#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h7h s LYS 2 N 0.00 4.40 -0.03 -1.46 2.20 -1.26 -4.97 119.74 118.63 1h7h s LYS 2 Ca 0.00 0.86 0.04 0.00 -0.36 0.00 0.00 55.97 56.51 1h7h s LYS 2 Cb 0.00 -3.38 -0.01 0.00 -1.51 0.00 0.00 37.83 32.93 1h7h s LYS 2 CO 0.00 0.25 -0.16 0.00 -0.36 0.00 0.00 175.35 175.08 1h7h s ALA 3 N 0.18 1.38 0.12 3.13 0.00 -1.26 -0.60 121.76 124.70 1h7h s ALA 3 Ca 0.35 -0.66 0.06 0.00 0.00 0.00 0.00 51.96 51.71 1h7h s ALA 3 Cb -0.19 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.48 1h7h s ALA 3 CO 0.19 0.29 -0.14 0.14 0.00 0.00 0.00 175.76 176.23 1h7h s VAL 4 N -0.13 1.31 -0.15 0.00 -7.23 -0.70 -1.02 120.40 112.49 1h7h s VAL 4 Ca 0.01 -1.67 -0.03 0.00 -1.81 0.00 0.00 61.98 58.48 1h7h s VAL 4 Cb -0.09 -1.48 -0.03 0.00 0.56 0.00 0.00 36.38 35.34 1h7h s VAL 4 CO 0.01 -0.39 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.74 1h7h s ILE 5 N -2.03 3.91 -0.12 -0.62 1.01 -0.33 -1.42 121.20 121.61 1h7h s ILE 5 Ca 0.08 -0.36 0.02 0.00 0.00 0.00 0.00 60.65 60.39 1h7h s ILE 5 Cb -0.06 -2.70 -0.00 0.00 0.01 0.00 0.00 42.46 39.71 1h7h s ILE 5 CO 0.03 0.50 -0.20 -0.69 0.00 0.00 0.00 174.94 174.58 1h7h s VAL 6 N 0.24 2.34 -0.41 2.92 1.01 -0.02 -0.33 120.40 126.15 1h7h s VAL 6 Ca -0.03 -0.91 -0.01 0.00 0.00 0.00 0.00 61.98 61.04 1h7h s VAL 6 Cb -0.14 -1.93 0.11 0.00 0.00 0.00 0.00 36.38 34.42 1h7h s VAL 6 CO 0.03 0.55 0.18 -0.63 0.00 0.00 0.00 175.10 175.23 1h7h s ILE 7 N 0.47 3.01 0.05 2.22 1.01 0.55 -1.79 121.20 126.71 1h7h s ILE 7 Ca -0.14 -2.26 -0.31 0.00 0.00 0.00 0.00 60.65 57.94 1h7h s ILE 7 Cb -0.17 -3.10 -0.07 0.00 0.01 0.00 0.00 42.46 39.14 1h7h s ILE 7 CO 0.06 -0.69 1.47 -2.84 0.00 0.00 0.00 174.94 172.95 1h7h s PRO 8 N 0.92 4.26 -0.39 2.79 0.02 -1.24 -1.45 135.00 139.92 1h7h s PRO 8 Ca 0.10 2.10 0.01 0.00 0.02 0.00 0.00 61.00 63.23 1h7h s PRO 8 Cb -0.22 -3.51 0.14 0.00 0.02 0.00 0.00 34.50 30.94 1h7h s PRO 8 CO -0.05 -0.60 0.23 0.00 -0.33 0.00 0.00 177.00 176.25 1h7h s ALA 9 N 2.19 1.36 0.06 -1.55 0.00 0.75 -3.36 121.76 121.21 1h7h s ALA 9 Ca 0.67 -2.14 -0.26 0.00 0.00 0.00 0.00 51.96 50.23 1h7h s ALA 9 Cb -0.35 -1.70 -0.06 0.00 0.00 0.00 0.00 23.12 21.02 1h7h s ALA 9 CO 0.29 -2.09 0.81 0.50 0.00 0.00 0.00 175.76 175.27 1h7h s ARG 10 N 0.77 4.54 -0.06 0.00 3.52 -1.26 -4.43 118.95 122.02 1h7h s ARG 10 Ca 0.19 1.15 -0.15 0.00 -0.13 0.00 0.00 55.73 56.79 1h7h s ARG 10 Cb -0.22 -3.36 -0.10 0.00 -1.56 0.00 0.00 34.95 29.71 1h7h s ARG 10 CO -0.01 0.27 0.60 -0.92 -0.81 0.00 0.00 175.30 174.44 1h7h h TYR 11 N 5.61 -0.26 -1.40 5.12 3.20 -1.97 -3.43 116.97 123.85 1h7h h TYR 11 Ca -0.44 -0.01 -0.68 0.00 3.14 0.00 0.00 58.73 60.75 1h7h h TYR 11 Cb 1.21 0.09 -0.00 0.00 1.54 0.00 0.00 36.73 39.56 1h7h h TYR 11 CO 0.65 0.03 1.22 0.41 -1.64 0.00 0.00 178.16 178.83 1h7h n GLY 12 N 0.83 0.79 3.11 1.82 0.00 -1.26 -2.08 105.19 108.39 1h7h n GLY 12 Ca -0.06 0.92 -0.12 0.00 0.00 0.00 0.00 46.02 46.76 1h7h n GLY 12 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1h7h s SER 13 N 5.67 -0.29 0.00 1.61 0.15 -1.26 -4.93 113.70 114.65 1h7h s SER 13 Ca 1.03 0.55 0.00 0.00 0.70 0.00 0.00 55.95 58.23 1h7h s SER 13 Cb -0.88 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 63.91 1h7h s SER 13 CO 0.54 -0.14 0.94 -1.54 1.20 0.00 0.00 173.24 174.24 1h7h n SER 14 N 3.73 0.00 -0.15 5.45 3.41 -1.26 -2.32 113.62 122.48 1h7h n SER 14 Ca -0.20 0.94 0.04 0.00 -0.26 0.00 0.00 58.87 59.39 1h7h n SER 14 Cb 0.55 -0.44 0.19 0.00 -0.26 0.00 0.00 64.21 64.26 1h7h n SER 14 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1h7h n ARG 15 N -1.88 1.19 -2.75 4.33 1.74 -1.26 -4.30 116.66 113.73 1h7h n ARG 15 Ca 0.00 -0.29 -0.07 0.00 -0.77 0.00 0.00 57.85 56.72 1h7h n ARG 15 Cb 0.00 -1.15 0.04 0.00 -1.02 0.00 0.00 32.46 30.33 1h7h n ARG 15 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1h7h n LEU 16 N -0.34 -3.02 -4.69 0.55 4.77 -1.23 -4.91 117.00 108.12 1h7h n LEU 16 Ca 0.07 -3.10 -0.42 0.00 -0.03 0.00 0.00 56.01 52.53 1h7h n LEU 16 Cb 0.09 0.80 -0.03 0.00 -2.33 0.00 0.00 43.42 41.95 1h7h n LEU 16 CO 0.05 1.95 1.45 -2.16 -1.33 0.00 0.00 177.39 177.36 1h7h s PRO 17 N 0.74 4.14 -0.68 3.23 0.04 -0.98 -2.24 135.00 139.25 1h7h s PRO 17 Ca 0.31 2.58 -0.00 0.00 0.04 0.00 0.00 61.00 63.92 1h7h s PRO 17 Cb 0.15 -3.54 -0.01 0.00 0.04 0.00 0.00 34.50 31.14 1h7h s PRO 17 CO -0.18 -0.83 0.57 0.41 0.04 0.00 0.00 177.00 177.02 1h7h n GLY 18 N 4.19 -0.05 0.20 0.56 0.00 -0.88 -4.95 105.19 104.25 1h7h n GLY 18 Ca 0.17 -0.10 -0.08 0.00 0.00 0.00 0.00 46.02 46.02 1h7h n GLY 18 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1h7h h LYS 19 N -1.03 0.61 0.00 1.61 3.64 -1.53 -2.80 116.57 117.07 1h7h h LYS 19 Ca -0.34 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 1h7h h LYS 19 Cb 1.19 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1h7h h LYS 19 CO 0.28 0.43 0.00 -0.35 -2.27 0.00 0.00 179.45 177.55 1h7h n PRO 20 N -4.74 0.13 0.00 1.90 -0.04 -1.26 -2.38 135.00 128.60 1h7h n PRO 20 Ca 0.01 0.45 0.12 0.00 -0.04 0.00 0.00 63.50 64.05 1h7h n PRO 20 Cb 0.04 -1.79 0.16 0.00 -0.04 0.00 0.00 33.50 31.88 1h7h n PRO 20 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1h7h n LEU 21 N -2.04 1.98 -4.76 1.53 4.77 -1.06 -0.68 117.00 116.74 1h7h n LEU 21 Ca 0.01 -0.68 -0.41 0.00 -0.03 0.00 0.00 56.01 54.90 1h7h n LEU 21 Cb 0.15 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 1h7h n LEU 21 CO 0.14 0.35 1.19 -0.76 -1.33 0.00 0.00 177.39 176.98 1h7h s LEU 22 N -2.32 4.33 0.09 2.23 1.43 -1.00 -4.50 118.68 118.94 1h7h s LEU 22 Ca 0.24 2.99 -0.30 0.00 -1.03 0.00 0.00 54.13 56.03 1h7h s LEU 22 Cb 0.19 -3.65 -0.05 0.00 0.03 0.00 0.00 46.19 42.71 1h7h s LEU 22 CO 0.47 -0.89 1.02 -0.62 0.23 0.00 0.00 176.35 176.56 1h7h s ASP 23 N 0.18 7.38 -0.15 2.29 -1.08 -1.26 -0.28 116.67 123.75 1h7h s ASP 23 Ca 0.58 1.83 -0.03 0.00 -0.52 0.00 0.00 52.55 54.41 1h7h s ASP 23 Cb -0.47 -2.59 0.05 0.00 -1.46 0.00 0.00 42.92 38.46 1h7h s ASP 23 CO 0.55 -0.19 0.05 -0.63 0.52 0.00 0.00 175.17 175.47 1h7h s ILE 24 N 0.34 0.24 -1.56 4.11 1.01 -0.25 -4.86 121.20 120.24 1h7h s ILE 24 Ca 0.50 -0.20 -0.08 0.00 0.00 0.00 0.00 60.65 60.88 1h7h s ILE 24 Cb -0.24 -0.70 0.07 0.00 0.01 0.00 0.00 42.46 41.59 1h7h s ILE 24 CO 0.30 -0.10 0.49 1.33 0.00 0.00 0.00 174.94 176.96 1h7h n VAL 25 N 5.17 -1.89 -0.43 2.92 0.24 -1.26 -2.02 118.33 121.06 1h7h n VAL 25 Ca -0.07 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 61.92 1h7h n VAL 25 Cb 0.49 -1.96 0.00 0.00 -1.47 0.00 0.00 33.84 30.90 1h7h n VAL 25 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1h7h n GLY 26 N -1.83 1.26 3.18 7.63 0.00 -1.26 -5.04 105.19 109.12 1h7h n GLY 26 Ca -0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 1h7h n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h7h s LYS 27 N -0.33 1.10 0.58 1.61 1.02 -0.86 -5.10 119.74 117.76 1h7h s LYS 27 Ca 0.00 -0.82 -0.19 0.00 0.02 0.00 0.00 55.97 54.98 1h7h s LYS 27 Cb 0.00 -1.15 -0.04 0.00 -0.52 0.00 0.00 37.83 36.12 1h7h s LYS 27 CO 0.00 0.29 1.19 -1.25 -0.92 0.00 0.00 175.35 174.66 1h7h s PRO 28 N -1.13 3.09 0.27 -1.68 0.04 -1.26 -1.09 135.00 133.24 1h7h s PRO 28 Ca 0.04 1.78 -0.00 0.00 0.04 0.00 0.00 61.00 62.86 1h7h s PRO 28 Cb -0.08 -1.97 0.58 0.00 0.04 0.00 0.00 34.50 33.07 1h7h s PRO 28 CO 0.01 -1.10 1.72 1.98 0.04 0.00 0.00 177.00 179.65 1h7h h MET 29 N 1.01 0.44 -0.43 4.56 1.85 -0.23 -0.94 114.93 121.19 1h7h h MET 29 Ca -0.50 -0.03 0.06 0.00 -0.61 0.00 0.00 59.70 58.62 1h7h h MET 29 Cb 1.29 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 33.19 1h7h h MET 29 CO 0.56 0.29 0.29 0.97 -0.40 0.00 0.00 176.91 178.62 1h7h h ILE 30 N 0.45 0.96 -0.49 1.77 6.09 -1.13 -1.87 117.51 123.29 1h7h h ILE 30 Ca 0.48 -0.12 -0.11 0.00 -1.37 0.00 0.00 64.86 63.74 1h7h h ILE 30 Cb 0.81 0.59 -0.02 0.00 0.47 0.00 0.00 36.82 38.67 1h7h h ILE 30 CO -0.45 0.06 -0.12 -0.61 -3.07 0.00 0.00 178.15 173.96 1h7h h GLN 31 N 0.34 0.95 -0.79 2.19 4.15 -1.43 -1.59 115.11 118.92 1h7h h GLN 31 Ca 0.19 -0.37 0.00 0.00 0.77 0.00 0.00 58.65 59.25 1h7h h GLN 31 Cb 0.31 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 27.91 1h7h h GLN 31 CO -0.04 1.03 0.51 0.45 -1.93 0.00 0.00 178.83 178.85 1h7h h HIS 32 N 0.80 1.01 -0.29 3.99 3.86 -1.28 0.15 115.15 123.39 1h7h h HIS 32 Ca 0.12 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.30 1h7h h HIS 32 Cb 0.68 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.80 1h7h h HIS 32 CO 0.05 0.65 -0.01 0.28 0.86 0.00 0.00 177.93 179.76 1h7h h VAL 33 N 1.08 1.26 -0.30 2.45 2.07 -1.35 -2.31 116.25 119.16 1h7h h VAL 33 Ca 0.29 -0.96 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 1h7h h VAL 33 Cb -0.10 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1h7h h VAL 33 CO -0.06 0.31 0.19 0.22 0.02 0.00 0.00 177.57 178.24 1h7h h TYR 34 N 0.30 0.39 -0.80 1.57 5.03 -0.86 0.37 116.97 122.97 1h7h h TYR 34 Ca 0.08 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.38 1h7h h TYR 34 Cb 0.45 -0.13 -0.04 0.00 1.55 0.00 0.00 36.73 38.56 1h7h h TYR 34 CO 0.04 0.28 0.45 0.93 -1.32 0.00 0.00 178.16 178.53 1h7h h GLU 35 N 0.39 1.10 -0.20 1.82 5.08 -0.71 -1.51 114.58 120.55 1h7h h GLU 35 Ca 0.11 -0.12 -0.18 0.00 -1.00 0.00 0.00 59.36 58.17 1h7h h GLU 35 Cb -0.01 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.02 1h7h h GLU 35 CO -0.02 0.80 -0.61 0.00 -1.00 0.00 0.00 179.01 178.17 1h7h h ARG 36 N 1.11 0.69 -0.71 2.33 3.08 -1.04 -3.00 114.38 116.83 1h7h h ARG 36 Ca 0.28 -0.47 0.01 0.00 0.07 0.00 0.00 59.98 59.88 1h7h h ARG 36 Cb 0.01 0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.09 1h7h h ARG 36 CO -0.05 1.09 0.47 0.00 -1.07 0.00 0.00 179.97 180.42 1h7h h ALA 37 N 0.80 1.52 0.00 0.04 0.00 -0.49 -1.27 119.26 119.86 1h7h h ALA 37 Ca -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1h7h h ALA 37 Cb 1.20 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1h7h h ALA 37 CO 0.12 0.44 -0.08 -0.07 0.00 0.00 0.00 179.25 179.66 1h7h h LEU 38 N 0.94 0.00 -0.18 0.00 3.38 -1.15 -2.27 115.31 116.03 1h7h h LEU 38 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1h7h h LEU 38 Cb -0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1h7h h LEU 38 CO -0.06 0.08 -0.02 0.00 0.09 0.00 0.00 178.44 178.53 1h7h n GLN 39 N -3.48 0.97 -2.75 1.13 6.02 -0.48 -4.80 117.38 113.98 1h7h n GLN 39 Ca -0.02 -0.18 -0.43 0.00 -0.01 0.00 0.00 57.00 56.36 1h7h n GLN 39 Cb 0.21 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.95 1h7h n GLN 39 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1h7h s VAL 40 N -2.16 4.65 0.51 5.09 1.01 -0.86 -4.96 120.40 123.68 1h7h s VAL 40 Ca 0.41 1.64 -0.21 0.00 0.00 0.00 0.00 61.98 63.82 1h7h s VAL 40 Cb 0.21 -4.30 -0.06 0.00 0.00 0.00 0.00 36.38 32.23 1h7h s VAL 40 CO 0.39 -0.32 1.17 0.00 0.00 0.00 0.00 175.10 176.35 1h7h s ALA 41 N 3.30 2.82 0.00 5.51 0.00 -1.26 -3.57 121.76 128.56 1h7h s ALA 41 Ca 0.41 0.93 0.00 0.00 0.00 0.00 0.00 51.96 53.30 1h7h s ALA 41 Cb -0.14 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.59 1h7h s ALA 41 CO 0.12 -0.80 0.00 0.41 0.00 0.00 0.00 175.76 175.49 1h7h n GLY 42 N 0.37 0.81 3.69 0.00 0.00 -1.26 -4.93 105.19 103.88 1h7h n GLY 42 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 1h7h n GLY 42 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h7h s VAL 43 N -3.16 5.02 -0.11 1.61 1.01 -1.23 -4.42 120.40 119.12 1h7h s VAL 43 Ca 0.00 0.05 -0.27 0.00 0.00 0.00 0.00 61.98 61.75 1h7h s VAL 43 Cb 0.00 -3.26 -0.27 0.00 0.00 0.00 0.00 36.38 32.85 1h7h s VAL 43 CO 0.00 0.48 0.83 0.00 0.00 0.00 0.00 175.10 176.40 1h7h h ALA 44 N 6.46 -0.02 -2.60 5.51 0.00 -1.44 -3.48 119.26 123.69 1h7h h ALA 44 Ca -0.40 -0.53 -0.14 0.00 0.00 0.00 0.00 54.91 53.83 1h7h h ALA 44 Cb 1.17 0.02 -0.18 0.00 0.00 0.00 0.00 17.79 18.80 1h7h h ALA 44 CO 0.70 0.08 -0.67 -1.21 0.00 0.00 0.00 179.25 178.15 1h7h s GLU 45 N -2.39 0.48 -0.10 0.00 2.02 -1.26 -5.07 118.70 112.38 1h7h s GLU 45 Ca -0.18 -0.91 0.02 0.00 0.02 0.00 0.00 54.97 53.92 1h7h s GLU 45 Cb -0.02 0.17 0.01 0.00 0.10 0.00 0.00 34.13 34.40 1h7h s GLU 45 CO 0.72 -0.09 -0.14 0.08 0.02 0.00 0.00 175.26 175.85 1h7h s VAL 46 N -2.72 1.42 0.18 2.63 1.01 -1.26 -1.18 120.40 120.48 1h7h s VAL 46 Ca -0.04 -0.60 0.09 0.00 0.00 0.00 0.00 61.98 61.42 1h7h s VAL 46 Cb -0.01 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 1h7h s VAL 46 CO -0.06 0.42 -0.17 0.26 0.00 0.00 0.00 175.10 175.55 1h7h s TRP 47 N 0.96 1.82 -0.19 5.22 0.52 0.56 -4.36 118.94 123.48 1h7h s TRP 47 Ca -0.07 -0.48 0.01 0.00 0.02 0.00 0.00 56.10 55.57 1h7h s TRP 47 Cb -0.15 -0.89 0.02 0.00 -1.15 0.00 0.00 33.47 31.30 1h7h s TRP 47 CO -0.01 0.36 -0.19 0.08 0.02 0.00 0.00 176.95 177.22 1h7h s VAL 48 N -2.29 2.15 -0.24 4.03 1.01 -0.36 -0.33 120.40 124.36 1h7h s VAL 48 Ca 0.18 -0.95 -0.13 0.00 0.00 0.00 0.00 61.98 61.08 1h7h s VAL 48 Cb -0.04 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 1h7h s VAL 48 CO 0.07 0.50 0.27 0.00 0.00 0.00 0.00 175.10 175.94 1h7h s ALA 49 N 1.29 3.58 0.11 5.51 0.00 -0.53 -0.98 121.76 130.75 1h7h s ALA 49 Ca 0.04 -0.80 -0.03 0.00 0.00 0.00 0.00 51.96 51.18 1h7h s ALA 49 Cb -0.13 -2.49 -0.03 0.00 0.00 0.00 0.00 23.12 20.46 1h7h s ALA 49 CO -0.12 -0.34 0.08 -0.08 0.00 0.00 0.00 175.76 175.30 1h7h s THR 50 N 1.38 0.13 -0.39 0.00 -1.32 -0.81 -0.17 115.64 114.46 1h7h s THR 50 Ca 0.12 -1.75 0.04 0.00 -1.21 0.00 0.00 61.69 58.89 1h7h s THR 50 Cb -0.15 -1.84 0.01 0.00 -1.51 0.00 0.00 72.50 69.02 1h7h s THR 50 CO 0.07 -0.57 0.47 -0.90 -2.21 0.00 0.00 174.62 171.48 1h7h n ASP 51 N -0.06 0.95 -4.21 8.08 5.75 -1.26 -0.03 116.55 125.76 1h7h n ASP 51 Ca -0.08 -0.97 -0.32 0.00 -0.01 0.00 0.00 54.79 53.40 1h7h n ASP 51 Cb 0.63 0.33 -0.17 0.00 -1.03 0.00 0.00 41.12 40.88 1h7h n ASP 51 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1h7h s ASP 52 N -0.66 3.17 0.57 -1.12 -1.08 -1.26 -4.83 116.67 111.46 1h7h s ASP 52 Ca 0.04 -0.56 0.29 0.00 -0.52 0.00 0.00 52.55 51.79 1h7h s ASP 52 Cb 0.03 -1.44 1.73 0.00 -1.46 0.00 0.00 42.92 41.78 1h7h s ASP 52 CO 0.08 0.13 2.22 1.55 0.52 0.00 0.00 175.17 179.67 1h7h h PRO 53 N 6.97 0.00 -0.06 4.34 0.13 -1.98 -1.87 132.00 139.52 1h7h h PRO 53 Ca -0.25 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.77 1h7h h PRO 53 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1h7h h PRO 53 CO 0.51 0.03 -0.47 0.00 -0.23 0.00 0.00 178.00 177.84 1h7h h ARG 54 N 0.00 0.16 0.15 0.86 3.08 -1.99 0.55 114.38 117.19 1h7h h ARG 54 Ca -0.00 -0.08 -0.30 0.00 0.07 0.00 0.00 59.98 59.66 1h7h h ARG 54 Cb 0.07 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.15 1h7h h ARG 54 CO 0.00 0.60 -1.30 0.28 -1.07 0.00 0.00 179.97 178.48 1h7h h VAL 55 N 0.13 1.31 -0.68 2.04 2.07 -1.74 -2.37 116.25 117.01 1h7h h VAL 55 Ca 0.01 -2.59 -0.04 0.00 0.82 0.00 0.00 66.70 64.89 1h7h h VAL 55 Cb 0.88 2.80 -0.03 0.00 -1.52 0.00 0.00 31.29 33.42 1h7h h VAL 55 CO 0.07 0.78 0.25 -0.08 0.02 0.00 0.00 177.57 178.61 1h7h h GLU 56 N 0.22 1.01 -0.32 1.57 4.81 -1.25 -0.96 114.58 119.66 1h7h h GLU 56 Ca -0.20 -0.18 -0.15 0.00 -0.13 0.00 0.00 59.36 58.71 1h7h h GLU 56 Cb 1.98 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 31.19 1h7h h GLU 56 CO 0.24 0.84 -0.37 1.96 -0.73 0.00 0.00 179.01 180.95 1h7h h GLN 57 N 0.98 0.82 -0.57 1.92 1.08 -0.92 -2.04 115.11 116.38 1h7h h GLN 57 Ca 0.23 -0.45 -0.05 0.00 -1.45 0.00 0.00 58.65 56.92 1h7h h GLN 57 Cb 0.22 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.65 1h7h h GLN 57 CO -0.02 1.08 0.14 0.00 -0.95 0.00 0.00 178.83 179.09 1h7h h ALA 58 N 0.72 1.16 -0.15 3.87 0.00 -1.14 -0.42 119.26 123.30 1h7h h ALA 58 Ca 0.05 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1h7h h ALA 58 Cb 0.96 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1h7h h ALA 58 CO 0.09 0.57 -0.12 0.28 0.00 0.00 0.00 179.25 180.07 1h7h h VAL 59 N 0.85 1.33 -0.30 0.00 2.07 -1.13 -3.11 116.25 115.96 1h7h h VAL 59 Ca 0.19 -1.25 -0.06 0.00 0.82 0.00 0.00 66.70 66.40 1h7h h VAL 59 Cb 0.31 1.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1h7h h VAL 59 CO -0.00 0.37 -0.09 1.56 0.02 0.00 0.00 177.57 179.42 1h7h h GLN 60 N 0.00 0.50 -0.50 1.57 4.20 -1.24 -0.24 115.11 119.40 1h7h h GLN 60 Ca 0.03 -0.13 0.10 0.00 0.06 0.00 0.00 58.65 58.71 1h7h h GLN 60 Cb 0.64 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 1h7h h GLN 60 CO 0.03 0.59 0.34 0.00 -0.67 0.00 0.00 178.83 179.13 1h7h h ALA 61 N 1.44 2.13 -0.67 3.87 0.00 -1.00 0.38 119.26 125.41 1h7h h ALA 61 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1h7h h ALA 61 Cb 0.45 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1h7h h ALA 61 CO 0.02 -0.25 0.00 1.97 0.00 0.00 0.00 179.25 180.99 1h7h n PHE 62 N -4.46 0.89 -0.81 0.00 1.16 -1.04 -4.95 117.46 108.25 1h7h n PHE 62 Ca 0.08 -0.44 0.00 0.00 -1.87 0.00 0.00 57.45 55.22 1h7h n PHE 62 Cb 0.39 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.26 1h7h n PHE 62 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1h7h n GLY 63 N 1.65 0.54 3.90 4.97 0.00 0.13 -5.07 105.19 111.31 1h7h n GLY 63 Ca 0.24 -0.54 -0.28 0.00 0.00 0.00 0.00 46.02 45.44 1h7h n GLY 63 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h7h s GLY 64 N -2.49 1.55 -0.16 -0.02 0.00 -0.13 -4.96 107.32 101.12 1h7h s GLY 64 Ca 0.00 -0.47 -0.23 0.00 0.00 0.00 0.00 44.72 44.02 1h7h s GLY 64 CO 0.00 -0.26 0.72 0.54 0.00 0.00 0.00 173.10 174.10 1h7h s LYS 65 N -4.90 4.29 0.06 2.90 1.02 -1.26 -4.06 119.74 117.80 1h7h s LYS 65 Ca 0.51 0.82 0.08 0.00 0.02 0.00 0.00 55.97 57.40 1h7h s LYS 65 Cb -0.10 -3.55 -0.03 0.00 -0.52 0.00 0.00 37.83 33.63 1h7h s LYS 65 CO 0.47 -0.20 -0.21 0.00 -0.92 0.00 0.00 175.35 174.48 1h7h s ALA 66 N 1.75 1.83 -0.06 5.17 0.00 -1.26 -1.22 121.76 127.97 1h7h s ALA 66 Ca 0.34 -1.14 -0.01 0.00 0.00 0.00 0.00 51.96 51.16 1h7h s ALA 66 Cb -0.16 -0.33 0.03 0.00 0.00 0.00 0.00 23.12 22.65 1h7h s ALA 66 CO 0.13 0.40 -0.00 -1.50 0.00 0.00 0.00 175.76 174.79 1h7h s ILE 67 N -0.90 0.35 0.17 0.00 2.07 -0.15 -4.92 121.20 117.82 1h7h s ILE 67 Ca 0.08 0.10 -0.30 0.00 -1.41 0.00 0.00 60.65 59.11 1h7h s ILE 67 Cb -0.09 -0.49 -0.08 0.00 0.13 0.00 0.00 42.46 41.93 1h7h s ILE 67 CO 0.03 0.24 1.15 -0.04 -1.91 0.00 0.00 174.94 174.40 1h7h s MET 68 N 1.71 4.53 0.36 3.50 -1.94 -1.26 -1.92 119.30 124.28 1h7h s MET 68 Ca 0.01 1.79 0.04 0.00 -1.71 0.00 0.00 55.69 55.82 1h7h s MET 68 Cb -0.13 -3.27 -0.06 0.00 2.01 0.00 0.00 34.83 33.38 1h7h s MET 68 CO -0.04 -0.03 0.05 0.95 -0.01 0.00 0.00 175.02 175.94 1h7h s THR 69 N -0.03 1.33 0.48 2.05 -4.23 0.95 -4.90 115.64 111.29 1h7h s THR 69 Ca 0.52 -2.00 -0.22 0.00 -1.18 0.00 0.00 61.69 58.80 1h7h s THR 69 Cb -0.31 -2.79 -0.07 0.00 1.34 0.00 0.00 72.50 70.68 1h7h s THR 69 CO 0.35 0.00 1.19 -0.13 -0.54 0.00 0.00 174.62 175.49 1h7h s ARG 70 N -3.84 3.62 0.11 3.99 0.52 -1.26 -4.42 118.95 117.67 1h7h s ARG 70 Ca 0.34 1.82 0.25 0.00 -0.52 0.00 0.00 55.73 57.62 1h7h s ARG 70 Cb 0.08 -2.33 0.58 0.00 0.52 0.00 0.00 34.95 33.80 1h7h s ARG 70 CO 0.16 -0.68 1.51 0.27 0.02 0.00 0.00 175.30 176.57 1h7h n ASN 71 N -0.67 0.63 0.00 0.23 6.94 -1.26 -3.76 115.26 117.37 1h7h n ASN 71 Ca 0.08 0.23 0.05 0.00 -0.02 0.00 0.00 54.58 54.92 1h7h n ASN 71 Cb 0.48 -0.14 0.32 0.00 -2.36 0.00 0.00 39.78 38.08 1h7h n ASN 71 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1h7h n ASP 72 N -2.01 0.00 -4.71 0.53 5.68 -1.26 -4.84 116.55 109.95 1h7h n ASP 72 Ca 0.05 -1.51 -0.42 0.00 -0.50 0.00 0.00 54.79 52.41 1h7h n ASP 72 Cb 0.41 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.36 1h7h n ASP 72 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 1h7h s HIS 73 N -2.00 3.20 -0.55 2.11 3.76 -1.25 -4.93 115.29 115.63 1h7h s HIS 73 Ca 0.16 1.03 0.24 0.00 -0.15 0.00 0.00 55.06 56.34 1h7h s HIS 73 Cb 0.07 -3.59 0.47 0.00 1.11 0.00 0.00 32.58 30.64 1h7h s HIS 73 CO 0.12 -2.05 1.57 1.05 -0.85 0.00 0.00 174.74 174.58 1h7h h GLU 74 N 7.07 0.00 -3.47 1.40 4.11 -1.95 -3.48 114.58 118.26 1h7h h GLU 74 Ca -0.41 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 58.97 1h7h h GLU 74 Cb 1.20 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.39 1h7h h GLU 74 CO 0.86 0.00 0.01 -1.54 0.07 0.00 0.00 179.01 178.41 1h7h s SER 75 N -5.26 0.01 0.44 3.06 1.04 -1.26 -5.04 113.70 106.70 1h7h s SER 75 Ca 0.07 -0.96 0.30 0.00 0.48 0.00 0.00 55.95 55.84 1h7h s SER 75 Cb 0.09 0.67 1.15 0.00 0.10 0.00 0.00 66.02 68.03 1h7h s SER 75 CO 0.66 -1.29 1.87 1.23 0.98 0.00 0.00 173.24 176.69 1h7h h GLY 76 N 2.14 0.00 1.41 7.32 0.00 -2.00 -2.86 103.07 109.09 1h7h h GLY 76 Ca -0.26 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.79 1h7h h GLY 76 CO 0.34 0.00 -1.40 -0.84 0.00 0.00 0.00 176.54 174.63 1h7h h THR 77 N 0.00 1.29 -0.42 4.70 2.02 -1.99 -2.92 112.91 115.60 1h7h h THR 77 Ca 0.00 -2.93 -0.11 0.00 0.77 0.00 0.00 66.41 64.14 1h7h h THR 77 Cb 0.52 2.80 -0.02 0.00 -1.74 0.00 0.00 68.15 69.72 1h7h h THR 77 CO 0.00 0.84 -0.19 0.44 0.37 0.00 0.00 175.52 176.98 1h7h h ASP 78 N 0.06 0.81 -0.28 4.18 3.32 -1.94 -2.33 116.42 120.24 1h7h h ASP 78 Ca -0.19 -0.28 -0.06 0.00 0.02 0.00 0.00 57.03 56.52 1h7h h ASP 78 Cb 1.98 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 41.29 1h7h h ASP 78 CO 0.17 0.99 -0.01 -0.09 -1.72 0.00 0.00 179.24 178.58 1h7h h ARG 79 N 0.71 0.62 -0.19 3.56 2.43 -1.58 -2.56 114.38 117.36 1h7h h ARG 79 Ca 0.10 -0.15 -0.13 0.00 -0.81 0.00 0.00 59.98 58.99 1h7h h ARG 79 Cb 0.70 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.16 1h7h h ARG 79 CO 0.05 0.65 -0.44 1.25 -1.51 0.00 0.00 179.97 179.97 1h7h h LEU 80 N 0.59 0.50 -1.03 3.80 5.85 -1.27 -2.82 115.31 120.92 1h7h h LEU 80 Ca 0.12 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.58 1h7h h LEU 80 Cb 0.39 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1h7h h LEU 80 CO 0.01 0.88 0.35 0.58 -0.34 0.00 0.00 178.44 179.92 1h7h h VAL 81 N 0.38 1.23 -0.41 1.05 2.07 -1.01 -0.45 116.25 119.10 1h7h h VAL 81 Ca 0.03 -0.65 -0.14 0.00 0.82 0.00 0.00 66.70 66.76 1h7h h VAL 81 Cb 0.93 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1h7h h VAL 81 CO 0.08 0.27 -0.30 -0.08 0.02 0.00 0.00 177.57 177.57 1h7h h GLU 82 N 1.03 0.90 -0.35 1.57 4.81 -1.39 -2.93 114.58 118.23 1h7h h GLU 82 Ca 0.25 -0.42 -0.10 0.00 -0.13 0.00 0.00 59.36 58.96 1h7h h GLU 82 Cb 0.10 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1h7h h GLU 82 CO -0.03 1.08 -0.19 0.28 -0.73 0.00 0.00 179.01 179.41 1h7h h VAL 83 N 0.76 1.26 -0.82 0.32 2.07 -1.22 -3.10 116.25 115.53 1h7h h VAL 83 Ca 0.08 -1.24 0.11 0.00 0.82 0.00 0.00 66.70 66.48 1h7h h VAL 83 Cb 0.87 1.20 -0.06 0.00 -1.52 0.00 0.00 31.29 31.78 1h7h h VAL 83 CO 0.08 0.41 0.53 -0.03 0.02 0.00 0.00 177.57 178.58 1h7h h MET 84 N 0.59 0.68 -0.20 1.57 1.85 -0.90 0.26 114.93 118.78 1h7h h MET 84 Ca 0.09 -0.04 -0.11 0.00 -0.61 0.00 0.00 59.70 59.03 1h7h h MET 84 Cb 0.65 -0.15 -0.01 0.00 0.43 0.00 0.00 31.60 32.51 1h7h h MET 84 CO 0.05 0.45 -0.34 0.45 -0.40 0.00 0.00 176.91 177.12 1h7h h HIS 85 N 0.70 0.48 0.11 1.39 -0.00 -1.51 -3.31 115.15 113.01 1h7h h HIS 85 Ca 0.39 -0.12 -0.34 0.00 -0.00 0.00 0.00 60.37 60.30 1h7h h HIS 85 Cb 0.54 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 27.82 1h7h h HIS 85 CO -0.00 0.71 -1.82 0.87 -0.00 0.00 0.00 177.93 177.69 1h7h h LYS 86 N 0.36 0.23 -4.72 2.45 1.57 -1.48 -3.45 116.57 111.53 1h7h h LYS 86 Ca 0.04 -0.40 -0.68 0.00 -1.87 0.00 0.00 60.65 57.75 1h7h h LYS 86 Cb 0.77 0.15 -0.19 0.00 0.08 0.00 0.00 32.23 33.04 1h7h h LYS 86 CO 0.06 1.19 -0.48 0.08 -0.57 0.00 0.00 179.45 179.73 1h7h s VAL 87 N -2.52 5.24 0.06 0.50 1.01 0.84 -5.07 120.40 120.46 1h7h s VAL 87 Ca -0.23 -0.23 -0.26 0.00 0.00 0.00 0.00 61.98 61.26 1h7h s VAL 87 Cb 0.06 -3.69 -0.06 0.00 0.00 0.00 0.00 36.38 32.70 1h7h s VAL 87 CO 0.75 -0.01 0.81 -0.70 0.00 0.00 0.00 175.10 175.95 1h7h s GLU 88 N 1.71 4.54 0.05 2.72 2.12 -1.26 -4.49 118.70 124.09 1h7h s GLU 88 Ca 0.06 1.15 -0.28 0.00 0.36 0.00 0.00 54.97 56.26 1h7h s GLU 88 Cb -0.17 -3.36 0.09 0.00 0.26 0.00 0.00 34.13 30.94 1h7h s GLU 88 CO 0.10 0.28 0.93 0.00 -0.54 0.00 0.00 175.26 176.03 1h7h s ALA 89 N -0.08 -1.78 -0.13 6.30 0.00 -1.26 -4.96 121.76 119.85 1h7h s ALA 89 Ca 0.40 0.68 0.13 0.00 0.00 0.00 0.00 51.96 53.17 1h7h s ALA 89 Cb -0.21 0.49 -0.24 0.00 0.00 0.00 0.00 23.12 23.16 1h7h s ALA 89 CO 0.24 -0.83 0.31 -0.25 0.00 0.00 0.00 175.76 175.24 1h7h n ASP 90 N -0.33 0.67 -3.94 0.00 8.00 0.23 -4.69 116.55 116.49 1h7h n ASP 90 Ca -0.08 0.18 -0.26 0.00 0.71 0.00 0.00 54.79 55.34 1h7h n ASP 90 Cb 0.61 0.32 -0.17 0.00 -0.02 0.00 0.00 41.12 41.86 1h7h n ASP 90 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1h7h s ILE 91 N -2.54 1.02 -0.17 0.53 1.01 -0.77 -0.93 121.20 119.36 1h7h s ILE 91 Ca -0.11 -0.33 -0.04 0.00 0.00 0.00 0.00 60.65 60.18 1h7h s ILE 91 Cb 0.07 -1.01 -0.03 0.00 0.01 0.00 0.00 42.46 41.50 1h7h s ILE 91 CO 0.81 0.36 -0.03 -0.31 0.00 0.00 0.00 174.94 175.76 1h7h s TYR 92 N 1.39 3.03 -0.18 3.97 1.51 -0.08 -1.72 117.35 125.27 1h7h s TYR 92 Ca -0.01 -0.34 -0.05 0.00 -1.01 0.00 0.00 57.07 55.66 1h7h s TYR 92 Cb -0.13 -1.99 -0.03 0.00 -0.11 0.00 0.00 41.96 39.70 1h7h s TYR 92 CO -0.05 -0.09 -0.01 0.42 -1.11 0.00 0.00 175.55 174.72 1h7h s ILE 93 N 0.52 3.97 -0.37 2.71 1.01 -0.51 -0.24 121.20 128.29 1h7h s ILE 93 Ca -0.03 -0.32 -0.13 0.00 0.00 0.00 0.00 60.65 60.17 1h7h s ILE 93 Cb -0.14 -2.77 -0.00 0.00 0.01 0.00 0.00 42.46 39.56 1h7h s ILE 93 CO 0.03 0.46 0.26 0.21 0.00 0.00 0.00 174.94 175.89 1h7h s ASN 94 N 0.70 6.04 -0.03 3.58 2.47 0.99 -0.84 114.94 127.85 1h7h s ASN 94 Ca -0.01 -0.63 0.01 0.00 0.42 0.00 0.00 52.86 52.65 1h7h s ASN 94 Cb -0.14 -2.13 -0.03 0.00 -1.45 0.00 0.00 41.25 37.49 1h7h s ASN 94 CO 0.02 -0.32 -0.03 -0.76 -3.72 0.00 0.00 177.10 172.29 1h7h s LEU 95 N 1.69 3.38 0.12 3.21 1.43 -0.74 -2.73 118.68 125.05 1h7h s LEU 95 Ca 0.05 -0.02 -0.30 0.00 -1.03 0.00 0.00 54.13 52.84 1h7h s LEU 95 Cb -0.18 -1.87 -0.06 0.00 0.03 0.00 0.00 46.19 44.10 1h7h s LEU 95 CO 0.10 0.31 1.11 -1.10 0.23 0.00 0.00 176.35 177.00 1h7h s GLN 96 N -1.27 4.55 0.10 1.70 -1.52 -1.26 -3.62 119.66 118.34 1h7h s GLN 96 Ca 0.17 1.69 0.23 0.00 -1.95 0.00 0.00 55.36 55.49 1h7h s GLN 96 Cb -0.11 -3.32 0.91 0.00 -0.22 0.00 0.00 33.01 30.26 1h7h s GLN 96 CO 0.07 -0.02 1.71 0.41 -0.25 0.00 0.00 175.29 177.20 1h7h n GLY 97 N 2.47 -1.34 1.07 3.09 0.00 -1.21 -3.39 105.19 105.87 1h7h n GLY 97 Ca 0.05 -0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.12 1h7h n GLY 97 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1h7h n ASP 98 N -1.82 3.83 -3.87 1.61 5.68 -1.26 -4.48 116.55 116.23 1h7h n ASP 98 Ca 0.05 -2.36 -0.29 0.00 -0.50 0.00 0.00 54.79 51.69 1h7h n ASP 98 Cb 0.28 -0.43 -0.11 0.00 -1.14 0.00 0.00 41.12 39.72 1h7h n ASP 98 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1h7h n GLU 99 N 0.61 2.04 0.12 0.11 1.02 -1.22 -2.89 120.64 120.42 1h7h n GLU 99 Ca 0.19 -4.52 0.11 0.00 -0.02 0.00 0.00 57.16 52.92 1h7h n GLU 99 Cb 0.69 -2.30 0.47 0.00 -0.02 0.00 0.00 31.44 30.28 1h7h n GLU 99 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1h7h n PRO 100 N 1.85 0.15 -0.62 3.49 -0.04 -1.26 -3.07 135.00 135.50 1h7h n PRO 100 Ca 0.21 0.46 0.07 0.00 -0.04 0.00 0.00 63.50 64.20 1h7h n PRO 100 Cb 0.36 -1.83 0.33 0.00 -0.04 0.00 0.00 33.50 32.31 1h7h n PRO 100 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1h7h n MET 101 N -2.12 3.72 -1.72 0.54 2.81 -1.26 -4.65 117.12 114.44 1h7h n MET 101 Ca 0.01 -2.56 -0.42 0.00 -1.81 0.00 0.00 57.70 52.92 1h7h n MET 101 Cb 0.17 -1.94 -0.01 0.00 -0.71 0.00 0.00 33.22 30.73 1h7h n MET 101 CO 0.00 0.00 0.00 1.51 1.51 0.00 0.00 175.97 178.99 1h7h n ILE 102 N 0.82 1.75 -3.46 2.02 0.13 -1.17 -4.60 119.36 114.85 1h7h n ILE 102 Ca 0.23 -0.44 -0.39 0.00 -1.10 0.00 0.00 62.75 61.05 1h7h n ILE 102 Cb 0.89 -1.69 -0.10 0.00 -0.84 0.00 0.00 39.64 37.90 1h7h n ILE 102 CO 0.00 0.00 0.00 -0.13 2.80 0.00 0.00 176.55 179.22 1h7h s ARG 103 N -1.58 4.00 0.47 9.51 0.52 -1.26 -4.97 118.95 125.63 1h7h s ARG 103 Ca 0.58 -0.07 0.23 0.00 -0.52 0.00 0.00 55.73 55.94 1h7h s ARG 103 Cb -0.55 -3.65 1.25 0.00 0.52 0.00 0.00 34.95 32.51 1h7h s ARG 103 CO 0.59 -0.24 1.87 -1.35 0.02 0.00 0.00 175.30 176.19 1h7h h PRO 104 N 8.22 0.23 -0.50 3.54 0.11 -1.93 -0.68 132.00 140.99 1h7h h PRO 104 Ca -0.33 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.72 1h7h h PRO 104 Cb 1.17 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1h7h h PRO 104 CO 0.61 0.15 0.10 -0.09 -0.21 0.00 0.00 178.00 178.57 1h7h h ARG 105 N 0.24 0.76 -0.53 1.05 9.65 -1.93 -2.28 114.38 121.34 1h7h h ARG 105 Ca 0.45 -0.16 -0.08 0.00 -1.10 0.00 0.00 59.98 59.10 1h7h h ARG 105 Cb 1.39 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 29.83 1h7h h ARG 105 CO -0.12 0.70 0.00 -0.44 2.80 0.00 0.00 179.97 182.92 1h7h h ASP 106 N 0.73 0.86 0.01 -3.80 3.32 -1.54 -1.71 116.42 114.30 1h7h h ASP 106 Ca 0.16 -0.22 -0.11 0.00 0.02 0.00 0.00 57.03 56.88 1h7h h ASP 106 Cb 0.30 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1h7h h ASP 106 CO 0.00 0.92 -0.35 0.58 -1.72 0.00 0.00 179.24 178.68 1h7h h VAL 107 N 0.83 1.29 -0.28 -1.35 2.07 -1.46 -2.52 116.25 114.82 1h7h h VAL 107 Ca 0.16 -1.45 -0.09 0.00 0.82 0.00 0.00 66.70 66.14 1h7h h VAL 107 Cb 0.49 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 1h7h h VAL 107 CO 0.02 0.45 -0.20 -0.33 0.02 0.00 0.00 177.57 177.53 1h7h h GLU 108 N 0.40 0.52 -0.51 1.57 5.08 -0.93 -0.81 114.58 119.89 1h7h h GLU 108 Ca 0.04 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1h7h h GLU 108 Cb 0.80 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 1h7h h GLU 108 CO 0.06 0.70 0.24 1.15 -1.00 0.00 0.00 179.01 180.16 1h7h h THR 109 N 0.47 1.20 -0.40 1.13 2.02 -1.00 0.34 112.91 116.66 1h7h h THR 109 Ca 0.07 -0.57 -0.02 0.00 0.77 0.00 0.00 66.41 66.67 1h7h h THR 109 Cb 0.62 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 1h7h h THR 109 CO 0.04 0.22 0.19 0.25 0.37 0.00 0.00 175.52 176.59 1h7h h LEU 110 N 0.68 0.54 -0.59 2.58 5.85 -1.05 -1.67 115.31 121.65 1h7h h LEU 110 Ca 0.18 -0.14 -0.11 0.00 0.84 0.00 0.00 57.88 58.65 1h7h h LEU 110 Cb 0.13 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1h7h h LEU 110 CO -0.02 0.52 -0.09 0.25 -0.34 0.00 0.00 178.44 178.76 1h7h h LEU 111 N 0.51 1.03 -0.97 2.25 6.46 -0.89 -2.60 115.31 121.10 1h7h h LEU 111 Ca 0.14 -0.33 -0.08 0.00 -0.12 0.00 0.00 57.88 57.49 1h7h h LEU 111 Cb 0.14 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 39.77 1h7h h LEU 111 CO -0.02 1.12 -0.11 -0.61 -0.62 0.00 0.00 178.44 178.21 1h7h h GLN 112 N 0.92 0.62 -0.62 1.25 5.75 -0.80 -1.84 115.11 120.39 1h7h h GLN 112 Ca 0.15 -0.19 -0.03 0.00 -0.15 0.00 0.00 58.65 58.43 1h7h h GLN 112 Cb 0.65 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 29.11 1h7h h GLN 112 CO 0.05 0.72 0.26 0.78 -2.65 0.00 0.00 178.83 177.99 1h7h h GLY 113 N 0.96 0.99 1.00 2.39 0.00 -1.03 0.05 103.07 107.43 1h7h h GLY 113 Ca 0.10 -0.52 -0.06 0.00 0.00 0.00 0.00 47.33 46.85 1h7h h GLY 113 CO 0.03 0.49 0.08 -0.33 0.00 0.00 0.00 176.54 176.81 1h7h h MET 114 N 0.86 0.87 0.00 4.80 2.86 -1.19 -2.96 114.93 120.18 1h7h h MET 114 Ca 0.21 -0.24 -0.12 0.00 -2.06 0.00 0.00 59.70 57.49 1h7h h MET 114 Cb 0.18 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 1h7h h MET 114 CO -0.02 0.86 -0.57 0.00 1.06 0.00 0.00 176.91 178.23 1h7h h ARG 115 N 0.75 0.00 0.00 1.72 3.08 -1.12 -3.06 114.38 115.75 1h7h h ARG 115 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 1h7h h ARG 115 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1h7h h ARG 115 CO 0.01 0.57 0.00 -0.25 -1.07 0.00 0.00 179.97 179.23 1h7h n ASP 116 N -3.79 0.48 -3.45 7.04 8.00 -0.01 -4.40 116.55 120.42 1h7h n ASP 116 Ca -0.01 0.57 -0.24 0.00 0.71 0.00 0.00 54.79 55.82 1h7h n ASP 116 Cb 0.59 -0.69 -0.11 0.00 -0.02 0.00 0.00 41.12 40.89 1h7h n ASP 116 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1h7h s ASP 117 N -3.90 2.44 0.64 -2.24 2.15 -1.13 -5.01 116.67 109.62 1h7h s ASP 117 Ca 0.09 -1.49 0.40 0.00 0.43 0.00 0.00 52.55 51.99 1h7h s ASP 117 Cb 0.13 0.03 2.24 0.00 -0.30 0.00 0.00 42.92 45.02 1h7h s ASP 117 CO 0.49 -0.35 2.34 -0.65 -0.17 0.00 0.00 175.17 176.82 1h7h h PRO 118 N 7.69 0.00 0.00 4.34 0.11 -1.77 -2.17 132.00 140.20 1h7h h PRO 118 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1h7h h PRO 118 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1h7h h PRO 118 CO 0.31 0.00 -0.28 0.00 -0.21 0.00 0.00 178.00 177.82 1h7h n ALA 119 N -2.16 2.78 -2.32 -0.75 0.00 -1.26 -4.85 120.51 111.94 1h7h n ALA 119 Ca -0.03 -0.18 -0.43 0.00 0.00 0.00 0.00 53.44 52.80 1h7h n ALA 119 Cb 0.08 -1.31 -0.02 0.00 0.00 0.00 0.00 19.45 18.20 1h7h n ALA 119 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1h7h s LEU 120 N -3.63 4.06 -0.05 0.00 2.96 -0.82 -4.94 118.68 116.26 1h7h s LEU 120 Ca 0.11 1.60 -0.24 0.00 -0.22 0.00 0.00 54.13 55.37 1h7h s LEU 120 Cb 0.16 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 43.08 1h7h s LEU 120 CO 0.63 -0.95 1.04 -0.65 -1.32 0.00 0.00 176.35 175.10 1h7h h PRO 121 N 9.09 0.17 -4.13 0.98 0.11 -1.89 -3.44 132.00 132.88 1h7h h PRO 121 Ca -0.29 -0.17 -0.24 0.00 0.11 0.00 0.00 66.00 65.41 1h7h h PRO 121 Cb 1.12 0.05 -0.24 0.00 0.11 0.00 0.00 31.00 32.03 1h7h h PRO 121 CO 0.99 0.90 -0.72 0.08 -0.21 0.00 0.00 178.00 179.04 1h7h s VAL 122 N -3.17 0.25 0.02 3.15 1.01 -1.21 -1.47 120.40 118.98 1h7h s VAL 122 Ca -0.16 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.24 1h7h s VAL 122 Cb 0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 36.38 36.07 1h7h s VAL 122 CO 0.74 -0.23 -0.06 0.00 0.00 0.00 0.00 175.10 175.56 1h7h s ALA 123 N -0.82 0.42 0.32 5.51 0.00 -0.77 -1.61 121.76 124.83 1h7h s ALA 123 Ca -0.07 -0.48 0.02 0.00 0.00 0.00 0.00 51.96 51.43 1h7h s ALA 123 Cb -0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 1h7h s ALA 123 CO -0.00 0.01 0.38 -2.37 0.00 0.00 0.00 175.76 173.78 1h7h n THR 124 N 2.17 0.00 -4.44 0.00 5.66 0.06 -1.39 114.28 116.34 1h7h n THR 124 Ca -0.18 -1.91 -0.24 0.00 -3.05 0.00 0.00 64.05 58.66 1h7h n THR 124 Cb 0.56 1.07 -0.10 0.00 -1.55 0.00 0.00 70.33 70.32 1h7h n THR 124 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1h7h s LEU 125 N 0.00 2.66 0.14 1.09 1.43 -1.23 -1.01 118.68 121.75 1h7h s LEU 125 Ca 0.31 -0.95 -0.21 0.00 -1.03 0.00 0.00 54.13 52.26 1h7h s LEU 125 Cb 0.00 -1.20 0.06 0.00 0.03 0.00 0.00 46.19 45.07 1h7h s LEU 125 CO 0.22 0.05 0.53 0.00 0.23 0.00 0.00 176.35 177.38 1h7h s HIS 127 N -3.61 -0.03 0.31 0.00 -3.43 -0.43 -0.61 115.29 107.48 1h7h s HIS 127 Ca 0.01 -0.07 -0.29 0.00 -0.80 0.00 0.00 55.06 53.91 1h7h s HIS 127 Cb -0.00 0.01 -0.10 0.00 -1.43 0.00 0.00 32.58 31.06 1h7h s HIS 127 CO -0.11 -0.39 1.43 0.00 -2.00 0.00 0.00 174.74 173.67 1h7h s ALA 128 N -1.92 3.59 0.14 -1.38 0.00 -1.26 -0.27 121.76 120.66 1h7h s ALA 128 Ca -0.10 1.40 0.03 0.00 0.00 0.00 0.00 51.96 53.28 1h7h s ALA 128 Cb -0.04 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 19.48 1h7h s ALA 128 CO -0.00 -0.82 -0.05 0.96 0.00 0.00 0.00 175.76 175.85 1h7h s ILE 129 N -0.58 0.84 0.79 0.00 -4.36 -0.65 -4.83 121.20 112.41 1h7h s ILE 129 Ca 0.55 -1.99 -0.12 0.00 -0.26 0.00 0.00 60.65 58.83 1h7h s ILE 129 Cb -0.43 -1.91 0.07 0.00 1.25 0.00 0.00 42.46 41.43 1h7h s ILE 129 CO 0.51 -0.67 1.16 -0.94 0.24 0.00 0.00 174.94 175.24 1h7h s SER 130 N -3.14 4.68 0.29 4.36 1.04 -1.26 -4.03 113.70 115.64 1h7h s SER 130 Ca 0.18 0.84 0.01 0.00 0.48 0.00 0.00 55.95 57.46 1h7h s SER 130 Cb 0.05 -1.39 0.45 0.00 0.10 0.00 0.00 66.02 65.23 1h7h s SER 130 CO 0.00 -1.80 1.81 0.00 0.98 0.00 0.00 173.24 174.23 1h7h h ALA 131 N -0.98 1.22 -0.64 5.32 0.00 -1.97 -2.29 119.26 119.92 1h7h h ALA 131 Ca -0.46 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.18 1h7h h ALA 131 Cb 1.32 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1h7h h ALA 131 CO 0.66 0.52 0.26 0.00 0.00 0.00 0.00 179.25 180.69 1h7h h ALA 132 N 1.37 0.83 -0.32 0.00 0.00 -2.02 -2.71 119.26 116.41 1h7h h ALA 132 Ca 0.13 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 1h7h h ALA 132 Cb 0.39 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1h7h h ALA 132 CO 0.01 0.44 -0.34 0.93 0.00 0.00 0.00 179.25 180.29 1h7h h GLU 133 N 0.90 0.71 0.00 0.00 5.08 -1.89 -3.02 114.58 116.35 1h7h h GLU 133 Ca 0.21 -0.34 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1h7h h GLU 133 Cb 0.19 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 1h7h h GLU 133 CO -0.02 0.95 -0.02 0.00 -1.00 0.00 0.00 179.01 178.92 1h7h h ALA 134 N 1.02 1.09 0.00 3.43 0.00 -1.13 -2.60 119.26 121.07 1h7h h ALA 134 Ca 0.06 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1h7h h ALA 134 Cb 0.87 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1h7h h ALA 134 CO 0.08 0.02 -0.11 0.00 0.00 0.00 0.00 179.25 179.24 1h7h h ALA 135 N 1.98 1.07 -2.26 0.00 0.00 -1.35 -3.40 119.26 115.32 1h7h h ALA 135 Ca -0.00 -0.10 -0.56 0.00 0.00 0.00 0.00 54.91 54.26 1h7h h ALA 135 Cb 0.17 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1h7h h ALA 135 CO 0.00 0.13 0.80 -1.21 0.00 0.00 0.00 179.25 178.97 1h7h s GLU 136 N -3.83 4.30 0.60 0.00 0.41 -0.98 -4.89 118.70 114.30 1h7h s GLU 136 Ca -0.01 1.71 0.38 0.00 -0.41 0.00 0.00 54.97 56.65 1h7h s GLU 136 Cb 0.11 -3.65 1.88 0.00 -1.78 0.00 0.00 34.13 30.70 1h7h s GLU 136 CO 0.57 -0.57 2.18 -1.00 -0.49 0.00 0.00 175.26 175.96 1h7h h PRO 137 N 7.82 0.00 0.00 0.39 0.13 -1.85 -1.79 132.00 136.69 1h7h h PRO 137 Ca -0.32 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1h7h h PRO 137 Cb 1.14 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 1h7h h PRO 137 CO 0.92 0.01 -0.02 0.66 -0.23 0.00 0.00 178.00 179.34 1h7h h SER 138 N 0.00 0.00 -3.26 1.44 4.64 -1.91 -3.43 113.55 111.03 1h7h h SER 138 Ca -0.00 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.73 1h7h h SER 138 Cb 0.25 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.26 1h7h h SER 138 CO 0.00 0.02 -0.26 -0.89 -0.87 0.00 0.00 176.83 174.83 1h7h s THR 139 N -3.51 5.25 -0.22 2.95 2.01 -0.68 -5.07 115.64 116.37 1h7h s THR 139 Ca 0.03 0.70 -0.16 0.00 0.31 0.00 0.00 61.69 62.57 1h7h s THR 139 Cb 0.08 -3.69 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 1h7h s THR 139 CO 0.59 0.39 0.41 -0.69 -0.69 0.00 0.00 174.62 174.63 1h7h s VAL 140 N 0.35 5.17 0.24 3.82 1.01 -1.26 -4.61 120.40 125.12 1h7h s VAL 140 Ca 0.20 0.71 -0.00 0.00 0.00 0.00 0.00 61.98 62.89 1h7h s VAL 140 Cb -0.14 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 1h7h s VAL 140 CO 0.07 0.21 0.43 -0.54 0.00 0.00 0.00 175.10 175.26 1h7h s LYS 141 N 1.62 3.51 -0.03 2.72 3.01 0.65 -0.75 119.74 130.47 1h7h s LYS 141 Ca 0.19 -0.37 -0.05 0.00 -1.01 0.00 0.00 55.97 54.73 1h7h s LYS 141 Cb -0.15 -2.79 0.01 0.00 -1.01 0.00 0.00 37.83 33.88 1h7h s LYS 141 CO 0.09 0.34 0.11 0.54 0.51 0.00 0.00 175.35 176.93 1h7h s VAL 142 N -1.99 0.03 -0.06 3.17 0.11 -0.97 -0.83 120.40 119.86 1h7h s VAL 142 Ca 0.39 -0.29 0.05 0.00 -2.93 0.00 0.00 61.98 59.19 1h7h s VAL 142 Cb -0.10 -0.26 -0.00 0.00 -1.53 0.00 0.00 36.38 34.48 1h7h s VAL 142 CO 0.31 -0.16 -0.22 -0.69 -3.33 0.00 0.00 175.10 171.01 1h7h s VAL 143 N -0.50 1.83 0.31 2.04 1.01 -1.01 -4.26 120.40 119.82 1h7h s VAL 143 Ca -0.06 -0.92 0.10 0.00 0.00 0.00 0.00 61.98 61.10 1h7h s VAL 143 Cb -0.04 -1.57 -0.06 0.00 0.00 0.00 0.00 36.38 34.72 1h7h s VAL 143 CO 0.00 0.51 -0.13 0.68 0.00 0.00 0.00 175.10 176.17 1h7h s VAL 144 N 0.07 2.26 0.06 2.92 -7.23 -1.26 0.35 120.40 117.57 1h7h s VAL 144 Ca -0.08 -2.27 0.01 0.00 -1.81 0.00 0.00 61.98 57.82 1h7h s VAL 144 Cb -0.14 -2.49 0.01 0.00 0.56 0.00 0.00 36.38 34.31 1h7h s VAL 144 CO 0.05 -0.29 0.08 -0.46 -0.31 0.00 0.00 175.10 174.17 1h7h n ASN 145 N -0.70 0.17 0.14 4.85 0.23 -0.20 -4.86 115.26 114.89 1h7h n ASN 145 Ca -0.05 -1.13 0.06 0.00 -0.53 0.00 0.00 54.58 52.93 1h7h n ASN 145 Cb 0.62 -0.05 0.53 0.00 -2.08 0.00 0.00 39.78 38.80 1h7h n ASN 145 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 1h7h h THR 146 N -0.14 1.06 -0.06 5.53 1.35 -2.02 -1.11 112.91 117.52 1h7h h THR 146 Ca -0.03 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 1h7h h THR 146 Cb 0.12 0.82 0.00 0.00 -1.73 0.00 0.00 68.15 67.35 1h7h h THR 146 CO 0.04 0.07 0.00 0.54 -0.25 0.00 0.00 175.52 175.91 1h7h n ARG 147 N -4.48 1.28 -1.22 4.72 1.74 -1.26 -4.88 116.66 112.55 1h7h n ARG 147 Ca -0.00 -0.42 -0.08 0.00 -0.77 0.00 0.00 57.85 56.58 1h7h n ARG 147 Cb 0.10 -1.33 -0.03 0.00 -1.02 0.00 0.00 32.46 30.18 1h7h n ARG 147 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1h7h n GLN 148 N -0.36 -0.59 -2.84 5.56 6.02 -0.42 -4.90 117.38 119.85 1h7h n GLN 148 Ca 0.15 0.74 -0.40 0.00 -0.01 0.00 0.00 57.00 57.48 1h7h n GLN 148 Cb 0.17 -4.58 -0.06 0.00 1.02 0.00 0.00 30.24 26.79 1h7h n GLN 148 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1h7h s ASP 149 N -2.84 7.54 0.21 1.08 1.01 -1.26 -0.92 116.67 121.49 1h7h s ASP 149 Ca 0.00 1.83 -0.30 0.00 0.71 0.00 0.00 52.55 54.80 1h7h s ASP 149 Cb 0.00 -2.57 -0.09 0.00 1.01 0.00 0.00 42.92 41.28 1h7h s ASP 149 CO 0.00 0.17 1.23 0.00 0.21 0.00 0.00 175.17 176.78 1h7h s ALA 150 N -1.19 3.47 -0.16 5.23 0.00 -0.43 -1.03 121.76 127.66 1h7h s ALA 150 Ca 0.39 1.02 -0.07 0.00 0.00 0.00 0.00 51.96 53.30 1h7h s ALA 150 Cb -0.25 -3.43 -0.24 0.00 0.00 0.00 0.00 23.12 19.20 1h7h s ALA 150 CO 0.30 -0.43 0.24 1.28 0.00 0.00 0.00 175.76 177.15 1h7h n LEU 151 N 2.33 2.59 -3.55 0.00 4.77 0.16 -4.81 117.00 118.48 1h7h n LEU 151 Ca 0.04 0.18 -0.10 0.00 -0.03 0.00 0.00 56.01 56.11 1h7h n LEU 151 Cb 0.44 -1.06 -0.04 0.00 -2.33 0.00 0.00 43.42 40.43 1h7h n LEU 151 CO 0.56 0.80 0.74 -0.47 -1.33 0.00 0.00 177.39 177.69 1h7h s TYR 152 N -2.53 -0.37 -0.04 -1.77 5.04 -1.21 -5.02 117.35 111.45 1h7h s TYR 152 Ca -0.26 0.48 0.06 0.00 -2.44 0.00 0.00 57.07 54.92 1h7h s TYR 152 Cb 0.07 0.48 -0.02 0.00 0.35 0.00 0.00 41.96 42.84 1h7h s TYR 152 CO 0.72 -0.42 -0.22 -0.06 -1.34 0.00 0.00 175.55 174.22 1h7h s PHE 153 N -1.89 2.48 0.08 4.97 0.40 -1.26 -2.40 117.98 120.36 1h7h s PHE 153 Ca 0.01 -0.43 -0.24 0.00 -0.60 0.00 0.00 56.93 55.67 1h7h s PHE 153 Cb -0.01 -1.57 0.06 0.00 0.51 0.00 0.00 43.02 42.01 1h7h s PHE 153 CO -0.02 -0.02 0.57 0.45 0.70 0.00 0.00 175.22 176.90 1h7h s SER 154 N -0.51 -0.52 0.21 1.36 0.15 -0.01 -4.97 113.70 109.42 1h7h s SER 154 Ca 0.07 0.16 0.24 0.00 0.70 0.00 0.00 55.95 57.11 1h7h s SER 154 Cb -0.11 0.55 0.29 0.00 -1.71 0.00 0.00 66.02 65.03 1h7h s SER 154 CO 0.01 -0.82 1.34 0.03 1.20 0.00 0.00 173.24 175.00 1h7h h ARG 155 N 2.45 0.00 -7.01 5.44 3.08 -1.85 0.19 114.38 116.68 1h7h h ARG 155 Ca -0.32 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.27 1h7h h ARG 155 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 1h7h h ARG 155 CO 0.40 0.00 0.37 -1.12 -1.07 0.00 0.00 179.97 178.55 1h7h s SER 156 N -4.97 6.80 -0.27 7.04 0.01 -1.26 -4.29 113.70 116.76 1h7h s SER 156 Ca 0.05 1.87 -0.29 0.00 1.31 0.00 0.00 55.95 58.89 1h7h s SER 156 Cb 0.11 -2.56 -0.02 0.00 0.21 0.00 0.00 66.02 63.75 1h7h s SER 156 CO 0.72 -0.46 1.71 -2.84 0.41 0.00 0.00 173.24 172.78 1h7h s PRO 157 N -2.82 3.58 -0.03 12.44 0.02 -1.26 -4.75 135.00 142.18 1h7h s PRO 157 Ca 0.60 1.57 0.04 0.00 0.02 0.00 0.00 61.00 63.23 1h7h s PRO 157 Cb -0.16 -4.12 -0.00 0.00 0.02 0.00 0.00 34.50 30.24 1h7h s PRO 157 CO 0.21 -1.56 -0.14 0.96 -0.33 0.00 0.00 177.00 176.13 1h7h s ILE 158 N 6.00 1.17 0.66 2.83 -4.36 -1.26 -3.79 121.20 122.45 1h7h s ILE 158 Ca 0.76 -0.59 -0.14 0.00 -0.26 0.00 0.00 60.65 60.41 1h7h s ILE 158 Cb -0.24 -1.00 -0.00 0.00 1.25 0.00 0.00 42.46 42.47 1h7h s ILE 158 CO 0.32 0.34 1.09 -2.16 0.24 0.00 0.00 174.94 174.77 1h7h s PRO 159 N -0.05 2.90 0.26 0.37 0.04 -1.26 -4.69 135.00 132.57 1h7h s PRO 159 Ca -0.00 1.27 -0.30 0.00 0.04 0.00 0.00 61.00 62.01 1h7h s PRO 159 Cb -0.09 -1.97 -0.10 0.00 0.04 0.00 0.00 34.50 32.38 1h7h s PRO 159 CO 0.01 -1.16 1.42 -0.47 0.04 0.00 0.00 177.00 176.84 1h7h s TYR 160 N -2.51 3.01 -1.51 0.56 5.04 -1.25 -4.91 117.35 115.78 1h7h s TYR 160 Ca 0.64 1.08 -0.11 0.00 -2.44 0.00 0.00 57.07 56.25 1h7h s TYR 160 Cb -0.18 -3.81 -0.00 0.00 0.35 0.00 0.00 41.96 38.32 1h7h s TYR 160 CO 0.43 -2.56 2.55 -0.35 -1.34 0.00 0.00 175.55 174.28 1h7h n PRO 161 N 2.07 3.42 0.03 4.97 -0.04 -1.26 -4.62 135.00 139.57 1h7h n PRO 161 Ca 0.06 -2.55 -0.13 0.00 -0.04 0.00 0.00 63.50 60.84 1h7h n PRO 161 Cb 0.40 -2.99 -0.09 0.00 -0.04 0.00 0.00 33.50 30.78 1h7h n PRO 161 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1h7h h ARG 162 N 5.43 -0.10 -3.21 0.54 9.65 -2.02 -3.26 114.38 121.41 1h7h h ARG 162 Ca 0.71 0.01 -0.71 0.00 -1.10 0.00 0.00 59.98 58.88 1h7h h ARG 162 Cb 0.45 0.02 -0.35 0.00 -1.39 0.00 0.00 29.97 28.71 1h7h h ARG 162 CO 1.80 0.31 -0.00 0.09 2.80 0.00 0.00 179.97 184.96 1h7h n ASN 163 N -4.94 4.49 -0.33 -3.80 3.02 -1.26 -4.96 115.26 107.47 1h7h n ASN 163 Ca -0.08 -3.18 0.21 0.00 -0.03 0.00 0.00 54.58 51.50 1h7h n ASN 163 Cb 0.23 -1.07 0.40 0.00 -0.61 0.00 0.00 39.78 38.73 1h7h n ASN 163 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1h7h h ALA 164 N 5.84 1.54 0.00 5.41 0.00 -1.91 -0.88 119.26 129.25 1h7h h ALA 164 Ca 0.17 0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.39 1h7h h ALA 164 Cb 0.78 0.48 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1h7h h ALA 164 CO 0.91 -0.70 0.00 0.93 0.00 0.00 0.00 179.25 180.40 1h7h h GLU 165 N 0.03 0.00 0.00 0.00 3.07 -1.93 -2.61 114.58 113.14 1h7h h GLU 165 Ca 0.69 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.55 1h7h h GLU 165 Cb 1.58 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.49 1h7h h GLU 165 CO -0.85 0.00 -0.85 1.63 -1.40 0.00 0.00 179.01 177.54 1h7h n LYS 166 N -2.77 0.23 -2.46 2.33 4.76 -0.34 -4.94 118.16 114.96 1h7h n LYS 166 Ca -0.00 0.02 -0.41 0.00 -2.87 0.00 0.00 58.31 55.05 1h7h n LYS 166 Cb 0.18 -1.60 -0.04 0.00 -1.84 0.00 0.00 35.03 31.74 1h7h n LYS 166 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1h7h s ALA 167 N -3.15 3.40 -0.07 7.82 0.00 -0.99 -5.05 121.76 123.72 1h7h s ALA 167 Ca 0.06 0.88 0.00 0.00 0.00 0.00 0.00 51.96 52.89 1h7h s ALA 167 Cb 0.15 -3.36 0.02 0.00 0.00 0.00 0.00 23.12 19.93 1h7h s ALA 167 CO 0.77 -0.24 -0.05 0.50 0.00 0.00 0.00 175.76 176.74 1h7h s ARG 168 N -0.64 1.09 -0.06 0.00 3.52 -1.26 -5.01 118.95 116.58 1h7h s ARG 168 Ca 0.49 -0.13 -0.04 0.00 -0.13 0.00 0.00 55.73 55.92 1h7h s ARG 168 Cb -0.31 -1.16 -0.04 0.00 -1.56 0.00 0.00 34.95 31.88 1h7h s ARG 168 CO 0.37 -0.18 0.12 0.71 -0.81 0.00 0.00 175.30 175.52 1h7h s TYR 169 N 1.38 3.46 -0.09 5.12 2.02 -1.26 -4.70 117.35 123.28 1h7h s TYR 169 Ca -0.03 0.37 0.03 0.00 -0.37 0.00 0.00 57.07 57.08 1h7h s TYR 169 Cb -0.13 -1.85 0.01 0.00 -0.40 0.00 0.00 41.96 39.58 1h7h s TYR 169 CO -0.03 0.64 -0.19 -0.51 -1.57 0.00 0.00 175.55 173.89 1h7h s LEU 170 N -1.40 1.92 -0.13 -1.29 1.43 -1.26 -1.63 118.68 116.32 1h7h s LEU 170 Ca 0.20 -0.47 -0.11 0.00 -1.03 0.00 0.00 54.13 52.72 1h7h s LEU 170 Cb -0.12 -1.21 -0.05 0.00 0.03 0.00 0.00 46.19 44.85 1h7h s LEU 170 CO 0.10 0.10 0.22 -0.75 0.23 0.00 0.00 176.35 176.25 1h7h s LYS 171 N 0.55 3.88 -0.06 1.70 2.20 0.63 -2.30 119.74 126.34 1h7h s LYS 171 Ca -0.15 -0.00 -0.30 0.00 -0.36 0.00 0.00 55.97 55.16 1h7h s LYS 171 Cb -0.17 -3.30 -0.02 0.00 -1.51 0.00 0.00 37.83 32.83 1h7h s LYS 171 CO 0.05 0.53 1.01 -1.58 -0.36 0.00 0.00 175.35 175.00 1h7h s HIS 172 N -0.36 3.55 -0.37 4.03 5.65 0.07 -1.32 115.29 126.54 1h7h s HIS 172 Ca 0.15 1.61 -0.13 0.00 0.25 0.00 0.00 55.06 56.95 1h7h s HIS 172 Cb -0.13 -3.18 0.01 0.00 -1.18 0.00 0.00 32.58 28.10 1h7h s HIS 172 CO 0.04 -0.21 0.24 0.08 -0.65 0.00 0.00 174.74 174.24 1h7h s VAL 173 N 1.64 4.98 0.00 0.89 1.01 0.12 -4.76 120.40 124.28 1h7h s VAL 173 Ca 0.50 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.92 1h7h s VAL 173 Cb -0.20 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1h7h s VAL 173 CO 0.22 -0.15 0.15 0.61 0.00 0.00 0.00 175.10 175.93 1h7h n GLY 174 N 5.08 0.60 3.40 4.51 0.00 -1.26 -3.51 105.19 114.00 1h7h n GLY 174 Ca -0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 1h7h n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h7h s ILE 175 N 2.11 3.21 0.13 -0.61 1.01 -1.26 -4.66 121.20 121.12 1h7h s ILE 175 Ca 0.00 -0.61 0.07 0.00 0.00 0.00 0.00 60.65 60.11 1h7h s ILE 175 Cb 0.00 -2.35 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 1h7h s ILE 175 CO 0.00 0.52 -0.17 -0.31 0.00 0.00 0.00 174.94 174.98 1h7h s TYR 176 N 0.30 1.61 -0.12 3.97 1.51 -1.10 -3.55 117.35 119.96 1h7h s TYR 176 Ca -0.09 -0.49 0.00 0.00 -1.01 0.00 0.00 57.07 55.49 1h7h s TYR 176 Cb -0.15 -0.84 0.02 0.00 -0.11 0.00 0.00 41.96 40.88 1h7h s TYR 176 CO 0.05 0.21 -0.11 0.00 -1.11 0.00 0.00 175.55 174.59 1h7h s ALA 177 N -1.81 1.56 -0.04 3.71 0.00 -0.48 -0.01 121.76 124.69 1h7h s ALA 177 Ca 0.09 -0.69 0.06 0.00 0.00 0.00 0.00 51.96 51.43 1h7h s ALA 177 Cb -0.07 -0.94 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 1h7h s ALA 177 CO 0.04 -0.34 -0.22 0.71 0.00 0.00 0.00 175.76 175.96 1h7h s TYR 178 N 1.49 2.48 0.53 0.00 2.02 0.67 -1.84 117.35 122.70 1h7h s TYR 178 Ca 0.03 -0.37 -0.18 0.00 -0.37 0.00 0.00 57.07 56.17 1h7h s TYR 178 Cb -0.13 -1.56 -0.06 0.00 -0.40 0.00 0.00 41.96 39.81 1h7h s TYR 178 CO -0.08 0.02 1.05 0.50 -1.57 0.00 0.00 175.55 175.47 1h7h s ARG 179 N -0.59 3.59 0.19 -0.62 6.06 -0.54 -0.90 118.95 126.13 1h7h s ARG 179 Ca 0.09 1.30 -0.13 0.00 -2.50 0.00 0.00 55.73 54.50 1h7h s ARG 179 Cb -0.11 -2.07 0.20 0.00 0.06 0.00 0.00 34.95 33.04 1h7h s ARG 179 CO 0.00 -0.60 1.71 -0.09 -2.50 0.00 0.00 175.30 173.82 1h7h h ARG 180 N 1.08 0.23 -0.10 5.12 2.43 -1.31 -2.48 114.38 119.35 1h7h h ARG 180 Ca -0.48 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 58.68 1h7h h ARG 180 Cb 1.22 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1h7h h ARG 180 CO 0.58 0.15 0.07 0.38 -1.51 0.00 0.00 179.97 179.64 1h7h h ASP 181 N 0.24 0.07 -0.48 -3.80 2.03 -1.93 -2.12 116.42 110.44 1h7h h ASP 181 Ca 0.26 -0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.51 1h7h h ASP 181 Cb 0.35 -0.02 -0.02 0.00 -0.83 0.00 0.00 39.33 38.81 1h7h h ASP 181 CO -0.33 0.05 0.13 0.58 -1.03 0.00 0.00 179.24 178.64 1h7h h VAL 182 N 0.09 1.23 -0.07 4.15 2.07 -1.79 -2.49 116.25 119.44 1h7h h VAL 182 Ca 0.04 -0.81 -0.10 0.00 0.82 0.00 0.00 66.70 66.66 1h7h h VAL 182 Cb 0.06 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1h7h h VAL 182 CO -0.01 0.29 -0.39 -0.07 0.02 0.00 0.00 177.57 177.41 1h7h h LEU 183 N 0.64 0.15 -0.81 2.57 3.38 -1.41 -1.56 115.31 118.28 1h7h h LEU 183 Ca 0.15 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.94 1h7h h LEU 183 Cb 0.31 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1h7h h LEU 183 CO -0.00 0.54 -0.38 1.56 0.09 0.00 0.00 178.44 180.24 1h7h h GLN 184 N 0.13 0.43 -0.02 1.13 4.20 -1.20 -3.06 115.11 116.72 1h7h h GLN 184 Ca 0.01 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.52 1h7h h GLN 184 Cb 0.76 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.53 1h7h h GLN 184 CO 0.06 0.75 -0.18 0.09 -0.67 0.00 0.00 178.83 178.88 1h7h n ASN 185 N -4.04 2.04 -0.03 1.46 3.02 -0.96 -4.61 115.26 112.14 1h7h n ASN 185 Ca -0.01 -1.55 -0.09 0.00 -0.03 0.00 0.00 54.58 52.89 1h7h n ASN 185 Cb 0.49 0.16 -0.03 0.00 -0.61 0.00 0.00 39.78 39.78 1h7h n ASN 185 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1h7h h TYR 186 N 2.92 0.06 0.00 3.10 3.20 -1.17 -2.88 116.97 122.20 1h7h h TYR 186 Ca 0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1h7h h TYR 186 Cb 0.73 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.00 1h7h h TYR 186 CO 0.00 0.02 0.00 0.66 -1.64 0.00 0.00 178.16 177.20 1h7h h SER 187 N 0.11 0.00 1.01 -2.11 4.64 -1.81 -1.76 113.55 113.62 1h7h h SER 187 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1h7h h SER 187 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1h7h h SER 187 CO -0.09 0.00 -0.32 0.00 -0.87 0.00 0.00 176.83 175.55 1h7h n GLN 188 N -2.60 0.19 -2.41 4.77 1.13 -1.09 -4.88 117.38 112.50 1h7h n GLN 188 Ca -0.02 0.10 -0.42 0.00 -1.94 0.00 0.00 57.00 54.72 1h7h n GLN 188 Cb 0.08 -1.66 -0.03 0.00 0.11 0.00 0.00 30.24 28.74 1h7h n GLN 188 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1h7h s LEU 189 N -3.93 4.39 0.56 1.08 1.43 -0.66 -5.03 118.68 116.51 1h7h s LEU 189 Ca 0.10 2.06 -0.11 0.00 -1.03 0.00 0.00 54.13 55.15 1h7h s LEU 189 Cb 0.15 -3.58 -0.05 0.00 0.03 0.00 0.00 46.19 42.73 1h7h s LEU 189 CO 0.65 -0.45 0.96 -2.16 0.23 0.00 0.00 176.35 175.58 1h7h s PRO 190 N 0.79 3.66 0.37 1.29 0.04 -1.26 -5.03 135.00 134.86 1h7h s PRO 190 Ca 0.58 0.66 -0.26 0.00 0.04 0.00 0.00 61.00 62.02 1h7h s PRO 190 Cb -0.30 -2.17 -0.09 0.00 0.04 0.00 0.00 34.50 31.98 1h7h s PRO 190 CO 0.31 -0.41 1.13 -1.21 0.04 0.00 0.00 177.00 176.85 1h7h s GLU 191 N -4.81 4.23 0.22 4.56 2.02 -1.26 -4.95 118.70 118.71 1h7h s GLU 191 Ca 0.54 1.77 0.05 0.00 0.02 0.00 0.00 54.97 57.35 1h7h s GLU 191 Cb -0.11 -2.78 -0.03 0.00 0.10 0.00 0.00 34.13 31.31 1h7h s GLU 191 CO 0.47 -0.14 0.30 -1.54 0.02 0.00 0.00 175.26 174.36 1h7h s SER 192 N -1.15 6.14 0.12 -0.19 1.04 -1.26 -5.02 113.70 113.39 1h7h s SER 192 Ca 0.54 0.03 -0.19 0.00 0.48 0.00 0.00 55.95 56.81 1h7h s SER 192 Cb -0.29 -1.77 -0.05 0.00 0.10 0.00 0.00 66.02 64.00 1h7h s SER 192 CO 0.37 -0.03 1.71 -0.03 0.98 0.00 0.00 173.24 176.25 1h7h h MET 193 N 1.52 0.37 -0.86 4.02 4.05 -1.97 -1.55 114.93 120.52 1h7h h MET 193 Ca -0.50 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 58.87 1h7h h MET 193 Cb 1.22 -0.07 -0.04 0.00 -0.80 0.00 0.00 31.60 31.91 1h7h h MET 193 CO 0.63 0.34 0.52 -1.35 0.23 0.00 0.00 176.91 177.27 1h7h h PRO 194 N 0.31 1.16 0.01 0.39 0.11 -1.95 0.22 132.00 132.25 1h7h h PRO 194 Ca 0.09 -0.10 0.01 0.00 0.11 0.00 0.00 66.00 66.11 1h7h h PRO 194 Cb 0.07 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 30.93 1h7h h PRO 194 CO -0.01 0.81 -0.03 1.49 -0.21 0.00 0.00 178.00 180.05 1h7h h GLU 195 N 1.18 -0.06 -0.33 1.05 4.81 -1.74 0.61 114.58 120.11 1h7h h GLU 195 Ca 0.31 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.46 1h7h h GLU 195 Cb -0.05 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 1h7h h GLU 195 CO -0.06 -0.04 -0.14 1.96 -0.73 0.00 0.00 179.01 180.00 1h7h h GLN 196 N -0.06 0.58 -0.00 1.92 4.20 -0.95 0.56 115.11 121.35 1h7h h GLN 196 Ca 0.01 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 58.54 1h7h h GLN 196 Cb 0.07 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.80 1h7h h GLN 196 CO -0.03 0.70 -0.00 0.00 -0.67 0.00 0.00 178.83 178.83 1h7h h ALA 197 N 1.32 0.00 0.00 3.87 0.00 -0.69 -3.32 119.26 120.45 1h7h h ALA 197 Ca 0.09 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 1h7h h ALA 197 Cb 0.55 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1h7h h ALA 197 CO 0.04 -0.23 -0.60 0.93 0.00 0.00 0.00 179.25 179.39 1h7h h GLU 198 N -0.52 0.00 -4.15 0.00 4.39 -0.88 -3.48 114.58 109.93 1h7h h GLU 198 Ca 0.00 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.49 1h7h h GLU 198 Cb 0.54 0.00 0.10 0.00 -0.10 0.00 0.00 28.75 29.29 1h7h h GLU 198 CO 0.00 0.56 -0.45 0.45 -1.16 0.00 0.00 179.01 178.41 1h7h n SER 199 N -3.23 -2.81 -3.91 1.42 2.88 0.19 -4.94 113.62 103.22 1h7h n SER 199 Ca 0.01 -0.36 -0.30 0.00 -1.33 0.00 0.00 58.87 56.89 1h7h n SER 199 Cb 0.77 -3.31 -0.15 0.00 -0.75 0.00 0.00 64.21 60.76 1h7h n SER 199 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1h7h s LEU 200 N -4.72 2.74 0.51 2.46 1.43 -1.07 -5.02 118.68 115.01 1h7h s LEU 200 Ca 0.11 -1.36 0.15 0.00 -1.03 0.00 0.00 54.13 52.00 1h7h s LEU 200 Cb -0.05 -1.16 1.23 0.00 0.03 0.00 0.00 46.19 46.24 1h7h s LEU 200 CO 0.45 -0.29 2.14 -0.08 0.23 0.00 0.00 176.35 178.79 1h7h h GLU 201 N 7.94 0.06 0.00 1.70 4.81 -1.96 -2.49 114.58 124.65 1h7h h GLU 201 Ca -0.15 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 1h7h h GLU 201 Cb 1.06 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1h7h h GLU 201 CO 0.43 0.04 0.00 -0.56 -0.73 0.00 0.00 179.01 178.19 1h7h h GLN 202 N 0.06 0.00 0.00 1.92 -0.00 -1.98 -1.23 115.11 113.88 1h7h h GLN 202 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.67 1h7h h GLN 202 Cb 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.50 1h7h h GLN 202 CO -0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.83 180.11 1h7h n LEU 203 N -2.60 0.48 -0.03 0.06 4.77 -0.94 -2.50 117.00 116.25 1h7h n LEU 203 Ca -0.01 0.59 -0.06 0.00 -0.03 0.00 0.00 56.01 56.50 1h7h n LEU 203 Cb 0.12 -0.48 0.13 0.00 -2.33 0.00 0.00 43.42 40.85 1h7h n LEU 203 CO 0.17 -0.33 0.69 -0.09 -1.33 0.00 0.00 177.39 176.50 1h7h h ARG 204 N 0.00 0.62 -0.17 3.23 2.43 -1.42 -1.38 114.38 117.70 1h7h h ARG 204 Ca 0.00 -0.26 -0.09 0.00 -0.81 0.00 0.00 59.98 58.82 1h7h h ARG 204 Cb 0.46 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1h7h h ARG 204 CO 0.00 0.84 -0.26 -0.07 -1.51 0.00 0.00 179.97 178.97 1h7h h LEU 205 N 0.54 0.52 -1.40 3.80 3.38 -1.66 -3.07 115.31 117.42 1h7h h LEU 205 Ca 0.07 -0.52 -0.04 0.00 0.09 0.00 0.00 57.88 57.48 1h7h h LEU 205 Cb 0.76 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1h7h h LEU 205 CO 0.06 0.94 -0.02 0.24 0.09 0.00 0.00 178.44 179.75 1h7h h MET 206 N 0.12 0.37 -0.54 1.13 2.86 -1.48 -1.60 114.93 115.78 1h7h h MET 206 Ca 0.02 -0.07 -0.05 0.00 -2.06 0.00 0.00 59.70 57.54 1h7h h MET 206 Cb 0.83 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.41 1h7h h MET 206 CO 0.06 0.42 0.15 -0.97 1.06 0.00 0.00 176.91 177.63 1h7h h ASN 207 N 0.36 0.76 -0.03 1.22 -1.24 -1.21 -2.13 115.58 113.30 1h7h h ASN 207 Ca 0.08 -0.12 0.00 0.00 0.71 0.00 0.00 56.30 56.97 1h7h h ASN 207 Cb 0.28 -0.20 0.00 0.00 0.73 0.00 0.00 38.32 39.13 1h7h h ASN 207 CO 0.01 0.73 0.00 0.00 -1.29 0.00 0.00 177.43 176.88 1h7h n ALA 208 N -2.46 2.62 -1.00 1.57 0.00 -0.82 -4.90 120.51 115.51 1h7h n ALA 208 Ca 0.04 -0.27 -0.00 0.00 0.00 0.00 0.00 53.44 53.21 1h7h n ALA 208 Cb 0.21 -1.32 -0.00 0.00 0.00 0.00 0.00 19.45 18.34 1h7h n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h7h n GLY 209 N 0.98 0.42 3.65 0.00 0.00 -0.80 -5.01 105.19 104.44 1h7h n GLY 209 Ca 0.18 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 1h7h n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h7h s ILE 210 N -2.00 4.86 0.30 -0.61 1.01 -0.67 -5.02 121.20 119.08 1h7h s ILE 210 Ca 0.00 1.57 -0.29 0.00 0.00 0.00 0.00 60.65 61.93 1h7h s ILE 210 Cb 0.00 -4.11 -0.10 0.00 0.01 0.00 0.00 42.46 38.26 1h7h s ILE 210 CO 0.00 -0.02 1.19 0.21 0.00 0.00 0.00 174.94 176.31 1h7h s ASN 211 N 1.26 7.06 -0.22 3.58 2.47 -1.26 -4.19 114.94 123.65 1h7h s ASN 211 Ca 0.36 2.45 -0.00 0.00 0.42 0.00 0.00 52.86 56.08 1h7h s ASN 211 Cb -0.16 -2.64 0.06 0.00 -1.45 0.00 0.00 41.25 37.06 1h7h s ASN 211 CO 0.09 -0.31 -0.03 -0.63 -3.72 0.00 0.00 177.10 172.50 1h7h s ILE 212 N -1.15 1.27 -0.00 -5.21 1.01 -1.26 -3.33 121.20 112.53 1h7h s ILE 212 Ca 0.46 -1.02 -0.21 0.00 0.00 0.00 0.00 60.65 59.88 1h7h s ILE 212 Cb -0.35 -1.58 -0.05 0.00 0.01 0.00 0.00 42.46 40.48 1h7h s ILE 212 CO 0.46 -0.10 0.62 -0.60 0.00 0.00 0.00 174.94 175.32 1h7h s ARG 213 N 1.52 4.35 -0.25 2.79 3.52 -0.63 -1.31 118.95 128.93 1h7h s ARG 213 Ca -0.04 0.78 -0.04 0.00 -0.13 0.00 0.00 55.73 56.30 1h7h s ARG 213 Cb -0.18 -3.35 0.01 0.00 -1.56 0.00 0.00 34.95 29.87 1h7h s ARG 213 CO -0.07 0.34 -0.02 0.99 -0.81 0.00 0.00 175.30 175.73 1h7h s THR 214 N -0.11 3.28 -0.08 4.11 2.01 -0.09 -0.76 115.64 123.98 1h7h s THR 214 Ca 0.32 -0.81 -0.15 0.00 0.31 0.00 0.00 61.69 61.36 1h7h s THR 214 Cb -0.18 -2.63 -0.05 0.00 0.01 0.00 0.00 72.50 69.65 1h7h s THR 214 CO 0.18 0.22 0.39 -0.36 -0.69 0.00 0.00 174.62 174.36 1h7h s PHE 215 N 1.41 3.58 0.01 4.92 0.08 -0.18 -4.82 117.98 122.97 1h7h s PHE 215 Ca 0.02 0.84 -0.23 0.00 0.12 0.00 0.00 56.93 57.69 1h7h s PHE 215 Cb -0.16 -2.38 -0.05 0.00 -0.57 0.00 0.00 43.02 39.86 1h7h s PHE 215 CO -0.02 0.38 0.68 -2.00 -0.10 0.00 0.00 175.22 174.16 1h7h s GLU 216 N -0.11 4.41 0.36 0.44 2.12 -1.26 -1.58 118.70 123.07 1h7h s GLU 216 Ca 0.22 0.89 0.04 0.00 0.36 0.00 0.00 54.97 56.48 1h7h s GLU 216 Cb -0.15 -3.37 -0.03 0.00 0.26 0.00 0.00 34.13 30.84 1h7h s GLU 216 CO 0.10 0.29 0.13 0.14 -0.54 0.00 0.00 175.26 175.38 1h7h s VAL 217 N -0.00 0.57 0.82 3.70 -7.23 0.22 -4.94 120.40 113.54 1h7h s VAL 217 Ca 0.35 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.41 1h7h s VAL 217 Cb -0.19 -2.47 0.08 0.00 0.56 0.00 0.00 36.38 34.36 1h7h s VAL 217 CO 0.20 0.00 1.09 0.00 -0.31 0.00 0.00 175.10 176.08 1h7h s ALA 218 N -3.36 2.04 0.10 1.32 0.00 -1.26 -4.33 121.76 116.26 1h7h s ALA 218 Ca 0.30 -0.10 -0.34 0.00 0.00 0.00 0.00 51.96 51.82 1h7h s ALA 218 Cb 0.04 -3.15 -0.14 0.00 0.00 0.00 0.00 23.12 19.87 1h7h s ALA 218 CO 0.16 -1.91 1.60 0.00 0.00 0.00 0.00 175.76 175.61 1h7h n ALA 219 N -3.57 0.94 -1.95 0.00 0.00 -1.26 -4.85 120.51 109.82 1h7h n ALA 219 Ca 0.07 0.43 -0.28 0.00 0.00 0.00 0.00 53.44 53.66 1h7h n ALA 219 Cb 0.55 -2.34 0.05 0.00 0.00 0.00 0.00 19.45 17.72 1h7h n ALA 219 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1h7h s THR 220 N 1.42 3.11 0.83 0.00 -4.23 -1.26 -5.07 115.64 110.44 1h7h s THR 220 Ca 0.82 0.17 -0.11 0.00 -1.18 0.00 0.00 61.69 61.39 1h7h s THR 220 Cb -0.73 -3.32 0.09 0.00 1.34 0.00 0.00 72.50 69.88 1h7h s THR 220 CO 0.42 -0.39 1.09 -0.83 -0.54 0.00 0.00 174.62 174.37 1h7h s GLY 221 N -4.40 1.62 0.37 3.99 0.00 -1.26 -4.99 107.32 102.64 1h7h s GLY 221 Ca 0.58 -0.13 -0.27 0.00 0.00 0.00 0.00 44.72 44.90 1h7h s GLY 221 CO 0.49 0.31 1.28 2.56 0.00 0.00 0.00 173.10 177.74 1h7h s PRO 222 N -5.06 4.17 0.00 2.90 0.04 -1.26 -4.97 135.00 130.81 1h7h s PRO 222 Ca 0.62 2.12 0.00 0.00 0.04 0.00 0.00 61.00 63.78 1h7h s PRO 222 Cb -0.16 -2.90 0.00 0.00 0.04 0.00 0.00 34.50 31.49 1h7h s PRO 222 CO 0.55 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.69 1h7h n GLY 223 N 0.74 -0.41 2.83 0.56 0.00 -1.26 -4.74 105.19 102.91 1h7h n GLY 223 Ca 0.02 -1.77 -0.29 0.00 0.00 0.00 0.00 46.02 43.98 1h7h n GLY 223 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h7h s VAL 224 N -0.46 1.12 0.00 1.61 1.01 -1.14 -4.66 120.40 117.88 1h7h s VAL 224 Ca 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 61.98 60.85 1h7h s VAL 224 Cb 0.00 -1.59 0.00 0.00 0.00 0.00 0.00 36.38 34.79 1h7h s VAL 224 CO 0.00 -0.30 0.00 0.47 0.00 0.00 0.00 175.10 175.27 1h7h n ASP 225 N 4.80 0.00 -4.46 3.32 8.00 -1.26 -4.96 116.55 121.99 1h7h n ASP 225 Ca -0.08 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.10 1h7h n ASP 225 Cb 0.44 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.41 1h7h n ASP 225 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1h7h s THR 226 N -1.00 2.90 -1.04 -3.53 -1.32 -1.26 -4.79 115.64 105.59 1h7h s THR 226 Ca 0.00 -0.89 0.06 0.00 -1.21 0.00 0.00 61.69 59.65 1h7h s THR 226 Cb 0.00 -2.15 0.05 0.00 -1.51 0.00 0.00 72.50 68.89 1h7h s THR 226 CO 0.00 0.52 1.16 -0.81 -2.21 0.00 0.00 174.62 173.28 1h7h n PRO 227 N 2.09 0.01 0.14 7.08 -0.04 -1.26 -1.53 135.00 141.49 1h7h n PRO 227 Ca -0.17 0.39 -0.23 0.00 -0.04 0.00 0.00 63.50 63.45 1h7h n PRO 227 Cb 0.52 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.32 1h7h n PRO 227 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1h7h h ALA 228 N 2.20 -0.12 0.00 0.55 0.00 -2.01 -3.20 119.26 116.68 1h7h h ALA 228 Ca 0.00 -0.86 -0.17 0.00 0.00 0.00 0.00 54.91 53.88 1h7h h ALA 228 Cb 0.09 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1h7h h ALA 228 CO 0.00 0.74 -0.82 0.00 0.00 0.00 0.00 179.25 179.17 1h7h h LEU 230 N 0.00 1.07 -0.95 0.00 5.85 -1.40 -1.10 115.31 118.77 1h7h h LEU 230 Ca -0.01 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.51 1h7h h LEU 230 Cb 1.58 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 1h7h h LEU 230 CO 0.11 0.85 -0.39 -0.33 -0.34 0.00 0.00 178.44 178.34 1h7h h GLU 231 N 1.19 0.26 -0.16 1.25 4.39 -1.62 -1.35 114.58 118.55 1h7h h GLU 231 Ca 0.30 -0.12 -0.17 0.00 0.34 0.00 0.00 59.36 59.71 1h7h h GLU 231 Cb 0.02 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1h7h h GLU 231 CO -0.05 0.62 -0.61 -0.22 -1.16 0.00 0.00 179.01 177.58 1h7h h LYS 232 N 0.22 0.54 -0.29 2.33 3.64 -1.51 -1.75 116.57 119.76 1h7h h LYS 232 Ca 0.02 -0.37 -0.07 0.00 -1.27 0.00 0.00 60.65 58.97 1h7h h LYS 232 Cb 0.79 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.66 1h7h h LYS 232 CO 0.06 0.99 -0.08 0.28 -2.27 0.00 0.00 179.45 178.43 1h7h h VAL 233 N 0.40 1.28 -0.43 2.00 2.07 -0.95 0.13 116.25 120.75 1h7h h VAL 233 Ca -0.01 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.40 1h7h h VAL 233 Cb 1.17 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 32.34 1h7h h VAL 233 CO 0.11 0.35 0.29 0.03 0.02 0.00 0.00 177.57 178.37 1h7h h ARG 234 N 0.31 0.57 -0.15 1.57 3.08 -1.19 0.67 114.38 119.24 1h7h h ARG 234 Ca 0.07 -0.04 -0.14 0.00 0.07 0.00 0.00 59.98 59.94 1h7h h ARG 234 Cb 0.56 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 1h7h h ARG 234 CO 0.03 0.38 -0.52 0.00 -1.07 0.00 0.00 179.97 178.79 1h7h h ALA 235 N 1.15 0.82 -0.08 0.04 0.00 -1.27 -1.00 119.26 118.93 1h7h h ALA 235 Ca 0.16 -0.49 -0.17 0.00 0.00 0.00 0.00 54.91 54.40 1h7h h ALA 235 Cb -0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1h7h h ALA 235 CO -0.03 0.68 -0.69 1.25 0.00 0.00 0.00 179.25 180.45 1h7h h LEU 236 N 0.33 0.42 -0.15 0.00 5.85 -0.31 -0.71 115.31 120.74 1h7h h LEU 236 Ca 0.01 -0.27 -0.17 0.00 0.84 0.00 0.00 57.88 58.29 1h7h h LEU 236 Cb 1.02 -0.12 0.01 0.00 0.37 0.00 0.00 40.66 41.94 1h7h h LEU 236 CO 0.09 0.99 -0.59 -0.03 -0.34 0.00 0.00 178.44 178.56 1h7h h MET 237 N 0.25 0.67 -0.48 1.25 4.05 0.44 -2.65 114.93 118.46 1h7h h MET 237 Ca -0.02 -0.51 -0.12 0.00 -0.28 0.00 0.00 59.70 58.76 1h7h h MET 237 Cb 1.25 0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 32.13 1h7h h MET 237 CO 0.12 1.13 -0.19 0.00 0.23 0.00 0.00 176.91 178.20 1h7h h ALA 238 N 0.54 0.76 0.00 0.39 0.00 -1.16 -2.46 119.26 117.33 1h7h h ALA 238 Ca -0.03 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 1h7h h ALA 238 Cb 1.22 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1h7h h ALA 238 CO 0.12 0.67 -0.15 0.37 0.00 0.00 0.00 179.25 180.25 1h7h h GLN 239 N 0.83 0.00 -0.10 0.00 -0.00 -1.14 -2.56 115.11 112.14 1h7h h GLN 239 Ca 0.11 0.00 -0.21 0.00 -0.00 0.00 0.00 58.65 58.56 1h7h h GLN 239 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.24 1h7h h GLN 239 CO 0.06 0.15 -0.78 1.49 0.00 0.00 0.00 178.83 179.75 1h7h h GLU 240 N 0.00 0.59 -0.49 1.69 4.81 -1.07 -2.83 114.58 117.27 1h7h h GLU 240 Ca -0.00 -0.50 -0.09 0.00 -0.13 0.00 0.00 59.36 58.64 1h7h h GLU 240 Cb 0.29 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 1h7h h GLU 240 CO 0.02 1.12 -0.05 -0.07 -0.73 0.00 0.00 179.01 179.30 1h7h h LEU 241 N 0.39 0.84 -0.63 1.64 3.38 -1.08 -2.79 115.31 117.06 1h7h h LEU 241 Ca -0.05 -0.23 -0.15 0.00 0.09 0.00 0.00 57.88 57.54 1h7h h LEU 241 Cb 1.39 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 1h7h h LEU 241 CO 0.15 0.93 -0.67 0.00 0.09 0.00 0.00 178.44 178.94 1h7h h ALA 242 N 1.15 0.86 -0.24 1.53 0.00 -1.55 -3.21 119.26 117.80 1h7h h ALA 242 Ca 0.14 -0.60 -0.15 0.00 0.00 0.00 0.00 54.91 54.30 1h7h h ALA 242 Cb 0.54 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1h7h h ALA 242 CO 0.03 0.82 -0.46 1.49 0.00 0.00 0.00 179.25 181.13 1h7h h GLU 243 N 0.04 0.62 -2.41 0.00 4.81 -1.37 -3.26 114.58 113.01 1h7h h GLU 243 Ca -0.01 -0.35 -0.79 0.00 -0.13 0.00 0.00 59.36 58.08 1h7h h GLU 243 Cb 1.19 0.02 -0.23 0.00 0.63 0.00 0.00 28.75 30.36 1h7h h GLU 243 CO 0.09 0.95 1.38 0.09 -0.73 0.00 0.00 179.01 180.80 1h7h n ASN 244 N -4.00 7.43 -0.78 1.04 3.02 -1.07 -5.12 115.26 115.79 1h7h n ASN 244 Ca -0.02 -3.53 0.10 0.00 -0.03 0.00 0.00 54.58 51.10 1h7h n ASN 244 Cb 0.56 -1.23 0.08 0.00 -0.61 0.00 0.00 39.78 38.58 1h7h n ASN 244 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64