#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dl7 s ASP 5 N 0.00 6.44 0.00 4.31 3.68 -1.26 -4.89 116.67 124.95 3dl7 s ASP 5 Ca 0.00 1.65 0.16 0.00 2.13 0.00 0.00 52.55 56.49 3dl7 s ASP 5 Cb 0.00 -2.53 0.77 0.00 -1.45 0.00 0.00 42.92 39.70 3dl7 s ASP 5 CO 0.00 -1.20 1.46 -2.65 0.13 0.00 0.00 175.17 172.91 3dl7 n PRO 6 N 7.56 0.17 0.17 4.34 -0.02 -1.26 -0.51 135.00 145.45 3dl7 n PRO 6 Ca 0.18 0.16 0.06 0.00 -2.02 0.00 0.00 63.50 61.89 3dl7 n PRO 6 Cb 0.45 -1.50 0.08 0.00 -0.02 0.00 0.00 33.50 32.51 3dl7 n PRO 6 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 3dl7 h GLN 7 N 0.00 0.00 -0.40 -0.52 1.08 -2.03 -3.26 115.11 109.99 3dl7 h GLN 7 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3dl7 h GLN 7 Cb 0.18 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.61 3dl7 h GLN 7 CO 0.00 0.30 0.00 1.28 -0.95 0.00 0.00 178.83 179.46 3dl7 n LEU 8 N -3.16 3.31 -4.34 1.46 4.77 0.34 -4.83 117.00 114.55 3dl7 n LEU 8 Ca 0.03 -1.45 -0.35 0.00 -0.03 0.00 0.00 56.01 54.21 3dl7 n LEU 8 Cb 0.65 -0.26 -0.14 0.00 -2.33 0.00 0.00 43.42 41.35 3dl7 n LEU 8 CO 0.38 0.72 -0.37 -0.76 -1.33 0.00 0.00 177.39 176.04 3dl7 s LEU 9 N -1.45 3.00 -0.00 2.23 1.43 -1.22 0.14 118.68 122.80 3dl7 s LEU 9 Ca 0.39 -0.35 0.04 0.00 -1.03 0.00 0.00 54.13 53.18 3dl7 s LEU 9 Cb 0.22 -1.77 -0.01 0.00 0.03 0.00 0.00 46.19 44.66 3dl7 s LEU 9 CO 0.31 -0.02 -0.13 -0.69 0.23 0.00 0.00 176.35 176.05 3dl7 s VAL 10 N 1.48 1.06 -0.33 -1.59 1.01 -0.78 -4.98 120.40 116.28 3dl7 s VAL 10 Ca 0.06 -0.64 -0.11 0.00 0.00 0.00 0.00 61.98 61.29 3dl7 s VAL 10 Cb -0.14 -0.90 -0.01 0.00 0.00 0.00 0.00 36.38 35.33 3dl7 s VAL 10 CO -0.02 0.25 0.19 -0.60 0.00 0.00 0.00 175.10 174.92 3dl7 s ARG 11 N -0.45 3.33 0.52 2.72 3.52 -1.26 -0.30 118.95 127.03 3dl7 s ARG 11 Ca 0.05 -0.73 0.09 0.00 -0.13 0.00 0.00 55.73 55.00 3dl7 s ARG 11 Cb -0.06 -3.67 0.06 0.00 -1.56 0.00 0.00 34.95 29.72 3dl7 s ARG 11 CO -0.00 -0.46 0.68 0.14 -0.81 0.00 0.00 175.30 174.85 3dl7 s VAL 12 N 1.65 2.40 0.59 7.11 -7.23 -0.30 -4.89 120.40 119.73 3dl7 s VAL 12 Ca 0.05 -1.04 0.30 0.00 -1.81 0.00 0.00 61.98 59.48 3dl7 s VAL 12 Cb -0.17 -2.44 0.36 0.00 0.56 0.00 0.00 36.38 34.68 3dl7 s VAL 12 CO 0.08 0.00 2.24 -0.09 -0.31 0.00 0.00 175.10 177.02 3dl7 h ARG 13 N 0.39 0.00 -0.58 4.82 2.43 -1.93 -1.68 114.38 117.83 3dl7 h ARG 13 Ca -0.34 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 3dl7 h ARG 13 Cb 1.29 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 3dl7 h ARG 13 CO 0.44 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 179.31 3dl7 n GLY 14 N -1.32 2.75 0.00 2.80 0.00 -1.26 -4.97 105.19 103.19 3dl7 n GLY 14 Ca -0.02 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.28 3dl7 n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dl7 n GLY 15 N 1.06 0.61 3.87 -0.02 0.00 -0.63 -0.45 105.19 109.64 3dl7 n GLY 15 Ca 0.21 -2.11 -0.33 0.00 0.00 0.00 0.00 46.02 43.79 3dl7 n GLY 15 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dl7 s GLN 16 N -0.98 3.78 0.07 1.61 -0.21 -1.23 -1.15 119.66 121.55 3dl7 s GLN 16 Ca 0.00 0.20 0.05 0.00 0.02 0.00 0.00 55.36 55.63 3dl7 s GLN 16 Cb 0.00 -2.80 -0.03 0.00 1.00 0.00 0.00 33.01 31.18 3dl7 s GLN 16 CO 0.00 0.42 -0.14 -0.51 -2.12 0.00 0.00 175.29 172.94 3dl7 s LEU 17 N -2.49 2.28 -0.18 2.90 1.43 0.59 -0.71 118.68 122.50 3dl7 s LEU 17 Ca 0.42 -0.62 0.00 0.00 -1.03 0.00 0.00 54.13 52.90 3dl7 s LEU 17 Cb -0.12 -0.52 0.04 0.00 0.03 0.00 0.00 46.19 45.61 3dl7 s LEU 17 CO 0.21 -0.07 -0.08 -0.60 0.23 0.00 0.00 176.35 176.04 3dl7 s ARG 18 N -1.76 1.76 0.06 1.70 3.52 -0.54 -1.87 118.95 121.82 3dl7 s ARG 18 Ca -0.02 -0.67 -0.01 0.00 -0.13 0.00 0.00 55.73 54.91 3dl7 s ARG 18 Cb -0.10 -2.20 0.01 0.00 -1.56 0.00 0.00 34.95 31.10 3dl7 s ARG 18 CO 0.02 -0.42 0.08 0.41 -0.81 0.00 0.00 175.30 174.58 3dl7 n GLY 19 N 4.78 -0.94 3.13 8.12 0.00 0.12 -1.20 105.19 119.20 3dl7 n GLY 19 Ca -0.13 -1.70 -0.20 0.00 0.00 0.00 0.00 46.02 43.98 3dl7 n GLY 19 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3dl7 s ILE 20 N -1.04 1.08 -0.15 -0.61 2.07 0.33 -4.77 121.20 118.11 3dl7 s ILE 20 Ca 0.04 -0.91 -0.26 0.00 -1.41 0.00 0.00 60.65 58.12 3dl7 s ILE 20 Cb -0.00 -0.96 -0.01 0.00 0.13 0.00 0.00 42.46 41.61 3dl7 s ILE 20 CO 0.03 0.05 0.86 -0.60 -1.91 0.00 0.00 174.94 173.38 3dl7 s ARG 21 N -0.97 4.33 0.25 3.50 3.52 -1.26 -0.78 118.95 127.54 3dl7 s ARG 21 Ca 0.02 1.09 0.09 0.00 -0.13 0.00 0.00 55.73 56.81 3dl7 s ARG 21 Cb -0.07 -3.56 -0.04 0.00 -1.56 0.00 0.00 34.95 29.71 3dl7 s ARG 21 CO 0.01 -0.31 -0.02 -0.51 -0.81 0.00 0.00 175.30 173.66 3dl7 s LEU 22 N 2.05 3.16 -0.31 -0.88 1.43 0.11 -4.94 118.68 119.30 3dl7 s LEU 22 Ca 0.40 -0.62 -0.12 0.00 -1.03 0.00 0.00 54.13 52.76 3dl7 s LEU 22 Cb -0.17 -1.72 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 3dl7 s LEU 22 CO 0.14 0.02 0.23 -0.75 0.23 0.00 0.00 176.35 176.23 3dl7 s LYS 23 N -3.49 3.71 0.09 1.70 2.47 -1.26 -0.78 119.74 122.18 3dl7 s LYS 23 Ca 0.30 -0.47 0.02 0.00 -1.56 0.00 0.00 55.97 54.27 3dl7 s LYS 23 Cb -0.07 -3.74 -0.04 0.00 -1.46 0.00 0.00 37.83 32.52 3dl7 s LYS 23 CO 0.19 -0.33 0.16 0.00 0.16 0.00 0.00 175.35 175.52 3dl7 s ALA 24 N 1.77 3.76 0.55 3.13 0.00 0.25 -4.96 121.76 126.26 3dl7 s ALA 24 Ca 0.07 -0.99 0.31 0.00 0.00 0.00 0.00 51.96 51.35 3dl7 s ALA 24 Cb -0.17 -1.60 1.47 0.00 0.00 0.00 0.00 23.12 22.82 3dl7 s ALA 24 CO 0.11 0.72 1.88 -1.35 0.00 0.00 0.00 175.76 177.11 3dl7 h PRO 25 N 2.96 0.00 -0.31 0.00 0.11 -1.97 0.10 132.00 132.90 3dl7 h PRO 25 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3dl7 h PRO 25 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3dl7 h PRO 25 CO 0.69 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.89 3dl7 n GLY 26 N -1.66 2.64 0.00 -0.55 0.00 -1.26 -5.08 105.19 99.28 3dl7 n GLY 26 Ca 0.16 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.83 3dl7 n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dl7 n GLY 27 N 0.45 0.83 3.83 -0.02 0.00 0.36 -5.08 105.19 105.56 3dl7 n GLY 27 Ca 0.11 -1.22 -0.32 0.00 0.00 0.00 0.00 46.02 44.59 3dl7 n GLY 27 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dl7 s PRO 28 N -1.99 3.65 0.01 1.61 0.04 -1.26 -0.59 135.00 136.47 3dl7 s PRO 28 Ca 0.00 1.02 0.02 0.00 0.04 0.00 0.00 61.00 62.08 3dl7 s PRO 28 Cb 0.00 -2.09 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 3dl7 s PRO 28 CO 0.00 -0.53 -0.07 0.14 0.04 0.00 0.00 177.00 176.58 3dl7 s VAL 29 N -2.64 0.52 -0.09 -0.36 -7.23 0.04 -3.67 120.40 106.98 3dl7 s VAL 29 Ca 0.60 -0.44 -0.26 0.00 -1.81 0.00 0.00 61.98 60.07 3dl7 s VAL 29 Cb -0.12 -0.47 -0.03 0.00 0.56 0.00 0.00 36.38 36.32 3dl7 s VAL 29 CO 0.36 0.04 0.82 -0.44 -0.31 0.00 0.00 175.10 175.57 3dl7 s SER 30 N -0.45 7.07 -0.08 4.85 0.01 -0.89 0.08 113.70 124.28 3dl7 s SER 30 Ca 0.00 1.30 0.03 0.00 1.31 0.00 0.00 55.95 58.59 3dl7 s SER 30 Cb -0.04 -2.47 0.01 0.00 0.21 0.00 0.00 66.02 63.73 3dl7 s SER 30 CO -0.00 -0.26 -0.16 0.00 0.41 0.00 0.00 173.24 173.23 3dl7 s ALA 31 N 1.35 1.58 -0.43 1.44 0.00 0.04 -0.68 121.76 125.05 3dl7 s ALA 31 Ca 0.41 -0.61 0.01 0.00 0.00 0.00 0.00 51.96 51.78 3dl7 s ALA 31 Cb -0.18 -0.66 0.12 0.00 0.00 0.00 0.00 23.12 22.39 3dl7 s ALA 31 CO 0.18 0.15 0.19 -0.06 0.00 0.00 0.00 175.76 176.22 3dl7 s PHE 32 N 0.59 3.55 -0.06 0.00 0.40 0.14 -0.51 117.98 122.09 3dl7 s PHE 32 Ca -0.15 -2.86 -0.04 0.00 -0.60 0.00 0.00 56.93 53.28 3dl7 s PHE 32 Cb -0.16 -3.02 -0.04 0.00 0.51 0.00 0.00 43.02 40.31 3dl7 s PHE 32 CO 0.05 -0.90 0.11 -0.51 0.70 0.00 0.00 175.22 174.67 3dl7 s LEU 33 N 0.57 4.10 -0.56 -0.37 1.43 -0.58 -0.82 118.68 122.46 3dl7 s LEU 33 Ca 0.12 0.30 -0.02 0.00 -1.03 0.00 0.00 54.13 53.50 3dl7 s LEU 33 Cb -0.22 -2.17 0.00 0.00 0.03 0.00 0.00 46.19 43.83 3dl7 s LEU 33 CO -0.05 0.34 0.29 0.61 0.23 0.00 0.00 176.35 177.78 3dl7 n GLY 34 N 1.62 0.28 3.69 -3.19 0.00 -1.02 -3.71 105.19 102.86 3dl7 n GLY 34 Ca -0.16 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 3dl7 n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dl7 s ILE 35 N -2.87 4.37 0.07 -0.61 1.01 0.28 -4.79 121.20 118.65 3dl7 s ILE 35 Ca 0.14 1.68 -0.31 0.00 0.00 0.00 0.00 60.65 62.17 3dl7 s ILE 35 Cb -0.06 -4.08 -0.06 0.00 0.01 0.00 0.00 42.46 38.26 3dl7 s ILE 35 CO 0.18 0.01 1.24 -2.16 0.00 0.00 0.00 174.94 174.21 3dl7 s PRO 36 N 2.05 4.41 0.00 2.79 0.04 -1.26 -0.20 135.00 142.82 3dl7 s PRO 36 Ca 0.54 1.83 0.09 0.00 0.04 0.00 0.00 61.00 63.50 3dl7 s PRO 36 Cb -0.24 -3.34 -0.04 0.00 0.04 0.00 0.00 34.50 30.92 3dl7 s PRO 36 CO 0.22 -0.30 0.51 1.97 0.04 0.00 0.00 177.00 179.44 3dl7 n PHE 37 N 3.98 0.00 -3.89 0.56 1.16 -0.93 -4.86 117.46 113.48 3dl7 n PHE 37 Ca 0.10 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.58 3dl7 n PHE 37 Cb 0.46 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.24 3dl7 n PHE 37 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3dl7 s ALA 38 N -1.54 -0.18 0.36 1.98 0.00 -1.24 -3.22 121.76 117.92 3dl7 s ALA 38 Ca 0.06 -0.51 -0.28 0.00 0.00 0.00 0.00 51.96 51.22 3dl7 s ALA 38 Cb 0.07 0.33 -0.12 0.00 0.00 0.00 0.00 23.12 23.40 3dl7 s ALA 38 CO 0.29 -0.39 1.41 0.39 0.00 0.00 0.00 175.76 177.47 3dl7 n GLU 39 N 0.47 2.46 -1.70 0.00 -0.58 -0.58 -4.53 120.64 116.19 3dl7 n GLU 39 Ca -0.17 0.86 -0.43 0.00 -0.42 0.00 0.00 57.16 57.00 3dl7 n GLU 39 Cb 0.60 -2.54 -0.03 0.00 -0.57 0.00 0.00 31.44 28.90 3dl7 n GLU 39 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 3dl7 n PRO 40 N 0.50 2.69 -1.48 3.49 -0.02 -1.26 -4.68 135.00 134.24 3dl7 n PRO 40 Ca 0.03 0.97 -0.40 0.00 -2.02 0.00 0.00 63.50 62.08 3dl7 n PRO 40 Cb 0.38 -2.83 -0.02 0.00 -0.02 0.00 0.00 33.50 31.01 3dl7 n PRO 40 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3dl7 n PRO 41 N 4.63 3.60 -4.00 0.52 -0.04 -1.26 -4.90 135.00 133.56 3dl7 n PRO 41 Ca 0.17 -2.42 -0.22 0.00 -0.04 0.00 0.00 63.50 60.99 3dl7 n PRO 41 Cb 0.35 -2.89 -0.05 0.00 -0.04 0.00 0.00 33.50 30.87 3dl7 n PRO 41 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3dl7 s VAL 42 N 2.07 3.41 0.00 0.52 -7.23 -1.26 -3.44 120.40 114.47 3dl7 s VAL 42 Ca 0.63 -1.55 0.00 0.00 -1.81 0.00 0.00 61.98 59.25 3dl7 s VAL 42 Cb 0.17 -3.10 0.00 0.00 0.56 0.00 0.00 36.38 34.01 3dl7 s VAL 42 CO -0.07 -0.21 0.00 0.61 -0.31 0.00 0.00 175.10 175.12 3dl7 n GLY 43 N -1.22 3.69 0.32 2.32 0.00 -1.26 -1.87 105.19 107.16 3dl7 n GLY 43 Ca -0.03 0.11 0.22 0.00 0.00 0.00 0.00 46.02 46.32 3dl7 n GLY 43 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3dl7 h SER 44 N 0.00 0.00 0.23 1.61 4.64 -1.94 -1.60 113.55 116.50 3dl7 h SER 44 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dl7 h SER 44 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3dl7 h SER 44 CO 0.00 0.00 -0.16 0.54 -0.87 0.00 0.00 176.83 176.34 3dl7 n ARG 45 N -3.00 0.92 -1.69 4.77 5.12 -0.78 -4.79 116.66 117.21 3dl7 n ARG 45 Ca -0.03 -0.47 -0.44 0.00 -1.93 0.00 0.00 57.85 54.98 3dl7 n ARG 45 Cb 0.07 -1.49 -0.03 0.00 -1.16 0.00 0.00 32.46 29.85 3dl7 n ARG 45 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 3dl7 n ARG 46 N -0.63 2.19 -0.58 5.56 0.63 -0.60 -1.24 116.66 121.99 3dl7 n ARG 46 Ca 0.14 0.78 0.00 0.00 -0.92 0.00 0.00 57.85 57.85 3dl7 n ARG 46 Cb 0.32 -2.47 0.00 0.00 0.45 0.00 0.00 32.46 30.76 3dl7 n ARG 46 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 3dl7 n PHE 47 N 2.07 0.00 -3.41 -0.14 3.72 -1.26 -4.93 117.46 113.51 3dl7 n PHE 47 Ca 0.11 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.22 3dl7 n PHE 47 Cb 0.32 -0.60 -0.04 0.00 -0.94 0.00 0.00 39.48 38.22 3dl7 n PHE 47 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 3dl7 s MET 48 N -0.33 3.64 0.49 -1.08 -1.94 -0.37 -4.28 119.30 115.44 3dl7 s MET 48 Ca 0.00 0.00 -0.22 0.00 -1.71 0.00 0.00 55.69 53.77 3dl7 s MET 48 Cb 0.00 -2.68 -0.09 0.00 2.01 0.00 0.00 34.83 34.07 3dl7 s MET 48 CO 0.00 0.27 0.90 -2.30 -0.01 0.00 0.00 175.02 173.88 3dl7 n PRO 49 N -0.70 1.06 -2.25 2.03 -0.02 -1.26 -4.94 135.00 128.92 3dl7 n PRO 49 Ca -0.02 0.39 -0.38 0.00 -2.02 0.00 0.00 63.50 61.47 3dl7 n PRO 49 Cb 0.53 -2.00 -0.01 0.00 -0.02 0.00 0.00 33.50 32.00 3dl7 n PRO 49 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3dl7 s PRO 50 N -2.21 3.94 0.07 0.52 0.04 -1.26 -5.05 135.00 131.04 3dl7 s PRO 50 Ca 0.68 1.86 0.04 0.00 0.04 0.00 0.00 61.00 63.62 3dl7 s PRO 50 Cb -0.50 -2.59 -0.04 0.00 0.04 0.00 0.00 34.50 31.40 3dl7 s PRO 50 CO 0.54 -0.42 -0.01 -1.21 0.04 0.00 0.00 177.00 175.94 3dl7 s GLU 51 N -2.42 2.58 0.41 4.56 2.02 -1.26 -5.03 118.70 119.56 3dl7 s GLU 51 Ca 0.59 -0.79 -0.26 0.00 0.02 0.00 0.00 54.97 54.53 3dl7 s GLU 51 Cb -0.31 -2.56 -0.10 0.00 0.10 0.00 0.00 34.13 31.26 3dl7 s GLU 51 CO 0.39 0.56 1.38 -0.35 0.02 0.00 0.00 175.26 177.25 3dl7 n PRO 52 N 0.79 2.23 -1.97 0.39 -0.04 -1.26 -1.52 135.00 133.61 3dl7 n PRO 52 Ca -0.12 0.79 -0.42 0.00 -0.04 0.00 0.00 63.50 63.72 3dl7 n PRO 52 Cb 0.52 -2.52 -0.03 0.00 -0.04 0.00 0.00 33.50 31.43 3dl7 n PRO 52 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 3dl7 s LYS 53 N -2.22 4.24 0.44 0.54 2.47 -1.20 -4.21 119.74 119.80 3dl7 s LYS 53 Ca 0.58 2.33 -0.25 0.00 -1.56 0.00 0.00 55.97 57.08 3dl7 s LYS 53 Cb -0.49 -3.13 -0.08 0.00 -1.46 0.00 0.00 37.83 32.67 3dl7 s LYS 53 CO 0.60 -0.52 1.26 1.03 0.16 0.00 0.00 175.35 177.88 3dl7 s ARG 54 N 0.40 3.81 0.48 4.03 0.52 -1.26 -4.91 118.95 122.02 3dl7 s ARG 54 Ca 0.65 2.03 -0.19 0.00 -0.52 0.00 0.00 55.73 57.70 3dl7 s ARG 54 Cb -0.43 -2.59 -0.15 0.00 0.52 0.00 0.00 34.95 32.31 3dl7 s ARG 54 CO 0.37 -0.58 -0.00 -2.30 0.02 0.00 0.00 175.30 172.81 3dl7 n PRO 55 N -0.19 0.05 -4.23 3.54 -0.02 -1.26 -5.00 135.00 127.88 3dl7 n PRO 55 Ca 0.06 0.02 -0.17 0.00 -2.02 0.00 0.00 63.50 61.39 3dl7 n PRO 55 Cb 0.45 -1.06 -0.11 0.00 -0.02 0.00 0.00 33.50 32.76 3dl7 n PRO 55 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 3dl7 s TRP 56 N -1.88 1.33 0.38 6.00 -2.14 0.40 -5.03 118.94 118.00 3dl7 s TRP 56 Ca 0.59 -0.60 -0.09 0.00 2.66 0.00 0.00 56.10 58.66 3dl7 s TRP 56 Cb -0.53 -0.69 -0.06 0.00 -3.10 0.00 0.00 33.47 29.08 3dl7 s TRP 56 CO 0.64 0.12 0.72 -1.54 -2.66 0.00 0.00 176.95 174.23 3dl7 s SER 57 N -2.57 6.48 0.91 -2.66 1.04 -1.26 -4.56 113.70 111.06 3dl7 s SER 57 Ca 0.10 1.01 0.00 0.00 0.48 0.00 0.00 55.95 57.54 3dl7 s SER 57 Cb -0.03 -2.27 0.00 0.00 0.10 0.00 0.00 66.02 63.81 3dl7 s SER 57 CO 0.02 -0.37 0.00 0.61 0.98 0.00 0.00 173.24 174.48 3dl7 n GLY 58 N -1.31 0.85 3.46 7.32 0.00 -1.26 -4.63 105.19 109.63 3dl7 n GLY 58 Ca 0.01 -0.71 -0.37 0.00 0.00 0.00 0.00 46.02 44.95 3dl7 n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dl7 s VAL 59 N 0.00 4.49 -0.09 1.61 1.01 -1.26 -3.50 120.40 122.66 3dl7 s VAL 59 Ca 0.00 -0.18 -0.29 0.00 0.00 0.00 0.00 61.98 61.51 3dl7 s VAL 59 Cb 0.00 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 3dl7 s VAL 59 CO 0.00 0.27 0.96 -0.22 0.00 0.00 0.00 175.10 176.11 3dl7 s LEU 60 N 1.63 4.26 -0.47 3.92 2.96 0.12 -4.90 118.68 126.20 3dl7 s LEU 60 Ca 0.06 1.49 -0.28 0.00 -0.22 0.00 0.00 54.13 55.18 3dl7 s LEU 60 Cb -0.16 -3.49 0.01 0.00 0.50 0.00 0.00 46.19 43.05 3dl7 s LEU 60 CO 0.05 -0.39 1.49 -0.62 -1.32 0.00 0.00 176.35 175.57 3dl7 s ASP 61 N 1.07 6.12 -0.65 3.68 3.68 -1.26 -1.47 116.67 127.84 3dl7 s ASP 61 Ca 0.47 0.64 0.04 0.00 2.13 0.00 0.00 52.55 55.83 3dl7 s ASP 61 Cb -0.19 -2.54 0.35 0.00 -1.45 0.00 0.00 42.92 39.09 3dl7 s ASP 61 CO 0.19 -1.64 1.16 0.00 0.13 0.00 0.00 175.17 175.01 3dl7 n ALA 62 N 9.58 5.04 0.02 3.66 0.00 -0.34 -4.67 120.51 133.81 3dl7 n ALA 62 Ca 0.16 -4.62 0.00 0.00 0.00 0.00 0.00 53.44 48.98 3dl7 n ALA 62 Cb 0.49 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.94 3dl7 n ALA 62 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3dl7 n THR 63 N -0.26 0.00 -4.17 0.00 -2.24 -1.24 -1.52 114.28 104.85 3dl7 n THR 63 Ca 0.36 -0.49 -0.18 0.00 -2.27 0.00 0.00 64.05 61.47 3dl7 n THR 63 Cb 0.40 1.01 -0.12 0.00 -2.10 0.00 0.00 70.33 69.52 3dl7 n THR 63 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3dl7 s THR 64 N -0.63 1.09 0.30 4.28 -4.23 -1.26 -4.83 115.64 110.36 3dl7 s THR 64 Ca 0.00 -1.36 -0.30 0.00 -1.18 0.00 0.00 61.69 58.85 3dl7 s THR 64 Cb 0.00 -1.12 -0.12 0.00 1.34 0.00 0.00 72.50 72.61 3dl7 s THR 64 CO 0.02 -0.28 1.51 0.49 -0.54 0.00 0.00 174.62 175.81 3dl7 n PHE 65 N 1.15 2.66 -1.22 3.99 3.72 -1.26 -3.29 117.46 123.21 3dl7 n PHE 65 Ca -0.20 0.35 -0.08 0.00 -0.05 0.00 0.00 57.45 57.47 3dl7 n PHE 65 Cb 0.55 -2.54 0.05 0.00 -0.94 0.00 0.00 39.48 36.60 3dl7 n PHE 65 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3dl7 n GLN 66 N 1.72 -0.37 -2.19 -1.08 1.13 -1.26 -4.89 117.38 110.43 3dl7 n GLN 66 Ca 0.08 -0.53 -0.36 0.00 -1.94 0.00 0.00 57.00 54.25 3dl7 n GLN 66 Cb 0.36 -0.36 0.01 0.00 0.11 0.00 0.00 30.24 30.36 3dl7 n GLN 66 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 3dl7 s ASN 67 N -2.26 5.76 0.23 1.08 0.01 -1.26 -4.82 114.94 113.67 3dl7 s ASN 67 Ca 0.20 2.29 -0.30 0.00 -0.71 0.00 0.00 52.86 54.34 3dl7 s ASN 67 Cb -0.01 -2.59 -0.09 0.00 0.41 0.00 0.00 41.25 38.97 3dl7 s ASN 67 CO 0.14 -1.20 1.07 -0.69 -1.51 0.00 0.00 177.10 174.91 3dl7 s VAL 68 N -1.64 3.75 0.55 1.60 1.01 -0.08 -4.66 120.40 120.94 3dl7 s VAL 68 Ca 0.70 1.65 -0.22 0.00 0.00 0.00 0.00 61.98 64.12 3dl7 s VAL 68 Cb -0.27 -4.05 -0.05 0.00 0.00 0.00 0.00 36.38 32.01 3dl7 s VAL 68 CO 0.32 0.35 1.37 0.00 0.00 0.00 0.00 175.10 177.13 3dl7 s TYR 70 N -1.29 2.35 0.07 0.00 5.04 -0.98 -4.65 117.35 117.89 3dl7 s TYR 70 Ca 0.72 0.20 -0.20 0.00 -2.44 0.00 0.00 57.07 55.35 3dl7 s TYR 70 Cb -0.41 -4.05 0.05 0.00 0.35 0.00 0.00 41.96 37.90 3dl7 s TYR 70 CO 0.49 -4.24 0.47 1.14 -1.34 0.00 0.00 175.55 172.07 3dl7 s GLN 71 N 2.60 1.04 0.23 4.97 -2.07 -1.26 -4.63 119.66 120.54 3dl7 s GLN 71 Ca 0.76 -0.39 -0.30 0.00 -1.82 0.00 0.00 55.36 53.61 3dl7 s GLN 71 Cb -0.42 0.47 -0.15 0.00 -1.09 0.00 0.00 33.01 31.82 3dl7 s GLN 71 CO 0.34 -0.39 1.13 0.98 -1.32 0.00 0.00 175.29 176.04 3dl7 n TYR 72 N 0.22 1.42 -5.08 9.60 4.19 -1.26 -5.01 117.16 121.24 3dl7 n TYR 72 Ca -0.18 0.65 -0.32 0.00 3.31 0.00 0.00 57.90 61.36 3dl7 n TYR 72 Cb 0.61 -2.29 -0.16 0.00 0.49 0.00 0.00 39.34 37.99 3dl7 n TYR 72 CO 0.00 0.00 0.00 0.08 0.91 0.00 0.00 176.86 177.85 3dl7 s VAL 73 N -0.55 2.40 -0.20 2.97 1.01 -1.26 -4.84 120.40 119.94 3dl7 s VAL 73 Ca 0.66 -0.91 -0.29 0.00 0.00 0.00 0.00 61.98 61.44 3dl7 s VAL 73 Cb -0.75 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 33.68 3dl7 s VAL 73 CO 0.55 0.55 1.20 -0.62 0.00 0.00 0.00 175.10 176.79 3dl7 s ASP 74 N 0.22 6.96 -0.13 3.32 2.15 -1.26 -4.89 116.67 123.04 3dl7 s ASP 74 Ca -0.13 1.56 0.16 0.00 0.43 0.00 0.00 52.55 54.57 3dl7 s ASP 74 Cb -0.16 -2.54 0.40 0.00 -0.30 0.00 0.00 42.92 40.31 3dl7 s ASP 74 CO 0.07 -0.76 1.19 0.35 -0.17 0.00 0.00 175.17 175.84 3dl7 n THR 75 N 5.43 1.40 -0.11 1.71 -2.24 -1.26 -4.79 114.28 114.41 3dl7 n THR 75 Ca 0.13 -2.33 -0.10 0.00 -2.27 0.00 0.00 64.05 59.49 3dl7 n THR 75 Cb 0.45 0.18 0.05 0.00 -2.10 0.00 0.00 70.33 68.91 3dl7 n THR 75 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3dl7 h LEU 76 N 0.88 0.89 -6.16 3.22 5.85 -2.03 -3.36 115.31 114.59 3dl7 h LEU 76 Ca -0.07 -0.34 -0.59 0.00 0.84 0.00 0.00 57.88 57.72 3dl7 h LEU 76 Cb 1.30 -0.24 -0.41 0.00 0.37 0.00 0.00 40.66 41.68 3dl7 h LEU 76 CO 0.03 1.09 -0.75 -1.22 -0.34 0.00 0.00 178.44 177.25 3dl7 n TYR 77 N -4.10 2.37 -1.92 1.25 4.01 -1.26 -5.11 117.16 112.40 3dl7 n TYR 77 Ca -0.00 -3.97 -0.41 0.00 -0.16 0.00 0.00 57.90 53.35 3dl7 n TYR 77 Cb 0.46 -0.49 -0.02 0.00 -0.31 0.00 0.00 39.34 38.99 3dl7 n TYR 77 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 3dl7 s PRO 78 N -2.02 4.21 0.00 -0.72 0.02 -1.26 -1.82 135.00 133.41 3dl7 s PRO 78 Ca 0.38 2.42 0.00 0.00 0.02 0.00 0.00 61.00 63.82 3dl7 s PRO 78 Cb 0.15 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.61 3dl7 s PRO 78 CO -0.05 -0.47 0.00 0.41 -0.33 0.00 0.00 177.00 176.56 3dl7 n GLY 79 N 1.71 1.39 3.68 0.52 0.00 -1.26 -5.05 105.19 106.18 3dl7 n GLY 79 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 3dl7 n GLY 79 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3dl7 s PHE 80 N -2.38 3.45 0.23 1.61 5.36 -0.75 -4.98 117.98 120.52 3dl7 s PHE 80 Ca 0.00 1.09 -0.07 0.00 -0.96 0.00 0.00 56.93 57.00 3dl7 s PHE 80 Cb 0.00 -2.84 0.22 0.00 -0.34 0.00 0.00 43.02 40.06 3dl7 s PHE 80 CO 0.00 -0.10 1.84 1.49 -1.46 0.00 0.00 175.22 176.99 3dl7 h GLU 81 N 7.21 1.22 -0.30 10.12 4.57 -1.96 -0.63 114.58 134.81 3dl7 h GLU 81 Ca -0.34 -0.17 0.09 0.00 -1.18 0.00 0.00 59.36 57.76 3dl7 h GLU 81 Cb 1.16 -0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 29.51 3dl7 h GLU 81 CO 0.78 0.92 0.51 0.78 -1.18 0.00 0.00 179.01 180.82 3dl7 h GLY 82 N 1.22 0.00 0.00 1.92 0.00 -1.93 -2.37 103.07 101.91 3dl7 h GLY 82 Ca 0.30 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.44 3dl7 h GLY 82 CO -0.04 0.00 -1.66 -1.30 0.00 0.00 0.00 176.54 173.53 3dl7 n THR 83 N -3.31 0.66 0.06 4.70 -2.24 -0.93 -4.62 114.28 108.60 3dl7 n THR 83 Ca 0.05 -0.22 0.20 0.00 -2.27 0.00 0.00 64.05 61.81 3dl7 n THR 83 Cb 0.64 -1.18 0.74 0.00 -2.10 0.00 0.00 70.33 68.43 3dl7 n THR 83 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3dl7 h GLU 84 N -0.16 0.00 0.00 -0.78 4.39 -0.96 -0.92 114.58 116.15 3dl7 h GLU 84 Ca -0.28 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.42 3dl7 h GLU 84 Cb 1.35 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.00 3dl7 h GLU 84 CO -0.09 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.76 3dl7 h MET 85 N 0.00 0.00 0.00 2.33 -0.00 -1.69 -2.22 114.93 113.36 3dl7 h MET 85 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.91 3dl7 h MET 85 Cb 0.95 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.55 3dl7 h MET 85 CO -0.00 0.00 -1.03 0.91 -0.00 0.00 0.00 176.91 176.79 3dl7 n TRP 86 N -2.43 0.00 -1.83 -0.10 7.02 -0.36 -4.79 117.44 114.95 3dl7 n TRP 86 Ca 0.02 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.16 3dl7 n TRP 86 Cb 0.25 -0.10 0.04 0.00 -2.42 0.00 0.00 31.31 29.08 3dl7 n TRP 86 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 3dl7 s ASN 87 N -2.92 5.14 0.24 -0.99 0.01 -0.84 -4.70 114.94 110.89 3dl7 s ASN 87 Ca 0.03 2.07 -0.31 0.00 -0.71 0.00 0.00 52.86 53.94 3dl7 s ASN 87 Cb 0.12 -2.56 -0.13 0.00 0.41 0.00 0.00 41.25 39.09 3dl7 s ASN 87 CO 0.69 -1.61 1.45 -2.65 -1.51 0.00 0.00 177.10 173.47 3dl7 n PRO 88 N -2.21 2.12 -0.37 -0.60 -0.02 -1.26 -4.89 135.00 127.77 3dl7 n PRO 88 Ca 0.11 0.76 0.08 0.00 -2.02 0.00 0.00 63.50 62.42 3dl7 n PRO 88 Cb 0.52 -2.44 0.23 0.00 -0.02 0.00 0.00 33.50 31.79 3dl7 n PRO 88 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3dl7 n ASN 89 N 2.28 3.65 -4.07 2.55 6.94 -1.26 -4.98 115.26 120.37 3dl7 n ASN 89 Ca 0.12 -2.61 -0.10 0.00 -0.02 0.00 0.00 54.58 51.97 3dl7 n ASN 89 Cb 0.32 -0.44 -0.09 0.00 -2.36 0.00 0.00 39.78 37.22 3dl7 n ASN 89 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 3dl7 s ARG 90 N -2.09 1.06 0.23 -3.83 1.81 -1.26 -5.08 118.95 109.78 3dl7 s ARG 90 Ca 0.36 -1.33 -0.30 0.00 -1.72 0.00 0.00 55.73 52.73 3dl7 s ARG 90 Cb 0.26 0.31 -0.15 0.00 -0.45 0.00 0.00 34.95 34.92 3dl7 s ARG 90 CO 0.13 -0.35 1.06 0.39 -0.68 0.00 0.00 175.30 175.85 3dl7 n GLU 91 N -0.16 1.21 -2.75 3.54 -0.58 -1.26 -4.33 120.64 116.31 3dl7 n GLU 91 Ca -0.06 0.43 -0.37 0.00 -0.42 0.00 0.00 57.16 56.75 3dl7 n GLU 91 Cb 0.63 -1.84 -0.06 0.00 -0.57 0.00 0.00 31.44 29.60 3dl7 n GLU 91 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3dl7 s LEU 92 N 0.68 4.28 -0.14 -4.62 1.43 -1.26 -0.90 118.68 118.15 3dl7 s LEU 92 Ca 0.66 1.85 -0.30 0.00 -1.03 0.00 0.00 54.13 55.31 3dl7 s LEU 92 Cb -0.78 -4.08 0.11 0.00 0.03 0.00 0.00 46.19 41.47 3dl7 s LEU 92 CO 0.56 -0.15 0.91 -0.55 0.23 0.00 0.00 176.35 177.35 3dl7 s SER 93 N -1.65 -0.45 0.52 2.29 0.15 -0.43 -4.89 113.70 109.23 3dl7 s SER 93 Ca 0.52 0.51 0.31 0.00 0.70 0.00 0.00 55.95 57.99 3dl7 s SER 93 Cb -0.18 0.40 1.15 0.00 -1.71 0.00 0.00 66.02 65.68 3dl7 s SER 93 CO 0.23 -0.40 1.91 -0.33 1.20 0.00 0.00 173.24 175.85 3dl7 h GLU 94 N 2.76 0.00 -5.60 5.44 5.08 -1.94 -2.61 114.58 117.72 3dl7 h GLU 94 Ca -0.21 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.49 3dl7 h GLU 94 Cb 1.16 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.28 3dl7 h GLU 94 CO 0.32 0.02 1.42 0.34 -1.00 0.00 0.00 179.01 180.11 3dl7 s ASP 95 N -5.83 6.66 0.00 1.42 2.15 -1.26 -4.31 116.67 115.50 3dl7 s ASP 95 Ca 0.02 -1.97 0.00 0.00 0.43 0.00 0.00 52.55 51.03 3dl7 s ASP 95 Cb 0.08 -2.50 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 3dl7 s ASP 95 CO 0.57 -1.24 0.41 0.00 -0.17 0.00 0.00 175.17 174.75 3dl7 n LEU 97 N 0.00 5.18 -4.15 0.00 4.77 -1.26 -4.58 117.00 116.97 3dl7 n LEU 97 Ca 0.00 -4.18 -0.16 0.00 -0.03 0.00 0.00 56.01 51.64 3dl7 n LEU 97 Cb 0.46 -1.68 -0.11 0.00 -2.33 0.00 0.00 43.42 39.75 3dl7 n LEU 97 CO 0.00 0.46 -0.43 -0.31 -1.33 0.00 0.00 177.39 175.78 3dl7 s TYR 98 N 2.96 1.04 0.35 -1.77 2.02 -1.26 -2.19 117.35 118.50 3dl7 s TYR 98 Ca 0.49 -0.53 0.08 0.00 -0.37 0.00 0.00 57.07 56.74 3dl7 s TYR 98 Cb 0.02 -0.59 -0.07 0.00 -0.40 0.00 0.00 41.96 40.92 3dl7 s TYR 98 CO 0.04 0.01 -0.04 -0.48 -1.57 0.00 0.00 175.55 173.51 3dl7 s LEU 99 N -1.92 2.69 0.00 -1.29 0.05 0.73 -1.00 118.68 117.94 3dl7 s LEU 99 Ca -0.02 -1.28 0.06 0.00 0.05 0.00 0.00 54.13 52.95 3dl7 s LEU 99 Cb -0.08 -0.84 -0.02 0.00 -2.05 0.00 0.00 46.19 43.20 3dl7 s LEU 99 CO 0.01 -0.36 -0.20 0.20 -0.55 0.00 0.00 176.35 175.46 3dl7 s ASN 100 N -3.60 2.32 -0.11 1.48 0.01 0.12 -0.56 114.94 114.59 3dl7 s ASN 100 Ca 0.33 -0.41 -0.00 0.00 -0.71 0.00 0.00 52.86 52.08 3dl7 s ASN 100 Cb 0.06 -0.23 0.02 0.00 0.41 0.00 0.00 41.25 41.51 3dl7 s ASN 100 CO 0.16 0.21 -0.08 -0.69 -1.51 0.00 0.00 177.10 175.19 3dl7 s VAL 101 N -0.57 1.06 -0.15 1.60 1.01 -0.00 -0.87 120.40 122.47 3dl7 s VAL 101 Ca 0.07 -0.32 -0.06 0.00 0.00 0.00 0.00 61.98 61.67 3dl7 s VAL 101 Cb -0.08 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 3dl7 s VAL 101 CO 0.00 0.37 0.06 0.26 0.00 0.00 0.00 175.10 175.79 3dl7 s TRP 102 N 1.58 3.29 0.28 5.22 0.51 0.18 0.25 118.94 130.25 3dl7 s TRP 102 Ca 0.03 0.16 0.05 0.00 -2.12 0.00 0.00 56.10 54.22 3dl7 s TRP 102 Cb -0.13 -2.00 -0.06 0.00 -0.81 0.00 0.00 33.47 30.47 3dl7 s TRP 102 CO -0.07 0.30 -0.02 0.95 -0.51 0.00 0.00 176.95 177.61 3dl7 s THR 103 N -0.08 1.43 0.65 2.01 -4.23 0.14 -0.78 115.64 114.78 3dl7 s THR 103 Ca 0.07 -2.07 -0.17 0.00 -1.18 0.00 0.00 61.69 58.34 3dl7 s THR 103 Cb -0.12 -2.52 -0.00 0.00 1.34 0.00 0.00 72.50 71.19 3dl7 s THR 103 CO 0.01 -0.23 1.19 -2.84 -0.54 0.00 0.00 174.62 172.21 3dl7 s PRO 104 N -3.79 2.64 -0.22 3.99 0.02 -1.26 -2.10 135.00 134.28 3dl7 s PRO 104 Ca 0.31 1.73 0.02 0.00 0.02 0.00 0.00 61.00 63.08 3dl7 s PRO 104 Cb 0.05 -1.90 0.04 0.00 0.02 0.00 0.00 34.50 32.71 3dl7 s PRO 104 CO 0.12 -1.44 -0.15 -0.47 -0.33 0.00 0.00 177.00 174.73 3dl7 s TYR 105 N -1.86 3.02 0.86 6.54 5.04 -1.24 -2.92 117.35 126.79 3dl7 s TYR 105 Ca 0.75 -1.95 -0.11 0.00 -2.44 0.00 0.00 57.07 53.32 3dl7 s TYR 105 Cb -0.28 -1.93 0.11 0.00 0.35 0.00 0.00 41.96 40.20 3dl7 s TYR 105 CO 0.39 -0.84 1.09 -1.25 -1.34 0.00 0.00 175.55 173.60 3dl7 s PRO 106 N 1.21 1.52 -0.05 4.97 0.04 -1.26 -4.73 135.00 136.71 3dl7 s PRO 106 Ca -0.02 0.96 -0.38 0.00 0.04 0.00 0.00 61.00 61.61 3dl7 s PRO 106 Cb -0.16 -1.83 -0.16 0.00 0.04 0.00 0.00 34.50 32.39 3dl7 s PRO 106 CO -0.09 -2.09 1.52 -2.13 0.04 0.00 0.00 177.00 174.25 3dl7 n ARG 107 N -3.80 1.26 -1.48 4.56 0.63 -1.15 -4.81 116.66 111.87 3dl7 n ARG 107 Ca 0.08 0.46 -0.50 0.00 -0.92 0.00 0.00 57.85 56.97 3dl7 n ARG 107 Cb 0.54 -2.13 -0.04 0.00 0.45 0.00 0.00 32.46 31.28 3dl7 n ARG 107 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 3dl7 n PRO 108 N 3.78 0.45 0.11 -0.14 -0.02 -1.26 -4.91 135.00 133.01 3dl7 n PRO 108 Ca 0.21 0.16 -0.13 0.00 -2.02 0.00 0.00 63.50 61.72 3dl7 n PRO 108 Cb 0.18 -1.40 -0.08 0.00 -0.02 0.00 0.00 33.50 32.18 3dl7 n PRO 108 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dl7 h ALA 109 N 1.98 -0.25 -2.91 3.55 0.00 -1.93 -3.45 119.26 116.26 3dl7 h ALA 109 Ca -0.37 -0.12 -0.61 0.00 0.00 0.00 0.00 54.91 53.81 3dl7 h ALA 109 Cb 1.40 0.09 -0.13 0.00 0.00 0.00 0.00 17.79 19.16 3dl7 h ALA 109 CO 0.62 -0.55 -0.70 -1.54 0.00 0.00 0.00 179.25 177.07 3dl7 s SER 110 N -5.12 4.41 -0.45 0.00 1.04 -1.26 -5.07 113.70 107.25 3dl7 s SER 110 Ca -0.15 -0.53 -0.41 0.00 0.48 0.00 0.00 55.95 55.34 3dl7 s SER 110 Cb 0.04 -0.81 -0.18 0.00 0.10 0.00 0.00 66.02 65.17 3dl7 s SER 110 CO 0.63 0.09 1.54 -2.65 0.98 0.00 0.00 173.24 173.83 3dl7 n PRO 111 N -0.07 0.00 -4.09 4.02 -0.02 -1.26 -4.90 135.00 128.68 3dl7 n PRO 111 Ca -0.10 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.02 3dl7 n PRO 111 Cb 0.56 -1.34 -0.08 0.00 -0.02 0.00 0.00 33.50 32.62 3dl7 n PRO 111 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3dl7 s THR 112 N 3.32 4.91 0.24 3.45 2.01 -0.21 -4.67 115.64 124.69 3dl7 s THR 112 Ca 0.97 -0.01 -0.28 0.00 0.31 0.00 0.00 61.69 62.67 3dl7 s THR 112 Cb -1.34 -3.13 -0.16 0.00 0.01 0.00 0.00 72.50 67.89 3dl7 s THR 112 CO 0.70 0.58 0.79 -2.65 -0.69 0.00 0.00 174.62 173.34 3dl7 n PRO 113 N 2.37 0.69 -4.38 4.92 -0.02 -1.26 0.53 135.00 137.85 3dl7 n PRO 113 Ca -0.19 0.24 -0.34 0.00 -2.02 0.00 0.00 63.50 61.20 3dl7 n PRO 113 Cb 0.54 -1.45 -0.11 0.00 -0.02 0.00 0.00 33.50 32.46 3dl7 n PRO 113 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3dl7 s VAL 114 N -0.98 4.03 -0.19 -1.45 1.01 0.14 -2.99 120.40 119.97 3dl7 s VAL 114 Ca 0.62 -0.32 -0.04 0.00 0.00 0.00 0.00 61.98 62.24 3dl7 s VAL 114 Cb -0.82 -2.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.79 3dl7 s VAL 114 CO 0.58 0.52 -0.02 -0.76 0.00 0.00 0.00 175.10 175.41 3dl7 s LEU 115 N 0.04 3.17 -0.33 3.92 1.02 -0.18 -0.97 118.68 125.35 3dl7 s LEU 115 Ca 0.01 -0.22 -0.07 0.00 0.02 0.00 0.00 54.13 53.87 3dl7 s LEU 115 Cb -0.13 -1.79 0.03 0.00 0.02 0.00 0.00 46.19 44.32 3dl7 s LEU 115 CO 0.02 0.08 0.11 -0.63 0.02 0.00 0.00 176.35 175.95 3dl7 s ILE 116 N 0.88 3.91 0.04 -0.59 1.01 -0.08 -0.02 121.20 126.34 3dl7 s ILE 116 Ca -0.00 -0.98 -0.23 0.00 0.00 0.00 0.00 60.65 59.44 3dl7 s ILE 116 Cb -0.14 -3.15 -0.06 0.00 0.01 0.00 0.00 42.46 39.12 3dl7 s ILE 116 CO 0.02 -0.11 0.69 0.86 0.00 0.00 0.00 174.94 176.40 3dl7 s TRP 117 N 1.44 3.74 -0.25 3.97 -0.11 0.04 -1.11 118.94 126.66 3dl7 s TRP 117 Ca -0.00 1.37 0.02 0.00 1.22 0.00 0.00 56.10 58.71 3dl7 s TRP 117 Cb -0.19 -2.72 0.06 0.00 -1.50 0.00 0.00 33.47 29.13 3dl7 s TRP 117 CO 0.03 0.34 -0.09 0.42 -4.62 0.00 0.00 176.95 173.04 3dl7 s ILE 118 N -0.27 1.92 0.85 5.86 1.01 -0.36 -3.80 121.20 126.42 3dl7 s ILE 118 Ca 0.35 -1.48 -0.11 0.00 0.00 0.00 0.00 60.65 59.41 3dl7 s ILE 118 Cb -0.20 -2.10 0.10 0.00 0.01 0.00 0.00 42.46 40.28 3dl7 s ILE 118 CO 0.21 -0.06 1.10 -0.72 0.00 0.00 0.00 174.94 175.46 3dl7 s TYR 119 N 1.21 2.32 0.14 3.97 -0.85 -1.26 -3.45 117.35 119.43 3dl7 s TYR 119 Ca -0.08 1.47 0.02 0.00 -0.52 0.00 0.00 57.07 57.96 3dl7 s TYR 119 Cb -0.20 -3.13 0.02 0.00 0.38 0.00 0.00 41.96 39.04 3dl7 s TYR 119 CO -0.05 -2.21 0.19 0.41 -1.52 0.00 0.00 175.55 172.37 3dl7 n GLY 120 N -0.93 1.69 0.00 5.49 0.00 -1.13 -2.93 105.19 107.38 3dl7 n GLY 120 Ca 0.08 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.99 3dl7 n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dl7 n GLY 121 N 3.35 0.35 2.42 -0.02 0.00 -1.25 -4.21 105.19 105.83 3dl7 n GLY 121 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 3dl7 n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dl7 n GLY 122 N 0.00 1.01 3.17 -0.02 0.00 -1.26 -0.39 105.19 107.70 3dl7 n GLY 122 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.69 3dl7 n GLY 122 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3dl7 n PHE 123 N -2.58 0.00 0.32 1.61 3.72 -1.26 -4.79 117.46 114.48 3dl7 n PHE 123 Ca -0.09 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.35 3dl7 n PHE 123 Cb 0.37 -1.27 -0.05 0.00 -0.94 0.00 0.00 39.48 37.59 3dl7 n PHE 123 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 3dl7 n TYR 124 N -2.15 0.00 -3.99 1.38 0.18 -0.35 0.38 117.16 112.61 3dl7 n TYR 124 Ca 0.00 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.65 3dl7 n TYR 124 Cb 0.20 -0.04 -0.02 0.00 -0.38 0.00 0.00 39.34 39.10 3dl7 n TYR 124 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 3dl7 s SER 125 N -2.05 0.66 0.00 9.48 1.04 0.47 -4.04 113.70 119.27 3dl7 s SER 125 Ca 0.02 -1.40 0.00 0.00 0.48 0.00 0.00 55.95 55.05 3dl7 s SER 125 Cb 0.06 0.74 0.00 0.00 0.10 0.00 0.00 66.02 66.92 3dl7 s SER 125 CO 0.35 -1.45 0.00 0.61 0.98 0.00 0.00 173.24 173.73 3dl7 n GLY 126 N -0.57 2.30 3.61 7.32 0.00 -1.26 -3.97 105.19 112.62 3dl7 n GLY 126 Ca -0.02 -2.15 -0.10 0.00 0.00 0.00 0.00 46.02 43.75 3dl7 n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dl7 s ALA 127 N -1.82 -1.95 -2.00 4.61 0.00 -1.26 -4.63 121.76 114.71 3dl7 s ALA 127 Ca 0.00 1.73 0.26 0.00 0.00 0.00 0.00 51.96 53.95 3dl7 s ALA 127 Cb 0.00 -1.08 1.57 0.00 0.00 0.00 0.00 23.12 23.61 3dl7 s ALA 127 CO 0.00 -0.27 1.94 0.00 0.00 0.00 0.00 175.76 177.43 3dl7 n ALA 128 N 1.48 2.51 0.83 0.00 0.00 -1.26 -3.65 120.51 120.42 3dl7 n ALA 128 Ca -0.11 -0.16 0.09 0.00 0.00 0.00 0.00 53.44 53.25 3dl7 n ALA 128 Cb 0.57 -1.43 -0.01 0.00 0.00 0.00 0.00 19.45 18.58 3dl7 n ALA 128 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3dl7 n SER 129 N -0.98 1.77 -4.70 0.00 3.41 -1.26 -4.85 113.62 107.01 3dl7 n SER 129 Ca 0.20 -1.38 -0.37 0.00 -0.26 0.00 0.00 58.87 57.05 3dl7 n SER 129 Cb 0.09 0.49 0.06 0.00 -0.26 0.00 0.00 64.21 64.59 3dl7 n SER 129 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dl7 n LEU 130 N -0.11 5.45 -0.12 1.04 4.77 -1.24 -4.90 117.00 121.89 3dl7 n LEU 130 Ca 0.08 0.83 -0.02 0.00 -0.03 0.00 0.00 56.01 56.87 3dl7 n LEU 130 Cb 0.39 -1.52 0.22 0.00 -2.33 0.00 0.00 43.42 40.18 3dl7 n LEU 130 CO 0.24 -1.18 1.00 0.44 -1.33 0.00 0.00 177.39 176.56 3dl7 h ASP 131 N 0.58 0.74 0.09 -1.43 3.32 -1.93 -2.14 116.42 115.64 3dl7 h ASP 131 Ca -0.50 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.43 3dl7 h ASP 131 Cb 1.34 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.70 3dl7 h ASP 131 CO 0.53 0.71 0.00 -0.37 -1.72 0.00 0.00 179.24 178.38 3dl7 h VAL 132 N 0.78 0.00 -0.57 -1.35 -1.51 -1.90 -1.71 116.25 109.98 3dl7 h VAL 132 Ca 0.18 -0.04 -0.15 0.00 -1.23 0.00 0.00 66.70 65.46 3dl7 h VAL 132 Cb 0.24 0.73 -0.09 0.00 -2.13 0.00 0.00 31.29 30.04 3dl7 h VAL 132 CO -0.01 0.00 0.15 -1.22 -1.23 0.00 0.00 177.57 175.26 3dl7 n TYR 133 N -2.57 1.91 -2.30 5.19 4.01 -0.80 -4.56 117.16 118.03 3dl7 n TYR 133 Ca -0.02 -1.17 -0.43 0.00 -0.16 0.00 0.00 57.90 56.13 3dl7 n TYR 133 Cb 0.07 -0.57 -0.02 0.00 -0.31 0.00 0.00 39.34 38.51 3dl7 n TYR 133 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3dl7 s ASP 134 N -1.45 6.65 0.00 7.72 -1.08 -0.65 -4.89 116.67 122.97 3dl7 s ASP 134 Ca 0.51 1.52 0.07 0.00 -0.52 0.00 0.00 52.55 54.13 3dl7 s ASP 134 Cb 0.41 -2.54 0.27 0.00 -1.46 0.00 0.00 42.92 39.60 3dl7 s ASP 134 CO 0.11 -1.05 1.20 0.61 0.52 0.00 0.00 175.17 176.56 3dl7 n GLY 135 N 4.24 -0.26 0.18 2.66 0.00 -1.26 -4.29 105.19 106.46 3dl7 n GLY 135 Ca 0.16 -0.19 -0.17 0.00 0.00 0.00 0.00 46.02 45.82 3dl7 n GLY 135 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3dl7 h ARG 136 N 0.97 0.57 0.10 1.61 0.11 -1.90 -2.30 114.38 113.54 3dl7 h ARG 136 Ca 0.00 -0.50 -0.00 0.00 0.10 0.00 0.00 59.98 59.58 3dl7 h ARG 136 Cb 0.22 0.12 -0.00 0.00 1.11 0.00 0.00 29.97 31.41 3dl7 h ARG 136 CO 0.00 1.13 -0.08 0.74 0.10 0.00 0.00 179.97 181.86 3dl7 h PHE 137 N 0.19 -0.20 -0.74 4.08 0.04 -1.78 0.35 116.94 118.88 3dl7 h PHE 137 Ca -0.05 -0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.70 3dl7 h PHE 137 Cb 1.28 0.07 -0.04 0.00 2.20 0.00 0.00 35.95 39.47 3dl7 h PHE 137 CO 0.11 -0.12 0.39 -0.07 -0.60 0.00 0.00 178.31 178.02 3dl7 h LEU 138 N -0.19 0.93 -0.52 1.54 3.38 -1.69 0.53 115.31 119.29 3dl7 h LEU 138 Ca -0.00 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 3dl7 h LEU 138 Cb 0.17 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3dl7 h LEU 138 CO -0.00 0.76 0.02 0.00 0.09 0.00 0.00 178.44 179.30 3dl7 h ALA 139 N 1.39 0.70 0.11 1.53 0.00 -1.08 -2.54 119.26 119.38 3dl7 h ALA 139 Ca 0.26 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3dl7 h ALA 139 Cb 0.05 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3dl7 h ALA 139 CO -0.04 0.50 -0.05 0.37 0.00 0.00 0.00 179.25 180.03 3dl7 h GLN 140 N 0.78 -0.14 -0.64 0.00 -0.00 -0.46 -2.12 115.11 112.53 3dl7 h GLN 140 Ca 0.15 0.01 -0.02 0.00 -0.00 0.00 0.00 58.65 58.79 3dl7 h GLN 140 Cb 0.50 0.03 -0.03 0.00 0.00 0.00 0.00 27.48 27.98 3dl7 h GLN 140 CO 0.02 -0.01 0.31 0.28 0.00 0.00 0.00 178.83 179.43 3dl7 h VAL 141 N -1.03 1.21 -0.00 2.39 2.07 -1.04 -3.29 116.25 116.55 3dl7 h VAL 141 Ca -0.01 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 66.93 3dl7 h VAL 141 Cb 0.19 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 3dl7 h VAL 141 CO 0.02 0.24 -0.22 -0.62 0.02 0.00 0.00 177.57 177.01 3dl7 n GLU 142 N -4.35 4.77 -1.58 1.57 -0.58 -0.97 -5.00 120.64 114.50 3dl7 n GLU 142 Ca 0.06 -0.08 -0.07 0.00 -0.42 0.00 0.00 57.16 56.65 3dl7 n GLU 142 Cb 0.13 -0.78 -0.02 0.00 -0.57 0.00 0.00 31.44 30.20 3dl7 n GLU 142 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3dl7 n GLY 143 N 1.05 0.60 3.76 0.62 0.00 -0.80 -5.00 105.19 105.42 3dl7 n GLY 143 Ca 0.01 -0.66 -0.40 0.00 0.00 0.00 0.00 46.02 44.97 3dl7 n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dl7 s ALA 144 N -2.31 3.36 -0.23 4.61 0.00 -1.11 -4.76 121.76 121.31 3dl7 s ALA 144 Ca 0.00 0.74 -0.23 0.00 0.00 0.00 0.00 51.96 52.48 3dl7 s ALA 144 Cb 0.00 -3.26 -0.01 0.00 0.00 0.00 0.00 23.12 19.84 3dl7 s ALA 144 CO 0.00 0.03 0.74 0.08 0.00 0.00 0.00 175.76 176.61 3dl7 s VAL 145 N -1.21 4.91 -0.16 0.00 1.01 -1.16 -4.05 120.40 119.74 3dl7 s VAL 145 Ca 0.44 1.39 -0.00 0.00 0.00 0.00 0.00 61.98 63.80 3dl7 s VAL 145 Cb -0.28 -4.04 -0.00 0.00 0.00 0.00 0.00 36.38 32.06 3dl7 s VAL 145 CO 0.36 -0.00 -0.14 -0.22 0.00 0.00 0.00 175.10 175.09 3dl7 s LEU 146 N 2.51 2.55 0.01 3.92 0.20 0.04 -1.01 118.68 126.91 3dl7 s LEU 146 Ca 0.32 -0.45 0.05 0.00 0.69 0.00 0.00 54.13 54.74 3dl7 s LEU 146 Cb -0.16 -1.59 -0.03 0.00 -0.43 0.00 0.00 46.19 43.99 3dl7 s LEU 146 CO 0.09 0.08 -0.14 -0.69 -0.29 0.00 0.00 176.35 175.40 3dl7 s VAL 147 N 0.85 3.08 -0.02 1.68 1.01 0.97 -0.65 120.40 127.32 3dl7 s VAL 147 Ca -0.04 -0.98 -0.03 0.00 0.00 0.00 0.00 61.98 60.93 3dl7 s VAL 147 Cb -0.15 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 33.94 3dl7 s VAL 147 CO -0.00 0.40 0.07 -0.94 0.00 0.00 0.00 175.10 174.63 3dl7 s SER 148 N -1.30 -0.04 0.20 3.32 1.04 -0.05 -0.78 113.70 116.10 3dl7 s SER 148 Ca 0.15 0.07 0.10 0.00 0.48 0.00 0.00 55.95 56.74 3dl7 s SER 148 Cb -0.11 0.15 -0.04 0.00 0.10 0.00 0.00 66.02 66.12 3dl7 s SER 148 CO 0.05 -0.08 -0.12 0.00 0.98 0.00 0.00 173.24 174.07 3dl7 s MET 149 N -0.21 1.95 0.16 4.02 0.23 -1.25 0.14 119.30 124.35 3dl7 s MET 149 Ca -0.03 -1.37 -0.22 0.00 -1.03 0.00 0.00 55.69 53.05 3dl7 s MET 149 Cb -0.02 -2.07 -0.08 0.00 -1.53 0.00 0.00 34.83 31.13 3dl7 s MET 149 CO 0.00 0.41 0.70 -0.80 -2.03 0.00 0.00 175.02 173.31 3dl7 s ASN 150 N -2.94 7.20 0.06 -1.18 0.01 -0.17 -4.43 114.94 113.50 3dl7 s ASN 150 Ca 0.25 1.47 0.04 0.00 -0.71 0.00 0.00 52.86 53.91 3dl7 s ASN 150 Cb -0.08 -2.44 -0.03 0.00 0.41 0.00 0.00 41.25 39.12 3dl7 s ASN 150 CO 0.15 0.17 -0.11 -0.72 -1.51 0.00 0.00 177.10 175.07 3dl7 s TYR 151 N -1.26 0.99 0.26 2.20 1.13 -1.26 -4.46 117.35 114.95 3dl7 s TYR 151 Ca 0.36 -0.48 -0.30 0.00 -1.41 0.00 0.00 57.07 55.24 3dl7 s TYR 151 Cb -0.20 -0.57 -0.10 0.00 -1.10 0.00 0.00 41.96 39.99 3dl7 s TYR 151 CO 0.23 -0.00 1.46 1.03 -2.51 0.00 0.00 175.55 175.75 3dl7 s ARG 152 N -1.70 4.24 0.50 -3.49 0.52 -1.26 -4.84 118.95 112.92 3dl7 s ARG 152 Ca -0.05 2.35 0.04 0.00 -0.52 0.00 0.00 55.73 57.55 3dl7 s ARG 152 Cb -0.10 -3.09 -0.01 0.00 0.52 0.00 0.00 34.95 32.27 3dl7 s ARG 152 CO 0.01 -0.45 0.14 0.14 0.02 0.00 0.00 175.30 175.17 3dl7 s VAL 153 N -0.10 1.54 0.00 3.52 -7.23 -1.26 -4.08 120.40 112.79 3dl7 s VAL 153 Ca 0.59 -1.81 0.00 0.00 -1.81 0.00 0.00 61.98 58.95 3dl7 s VAL 153 Cb -0.43 -2.35 0.00 0.00 0.56 0.00 0.00 36.38 34.16 3dl7 s VAL 153 CO 0.45 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.85 3dl7 n GLY 154 N -1.37 2.20 0.29 2.32 0.00 0.16 -2.06 105.19 106.74 3dl7 n GLY 154 Ca -0.10 -0.41 -0.05 0.00 0.00 0.00 0.00 46.02 45.45 3dl7 n GLY 154 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3dl7 h THR 155 N 0.00 1.21 -0.49 2.61 1.35 -1.89 0.07 112.91 115.77 3dl7 h THR 155 Ca 0.00 -0.44 0.02 0.00 -0.55 0.00 0.00 66.41 65.44 3dl7 h THR 155 Cb 0.00 0.17 -0.03 0.00 -1.73 0.00 0.00 68.15 66.57 3dl7 h THR 155 CO 0.00 0.21 0.32 -0.26 -0.25 0.00 0.00 175.52 175.54 3dl7 h PHE 156 N 1.00 0.57 0.00 4.73 0.04 -1.87 -1.23 116.94 120.19 3dl7 h PHE 156 Ca 0.26 0.01 -0.12 0.00 2.80 0.00 0.00 57.97 60.93 3dl7 h PHE 156 Cb -0.05 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 37.89 3dl7 h PHE 156 CO -0.01 0.35 -1.73 0.41 -0.60 0.00 0.00 178.31 176.72 3dl7 n GLY 157 N -1.47 -1.14 0.00 -1.45 0.00 -0.87 -4.15 105.19 96.10 3dl7 n GLY 157 Ca 0.05 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.74 3dl7 n GLY 157 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3dl7 n PHE 158 N -2.60 0.00 -1.75 1.61 3.72 -0.02 -0.86 117.46 117.56 3dl7 n PHE 158 Ca -0.10 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.88 3dl7 n PHE 158 Cb 0.75 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.26 3dl7 n PHE 158 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 3dl7 s LEU 159 N -0.09 4.35 -0.01 4.37 0.20 -0.49 -4.44 118.68 122.58 3dl7 s LEU 159 Ca 0.00 2.52 0.06 0.00 0.69 0.00 0.00 54.13 57.40 3dl7 s LEU 159 Cb 0.00 -3.53 -0.02 0.00 -0.43 0.00 0.00 46.19 42.21 3dl7 s LEU 159 CO 0.00 -1.08 -0.20 0.00 -0.29 0.00 0.00 176.35 174.78 3dl7 s ALA 160 N 4.60 1.64 -0.75 5.97 0.00 -1.26 -4.18 121.76 127.77 3dl7 s ALA 160 Ca 0.86 -0.87 -0.03 0.00 0.00 0.00 0.00 51.96 51.91 3dl7 s ALA 160 Cb -0.40 -0.40 0.19 0.00 0.00 0.00 0.00 23.12 22.51 3dl7 s ALA 160 CO 0.39 0.40 0.61 -0.51 0.00 0.00 0.00 175.76 176.64 3dl7 s LEU 161 N -0.57 5.47 0.15 0.00 1.02 0.12 -3.93 118.68 120.94 3dl7 s LEU 161 Ca 0.07 -3.23 -0.34 0.00 0.02 0.00 0.00 54.13 50.66 3dl7 s LEU 161 Cb -0.08 -1.90 -0.15 0.00 0.02 0.00 0.00 46.19 44.08 3dl7 s LEU 161 CO -0.00 -0.30 1.39 -2.65 0.02 0.00 0.00 176.35 174.80 3dl7 n PRO 162 N 3.01 1.59 0.00 1.29 -0.02 -1.26 -1.38 135.00 138.22 3dl7 n PRO 162 Ca 0.14 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 3dl7 n PRO 162 Cb 0.38 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 3dl7 n PRO 162 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dl7 n GLY 163 N 2.62 2.76 3.64 -1.23 0.00 -1.26 -5.04 105.19 106.67 3dl7 n GLY 163 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 3dl7 n GLY 163 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dl7 s SER 164 N 0.54 1.69 -0.07 1.61 1.04 -0.48 -5.01 113.70 113.02 3dl7 s SER 164 Ca 0.00 0.85 0.19 0.00 0.48 0.00 0.00 55.95 57.47 3dl7 s SER 164 Cb 0.00 -1.28 -0.29 0.00 0.10 0.00 0.00 66.02 64.56 3dl7 s SER 164 CO 0.00 -3.67 0.34 -1.14 0.98 0.00 0.00 173.24 169.75 3dl7 n ARG 165 N -4.49 0.70 0.00 4.02 3.00 -1.26 -4.28 116.66 114.35 3dl7 n ARG 165 Ca 0.10 -0.14 0.08 0.00 -0.00 0.00 0.00 57.85 57.89 3dl7 n ARG 165 Cb 0.59 -1.47 -0.09 0.00 0.00 0.00 0.00 32.46 31.48 3dl7 n ARG 165 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 3dl7 n GLU 166 N -2.31 1.20 -2.96 -0.14 0.00 -1.26 -4.55 120.64 110.61 3dl7 n GLU 166 Ca -0.10 -0.10 -0.15 0.00 0.00 0.00 0.00 57.16 56.80 3dl7 n GLU 166 Cb 0.66 -1.34 -0.00 0.00 0.00 0.00 0.00 31.44 30.77 3dl7 n GLU 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3dl7 n ALA 167 N -1.27 0.43 1.00 -1.84 0.00 -1.26 -4.13 120.51 113.44 3dl7 n ALA 167 Ca 0.04 -2.35 0.11 0.00 0.00 0.00 0.00 53.44 51.24 3dl7 n ALA 167 Cb 0.29 -1.08 0.55 0.00 0.00 0.00 0.00 19.45 19.21 3dl7 n ALA 167 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3dl7 n PRO 168 N 1.35 0.23 -0.14 0.00 -0.04 -1.26 0.15 135.00 135.29 3dl7 n PRO 168 Ca 0.15 0.08 0.02 0.00 -0.04 0.00 0.00 63.50 63.71 3dl7 n PRO 168 Cb 0.60 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.55 3dl7 n PRO 168 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dl7 n GLY 169 N 0.70 -1.93 2.32 0.55 0.00 -1.26 -4.72 105.19 100.86 3dl7 n GLY 169 Ca 0.09 -1.47 -0.16 0.00 0.00 0.00 0.00 46.02 44.49 3dl7 n GLY 169 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3dl7 n ASN 170 N -2.51 -4.49 0.11 1.61 3.02 -1.26 -4.88 115.26 106.86 3dl7 n ASN 170 Ca -0.00 0.25 -0.04 0.00 -0.03 0.00 0.00 54.58 54.76 3dl7 n ASN 170 Cb 0.07 -3.92 0.11 0.00 -0.61 0.00 0.00 39.78 35.43 3dl7 n ASN 170 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 3dl7 h VAL 171 N 0.00 1.46 -0.28 2.41 -1.51 -1.79 -1.19 116.25 115.35 3dl7 h VAL 171 Ca -0.35 -2.24 0.01 0.00 -1.23 0.00 0.00 66.70 62.88 3dl7 h VAL 171 Cb 1.16 2.20 -0.01 0.00 -2.13 0.00 0.00 31.29 32.51 3dl7 h VAL 171 CO 0.46 0.65 0.19 1.23 -1.23 0.00 0.00 177.57 178.87 3dl7 h GLY 172 N 1.84 0.38 1.50 5.19 0.00 -1.21 0.38 103.07 111.15 3dl7 h GLY 172 Ca -0.01 -0.14 -0.22 0.00 0.00 0.00 0.00 47.33 46.96 3dl7 h GLY 172 CO 0.09 0.14 -0.89 1.41 0.00 0.00 0.00 176.54 177.29 3dl7 h LEU 173 N 0.36 0.58 -1.03 3.11 3.38 -1.63 -2.50 115.31 117.59 3dl7 h LEU 173 Ca 0.11 -0.44 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 3dl7 h LEU 173 Cb -0.02 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3dl7 h LEU 173 CO -0.02 1.23 0.13 -0.07 0.09 0.00 0.00 178.44 179.79 3dl7 h LEU 174 N 0.28 0.77 -0.01 1.67 3.38 -0.00 0.11 115.31 121.50 3dl7 h LEU 174 Ca -0.07 -0.14 0.03 0.00 0.09 0.00 0.00 57.88 57.79 3dl7 h LEU 174 Cb 1.51 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 42.02 3dl7 h LEU 174 CO 0.16 0.76 -0.19 0.44 0.09 0.00 0.00 178.44 179.70 3dl7 h ASP 175 N 0.80 -0.55 -0.28 -0.43 3.32 -0.20 0.21 116.42 119.28 3dl7 h ASP 175 Ca 0.17 0.08 0.05 0.00 0.02 0.00 0.00 57.03 57.35 3dl7 h ASP 175 Cb 0.30 0.23 -0.04 0.00 0.22 0.00 0.00 39.33 40.04 3dl7 h ASP 175 CO -0.00 -0.25 0.01 1.56 -1.72 0.00 0.00 179.24 178.83 3dl7 h GLN 176 N -0.30 0.09 -0.90 3.56 4.20 -1.03 -1.33 115.11 119.40 3dl7 h GLN 176 Ca 0.06 -0.01 0.07 0.00 0.06 0.00 0.00 58.65 58.83 3dl7 h GLN 176 Cb 0.38 -0.02 -0.06 0.00 0.30 0.00 0.00 27.48 28.08 3dl7 h GLN 176 CO -0.19 0.06 0.56 -0.09 -0.67 0.00 0.00 178.83 178.50 3dl7 h ARG 177 N 0.09 0.98 -0.53 1.46 2.43 -0.31 -0.45 114.38 118.05 3dl7 h ARG 177 Ca 0.13 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.19 3dl7 h ARG 177 Cb 0.17 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 3dl7 h ARG 177 CO -0.22 0.65 0.11 1.25 -1.51 0.00 0.00 179.97 180.25 3dl7 h LEU 178 N 1.01 0.76 -0.87 3.80 5.85 0.02 0.11 115.31 125.99 3dl7 h LEU 178 Ca 0.39 -0.14 -0.10 0.00 0.84 0.00 0.00 57.88 58.88 3dl7 h LEU 178 Cb 0.19 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 3dl7 h LEU 178 CO -0.18 0.76 -0.19 0.00 -0.34 0.00 0.00 178.44 178.49 3dl7 h ALA 179 N 1.34 1.04 -0.33 1.25 0.00 -0.21 0.10 119.26 122.45 3dl7 h ALA 179 Ca 0.17 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3dl7 h ALA 179 Cb 0.31 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3dl7 h ALA 179 CO 0.00 0.58 0.13 -0.07 0.00 0.00 0.00 179.25 179.89 3dl7 h LEU 180 N 0.55 0.45 -0.84 0.00 4.07 -0.44 -1.07 115.31 118.03 3dl7 h LEU 180 Ca 0.09 -0.16 -0.05 0.00 0.08 0.00 0.00 57.88 57.84 3dl7 h LEU 180 Cb 0.64 -0.12 -0.03 0.00 1.08 0.00 0.00 40.66 42.23 3dl7 h LEU 180 CO 0.05 0.49 0.29 -0.61 -1.08 0.00 0.00 178.44 177.58 3dl7 h GLN 181 N 0.39 1.15 -0.55 1.13 5.75 -0.50 -1.96 115.11 120.51 3dl7 h GLN 181 Ca 0.11 -0.21 0.05 0.00 -0.15 0.00 0.00 58.65 58.45 3dl7 h GLN 181 Cb 0.18 -0.18 -0.05 0.00 1.07 0.00 0.00 27.48 28.50 3dl7 h GLN 181 CO -0.01 0.94 0.29 2.35 -2.65 0.00 0.00 178.83 179.74 3dl7 h TRP 182 N 1.11 0.52 -0.36 3.99 7.01 -0.51 -1.86 115.95 125.86 3dl7 h TRP 182 Ca 0.25 0.02 0.02 0.00 2.11 0.00 0.00 58.89 61.30 3dl7 h TRP 182 Cb 0.23 -0.15 -0.03 0.00 -2.10 0.00 0.00 29.16 27.11 3dl7 h TRP 182 CO 0.02 0.25 0.19 0.28 -2.79 0.00 0.00 178.44 176.39 3dl7 h VAL 183 N 0.55 1.00 -0.52 2.65 2.07 -0.64 0.15 116.25 121.50 3dl7 h VAL 183 Ca 0.25 -0.13 0.10 0.00 0.82 0.00 0.00 66.70 67.73 3dl7 h VAL 183 Cb 0.15 0.58 -0.08 0.00 -1.52 0.00 0.00 31.29 30.42 3dl7 h VAL 183 CO -0.17 0.07 0.07 1.56 0.02 0.00 0.00 177.57 179.12 3dl7 h GLN 184 N 0.39 0.19 0.00 1.57 1.08 -0.87 0.83 115.11 118.30 3dl7 h GLN 184 Ca 0.15 -0.01 -0.14 0.00 -1.45 0.00 0.00 58.65 57.20 3dl7 h GLN 184 Cb 0.05 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 3dl7 h GLN 184 CO -0.10 0.12 -0.67 0.93 -0.95 0.00 0.00 178.83 178.17 3dl7 h GLU 185 N 0.19 0.00 0.00 1.46 5.08 -0.92 -3.40 114.58 116.99 3dl7 h GLU 185 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 3dl7 h GLU 185 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3dl7 h GLU 185 CO -0.38 0.67 -0.66 0.09 -1.00 0.00 0.00 179.01 177.73 3dl7 n ASN 186 N -3.47 3.32 0.22 1.42 3.02 0.00 -4.80 115.26 114.97 3dl7 n ASN 186 Ca 0.00 -0.11 0.07 0.00 -0.03 0.00 0.00 54.58 54.51 3dl7 n ASN 186 Cb 0.73 0.88 0.50 0.00 -0.61 0.00 0.00 39.78 41.27 3dl7 n ASN 186 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3dl7 h ILE 187 N 0.00 0.98 -0.63 2.41 6.09 -1.01 -2.52 117.51 122.82 3dl7 h ILE 187 Ca 0.00 -0.93 0.12 0.00 -1.37 0.00 0.00 64.86 62.68 3dl7 h ILE 187 Cb 0.00 1.53 -0.09 0.00 0.47 0.00 0.00 36.82 38.73 3dl7 h ILE 187 CO 0.00 0.25 0.17 0.00 -3.07 0.00 0.00 178.15 175.50 3dl7 h ALA 188 N 1.75 0.79 -0.94 0.18 0.00 -1.79 0.08 119.26 119.33 3dl7 h ALA 188 Ca -0.00 0.12 0.27 0.00 0.00 0.00 0.00 54.91 55.30 3dl7 h ALA 188 Cb 0.51 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 3dl7 h ALA 188 CO 0.03 -0.28 0.80 0.00 0.00 0.00 0.00 179.25 179.81 3dl7 h ALA 189 N 1.49 2.81 -0.02 0.00 0.00 -1.76 0.32 119.26 122.09 3dl7 h ALA 189 Ca 0.33 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3dl7 h ALA 189 Cb 0.49 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3dl7 h ALA 189 CO -0.40 -1.29 -0.03 1.19 0.00 0.00 0.00 179.25 178.73 3dl7 n PHE 190 N -3.87 0.00 -0.69 0.00 3.01 -0.10 -4.92 117.46 110.89 3dl7 n PHE 190 Ca 0.20 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.66 3dl7 n PHE 190 Cb 1.12 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.58 3dl7 n PHE 190 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3dl7 n GLY 191 N 1.27 0.58 3.90 1.37 0.00 0.11 -4.47 105.19 107.95 3dl7 n GLY 191 Ca 0.16 -0.64 -0.29 0.00 0.00 0.00 0.00 46.02 45.25 3dl7 n GLY 191 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dl7 s GLY 192 N -2.59 1.79 -0.44 -0.02 0.00 -0.49 -1.04 107.32 104.54 3dl7 s GLY 192 Ca 0.00 -0.44 -0.15 0.00 0.00 0.00 0.00 44.72 44.13 3dl7 s GLY 192 CO 0.00 -0.29 0.34 -0.35 0.00 0.00 0.00 173.10 172.80 3dl7 s ASP 193 N -3.39 6.10 0.39 1.64 -1.08 0.19 -3.52 116.67 117.00 3dl7 s ASP 193 Ca 0.47 -1.11 0.28 0.00 -0.52 0.00 0.00 52.55 51.67 3dl7 s ASP 193 Cb -0.10 -2.16 1.28 0.00 -1.46 0.00 0.00 42.92 40.48 3dl7 s ASP 193 CO 0.33 -0.54 1.84 1.55 0.52 0.00 0.00 175.17 178.88 3dl7 h PRO 194 N 8.67 0.00 -0.06 4.34 0.13 -1.89 -1.72 132.00 141.48 3dl7 h PRO 194 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3dl7 h PRO 194 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3dl7 h PRO 194 CO 0.79 0.00 0.00 -1.33 -0.23 0.00 0.00 178.00 177.23 3dl7 n MET 195 N -2.53 1.58 -3.43 0.86 2.81 -1.26 -4.30 117.12 110.85 3dl7 n MET 195 Ca 0.00 -0.85 -0.28 0.00 -1.81 0.00 0.00 57.70 54.77 3dl7 n MET 195 Cb 0.18 -1.45 -0.11 0.00 -0.71 0.00 0.00 33.22 31.14 3dl7 n MET 195 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3dl7 s SER 196 N -1.85 1.99 -0.20 7.83 0.15 -0.65 -4.93 113.70 116.04 3dl7 s SER 196 Ca 0.37 -2.80 -0.02 0.00 0.70 0.00 0.00 55.95 54.20 3dl7 s SER 196 Cb 0.20 -0.45 0.00 0.00 -1.71 0.00 0.00 66.02 64.05 3dl7 s SER 196 CO 0.31 -0.21 -0.10 -0.69 1.20 0.00 0.00 173.24 173.75 3dl7 s VAL 197 N 0.35 2.92 -0.22 4.45 1.01 -1.26 -0.69 120.40 126.97 3dl7 s VAL 197 Ca 0.28 -0.65 -0.06 0.00 0.00 0.00 0.00 61.98 61.55 3dl7 s VAL 197 Cb -0.05 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.00 3dl7 s VAL 197 CO -0.13 0.46 0.03 -0.89 0.00 0.00 0.00 175.10 174.58 3dl7 s THR 198 N 1.38 4.12 0.13 3.92 2.01 -0.14 -0.68 115.64 126.38 3dl7 s THR 198 Ca 0.05 -0.25 -0.27 0.00 0.31 0.00 0.00 61.69 61.53 3dl7 s THR 198 Cb -0.14 -2.89 -0.07 0.00 0.01 0.00 0.00 72.50 69.41 3dl7 s THR 198 CO -0.06 0.39 0.84 -0.76 -0.69 0.00 0.00 174.62 174.33 3dl7 s LEU 199 N 1.28 4.54 0.06 4.42 1.43 -0.32 -0.90 118.68 129.18 3dl7 s LEU 199 Ca 0.04 1.66 0.01 0.00 -1.03 0.00 0.00 54.13 54.81 3dl7 s LEU 199 Cb -0.15 -3.38 -0.03 0.00 0.03 0.00 0.00 46.19 42.66 3dl7 s LEU 199 CO 0.02 0.08 -0.06 0.72 0.23 0.00 0.00 176.35 177.34 3dl7 s PHE 200 N -0.56 0.69 -0.08 0.29 -0.71 -0.27 0.25 117.98 117.59 3dl7 s PHE 200 Ca 0.40 -0.75 -0.30 0.00 -1.04 0.00 0.00 56.93 55.24 3dl7 s PHE 200 Cb -0.23 -0.42 0.12 0.00 -1.21 0.00 0.00 43.02 41.28 3dl7 s PHE 200 CO 0.27 -0.17 0.98 0.20 -1.34 0.00 0.00 175.22 175.16 3dl7 s GLY 201 N -2.33 -0.38 -0.26 1.99 0.00 -1.08 -1.23 107.32 104.03 3dl7 s GLY 201 Ca 0.00 1.39 0.14 0.00 0.00 0.00 0.00 44.72 46.25 3dl7 s GLY 201 CO -0.03 0.56 1.16 -2.21 0.00 0.00 0.00 173.10 172.58 3dl7 n GLU 202 N 0.04 2.65 0.00 2.90 0.00 -1.22 -1.21 120.64 123.80 3dl7 n GLU 202 Ca -0.07 -3.77 0.00 0.00 0.00 0.00 0.00 57.16 53.31 3dl7 n GLU 202 Cb 0.60 -1.89 0.00 0.00 0.00 0.00 0.00 31.44 30.15 3dl7 n GLU 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3dl7 n ALA 204 N -0.65 0.00 -0.23 4.31 0.00 -1.26 -2.84 120.51 119.84 3dl7 n ALA 204 Ca 0.28 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.66 3dl7 n ALA 204 Cb 0.90 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.39 3dl7 n ALA 204 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3dl7 h GLY 205 N 0.00 0.92 0.80 0.00 0.00 -1.70 0.14 103.07 103.22 3dl7 h GLY 205 Ca 0.00 -0.37 0.02 0.00 0.00 0.00 0.00 47.33 46.99 3dl7 h GLY 205 CO 0.00 0.36 0.03 0.00 0.00 0.00 0.00 176.54 176.92 3dl7 h ALA 206 N 1.21 0.17 -0.45 3.60 0.00 -1.61 -0.47 119.26 121.70 3dl7 h ALA 206 Ca 0.23 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3dl7 h ALA 206 Cb -0.06 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3dl7 h ALA 206 CO -0.05 -0.41 0.29 0.00 0.00 0.00 0.00 179.25 179.08 3dl7 h ALA 207 N 1.13 1.66 -0.07 0.00 0.00 -1.58 -0.62 119.26 119.77 3dl7 h ALA 207 Ca 0.08 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3dl7 h ALA 207 Cb 0.08 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3dl7 h ALA 207 CO -0.11 0.31 0.01 0.77 0.00 0.00 0.00 179.25 180.23 3dl7 h SER 208 N 0.62 0.10 -0.56 0.00 0.02 -0.35 0.17 113.55 113.56 3dl7 h SER 208 Ca 0.16 -0.26 0.10 0.00 -0.84 0.00 0.00 61.79 60.96 3dl7 h SER 208 Cb -0.05 -0.03 -0.08 0.00 0.14 0.00 0.00 62.40 62.38 3dl7 h SER 208 CO -0.03 0.33 0.13 0.58 -1.14 0.00 0.00 176.83 176.70 3dl7 h VAL 209 N -0.13 0.70 -0.95 2.27 2.07 -0.56 0.77 116.25 120.42 3dl7 h VAL 209 Ca 0.02 -0.09 0.03 0.00 0.82 0.00 0.00 66.70 67.48 3dl7 h VAL 209 Cb 0.27 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 30.39 3dl7 h VAL 209 CO 0.00 0.05 0.62 1.23 0.02 0.00 0.00 177.57 179.49 3dl7 h GLY 210 N 0.27 1.37 1.75 2.17 0.00 -0.81 -0.39 103.07 107.43 3dl7 h GLY 210 Ca 0.28 -0.47 -0.11 0.00 0.00 0.00 0.00 47.33 47.04 3dl7 h GLY 210 CO -0.35 0.41 -0.39 -0.33 0.00 0.00 0.00 176.54 175.88 3dl7 h MET 211 N 1.19 0.28 -0.01 4.80 2.86 0.10 -1.17 114.93 122.99 3dl7 h MET 211 Ca 0.37 -0.13 -0.10 0.00 -2.06 0.00 0.00 59.70 57.78 3dl7 h MET 211 Cb 0.00 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 3dl7 h MET 211 CO -0.11 0.63 -0.47 0.45 1.06 0.00 0.00 176.91 178.47 3dl7 h HIS 212 N 0.24 0.02 -0.46 -0.22 3.86 -0.24 -2.02 115.15 116.32 3dl7 h HIS 212 Ca 0.02 -0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.18 3dl7 h HIS 212 Cb 0.79 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.24 3dl7 h HIS 212 CO 0.02 0.48 0.10 0.82 0.86 0.00 0.00 177.93 180.21 3dl7 h ILE 213 N 0.01 1.21 -0.60 2.45 2.04 -0.11 -3.11 117.51 119.39 3dl7 h ILE 213 Ca -0.00 -0.75 0.00 0.00 1.00 0.00 0.00 64.86 65.10 3dl7 h ILE 213 Cb 0.84 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 3dl7 h ILE 213 CO 0.06 0.28 0.00 0.18 0.00 0.00 0.00 178.15 178.67 3dl7 n LEU 214 N -4.29 5.28 -3.79 1.44 4.77 -0.54 -4.82 117.00 115.06 3dl7 n LEU 214 Ca 0.03 -2.73 -0.26 0.00 -0.03 0.00 0.00 56.01 53.01 3dl7 n LEU 214 Cb 0.22 -0.64 -0.17 0.00 -2.33 0.00 0.00 43.42 40.50 3dl7 n LEU 214 CO 0.39 0.71 -0.39 -0.55 -1.33 0.00 0.00 177.39 176.23 3dl7 s SER 215 N -0.88 2.52 0.16 -1.43 0.15 -0.81 -4.71 113.70 108.69 3dl7 s SER 215 Ca 0.53 -0.57 -0.16 0.00 0.70 0.00 0.00 55.95 56.45 3dl7 s SER 215 Cb 0.38 -0.65 0.08 0.00 -1.71 0.00 0.00 66.02 64.12 3dl7 s SER 215 CO 0.19 -0.24 1.75 0.25 1.20 0.00 0.00 173.24 176.39 3dl7 h LEU 216 N 8.23 0.12 -2.82 3.45 5.85 -1.85 -0.66 115.31 127.64 3dl7 h LEU 216 Ca -0.19 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.57 3dl7 h LEU 216 Cb 1.12 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.19 3dl7 h LEU 216 CO 0.33 0.10 0.04 -0.65 -0.34 0.00 0.00 178.44 177.93 3dl7 h PRO 217 N 0.27 0.00 0.02 5.25 0.11 -1.95 -1.55 132.00 134.16 3dl7 h PRO 217 Ca 0.18 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 66.05 3dl7 h PRO 217 Cb 0.16 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.25 3dl7 h PRO 217 CO -0.19 0.00 -1.16 0.77 -0.21 0.00 0.00 178.00 177.22 3dl7 h SER 218 N 0.00 0.06 -0.45 -2.05 0.02 -1.38 -3.38 113.55 106.37 3dl7 h SER 218 Ca 0.00 -0.07 0.12 0.00 -0.84 0.00 0.00 61.79 61.01 3dl7 h SER 218 Cb 0.08 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 3dl7 h SER 218 CO 0.00 1.05 0.32 0.03 -1.14 0.00 0.00 176.83 177.09 3dl7 h ARG 219 N 0.01 0.04 0.00 3.45 2.47 -1.08 -0.23 114.38 119.04 3dl7 h ARG 219 Ca -0.07 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.64 3dl7 h ARG 219 Cb 1.84 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 30.15 3dl7 h ARG 219 CO 0.13 0.03 0.00 -1.13 0.56 0.00 0.00 179.97 179.56 3dl7 n SER 220 N -4.42 0.00 -0.77 7.04 3.41 -1.26 -3.70 113.62 113.92 3dl7 n SER 220 Ca 0.08 -0.69 0.09 0.00 -0.26 0.00 0.00 58.87 58.09 3dl7 n SER 220 Cb 0.50 -0.08 0.12 0.00 -0.26 0.00 0.00 64.21 64.49 3dl7 n SER 220 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dl7 n LEU 221 N -1.08 2.73 -3.73 1.04 4.77 -0.10 -5.00 117.00 115.64 3dl7 n LEU 221 Ca 0.19 -1.30 -0.06 0.00 -0.03 0.00 0.00 56.01 54.81 3dl7 n LEU 221 Cb 0.13 -0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 3dl7 n LEU 221 CO 0.17 0.56 0.58 0.72 -1.33 0.00 0.00 177.39 178.09 3dl7 s PHE 222 N -1.30 -0.22 0.00 -1.77 -0.71 -1.24 -4.89 117.98 107.84 3dl7 s PHE 222 Ca 0.25 -0.11 0.00 0.00 -1.04 0.00 0.00 56.93 56.03 3dl7 s PHE 222 Cb 0.16 0.65 0.00 0.00 -1.21 0.00 0.00 43.02 42.61 3dl7 s PHE 222 CO 0.22 -0.96 0.00 0.72 -1.34 0.00 0.00 175.22 173.86 3dl7 n HIS 223 N -0.43 0.00 -3.79 3.49 8.25 0.15 -4.93 115.22 117.96 3dl7 n HIS 223 Ca -0.07 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.29 3dl7 n HIS 223 Cb 0.61 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.65 3dl7 n HIS 223 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3dl7 s ARG 224 N -1.45 0.84 -0.01 -0.41 0.52 -1.14 -4.28 118.95 113.01 3dl7 s ARG 224 Ca 0.00 -0.73 -0.04 0.00 -0.52 0.00 0.00 55.73 54.45 3dl7 s ARG 224 Cb 0.00 0.35 0.00 0.00 0.52 0.00 0.00 34.95 35.82 3dl7 s ARG 224 CO 0.00 -0.27 0.08 0.00 0.02 0.00 0.00 175.30 175.13 3dl7 s ALA 225 N -3.22 -0.19 -0.08 2.13 0.00 -0.99 -1.18 121.76 118.24 3dl7 s ALA 225 Ca -0.00 -0.03 0.03 0.00 0.00 0.00 0.00 51.96 51.96 3dl7 s ALA 225 Cb 0.02 -0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.13 3dl7 s ALA 225 CO -0.08 -0.12 -0.15 0.08 0.00 0.00 0.00 175.76 175.50 3dl7 s VAL 226 N -0.67 1.35 -0.25 0.00 1.01 0.14 -1.35 120.40 120.62 3dl7 s VAL 226 Ca -0.08 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.32 3dl7 s VAL 226 Cb -0.05 -1.22 0.06 0.00 0.00 0.00 0.00 36.38 35.18 3dl7 s VAL 226 CO 0.00 0.40 -0.07 -0.76 0.00 0.00 0.00 175.10 174.68 3dl7 s LEU 227 N 0.65 2.95 -0.29 3.92 1.02 0.42 -2.63 118.68 124.71 3dl7 s LEU 227 Ca -0.14 -1.30 -0.07 0.00 0.02 0.00 0.00 54.13 52.64 3dl7 s LEU 227 Cb -0.16 -1.32 0.00 0.00 0.02 0.00 0.00 46.19 44.73 3dl7 s LEU 227 CO 0.04 -0.23 0.09 -1.10 0.02 0.00 0.00 176.35 175.17 3dl7 s GLN 228 N 1.28 3.19 -1.42 1.70 -0.21 -0.35 -2.37 119.66 121.48 3dl7 s GLN 228 Ca -0.06 -0.79 -0.08 0.00 0.02 0.00 0.00 55.36 54.45 3dl7 s GLN 228 Cb -0.19 -3.38 0.04 0.00 1.00 0.00 0.00 33.01 30.48 3dl7 s GLN 228 CO -0.06 -0.41 0.93 0.43 -2.12 0.00 0.00 175.29 174.06 3dl7 n SER 229 N 4.89 -3.76 0.00 5.90 7.64 0.45 -4.15 113.62 124.59 3dl7 n SER 229 Ca -0.15 -0.74 0.00 0.00 1.01 0.00 0.00 58.87 58.99 3dl7 n SER 229 Cb 0.49 -4.20 0.00 0.00 -1.01 0.00 0.00 64.21 59.49 3dl7 n SER 229 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dl7 n GLY 230 N -1.67 0.75 3.20 0.23 0.00 -1.26 -4.78 105.19 101.65 3dl7 n GLY 230 Ca -0.09 -0.58 -0.09 0.00 0.00 0.00 0.00 46.02 45.26 3dl7 n GLY 230 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dl7 s THR 231 N -2.00 0.14 0.25 2.61 -4.23 -1.26 -4.22 115.64 106.92 3dl7 s THR 231 Ca 0.00 -1.12 0.08 0.00 -1.18 0.00 0.00 61.69 59.48 3dl7 s THR 231 Cb 0.00 -1.23 -0.04 0.00 1.34 0.00 0.00 72.50 72.57 3dl7 s THR 231 CO 0.00 -0.62 1.58 1.55 -0.54 0.00 0.00 174.62 176.59 3dl7 h PRO 232 N 2.95 0.08 -7.57 3.99 0.13 -1.83 -3.39 132.00 126.35 3dl7 h PRO 232 Ca -0.33 -0.06 -0.45 0.00 -0.87 0.00 0.00 66.00 64.29 3dl7 h PRO 232 Cb 1.20 0.01 0.14 0.00 0.13 0.00 0.00 31.00 32.47 3dl7 h PRO 232 CO 0.54 0.69 0.33 0.54 -0.23 0.00 0.00 178.00 179.87 3dl7 s ASN 233 N -6.86 3.34 0.00 1.44 4.22 -1.26 -4.50 114.94 111.31 3dl7 s ASN 233 Ca -0.02 0.75 0.00 0.00 -2.14 0.00 0.00 52.86 51.45 3dl7 s ASN 233 Cb 0.12 -1.17 0.00 0.00 1.28 0.00 0.00 41.25 41.49 3dl7 s ASN 233 CO 0.78 -2.64 0.00 0.61 -2.04 0.00 0.00 177.10 173.81 3dl7 n GLY 234 N -2.60 0.75 0.24 0.45 0.00 -1.26 -4.66 105.19 98.11 3dl7 n GLY 234 Ca 0.09 -2.06 0.15 0.00 0.00 0.00 0.00 46.02 44.20 3dl7 n GLY 234 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dl7 h PRO 235 N 0.00 0.00 0.00 1.61 0.13 -1.88 -3.34 132.00 128.52 3dl7 h PRO 235 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 3dl7 h PRO 235 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 3dl7 h PRO 235 CO 0.00 0.00 -1.39 -2.67 -0.23 0.00 0.00 178.00 173.71 3dl7 n TRP 236 N -3.01 0.00 0.16 1.56 4.27 -1.26 -4.74 117.44 114.42 3dl7 n TRP 236 Ca 0.02 0.00 0.02 0.00 -3.89 0.00 0.00 57.50 53.65 3dl7 n TRP 236 Cb 0.38 -0.21 0.27 0.00 -1.36 0.00 0.00 31.31 30.38 3dl7 n TRP 236 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3dl7 h ALA 237 N 0.68 1.09 -2.34 -1.67 0.00 -1.83 -3.44 119.26 111.74 3dl7 h ALA 237 Ca -0.03 -0.45 -0.34 0.00 0.00 0.00 0.00 54.91 54.09 3dl7 h ALA 237 Cb 0.54 -0.08 -0.14 0.00 0.00 0.00 0.00 17.79 18.11 3dl7 h ALA 237 CO 0.00 0.61 -0.62 0.95 0.00 0.00 0.00 179.25 180.20 3dl7 s THR 238 N -3.76 0.53 0.06 0.00 -4.23 -1.26 -3.71 115.64 103.27 3dl7 s THR 238 Ca -0.01 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.47 3dl7 s THR 238 Cb 0.13 -2.60 -0.03 0.00 1.34 0.00 0.00 72.50 71.33 3dl7 s THR 238 CO 0.73 -0.03 0.02 0.68 -0.54 0.00 0.00 174.62 175.49 3dl7 s VAL 239 N -3.77 0.20 0.67 2.29 -7.23 -0.81 -4.98 120.40 106.77 3dl7 s VAL 239 Ca 0.37 -1.64 -0.11 0.00 -1.81 0.00 0.00 61.98 58.79 3dl7 s VAL 239 Cb 0.08 -1.46 -0.01 0.00 0.56 0.00 0.00 36.38 35.55 3dl7 s VAL 239 CO 0.13 -0.91 1.05 -0.94 -0.31 0.00 0.00 175.10 174.13 3dl7 s SER 240 N -2.88 5.61 0.27 4.85 1.04 -1.26 -0.29 113.70 121.04 3dl7 s SER 240 Ca 0.06 1.59 0.01 0.00 0.48 0.00 0.00 55.95 58.09 3dl7 s SER 240 Cb 0.07 -2.49 0.63 0.00 0.10 0.00 0.00 66.02 64.33 3dl7 s SER 240 CO -0.10 -1.29 1.69 0.00 0.98 0.00 0.00 173.24 174.52 3dl7 h ALA 241 N -0.52 1.26 -0.51 5.32 0.00 -1.91 -1.70 119.26 121.20 3dl7 h ALA 241 Ca -0.44 0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 3dl7 h ALA 241 Cb 1.21 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 3dl7 h ALA 241 CO 0.58 -0.34 0.07 0.78 0.00 0.00 0.00 179.25 180.34 3dl7 h GLY 242 N 0.35 0.93 2.00 0.00 0.00 -1.92 -1.83 103.07 102.60 3dl7 h GLY 242 Ca 0.51 -0.63 -0.10 0.00 0.00 0.00 0.00 47.33 47.11 3dl7 h GLY 242 CO -0.53 0.58 -0.49 -2.09 0.00 0.00 0.00 176.54 174.02 3dl7 h GLU 243 N 0.73 0.00 0.20 4.80 4.57 -1.87 -2.28 114.58 120.74 3dl7 h GLU 243 Ca 0.15 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.32 3dl7 h GLU 243 Cb 0.43 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.02 3dl7 h GLU 243 CO 0.01 0.49 -0.10 0.00 -1.18 0.00 0.00 179.01 178.24 3dl7 h ALA 244 N 1.51 -0.27 -0.88 2.92 0.00 -1.07 -2.05 119.26 119.41 3dl7 h ALA 244 Ca -0.00 -0.20 0.17 0.00 0.00 0.00 0.00 54.91 54.88 3dl7 h ALA 244 Cb 1.12 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.91 3dl7 h ALA 244 CO 0.06 -0.45 0.45 -0.09 0.00 0.00 0.00 179.25 179.23 3dl7 h ARG 245 N -0.69 0.56 -0.05 0.00 2.43 -1.33 0.13 114.38 115.43 3dl7 h ARG 245 Ca -0.03 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 3dl7 h ARG 245 Cb 0.48 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 3dl7 h ARG 245 CO 0.05 0.37 -0.01 -0.09 -1.51 0.00 0.00 179.97 178.78 3dl7 h ARG 246 N 0.58 0.10 -0.72 0.20 2.43 -1.36 -0.79 114.38 114.82 3dl7 h ARG 246 Ca 0.51 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.61 3dl7 h ARG 246 Cb 0.81 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.32 3dl7 h ARG 246 CO -0.41 0.41 0.30 0.00 -1.51 0.00 0.00 179.97 178.75 3dl7 h ARG 247 N -0.22 1.05 0.10 0.20 3.08 -0.60 -1.06 114.38 116.93 3dl7 h ARG 247 Ca 0.01 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 59.89 3dl7 h ARG 247 Cb 0.37 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.24 3dl7 h ARG 247 CO 0.00 0.85 -0.05 0.00 -1.07 0.00 0.00 179.97 179.70 3dl7 h ALA 248 N 1.29 -0.14 -0.40 0.04 0.00 -0.87 -0.09 119.26 119.10 3dl7 h ALA 248 Ca 0.24 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3dl7 h ALA 248 Cb 0.18 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3dl7 h ALA 248 CO -0.02 -0.47 0.18 1.79 0.00 0.00 0.00 179.25 180.73 3dl7 h THR 249 N -0.35 1.15 -0.15 0.00 1.35 -1.07 0.59 112.91 114.42 3dl7 h THR 249 Ca -0.01 -0.43 -0.13 0.00 -0.55 0.00 0.00 66.41 65.28 3dl7 h THR 249 Cb 0.29 0.65 -0.01 0.00 -1.73 0.00 0.00 68.15 67.36 3dl7 h THR 249 CO 0.02 0.17 -0.49 0.25 -0.25 0.00 0.00 175.52 175.22 3dl7 h LEU 250 N 0.56 0.42 -0.21 3.87 5.85 -1.01 0.01 115.31 124.79 3dl7 h LEU 250 Ca 0.14 -0.21 -0.17 0.00 0.84 0.00 0.00 57.88 58.48 3dl7 h LEU 250 Cb 0.09 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.00 3dl7 h LEU 250 CO -0.02 0.84 -0.53 0.25 -0.34 0.00 0.00 178.44 178.65 3dl7 h LEU 251 N 0.31 0.84 -0.19 2.25 5.85 -0.46 -0.86 115.31 123.04 3dl7 h LEU 251 Ca 0.02 -0.57 0.05 0.00 0.84 0.00 0.00 57.88 58.22 3dl7 h LEU 251 Cb 0.97 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 41.70 3dl7 h LEU 251 CO 0.08 1.26 -0.23 0.00 -0.34 0.00 0.00 178.44 179.21 3dl7 h ALA 252 N 0.61 -0.15 -0.33 1.25 0.00 -0.71 -1.47 119.26 118.44 3dl7 h ALA 252 Ca -0.01 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.02 3dl7 h ALA 252 Cb 1.15 0.47 -0.05 0.00 0.00 0.00 0.00 17.79 19.35 3dl7 h ALA 252 CO 0.12 -0.67 -0.00 -0.09 0.00 0.00 0.00 179.25 178.60 3dl7 h ARG 253 N -0.26 0.09 0.00 0.00 2.43 -0.96 0.13 114.38 115.82 3dl7 h ARG 253 Ca 0.12 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 3dl7 h ARG 253 Cb 0.44 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 3dl7 h ARG 253 CO -0.34 0.06 0.00 1.28 -1.51 0.00 0.00 179.97 179.46 3dl7 n LEU 254 N -5.18 0.45 -0.09 3.80 4.77 -0.33 -1.80 117.00 118.63 3dl7 n LEU 254 Ca 0.01 0.70 0.07 0.00 -0.03 0.00 0.00 56.01 56.76 3dl7 n LEU 254 Cb 0.17 -0.74 0.10 0.00 -2.33 0.00 0.00 43.42 40.62 3dl7 n LEU 254 CO 0.22 -0.82 0.52 1.33 -1.33 0.00 0.00 177.39 177.31 3dl7 n VAL 255 N -2.10 1.50 -1.16 4.08 0.24 -0.78 -5.00 118.33 115.11 3dl7 n VAL 255 Ca -0.01 -1.76 0.00 0.00 -2.04 0.00 0.00 64.34 60.54 3dl7 n VAL 255 Cb 0.05 0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.42 3dl7 n VAL 255 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3dl7 n GLY 256 N -1.09 0.92 2.28 7.63 0.00 -0.74 -5.05 105.19 109.14 3dl7 n GLY 256 Ca 0.11 -0.58 -0.20 0.00 0.00 0.00 0.00 46.02 45.35 3dl7 n GLY 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dl7 n ASN 265 N -1.20 0.00 0.30 0.00 2.85 -1.26 -4.82 115.26 111.14 3dl7 n ASN 265 Ca -0.13 0.75 -0.16 0.00 -0.11 0.00 0.00 54.58 54.93 3dl7 n ASN 265 Cb 0.40 -1.12 -0.08 0.00 1.24 0.00 0.00 39.78 40.22 3dl7 n ASN 265 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 3dl7 h ASP 266 N 1.93 -0.65 -0.85 1.20 3.32 -2.01 -2.70 116.42 116.67 3dl7 h ASP 266 Ca 0.00 -0.03 0.21 0.00 0.02 0.00 0.00 57.03 57.23 3dl7 h ASP 266 Cb 0.00 0.17 -0.15 0.00 0.22 0.00 0.00 39.33 39.57 3dl7 h ASP 266 CO 0.00 -0.36 0.03 0.74 -1.72 0.00 0.00 179.24 177.94 3dl7 h THR 267 N -0.92 0.24 -0.30 0.35 2.02 -2.01 0.68 112.91 112.96 3dl7 h THR 267 Ca -0.08 -0.03 -0.12 0.00 0.77 0.00 0.00 66.41 66.95 3dl7 h THR 267 Cb 0.64 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 3dl7 h THR 267 CO 0.13 0.02 -0.27 -0.33 0.37 0.00 0.00 175.52 175.43 3dl7 h GLU 268 N 0.09 0.72 -0.10 6.66 5.08 -1.98 -0.87 114.58 124.18 3dl7 h GLU 268 Ca 0.49 -0.37 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 3dl7 h GLU 268 Cb 0.92 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.17 3dl7 h GLU 268 CO -0.75 0.99 0.04 1.25 -1.00 0.00 0.00 179.01 179.53 3dl7 h LEU 269 N 0.47 0.14 -0.73 1.33 6.46 -0.86 -0.55 115.31 121.58 3dl7 h LEU 269 Ca 0.05 -0.17 -0.02 0.00 -0.12 0.00 0.00 57.88 57.62 3dl7 h LEU 269 Cb 0.84 -0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.70 3dl7 h LEU 269 CO 0.07 0.27 0.36 0.40 -0.62 0.00 0.00 178.44 178.92 3dl7 h ILE 270 N -0.01 1.23 -0.91 4.05 2.04 -0.90 -0.44 117.51 122.58 3dl7 h ILE 270 Ca 0.03 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.26 3dl7 h ILE 270 Cb 0.18 0.32 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 3dl7 h ILE 270 CO -0.00 0.27 0.58 0.00 0.00 0.00 0.00 178.15 179.00 3dl7 h ALA 271 N 1.18 1.15 -0.46 1.87 0.00 -1.01 -0.47 119.26 121.52 3dl7 h ALA 271 Ca 0.25 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 3dl7 h ALA 271 Cb 0.10 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3dl7 h ALA 271 CO -0.03 0.57 0.08 0.00 0.00 0.00 0.00 179.25 179.87 3dl7 h LEU 273 N 0.62 0.93 -1.56 0.00 3.38 -0.73 -2.08 115.31 115.87 3dl7 h LEU 273 Ca 0.14 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3dl7 h LEU 273 Cb 0.37 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3dl7 h LEU 273 CO 0.01 0.66 0.00 0.03 0.09 0.00 0.00 178.44 179.23 3dl7 h ARG 274 N 1.09 0.00 -0.07 1.13 3.08 -0.78 -2.32 114.38 116.51 3dl7 h ARG 274 Ca 0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.36 3dl7 h ARG 274 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.98 3dl7 h ARG 274 CO -0.08 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.07 3dl7 n THR 275 N -2.55 0.08 -3.54 2.04 -2.24 -0.78 -4.90 114.28 102.39 3dl7 n THR 275 Ca -0.00 -0.33 -0.37 0.00 -2.27 0.00 0.00 64.05 61.08 3dl7 n THR 275 Cb 0.14 0.62 -0.07 0.00 -2.10 0.00 0.00 70.33 68.92 3dl7 n THR 275 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3dl7 s ARG 276 N -1.92 4.19 0.35 -0.78 1.81 -0.88 -5.05 118.95 116.67 3dl7 s ARG 276 Ca 0.35 0.13 -0.24 0.00 -1.72 0.00 0.00 55.73 54.26 3dl7 s ARG 276 Cb 0.20 -3.40 -0.15 0.00 -0.45 0.00 0.00 34.95 31.16 3dl7 s ARG 276 CO 0.31 0.30 0.41 -2.30 -0.68 0.00 0.00 175.30 173.34 3dl7 n PRO 277 N 3.34 0.27 -0.21 3.54 -0.01 -1.26 -4.85 135.00 135.83 3dl7 n PRO 277 Ca -0.12 0.10 0.01 0.00 -0.01 0.00 0.00 63.50 63.48 3dl7 n PRO 277 Cb 0.52 -1.22 0.12 0.00 -0.01 0.00 0.00 33.50 32.91 3dl7 n PRO 277 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 3dl7 h ALA 278 N 0.77 0.75 0.00 3.55 0.00 -1.97 -2.41 119.26 119.96 3dl7 h ALA 278 Ca -0.36 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 3dl7 h ALA 278 Cb 1.42 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.38 3dl7 h ALA 278 CO 0.52 -0.30 -0.13 0.37 0.00 0.00 0.00 179.25 179.72 3dl7 h GLN 279 N 0.28 0.00 -0.35 0.00 5.75 -1.99 -2.08 115.11 116.72 3dl7 h GLN 279 Ca 0.33 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.82 3dl7 h GLN 279 Cb 0.49 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.02 3dl7 h GLN 279 CO -0.41 0.13 0.19 -0.44 -2.65 0.00 0.00 178.83 175.66 3dl7 h ASP 280 N 0.00 0.44 -0.38 -0.69 3.32 -1.77 0.38 116.42 117.71 3dl7 h ASP 280 Ca -0.00 -0.09 0.01 0.00 0.02 0.00 0.00 57.03 56.97 3dl7 h ASP 280 Cb 0.32 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 3dl7 h ASP 280 CO 0.02 0.40 0.25 -0.07 -1.72 0.00 0.00 179.24 178.12 3dl7 h LEU 281 N 0.45 0.43 -1.69 1.55 4.07 -1.44 -2.86 115.31 115.81 3dl7 h LEU 281 Ca 0.12 -0.01 -0.04 0.00 0.08 0.00 0.00 57.88 58.04 3dl7 h LEU 281 Cb 0.06 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 41.69 3dl7 h LEU 281 CO -0.02 0.31 -0.17 0.58 -1.08 0.00 0.00 178.44 178.06 3dl7 h VAL 282 N 0.51 1.04 -0.13 1.22 2.07 -1.21 -2.39 116.25 117.37 3dl7 h VAL 282 Ca 0.14 -0.61 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 3dl7 h VAL 282 Cb -0.05 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 3dl7 h VAL 282 CO -0.04 0.17 0.03 0.44 0.02 0.00 0.00 177.57 178.19 3dl7 h ASP 283 N 0.00 0.15 -0.08 0.57 3.32 -0.68 -3.15 116.42 116.56 3dl7 h ASP 283 Ca -0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3dl7 h ASP 283 Cb 0.32 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.83 3dl7 h ASP 283 CO 0.02 0.17 0.00 1.41 -1.72 0.00 0.00 179.24 179.12 3dl7 n HIS 284 N -4.46 0.10 -0.20 4.55 8.25 -1.02 -4.71 115.22 117.74 3dl7 n HIS 284 Ca -0.01 -0.33 0.00 0.00 -0.26 0.00 0.00 57.72 57.12 3dl7 n HIS 284 Cb 0.13 -0.03 0.11 0.00 1.12 0.00 0.00 29.99 31.32 3dl7 n HIS 284 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 3dl7 h GLU 285 N 0.68 0.37 -0.73 -0.41 4.81 -1.39 -2.31 114.58 115.60 3dl7 h GLU 285 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3dl7 h GLU 285 Cb 0.43 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.73 3dl7 h GLU 285 CO 0.00 0.24 0.00 0.91 -0.73 0.00 0.00 179.01 179.43 3dl7 n TRP 286 N -5.02 0.82 -0.73 0.92 7.02 -1.26 -3.82 117.44 115.37 3dl7 n TRP 286 Ca 0.09 -0.30 0.07 0.00 -1.02 0.00 0.00 57.50 56.34 3dl7 n TRP 286 Cb 0.28 -0.23 0.14 0.00 -2.42 0.00 0.00 31.31 29.08 3dl7 n TRP 286 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 3dl7 n HIS 287 N 0.30 0.25 0.33 -5.99 8.25 -0.87 -4.64 115.22 112.85 3dl7 n HIS 287 Ca 0.12 -0.82 0.04 0.00 -0.26 0.00 0.00 57.72 56.80 3dl7 n HIS 287 Cb 0.59 -0.15 0.02 0.00 1.12 0.00 0.00 29.99 31.57 3dl7 n HIS 287 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 3dl7 n VAL 288 N -0.85 0.00 -2.30 1.59 0.24 -1.25 -5.02 118.33 110.74 3dl7 n VAL 288 Ca 0.13 -0.46 -0.41 0.00 -2.04 0.00 0.00 64.34 61.56 3dl7 n VAL 288 Cb 0.59 1.13 -0.03 0.00 -1.47 0.00 0.00 33.84 34.06 3dl7 n VAL 288 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3dl7 s LEU 289 N -1.03 4.43 0.56 1.34 1.43 -1.26 -4.85 118.68 119.31 3dl7 s LEU 289 Ca 0.08 2.31 0.27 0.00 -1.03 0.00 0.00 54.13 55.76 3dl7 s LEU 289 Cb 0.06 -3.61 1.66 0.00 0.03 0.00 0.00 46.19 44.34 3dl7 s LEU 289 CO 0.14 -0.44 2.20 1.55 0.23 0.00 0.00 176.35 180.03 3dl7 h PRO 290 N 5.28 0.00 -3.68 1.29 0.13 -2.00 -3.44 132.00 129.58 3dl7 h PRO 290 Ca -0.45 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.62 3dl7 h PRO 290 Cb 1.21 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.24 3dl7 h PRO 290 CO 0.76 0.03 -0.15 -0.65 -0.23 0.00 0.00 178.00 177.75 3dl7 s GLN 291 N -4.58 1.44 0.16 0.86 1.11 -1.26 -5.12 119.66 112.26 3dl7 s GLN 291 Ca -0.05 -1.20 -0.31 0.00 0.01 0.00 0.00 55.36 53.81 3dl7 s GLN 291 Cb 0.15 0.45 -0.11 0.00 -1.01 0.00 0.00 33.01 32.49 3dl7 s GLN 291 CO 0.57 -0.58 1.81 -1.91 0.01 0.00 0.00 175.29 175.19 3dl7 n GLU 292 N -0.34 2.82 -3.85 2.91 2.13 -1.26 -4.95 120.64 118.10 3dl7 n GLU 292 Ca -0.04 1.02 -0.09 0.00 0.66 0.00 0.00 57.16 58.72 3dl7 n GLU 292 Cb 0.62 -2.91 -0.04 0.00 0.27 0.00 0.00 31.44 29.39 3dl7 n GLU 292 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 3dl7 s SER 293 N 2.21 -0.20 0.28 4.31 1.04 -1.26 -4.68 113.70 115.40 3dl7 s SER 293 Ca 0.79 -0.65 0.07 0.00 0.48 0.00 0.00 55.95 56.64 3dl7 s SER 293 Cb -0.48 0.61 -0.06 0.00 0.10 0.00 0.00 66.02 66.19 3dl7 s SER 293 CO 0.35 -1.14 -0.07 0.27 0.98 0.00 0.00 173.24 173.64 3dl7 s ILE 294 N -3.93 1.72 -1.42 -1.02 -4.36 -1.06 -4.82 121.20 106.31 3dl7 s ILE 294 Ca 0.14 -2.14 -0.09 0.00 -0.26 0.00 0.00 60.65 58.30 3dl7 s ILE 294 Cb -0.02 -2.44 0.05 0.00 1.25 0.00 0.00 42.46 41.31 3dl7 s ILE 294 CO 0.03 -0.31 0.64 0.33 0.24 0.00 0.00 174.94 175.87 3dl7 n PHE 295 N -0.59 -1.97 -4.00 1.37 -0.00 -1.26 -4.83 117.46 106.17 3dl7 n PHE 295 Ca -0.05 0.58 -0.13 0.00 -0.00 0.00 0.00 57.45 57.85 3dl7 n PHE 295 Cb 0.63 -3.65 -0.13 0.00 -0.00 0.00 0.00 39.48 36.33 3dl7 n PHE 295 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.76 177.26 3dl7 s ARG 296 N -6.05 0.25 -0.01 -4.13 6.06 -1.26 -4.69 118.95 109.11 3dl7 s ARG 296 Ca 0.43 -0.24 -0.02 0.00 -2.50 0.00 0.00 55.73 53.40 3dl7 s ARG 296 Cb -0.21 -0.15 0.00 0.00 0.06 0.00 0.00 34.95 34.65 3dl7 s ARG 296 CO 0.53 0.03 0.04 -0.06 -2.50 0.00 0.00 175.30 173.35 3dl7 s PHE 297 N -0.43 -0.03 0.10 5.12 0.08 -1.26 -5.05 117.98 116.51 3dl7 s PHE 297 Ca -0.03 0.08 -0.13 0.00 0.12 0.00 0.00 56.93 56.96 3dl7 s PHE 297 Cb -0.03 0.00 -0.13 0.00 -0.57 0.00 0.00 43.02 42.29 3dl7 s PHE 297 CO -0.00 -0.04 1.34 0.77 -0.10 0.00 0.00 175.22 177.19 3dl7 h SER 298 N 5.96 0.89 -3.48 1.36 0.02 -1.91 -3.41 113.55 112.98 3dl7 h SER 298 Ca -0.25 -0.58 -0.61 0.00 -0.84 0.00 0.00 61.79 59.51 3dl7 h SER 298 Cb 1.21 -0.26 -0.39 0.00 0.14 0.00 0.00 62.40 63.10 3dl7 h SER 298 CO 0.48 1.31 -0.76 -0.36 -1.14 0.00 0.00 176.83 176.36 3dl7 s PHE 299 N -3.93 2.46 0.22 3.45 0.08 -1.26 -5.01 117.98 113.99 3dl7 s PHE 299 Ca -0.11 -2.02 0.01 0.00 0.12 0.00 0.00 56.93 54.93 3dl7 s PHE 299 Cb 0.09 -1.93 -0.05 0.00 -0.57 0.00 0.00 43.02 40.56 3dl7 s PHE 299 CO 0.88 -0.84 0.07 0.14 -0.10 0.00 0.00 175.22 175.37 3dl7 s VAL 300 N 1.36 0.51 0.67 -0.44 -7.23 -1.26 -4.56 120.40 109.45 3dl7 s VAL 300 Ca 0.03 -1.99 -0.17 0.00 -1.81 0.00 0.00 61.98 58.05 3dl7 s VAL 300 Cb -0.18 -2.45 -0.03 0.00 0.56 0.00 0.00 36.38 34.28 3dl7 s VAL 300 CO -0.13 -0.16 0.77 -2.65 -0.31 0.00 0.00 175.10 172.62 3dl7 n PRO 301 N -0.36 0.54 -5.24 4.82 -0.02 -1.24 -4.74 135.00 128.75 3dl7 n PRO 301 Ca -0.02 0.23 -0.32 0.00 -2.02 0.00 0.00 63.50 61.37 3dl7 n PRO 301 Cb 0.65 -2.01 -0.16 0.00 -0.02 0.00 0.00 33.50 31.96 3dl7 n PRO 301 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3dl7 s VAL 302 N -1.76 2.10 -0.54 -1.45 0.11 -1.26 -1.93 120.40 115.68 3dl7 s VAL 302 Ca 0.71 -1.04 -0.27 0.00 -2.93 0.00 0.00 61.98 58.44 3dl7 s VAL 302 Cb -0.38 -1.77 -0.00 0.00 -1.53 0.00 0.00 36.38 32.70 3dl7 s VAL 302 CO 0.52 0.57 1.61 -0.69 -3.33 0.00 0.00 175.10 173.78 3dl7 s VAL 303 N -0.10 3.60 -0.42 2.04 1.01 0.60 -4.65 120.40 122.48 3dl7 s VAL 303 Ca -0.05 0.48 0.06 0.00 0.00 0.00 0.00 61.98 62.47 3dl7 s VAL 303 Cb -0.14 -4.17 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 3dl7 s VAL 303 CO 0.04 -0.99 0.37 -0.90 0.00 0.00 0.00 175.10 173.63 3dl7 n ASP 304 N 10.68 0.62 0.00 3.32 5.75 -1.21 -3.07 116.55 132.64 3dl7 n ASP 304 Ca 0.16 -0.81 0.00 0.00 -0.01 0.00 0.00 54.79 54.13 3dl7 n ASP 304 Cb 0.50 0.72 0.00 0.00 -1.03 0.00 0.00 41.12 41.31 3dl7 n ASP 304 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dl7 n GLY 305 N 0.92 0.53 0.16 6.12 0.00 -0.14 -4.82 105.19 107.96 3dl7 n GLY 305 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3dl7 n GLY 305 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3dl7 n ASP 306 N -0.15 0.00 0.03 1.61 2.03 -1.26 -4.50 116.55 114.31 3dl7 n ASP 306 Ca 0.00 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.19 3dl7 n ASP 306 Cb 0.08 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.40 3dl7 n ASP 306 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 3dl7 h PHE 307 N 0.00 0.00 -3.40 -0.67 3.04 -1.91 -3.34 116.94 110.65 3dl7 h PHE 307 Ca 0.00 -0.00 -0.72 0.00 3.98 0.00 0.00 57.97 61.23 3dl7 h PHE 307 Cb 0.00 -0.00 -0.28 0.00 2.56 0.00 0.00 35.95 38.23 3dl7 h PHE 307 CO 0.00 0.08 -0.44 -0.51 -2.02 0.00 0.00 178.31 175.42 3dl7 s LEU 308 N -10.03 5.32 0.54 0.59 1.43 -1.26 -4.58 118.68 110.69 3dl7 s LEU 308 Ca -0.13 -1.58 0.36 0.00 -1.03 0.00 0.00 54.13 51.74 3dl7 s LEU 308 Cb 0.05 -2.01 1.73 0.00 0.03 0.00 0.00 46.19 46.00 3dl7 s LEU 308 CO 0.66 -0.58 2.08 0.77 0.23 0.00 0.00 176.35 179.51 3dl7 h SER 309 N 8.45 0.00 -2.74 2.29 4.64 -1.79 -0.34 113.55 124.06 3dl7 h SER 309 Ca -0.23 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.02 3dl7 h SER 309 Cb 1.08 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.17 3dl7 h SER 309 CO 0.79 0.00 0.14 -0.67 -0.87 0.00 0.00 176.83 176.22 3dl7 n ASP 310 N -2.90 -1.62 -4.75 4.97 -0.08 -1.26 -4.49 116.55 106.42 3dl7 n ASP 310 Ca -0.01 -2.29 -0.36 0.00 -1.51 0.00 0.00 54.79 50.62 3dl7 n ASP 310 Cb 0.17 2.74 0.04 0.00 2.34 0.00 0.00 41.12 46.42 3dl7 n ASP 310 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 3dl7 s THR 311 N -2.40 2.44 0.22 5.18 -4.23 -1.26 -4.82 115.64 110.77 3dl7 s THR 311 Ca 0.15 0.28 -0.12 0.00 -1.18 0.00 0.00 61.69 60.82 3dl7 s THR 311 Cb -0.03 -3.12 0.24 0.00 1.34 0.00 0.00 72.50 70.94 3dl7 s THR 311 CO 0.11 -0.05 1.63 -0.65 -0.54 0.00 0.00 174.62 175.12 3dl7 h PRO 312 N 0.88 0.04 -0.30 3.99 0.11 -1.97 -0.10 132.00 134.64 3dl7 h PRO 312 Ca -0.51 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.66 3dl7 h PRO 312 Cb 1.31 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.36 3dl7 h PRO 312 CO 0.55 0.02 -0.04 0.93 -0.21 0.00 0.00 178.00 179.26 3dl7 h GLU 313 N 0.04 0.04 -0.90 1.05 4.39 -1.92 0.25 114.58 117.54 3dl7 h GLU 313 Ca 0.33 -0.00 0.07 0.00 0.34 0.00 0.00 59.36 60.11 3dl7 h GLU 313 Cb 0.54 -0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 29.11 3dl7 h GLU 313 CO -0.64 0.03 0.56 0.00 -1.16 0.00 0.00 179.01 177.79 3dl7 h ALA 314 N 1.28 1.26 0.00 3.43 0.00 -1.76 -1.74 119.26 121.73 3dl7 h ALA 314 Ca 0.14 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.87 3dl7 h ALA 314 Cb 0.21 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3dl7 h ALA 314 CO -0.27 0.27 -0.84 -0.07 0.00 0.00 0.00 179.25 178.34 3dl7 h LEU 315 N 0.98 0.03 0.00 0.00 3.38 0.93 -2.94 115.31 117.69 3dl7 h LEU 315 Ca 0.40 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 58.22 3dl7 h LEU 315 Cb 0.24 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3dl7 h LEU 315 CO -0.20 0.86 -0.72 0.16 0.09 0.00 0.00 178.44 178.63 3dl7 h ILE 316 N 0.01 0.85 -0.11 1.22 3.07 -0.44 -2.50 117.51 119.61 3dl7 h ILE 316 Ca -0.01 -2.26 -0.12 0.00 1.55 0.00 0.00 64.86 64.02 3dl7 h ILE 316 Cb 1.48 2.37 -0.01 0.00 -0.27 0.00 0.00 36.82 40.39 3dl7 h ILE 316 CO 0.11 0.48 -0.47 0.78 -1.05 0.00 0.00 178.15 178.00 3dl7 h ASN 317 N 0.00 0.31 -0.01 2.16 2.35 -1.26 -3.33 115.58 115.80 3dl7 h ASN 317 Ca -0.04 -0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.57 3dl7 h ASN 317 Cb 1.45 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.73 3dl7 h ASN 317 CO 0.07 0.74 -0.05 0.35 -1.65 0.00 0.00 177.43 176.89 3dl7 n THR 318 N -3.98 0.00 -1.88 2.81 -2.24 -1.12 -5.03 114.28 102.84 3dl7 n THR 318 Ca -0.02 -0.47 -0.31 0.00 -2.27 0.00 0.00 64.05 60.98 3dl7 n THR 318 Cb 0.53 1.16 0.01 0.00 -2.10 0.00 0.00 70.33 69.94 3dl7 n THR 318 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3dl7 s GLY 319 N -0.88 1.66 -0.20 3.38 0.00 -0.94 -5.06 107.32 105.27 3dl7 s GLY 319 Ca 0.09 -0.12 -0.05 0.00 0.00 0.00 0.00 44.72 44.64 3dl7 s GLY 319 CO 0.14 0.16 0.00 -0.35 0.00 0.00 0.00 173.10 173.05 3dl7 s ASP 320 N -4.20 4.83 -0.15 1.64 2.15 -1.26 -4.87 116.67 114.81 3dl7 s ASP 320 Ca 0.55 -0.21 0.15 0.00 0.43 0.00 0.00 52.55 53.47 3dl7 s ASP 320 Cb -0.11 -1.83 0.39 0.00 -0.30 0.00 0.00 42.92 41.07 3dl7 s ASP 320 CO 0.54 0.06 1.19 0.49 -0.17 0.00 0.00 175.17 177.28 3dl7 n PHE 321 N 4.29 0.00 -0.10 -5.34 3.72 -0.51 -4.87 117.46 114.65 3dl7 n PHE 321 Ca -0.17 -1.19 -0.07 0.00 -0.05 0.00 0.00 57.45 55.97 3dl7 n PHE 321 Cb 0.52 -0.21 -0.01 0.00 -0.94 0.00 0.00 39.48 38.83 3dl7 n PHE 321 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 3dl7 h GLN 322 N 0.84 -0.24 -2.04 -1.08 1.08 -1.73 -2.70 115.11 109.24 3dl7 h GLN 322 Ca -0.04 0.02 -0.75 0.00 -1.45 0.00 0.00 58.65 56.42 3dl7 h GLN 322 Cb 1.19 0.05 -0.30 0.00 -0.05 0.00 0.00 27.48 28.38 3dl7 h GLN 322 CO 0.02 -0.16 0.76 -0.25 -0.95 0.00 0.00 178.83 178.25 3dl7 n ASP 323 N -5.41 6.99 -3.80 1.46 8.00 -1.26 -4.59 116.55 117.94 3dl7 n ASP 323 Ca 0.01 -3.77 -0.18 0.00 0.71 0.00 0.00 54.79 51.56 3dl7 n ASP 323 Cb 0.33 -1.00 -0.16 0.00 -0.02 0.00 0.00 41.12 40.26 3dl7 n ASP 323 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3dl7 s LEU 324 N -4.06 1.02 -0.10 0.64 2.96 -1.13 -5.01 118.68 113.00 3dl7 s LEU 324 Ca 0.48 -0.02 -0.04 0.00 -0.22 0.00 0.00 54.13 54.32 3dl7 s LEU 324 Cb 0.35 -0.23 -0.04 0.00 0.50 0.00 0.00 46.19 46.78 3dl7 s LEU 324 CO -0.29 -0.12 0.07 -1.10 -1.32 0.00 0.00 176.35 173.58 3dl7 s GLN 325 N 1.20 3.22 -0.00 1.98 1.11 -1.26 -1.28 119.66 124.63 3dl7 s GLN 325 Ca -0.07 -0.28 0.01 0.00 0.01 0.00 0.00 55.36 55.02 3dl7 s GLN 325 Cb -0.13 -2.99 -0.00 0.00 -1.01 0.00 0.00 33.01 28.88 3dl7 s GLN 325 CO -0.02 0.72 -0.02 0.08 0.01 0.00 0.00 175.29 176.07 3dl7 s VAL 326 N -0.91 0.13 -0.15 1.09 1.01 0.39 -2.33 120.40 119.63 3dl7 s VAL 326 Ca 0.14 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.06 3dl7 s VAL 326 Cb -0.12 -0.12 0.01 0.00 0.00 0.00 0.00 36.38 36.15 3dl7 s VAL 326 CO 0.03 0.04 -0.18 -0.22 0.00 0.00 0.00 175.10 174.77 3dl7 s LEU 327 N -0.00 2.30 0.06 3.92 2.96 -0.46 -0.79 118.68 126.68 3dl7 s LEU 327 Ca 0.00 -0.54 0.02 0.00 -0.22 0.00 0.00 54.13 53.39 3dl7 s LEU 327 Cb -0.01 -1.51 -0.03 0.00 0.50 0.00 0.00 46.19 45.14 3dl7 s LEU 327 CO -0.00 0.07 -0.08 0.68 -1.32 0.00 0.00 176.35 175.70 3dl7 s VAL 328 N 0.90 0.66 0.00 1.68 -7.23 0.49 -0.44 120.40 116.46 3dl7 s VAL 328 Ca -0.04 -1.38 -0.28 0.00 -1.81 0.00 0.00 61.98 58.46 3dl7 s VAL 328 Cb -0.15 -1.00 0.10 0.00 0.56 0.00 0.00 36.38 35.89 3dl7 s VAL 328 CO -0.02 -0.52 1.26 -0.83 -0.31 0.00 0.00 175.10 174.68 3dl7 s GLY 329 N -2.07 -0.19 0.24 2.32 0.00 -1.00 -1.49 107.32 105.13 3dl7 s GLY 329 Ca -0.02 0.20 0.02 0.00 0.00 0.00 0.00 44.72 44.92 3dl7 s GLY 329 CO -0.01 3.67 0.17 -1.34 0.00 0.00 0.00 173.10 175.60 3dl7 s VAL 330 N -2.16 0.04 0.35 1.40 -7.23 -1.06 -0.41 120.40 111.33 3dl7 s VAL 330 Ca 0.24 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.49 3dl7 s VAL 330 Cb 0.01 -2.50 -0.03 0.00 0.56 0.00 0.00 36.38 34.42 3dl7 s VAL 330 CO -0.01 0.00 0.29 0.68 -0.31 0.00 0.00 175.10 175.75 3dl7 s VAL 331 N -3.92 3.33 0.52 1.32 -7.23 -1.26 -0.14 120.40 113.02 3dl7 s VAL 331 Ca 0.39 -1.39 0.34 0.00 -1.81 0.00 0.00 61.98 59.50 3dl7 s VAL 331 Cb 0.06 -3.13 0.37 0.00 0.56 0.00 0.00 36.38 34.23 3dl7 s VAL 331 CO 0.17 -0.14 2.21 0.50 -0.31 0.00 0.00 175.10 177.52 3dl7 h LYS 332 N 1.24 0.00 -1.50 4.82 3.64 -0.63 -3.30 116.57 120.84 3dl7 h LYS 332 Ca -0.44 0.00 -0.42 0.00 -1.27 0.00 0.00 60.65 58.52 3dl7 h LYS 332 Cb 1.26 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 32.68 3dl7 h LYS 332 CO 0.59 0.04 -1.18 -0.25 -2.27 0.00 0.00 179.45 176.37 3dl7 n ASP 333 N -3.50 1.27 -0.39 4.20 9.92 -0.33 -4.88 116.55 122.85 3dl7 n ASP 333 Ca -0.02 -2.89 0.34 0.00 -0.53 0.00 0.00 54.79 51.69 3dl7 n ASP 333 Cb 0.15 -0.57 0.68 0.00 -0.64 0.00 0.00 41.12 40.74 3dl7 n ASP 333 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 3dl7 h GLU 334 N 2.99 0.11 -0.01 -1.24 4.39 -1.74 -2.34 114.58 116.74 3dl7 h GLU 334 Ca 0.01 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3dl7 h GLU 334 Cb 1.06 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.69 3dl7 h GLU 334 CO 0.51 0.07 -0.47 0.41 -1.16 0.00 0.00 179.01 178.37 3dl7 n GLY 335 N -1.67 -0.15 0.32 -3.84 0.00 -1.26 -4.38 105.19 94.22 3dl7 n GLY 335 Ca 0.29 -0.60 -0.14 0.00 0.00 0.00 0.00 46.02 45.57 3dl7 n GLY 335 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3dl7 h SER 336 N 2.06 -0.64 -0.59 1.61 4.64 -1.66 -3.23 113.55 115.75 3dl7 h SER 336 Ca 0.00 -0.04 0.19 0.00 -0.47 0.00 0.00 61.79 61.47 3dl7 h SER 336 Cb 0.70 0.16 -0.11 0.00 -0.31 0.00 0.00 62.40 62.84 3dl7 h SER 336 CO 0.00 -0.27 0.12 0.00 -0.87 0.00 0.00 176.83 175.81 3dl7 n TYR 337 N -5.31 0.49 0.19 4.77 9.36 -1.26 -1.34 117.16 124.06 3dl7 n TYR 337 Ca -0.11 0.71 0.11 0.00 3.32 0.00 0.00 57.90 61.92 3dl7 n TYR 337 Cb 0.33 -1.01 0.12 0.00 -0.63 0.00 0.00 39.34 38.15 3dl7 n TYR 337 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 3dl7 h PHE 338 N 0.00 0.00 -0.75 2.98 0.04 -1.87 -3.29 116.94 114.06 3dl7 h PHE 338 Ca 0.41 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.16 3dl7 h PHE 338 Cb 0.95 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.06 3dl7 h PHE 338 CO -0.20 0.07 0.38 -0.07 -0.60 0.00 0.00 178.31 177.89 3dl7 h LEU 339 N 0.00 0.95 -1.23 1.54 3.38 -1.35 -1.39 115.31 117.21 3dl7 h LEU 339 Ca -0.00 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3dl7 h LEU 339 Cb 1.05 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.56 3dl7 h LEU 339 CO 0.01 0.79 0.00 -0.37 0.09 0.00 0.00 178.44 178.96 3dl7 h VAL 340 N 1.05 0.00 -0.76 1.22 -1.51 -1.74 0.16 116.25 114.67 3dl7 h VAL 340 Ca 0.26 -0.22 -0.45 0.00 -1.23 0.00 0.00 66.70 65.07 3dl7 h VAL 340 Cb 0.08 0.97 -0.23 0.00 -2.13 0.00 0.00 31.29 29.98 3dl7 h VAL 340 CO -0.04 0.00 0.57 -1.22 -1.23 0.00 0.00 177.57 175.66 3dl7 n TYR 341 N -2.50 2.39 0.00 5.19 4.02 -0.52 -4.64 117.16 121.10 3dl7 n TYR 341 Ca 0.01 -1.97 0.00 0.00 -0.01 0.00 0.00 57.90 55.93 3dl7 n TYR 341 Cb 0.19 -0.97 0.00 0.00 -0.02 0.00 0.00 39.34 38.53 3dl7 n TYR 341 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dl7 n GLY 342 N -0.58 -0.50 3.35 2.72 0.00 -1.19 -4.96 105.19 104.03 3dl7 n GLY 342 Ca 0.47 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.09 3dl7 n GLY 342 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dl7 s VAL 343 N -0.23 4.41 -0.07 1.61 1.01 0.04 -5.00 120.40 122.16 3dl7 s VAL 343 Ca 0.00 -0.93 -0.38 0.00 0.00 0.00 0.00 61.98 60.67 3dl7 s VAL 343 Cb 0.00 -3.47 -0.16 0.00 0.00 0.00 0.00 36.38 32.75 3dl7 s VAL 343 CO 0.00 -0.23 1.58 -2.65 0.00 0.00 0.00 175.10 173.80 3dl7 n PRO 344 N 4.96 1.35 0.00 2.72 -0.02 -1.26 -1.83 135.00 140.91 3dl7 n PRO 344 Ca -0.12 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 3dl7 n PRO 344 Cb 0.46 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 3dl7 n PRO 344 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dl7 n GLY 345 N 3.47 1.20 3.46 -1.23 0.00 -1.26 -4.93 105.19 105.90 3dl7 n GLY 345 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 3dl7 n GLY 345 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dl7 s PHE 346 N -2.02 3.01 0.01 1.61 0.40 -0.76 -4.49 117.98 115.74 3dl7 s PHE 346 Ca 0.00 -0.41 -0.02 0.00 -0.60 0.00 0.00 56.93 55.90 3dl7 s PHE 346 Cb 0.00 -1.99 -0.01 0.00 0.51 0.00 0.00 43.02 41.52 3dl7 s PHE 346 CO 0.00 -0.14 0.01 0.45 0.70 0.00 0.00 175.22 176.24 3dl7 s SER 347 N 0.62 0.15 0.18 1.36 0.15 -1.26 -4.55 113.70 110.34 3dl7 s SER 347 Ca -0.02 -0.33 0.23 0.00 0.70 0.00 0.00 55.95 56.52 3dl7 s SER 347 Cb -0.14 0.11 0.90 0.00 -1.71 0.00 0.00 66.02 65.18 3dl7 s SER 347 CO 0.02 -0.25 1.70 2.29 1.20 0.00 0.00 173.24 178.20 3dl7 n LYS 348 N 1.87 0.16 -0.02 5.44 2.85 -1.26 -3.98 118.16 123.22 3dl7 n LYS 348 Ca -0.21 0.31 -0.05 0.00 -1.05 0.00 0.00 58.31 57.30 3dl7 n LYS 348 Cb 0.56 -1.76 -0.13 0.00 -0.65 0.00 0.00 35.03 33.06 3dl7 n LYS 348 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3dl7 n ASP 349 N -2.04 0.67 0.00 -5.58 8.00 -1.26 -4.38 116.55 111.96 3dl7 n ASP 349 Ca 0.04 0.31 0.00 0.00 0.71 0.00 0.00 54.79 55.84 3dl7 n ASP 349 Cb 0.27 0.30 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 3dl7 n ASP 349 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3dl7 n ASN 350 N -2.90 0.00 0.00 -2.24 0.23 -1.26 -5.06 115.26 104.03 3dl7 n ASN 350 Ca -0.17 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.88 3dl7 n ASN 350 Cb 0.98 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.68 3dl7 n ASN 350 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3dl7 n GLU 351 N 0.00 0.13 -3.07 -3.83 1.02 -1.26 -4.99 120.64 108.64 3dl7 n GLU 351 Ca 0.00 -0.21 -0.22 0.00 -0.02 0.00 0.00 57.16 56.72 3dl7 n GLU 351 Cb 0.00 -0.67 0.01 0.00 -0.02 0.00 0.00 31.44 30.76 3dl7 n GLU 351 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3dl7 n SER 352 N -0.08 -4.94 -4.56 1.62 7.64 -1.26 -4.85 113.62 107.19 3dl7 n SER 352 Ca 0.00 -0.26 -0.27 0.00 1.01 0.00 0.00 58.87 59.35 3dl7 n SER 352 Cb 0.11 -4.05 -0.05 0.00 -1.01 0.00 0.00 64.21 59.21 3dl7 n SER 352 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3dl7 s LEU 353 N -6.47 3.15 0.86 -3.43 1.43 -1.26 -4.78 118.68 108.18 3dl7 s LEU 353 Ca 0.30 -0.22 -0.12 0.00 -1.03 0.00 0.00 54.13 53.06 3dl7 s LEU 353 Cb -0.14 -2.55 0.14 0.00 0.03 0.00 0.00 46.19 43.67 3dl7 s LEU 353 CO 0.37 -2.91 1.21 0.27 0.23 0.00 0.00 176.35 175.51 3dl7 s ILE 354 N 10.99 2.06 0.49 -0.59 -4.36 -1.26 -4.97 121.20 123.55 3dl7 s ILE 354 Ca 0.76 -0.11 0.02 0.00 -0.26 0.00 0.00 60.65 61.06 3dl7 s ILE 354 Cb -0.10 -2.94 -0.02 0.00 1.25 0.00 0.00 42.46 40.65 3dl7 s ILE 354 CO 0.07 0.00 0.02 -0.94 0.24 0.00 0.00 174.94 174.33 3dl7 s SER 355 N -4.75 3.94 0.20 4.36 1.04 -1.26 -4.21 113.70 113.01 3dl7 s SER 355 Ca 0.68 -1.63 -0.11 0.00 0.48 0.00 0.00 55.95 55.38 3dl7 s SER 355 Cb -0.07 0.42 0.20 0.00 0.10 0.00 0.00 66.02 66.67 3dl7 s SER 355 CO 0.50 -0.82 1.79 -0.09 0.98 0.00 0.00 173.24 175.60 3dl7 h ARG 356 N 1.45 0.54 -0.50 4.02 2.43 -1.91 -1.67 114.38 118.74 3dl7 h ARG 356 Ca -0.43 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 58.62 3dl7 h ARG 356 Cb 1.30 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.71 3dl7 h ARG 356 CO 0.73 0.35 -0.03 0.00 -1.51 0.00 0.00 179.97 179.52 3dl7 h ALA 357 N 1.32 1.02 -0.44 2.80 0.00 -2.00 -0.09 119.26 121.88 3dl7 h ALA 357 Ca 0.26 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3dl7 h ALA 357 Cb 0.19 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3dl7 h ALA 357 CO -0.19 0.60 -0.05 1.96 0.00 0.00 0.00 179.25 181.57 3dl7 h GLN 358 N 0.78 0.74 -0.34 0.00 4.20 -1.85 -1.92 115.11 116.72 3dl7 h GLN 358 Ca 0.14 -0.21 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 3dl7 h GLN 358 Cb 0.51 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 3dl7 h GLN 358 CO 0.03 0.79 0.10 0.35 -0.67 0.00 0.00 178.83 179.42 3dl7 h PHE 359 N 0.68 0.55 -0.41 2.96 3.04 -0.35 0.27 116.94 123.68 3dl7 h PHE 359 Ca 0.13 -0.06 -0.09 0.00 3.98 0.00 0.00 57.97 61.93 3dl7 h PHE 359 Cb 0.50 -0.16 -0.02 0.00 2.56 0.00 0.00 35.95 38.83 3dl7 h PHE 359 CO 0.02 0.55 -0.13 -0.07 -2.02 0.00 0.00 178.31 176.67 3dl7 h LEU 360 N 0.39 0.74 -0.30 0.59 3.38 -0.78 -2.39 115.31 116.94 3dl7 h LEU 360 Ca 0.11 -0.22 -0.20 0.00 0.09 0.00 0.00 57.88 57.65 3dl7 h LEU 360 Cb 0.26 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3dl7 h LEU 360 CO -0.00 0.88 -0.76 0.00 0.09 0.00 0.00 178.44 178.65 3dl7 h ALA 361 N 1.19 0.47 -0.96 1.53 0.00 -1.25 -2.83 119.26 117.41 3dl7 h ALA 361 Ca 0.11 -0.61 0.16 0.00 0.00 0.00 0.00 54.91 54.58 3dl7 h ALA 361 Cb 0.60 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.26 3dl7 h ALA 361 CO 0.04 0.73 0.61 0.78 0.00 0.00 0.00 179.25 181.41 3dl7 h GLY 362 N 0.98 1.45 1.75 0.00 0.00 -0.26 -2.53 103.07 104.47 3dl7 h GLY 362 Ca -0.04 -0.33 -0.15 0.00 0.00 0.00 0.00 47.33 46.80 3dl7 h GLY 362 CO 0.14 0.04 -0.63 -2.08 0.00 0.00 0.00 176.54 174.01 3dl7 h VAL 363 N 0.75 1.39 0.00 4.60 2.07 -1.19 0.16 116.25 124.04 3dl7 h VAL 363 Ca 0.51 -2.04 -0.07 0.00 0.82 0.00 0.00 66.70 65.92 3dl7 h VAL 363 Cb 0.79 2.04 -0.01 0.00 -1.52 0.00 0.00 31.29 32.59 3dl7 h VAL 363 CO -0.27 0.60 -0.33 0.03 0.02 0.00 0.00 177.57 177.62 3dl7 h ARG 364 N 0.18 0.00 0.19 1.57 2.47 -1.33 0.22 114.38 117.69 3dl7 h ARG 364 Ca -0.01 0.00 -0.28 0.00 -1.26 0.00 0.00 59.98 58.43 3dl7 h ARG 364 Cb 1.15 0.00 0.03 0.00 -1.65 0.00 0.00 29.97 29.50 3dl7 h ARG 364 CO 0.10 0.33 -1.27 0.82 0.56 0.00 0.00 179.97 180.51 3dl7 h ILE 365 N 0.00 1.30 -0.01 2.04 2.04 -1.23 -3.14 117.51 118.51 3dl7 h ILE 365 Ca -0.00 -2.59 -0.13 0.00 1.00 0.00 0.00 64.86 63.14 3dl7 h ILE 365 Cb 0.83 3.04 -0.02 0.00 -0.74 0.00 0.00 36.82 39.93 3dl7 h ILE 365 CO 0.04 0.77 -0.59 1.23 0.00 0.00 0.00 178.15 179.61 3dl7 h GLY 366 N 0.00 0.05 -6.40 5.37 0.00 -0.59 -2.81 103.07 98.69 3dl7 h GLY 366 Ca -0.23 -0.06 -0.60 0.00 0.00 0.00 0.00 47.33 46.44 3dl7 h GLY 366 CO 0.20 0.05 -0.69 -0.62 0.00 0.00 0.00 176.54 175.48 3dl7 n VAL 367 N -3.85 1.46 0.27 4.60 0.31 0.06 -4.84 118.33 116.33 3dl7 n VAL 367 Ca -0.01 -4.82 0.11 0.00 -0.01 0.00 0.00 64.34 59.61 3dl7 n VAL 367 Cb 0.59 -2.07 0.74 0.00 -0.91 0.00 0.00 33.84 32.19 3dl7 n VAL 367 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 3dl7 h PRO 368 N 4.56 0.00 -0.00 5.55 0.13 -1.63 -0.92 132.00 139.69 3dl7 h PRO 368 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 3dl7 h PRO 368 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 3dl7 h PRO 368 CO 0.72 0.05 -0.05 0.00 -0.23 0.00 0.00 178.00 178.48 3dl7 n GLN 369 N -4.10 0.37 -2.25 0.86 0.00 -1.26 -4.90 117.38 106.10 3dl7 n GLN 369 Ca -0.03 -0.05 -0.42 0.00 0.00 0.00 0.00 57.00 56.50 3dl7 n GLN 369 Cb 0.13 -1.50 -0.03 0.00 0.00 0.00 0.00 30.24 28.85 3dl7 n GLN 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3dl7 s ALA 370 N -2.67 3.53 1.03 2.61 0.00 -0.35 -4.90 121.76 121.01 3dl7 s ALA 370 Ca 0.24 1.02 -0.14 0.00 0.00 0.00 0.00 51.96 53.09 3dl7 s ALA 370 Cb 0.20 -3.51 0.20 0.00 0.00 0.00 0.00 23.12 20.01 3dl7 s ALA 370 CO 0.49 -0.57 1.11 -1.54 0.00 0.00 0.00 175.76 175.25 3dl7 s SER 371 N 1.13 2.40 0.22 0.00 1.04 -1.26 -4.72 113.70 112.52 3dl7 s SER 371 Ca 0.63 1.03 -0.07 0.00 0.48 0.00 0.00 55.95 58.02 3dl7 s SER 371 Cb -0.34 -1.61 0.36 0.00 0.10 0.00 0.00 66.02 64.52 3dl7 s SER 371 CO 0.30 -3.25 1.74 0.44 0.98 0.00 0.00 173.24 173.44 3dl7 h ASP 372 N -1.98 0.24 0.03 7.02 5.19 -1.96 0.20 116.42 125.17 3dl7 h ASP 372 Ca -0.53 0.09 -0.00 0.00 -0.62 0.00 0.00 57.03 55.97 3dl7 h ASP 372 Cb 1.33 0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.91 3dl7 h ASP 372 CO 0.55 0.12 -0.02 0.25 -3.12 0.00 0.00 179.24 177.02 3dl7 h LEU 373 N 0.42 -0.04 -0.50 1.55 5.85 -1.97 -1.66 115.31 118.96 3dl7 h LEU 373 Ca 0.36 -0.30 0.09 0.00 0.84 0.00 0.00 57.88 58.86 3dl7 h LEU 373 Cb 0.49 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.46 3dl7 h LEU 373 CO -0.35 0.28 0.09 0.00 -0.34 0.00 0.00 178.44 178.12 3dl7 h ALA 374 N 0.59 0.56 -0.11 1.25 0.00 -1.85 0.14 119.26 119.85 3dl7 h ALA 374 Ca -0.00 0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.04 3dl7 h ALA 374 Cb 0.34 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 3dl7 h ALA 374 CO 0.01 -0.32 -0.02 0.00 0.00 0.00 0.00 179.25 178.92 3dl7 h ALA 375 N 1.40 0.08 -0.39 0.00 0.00 -0.91 -0.81 119.26 118.64 3dl7 h ALA 375 Ca 0.25 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.28 3dl7 h ALA 375 Cb 0.35 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.14 3dl7 h ALA 375 CO -0.34 -0.48 -0.11 1.49 0.00 0.00 0.00 179.25 179.81 3dl7 h GLU 376 N 0.01 -0.02 -0.93 0.00 4.57 -0.80 0.58 114.58 118.00 3dl7 h GLU 376 Ca 0.05 0.00 0.09 0.00 -1.18 0.00 0.00 59.36 58.32 3dl7 h GLU 376 Cb 0.07 0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 28.59 3dl7 h GLU 376 CO -0.10 -0.01 0.57 0.00 -1.18 0.00 0.00 179.01 178.29 3dl7 h ALA 377 N 1.36 1.33 0.10 2.92 0.00 -0.05 0.18 119.26 125.10 3dl7 h ALA 377 Ca 0.19 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3dl7 h ALA 377 Cb 0.30 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3dl7 h ALA 377 CO -0.41 0.25 -0.05 0.28 0.00 0.00 0.00 179.25 179.32 3dl7 h VAL 378 N 0.98 1.02 -0.65 0.00 2.07 -0.28 -0.50 116.25 118.89 3dl7 h VAL 378 Ca 0.43 -0.44 0.06 0.00 0.82 0.00 0.00 66.70 67.57 3dl7 h VAL 378 Cb 0.32 1.30 -0.06 0.00 -1.52 0.00 0.00 31.29 31.34 3dl7 h VAL 378 CO -0.22 0.11 0.35 0.58 0.02 0.00 0.00 177.57 178.41 3dl7 h VAL 379 N -0.34 0.95 -0.04 2.57 2.07 -0.28 -1.04 116.25 120.15 3dl7 h VAL 379 Ca -0.01 -0.22 -0.12 0.00 0.82 0.00 0.00 66.70 67.16 3dl7 h VAL 379 Cb 0.28 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 3dl7 h VAL 379 CO 0.02 0.12 -0.54 -0.07 0.02 0.00 0.00 177.57 177.12 3dl7 h LEU 380 N 0.65 0.12 -0.37 2.57 3.38 -0.50 -0.28 115.31 120.88 3dl7 h LEU 380 Ca 0.30 -0.06 -0.16 0.00 0.09 0.00 0.00 57.88 58.04 3dl7 h LEU 380 Cb 0.20 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 3dl7 h LEU 380 CO -0.19 0.63 -0.40 -0.74 0.09 0.00 0.00 178.44 177.84 3dl7 h HIS 381 N 0.08 1.10 0.00 1.13 2.76 -0.44 -3.33 115.15 116.46 3dl7 h HIS 381 Ca -0.00 -0.34 0.00 0.00 -2.20 0.00 0.00 60.37 57.83 3dl7 h HIS 381 Cb 0.98 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 29.71 3dl7 h HIS 381 CO 0.01 1.16 -0.88 0.66 -1.30 0.00 0.00 177.93 177.59 3dl7 n TYR 382 N -4.07 0.13 -2.10 5.26 4.02 -0.45 -4.85 117.16 115.10 3dl7 n TYR 382 Ca -0.03 0.04 -0.42 0.00 -0.01 0.00 0.00 57.90 57.49 3dl7 n TYR 382 Cb 0.55 -0.29 -0.03 0.00 -0.02 0.00 0.00 39.34 39.55 3dl7 n TYR 382 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3dl7 s THR 383 N -3.10 2.95 -0.59 -0.72 2.01 -0.13 -4.86 115.64 111.18 3dl7 s THR 383 Ca 0.07 0.76 -0.27 0.00 0.31 0.00 0.00 61.69 62.56 3dl7 s THR 383 Cb 0.16 -3.48 0.04 0.00 0.01 0.00 0.00 72.50 69.22 3dl7 s THR 383 CO 0.79 0.10 1.12 -0.62 -0.69 0.00 0.00 174.62 175.32 3dl7 s ASP 384 N 0.54 6.37 0.24 3.53 -1.08 -1.26 -4.92 116.67 120.09 3dl7 s ASP 384 Ca 0.60 -0.14 0.23 0.00 -0.52 0.00 0.00 52.55 52.72 3dl7 s ASP 384 Cb -0.39 -2.51 0.95 0.00 -1.46 0.00 0.00 42.92 39.51 3dl7 s ASP 384 CO 0.38 -1.45 1.70 0.79 0.52 0.00 0.00 175.17 177.12 3dl7 n TRP 385 N 8.22 0.77 0.15 -5.34 7.02 -1.26 -0.80 117.44 126.21 3dl7 n TRP 385 Ca 0.05 0.30 0.02 0.00 -1.02 0.00 0.00 57.50 56.85 3dl7 n TRP 385 Cb 0.48 -0.98 0.20 0.00 -2.42 0.00 0.00 31.31 28.59 3dl7 n TRP 385 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 3dl7 h LEU 386 N 0.00 0.00 -5.95 -0.99 3.38 -2.04 -3.36 115.31 106.35 3dl7 h LEU 386 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 3dl7 h LEU 386 Cb 0.38 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 40.73 3dl7 h LEU 386 CO 0.00 0.52 -1.09 1.41 0.09 0.00 0.00 178.44 179.37 3dl7 n HIS 387 N -3.53 0.50 -0.08 1.13 8.25 0.02 -4.99 115.22 116.52 3dl7 n HIS 387 Ca -0.00 -3.76 0.15 0.00 -0.26 0.00 0.00 57.72 53.85 3dl7 n HIS 387 Cb 0.62 -0.41 0.56 0.00 1.12 0.00 0.00 29.99 31.87 3dl7 n HIS 387 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3dl7 h PRO 388 N 3.43 0.28 -0.01 -0.41 0.11 -1.46 -2.91 132.00 131.02 3dl7 h PRO 388 Ca 0.10 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.19 3dl7 h PRO 388 Cb 0.88 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.93 3dl7 h PRO 388 CO 0.53 0.19 -0.01 0.39 -0.21 0.00 0.00 178.00 178.88 3dl7 n GLU 389 N -4.45 0.28 -1.68 1.05 1.02 -1.26 -4.82 120.64 110.77 3dl7 n GLU 389 Ca 0.11 -0.93 -0.46 0.00 -0.02 0.00 0.00 57.16 55.86 3dl7 n GLU 389 Cb 0.48 -1.14 -0.04 0.00 -0.02 0.00 0.00 31.44 30.72 3dl7 n GLU 389 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3dl7 n ASP 390 N 0.38 3.70 -0.14 1.62 2.03 -1.10 -4.77 116.55 118.27 3dl7 n ASP 390 Ca 0.04 0.96 -0.11 0.00 0.52 0.00 0.00 54.79 56.21 3dl7 n ASP 390 Cb 0.19 -1.44 0.02 0.00 -0.72 0.00 0.00 41.12 39.18 3dl7 n ASP 390 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3dl7 h PRO 391 N 9.33 0.94 -0.55 -0.67 0.11 -1.92 -2.05 132.00 137.19 3dl7 h PRO 391 Ca -0.48 -0.40 0.08 0.00 0.11 0.00 0.00 66.00 65.30 3dl7 h PRO 391 Cb 1.26 -0.03 -0.06 0.00 0.11 0.00 0.00 31.00 32.27 3dl7 h PRO 391 CO 0.94 1.07 0.22 1.15 -0.21 0.00 0.00 178.00 181.17 3dl7 h THR 392 N 0.81 0.83 -0.15 -1.15 2.02 -1.90 -0.29 112.91 113.08 3dl7 h THR 392 Ca 0.10 -0.14 -0.03 0.00 0.77 0.00 0.00 66.41 67.11 3dl7 h THR 392 Cb 0.79 0.38 -0.00 0.00 -1.74 0.00 0.00 68.15 67.58 3dl7 h THR 392 CO 0.07 0.08 -0.02 -0.74 0.37 0.00 0.00 175.52 175.27 3dl7 h HIS 393 N 0.41 0.30 -0.96 3.16 -0.00 -1.88 -1.34 115.15 114.84 3dl7 h HIS 393 Ca 0.27 -0.06 0.16 0.00 -0.00 0.00 0.00 60.37 60.73 3dl7 h HIS 393 Cb 0.29 -0.08 -0.08 0.00 -0.00 0.00 0.00 27.41 27.54 3dl7 h HIS 393 CO -0.15 0.53 0.61 -0.07 -0.00 0.00 0.00 177.93 178.85 3dl7 h LEU 394 N -0.02 0.76 0.11 0.26 3.38 -1.14 0.55 115.31 119.21 3dl7 h LEU 394 Ca 0.04 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 3dl7 h LEU 394 Cb 0.42 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3dl7 h LEU 394 CO 0.01 0.35 -0.05 -0.09 0.09 0.00 0.00 178.44 178.75 3dl7 h ARG 395 N 0.78 -0.14 -0.91 1.13 1.12 -0.94 -1.91 114.38 113.51 3dl7 h ARG 395 Ca 0.50 0.01 0.14 0.00 -1.11 0.00 0.00 59.98 59.52 3dl7 h ARG 395 Cb 0.74 0.03 -0.07 0.00 -0.01 0.00 0.00 29.97 30.66 3dl7 h ARG 395 CO -0.27 0.33 0.58 -0.44 -3.11 0.00 0.00 179.97 177.06 3dl7 h ASP 396 N -0.71 0.70 -0.34 -3.80 3.32 -0.89 -2.54 116.42 112.16 3dl7 h ASP 396 Ca -0.02 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.05 3dl7 h ASP 396 Cb 0.54 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 3dl7 h ASP 396 CO 0.02 0.36 0.10 0.00 -1.72 0.00 0.00 179.24 178.00 3dl7 h ALA 397 N 1.59 0.45 -0.78 3.45 0.00 0.23 -1.39 119.26 122.81 3dl7 h ALA 397 Ca 0.46 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.26 3dl7 h ALA 397 Cb 0.68 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 3dl7 h ALA 397 CO -0.22 0.09 0.47 1.98 0.00 0.00 0.00 179.25 181.57 3dl7 h MET 398 N 0.40 0.84 0.33 0.00 1.85 -1.08 0.23 114.93 117.50 3dl7 h MET 398 Ca 0.11 -0.05 -0.01 0.00 -0.61 0.00 0.00 59.70 59.14 3dl7 h MET 398 Cb 0.26 -0.19 -0.01 0.00 0.43 0.00 0.00 31.60 32.10 3dl7 h MET 398 CO -0.00 0.55 -0.21 1.03 -0.40 0.00 0.00 176.91 177.88 3dl7 h SER 399 N 0.86 -0.53 -0.67 1.39 0.87 -1.18 -2.77 113.55 111.52 3dl7 h SER 399 Ca 0.34 0.03 0.07 0.00 -1.23 0.00 0.00 61.79 61.01 3dl7 h SER 399 Cb 0.16 0.16 -0.06 0.00 -0.44 0.00 0.00 62.40 62.22 3dl7 h SER 399 CO -0.17 -0.34 0.35 0.00 -0.53 0.00 0.00 176.83 176.14 3dl7 h ALA 400 N 0.11 0.90 -0.37 6.23 0.00 -0.58 0.11 119.26 125.66 3dl7 h ALA 400 Ca -0.03 0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.98 3dl7 h ALA 400 Cb 0.44 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 3dl7 h ALA 400 CO 0.03 -0.01 -0.01 0.28 0.00 0.00 0.00 179.25 179.53 3dl7 h VAL 401 N 0.62 0.71 -0.06 0.00 2.07 -0.48 0.33 116.25 119.44 3dl7 h VAL 401 Ca 0.31 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.78 3dl7 h VAL 401 Cb 0.26 0.61 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 3dl7 h VAL 401 CO -0.22 0.02 -0.05 0.58 0.02 0.00 0.00 177.57 177.92 3dl7 h VAL 402 N 0.09 1.36 -0.41 2.57 2.07 -1.00 -1.15 116.25 119.77 3dl7 h VAL 402 Ca 0.18 -1.16 0.05 0.00 0.82 0.00 0.00 66.70 66.60 3dl7 h VAL 402 Cb 0.26 2.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.98 3dl7 h VAL 402 CO -0.31 0.32 0.15 1.23 0.02 0.00 0.00 177.57 178.98 3dl7 h GLY 403 N -0.28 0.54 0.63 2.17 0.00 -0.67 -2.14 103.07 103.32 3dl7 h GLY 403 Ca 0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 3dl7 h GLY 403 CO 0.01 0.03 -0.05 -0.55 0.00 0.00 0.00 176.54 175.98 3dl7 h ASP 404 N 0.32 -0.11 -0.82 0.19 3.32 -0.28 0.36 116.42 119.40 3dl7 h ASP 404 Ca 0.19 -0.31 0.01 0.00 0.02 0.00 0.00 57.03 56.94 3dl7 h ASP 404 Cb 0.17 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.71 3dl7 h ASP 404 CO -0.19 0.26 0.54 -0.74 -1.72 0.00 0.00 179.24 177.39 3dl7 h HIS 405 N -0.51 1.02 0.00 4.55 -0.00 -1.24 -1.16 115.15 117.81 3dl7 h HIS 405 Ca -0.01 0.02 -0.36 0.00 -0.00 0.00 0.00 60.37 60.02 3dl7 h HIS 405 Cb 0.42 -0.34 -0.07 0.00 -0.00 0.00 0.00 27.41 27.42 3dl7 h HIS 405 CO 0.05 0.64 -2.30 0.09 -0.00 0.00 0.00 177.93 176.40 3dl7 n ASN 406 N -4.42 0.38 0.05 3.26 3.02 -0.80 -4.54 115.26 112.21 3dl7 n ASN 406 Ca 0.09 0.05 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 3dl7 n ASN 406 Cb 0.04 0.66 0.00 0.00 -0.61 0.00 0.00 39.78 39.86 3dl7 n ASN 406 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3dl7 n VAL 407 N -2.86 0.79 -0.07 2.41 0.31 0.12 -4.68 118.33 114.34 3dl7 n VAL 407 Ca -0.32 0.26 -0.09 0.00 -0.01 0.00 0.00 64.34 64.18 3dl7 n VAL 407 Cb 1.12 -1.28 -0.02 0.00 -0.91 0.00 0.00 33.84 32.75 3dl7 n VAL 407 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3dl7 h VAL 408 N 0.00 1.07 -0.05 2.52 2.07 -1.24 0.81 116.25 121.44 3dl7 h VAL 408 Ca 0.00 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.35 3dl7 h VAL 408 Cb 0.00 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 3dl7 h VAL 408 CO 0.00 0.07 -0.11 0.00 0.02 0.00 0.00 177.57 177.55 3dl7 h PRO 410 N -0.35 0.57 -0.43 0.00 0.11 -1.67 -1.17 132.00 129.05 3dl7 h PRO 410 Ca 0.00 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.05 3dl7 h PRO 410 Cb 0.69 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.66 3dl7 h PRO 410 CO 0.02 0.38 0.16 0.28 -0.21 0.00 0.00 178.00 178.63 3dl7 h VAL 411 N 0.59 1.21 -0.57 3.15 2.07 -0.42 -0.98 116.25 121.29 3dl7 h VAL 411 Ca 0.58 -0.67 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 3dl7 h VAL 411 Cb 1.16 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 3dl7 h VAL 411 CO -0.35 0.24 0.20 0.00 0.02 0.00 0.00 177.57 177.69 3dl7 h ALA 412 N 1.00 0.75 -0.10 1.67 0.00 -0.35 0.17 119.26 122.40 3dl7 h ALA 412 Ca 0.14 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.89 3dl7 h ALA 412 Cb 0.22 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3dl7 h ALA 412 CO -0.01 0.39 -0.00 0.37 0.00 0.00 0.00 179.25 180.00 3dl7 h GLN 413 N 0.80 0.03 -0.41 0.00 4.15 -1.21 0.47 115.11 118.94 3dl7 h GLN 413 Ca 0.19 -0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.63 3dl7 h GLN 413 Cb 0.25 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.90 3dl7 h GLN 413 CO -0.01 0.02 0.23 1.25 -1.93 0.00 0.00 178.83 178.39 3dl7 h LEU 414 N 0.03 0.37 -0.27 -2.39 5.85 -0.82 -0.32 115.31 117.76 3dl7 h LEU 414 Ca 0.05 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 3dl7 h LEU 414 Cb 0.06 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 3dl7 h LEU 414 CO -0.08 0.27 0.11 0.00 -0.34 0.00 0.00 178.44 178.40 3dl7 h ALA 415 N 1.18 0.36 -0.29 1.25 0.00 -0.42 -0.94 119.26 120.39 3dl7 h ALA 415 Ca 0.16 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.98 3dl7 h ALA 415 Cb 0.02 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3dl7 h ALA 415 CO -0.08 -0.05 0.12 0.78 0.00 0.00 0.00 179.25 180.01 3dl7 h GLY 416 N 0.29 0.38 0.94 0.00 0.00 -0.81 -0.98 103.07 102.89 3dl7 h GLY 416 Ca 0.09 -0.08 -0.08 0.00 0.00 0.00 0.00 47.33 47.26 3dl7 h GLY 416 CO -0.01 0.05 -0.10 3.21 0.00 0.00 0.00 176.54 179.70 3dl7 h ARG 417 N 0.26 0.69 -0.54 4.80 2.47 -0.73 -1.57 114.38 119.75 3dl7 h ARG 417 Ca 0.13 -0.27 -0.05 0.00 -1.26 0.00 0.00 59.98 58.53 3dl7 h ARG 417 Cb 0.08 -0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.34 3dl7 h ARG 417 CO -0.12 0.85 0.14 -0.07 0.56 0.00 0.00 179.97 181.34 3dl7 h LEU 418 N 0.48 0.76 -0.15 3.04 3.38 -1.06 -0.63 115.31 121.12 3dl7 h LEU 418 Ca 0.09 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 3dl7 h LEU 418 Cb 0.61 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 3dl7 h LEU 418 CO 0.04 0.74 -0.20 0.00 0.09 0.00 0.00 178.44 179.11 3dl7 h ALA 419 N 1.36 0.23 -0.94 1.53 0.00 -1.02 0.22 119.26 120.64 3dl7 h ALA 419 Ca 0.18 -0.36 0.07 0.00 0.00 0.00 0.00 54.91 54.80 3dl7 h ALA 419 Cb 0.27 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 3dl7 h ALA 419 CO -0.00 0.17 0.61 0.00 0.00 0.00 0.00 179.25 180.03 3dl7 h ALA 420 N 0.59 1.48 -1.00 0.00 0.00 -1.13 -2.90 119.26 116.31 3dl7 h ALA 420 Ca 0.02 -0.02 -0.55 0.00 0.00 0.00 0.00 54.91 54.35 3dl7 h ALA 420 Cb 0.76 -0.28 -0.31 0.00 0.00 0.00 0.00 17.79 17.97 3dl7 h ALA 420 CO 0.05 0.37 0.71 1.04 0.00 0.00 0.00 179.25 181.42 3dl7 n GLN 421 N -4.50 2.34 0.00 0.00 6.02 -0.26 -4.90 117.38 116.08 3dl7 n GLN 421 Ca 0.15 -3.07 0.00 0.00 -0.01 0.00 0.00 57.00 54.07 3dl7 n GLN 421 Cb 0.21 -2.20 0.00 0.00 1.02 0.00 0.00 30.24 29.26 3dl7 n GLN 421 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dl7 n GLY 422 N -1.10 0.50 3.78 1.08 0.00 -1.10 -1.42 105.19 106.94 3dl7 n GLY 422 Ca 0.61 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.28 3dl7 n GLY 422 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dl7 s ALA 423 N -2.14 2.80 -0.23 4.61 0.00 0.76 -4.22 121.76 123.33 3dl7 s ALA 423 Ca 0.00 0.74 -0.23 0.00 0.00 0.00 0.00 51.96 52.46 3dl7 s ALA 423 Cb 0.00 -3.31 -0.01 0.00 0.00 0.00 0.00 23.12 19.80 3dl7 s ALA 423 CO 0.00 -0.55 0.78 0.50 0.00 0.00 0.00 175.76 176.48 3dl7 s ARG 424 N -3.20 4.18 -0.05 0.00 3.52 -0.40 -4.42 118.95 118.57 3dl7 s ARG 424 Ca 0.70 0.85 0.05 0.00 -0.13 0.00 0.00 55.73 57.19 3dl7 s ARG 424 Cb -0.21 -3.63 -0.00 0.00 -1.56 0.00 0.00 34.95 29.54 3dl7 s ARG 424 CO 0.24 -0.46 -0.19 0.08 -0.81 0.00 0.00 175.30 174.16 3dl7 s VAL 425 N 2.64 1.62 -0.09 7.11 1.01 -1.26 -0.46 120.40 130.98 3dl7 s VAL 425 Ca 0.33 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.53 3dl7 s VAL 425 Cb -0.15 -1.39 0.00 0.00 0.00 0.00 0.00 36.38 34.83 3dl7 s VAL 425 CO 0.08 0.46 -0.22 -0.31 0.00 0.00 0.00 175.10 175.11 3dl7 s TYR 426 N 0.06 2.33 0.20 5.22 1.51 0.03 0.16 117.35 126.86 3dl7 s TYR 426 Ca -0.06 -0.91 0.11 0.00 -1.01 0.00 0.00 57.07 55.20 3dl7 s TYR 426 Cb -0.13 -1.57 -0.04 0.00 -0.11 0.00 0.00 41.96 40.10 3dl7 s TYR 426 CO 0.03 -0.37 -0.22 0.00 -1.11 0.00 0.00 175.55 173.89 3dl7 s ALA 427 N 0.33 2.60 0.09 3.71 0.00 -1.25 -0.38 121.76 126.85 3dl7 s ALA 427 Ca -0.16 -1.63 -0.06 0.00 0.00 0.00 0.00 51.96 50.11 3dl7 s ALA 427 Cb -0.17 -0.38 -0.02 0.00 0.00 0.00 0.00 23.12 22.56 3dl7 s ALA 427 CO 0.07 0.43 0.13 1.52 0.00 0.00 0.00 175.76 177.91 3dl7 s TYR 428 N -1.71 0.33 -0.06 0.00 -0.85 -0.56 -2.16 117.35 112.34 3dl7 s TYR 428 Ca 0.22 -0.79 0.04 0.00 -0.52 0.00 0.00 57.07 56.02 3dl7 s TYR 428 Cb -0.08 -0.18 0.00 0.00 0.38 0.00 0.00 41.96 42.08 3dl7 s TYR 428 CO 0.11 -0.51 -0.18 -1.50 -1.52 0.00 0.00 175.55 171.95 3dl7 s ILE 429 N -3.90 1.52 -0.23 -3.49 2.07 0.41 -2.56 121.20 115.02 3dl7 s ILE 429 Ca 0.08 -0.74 -0.11 0.00 -1.41 0.00 0.00 60.65 58.47 3dl7 s ILE 429 Cb 0.06 -1.32 -0.05 0.00 0.13 0.00 0.00 42.46 41.28 3dl7 s ILE 429 CO -0.09 0.44 0.17 0.12 -1.91 0.00 0.00 174.94 173.67 3dl7 s PHE 430 N 0.21 3.34 0.00 3.50 2.19 0.81 0.28 117.98 128.30 3dl7 s PHE 430 Ca -0.09 0.28 0.00 0.00 0.33 0.00 0.00 56.93 57.45 3dl7 s PHE 430 Cb -0.14 -2.26 0.00 0.00 -1.31 0.00 0.00 43.02 39.31 3dl7 s PHE 430 CO 0.04 0.11 0.52 0.39 1.83 0.00 0.00 175.22 178.11 3dl7 n GLU 431 N 4.12 0.55 -3.27 10.12 1.02 0.88 -0.10 120.64 133.96 3dl7 n GLU 431 Ca -0.15 -0.66 -0.41 0.00 -0.02 0.00 0.00 57.16 55.93 3dl7 n GLU 431 Cb 0.52 -0.77 -0.08 0.00 -0.02 0.00 0.00 31.44 31.09 3dl7 n GLU 431 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3dl7 s HIS 432 N -0.27 3.19 -0.18 -0.32 2.46 -1.25 -4.94 115.29 113.98 3dl7 s HIS 432 Ca 0.00 0.21 -0.29 0.00 0.47 0.00 0.00 55.06 55.45 3dl7 s HIS 432 Cb 0.00 -2.85 -0.00 0.00 -0.13 0.00 0.00 32.58 29.60 3dl7 s HIS 432 CO 0.00 -0.48 1.07 0.50 -2.47 0.00 0.00 174.74 173.36 3dl7 s ARG 433 N 2.32 4.30 0.23 2.88 3.52 -1.26 -4.93 118.95 126.01 3dl7 s ARG 433 Ca 0.18 1.43 -0.32 0.00 -0.13 0.00 0.00 55.73 56.89 3dl7 s ARG 433 Cb -0.16 -3.63 -0.13 0.00 -1.56 0.00 0.00 34.95 29.47 3dl7 s ARG 433 CO 0.12 -0.56 1.46 0.00 -0.81 0.00 0.00 175.30 175.51 3dl7 n ALA 434 N 6.02 1.35 0.14 6.12 0.00 -1.26 -4.90 120.51 127.98 3dl7 n ALA 434 Ca 0.12 0.41 0.05 0.00 0.00 0.00 0.00 53.44 54.02 3dl7 n ALA 434 Cb 0.46 -2.31 0.51 0.00 0.00 0.00 0.00 19.45 18.11 3dl7 n ALA 434 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3dl7 h SER 435 N 4.60 0.22 -0.05 0.00 4.64 -1.95 -2.43 113.55 118.58 3dl7 h SER 435 Ca -0.45 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3dl7 h SER 435 Cb 1.26 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3dl7 h SER 435 CO 0.79 0.20 0.00 0.35 -0.87 0.00 0.00 176.83 177.30 3dl7 n THR 436 N -4.47 0.06 -2.16 2.95 -2.24 -1.26 -4.94 114.28 102.23 3dl7 n THR 436 Ca -0.00 -0.07 -0.40 0.00 -2.27 0.00 0.00 64.05 61.30 3dl7 n THR 436 Cb 0.11 -0.05 -0.02 0.00 -2.10 0.00 0.00 70.33 68.26 3dl7 n THR 436 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3dl7 s LEU 437 N -1.26 4.42 0.00 3.22 2.96 -0.92 -4.93 118.68 122.17 3dl7 s LEU 437 Ca 0.15 2.62 0.13 0.00 -0.22 0.00 0.00 54.13 56.81 3dl7 s LEU 437 Cb 0.07 -3.68 0.00 0.00 0.50 0.00 0.00 46.19 43.09 3dl7 s LEU 437 CO 0.12 -0.51 0.74 0.35 -1.32 0.00 0.00 176.35 175.72 3dl7 n THR 438 N 0.77 0.00 -2.12 3.68 -2.24 -1.26 -4.95 114.28 108.16 3dl7 n THR 438 Ca 0.00 -0.38 -0.33 0.00 -2.27 0.00 0.00 64.05 61.07 3dl7 n THR 438 Cb 0.42 1.16 0.00 0.00 -2.10 0.00 0.00 70.33 69.82 3dl7 n THR 438 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 3dl7 s TRP 439 N -1.54 2.98 0.92 4.78 0.52 -1.26 -4.90 118.94 120.44 3dl7 s TRP 439 Ca 0.11 1.52 -0.11 0.00 0.02 0.00 0.00 56.10 57.63 3dl7 s TRP 439 Cb 0.10 -3.02 0.14 0.00 -1.15 0.00 0.00 33.47 29.54 3dl7 s TRP 439 CO 0.30 -1.09 1.09 -1.25 0.02 0.00 0.00 176.95 176.02 3dl7 s PRO 440 N -3.94 1.03 0.26 4.98 0.04 -1.26 -4.91 135.00 131.20 3dl7 s PRO 440 Ca 0.64 0.99 -0.02 0.00 0.04 0.00 0.00 61.00 62.65 3dl7 s PRO 440 Cb -0.16 -1.77 0.42 0.00 0.04 0.00 0.00 34.50 33.03 3dl7 s PRO 440 CO 0.34 -2.45 1.86 -0.07 0.04 0.00 0.00 177.00 176.73 3dl7 h LEU 441 N -1.71 0.97 -1.60 -3.56 3.38 -1.94 -2.45 115.31 108.40 3dl7 h LEU 441 Ca -0.49 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.50 3dl7 h LEU 441 Cb 1.28 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3dl7 h LEU 441 CO 0.51 0.60 0.00 4.11 0.09 0.00 0.00 178.44 183.75 3dl7 h TRP 442 N 1.09 0.00 0.00 1.13 5.08 -1.94 0.14 115.95 121.45 3dl7 h TRP 442 Ca 0.44 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.41 3dl7 h TRP 442 Cb 0.24 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.40 3dl7 h TRP 442 CO -0.01 0.00 -0.33 -1.33 -1.28 0.00 0.00 178.44 175.49 3dl7 n MET 443 N -2.35 0.19 0.00 0.12 2.81 -0.92 -4.99 117.12 111.99 3dl7 n MET 443 Ca -0.02 0.10 0.00 0.00 -1.81 0.00 0.00 57.70 55.97 3dl7 n MET 443 Cb 0.04 -1.66 0.00 0.00 -0.71 0.00 0.00 33.22 30.89 3dl7 n MET 443 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3dl7 n GLY 444 N 1.38 3.65 3.12 3.03 0.00 0.47 -3.77 105.19 113.07 3dl7 n GLY 444 Ca 0.05 0.12 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 3dl7 n GLY 444 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dl7 s VAL 445 N 0.00 3.65 0.60 1.61 1.01 -1.26 -4.79 120.40 121.23 3dl7 s VAL 445 Ca 0.00 -2.50 -0.12 0.00 0.00 0.00 0.00 61.98 59.35 3dl7 s VAL 445 Cb 0.00 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 3dl7 s VAL 445 CO 0.00 -0.80 1.02 -2.16 0.00 0.00 0.00 175.10 173.16 3dl7 s PRO 446 N 0.52 3.60 0.52 2.72 0.05 -1.25 -1.18 135.00 139.99 3dl7 s PRO 446 Ca 0.13 0.83 -0.22 0.00 0.05 0.00 0.00 61.00 61.79 3dl7 s PRO 446 Cb -0.21 -2.08 -0.06 0.00 0.05 0.00 0.00 34.50 32.19 3dl7 s PRO 446 CO -0.04 -0.56 1.28 -2.39 0.05 0.00 0.00 177.00 175.34 3dl7 n HIS 447 N -2.49 2.03 0.00 0.56 1.44 -1.26 -2.21 115.22 113.30 3dl7 n HIS 447 Ca 0.06 0.45 0.00 0.00 -2.01 0.00 0.00 57.72 56.22 3dl7 n HIS 447 Cb 0.54 -2.33 0.00 0.00 0.12 0.00 0.00 29.99 28.32 3dl7 n HIS 447 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3dl7 n GLY 448 N 0.85 2.75 0.64 -1.39 0.00 -1.26 -4.93 105.19 101.86 3dl7 n GLY 448 Ca 0.10 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.15 3dl7 n GLY 448 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3dl7 n TYR 449 N -2.00 0.47 -0.01 1.61 4.02 -0.94 -2.84 117.16 117.47 3dl7 n TYR 449 Ca 0.00 -0.20 0.04 0.00 -0.01 0.00 0.00 57.90 57.73 3dl7 n TYR 449 Cb 0.00 -0.08 -0.13 0.00 -0.02 0.00 0.00 39.34 39.11 3dl7 n TYR 449 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 3dl7 n GLU 450 N 0.23 0.65 -0.19 -0.72 0.00 -1.26 -4.57 120.64 114.78 3dl7 n GLU 450 Ca 0.09 -0.04 -0.02 0.00 0.00 0.00 0.00 57.16 57.19 3dl7 n GLU 450 Cb 0.34 -1.61 0.09 0.00 0.00 0.00 0.00 31.44 30.26 3dl7 n GLU 450 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 3dl7 h ILE 451 N 0.00 0.87 -0.44 3.84 2.04 -1.91 -1.22 117.51 120.69 3dl7 h ILE 451 Ca -0.16 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 3dl7 h ILE 451 Cb 1.40 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 3dl7 h ILE 451 CO 0.02 0.09 0.23 1.05 0.00 0.00 0.00 178.15 179.54 3dl7 h GLU 452 N 0.48 0.59 -0.17 2.37 4.11 -1.80 0.20 114.58 120.36 3dl7 h GLU 452 Ca 0.28 -0.06 -0.05 0.00 0.07 0.00 0.00 59.36 59.60 3dl7 h GLU 452 Cb 0.26 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 3dl7 h GLU 452 CO -0.23 0.44 -0.10 0.74 0.07 0.00 0.00 179.01 179.93 3dl7 h PHE 453 N 0.60 0.42 -0.70 2.06 0.04 -1.53 -0.55 116.94 117.28 3dl7 h PHE 453 Ca 0.16 -0.11 -0.07 0.00 2.80 0.00 0.00 57.97 60.75 3dl7 h PHE 453 Cb 0.02 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 38.05 3dl7 h PHE 453 CO 0.00 0.69 0.17 0.82 -0.60 0.00 0.00 178.31 179.39 3dl7 h ILE 454 N 0.03 1.26 0.00 -0.55 1.08 -0.77 -2.52 117.51 116.04 3dl7 h ILE 454 Ca 0.04 -0.96 0.00 0.00 -0.39 0.00 0.00 64.86 63.55 3dl7 h ILE 454 Cb 0.59 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 34.88 3dl7 h ILE 454 CO 0.03 0.37 0.00 -0.26 -0.69 0.00 0.00 178.15 177.60 3dl7 h PHE 455 N 1.05 0.00 0.00 1.37 -1.00 -0.99 -3.39 116.94 113.97 3dl7 h PHE 455 Ca 0.22 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.00 3dl7 h PHE 455 Cb 0.36 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.92 3dl7 h PHE 455 CO 0.03 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.14 3dl7 n GLY 456 N 0.25 0.96 0.33 -1.45 0.00 -0.86 -4.00 105.19 100.41 3dl7 n GLY 456 Ca 0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 46.02 45.96 3dl7 n GLY 456 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3dl7 h LEU 457 N 0.00 0.84 -1.10 0.99 4.07 -1.35 -0.85 115.31 117.91 3dl7 h LEU 457 Ca 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.89 3dl7 h LEU 457 Cb 0.00 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 41.53 3dl7 h LEU 457 CO 0.00 0.68 0.19 -2.65 -1.08 0.00 0.00 178.44 175.59 3dl7 n PRO 458 N -4.37 0.11 0.00 1.13 -0.02 -1.26 -1.45 135.00 129.14 3dl7 n PRO 458 Ca 0.07 0.60 0.11 0.00 -2.02 0.00 0.00 63.50 62.25 3dl7 n PRO 458 Cb 0.10 -2.06 0.63 0.00 -0.02 0.00 0.00 33.50 32.16 3dl7 n PRO 458 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3dl7 n LEU 459 N -2.15 0.00 -4.33 2.45 4.32 -0.32 -4.53 117.00 112.44 3dl7 n LEU 459 Ca -0.01 0.03 -0.41 0.00 -0.02 0.00 0.00 56.01 55.60 3dl7 n LEU 459 Cb 0.22 -0.03 -0.10 0.00 -1.62 0.00 0.00 43.42 41.89 3dl7 n LEU 459 CO 0.07 -0.01 -0.09 -0.62 -1.22 0.00 0.00 177.39 175.53 3dl7 s ASP 460 N -2.06 5.80 0.56 -1.43 -1.08 -0.53 -4.73 116.67 113.20 3dl7 s ASP 460 Ca 0.31 -1.31 0.26 0.00 -0.52 0.00 0.00 52.55 51.29 3dl7 s ASP 460 Cb 0.15 -2.05 1.52 0.00 -1.46 0.00 0.00 42.92 41.08 3dl7 s ASP 460 CO 0.26 -0.52 2.07 -0.65 0.52 0.00 0.00 175.17 176.85 3dl7 h PRO 461 N 8.50 0.00 0.00 4.34 0.11 -1.88 -0.39 132.00 142.69 3dl7 h PRO 461 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 3dl7 h PRO 461 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3dl7 h PRO 461 CO 0.76 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.42 3dl7 n SER 462 N -4.06 0.11 -0.71 -2.05 3.41 -1.26 -3.28 113.62 105.78 3dl7 n SER 462 Ca 0.04 0.54 0.11 0.00 -0.26 0.00 0.00 58.87 59.29 3dl7 n SER 462 Cb 0.39 -0.56 0.04 0.00 -0.26 0.00 0.00 64.21 63.83 3dl7 n SER 462 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dl7 n LEU 463 N -1.63 2.46 -1.65 1.04 4.77 -0.16 -4.99 117.00 116.85 3dl7 n LEU 463 Ca 0.02 -0.88 -0.15 0.00 -0.03 0.00 0.00 56.01 54.97 3dl7 n LEU 463 Cb 0.09 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 3dl7 n LEU 463 CO 0.08 0.43 -0.19 0.59 -1.33 0.00 0.00 177.39 176.98 3dl7 n ASN 464 N 0.62 -4.64 -4.79 -1.43 3.02 -1.21 -5.00 115.26 101.85 3dl7 n ASN 464 Ca 0.11 0.05 -0.36 0.00 -0.03 0.00 0.00 54.58 54.35 3dl7 n ASN 464 Cb 0.52 -3.72 -0.06 0.00 -0.61 0.00 0.00 39.78 35.91 3dl7 n ASN 464 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3dl7 s TYR 465 N -2.73 3.45 1.01 3.10 2.02 -1.26 -4.83 117.35 118.11 3dl7 s TYR 465 Ca 0.00 1.70 -0.12 0.00 -0.37 0.00 0.00 57.07 58.28 3dl7 s TYR 465 Cb 0.00 -2.99 0.20 0.00 -0.40 0.00 0.00 41.96 38.76 3dl7 s TYR 465 CO 0.00 -0.19 1.08 0.95 -1.57 0.00 0.00 175.55 175.83 3dl7 s THR 466 N -1.73 2.22 -0.28 -0.71 -4.23 -1.26 -4.85 115.64 104.81 3dl7 s THR 466 Ca 0.55 0.07 0.23 0.00 -1.18 0.00 0.00 61.69 61.36 3dl7 s THR 466 Cb -0.18 -2.24 0.28 0.00 1.34 0.00 0.00 72.50 71.70 3dl7 s THR 466 CO 0.23 -0.09 1.64 0.71 -0.54 0.00 0.00 174.62 176.57 3dl7 h THR 467 N -2.08 0.21 -0.45 3.99 1.35 -1.97 -2.29 112.91 111.67 3dl7 h THR 467 Ca -0.52 -1.19 -0.08 0.00 -0.55 0.00 0.00 66.41 64.07 3dl7 h THR 467 Cb 1.30 2.01 -0.02 0.00 -1.73 0.00 0.00 68.15 69.71 3dl7 h THR 467 CO 0.49 0.11 -0.01 -0.33 -0.25 0.00 0.00 175.52 175.53 3dl7 h GLU 468 N 0.00 0.80 -0.41 4.72 3.07 -2.00 -2.84 114.58 117.93 3dl7 h GLU 468 Ca -0.00 -0.26 -0.04 0.00 -0.50 0.00 0.00 59.36 58.55 3dl7 h GLU 468 Cb 1.00 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.82 3dl7 h GLU 468 CO 0.02 0.87 0.07 0.93 -1.40 0.00 0.00 179.01 179.49 3dl7 h GLU 469 N 0.65 0.63 -0.41 2.33 5.08 -1.82 -0.16 114.58 120.88 3dl7 h GLU 469 Ca 0.13 -0.12 -0.11 0.00 -1.00 0.00 0.00 59.36 58.26 3dl7 h GLU 469 Cb 0.51 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 3dl7 h GLU 469 CO 0.03 0.60 -0.17 -0.09 -1.00 0.00 0.00 179.01 178.37 3dl7 h ARG 470 N 0.61 0.78 -0.17 2.33 1.12 -1.37 0.68 114.38 118.36 3dl7 h ARG 470 Ca 0.14 -0.29 -0.21 0.00 -1.11 0.00 0.00 59.98 58.50 3dl7 h ARG 470 Cb 0.28 -0.05 0.01 0.00 -0.01 0.00 0.00 29.97 30.20 3dl7 h ARG 470 CO 0.00 0.90 -0.73 0.82 -3.11 0.00 0.00 179.97 177.86 3dl7 h ILE 471 N 0.69 1.29 -0.20 1.20 2.04 -1.18 -2.41 117.51 118.93 3dl7 h ILE 471 Ca 0.11 -1.94 0.04 0.00 1.00 0.00 0.00 64.86 64.06 3dl7 h ILE 471 Cb 0.67 1.92 -0.03 0.00 -0.74 0.00 0.00 36.82 38.64 3dl7 h ILE 471 CO 0.05 0.61 -0.01 0.15 0.00 0.00 0.00 178.15 178.95 3dl7 h PHE 472 N 0.54 -0.04 -0.89 1.37 3.57 -0.86 -1.84 116.94 118.79 3dl7 h PHE 472 Ca -0.04 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.51 3dl7 h PHE 472 Cb 1.34 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 40.08 3dl7 h PHE 472 CO 0.08 -0.05 0.58 0.00 -2.23 0.00 0.00 178.31 176.69 3dl7 h ALA 473 N 1.18 1.18 -0.57 2.41 0.00 -0.82 -1.14 119.26 121.51 3dl7 h ALA 473 Ca 0.10 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3dl7 h ALA 473 Cb 0.13 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3dl7 h ALA 473 CO -0.18 0.44 0.23 1.96 0.00 0.00 0.00 179.25 181.71 3dl7 h GLN 474 N 1.13 0.82 0.06 0.00 4.20 -1.01 -0.79 115.11 119.52 3dl7 h GLN 474 Ca 0.35 -0.12 -0.00 0.00 0.06 0.00 0.00 58.65 58.94 3dl7 h GLN 474 Cb -0.01 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.62 3dl7 h GLN 474 CO -0.11 0.67 -0.03 0.00 -0.67 0.00 0.00 178.83 178.69 3dl7 h ARG 475 N 0.81 -0.08 -0.86 1.46 3.08 -0.46 -2.33 114.38 116.00 3dl7 h ARG 475 Ca 0.19 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.22 3dl7 h ARG 475 Cb 0.15 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.18 3dl7 h ARG 475 CO -0.02 0.15 0.43 -0.07 -1.07 0.00 0.00 179.97 179.38 3dl7 h LEU 476 N -0.29 1.12 -1.42 3.04 3.38 -0.88 -0.24 115.31 120.01 3dl7 h LEU 476 Ca -0.01 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3dl7 h LEU 476 Cb 0.26 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 3dl7 h LEU 476 CO 0.01 0.93 0.29 0.24 0.09 0.00 0.00 178.44 180.00 3dl7 h MET 477 N 1.23 0.68 -0.24 1.13 2.86 -1.09 -0.26 114.93 119.23 3dl7 h MET 477 Ca 0.30 -0.06 -0.10 0.00 -2.06 0.00 0.00 59.70 57.78 3dl7 h MET 477 Cb 0.10 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 3dl7 h MET 477 CO -0.04 0.49 -0.23 0.87 1.06 0.00 0.00 176.91 179.06 3dl7 h LYS 478 N 0.69 0.58 0.47 1.72 1.79 -0.65 -1.39 116.57 119.77 3dl7 h LYS 478 Ca 0.18 -0.30 -0.02 0.00 -2.18 0.00 0.00 60.65 58.33 3dl7 h LYS 478 Cb -0.01 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 3dl7 h LYS 478 CO -0.03 0.89 -0.23 1.88 -1.08 0.00 0.00 179.45 180.88 3dl7 h TYR 479 N 0.29 -0.58 -0.54 -1.35 0.05 -0.37 0.26 116.97 114.72 3dl7 h TYR 479 Ca 0.04 -0.01 0.07 0.00 0.05 0.00 0.00 58.73 58.88 3dl7 h TYR 479 Cb 0.78 0.19 -0.06 0.00 1.01 0.00 0.00 36.73 38.65 3dl7 h TYR 479 CO 0.07 -0.36 0.21 -1.49 -1.05 0.00 0.00 178.16 175.54 3dl7 h TRP 480 N -0.63 0.36 0.03 4.88 6.55 -1.09 0.24 115.95 126.29 3dl7 h TRP 480 Ca -0.06 0.03 -0.23 0.00 0.95 0.00 0.00 58.89 59.57 3dl7 h TRP 480 Cb 0.49 -0.08 -0.02 0.00 -0.86 0.00 0.00 29.16 28.68 3dl7 h TRP 480 CO -0.04 0.12 -1.12 1.79 -1.05 0.00 0.00 178.44 178.13 3dl7 h THR 481 N 0.39 1.59 -0.21 1.49 1.35 -1.19 0.21 112.91 116.54 3dl7 h THR 481 Ca 0.26 -3.28 0.01 0.00 -0.55 0.00 0.00 66.41 62.85 3dl7 h THR 481 Cb 0.28 2.83 -0.02 0.00 -1.73 0.00 0.00 68.15 69.52 3dl7 h THR 481 CO -0.26 0.92 0.10 0.78 -0.25 0.00 0.00 175.52 176.82 3dl7 h ASN 482 N 0.02 0.15 -0.66 5.36 2.35 -0.11 0.22 115.58 122.90 3dl7 h ASN 482 Ca -0.06 0.01 0.05 0.00 -0.55 0.00 0.00 56.30 55.75 3dl7 h ASN 482 Cb 1.84 -0.02 -0.05 0.00 0.05 0.00 0.00 38.32 40.13 3dl7 h ASN 482 CO 0.14 0.12 0.38 0.15 -1.65 0.00 0.00 177.43 176.57 3dl7 h PHE 483 N 0.22 0.70 -0.88 1.19 3.57 -0.30 0.39 116.94 121.83 3dl7 h PHE 483 Ca 0.09 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.61 3dl7 h PHE 483 Cb 0.02 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.50 3dl7 h PHE 483 CO -0.09 0.35 0.56 0.00 -2.23 0.00 0.00 178.31 176.89 3dl7 h ALA 484 N 1.33 1.32 -0.29 2.41 0.00 0.13 0.11 119.26 124.27 3dl7 h ALA 484 Ca 0.29 -0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.95 3dl7 h ALA 484 Cb 0.14 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 3dl7 h ALA 484 CO -0.16 0.60 -0.48 0.00 0.00 0.00 0.00 179.25 179.21 3dl7 h ARG 485 N 1.20 0.85 0.00 0.00 3.08 0.20 -3.41 114.38 116.30 3dl7 h ARG 485 Ca 0.32 -0.52 0.00 0.00 0.07 0.00 0.00 59.98 59.85 3dl7 h ARG 485 Cb -0.10 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.01 3dl7 h ARG 485 CO -0.06 1.15 -0.06 0.25 -1.07 0.00 0.00 179.97 180.18 3dl7 n THR 486 N -4.07 0.00 -0.84 2.04 -2.24 0.05 -5.00 114.28 104.23 3dl7 n THR 486 Ca -0.04 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 3dl7 n THR 486 Cb 0.59 0.91 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 3dl7 n THR 486 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dl7 n GLY 487 N 0.58 0.74 2.71 3.38 0.00 0.37 -5.02 105.19 107.96 3dl7 n GLY 487 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 3dl7 n GLY 487 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dl7 s ASP 488 N -2.47 1.27 0.00 1.61 -1.08 -1.26 -4.82 116.67 109.93 3dl7 s ASP 488 Ca 0.00 0.01 0.25 0.00 -0.52 0.00 0.00 52.55 52.29 3dl7 s ASP 488 Cb 0.00 -0.26 1.38 0.00 -1.46 0.00 0.00 42.92 42.58 3dl7 s ASP 488 CO 0.00 -0.22 1.84 -0.81 0.52 0.00 0.00 175.17 176.50 3dl7 n PRO 489 N 5.19 0.59 -2.74 4.34 -0.04 -1.26 -3.18 135.00 137.89 3dl7 n PRO 489 Ca -0.06 0.03 -0.40 0.00 -0.04 0.00 0.00 63.50 63.03 3dl7 n PRO 489 Cb 0.50 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.40 3dl7 n PRO 489 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3dl7 s ASN 490 N -2.26 7.63 -0.33 3.54 0.01 -1.26 -4.34 114.94 117.94 3dl7 s ASN 490 Ca 0.31 1.96 -0.29 0.00 -0.71 0.00 0.00 52.86 54.13 3dl7 s ASN 490 Cb 0.17 -2.61 -0.01 0.00 0.41 0.00 0.00 41.25 39.20 3dl7 s ASN 490 CO 0.33 0.14 1.71 -0.62 -1.51 0.00 0.00 177.10 177.15 3dl7 s ASP 491 N -1.14 6.04 -0.66 -1.22 -1.08 -1.26 -4.96 116.67 112.40 3dl7 s ASP 491 Ca 0.41 1.27 0.03 0.00 -0.52 0.00 0.00 52.55 53.75 3dl7 s ASP 491 Cb -0.26 -2.53 0.35 0.00 -1.46 0.00 0.00 42.92 39.02 3dl7 s ASP 491 CO 0.32 -1.59 1.22 -0.81 0.52 0.00 0.00 175.17 174.83 3dl7 n PRO 492 N 8.26 3.69 -2.65 4.34 -0.04 -1.26 -2.35 135.00 145.00 3dl7 n PRO 492 Ca 0.21 -4.68 -0.21 0.00 -0.04 0.00 0.00 63.50 58.78 3dl7 n PRO 492 Cb 0.47 -2.29 0.05 0.00 -0.04 0.00 0.00 33.50 31.68 3dl7 n PRO 492 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3dl7 s ARG 493 N -3.70 2.42 0.00 0.54 3.00 -1.26 -5.13 118.95 114.82 3dl7 s ARG 493 Ca 0.47 -0.86 0.00 0.00 0.00 0.00 0.00 55.73 55.34 3dl7 s ARG 493 Cb 0.29 -2.48 0.00 0.00 0.00 0.00 0.00 34.95 32.77 3dl7 s ARG 493 CO -0.16 -0.81 0.00 -0.40 0.00 0.00 0.00 175.30 173.93 3dl7 n ASP 494 N -2.40 0.00 0.00 0.23 5.75 -0.99 -5.19 116.55 113.96 3dl7 n ASP 494 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.87 3dl7 n ASP 494 Cb 0.60 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.69 3dl7 n ASP 494 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 3dl7 n SER 495 N 0.00 0.00 -2.34 -1.12 7.64 -1.26 -4.86 113.62 111.67 3dl7 n SER 495 Ca 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.87 3dl7 n SER 495 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 3dl7 n SER 495 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 3dl7 n SER 497 N 0.00 -4.93 -4.72 6.43 7.64 -1.26 -5.01 113.62 111.77 3dl7 n SER 497 Ca 0.00 1.01 -0.31 0.00 1.01 0.00 0.00 58.87 60.58 3dl7 n SER 497 Cb 0.00 -4.09 0.13 0.00 -1.01 0.00 0.00 64.21 59.24 3dl7 n SER 497 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 3dl7 s PRO 498 N -1.06 1.66 0.38 1.43 0.02 -1.26 -4.95 135.00 131.22 3dl7 s PRO 498 Ca -0.05 1.39 -0.24 0.00 0.02 0.00 0.00 61.00 62.11 3dl7 s PRO 498 Cb 0.00 -1.81 -0.10 0.00 0.02 0.00 0.00 34.50 32.61 3dl7 s PRO 498 CO 0.56 -2.12 1.00 -0.65 -0.33 0.00 0.00 177.00 175.46 3dl7 s GLN 499 N -4.72 4.31 -0.51 5.54 -1.52 -1.26 -4.85 119.66 116.66 3dl7 s GLN 499 Ca 0.65 1.39 -0.29 0.00 -1.95 0.00 0.00 55.36 55.15 3dl7 s GLN 499 Cb -0.20 -2.57 0.03 0.00 -0.22 0.00 0.00 33.01 30.04 3dl7 s GLN 499 CO 0.56 0.02 1.22 -0.46 -0.25 0.00 0.00 175.29 176.38 3dl7 s TRP 500 N -1.73 2.64 0.43 0.91 -0.11 -1.26 -4.92 118.94 114.89 3dl7 s TRP 500 Ca 0.56 0.59 -0.17 0.00 1.22 0.00 0.00 56.10 58.30 3dl7 s TRP 500 Cb -0.19 -4.45 -0.09 0.00 -1.50 0.00 0.00 33.47 27.25 3dl7 s TRP 500 CO 0.24 -1.54 0.89 -1.25 -4.62 0.00 0.00 176.95 170.66 3dl7 s PRO 501 N 4.79 4.03 0.48 5.86 0.04 -1.26 -4.91 135.00 144.03 3dl7 s PRO 501 Ca 0.49 0.87 -0.24 0.00 0.04 0.00 0.00 61.00 62.16 3dl7 s PRO 501 Cb -0.08 -2.25 -0.08 0.00 0.04 0.00 0.00 34.50 32.13 3dl7 s PRO 501 CO 0.29 -0.06 1.29 -2.30 0.04 0.00 0.00 177.00 176.26 3dl7 n PRO 502 N -0.96 1.81 -2.52 0.56 -0.02 -1.26 -4.71 135.00 127.90 3dl7 n PRO 502 Ca 0.05 0.65 -0.41 0.00 -2.02 0.00 0.00 63.50 61.78 3dl7 n PRO 502 Cb 0.54 -2.46 -0.04 0.00 -0.02 0.00 0.00 33.50 31.52 3dl7 n PRO 502 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3dl7 s TYR 503 N -1.25 3.61 0.09 6.00 6.14 0.43 -4.54 117.35 127.83 3dl7 s TYR 503 Ca 0.66 1.62 0.01 0.00 0.64 0.00 0.00 57.07 60.00 3dl7 s TYR 503 Cb -0.46 -3.27 -0.04 0.00 0.42 0.00 0.00 41.96 38.61 3dl7 s TYR 503 CO 0.54 -0.56 -0.05 0.95 0.64 0.00 0.00 175.55 177.07 3dl7 s THR 504 N -0.41 0.58 0.08 4.34 -4.23 -1.26 -4.33 115.64 110.41 3dl7 s THR 504 Ca 0.48 -1.91 0.15 0.00 -1.18 0.00 0.00 61.69 59.23 3dl7 s THR 504 Cb -0.30 -1.69 0.04 0.00 1.34 0.00 0.00 72.50 71.89 3dl7 s THR 504 CO 0.36 -0.86 1.56 0.71 -0.54 0.00 0.00 174.62 175.84 3dl7 h THR 505 N 2.98 1.09 0.15 3.99 1.35 -1.91 -0.16 112.91 120.40 3dl7 h THR 505 Ca -0.35 -2.12 -0.01 0.00 -0.55 0.00 0.00 66.41 63.39 3dl7 h THR 505 Cb 1.16 2.25 0.00 0.00 -1.73 0.00 0.00 68.15 69.84 3dl7 h THR 505 CO 0.65 0.54 -0.07 0.00 -0.25 0.00 0.00 175.52 176.38 3dl7 h ALA 506 N 1.45 -0.53 0.01 6.62 0.00 -1.99 -3.40 119.26 121.43 3dl7 h ALA 506 Ca -0.01 -0.04 -0.21 0.00 0.00 0.00 0.00 54.91 54.66 3dl7 h ALA 506 Cb 1.21 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 3dl7 h ALA 506 CO 0.07 -0.51 -0.97 0.00 0.00 0.00 0.00 179.25 177.84 3dl7 h ALA 507 N -1.75 0.41 -4.57 0.00 0.00 -1.98 -3.48 119.26 107.90 3dl7 h ALA 507 Ca -0.02 -0.85 -0.40 0.00 0.00 0.00 0.00 54.91 53.64 3dl7 h ALA 507 Cb 0.15 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 17.84 3dl7 h ALA 507 CO 0.03 1.13 -0.59 1.04 0.00 0.00 0.00 179.25 180.87 3dl7 n GLN 508 N -3.45 -4.39 -2.66 0.00 6.02 -0.07 -4.42 117.38 108.41 3dl7 n GLN 508 Ca -0.01 0.83 -0.41 0.00 -0.01 0.00 0.00 57.00 57.39 3dl7 n GLN 508 Cb 0.90 -5.65 -0.04 0.00 1.02 0.00 0.00 30.24 26.47 3dl7 n GLN 508 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3dl7 s GLN 509 N -5.71 4.68 0.14 -1.09 -0.21 -1.26 -0.65 119.66 115.56 3dl7 s GLN 509 Ca 0.30 1.54 -0.05 0.00 0.02 0.00 0.00 55.36 57.17 3dl7 s GLN 509 Cb -0.14 -3.34 -0.02 0.00 1.00 0.00 0.00 33.01 30.51 3dl7 s GLN 509 CO 0.37 0.20 0.17 1.52 -2.12 0.00 0.00 175.29 175.42 3dl7 s TYR 510 N -0.19 0.57 0.13 0.91 1.13 0.44 -3.78 117.35 116.56 3dl7 s TYR 510 Ca 0.47 -0.96 0.08 0.00 -1.41 0.00 0.00 57.07 55.26 3dl7 s TYR 510 Cb -0.26 -0.25 -0.04 0.00 -1.10 0.00 0.00 41.96 40.32 3dl7 s TYR 510 CO 0.32 -0.61 -0.12 0.14 -2.51 0.00 0.00 175.55 172.77 3dl7 s VAL 511 N -3.99 3.16 -0.02 -3.49 -7.23 -0.92 0.24 120.40 108.15 3dl7 s VAL 511 Ca 0.18 -1.46 -0.23 0.00 -1.81 0.00 0.00 61.98 58.67 3dl7 s VAL 511 Cb 0.05 -2.50 -0.05 0.00 0.56 0.00 0.00 36.38 34.45 3dl7 s VAL 511 CO -0.01 0.04 0.67 -0.94 -0.31 0.00 0.00 175.10 174.55 3dl7 s SER 512 N -2.38 7.02 -0.32 4.85 1.04 -0.94 -0.45 113.70 122.52 3dl7 s SER 512 Ca 0.21 1.22 -0.09 0.00 0.48 0.00 0.00 55.95 57.78 3dl7 s SER 512 Cb -0.10 -2.40 0.01 0.00 0.10 0.00 0.00 66.02 63.62 3dl7 s SER 512 CO 0.13 -0.01 0.13 -0.76 0.98 0.00 0.00 173.24 173.72 3dl7 s LEU 513 N 0.25 4.16 0.00 2.42 1.43 0.14 -4.12 118.68 122.96 3dl7 s LEU 513 Ca 0.35 -0.73 0.00 0.00 -1.03 0.00 0.00 54.13 52.72 3dl7 s LEU 513 Cb -0.18 -1.95 0.00 0.00 0.03 0.00 0.00 46.19 44.08 3dl7 s LEU 513 CO 0.19 -0.24 0.00 -0.46 0.23 0.00 0.00 176.35 176.06 3dl7 n ASN 514 N 4.93 0.00 0.03 2.29 0.23 -1.26 -0.09 115.26 121.39 3dl7 n ASN 514 Ca -0.14 -0.91 -0.03 0.00 -0.53 0.00 0.00 54.58 52.98 3dl7 n ASN 514 Cb 0.48 0.00 0.22 0.00 -2.08 0.00 0.00 39.78 38.39 3dl7 n ASN 514 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 3dl7 h LEU 515 N 0.00 0.44-10.18 -4.53 3.38 -1.96 -3.43 115.31 99.03 3dl7 h LEU 515 Ca 0.00 -0.15 -0.53 0.00 0.09 0.00 0.00 57.88 57.29 3dl7 h LEU 515 Cb 0.00 -0.12 0.15 0.00 0.09 0.00 0.00 40.66 40.78 3dl7 h LEU 515 CO 0.00 0.69 0.39 -0.54 0.09 0.00 0.00 178.44 179.08 3dl7 s LYS 516 N -4.48 2.25 0.92 1.13 1.02 -1.26 -5.00 119.74 114.32 3dl7 s LYS 516 Ca -0.06 1.70 -0.10 0.00 0.02 0.00 0.00 55.97 57.53 3dl7 s LYS 516 Cb 0.14 -1.85 0.15 0.00 -0.52 0.00 0.00 37.83 35.74 3dl7 s LYS 516 CO 0.78 -1.73 1.12 -2.30 -0.92 0.00 0.00 175.35 172.30 3dl7 n PRO 517 N -2.65 -0.47 -1.59 -1.68 -0.02 -1.26 -4.85 135.00 122.48 3dl7 n PRO 517 Ca 0.13 -0.07 -0.53 0.00 -2.02 0.00 0.00 63.50 61.01 3dl7 n PRO 517 Cb 0.50 -2.36 -0.06 0.00 -0.02 0.00 0.00 33.50 31.56 3dl7 n PRO 517 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3dl7 n LEU 518 N -4.15 1.50 -4.27 2.45 4.77 -1.26 -4.95 117.00 111.08 3dl7 n LEU 518 Ca 0.12 1.12 -0.32 0.00 -0.03 0.00 0.00 56.01 56.90 3dl7 n LEU 518 Cb 0.52 -1.16 -0.16 0.00 -2.33 0.00 0.00 43.42 40.29 3dl7 n LEU 518 CO 0.49 -1.11 -0.52 -0.70 -1.33 0.00 0.00 177.39 174.23 3dl7 s GLU 519 N 0.58 3.17 -0.08 3.23 2.12 -1.26 -4.57 118.70 121.89 3dl7 s GLU 519 Ca 0.86 -0.81 -0.24 0.00 0.36 0.00 0.00 54.97 55.14 3dl7 s GLU 519 Cb -0.99 -2.44 -0.03 0.00 0.26 0.00 0.00 34.13 30.92 3dl7 s GLU 519 CO 0.49 0.17 0.73 0.08 -0.54 0.00 0.00 175.26 176.19 3dl7 s VAL 520 N 0.40 5.02 0.22 3.70 1.01 -1.26 -2.22 120.40 127.26 3dl7 s VAL 520 Ca -0.15 1.50 0.09 0.00 0.00 0.00 0.00 61.98 63.42 3dl7 s VAL 520 Cb -0.17 -4.07 -0.05 0.00 0.00 0.00 0.00 36.38 32.10 3dl7 s VAL 520 CO 0.07 0.22 -0.17 -0.13 0.00 0.00 0.00 175.10 175.08 3dl7 s ARG 521 N 0.98 1.44 -0.05 2.72 0.52 0.14 -4.97 118.95 119.73 3dl7 s ARG 521 Ca 0.38 -1.61 0.06 0.00 -0.52 0.00 0.00 55.73 54.04 3dl7 s ARG 521 Cb -0.18 -1.40 -0.01 0.00 0.52 0.00 0.00 34.95 33.88 3dl7 s ARG 521 CO 0.18 0.26 -0.24 1.03 0.02 0.00 0.00 175.30 176.55 3dl7 s ARG 522 N -3.39 2.51 0.00 3.54 0.52 -1.26 -0.42 118.95 120.45 3dl7 s ARG 522 Ca 0.23 -0.89 0.00 0.00 -0.52 0.00 0.00 55.73 54.56 3dl7 s ARG 522 Cb -0.03 -2.18 0.00 0.00 0.52 0.00 0.00 34.95 33.26 3dl7 s ARG 522 CO 0.09 0.42 0.00 0.41 0.02 0.00 0.00 175.30 176.25 3dl7 n GLY 523 N 2.84 -2.78 3.42 -3.53 0.00 0.18 -4.91 105.19 100.40 3dl7 n GLY 523 Ca -0.17 -0.65 -0.44 0.00 0.00 0.00 0.00 46.02 44.75 3dl7 n GLY 523 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dl7 s LEU 524 N 0.00 5.34 -1.44 0.99 2.96 -1.26 -4.30 118.68 120.97 3dl7 s LEU 524 Ca 0.00 -1.96 -0.06 0.00 -0.22 0.00 0.00 54.13 51.90 3dl7 s LEU 524 Cb 0.00 -2.35 0.04 0.00 0.50 0.00 0.00 46.19 44.38 3dl7 s LEU 524 CO 0.00 -1.02 0.69 0.54 -1.32 0.00 0.00 176.35 175.23 3dl7 n ARG 525 N 6.18 -4.34 -0.30 1.98 5.12 -1.26 -4.74 116.66 119.30 3dl7 n ARG 525 Ca 0.14 0.52 -0.01 0.00 -1.93 0.00 0.00 57.85 56.57 3dl7 n ARG 525 Cb 0.47 -5.04 0.17 0.00 -1.16 0.00 0.00 32.46 26.91 3dl7 n ARG 525 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3dl7 h ALA 526 N 0.89 1.36 -0.03 7.54 0.00 -1.93 0.22 119.26 127.31 3dl7 h ALA 526 Ca -0.61 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.21 3dl7 h ALA 526 Cb 1.37 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.80 3dl7 h ALA 526 CO 0.63 0.59 -0.08 1.96 0.00 0.00 0.00 179.25 182.35 3dl7 h GLN 527 N 1.20 0.11 -0.24 0.00 1.08 -1.96 -2.46 115.11 112.84 3dl7 h GLN 527 Ca 0.32 -0.08 -0.10 0.00 -1.45 0.00 0.00 58.65 57.34 3dl7 h GLN 527 Cb -0.13 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.30 3dl7 h GLN 527 CO -0.07 0.67 -0.29 1.15 -0.95 0.00 0.00 178.83 179.35 3dl7 h THR 528 N -0.43 1.28 0.00 -0.54 2.02 -1.87 -2.49 112.91 110.87 3dl7 h THR 528 Ca -0.00 -1.34 -0.12 0.00 0.77 0.00 0.00 66.41 65.72 3dl7 h THR 528 Cb 0.68 1.41 -0.02 0.00 -1.74 0.00 0.00 68.15 68.48 3dl7 h THR 528 CO 0.02 0.42 -0.55 0.00 0.37 0.00 0.00 175.52 175.78 3dl7 h ALA 530 N 1.45 1.25 0.33 0.00 0.00 -1.08 0.59 119.26 121.81 3dl7 h ALA 530 Ca -0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3dl7 h ALA 530 Cb 1.19 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 3dl7 h ALA 530 CO 0.07 0.48 -0.25 0.35 0.00 0.00 0.00 179.25 179.90 3dl7 h PHE 531 N 1.18 -0.67 -0.38 0.00 3.57 -1.00 0.57 116.94 120.21 3dl7 h PHE 531 Ca 0.38 -0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.73 3dl7 h PHE 531 Cb 0.02 0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 3dl7 h PHE 531 CO -0.01 -0.38 -0.33 -1.49 -2.23 0.00 0.00 178.31 173.87 3dl7 h TRP 532 N -0.59 1.06 0.00 0.41 4.06 -1.17 0.49 115.95 120.22 3dl7 h TRP 532 Ca -0.03 -0.31 -0.18 0.00 2.06 0.00 0.00 58.89 60.43 3dl7 h TRP 532 Cb 0.51 -0.23 -0.03 0.00 -1.00 0.00 0.00 29.16 28.41 3dl7 h TRP 532 CO -0.13 1.12 -1.21 -0.91 -3.56 0.00 0.00 178.44 173.75 3dl7 h ASN 533 N 0.71 0.00 0.00 -3.49 2.35 0.19 -3.38 115.58 111.96 3dl7 h ASN 533 Ca 0.07 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.66 3dl7 h ASN 533 Cb 0.92 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.26 3dl7 h ASN 533 CO 0.08 0.70 -1.57 0.54 -1.65 0.00 0.00 177.43 175.53 3dl7 n ARG 534 N -3.06 0.24 -0.09 0.81 1.74 0.16 -4.77 116.66 111.69 3dl7 n ARG 534 Ca -0.07 0.07 -0.21 0.00 -0.77 0.00 0.00 57.85 56.87 3dl7 n ARG 534 Cb 0.87 -1.11 -0.12 0.00 -1.02 0.00 0.00 32.46 31.08 3dl7 n ARG 534 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 3dl7 h PHE 535 N -0.10 0.02 -0.67 -1.55 3.57 -1.15 -3.37 116.94 113.69 3dl7 h PHE 535 Ca -0.24 -0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.36 3dl7 h PHE 535 Cb 1.32 -0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.97 3dl7 h PHE 535 CO -0.00 1.45 0.24 1.25 -2.23 0.00 0.00 178.31 179.02 3dl7 h LEU 536 N -0.95 0.22 -0.80 0.59 7.12 -1.08 -1.20 115.31 119.20 3dl7 h LEU 536 Ca -0.31 0.10 0.14 0.00 0.13 0.00 0.00 57.88 57.93 3dl7 h LEU 536 Cb 1.30 0.08 -0.09 0.00 -0.53 0.00 0.00 40.66 41.42 3dl7 h LEU 536 CO -0.17 0.11 0.37 -0.65 -0.13 0.00 0.00 178.44 177.96 3dl7 h PRO 537 N 0.41 0.53 -0.92 5.25 0.11 -1.76 -1.84 132.00 133.78 3dl7 h PRO 537 Ca 0.35 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 66.46 3dl7 h PRO 537 Cb 0.49 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 31.43 3dl7 h PRO 537 CO -0.36 0.35 0.60 0.87 -0.21 0.00 0.00 178.00 179.24 3dl7 h LYS 538 N 0.54 1.13 -0.58 1.05 1.57 -1.39 -1.17 116.57 117.72 3dl7 h LYS 538 Ca 0.43 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 59.09 3dl7 h LYS 538 Cb 0.62 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 3dl7 h LYS 538 CO -0.37 0.75 0.17 1.25 -0.57 0.00 0.00 179.45 180.67 3dl7 h LEU 539 N 1.16 0.87 -0.19 2.94 5.85 -0.96 -3.10 115.31 121.88 3dl7 h LEU 539 Ca 0.36 -0.22 -0.10 0.00 0.84 0.00 0.00 57.88 58.76 3dl7 h LEU 539 Cb -0.01 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 40.79 3dl7 h LEU 539 CO -0.11 0.86 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.49 3dl7 h LEU 540 N 0.83 0.58 -1.41 2.25 3.38 -1.18 -3.06 115.31 116.70 3dl7 h LEU 540 Ca 0.19 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.64 3dl7 h LEU 540 Cb 0.31 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3dl7 h LEU 540 CO -0.00 0.99 0.00 -1.54 0.09 0.00 0.00 178.44 177.98 3dl7 n SER 541 N -4.36 0.83 -3.46 -0.43 3.41 -0.46 0.00 113.62 109.15 3dl7 n SER 541 Ca -0.06 -0.91 -0.27 0.00 -0.26 0.00 0.00 58.87 57.38 3dl7 n SER 541 Cb 0.46 -0.23 -0.09 0.00 -0.26 0.00 0.00 64.21 64.10 3dl7 n SER 541 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dl7 n ALA 542 N 0.48 3.54 -2.66 7.33 0.00 -1.16 -4.99 120.51 123.05 3dl7 n ALA 542 Ca 0.00 -4.34 -0.11 0.00 0.00 0.00 0.00 53.44 49.00 3dl7 n ALA 542 Cb 0.16 -0.89 0.01 0.00 0.00 0.00 0.00 19.45 18.73 3dl7 n ALA 542 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3dl7 n THR 543 N 1.29 -1.99 0.00 0.00 -1.04 -0.78 -5.02 114.28 106.74 3dl7 n THR 543 Ca 0.26 0.26 0.00 0.00 -2.04 0.00 0.00 64.05 62.53 3dl7 n THR 543 Cb 0.43 -2.39 0.00 0.00 -1.82 0.00 0.00 70.33 66.55 3dl7 n THR 543 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43