ra7 h LEU 318 N 8.00 0.00 -0.83 -1.34 3.38 -1.95 0.44 115.31 123.01 1ra7 h LEU 318 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1ra7 h LEU 318 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1ra7 h LEU 318 CO 0.82 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.82 1ra7 n ASP 319 N -4.22 0.34 -0.38 -0.43 8.00 -1.26 -0.41 116.55 118.20 1ra7 n ASP 319 Ca 0.09 0.65 0.09 0.00 0.71 0.00 0.00 54.79 56.33 1ra7 n ASP 319 Cb 0.61 -0.70 0.17 0.00 -0.02 0.00 0.00 41.12 41.18 1ra7 n ASP 319 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1ra7 n HIS 320 N -1.95 0.35 -3.24 1.24 8.25 0.16 -4.89 115.22 115.13 1ra7 n HIS 320 Ca -0.01 -0.90 -0.40 0.00 -0.26 0.00 0.00 57.72 56.16 1ra7 n HIS 320 Cb 0.03 -0.19 -0.08 0.00 1.12 0.00 0.00 29.99 30.87 1ra7 n HIS 320 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1ra7 s LEU 321 N -2.63 4.06 -0.28 2.41 2.96 0.46 -4.16 118.68 121.49 1ra7 s LEU 321 Ca 0.33 0.49 0.01 0.00 -0.22 0.00 0.00 54.13 54.74 1ra7 s LEU 321 Cb 0.27 -2.65 0.06 0.00 0.50 0.00 0.00 46.19 44.37 1ra7 s LEU 321 CO 0.05 -0.29 -0.06 -0.54 -1.32 0.00 0.00 176.35 174.20 1ra7 s LYS 322 N 2.30 2.27 0.08 1.98 -0.14 -0.43 -4.98 119.74 120.82 1ra7 s LYS 322 Ca 0.21 -1.35 0.03 0.00 -1.36 0.00 0.00 55.97 53.49 1ra7 s LYS 322 Cb -0.16 -3.03 -0.03 0.00 -1.68 0.00 0.00 37.83 32.93 1ra7 s LYS 322 CO 0.09 -0.62 -0.08 0.00 -0.76 0.00 0.00 175.35 173.98 1ra7 s MET 323 N 1.15 0.75 -0.04 1.68 0.23 -1.26 0.02 119.30 121.83 1ra7 s MET 323 Ca -0.06 -1.11 -0.01 0.00 -1.03 0.00 0.00 55.69 53.48 1ra7 s MET 323 Cb -0.20 -0.35 0.03 0.00 -1.53 0.00 0.00 34.83 32.78 1ra7 s MET 323 CO -0.04 0.04 0.03 0.42 -2.03 0.00 0.00 175.02 173.44 1ra7 s ILE 324 N -2.56 0.05 0.21 3.16 1.01 0.49 -4.36 121.20 119.20 1ra7 s ILE 324 Ca 0.03 0.23 0.11 0.00 0.00 0.00 0.00 60.65 61.02 1ra7 s ILE 324 Cb -0.02 -0.21 -0.05 0.00 0.01 0.00 0.00 42.46 42.19 1ra7 s ILE 324 CO -0.02 0.15 -0.21 0.00 0.00 0.00 0.00 174.94 174.87 1ra7 s ALA 325 N 1.51 2.44 -0.35 9.38 0.00 -0.68 -0.68 121.76 133.38 1ra7 s ALA 325 Ca -0.03 -1.68 0.00 0.00 0.00 0.00 0.00 51.96 50.25 1ra7 s ALA 325 Cb -0.13 -0.26 0.14 0.00 0.00 0.00 0.00 23.12 22.88 1ra7 s ALA 325 CO -0.03 0.31 0.22 -0.47 0.00 0.00 0.00 175.76 175.79 1ra7 s TYR 326 N -2.11 0.59 0.00 0.00 6.14 0.19 -0.78 117.35 121.37 1ra7 s TYR 326 Ca 0.22 -1.50 0.00 0.00 0.64 0.00 0.00 57.07 56.44 1ra7 s TYR 326 Cb -0.06 -0.86 0.00 0.00 0.42 0.00 0.00 41.96 41.46 1ra7 s TYR 326 CO 0.10 -0.84 0.00 0.41 0.64 0.00 0.00 175.55 175.86 1ra7 n GLY 327 N 4.14 2.57 0.12 8.97 0.00 -1.25 -1.58 105.19 118.16 1ra7 n GLY 327 Ca 0.11 -0.32 0.13 0.00 0.00 0.00 0.00 46.02 45.94 1ra7 n GLY 327 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1ra7 h ASP 328 N 1.48 0.00 -3.94 1.61 2.03 -1.93 -3.36 116.42 112.31 1ra7 h ASP 328 Ca 0.00 0.00 -0.49 0.00 -0.73 0.00 0.00 57.03 55.81 1ra7 h ASP 328 Cb 0.00 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 38.52 1ra7 h ASP 328 CO 0.00 0.00 0.43 -0.62 -1.03 0.00 0.00 179.24 178.02 1ra7 s ASP 329 N -4.81 6.81 -0.09 4.15 -1.08 -0.61 -4.77 116.67 116.27 1ra7 s ASP 329 Ca 0.10 2.09 -0.24 0.00 -0.52 0.00 0.00 52.55 53.99 1ra7 s ASP 329 Cb 0.11 -2.59 0.05 0.00 -1.46 0.00 0.00 42.92 39.03 1ra7 s ASP 329 CO 0.61 -0.46 0.56 0.54 0.52 0.00 0.00 175.17 176.94 1ra7 s VAL 330 N -1.57 0.01 -0.13 1.11 0.11 -1.26 -0.64 120.40 118.04 1ra7 s VAL 330 Ca 0.56 -0.12 0.00 0.00 -2.93 0.00 0.00 61.98 59.49 1ra7 s VAL 330 Cb -0.24 -0.85 0.02 0.00 -1.53 0.00 0.00 36.38 33.78 1ra7 s VAL 330 CO 0.30 -0.07 -0.11 -0.51 -3.33 0.00 0.00 175.10 171.38 1ra7 s ILE 331 N -0.79 1.33 0.25 7.04 2.07 0.14 -4.75 121.20 126.50 1ra7 s ILE 331 Ca -0.08 -0.48 0.07 0.00 -1.41 0.00 0.00 60.65 58.74 1ra7 s ILE 331 Cb -0.03 -1.29 -0.05 0.00 0.13 0.00 0.00 42.46 41.23 1ra7 s ILE 331 CO 0.06 0.42 -0.08 0.00 -1.91 0.00 0.00 174.94 173.43 1ra7 s ALA 332 N 1.56 2.19 0.12 1.50 0.00 -1.06 -0.38 121.76 125.69 1ra7 s ALA 332 Ca 0.05 -1.81 -0.17 0.00 0.00 0.00 0.00 51.96 50.02 1ra7 s ALA 332 Cb -0.13 0.13 0.04 0.00 0.00 0.00 0.00 23.12 23.16 1ra7 s ALA 332 CO -0.09 -0.04 0.42 -1.54 0.00 0.00 0.00 175.76 174.50 1ra7 s SER 333 N -3.39 -0.27 -0.02 0.00 1.04 0.10 -1.05 113.70 110.11 1ra7 s SER 333 Ca 0.27 -0.25 -0.23 0.00 0.48 0.00 0.00 55.95 56.22 1ra7 s SER 333 Cb 0.02 0.48 0.05 0.00 0.10 0.00 0.00 66.02 66.68 1ra7 s SER 333 CO 0.10 -0.84 0.52 -0.47 0.98 0.00 0.00 173.24 173.52 1ra7 s TYR 334 N -3.65 -0.44 0.57 5.02 5.04 0.15 -1.31 117.35 122.74 1ra7 s TYR 334 Ca 0.02 0.68 0.34 0.00 -2.44 0.00 0.00 57.07 55.66 1ra7 s TYR 334 Cb 0.01 0.28 1.92 0.00 0.35 0.00 0.00 41.96 44.53 1ra7 s TYR 334 CO -0.11 -0.54 2.26 -1.35 -1.34 0.00 0.00 175.55 174.46 1ra7 h PRO 335 N 3.24 0.00 -6.31 4.97 0.11 -1.83 -0.30 132.00 131.88 1ra7 h PRO 335 Ca -0.29 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.21 1ra7 h PRO 335 Cb 1.17 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.13 1ra7 h PRO 335 CO 0.40 0.02 -0.76 -1.01 -0.21 0.00 0.00 178.00 176.43 1ra7 s HIS 336 N -4.42 2.34 0.70 0.65 3.76 -1.26 -4.42 115.29 112.65 1ra7 s HIS 336 Ca -0.05 -0.32 -0.14 0.00 -0.15 0.00 0.00 55.06 54.40 1ra7 s HIS 336 Cb 0.14 -1.05 0.02 0.00 1.11 0.00 0.00 32.58 32.80 1ra7 s HIS 336 CO 0.52 0.65 1.12 -2.00 -0.85 0.00 0.00 174.74 174.18 1ra7 s GLU 337 N -3.31 2.54 0.04 1.40 2.12 -1.26 -4.78 118.70 115.45 1ra7 s GLU 337 Ca 0.28 1.37 -0.04 0.00 0.36 0.00 0.00 54.97 56.94 1ra7 s GLU 337 Cb -0.06 -1.92 -0.02 0.00 0.26 0.00 0.00 34.13 32.40 1ra7 s GLU 337 CO 0.14 -1.45 0.06 0.14 -0.54 0.00 0.00 175.26 173.61 1ra7 s VAL 338 N -2.46 0.15 -0.56 3.70 -7.23 -1.26 -5.11 120.40 107.63 1ra7 s VAL 338 Ca 0.66 -1.22 -0.22 0.00 -1.81 0.00 0.00 61.98 59.40 1ra7 s VAL 338 Cb -0.20 -0.96 0.06 0.00 0.56 0.00 0.00 36.38 35.83 1ra7 s VAL 338 CO 0.46 -0.67 0.82 -0.62 -0.31 0.00 0.00 175.10 174.78 1ra7 s ASP 339 N -2.23 6.26 0.25 4.85 -1.08 -1.26 -4.90 116.67 118.56 1ra7 s ASP 339 Ca -0.03 -0.74 -0.06 0.00 -0.52 0.00 0.00 52.55 51.20 1ra7 s ASP 339 Cb -0.00 -2.37 0.27 0.00 -1.46 0.00 0.00 42.92 39.36 1ra7 s ASP 339 CO -0.06 -1.14 1.91 0.00 0.52 0.00 0.00 175.17 176.40 1ra7 h ALA 340 N 9.24 1.26 -0.74 3.66 0.00 -1.95 -1.62 119.26 129.11 1ra7 h ALA 340 Ca -0.27 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.61 1ra7 h ALA 340 Cb 1.08 -0.38 -0.06 0.00 0.00 0.00 0.00 17.79 18.43 1ra7 h ALA 340 CO 1.06 0.65 0.43 1.03 0.00 0.00 0.00 179.25 182.43 1ra7 h SER 341 N 1.30 0.66 -0.30 0.00 0.87 -1.93 0.15 113.55 114.30 1ra7 h SER 341 Ca 0.34 0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.88 1ra7 h SER 341 Cb -0.09 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 1ra7 h SER 341 CO -0.07 0.42 -0.01 0.25 -0.53 0.00 0.00 176.83 176.90 1ra7 h LEU 342 N 0.79 0.53 -1.00 2.23 6.46 -1.82 -2.07 115.31 120.44 1ra7 h LEU 342 Ca 0.33 -0.32 0.05 0.00 -0.12 0.00 0.00 57.88 57.82 1ra7 h LEU 342 Cb 0.19 -0.14 -0.06 0.00 -0.73 0.00 0.00 40.66 39.91 1ra7 h LEU 342 CO -0.18 0.72 0.65 -0.07 -0.62 0.00 0.00 178.44 178.93 1ra7 h LEU 343 N 0.33 1.06 -1.04 2.25 3.38 -0.58 -0.59 115.31 120.12 1ra7 h LEU 343 Ca 0.08 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1ra7 h LEU 343 Cb 0.45 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1ra7 h LEU 343 CO 0.02 0.70 0.32 0.00 0.09 0.00 0.00 178.44 179.57 1ra7 h ALA 344 N 1.43 1.25 -0.37 1.53 0.00 -0.44 0.11 119.26 122.77 1ra7 h ALA 344 Ca 0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1ra7 h ALA 344 Cb 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1ra7 h ALA 344 CO -0.15 0.57 0.19 1.96 0.00 0.00 0.00 179.25 181.82 1ra7 h GLN 345 N 0.99 0.53 -0.41 0.00 4.20 -0.44 -2.11 115.11 117.87 1ra7 h GLN 345 Ca 0.24 -0.07 -0.06 0.00 0.06 0.00 0.00 58.65 58.82 1ra7 h GLN 345 Cb 0.12 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 1ra7 h GLN 345 CO -0.03 0.46 0.01 0.77 -0.67 0.00 0.00 178.83 179.37 1ra7 h SER 346 N 0.46 0.61 -0.78 1.46 0.02 -0.56 -2.66 113.55 112.10 1ra7 h SER 346 Ca 0.13 -0.13 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 1ra7 h SER 346 Cb 0.10 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.44 1ra7 h SER 346 CO -0.02 0.68 0.51 1.23 -1.14 0.00 0.00 176.83 178.09 1ra7 h GLY 347 N 0.91 1.09 1.27 -3.77 0.00 -0.26 -1.74 103.07 100.57 1ra7 h GLY 347 Ca 0.13 -0.40 0.05 0.00 0.00 0.00 0.00 47.33 47.11 1ra7 h GLY 347 CO 0.01 0.39 0.37 1.70 0.00 0.00 0.00 176.54 179.01 1ra7 h LYS 348 N 1.03 0.57 0.00 4.80 3.64 -1.03 0.17 116.57 125.76 1ra7 h LYS 348 Ca 0.29 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1ra7 h LYS 348 Cb -0.09 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.60 1ra7 h LYS 348 CO -0.07 0.37 0.00 -0.44 -2.27 0.00 0.00 179.45 177.05 1ra7 h ASP 349 N 0.58 0.00 -0.70 4.20 3.32 -1.37 -2.38 116.42 120.08 1ra7 h ASP 349 Ca 0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 1ra7 h ASP 349 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 1ra7 h ASP 349 CO -0.07 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.23 1ra7 n TYR 350 N -3.06 1.04 -0.85 4.55 4.01 0.48 -4.63 117.16 118.70 1ra7 n TYR 350 Ca 0.01 -0.52 0.00 0.00 -0.16 0.00 0.00 57.90 57.22 1ra7 n TYR 350 Cb 0.30 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.28 1ra7 n TYR 350 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ra7 n GLY 351 N 1.48 0.52 3.52 2.72 0.00 -0.89 -4.68 105.19 107.86 1ra7 n GLY 351 Ca 0.24 -0.55 -0.34 0.00 0.00 0.00 0.00 46.02 45.37 1ra7 n GLY 351 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ra7 s LEU 352 N 0.00 3.14 -0.42 0.99 1.43 -0.40 -4.66 118.68 118.75 1ra7 s LEU 352 Ca 0.00 -0.11 -0.10 0.00 -1.03 0.00 0.00 54.13 52.89 1ra7 s LEU 352 Cb 0.00 -1.72 0.07 0.00 0.03 0.00 0.00 46.19 44.58 1ra7 s LEU 352 CO 0.00 0.26 0.27 -0.89 0.23 0.00 0.00 176.35 176.22 1ra7 s THR 353 N -0.18 4.39 -0.09 5.49 2.01 -1.26 -2.61 115.64 123.39 1ra7 s THR 353 Ca 0.02 -1.31 -0.01 0.00 0.31 0.00 0.00 61.69 60.70 1ra7 s THR 353 Cb -0.13 -3.66 -0.03 0.00 0.01 0.00 0.00 72.50 68.69 1ra7 s THR 353 CO 0.03 -0.50 -0.05 -0.04 -0.69 0.00 0.00 174.62 173.36 1ra7 s MET 354 N 1.46 2.99 0.19 4.92 -1.94 -1.26 -0.92 119.30 124.74 1ra7 s MET 354 Ca 0.03 -0.52 0.01 0.00 -1.71 0.00 0.00 55.69 53.49 1ra7 s MET 354 Cb -0.23 -2.69 -0.04 0.00 2.01 0.00 0.00 34.83 33.88 1ra7 s MET 354 CO 0.03 0.57 0.06 0.95 -0.01 0.00 0.00 175.02 176.62 1ra7 s THR 355 N -0.55 0.41 0.29 2.05 -4.23 0.31 -4.90 115.64 109.04 1ra7 s THR 355 Ca 0.08 -1.97 -0.27 0.00 -1.18 0.00 0.00 61.69 58.36 1ra7 s THR 355 Cb -0.12 -2.27 -0.15 0.00 1.34 0.00 0.00 72.50 71.30 1ra7 s THR 355 CO 0.02 -0.30 0.75 -2.65 -0.54 0.00 0.00 174.62 171.90 1ra7 n PRO 356 N -0.26 0.75 -1.73 3.99 -0.02 -1.26 -0.49 135.00 135.97 1ra7 n PRO 356 Ca -0.04 0.26 -0.42 0.00 -2.02 0.00 0.00 63.50 61.29 1ra7 n PRO 356 Cb 0.64 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.61 1ra7 n PRO 356 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ra7 n ALA 357 N -0.10 2.51 -3.45 3.55 0.00 -1.26 -3.25 120.51 118.51 1ra7 n ALA 357 Ca 0.13 0.38 -0.18 0.00 0.00 0.00 0.00 53.44 53.77 1ra7 n ALA 357 Cb 0.32 -2.46 0.08 0.00 0.00 0.00 0.00 19.45 17.38 1ra7 n ALA 357 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1ra7 n ASP 358 N 2.56 -2.56 -1.72 0.00 8.00 -1.26 -2.93 116.55 118.64 1ra7 n ASP 358 Ca 0.10 -0.67 -0.13 0.00 0.71 0.00 0.00 54.79 54.81 1ra7 n ASP 358 Cb 0.36 -4.94 -0.04 0.00 -0.02 0.00 0.00 41.12 36.48 1ra7 n ASP 358 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1ra7 n LYS 359 N -4.04 -1.58 -0.92 -1.24 5.02 -1.20 -4.93 118.16 109.27 1ra7 n LYS 359 Ca -0.26 0.71 -0.32 0.00 -2.02 0.00 0.00 58.31 56.42 1ra7 n LYS 359 Cb 0.66 -5.06 0.14 0.00 -0.02 0.00 0.00 35.03 30.76 1ra7 n LYS 359 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1ra7 s SER 360 N -2.06 3.34 0.07 4.39 0.01 -1.15 -4.92 113.70 113.38 1ra7 s SER 360 Ca 0.00 2.23 -0.12 0.00 1.31 0.00 0.00 55.95 59.37 1ra7 s SER 360 Cb 0.00 -2.57 -0.26 0.00 0.21 0.00 0.00 66.02 63.40 1ra7 s SER 360 CO 0.00 -2.83 1.14 0.00 0.41 0.00 0.00 173.24 171.97 1ra7 h ALA 361 N -1.40 0.07 -2.23 1.44 0.00 -1.92 -3.41 119.26 111.80 1ra7 h ALA 361 Ca -0.44 -0.77 -0.29 0.00 0.00 0.00 0.00 54.91 53.40 1ra7 h ALA 361 Cb 1.28 0.08 -0.15 0.00 0.00 0.00 0.00 17.79 19.00 1ra7 h ALA 361 CO 0.44 0.74 -0.70 0.95 0.00 0.00 0.00 179.25 180.68 1ra7 s THR 362 N -3.01 0.97 -0.40 0.00 -4.23 -1.26 -4.91 115.64 102.80 1ra7 s THR 362 Ca -0.08 -2.01 -0.29 0.00 -1.18 0.00 0.00 61.69 58.13 1ra7 s THR 362 Cb 0.06 -1.84 0.00 0.00 1.34 0.00 0.00 72.50 72.06 1ra7 s THR 362 CO 0.92 -0.74 1.48 -0.36 -0.54 0.00 0.00 174.62 175.38 1ra7 s PHE 363 N -3.46 2.29 0.39 3.99 0.08 -1.26 -4.84 117.98 115.17 1ra7 s PHE 363 Ca 0.16 0.66 0.08 0.00 0.12 0.00 0.00 56.93 57.95 1ra7 s PHE 363 Cb 0.04 -4.28 -0.05 0.00 -0.57 0.00 0.00 43.02 38.15 1ra7 s PHE 363 CO -0.00 -2.17 0.12 -1.21 -0.10 0.00 0.00 175.22 171.86 1ra7 s GLU 364 N 5.08 2.18 0.26 0.44 0.41 -1.26 -4.96 118.70 120.85 1ra7 s GLU 364 Ca 0.65 -1.82 -0.31 0.00 -0.41 0.00 0.00 54.97 53.08 1ra7 s GLU 364 Cb -0.15 -1.96 -0.12 0.00 -1.78 0.00 0.00 34.13 30.12 1ra7 s GLU 364 CO 0.33 -0.03 1.64 2.41 -0.49 0.00 0.00 175.26 179.12 1ra7 n THR 365 N -1.14 0.68 -3.36 3.63 -1.04 -1.26 -4.97 114.28 106.82 1ra7 n THR 365 Ca -0.02 -0.17 -0.38 0.00 -2.04 0.00 0.00 64.05 61.43 1ra7 n THR 365 Cb 0.64 -1.97 -0.07 0.00 -1.82 0.00 0.00 70.33 67.11 1ra7 n THR 365 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1ra7 s VAL 366 N 0.38 5.19 0.34 12.58 1.01 -1.26 -5.01 120.40 133.63 1ra7 s VAL 366 Ca 0.68 0.77 0.06 0.00 0.00 0.00 0.00 61.98 63.49 1ra7 s VAL 366 Cb -0.50 -3.76 -0.07 0.00 0.00 0.00 0.00 36.38 32.06 1ra7 s VAL 366 CO 0.43 0.25 0.00 0.42 0.00 0.00 0.00 175.10 176.21 1ra7 s THR 367 N 1.25 1.62 -0.90 3.92 -4.23 -1.26 -4.42 115.64 111.62 1ra7 s THR 367 Ca 0.21 -2.05 0.13 0.00 -1.18 0.00 0.00 61.69 58.80 1ra7 s THR 367 Cb -0.15 -2.76 0.12 0.00 1.34 0.00 0.00 72.50 71.05 1ra7 s THR 367 CO 0.08 -0.09 1.41 0.79 -0.54 0.00 0.00 174.62 176.28 1ra7 n TRP 368 N -0.76 0.14 -0.02 3.99 7.02 -1.26 -0.47 117.44 126.08 1ra7 n TRP 368 Ca -0.04 0.06 -0.17 0.00 -1.02 0.00 0.00 57.50 56.33 1ra7 n TRP 368 Cb 0.66 -0.59 -0.14 0.00 -2.42 0.00 0.00 31.31 28.82 1ra7 n TRP 368 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 1ra7 n GLU 369 N -1.63 0.71 0.00 -0.99 0.00 -1.26 -4.46 120.64 113.01 1ra7 n GLU 369 Ca 0.02 0.25 0.07 0.00 0.00 0.00 0.00 57.16 57.50 1ra7 n GLU 369 Cb 0.14 -1.70 0.03 0.00 0.00 0.00 0.00 31.44 29.91 1ra7 n GLU 369 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 1ra7 n ASN 370 N -3.30 1.85 -4.76 4.31 2.04 -0.92 -4.87 115.26 109.62 1ra7 n ASN 370 Ca -0.29 -1.42 -0.40 0.00 -0.44 0.00 0.00 54.58 52.03 1ra7 n ASN 370 Cb 1.05 0.21 -0.05 0.00 -2.53 0.00 0.00 39.78 38.45 1ra7 n ASN 370 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1ra7 s VAL 371 N -1.38 3.90 0.14 3.53 0.11 0.38 -4.87 120.40 122.20 1ra7 s VAL 371 Ca 0.14 1.87 0.06 0.00 -2.93 0.00 0.00 61.98 61.13 1ra7 s VAL 371 Cb 0.11 -4.18 -0.04 0.00 -1.53 0.00 0.00 36.38 30.75 1ra7 s VAL 371 CO 0.25 0.42 -0.14 0.42 -3.33 0.00 0.00 175.10 172.71 1ra7 s THR 372 N -1.22 1.42 -0.12 5.04 -4.23 -1.26 -4.13 115.64 111.14 1ra7 s THR 372 Ca 0.43 -1.81 -0.05 0.00 -1.18 0.00 0.00 61.69 59.08 1ra7 s THR 372 Cb -0.27 -1.64 0.06 0.00 1.34 0.00 0.00 72.50 71.99 1ra7 s THR 372 CO 0.34 -0.44 0.25 0.12 -0.54 0.00 0.00 174.62 174.35 1ra7 s PHE 373 N -2.27 -0.39 -1.36 3.99 5.36 -0.56 -4.82 117.98 117.93 1ra7 s PHE 373 Ca 0.12 0.91 -0.09 0.00 -0.96 0.00 0.00 56.93 56.91 1ra7 s PHE 373 Cb -0.04 -0.04 0.01 0.00 -0.34 0.00 0.00 43.02 42.61 1ra7 s PHE 373 CO 0.04 -0.33 1.17 1.28 -1.46 0.00 0.00 175.22 175.92 1ra7 n LEU 374 N 5.14 -3.40 0.00 6.12 4.77 -1.26 -1.82 117.00 126.55 1ra7 n LEU 374 Ca -0.10 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.33 1ra7 n LEU 374 Cb 0.50 -3.02 0.00 0.00 -2.33 0.00 0.00 43.42 38.57 1ra7 n LEU 374 CO 0.05 0.64 0.00 0.29 -1.33 0.00 0.00 177.39 177.04 1ra7 n LYS 375 N -4.98 0.00 -3.64 3.23 5.02 -1.26 -4.97 118.16 111.56 1ra7 n LYS 375 Ca 0.00 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.92 1ra7 n LYS 375 Cb 0.56 -3.37 -0.06 0.00 -0.02 0.00 0.00 35.03 32.14 1ra7 n LYS 375 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1ra7 s ARG 376 N -0.28 3.76 0.81 1.97 0.52 -0.76 -4.28 118.95 120.70 1ra7 s ARG 376 Ca 0.00 0.20 -0.06 0.00 -0.52 0.00 0.00 55.73 55.35 1ra7 s ARG 376 Cb 0.00 -3.22 0.16 0.00 0.52 0.00 0.00 34.95 32.41 1ra7 s ARG 376 CO 0.00 0.70 1.12 -0.06 0.02 0.00 0.00 175.30 177.08 1ra7 s PHE 377 N -0.98 1.50 -0.15 -0.53 0.40 0.12 -1.49 117.98 116.85 1ra7 s PHE 377 Ca 0.20 -0.10 0.02 0.00 -0.60 0.00 0.00 56.93 56.45 1ra7 s PHE 377 Cb -0.15 -3.40 0.01 0.00 0.51 0.00 0.00 43.02 40.00 1ra7 s PHE 377 CO 0.09 -2.09 -0.20 -0.06 0.70 0.00 0.00 175.22 173.66 1ra7 s PHE 378 N -3.42 2.56 -0.10 0.36 0.40 -1.26 -0.73 117.98 115.78 1ra7 s PHE 378 Ca 0.70 -1.35 -0.03 0.00 -0.60 0.00 0.00 56.93 55.65 1ra7 s PHE 378 Cb -0.04 -1.77 0.04 0.00 0.51 0.00 0.00 43.02 41.76 1ra7 s PHE 378 CO 0.48 -0.65 0.05 1.03 0.70 0.00 0.00 175.22 176.83 1ra7 s ARG 379 N 1.01 0.22 0.34 0.44 1.81 -0.81 -4.77 118.95 117.19 1ra7 s ARG 379 Ca -0.03 0.09 -0.29 0.00 -1.72 0.00 0.00 55.73 53.78 1ra7 s ARG 379 Cb -0.15 -1.16 -0.11 0.00 -0.45 0.00 0.00 34.95 33.08 1ra7 s ARG 379 CO -0.05 -0.45 1.48 0.00 -0.68 0.00 0.00 175.30 175.60 1ra7 s ALA 380 N 2.07 3.61 0.15 2.13 0.00 -1.26 -0.15 121.76 128.31 1ra7 s ALA 380 Ca 0.03 1.51 -0.31 0.00 0.00 0.00 0.00 51.96 53.19 1ra7 s ALA 380 Cb -0.14 -3.60 -0.09 0.00 0.00 0.00 0.00 23.12 19.29 1ra7 s ALA 380 CO -0.06 -0.96 1.54 0.34 0.00 0.00 0.00 175.76 176.62 1ra7 s ASP 381 N -0.01 6.64 0.31 0.00 2.15 -0.24 -4.85 116.67 120.67 1ra7 s ASP 381 Ca 0.55 2.55 0.06 0.00 0.43 0.00 0.00 52.55 56.14 1ra7 s ASP 381 Cb -0.45 -2.59 0.75 0.00 -0.30 0.00 0.00 42.92 40.33 1ra7 s ASP 381 CO 0.57 -0.79 1.78 -0.33 -0.17 0.00 0.00 175.17 176.22 1ra7 h GLU 382 N 6.90 0.73 0.00 4.34 5.08 -1.91 -1.48 114.58 128.25 1ra7 h GLU 382 Ca -0.42 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 57.82 1ra7 h GLU 382 Cb 1.20 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 1ra7 h GLU 382 CO 0.91 0.48 -0.40 0.87 -1.00 0.00 0.00 179.01 179.87 1ra7 h LYS 383 N 0.75 0.00 -3.04 2.33 1.57 -1.99 -3.41 116.57 112.79 1ra7 h LYS 383 Ca 0.57 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.74 1ra7 h LYS 383 Cb 0.91 0.00 -0.42 0.00 0.08 0.00 0.00 32.23 32.80 1ra7 h LYS 383 CO -0.37 1.00 -0.59 0.66 -0.57 0.00 0.00 179.45 179.58 1ra7 n TYR 384 N -4.55 3.14 -0.11 -1.35 4.02 -1.15 -4.98 117.16 112.17 1ra7 n TYR 384 Ca -0.17 -4.28 0.24 0.00 -0.01 0.00 0.00 57.90 53.68 1ra7 n TYR 384 Cb 0.54 -0.60 0.45 0.00 -0.02 0.00 0.00 39.34 39.72 1ra7 n TYR 384 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1ra7 h PRO 385 N 5.36 0.00 0.00 -0.72 0.11 -1.52 -0.71 132.00 134.52 1ra7 h PRO 385 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1ra7 h PRO 385 Cb 0.75 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.86 1ra7 h PRO 385 CO 0.71 0.00 0.00 1.97 -0.21 0.00 0.00 178.00 180.47 1ra7 n PHE 386 N -3.24 0.00 -3.67 0.65 1.16 -1.26 -4.32 117.46 106.78 1ra7 n PHE 386 Ca 0.19 0.00 -0.37 0.00 -1.87 0.00 0.00 57.45 55.40 1ra7 n PHE 386 Cb 1.33 -0.41 -0.10 0.00 -1.61 0.00 0.00 39.48 38.70 1ra7 n PHE 386 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1ra7 s LEU 387 N -2.82 4.05 -0.18 5.98 1.43 -0.27 -4.92 118.68 121.95 1ra7 s LEU 387 Ca 0.19 0.07 -0.08 0.00 -1.03 0.00 0.00 54.13 53.28 1ra7 s LEU 387 Cb 0.18 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 1ra7 s LEU 387 CO 0.47 0.04 0.10 -0.63 0.23 0.00 0.00 176.35 176.57 1ra7 s ILE 388 N 1.18 5.13 -0.15 -0.59 -1.09 -1.26 -1.08 121.20 123.35 1ra7 s ILE 388 Ca 0.07 0.09 -0.23 0.00 -2.23 0.00 0.00 60.65 58.35 1ra7 s ILE 388 Cb -0.14 -3.31 -0.03 0.00 -1.58 0.00 0.00 42.46 37.40 1ra7 s ILE 388 CO 0.05 0.48 0.70 -1.00 -1.23 0.00 0.00 174.94 173.95 1ra7 s HIS 389 N 0.12 3.45 -0.21 3.97 3.76 0.79 -4.23 115.29 122.94 1ra7 s HIS 389 Ca 0.07 1.11 -0.26 0.00 -0.15 0.00 0.00 55.06 55.84 1ra7 s HIS 389 Cb -0.12 -2.85 -0.00 0.00 1.11 0.00 0.00 32.58 30.72 1ra7 s HIS 389 CO -0.00 -0.10 0.88 -1.25 -0.85 0.00 0.00 174.74 173.42 1ra7 s PRO 390 N 1.59 4.24 -0.41 8.40 0.04 -1.26 -1.93 135.00 145.66 1ra7 s PRO 390 Ca 0.34 1.07 -0.05 0.00 0.04 0.00 0.00 61.00 62.39 1ra7 s PRO 390 Cb -0.17 -3.62 0.10 0.00 0.04 0.00 0.00 34.50 30.85 1ra7 s PRO 390 CO 0.13 -0.48 0.22 0.08 0.04 0.00 0.00 177.00 176.99 1ra7 s VAL 391 N 2.70 3.62 -0.08 -0.36 1.01 0.09 -4.80 120.40 122.57 1ra7 s VAL 391 Ca 0.38 -1.82 -0.30 0.00 0.00 0.00 0.00 61.98 60.25 1ra7 s VAL 391 Cb -0.16 -3.37 -0.02 0.00 0.00 0.00 0.00 36.38 32.83 1ra7 s VAL 391 CO 0.09 -0.62 1.09 -0.32 0.00 0.00 0.00 175.10 175.34 1ra7 s MET 392 N 1.25 4.39 0.42 2.72 0.00 -1.26 -0.70 119.30 126.12 1ra7 s MET 392 Ca 0.05 1.52 -0.25 0.00 0.00 0.00 0.00 55.69 57.01 1ra7 s MET 392 Cb -0.23 -3.54 -0.10 0.00 0.00 0.00 0.00 34.83 30.95 1ra7 s MET 392 CO -0.02 -0.37 1.17 -2.30 0.00 0.00 0.00 175.02 173.51 1ra7 n PRO 393 N 5.05 1.71 0.25 4.11 -0.02 -1.26 -4.86 135.00 139.97 1ra7 n PRO 393 Ca 0.10 0.61 0.10 0.00 -2.02 0.00 0.00 63.50 62.29 1ra7 n PRO 393 Cb 0.48 -2.25 0.65 0.00 -0.02 0.00 0.00 33.50 32.35 1ra7 n PRO 393 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 1ra7 h MET 394 N 1.89 0.00 -0.77 -0.52 2.86 -1.96 -2.67 114.93 113.76 1ra7 h MET 394 Ca -0.46 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.24 1ra7 h MET 394 Cb 1.31 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.91 1ra7 h MET 394 CO 0.59 0.16 0.45 -0.22 1.06 0.00 0.00 176.91 178.94 1ra7 h LYS 395 N 0.00 0.78 -0.56 1.72 3.64 -1.98 0.23 116.57 120.41 1ra7 h LYS 395 Ca -0.00 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 1ra7 h LYS 395 Cb 0.38 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 1ra7 h LYS 395 CO 0.02 0.52 0.21 0.93 -2.27 0.00 0.00 179.45 178.86 1ra7 h GLU 396 N 0.80 0.84 -0.55 1.90 4.39 -1.85 -0.19 114.58 119.93 1ra7 h GLU 396 Ca 0.35 -0.16 -0.08 0.00 0.34 0.00 0.00 59.36 59.81 1ra7 h GLU 396 Cb 0.22 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 1ra7 h GLU 396 CO -0.19 0.74 0.03 0.82 -1.16 0.00 0.00 179.01 179.25 1ra7 h ILE 397 N 0.77 1.26 -0.20 3.13 2.04 -1.39 -2.14 117.51 120.98 1ra7 h ILE 397 Ca 0.18 -1.06 -0.01 0.00 1.00 0.00 0.00 64.86 64.98 1ra7 h ILE 397 Cb 0.22 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1ra7 h ILE 397 CO -0.01 0.38 0.08 0.45 0.00 0.00 0.00 178.15 179.05 1ra7 h HIS 398 N 0.83 0.31 -0.42 1.37 3.86 -0.24 -0.84 115.15 120.02 1ra7 h HIS 398 Ca 0.16 -0.02 0.07 0.00 -1.16 0.00 0.00 60.37 59.41 1ra7 h HIS 398 Cb 0.49 -0.09 -0.06 0.00 1.06 0.00 0.00 27.41 28.81 1ra7 h HIS 398 CO 0.04 0.35 0.08 0.93 0.86 0.00 0.00 177.93 180.19 1ra7 h GLU 399 N 0.18 0.20 -0.31 2.45 4.39 -0.92 -2.81 114.58 117.77 1ra7 h GLU 399 Ca 0.07 -0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.72 1ra7 h GLU 399 Cb 0.17 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1ra7 h GLU 399 CO -0.01 0.14 0.04 1.03 -1.16 0.00 0.00 179.01 179.05 1ra7 h SER 400 N 0.21 0.50 0.40 1.42 0.87 -1.14 -3.05 113.55 112.76 1ra7 h SER 400 Ca 0.20 -0.27 -0.01 0.00 -1.23 0.00 0.00 61.79 60.48 1ra7 h SER 400 Cb 0.25 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1ra7 h SER 400 CO -0.27 0.64 -0.05 -0.29 -0.53 0.00 0.00 176.83 176.34 1ra7 h ILE 401 N 0.33 0.24 0.00 2.23 2.10 -0.99 -2.77 117.51 118.66 1ra7 h ILE 401 Ca 0.09 -0.34 0.00 0.00 1.08 0.00 0.00 64.86 65.69 1ra7 h ILE 401 Cb 0.36 1.26 0.00 0.00 -1.09 0.00 0.00 36.82 37.35 1ra7 h ILE 401 CO 0.01 0.05 0.00 0.54 -1.08 0.00 0.00 178.15 177.66 1ra7 n ARG 402 N -3.33 0.48 -4.14 2.19 1.74 -1.08 -4.54 116.66 107.99 1ra7 n ARG 402 Ca -0.02 0.03 -0.09 0.00 -0.77 0.00 0.00 57.85 57.00 1ra7 n ARG 402 Cb 0.20 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.04 1ra7 n ARG 402 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1ra7 s TRP 403 N -2.13 0.79 0.07 -1.55 0.52 -1.05 -2.28 118.94 113.32 1ra7 s TRP 403 Ca 0.24 -1.12 -0.10 0.00 0.02 0.00 0.00 56.10 55.14 1ra7 s TRP 403 Cb 0.12 -0.48 0.01 0.00 -1.15 0.00 0.00 33.47 31.97 1ra7 s TRP 403 CO 0.22 -0.40 0.22 -0.08 0.02 0.00 0.00 176.95 176.93 1ra7 s THR 404 N -3.92 0.12 -0.05 2.01 -1.32 -0.51 -4.70 115.64 107.27 1ra7 s THR 404 Ca 0.17 -0.95 0.00 0.00 -1.21 0.00 0.00 61.69 59.70 1ra7 s THR 404 Cb 0.07 -1.11 -0.03 0.00 -1.51 0.00 0.00 72.50 69.93 1ra7 s THR 404 CO -0.03 -0.53 -0.04 0.29 -2.21 0.00 0.00 174.62 172.10 1ra7 n LYS 405 N 0.31 0.11 -3.73 7.08 5.02 -1.26 -1.22 118.16 124.48 1ra7 n LYS 405 Ca -0.17 0.03 -0.23 0.00 -2.02 0.00 0.00 58.31 55.91 1ra7 n LYS 405 Cb 0.61 -1.04 -0.17 0.00 -0.02 0.00 0.00 35.03 34.40 1ra7 n LYS 405 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ra7 s ASP 406 N -4.56 1.81 0.64 4.39 -1.08 -1.26 -4.85 116.67 111.75 1ra7 s ASP 406 Ca -0.06 -0.23 0.36 0.00 -0.52 0.00 0.00 52.55 52.09 1ra7 s ASP 406 Cb 0.02 -0.39 2.03 0.00 -1.46 0.00 0.00 42.92 43.12 1ra7 s ASP 406 CO 0.10 -0.24 2.22 -0.65 0.52 0.00 0.00 175.17 177.13 1ra7 h PRO 407 N 8.35 0.00 0.00 4.34 0.11 -1.99 -0.30 132.00 142.51 1ra7 h PRO 407 Ca -0.17 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.92 1ra7 h PRO 407 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 1ra7 h PRO 407 CO 0.25 0.00 -0.10 0.00 -0.21 0.00 0.00 178.00 177.95 1ra7 h ARG 408 N 0.00 0.00 -0.63 1.05 3.08 -2.04 -2.87 114.38 112.97 1ra7 h ARG 408 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1ra7 h ARG 408 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1ra7 h ARG 408 CO -0.00 0.10 0.00 0.09 -1.07 0.00 0.00 179.97 179.09 1ra7 n ASN 409 N -3.24 4.51 -0.27 7.04 3.02 -0.12 -4.50 115.26 121.70 1ra7 n ASN 409 Ca 0.00 -2.38 -0.05 0.00 -0.03 0.00 0.00 54.58 52.12 1ra7 n ASN 409 Cb 0.36 -0.54 0.06 0.00 -0.61 0.00 0.00 39.78 39.04 1ra7 n ASN 409 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1ra7 h THR 410 N 3.90 1.21 0.13 3.41 2.02 -1.57 0.12 112.91 122.12 1ra7 h THR 410 Ca 0.00 -0.45 -0.00 0.00 0.77 0.00 0.00 66.41 66.72 1ra7 h THR 410 Cb 1.35 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1ra7 h THR 410 CO 0.18 0.22 -0.08 -0.61 0.37 0.00 0.00 175.52 175.60 1ra7 h GLN 411 N 1.02 -0.19 -0.36 6.66 5.75 -1.83 -0.83 115.11 125.33 1ra7 h GLN 411 Ca 0.27 0.01 -0.07 0.00 -0.15 0.00 0.00 58.65 58.71 1ra7 h GLN 411 Cb -0.04 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 1ra7 h GLN 411 CO -0.05 -0.13 -0.06 -0.44 -2.65 0.00 0.00 178.83 175.50 1ra7 h ASP 412 N -0.20 0.68 -0.01 -0.69 3.32 -1.82 0.04 116.42 117.74 1ra7 h ASP 412 Ca -0.01 -0.35 0.02 0.00 0.02 0.00 0.00 57.03 56.71 1ra7 h ASP 412 Cb 0.17 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1ra7 h ASP 412 CO 0.01 0.87 -0.10 -0.74 -1.72 0.00 0.00 179.24 177.56 1ra7 h HIS 413 N 0.48 -0.25 -0.45 4.55 2.76 -0.70 0.15 115.15 121.68 1ra7 h HIS 413 Ca 0.10 0.01 -0.12 0.00 -2.20 0.00 0.00 60.37 58.15 1ra7 h HIS 413 Cb 0.55 0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.61 1ra7 h HIS 413 CO 0.05 -0.15 -0.21 0.28 -1.30 0.00 0.00 177.93 176.59 1ra7 h VAL 414 N -0.17 1.27 -0.38 5.26 2.07 -1.12 -1.98 116.25 121.21 1ra7 h VAL 414 Ca 0.04 -1.36 -0.00 0.00 0.82 0.00 0.00 66.70 66.20 1ra7 h VAL 414 Cb 0.22 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1ra7 h VAL 414 CO -0.11 0.46 0.22 -0.09 0.02 0.00 0.00 177.57 178.08 1ra7 h ARG 415 N 0.79 0.52 -0.65 1.57 9.65 -0.75 -1.41 114.38 124.10 1ra7 h ARG 415 Ca 0.11 -0.05 0.07 0.00 -1.10 0.00 0.00 59.98 59.01 1ra7 h ARG 415 Cb 0.76 -0.11 -0.06 0.00 -1.39 0.00 0.00 29.97 29.18 1ra7 h ARG 415 CO 0.06 0.40 0.34 0.77 2.80 0.00 0.00 179.97 184.34 1ra7 h SER 416 N 0.49 0.47 -0.20 -3.80 0.02 -0.45 -0.49 113.55 109.57 1ra7 h SER 416 Ca 0.13 0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 61.07 1ra7 h SER 416 Cb 0.02 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 1ra7 h SER 416 CO -0.02 0.29 -0.04 -0.07 -1.14 0.00 0.00 176.83 175.85 1ra7 h LEU 417 N 0.61 0.50 -0.86 5.07 3.38 -0.99 -2.07 115.31 120.94 1ra7 h LEU 417 Ca 0.31 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 1ra7 h LEU 417 Cb 0.25 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1ra7 h LEU 417 CO -0.22 0.60 0.28 0.00 0.09 0.00 0.00 178.44 179.19 1ra7 h LEU 419 N 1.09 0.00 0.07 0.00 3.38 -0.57 -2.43 115.31 116.85 1ra7 h LEU 419 Ca 0.25 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.92 1ra7 h LEU 419 Cb 0.24 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1ra7 h LEU 419 CO -0.02 0.05 -1.62 -0.07 0.09 0.00 0.00 178.44 176.88 1ra7 h LEU 420 N 0.00 0.24 -0.45 1.67 3.38 -1.07 -3.42 115.31 115.67 1ra7 h LEU 420 Ca -0.00 -0.75 0.02 0.00 0.09 0.00 0.00 57.88 57.23 1ra7 h LEU 420 Cb 0.19 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1ra7 h LEU 420 CO 0.01 1.68 0.27 0.00 0.09 0.00 0.00 178.44 180.48 1ra7 h ALA 421 N -0.18 0.57 -0.34 1.53 0.00 0.03 -3.24 119.26 117.62 1ra7 h ALA 421 Ca -0.38 -0.01 0.10 0.00 0.00 0.00 0.00 54.91 54.62 1ra7 h ALA 421 Cb 1.70 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 1ra7 h ALA 421 CO -0.04 -0.05 0.42 0.11 0.00 0.00 0.00 179.25 179.69 1ra7 h TRP 422 N 0.54 0.00 0.00 0.00 5.08 -1.69 -0.07 115.95 119.81 1ra7 h TRP 422 Ca 0.18 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.15 1ra7 h TRP 422 Cb 0.01 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.17 1ra7 h TRP 422 CO -0.07 0.00 0.00 0.72 -1.28 0.00 0.00 178.44 177.81 1ra7 n HIS 423 N -3.60 0.48 1.99 0.12 8.25 -1.22 -1.76 115.22 119.49 1ra7 n HIS 423 Ca 0.06 0.21 0.14 0.00 -0.26 0.00 0.00 57.72 57.87 1ra7 n HIS 423 Cb 0.58 -0.84 0.85 0.00 1.12 0.00 0.00 29.99 31.69 1ra7 n HIS 423 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1ra7 n ASN 424 N -1.96 0.02 0.00 0.41 3.02 -0.04 -4.86 115.26 111.84 1ra7 n ASN 424 Ca 0.01 -1.11 0.00 0.00 -0.03 0.00 0.00 54.58 53.45 1ra7 n ASN 424 Cb 0.13 -0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 1ra7 n ASN 424 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ra7 n GLY 425 N 0.95 2.75 0.27 7.41 0.00 -0.72 -4.60 105.19 111.25 1ra7 n GLY 425 Ca 0.21 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.50 1ra7 n GLY 425 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ra7 h GLU 426 N 0.00 0.65 0.59 1.61 4.81 -1.94 -0.60 114.58 119.71 1ra7 h GLU 426 Ca 0.00 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 1ra7 h GLU 426 Cb 0.00 -0.15 0.01 0.00 0.63 0.00 0.00 28.75 29.24 1ra7 h GLU 426 CO 0.00 0.43 -0.28 1.49 -0.73 0.00 0.00 179.01 179.92 1ra7 h GLU 427 N 0.67 -0.77 -0.83 1.92 4.81 -1.96 -1.12 114.58 117.31 1ra7 h GLU 427 Ca 0.33 0.05 0.08 0.00 -0.13 0.00 0.00 59.36 59.70 1ra7 h GLU 427 Cb 0.28 0.17 -0.07 0.00 0.63 0.00 0.00 28.75 29.76 1ra7 h GLU 427 CO -0.22 -0.51 0.49 0.93 -0.73 0.00 0.00 179.01 178.97 1ra7 h GLU 428 N -0.81 0.82 -0.66 1.92 4.39 -1.77 -1.97 114.58 116.50 1ra7 h GLU 428 Ca -0.08 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.54 1ra7 h GLU 428 Cb 0.61 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 29.05 1ra7 h GLU 428 CO 0.13 0.54 0.28 -0.92 -1.16 0.00 0.00 179.01 177.88 1ra7 h TYR 429 N 0.84 0.99 -0.13 4.33 3.20 -0.88 -1.57 116.97 123.76 1ra7 h TYR 429 Ca 0.39 -0.07 -0.11 0.00 3.14 0.00 0.00 58.73 62.08 1ra7 h TYR 429 Cb 0.31 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 1ra7 h TYR 429 CO -0.05 0.77 -0.43 -0.91 -1.64 0.00 0.00 178.16 175.90 1ra7 h ASN 430 N 0.93 0.31 -0.32 -2.11 2.35 -0.69 -0.18 115.58 115.86 1ra7 h ASN 430 Ca 0.22 -0.13 -0.07 0.00 -0.55 0.00 0.00 56.30 55.77 1ra7 h ASN 430 Cb 0.18 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 1ra7 h ASN 430 CO -0.02 0.70 -0.03 0.11 -1.65 0.00 0.00 177.43 176.54 1ra7 h LYS 431 N 0.24 0.70 -0.27 0.81 1.57 -1.08 0.34 116.57 118.88 1ra7 h LYS 431 Ca 0.02 -0.19 -0.08 0.00 -1.87 0.00 0.00 60.65 58.53 1ra7 h LYS 431 Cb 0.85 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 1ra7 h LYS 431 CO 0.07 0.73 -0.14 0.35 -0.57 0.00 0.00 179.45 179.89 1ra7 h PHE 432 N 0.65 0.66 -0.63 -1.35 3.57 -0.76 -1.70 116.94 117.39 1ra7 h PHE 432 Ca 0.13 -0.17 -0.06 0.00 3.53 0.00 0.00 57.97 61.39 1ra7 h PHE 432 Cb 0.45 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 1ra7 h PHE 432 CO 0.02 0.83 0.13 -0.07 -2.23 0.00 0.00 178.31 176.99 1ra7 h LEU 433 N 0.31 0.94 -0.15 0.59 3.38 -0.76 -2.02 115.31 117.60 1ra7 h LEU 433 Ca 0.06 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1ra7 h LEU 433 Cb 0.66 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1ra7 h LEU 433 CO 0.04 0.92 0.07 0.00 0.09 0.00 0.00 178.44 179.56 1ra7 h ALA 434 N 1.20 0.19 -0.73 1.53 0.00 -0.80 -0.13 119.26 120.53 1ra7 h ALA 434 Ca 0.20 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1ra7 h ALA 434 Cb 0.36 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1ra7 h ALA 434 CO 0.00 -0.25 0.35 0.87 0.00 0.00 0.00 179.25 180.23 1ra7 h LYS 435 N 0.11 1.04 -0.73 0.00 1.57 -1.19 -1.77 116.57 115.60 1ra7 h LYS 435 Ca 0.05 -0.14 -0.04 0.00 -1.87 0.00 0.00 60.65 58.65 1ra7 h LYS 435 Cb 0.12 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 1ra7 h LYS 435 CO -0.01 0.80 0.29 0.82 -0.57 0.00 0.00 179.45 180.78 1ra7 h ILE 436 N 1.03 1.25 -0.19 1.86 2.04 -0.94 -2.05 117.51 120.51 1ra7 h ILE 436 Ca 0.25 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.33 1ra7 h ILE 436 Cb 0.10 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.56 1ra7 h ILE 436 CO -0.03 0.32 0.00 0.54 0.00 0.00 0.00 178.15 178.98 1ra7 n ARG 437 N -4.29 1.47 -0.01 2.37 1.74 -0.10 -3.59 116.66 114.25 1ra7 n ARG 437 Ca 0.07 -0.69 0.14 0.00 -0.77 0.00 0.00 57.85 56.60 1ra7 n ARG 437 Cb 0.18 -1.18 0.60 0.00 -1.02 0.00 0.00 32.46 31.04 1ra7 n ARG 437 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1ra7 n SER 438 N 0.06 1.12 -4.08 0.55 3.41 -0.76 -4.56 113.62 109.35 1ra7 n SER 438 Ca 0.06 -1.42 -0.10 0.00 -0.26 0.00 0.00 58.87 57.16 1ra7 n SER 438 Cb 0.18 -0.02 -0.11 0.00 -0.26 0.00 0.00 64.21 64.01 1ra7 n SER 438 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1ra7 s VAL 439 N -1.97 0.40 0.18 -3.33 -7.23 -1.24 -5.08 120.40 102.14 1ra7 s VAL 439 Ca 0.39 -1.51 -0.18 0.00 -1.81 0.00 0.00 61.98 58.88 1ra7 s VAL 439 Cb 0.20 -1.11 0.14 0.00 0.56 0.00 0.00 36.38 36.17 1ra7 s VAL 439 CO 0.33 -0.73 1.62 -0.65 -0.31 0.00 0.00 175.10 175.36 1ra7 h PRO 440 N 3.69 -0.09 -0.59 4.82 0.11 -1.89 -2.49 132.00 135.57 1ra7 h PRO 440 Ca -0.34 0.01 0.10 0.00 0.11 0.00 0.00 66.00 65.87 1ra7 h PRO 440 Cb 1.17 0.02 -0.08 0.00 0.11 0.00 0.00 31.00 32.23 1ra7 h PRO 440 CO 0.55 -0.06 0.18 0.82 -0.21 0.00 0.00 178.00 179.28 1ra7 h ILE 441 N -0.10 0.72 -0.04 4.15 1.08 -1.94 -2.44 117.51 118.94 1ra7 h ILE 441 Ca 0.23 -0.11 -0.00 0.00 -0.39 0.00 0.00 64.86 64.59 1ra7 h ILE 441 Cb 0.46 0.36 -0.00 0.00 -3.07 0.00 0.00 36.82 34.56 1ra7 h ILE 441 CO -0.56 0.06 0.02 1.23 -0.69 0.00 0.00 178.15 178.21 1ra7 h GLY 442 N 0.33 0.07 1.20 5.37 0.00 -1.53 -2.72 103.07 105.79 1ra7 h GLY 442 Ca 0.30 -0.03 0.06 0.00 0.00 0.00 0.00 47.33 47.66 1ra7 h GLY 442 CO -0.34 0.03 0.34 3.21 0.00 0.00 0.00 176.54 179.78 1ra7 h ARG 443 N -0.06 0.00 -0.00 4.80 3.08 -1.02 0.30 114.38 121.49 1ra7 h ARG 443 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1ra7 h ARG 443 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1ra7 h ARG 443 CO -0.00 0.00 -0.46 0.00 -1.07 0.00 0.00 179.97 178.44 1ra7 n ALA 444 N -2.18 3.48 -1.81 0.04 0.00 -1.00 -4.93 120.51 114.11 1ra7 n ALA 444 Ca 0.03 -0.37 -0.33 0.00 0.00 0.00 0.00 53.44 52.76 1ra7 n ALA 444 Cb 0.46 -1.11 -0.06 0.00 0.00 0.00 0.00 19.45 18.74 1ra7 n ALA 444 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ra7 s LEU 445 N -2.88 3.89 -0.72 0.00 1.43 0.09 -5.01 118.68 115.49 1ra7 s LEU 445 Ca 0.14 1.76 -0.18 0.00 -1.03 0.00 0.00 54.13 54.83 1ra7 s LEU 445 Cb 0.18 -4.55 0.13 0.00 0.03 0.00 0.00 46.19 41.99 1ra7 s LEU 445 CO 0.66 -0.52 0.82 -0.62 0.23 0.00 0.00 176.35 176.92 1ra7 s ASP 446 N -2.16 6.41 -0.09 2.29 -1.08 -1.26 -5.03 116.67 115.75 1ra7 s ASP 446 Ca 0.64 -1.84 0.02 0.00 -0.52 0.00 0.00 52.55 50.84 1ra7 s ASP 446 Cb -0.12 -2.30 -0.02 0.00 -1.46 0.00 0.00 42.92 39.02 1ra7 s ASP 446 CO 0.16 -0.99 -0.12 -0.76 0.52 0.00 0.00 175.17 173.98 1ra7 s LEU 447 N 2.15 2.80 0.26 -1.34 1.43 -1.26 -4.93 118.68 117.79 1ra7 s LEU 447 Ca 0.18 -0.22 -0.29 0.00 -1.03 0.00 0.00 54.13 52.76 1ra7 s LEU 447 Cb -0.17 -1.60 -0.09 0.00 0.03 0.00 0.00 46.19 44.36 1ra7 s LEU 447 CO -0.01 0.27 1.19 -2.16 0.23 0.00 0.00 176.35 175.88 1ra7 s PRO 448 N -0.30 4.52 0.60 1.29 0.04 -1.26 -5.03 135.00 134.85 1ra7 s PRO 448 Ca 0.03 1.93 -0.10 0.00 0.04 0.00 0.00 61.00 62.90 1ra7 s PRO 448 Cb -0.13 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.20 1ra7 s PRO 448 CO 0.03 0.01 0.98 -1.21 0.04 0.00 0.00 177.00 176.85 1ra7 s GLU 449 N -1.08 3.54 0.06 4.56 0.41 -1.26 -4.93 118.70 119.99 1ra7 s GLU 449 Ca 0.49 0.61 -0.20 0.00 -0.41 0.00 0.00 54.97 55.46 1ra7 s GLU 449 Cb -0.34 -2.14 -0.09 0.00 -1.78 0.00 0.00 34.13 29.79 1ra7 s GLU 449 CO 0.42 -0.53 1.31 -0.92 -0.49 0.00 0.00 175.26 175.06 1ra7 h TYR 450 N -0.23 -0.85 -0.95 1.61 3.20 -1.96 -2.53 116.97 115.26 1ra7 h TYR 450 Ca -0.45 0.02 0.29 0.00 3.14 0.00 0.00 58.73 61.74 1ra7 h TYR 450 Cb 1.20 0.35 -0.15 0.00 1.54 0.00 0.00 36.73 39.67 1ra7 h TYR 450 CO 0.63 -0.35 0.37 0.66 -1.64 0.00 0.00 178.16 177.84 1ra7 h SER 451 N -0.46 0.17 -0.61 -2.11 4.64 -1.99 0.35 113.55 113.54 1ra7 h SER 451 Ca -0.01 0.21 -0.02 0.00 -0.47 0.00 0.00 61.79 61.50 1ra7 h SER 451 Cb 0.44 0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.75 1ra7 h SER 451 CO -0.13 -0.20 0.31 0.74 -0.87 0.00 0.00 176.83 176.67 1ra7 h THR 452 N 0.20 1.21 -0.19 2.95 2.02 -1.87 -1.43 112.91 115.80 1ra7 h THR 452 Ca 0.66 -0.57 -0.06 0.00 0.77 0.00 0.00 66.41 67.21 1ra7 h THR 452 Cb 1.47 0.46 -0.00 0.00 -1.74 0.00 0.00 68.15 68.34 1ra7 h THR 452 CO -0.68 0.24 -0.12 -0.07 0.37 0.00 0.00 175.52 175.26 1ra7 h LEU 453 N 0.83 0.44 0.10 2.58 3.38 0.01 -2.57 115.31 120.08 1ra7 h LEU 453 Ca 0.21 -0.43 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1ra7 h LEU 453 Cb 0.10 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1ra7 h LEU 453 CO -0.03 0.77 -0.05 0.22 0.09 0.00 0.00 178.44 179.44 1ra7 h TYR 454 N 0.11 -0.13 -0.76 1.13 3.20 -1.01 0.41 116.97 119.91 1ra7 h TYR 454 Ca 0.04 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1ra7 h TYR 454 Cb 0.62 0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.89 1ra7 h TYR 454 CO 0.07 -0.08 0.42 -0.44 -1.64 0.00 0.00 178.16 176.49 1ra7 h ASP 455 N -0.14 0.95 -0.70 -2.11 3.32 -1.34 0.49 116.42 116.90 1ra7 h ASP 455 Ca -0.01 -0.10 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 1ra7 h ASP 455 Cb 0.11 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 1ra7 h ASP 455 CO 0.02 0.78 0.31 -0.09 -1.72 0.00 0.00 179.24 178.54 1ra7 h ARG 456 N 1.06 1.02 0.39 3.56 2.43 -1.28 -1.98 114.38 119.58 1ra7 h ARG 456 Ca 0.27 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 1ra7 h ARG 456 Cb 0.03 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 1ra7 h ARG 456 CO -0.04 0.82 -0.19 2.35 -1.51 0.00 0.00 179.97 181.40 1ra7 h TRP 457 N 0.98 -0.48 -0.77 2.20 7.01 -0.23 -1.96 115.95 122.70 1ra7 h TRP 457 Ca 0.24 -0.01 0.17 0.00 2.11 0.00 0.00 58.89 61.39 1ra7 h TRP 457 Cb 0.16 0.16 -0.11 0.00 -2.10 0.00 0.00 29.16 27.27 1ra7 h TRP 457 CO 0.01 -0.28 0.22 -0.07 -2.79 0.00 0.00 178.44 175.53 1ra7 h LEU 458 N -0.56 0.08 -0.71 0.65 3.38 -0.72 -0.29 115.31 117.14 1ra7 h LEU 458 Ca -0.05 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1ra7 h LEU 458 Cb 0.42 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1ra7 h LEU 458 CO 0.09 -0.02 0.00 0.44 0.09 0.00 0.00 178.44 179.03 1ra7 h ASP 459 N 0.30 0.00 1.26 -0.43 5.19 -1.11 -3.30 116.42 118.34 1ra7 h ASP 459 Ca 0.44 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.85 1ra7 h ASP 459 Cb 0.77 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.28 1ra7 h ASP 459 CO -0.51 0.00 0.00 0.77 -3.12 0.00 0.00 179.24 176.38 1ra7 h SER 460 N 0.00 0.00 0.00 6.45 4.64 -0.26 -3.51 113.55 120.87 1ra7 h SER 460 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ra7 h SER 460 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1ra7 h SER 460 CO 0.00 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.45