#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j9s s THR 5 N 0.00 3.56 0.15 0.00 -4.23 -1.26 -5.02 115.64 108.83 1j9s s THR 5 Ca 0.00 -0.59 -0.12 0.00 -1.18 0.00 0.00 61.69 59.80 1j9s s THR 5 Cb 0.00 -3.31 0.01 0.00 1.34 0.00 0.00 72.50 70.54 1j9s s THR 5 CO 0.00 -0.21 1.59 0.00 -0.54 0.00 0.00 174.62 175.45 1j9s h ALA 6 N 0.33 0.66 -0.18 3.99 0.00 -2.06 -3.08 119.26 118.92 1j9s h ALA 6 Ca -0.45 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.04 1j9s h ALA 6 Cb 1.27 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1j9s h ALA 6 CO 0.55 0.50 -0.40 0.00 0.00 0.00 0.00 179.25 179.90 1j9s h ALA 7 N 0.91 0.96 -0.54 0.00 0.00 -1.99 -3.02 119.26 115.59 1j9s h ALA 7 Ca 0.13 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1j9s h ALA 7 Cb 0.57 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1j9s h ALA 7 CO 0.03 0.62 0.30 0.93 0.00 0.00 0.00 179.25 181.13 1j9s h GLU 8 N 0.35 0.75 -0.39 0.00 5.08 -1.94 -0.14 114.58 118.28 1j9s h GLU 8 Ca 0.03 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1j9s h GLU 8 Cb 0.86 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 1j9s h GLU 8 CO 0.07 0.58 0.17 0.82 -1.00 0.00 0.00 179.01 179.64 1j9s h ILE 9 N 0.72 1.19 0.00 3.13 2.04 -1.52 -2.13 117.51 120.94 1j9s h ILE 9 Ca 0.19 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.45 1j9s h ILE 9 Cb 0.05 0.84 -0.00 0.00 -0.74 0.00 0.00 36.82 36.96 1j9s h ILE 9 CO -0.03 0.21 -0.09 0.00 0.00 0.00 0.00 178.15 178.24 1j9s h ALA 10 N 1.01 1.55 0.00 1.87 0.00 -1.34 -2.38 119.26 119.97 1j9s h ALA 10 Ca 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1j9s h ALA 10 Cb 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1j9s h ALA 10 CO -0.01 0.12 -0.42 0.00 0.00 0.00 0.00 179.25 178.94 1j9s n ALA 11 N -2.39 3.20 -1.70 0.00 0.00 -0.10 -4.93 120.51 114.60 1j9s n ALA 11 Ca -0.02 -0.28 -0.36 0.00 0.00 0.00 0.00 53.44 52.77 1j9s n ALA 11 Cb 0.18 -1.20 0.06 0.00 0.00 0.00 0.00 19.45 18.49 1j9s n ALA 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1j9s s LEU 12 N -3.21 3.58 0.56 0.00 1.43 -0.90 -4.94 118.68 115.20 1j9s s LEU 12 Ca 0.11 2.51 -0.20 0.00 -1.03 0.00 0.00 54.13 55.51 1j9s s LEU 12 Cb 0.17 -4.61 -0.05 0.00 0.03 0.00 0.00 46.19 41.74 1j9s s LEU 12 CO 0.67 -1.87 1.25 -2.84 0.23 0.00 0.00 176.35 173.79 1j9s s PRO 13 N -3.41 3.14 -0.12 1.29 0.02 -1.26 -4.79 135.00 129.87 1j9s s PRO 13 Ca 0.80 1.96 -0.00 0.00 0.02 0.00 0.00 61.00 63.78 1j9s s PRO 13 Cb -0.34 -2.12 -0.02 0.00 0.02 0.00 0.00 34.50 32.05 1j9s s PRO 13 CO 0.38 -1.10 -0.12 1.03 -0.33 0.00 0.00 177.00 176.85 1j9s s ARG 14 N -3.08 3.31 -0.09 5.54 3.00 -1.26 -1.15 118.95 125.21 1j9s s ARG 14 Ca 0.73 -0.66 -0.01 0.00 0.00 0.00 0.00 55.73 55.79 1j9s s ARG 14 Cb -0.34 -2.64 0.03 0.00 0.00 0.00 0.00 34.95 32.00 1j9s s ARG 14 CO 0.38 0.27 -0.04 -1.14 0.00 0.00 0.00 175.30 174.78 1j9s s GLN 15 N 0.20 1.12 0.05 3.54 0.74 -0.12 -4.96 119.66 120.23 1j9s s GLN 15 Ca -0.07 -0.10 -0.22 0.00 0.05 0.00 0.00 55.36 55.02 1j9s s GLN 15 Cb -0.15 -1.30 -0.06 0.00 1.10 0.00 0.00 33.01 32.60 1j9s s GLN 15 CO 0.05 -0.27 0.66 0.15 -0.55 0.00 0.00 175.29 175.33 1j9s s LYS 16 N 1.78 4.38 0.01 1.67 1.02 -1.26 0.44 119.74 127.77 1j9s s LYS 16 Ca 0.04 0.88 0.07 0.00 0.02 0.00 0.00 55.97 56.98 1j9s s LYS 16 Cb -0.13 -3.31 -0.03 0.00 -0.52 0.00 0.00 37.83 33.84 1j9s s LYS 16 CO -0.07 0.43 -0.20 0.08 -0.92 0.00 0.00 175.35 174.68 1j9s s VAL 17 N -0.49 2.65 -0.29 3.17 1.01 -0.41 -4.91 120.40 121.13 1j9s s VAL 17 Ca 0.33 -1.08 -0.17 0.00 0.00 0.00 0.00 61.98 61.06 1j9s s VAL 17 Cb -0.20 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.11 1j9s s VAL 17 CO 0.20 0.45 0.47 -1.61 0.00 0.00 0.00 175.10 174.62 1j9s s GLU 18 N -1.08 3.94 0.61 2.72 2.02 -1.26 -4.72 118.70 120.93 1j9s s GLU 18 Ca 0.13 0.13 -0.14 0.00 0.02 0.00 0.00 54.97 55.10 1j9s s GLU 18 Cb -0.10 -3.69 -0.03 0.00 0.10 0.00 0.00 34.13 30.40 1j9s s GLU 18 CO 0.03 -0.40 1.04 -0.51 0.02 0.00 0.00 175.26 175.43 1j9s s LEU 19 N 2.26 3.40 0.07 1.80 1.43 -1.26 -4.67 118.68 121.71 1j9s s LEU 19 Ca 0.19 1.68 0.07 0.00 -1.03 0.00 0.00 54.13 55.03 1j9s s LEU 19 Cb -0.16 -4.51 -0.03 0.00 0.03 0.00 0.00 46.19 41.52 1j9s s LEU 19 CO 0.10 -1.10 -0.18 0.68 0.23 0.00 0.00 176.35 176.08 1j9s s VAL 20 N -2.72 1.42 0.38 -1.59 -7.23 -1.26 -4.97 120.40 104.43 1j9s s VAL 20 Ca 0.60 -1.31 -0.26 0.00 -1.81 0.00 0.00 61.98 59.20 1j9s s VAL 20 Cb -0.14 -1.29 -0.09 0.00 0.56 0.00 0.00 36.38 35.42 1j9s s VAL 20 CO 0.42 -0.05 1.17 -1.81 -0.31 0.00 0.00 175.10 174.52 1j9s s ASP 21 N -1.58 6.64 0.79 4.85 1.01 -1.26 -4.61 116.67 122.51 1j9s s ASP 21 Ca 0.03 2.35 -0.13 0.00 0.71 0.00 0.00 52.55 55.51 1j9s s ASP 21 Cb -0.09 -2.62 0.07 0.00 1.01 0.00 0.00 42.92 41.29 1j9s s ASP 21 CO 0.03 -0.60 1.19 -2.84 0.21 0.00 0.00 175.17 173.16 1j9s s PRO 22 N -2.17 1.79 0.00 8.23 0.02 -1.26 -2.03 135.00 139.58 1j9s s PRO 22 Ca 0.55 1.69 0.25 0.00 0.02 0.00 0.00 61.00 63.52 1j9s s PRO 22 Cb -0.31 -1.80 1.51 0.00 0.02 0.00 0.00 34.50 33.92 1j9s s PRO 22 CO 0.40 -2.09 1.93 -0.35 -0.33 0.00 0.00 177.00 176.56 1j9s n PRO 23 N -3.21 0.92 -1.83 5.54 -0.04 -1.26 -5.05 135.00 130.07 1j9s n PRO 23 Ca 0.13 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.29 1j9s n PRO 23 Cb 0.51 -1.43 0.05 0.00 -0.04 0.00 0.00 33.50 32.59 1j9s n PRO 23 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1j9s s PHE 24 N -2.00 3.27 -0.01 0.54 0.40 -0.86 -0.77 117.98 118.55 1j9s s PHE 24 Ca 0.38 1.08 0.04 0.00 -0.60 0.00 0.00 56.93 57.83 1j9s s PHE 24 Cb 0.17 -3.06 -0.01 0.00 0.51 0.00 0.00 43.02 40.64 1j9s s PHE 24 CO 0.29 -1.24 -0.13 0.08 0.70 0.00 0.00 175.22 174.93 1j9s s VAL 25 N -3.32 1.02 1.04 -0.44 1.01 -1.26 -4.61 120.40 113.84 1j9s s VAL 25 Ca 0.58 -0.55 -0.11 0.00 0.00 0.00 0.00 61.98 61.90 1j9s s VAL 25 Cb -0.12 -0.85 0.22 0.00 0.00 0.00 0.00 36.38 35.63 1j9s s VAL 25 CO 0.52 0.29 1.09 -1.38 0.00 0.00 0.00 175.10 175.62 1j9s s HIS 26 N -0.30 1.47 0.27 5.22 -3.43 -1.26 -4.91 115.29 112.35 1j9s s HIS 26 Ca 0.05 1.49 -0.30 0.00 -0.80 0.00 0.00 55.06 55.50 1j9s s HIS 26 Cb -0.05 -3.22 -0.11 0.00 -1.43 0.00 0.00 32.58 27.77 1j9s s HIS 26 CO -0.00 -3.36 1.57 0.00 -2.00 0.00 0.00 174.74 170.94 1j9s s ALA 27 N -2.55 3.73 0.17 -1.38 0.00 -1.26 -5.00 121.76 115.47 1j9s s ALA 27 Ca 0.68 1.51 -0.24 0.00 0.00 0.00 0.00 51.96 53.91 1j9s s ALA 27 Cb -0.24 -3.63 0.06 0.00 0.00 0.00 0.00 23.12 19.31 1j9s s ALA 27 CO 0.61 -0.92 0.77 -3.38 0.00 0.00 0.00 175.76 172.84 1j9s s HIS 28 N 0.12 -0.30 -0.01 0.00 -3.43 -1.26 -5.03 115.29 105.37 1j9s s HIS 28 Ca 0.63 0.00 0.04 0.00 -0.80 0.00 0.00 55.06 54.94 1j9s s HIS 28 Cb -0.46 0.62 -0.03 0.00 -1.43 0.00 0.00 32.58 31.28 1j9s s HIS 28 CO 0.45 -0.92 -0.12 0.45 -2.00 0.00 0.00 174.74 172.60 1j9s s SER 29 N -2.80 4.25 0.02 7.38 0.15 -1.26 -5.04 113.70 116.40 1j9s s SER 29 Ca 0.07 -0.21 -0.21 0.00 0.70 0.00 0.00 55.95 56.31 1j9s s SER 29 Cb -0.03 -0.91 -0.17 0.00 -1.71 0.00 0.00 66.02 63.20 1j9s s SER 29 CO -0.03 0.31 1.26 1.56 1.20 0.00 0.00 173.24 177.54 1j9s h GLN 30 N 4.88 0.34 -6.07 5.44 4.20 -1.97 -3.41 115.11 118.51 1j9s h GLN 30 Ca -0.48 -0.23 -0.57 0.00 0.06 0.00 0.00 58.65 57.44 1j9s h GLN 30 Cb 1.16 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 28.92 1j9s h GLN 30 CO 0.51 0.83 -0.00 0.08 -0.67 0.00 0.00 178.83 179.57 1j9s s VAL 31 N -3.97 4.92 0.54 -0.54 1.01 -1.26 -3.55 120.40 117.55 1j9s s VAL 31 Ca -0.14 1.26 -0.22 0.00 0.00 0.00 0.00 61.98 62.88 1j9s s VAL 31 Cb 0.04 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 1j9s s VAL 31 CO 0.76 0.40 1.30 0.00 0.00 0.00 0.00 175.10 177.57 1j9s n ALA 32 N 2.83 1.37 -3.52 5.51 0.00 0.83 -4.96 120.51 122.57 1j9s n ALA 32 Ca -0.06 0.13 -0.36 0.00 0.00 0.00 0.00 53.44 53.15 1j9s n ALA 32 Cb 0.51 -2.32 -0.14 0.00 0.00 0.00 0.00 19.45 17.51 1j9s n ALA 32 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1j9s s GLU 33 N -2.81 2.82 0.25 0.00 2.02 -1.26 -5.00 118.70 114.72 1j9s s GLU 33 Ca 0.71 -1.01 0.00 0.00 0.02 0.00 0.00 54.97 54.69 1j9s s GLU 33 Cb -0.43 -3.16 0.00 0.00 0.10 0.00 0.00 34.13 30.64 1j9s s GLU 33 CO 0.50 -0.47 0.00 0.41 0.02 0.00 0.00 175.26 175.72 1j9s n GLY 34 N 4.73 -2.22 0.00 -1.39 0.00 -1.26 -4.95 105.19 100.09 1j9s n GLY 34 Ca -0.15 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.36 1j9s n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j9s n GLY 35 N -0.80 -0.96 3.66 -0.02 0.00 -1.26 -4.98 105.19 100.83 1j9s n GLY 35 Ca 0.00 -1.68 -0.44 0.00 0.00 0.00 0.00 46.02 43.91 1j9s n GLY 35 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1j9s n PRO 36 N -0.83 1.87 -4.23 1.61 -0.02 -1.26 -5.02 135.00 127.12 1j9s n PRO 36 Ca 0.00 0.66 -0.13 0.00 -2.02 0.00 0.00 63.50 62.01 1j9s n PRO 36 Cb 0.00 -2.18 -0.10 0.00 -0.02 0.00 0.00 33.50 31.20 1j9s n PRO 36 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1j9s s LYS 37 N -1.55 1.01 -0.47 -0.52 1.02 -1.26 -4.45 119.74 113.53 1j9s s LYS 37 Ca 0.58 -1.44 -0.14 0.00 0.02 0.00 0.00 55.97 54.99 1j9s s LYS 37 Cb -0.63 -0.45 0.08 0.00 -0.52 0.00 0.00 37.83 36.31 1j9s s LYS 37 CO 0.60 0.01 0.38 0.08 -0.92 0.00 0.00 175.35 175.50 1j9s s VAL 38 N -3.47 5.07 -0.24 3.17 1.01 -0.30 -1.10 120.40 124.54 1j9s s VAL 38 Ca 0.17 -1.15 -0.23 0.00 0.00 0.00 0.00 61.98 60.77 1j9s s VAL 38 Cb 0.04 -4.05 -0.01 0.00 0.00 0.00 0.00 36.38 32.35 1j9s s VAL 38 CO -0.00 -0.59 0.75 -0.69 0.00 0.00 0.00 175.10 174.57 1j9s s VAL 39 N 1.60 4.90 -0.17 2.92 1.01 -0.02 -0.95 120.40 129.70 1j9s s VAL 39 Ca 0.04 1.40 -0.09 0.00 0.00 0.00 0.00 61.98 63.32 1j9s s VAL 39 Cb -0.24 -4.04 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 1j9s s VAL 39 CO 0.06 -0.02 0.15 -1.61 0.00 0.00 0.00 175.10 173.67 1j9s s GLU 40 N 2.64 3.93 0.06 2.72 2.02 0.17 -0.87 118.70 129.38 1j9s s GLU 40 Ca 0.32 -0.16 0.04 0.00 0.02 0.00 0.00 54.97 55.19 1j9s s GLU 40 Cb -0.15 -3.34 -0.03 0.00 0.10 0.00 0.00 34.13 30.71 1j9s s GLU 40 CO 0.08 0.47 -0.12 -0.06 0.02 0.00 0.00 175.26 175.65 1j9s s PHE 41 N -0.13 1.04 -0.04 1.61 0.40 -0.79 -1.29 117.98 118.79 1j9s s PHE 41 Ca 0.11 -0.49 0.02 0.00 -0.60 0.00 0.00 56.93 55.98 1j9s s PHE 41 Cb -0.12 -0.59 0.01 0.00 0.51 0.00 0.00 43.02 42.83 1j9s s PHE 41 CO 0.01 0.01 -0.09 0.99 0.70 0.00 0.00 175.22 176.84 1j9s s THR 42 N -1.39 0.79 -0.02 0.64 2.01 -1.26 -0.47 115.64 115.94 1j9s s THR 42 Ca -0.04 -0.32 0.01 0.00 0.31 0.00 0.00 61.69 61.65 1j9s s THR 42 Cb -0.10 -0.73 0.01 0.00 0.01 0.00 0.00 72.50 71.70 1j9s s THR 42 CO 0.02 0.26 -0.04 -0.04 -0.69 0.00 0.00 174.62 174.13 1j9s s MET 43 N 0.46 0.54 -0.15 4.92 -1.94 -0.53 -4.95 119.30 117.64 1j9s s MET 43 Ca -0.08 -0.09 -0.06 0.00 -1.71 0.00 0.00 55.69 53.75 1j9s s MET 43 Cb -0.11 -0.58 -0.04 0.00 2.01 0.00 0.00 34.83 36.11 1j9s s MET 43 CO 0.01 -0.02 0.07 0.08 -0.01 0.00 0.00 175.02 175.15 1j9s s VAL 44 N 0.54 4.85 0.06 -6.03 1.01 -1.26 -1.13 120.40 118.45 1j9s s VAL 44 Ca -0.06 -0.02 -0.24 0.00 0.00 0.00 0.00 61.98 61.66 1j9s s VAL 44 Cb -0.10 -3.15 -0.06 0.00 0.00 0.00 0.00 36.38 33.08 1j9s s VAL 44 CO -0.00 0.52 0.73 -0.63 0.00 0.00 0.00 175.10 175.71 1j9s s ILE 45 N -0.14 4.70 -0.15 2.22 1.01 0.53 -0.65 121.20 128.73 1j9s s ILE 45 Ca 0.07 1.55 -0.01 0.00 0.00 0.00 0.00 60.65 62.27 1j9s s ILE 45 Cb -0.12 -4.07 0.04 0.00 0.01 0.00 0.00 42.46 38.31 1j9s s ILE 45 CO 0.01 0.41 -0.04 -0.70 0.00 0.00 0.00 174.94 174.62 1j9s s GLU 46 N -0.31 1.31 -0.13 2.79 2.12 -0.32 -4.44 118.70 119.73 1j9s s GLU 46 Ca 0.36 -0.42 -0.24 0.00 0.36 0.00 0.00 54.97 55.04 1j9s s GLU 46 Cb -0.20 -1.87 -0.03 0.00 0.26 0.00 0.00 34.13 32.29 1j9s s GLU 46 CO 0.22 -0.41 0.73 -1.21 -0.54 0.00 0.00 175.26 174.05 1j9s s GLU 47 N 1.69 4.35 0.04 4.30 2.02 -1.26 -1.17 118.70 128.66 1j9s s GLU 47 Ca 0.02 0.88 -0.27 0.00 0.02 0.00 0.00 54.97 55.61 1j9s s GLU 47 Cb -0.15 -3.52 0.08 0.00 0.10 0.00 0.00 34.13 30.65 1j9s s GLU 47 CO -0.08 -0.13 0.69 -1.59 0.02 0.00 0.00 175.26 174.18 1j9s s LYS 48 N 1.47 1.09 0.02 1.61 -2.85 0.09 -4.98 119.74 116.20 1j9s s LYS 48 Ca 0.36 -0.12 -0.27 0.00 -1.00 0.00 0.00 55.97 54.94 1j9s s LYS 48 Cb -0.17 0.51 -0.05 0.00 -2.06 0.00 0.00 37.83 36.06 1j9s s LYS 48 CO 0.15 -0.42 0.84 0.15 0.10 0.00 0.00 175.35 176.17 1j9s s LYS 49 N -2.48 4.54 0.07 1.78 1.02 -1.26 0.27 119.74 123.67 1j9s s LYS 49 Ca -0.03 1.18 0.04 0.00 0.02 0.00 0.00 55.97 57.17 1j9s s LYS 49 Cb -0.01 -3.41 -0.03 0.00 -0.52 0.00 0.00 37.83 33.87 1j9s s LYS 49 CO -0.03 0.15 -0.11 0.96 -0.92 0.00 0.00 175.35 175.40 1j9s s ILE 50 N 0.38 0.88 -0.17 2.17 -4.36 -0.73 -4.93 121.20 114.44 1j9s s ILE 50 Ca 0.43 -1.29 -0.13 0.00 -0.26 0.00 0.00 60.65 59.41 1j9s s ILE 50 Cb -0.21 -0.96 -0.05 0.00 1.25 0.00 0.00 42.46 42.50 1j9s s ILE 50 CO 0.24 -0.34 0.25 -0.69 0.24 0.00 0.00 174.94 174.64 1j9s s VAL 51 N -1.51 5.33 -1.11 8.37 1.01 -1.26 -1.71 120.40 129.52 1j9s s VAL 51 Ca -0.04 0.45 0.10 0.00 0.00 0.00 0.00 61.98 62.50 1j9s s VAL 51 Cb -0.09 -3.59 0.04 0.00 0.00 0.00 0.00 36.38 32.74 1j9s s VAL 51 CO 0.01 0.41 0.72 2.30 0.00 0.00 0.00 175.10 178.54 1j9s n ILE 52 N 3.54 0.00 -3.95 2.22 -5.35 -0.32 -4.84 119.36 110.66 1j9s n ILE 52 Ca -0.13 -0.44 -0.10 0.00 -0.27 0.00 0.00 62.75 61.80 1j9s n ILE 52 Cb 0.52 1.16 -0.03 0.00 -1.74 0.00 0.00 39.64 39.56 1j9s n ILE 52 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1j9s n ASP 53 N 0.12 -0.86 -0.16 7.28 3.85 -1.26 -0.76 116.55 124.76 1j9s n ASP 53 Ca 0.05 -2.32 0.14 0.00 -0.71 0.00 0.00 54.79 51.95 1j9s n ASP 53 Cb 0.24 1.65 0.74 0.00 -1.35 0.00 0.00 41.12 42.39 1j9s n ASP 53 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 1j9s n ASP 54 N -1.84 0.48 -1.11 -1.12 5.68 -1.26 -3.35 116.55 114.04 1j9s n ASP 54 Ca 0.01 -1.24 0.08 0.00 -0.50 0.00 0.00 54.79 53.14 1j9s n ASP 54 Cb 0.40 -0.01 0.27 0.00 -1.14 0.00 0.00 41.12 40.64 1j9s n ASP 54 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1j9s n ALA 55 N -0.58 2.63 -1.28 2.12 0.00 -1.26 -4.95 120.51 117.18 1j9s n ALA 55 Ca 0.21 -1.50 -0.07 0.00 0.00 0.00 0.00 53.44 52.07 1j9s n ALA 55 Cb 0.18 -0.75 -0.03 0.00 0.00 0.00 0.00 19.45 18.85 1j9s n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j9s n GLY 56 N 0.75 0.88 3.72 0.00 0.00 -1.21 -4.98 105.19 104.34 1j9s n GLY 56 Ca 0.20 -0.71 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 1j9s n GLY 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j9s s THR 57 N -2.28 2.68 0.11 2.61 2.01 -1.26 -4.89 115.64 114.62 1j9s s THR 57 Ca 0.00 0.47 0.03 0.00 0.31 0.00 0.00 61.69 62.50 1j9s s THR 57 Cb 0.00 -3.30 -0.04 0.00 0.01 0.00 0.00 72.50 69.17 1j9s s THR 57 CO 0.00 0.03 0.12 -1.61 -0.69 0.00 0.00 174.62 172.47 1j9s s GLU 58 N 1.26 2.96 -0.00 4.92 2.02 -1.26 -1.18 118.70 127.42 1j9s s GLU 58 Ca 0.70 -0.72 -0.00 0.00 0.02 0.00 0.00 54.97 54.97 1j9s s GLU 58 Cb -0.43 -2.74 0.00 0.00 0.10 0.00 0.00 34.13 31.06 1j9s s GLU 58 CO 0.31 0.54 0.01 0.08 0.02 0.00 0.00 175.26 176.22 1j9s s VAL 59 N -1.52 -0.00 -0.83 2.63 1.01 -0.70 -4.96 120.40 116.02 1j9s s VAL 59 Ca 0.30 0.00 -0.22 0.00 0.00 0.00 0.00 61.98 62.07 1j9s s VAL 59 Cb -0.12 -0.02 0.08 0.00 0.00 0.00 0.00 36.38 36.32 1j9s s VAL 59 CO 0.23 0.00 1.16 -1.00 0.00 0.00 0.00 175.10 175.49 1j9s s HIS 60 N 0.03 2.73 0.50 5.22 3.76 -1.26 -1.77 115.29 124.50 1j9s s HIS 60 Ca -0.00 -0.81 -0.19 0.00 -0.15 0.00 0.00 55.06 53.90 1j9s s HIS 60 Cb -0.00 -4.42 -0.08 0.00 1.11 0.00 0.00 32.58 29.19 1j9s s HIS 60 CO -0.00 -1.72 1.04 0.00 -0.85 0.00 0.00 174.74 173.21 1j9s s ALA 61 N 4.03 2.86 -0.42 -1.40 0.00 0.14 -4.83 121.76 122.14 1j9s s ALA 61 Ca 0.32 0.55 0.03 0.00 0.00 0.00 0.00 51.96 52.86 1j9s s ALA 61 Cb -0.08 -3.24 0.12 0.00 0.00 0.00 0.00 23.12 19.91 1j9s s ALA 61 CO 0.00 -0.37 0.17 -1.64 0.00 0.00 0.00 175.76 173.92 1j9s s MET 62 N -3.40 1.56 -0.24 0.00 -1.94 -0.83 -0.73 119.30 113.72 1j9s s MET 62 Ca 0.66 -2.11 -0.06 0.00 -1.71 0.00 0.00 55.69 52.47 1j9s s MET 62 Cb -0.16 -2.98 -0.02 0.00 2.01 0.00 0.00 34.83 33.68 1j9s s MET 62 CO 0.23 -1.05 0.04 0.00 -0.01 0.00 0.00 175.02 174.23 1j9s s ALA 63 N 0.41 3.09 0.08 3.03 0.00 -0.32 -2.51 121.76 125.56 1j9s s ALA 63 Ca 0.14 -1.11 -0.31 0.00 0.00 0.00 0.00 51.96 50.69 1j9s s ALA 63 Cb -0.22 -1.98 -0.08 0.00 0.00 0.00 0.00 23.12 20.84 1j9s s ALA 63 CO -0.05 -0.42 1.49 -0.06 0.00 0.00 0.00 175.76 176.72 1j9s s PHE 64 N 1.49 2.90 -1.94 0.00 0.08 -1.25 -1.17 117.98 118.10 1j9s s PHE 64 Ca 0.06 0.70 0.00 0.00 0.12 0.00 0.00 56.93 57.81 1j9s s PHE 64 Cb -0.15 -3.79 0.00 0.00 -0.57 0.00 0.00 43.02 38.51 1j9s s PHE 64 CO 0.02 -2.95 0.00 -1.71 -0.10 0.00 0.00 175.22 170.48 1j9s n ASN 65 N 4.74 -5.31 0.00 1.36 5.15 0.18 -2.55 115.26 118.83 1j9s n ASN 65 Ca 0.13 0.38 0.00 0.00 -0.60 0.00 0.00 54.58 54.50 1j9s n ASN 65 Cb 0.42 -4.45 0.00 0.00 -0.53 0.00 0.00 39.78 35.22 1j9s n ASN 65 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1j9s n GLY 66 N -0.72 0.72 3.31 8.20 0.00 -0.89 -4.94 105.19 110.87 1j9s n GLY 66 Ca -0.19 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.61 1j9s n GLY 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j9s s THR 67 N -3.06 1.73 -0.23 2.61 -4.23 -1.06 -4.94 115.64 106.47 1j9s s THR 67 Ca 0.00 -1.83 0.02 0.00 -1.18 0.00 0.00 61.69 58.70 1j9s s THR 67 Cb 0.00 -1.75 0.05 0.00 1.34 0.00 0.00 72.50 72.14 1j9s s THR 67 CO 0.00 -0.29 -0.12 -0.69 -0.54 0.00 0.00 174.62 172.98 1j9s s VAL 68 N -1.91 2.02 1.00 2.29 1.01 -1.26 -2.95 120.40 120.59 1j9s s VAL 68 Ca 0.13 -1.36 -0.14 0.00 0.00 0.00 0.00 61.98 60.62 1j9s s VAL 68 Cb -0.06 -2.06 0.19 0.00 0.00 0.00 0.00 36.38 34.44 1j9s s VAL 68 CO 0.06 0.12 1.14 -2.16 0.00 0.00 0.00 175.10 174.25 1j9s s PRO 69 N 1.21 0.44 0.88 2.72 0.04 -1.26 -1.80 135.00 137.24 1j9s s PRO 69 Ca -0.04 0.22 -0.11 0.00 0.04 0.00 0.00 61.00 61.10 1j9s s PRO 69 Cb -0.18 -1.76 0.12 0.00 0.04 0.00 0.00 34.50 32.72 1j9s s PRO 69 CO -0.07 -2.66 1.09 0.20 0.04 0.00 0.00 177.00 175.60 1j9s s GLY 70 N -3.92 1.63 0.73 0.56 0.00 0.60 -4.76 107.32 102.16 1j9s s GLY 70 Ca 0.66 -0.00 -0.13 0.00 0.00 0.00 0.00 44.72 45.25 1j9s s GLY 70 CO 0.55 0.47 1.12 2.56 0.00 0.00 0.00 173.10 177.79 1j9s s PRO 71 N -4.92 2.36 -0.08 2.90 0.04 -1.26 -4.44 135.00 129.60 1j9s s PRO 71 Ca 0.63 1.37 -0.28 0.00 0.04 0.00 0.00 61.00 62.76 1j9s s PRO 71 Cb -0.18 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 1j9s s PRO 71 CO 0.57 -1.59 0.91 -1.17 0.04 0.00 0.00 177.00 175.76 1j9s s LEU 72 N -5.45 4.28 -0.14 -3.56 2.96 -1.26 -4.29 118.68 111.22 1j9s s LEU 72 Ca 0.66 1.43 -0.05 0.00 -0.22 0.00 0.00 54.13 55.94 1j9s s LEU 72 Cb -0.20 -3.40 -0.04 0.00 0.50 0.00 0.00 46.19 43.05 1j9s s LEU 72 CO 0.49 -0.33 0.04 -0.04 -1.32 0.00 0.00 176.35 175.19 1j9s s MET 73 N 1.55 3.59 -0.10 1.98 -1.94 -1.14 -4.59 119.30 118.65 1j9s s MET 73 Ca 0.45 -0.37 0.03 0.00 -1.71 0.00 0.00 55.69 54.09 1j9s s MET 73 Cb -0.19 -3.04 0.01 0.00 2.01 0.00 0.00 34.83 33.62 1j9s s MET 73 CO 0.19 0.44 -0.21 0.08 -0.01 0.00 0.00 175.02 175.52 1j9s s VAL 74 N -0.13 1.88 0.34 -6.03 1.01 -1.26 0.01 120.40 116.21 1j9s s VAL 74 Ca 0.06 -0.90 0.05 0.00 0.00 0.00 0.00 61.98 61.19 1j9s s VAL 74 Cb -0.12 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 1j9s s VAL 74 CO 0.02 0.52 0.33 0.68 0.00 0.00 0.00 175.10 176.64 1j9s s VAL 75 N 0.55 0.00 0.25 2.92 -7.23 -0.54 -4.98 120.40 111.37 1j9s s VAL 75 Ca -0.15 -1.91 0.10 0.00 -1.81 0.00 0.00 61.98 58.21 1j9s s VAL 75 Cb -0.17 -2.54 -0.04 0.00 0.56 0.00 0.00 36.38 34.19 1j9s s VAL 75 CO 0.05 0.00 -0.07 -1.00 -0.31 0.00 0.00 175.10 173.77 1j9s s HIS 76 N -3.32 2.60 0.18 2.82 3.76 -1.26 -0.97 115.29 119.09 1j9s s HIS 76 Ca 0.39 -0.24 -0.33 0.00 -0.15 0.00 0.00 55.06 54.72 1j9s s HIS 76 Cb 0.02 -1.17 -0.14 0.00 1.11 0.00 0.00 32.58 32.39 1j9s s HIS 76 CO 0.27 0.61 1.46 0.94 -0.85 0.00 0.00 174.74 177.17 1j9s n GLN 77 N -0.61 1.91 -0.99 1.40 7.27 0.18 -1.53 117.38 125.01 1j9s n GLN 77 Ca -0.07 0.69 0.00 0.00 0.07 0.00 0.00 57.00 57.68 1j9s n GLN 77 Cb 0.58 -2.38 0.00 0.00 2.41 0.00 0.00 30.24 30.85 1j9s n GLN 77 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1j9s n ASP 78 N 2.79 -2.25 -4.75 1.69 10.43 0.69 -4.72 116.55 120.43 1j9s n ASP 78 Ca 0.15 0.00 -0.28 0.00 2.57 0.00 0.00 54.79 57.24 1j9s n ASP 78 Cb 0.28 -0.58 0.10 0.00 1.84 0.00 0.00 41.12 42.76 1j9s n ASP 78 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 1j9s s ASP 79 N -2.28 4.34 -0.02 -2.24 -0.00 -0.58 -4.66 116.67 111.23 1j9s s ASP 79 Ca 0.00 0.50 0.05 0.00 -0.00 0.00 0.00 52.55 53.11 1j9s s ASP 79 Cb 0.00 -0.96 -0.03 0.00 -0.00 0.00 0.00 42.92 41.93 1j9s s ASP 79 CO 0.00 -1.95 -0.17 -0.31 -0.00 0.00 0.00 175.17 172.74 1j9s s TYR 80 N -3.50 2.62 -0.25 4.23 1.51 -0.26 -1.43 117.35 120.27 1j9s s TYR 80 Ca 0.64 -0.22 -0.07 0.00 -1.01 0.00 0.00 57.07 56.40 1j9s s TYR 80 Cb -0.09 -1.57 -0.03 0.00 -0.11 0.00 0.00 41.96 40.16 1j9s s TYR 80 CO 0.48 0.18 0.08 -1.17 -1.11 0.00 0.00 175.55 174.00 1j9s s LEU 81 N -0.92 3.48 -0.32 -1.29 0.20 0.28 -0.84 118.68 119.27 1j9s s LEU 81 Ca 0.12 -0.22 -0.01 0.00 0.69 0.00 0.00 54.13 54.71 1j9s s LEU 81 Cb -0.10 -1.93 0.07 0.00 -0.43 0.00 0.00 46.19 43.79 1j9s s LEU 81 CO 0.02 -0.04 0.02 -0.70 -0.29 0.00 0.00 176.35 175.36 1j9s s GLU 82 N 1.62 2.22 -0.20 1.98 2.12 -0.05 -1.89 118.70 124.51 1j9s s GLU 82 Ca 0.06 -1.44 -0.07 0.00 0.36 0.00 0.00 54.97 53.88 1j9s s GLU 82 Cb -0.15 -3.21 -0.04 0.00 0.26 0.00 0.00 34.13 30.99 1j9s s GLU 82 CO 0.04 -0.72 0.06 -1.17 -0.54 0.00 0.00 175.26 172.93 1j9s s LEU 83 N 1.17 3.74 -0.38 2.70 0.20 0.59 -1.88 118.68 124.82 1j9s s LEU 83 Ca -0.02 0.02 -0.16 0.00 0.69 0.00 0.00 54.13 54.66 1j9s s LEU 83 Cb -0.20 -1.96 0.00 0.00 -0.43 0.00 0.00 46.19 43.60 1j9s s LEU 83 CO -0.03 0.13 0.39 -0.89 -0.29 0.00 0.00 176.35 175.66 1j9s s THR 84 N 0.63 5.14 -0.17 3.68 2.01 0.38 -1.36 115.64 125.94 1j9s s THR 84 Ca 0.03 -0.15 -0.05 0.00 0.31 0.00 0.00 61.69 61.83 1j9s s THR 84 Cb -0.13 -3.92 -0.03 0.00 0.01 0.00 0.00 72.50 68.43 1j9s s THR 84 CO 0.01 -0.24 0.01 -0.22 -0.69 0.00 0.00 174.62 173.49 1j9s s LEU 85 N 2.06 3.48 -0.08 4.42 2.96 0.24 -1.46 118.68 130.31 1j9s s LEU 85 Ca 0.12 -0.05 0.05 0.00 -0.22 0.00 0.00 54.13 54.02 1j9s s LEU 85 Cb -0.17 -1.86 -0.01 0.00 0.50 0.00 0.00 46.19 44.65 1j9s s LEU 85 CO 0.12 0.15 -0.25 -0.63 -1.32 0.00 0.00 176.35 174.43 1j9s s ILE 86 N 0.47 2.06 -0.42 6.68 1.01 -0.28 -1.45 121.20 129.27 1j9s s ILE 86 Ca -0.00 -1.04 0.03 0.00 0.00 0.00 0.00 60.65 59.64 1j9s s ILE 86 Cb -0.14 -1.76 0.12 0.00 0.01 0.00 0.00 42.46 40.69 1j9s s ILE 86 CO 0.02 0.57 0.16 0.21 0.00 0.00 0.00 174.94 175.90 1j9s s ASN 87 N 0.07 4.38 0.60 3.58 2.47 -0.48 -0.35 114.94 125.21 1j9s s ASN 87 Ca -0.11 -2.51 -0.18 0.00 0.42 0.00 0.00 52.86 50.48 1j9s s ASN 87 Cb -0.16 -1.49 -0.05 0.00 -1.45 0.00 0.00 41.25 38.11 1j9s s ASN 87 CO 0.06 -0.31 0.91 -2.65 -3.72 0.00 0.00 177.10 171.39 1j9s n PRO 88 N 3.76 0.84 0.27 0.43 -0.02 -1.26 0.76 135.00 139.77 1j9s n PRO 88 Ca 0.04 0.33 0.18 0.00 -2.02 0.00 0.00 63.50 62.03 1j9s n PRO 88 Cb 0.37 -2.11 0.91 0.00 -0.02 0.00 0.00 33.50 32.65 1j9s n PRO 88 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1j9s h GLU 89 N 0.43 0.00 0.00 -0.52 4.11 -1.90 -0.56 114.58 116.14 1j9s h GLU 89 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 1j9s h GLU 89 Cb 1.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1j9s h GLU 89 CO 0.50 0.00 0.00 0.25 0.07 0.00 0.00 179.01 179.83 1j9s n THR 90 N -2.79 0.65 -2.26 -1.06 -2.24 -1.26 -4.76 114.28 100.56 1j9s n THR 90 Ca -0.02 0.09 -0.27 0.00 -2.27 0.00 0.00 64.05 61.58 1j9s n THR 90 Cb 0.11 -0.85 0.04 0.00 -2.10 0.00 0.00 70.33 67.53 1j9s n THR 90 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1j9s s ASN 91 N -3.60 5.39 -0.01 3.42 0.01 -0.22 -5.02 114.94 114.91 1j9s s ASN 91 Ca 0.09 0.73 0.07 0.00 -0.71 0.00 0.00 52.86 53.03 1j9s s ASN 91 Cb 0.12 -1.61 -0.09 0.00 0.41 0.00 0.00 41.25 40.08 1j9s s ASN 91 CO 0.42 -1.24 0.20 0.35 -1.51 0.00 0.00 177.10 175.32 1j9s n THR 92 N -2.74 0.00 -4.29 1.60 -2.24 -1.26 -4.74 114.28 100.62 1j9s n THR 92 Ca 0.06 -0.23 -0.27 0.00 -2.27 0.00 0.00 64.05 61.34 1j9s n THR 92 Cb 0.58 0.60 -0.09 0.00 -2.10 0.00 0.00 70.33 69.32 1j9s n THR 92 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1j9s s LEU 93 N -3.01 2.99 0.36 3.22 1.43 -1.26 -4.90 118.68 117.51 1j9s s LEU 93 Ca -0.01 -0.58 -0.24 0.00 -1.03 0.00 0.00 54.13 52.27 1j9s s LEU 93 Cb 0.05 -1.66 -0.10 0.00 0.03 0.00 0.00 46.19 44.50 1j9s s LEU 93 CO 0.27 0.10 0.95 -0.32 0.23 0.00 0.00 176.35 177.58 1j9s s MET 94 N -2.87 4.44 0.15 1.70 -2.45 -1.26 -4.24 119.30 114.78 1j9s s MET 94 Ca 0.25 1.27 -0.01 0.00 -1.25 0.00 0.00 55.69 55.96 1j9s s MET 94 Cb -0.09 -2.58 -0.04 0.00 1.25 0.00 0.00 34.83 33.37 1j9s s MET 94 CO 0.15 0.15 0.07 -1.01 1.05 0.00 0.00 175.02 175.43 1j9s s HIS 95 N -1.80 0.98 0.00 4.11 0.09 -0.58 -4.92 115.29 113.16 1j9s s HIS 95 Ca 0.55 -1.24 0.00 0.00 -0.00 0.00 0.00 55.06 54.36 1j9s s HIS 95 Cb -0.16 -0.53 0.00 0.00 -0.00 0.00 0.00 32.58 31.89 1j9s s HIS 95 CO 0.20 -0.51 0.00 0.27 -0.00 0.00 0.00 174.74 174.71 1j9s n ASN 96 N -0.15 0.00 -3.72 1.40 6.94 -1.26 -0.24 115.26 118.22 1j9s n ASN 96 Ca -0.04 -0.86 -0.12 0.00 -0.02 0.00 0.00 54.58 53.54 1j9s n ASN 96 Cb 0.64 0.00 -0.11 0.00 -2.36 0.00 0.00 39.78 37.95 1j9s n ASN 96 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 1j9s s ILE 97 N -2.83 -0.02 -0.19 1.53 2.07 -1.26 -4.16 121.20 116.35 1j9s s ILE 97 Ca 0.00 0.06 -0.02 0.00 -1.41 0.00 0.00 60.65 59.28 1j9s s ILE 97 Cb 0.00 -0.53 -0.00 0.00 0.13 0.00 0.00 42.46 42.05 1j9s s ILE 97 CO 0.00 0.02 -0.10 -0.62 -1.91 0.00 0.00 174.94 172.33 1j9s s ASP 98 N 0.84 3.96 -0.36 4.50 2.15 0.11 -1.48 116.67 126.39 1j9s s ASP 98 Ca -0.05 -0.43 -0.12 0.00 0.43 0.00 0.00 52.55 52.37 1j9s s ASP 98 Cb -0.06 -1.65 0.01 0.00 -0.30 0.00 0.00 42.92 40.92 1j9s s ASP 98 CO -0.06 0.04 0.23 -0.36 -0.17 0.00 0.00 175.17 174.85 1j9s s PHE 99 N 1.12 3.22 0.36 -5.34 0.40 0.88 -1.29 117.98 117.34 1j9s s PHE 99 Ca 0.01 -0.56 0.38 0.00 -0.60 0.00 0.00 56.93 56.16 1j9s s PHE 99 Cb -0.14 -2.47 1.94 0.00 0.51 0.00 0.00 43.02 42.85 1j9s s PHE 99 CO -0.03 -0.51 2.16 0.45 0.70 0.00 0.00 175.22 177.99 1j9s h HIS 100 N 8.49 0.00 0.00 0.36 3.86 -1.55 -1.58 115.15 124.72 1j9s h HIS 100 Ca -0.29 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 58.89 1j9s h HIS 100 Cb 1.13 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.60 1j9s h HIS 100 CO 0.61 0.00 -0.14 0.00 0.86 0.00 0.00 177.93 179.25 1j9s h ALA 101 N 2.01 0.94 -2.24 2.45 0.00 -1.90 -3.47 119.26 117.06 1j9s h ALA 101 Ca 0.00 -0.13 -0.46 0.00 0.00 0.00 0.00 54.91 54.32 1j9s h ALA 101 Cb 0.17 -0.02 0.09 0.00 0.00 0.00 0.00 17.79 18.03 1j9s h ALA 101 CO 0.00 0.18 0.27 0.00 0.00 0.00 0.00 179.25 179.70 1j9s s ALA 102 N -3.37 3.02 -0.11 0.00 0.00 -0.60 -4.61 121.76 116.10 1j9s s ALA 102 Ca 0.04 -0.98 -0.01 0.00 0.00 0.00 0.00 51.96 51.01 1j9s s ALA 102 Cb 0.08 -2.62 0.03 0.00 0.00 0.00 0.00 23.12 20.60 1j9s s ALA 102 CO 0.65 -1.50 -0.05 0.99 0.00 0.00 0.00 175.76 175.85 1j9s s THR 103 N -3.36 0.81 0.00 0.00 2.01 -1.26 -4.77 115.64 109.07 1j9s s THR 103 Ca 0.62 -0.20 0.00 0.00 0.31 0.00 0.00 61.69 62.42 1j9s s THR 103 Cb -0.10 -0.91 0.00 0.00 0.01 0.00 0.00 72.50 71.51 1j9s s THR 103 CO 0.46 0.29 0.00 0.61 -0.69 0.00 0.00 174.62 175.29 1j9s n GLY 104 N 5.00 2.89 4.15 4.40 0.00 -1.26 -4.93 105.19 115.44 1j9s n GLY 104 Ca -0.11 -1.85 -0.31 0.00 0.00 0.00 0.00 46.02 43.76 1j9s n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9s n ALA 105 N 0.16 -2.10 -2.93 4.61 0.00 -1.26 -0.61 120.51 118.38 1j9s n ALA 105 Ca 0.00 -0.38 -0.22 0.00 0.00 0.00 0.00 53.44 52.84 1j9s n ALA 105 Cb 0.00 -1.33 0.02 0.00 0.00 0.00 0.00 19.45 18.13 1j9s n ALA 105 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1j9s n LEU 106 N -4.56 -2.27 0.00 0.00 4.77 -1.26 -0.79 117.00 112.88 1j9s n LEU 106 Ca -0.29 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.46 1j9s n LEU 106 Cb 0.68 -2.78 0.00 0.00 -2.33 0.00 0.00 43.42 38.99 1j9s n LEU 106 CO 0.80 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 1j9s n GLY 107 N -1.33 0.69 0.00 -0.72 0.00 0.21 -3.45 105.19 100.59 1j9s n GLY 107 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1j9s n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j9s n GLY 108 N -2.59 1.70 0.36 -0.02 0.00 0.02 -0.08 105.19 104.58 1j9s n GLY 108 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1j9s n GLY 108 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1j9s h GLY 109 N 0.00 1.15 2.00 -0.02 0.00 -0.91 -1.63 103.07 103.67 1j9s h GLY 109 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.95 1j9s h GLY 109 CO 0.00 0.30 0.00 0.61 0.00 0.00 0.00 176.54 177.45 1j9s n GLY 110 N -1.42 -1.12 0.18 4.60 0.00 -0.96 -2.93 105.19 103.55 1j9s n GLY 110 Ca 0.12 0.03 0.04 0.00 0.00 0.00 0.00 46.02 46.21 1j9s n GLY 110 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1j9s n LEU 111 N -1.92 1.11 -0.21 0.99 4.77 -0.66 -4.72 117.00 116.36 1j9s n LEU 111 Ca 0.02 -0.79 0.09 0.00 -0.03 0.00 0.00 56.01 55.30 1j9s n LEU 111 Cb 0.19 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.43 1j9s n LEU 111 CO 0.16 0.23 0.51 0.35 -1.33 0.00 0.00 177.39 177.31 1j9s n THR 112 N -0.22 1.92 -2.11 -5.08 -2.24 -0.93 -4.95 114.28 100.67 1j9s n THR 112 Ca 0.03 -2.45 -0.43 0.00 -2.27 0.00 0.00 64.05 58.93 1j9s n THR 112 Cb 0.16 -0.22 -0.02 0.00 -2.10 0.00 0.00 70.33 68.14 1j9s n THR 112 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1j9s s GLU 113 N -2.90 3.44 -0.09 -0.78 2.02 -1.25 -4.12 118.70 115.02 1j9s s GLU 113 Ca 0.33 1.29 0.03 0.00 0.02 0.00 0.00 54.97 56.64 1j9s s GLU 113 Cb 0.30 -4.14 0.01 0.00 0.10 0.00 0.00 34.13 30.40 1j9s s GLU 113 CO 0.01 -1.73 -0.18 0.96 0.02 0.00 0.00 175.26 174.33 1j9s s ILE 114 N 6.34 1.65 0.70 -1.63 -4.36 0.67 -4.96 121.20 119.61 1j9s s ILE 114 Ca 0.74 -0.77 -0.10 0.00 -0.26 0.00 0.00 60.65 60.26 1j9s s ILE 114 Cb -0.20 -1.46 0.03 0.00 1.25 0.00 0.00 42.46 42.08 1j9s s ILE 114 CO 0.33 0.47 1.06 0.20 0.24 0.00 0.00 174.94 177.24 1j9s s ASN 115 N 0.59 5.18 0.32 4.36 0.02 -1.26 -1.53 114.94 122.61 1j9s s ASN 115 Ca -0.15 0.85 -0.29 0.00 -1.02 0.00 0.00 52.86 52.25 1j9s s ASN 115 Cb -0.17 -1.61 -0.12 0.00 0.02 0.00 0.00 41.25 39.38 1j9s s ASN 115 CO 0.05 -1.44 1.49 -2.65 0.02 0.00 0.00 177.10 174.57 1j9s n PRO 116 N -2.96 2.51 -0.23 -0.60 -0.02 -1.26 -1.40 135.00 131.04 1j9s n PRO 116 Ca 0.07 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 1j9s n PRO 116 Cb 0.59 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 1j9s n PRO 116 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1j9s n GLY 117 N 1.43 0.66 3.42 -1.23 0.00 0.23 -4.70 105.19 105.00 1j9s n GLY 117 Ca 0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.86 1j9s n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j9s s GLU 118 N -0.77 1.53 0.12 1.61 2.02 -0.49 -4.89 118.70 117.83 1j9s s GLU 118 Ca 0.00 -1.69 -0.01 0.00 0.02 0.00 0.00 54.97 53.29 1j9s s GLU 118 Cb 0.00 -1.49 -0.04 0.00 0.10 0.00 0.00 34.13 32.70 1j9s s GLU 118 CO 0.00 0.27 0.04 -1.59 0.02 0.00 0.00 175.26 174.00 1j9s s LYS 119 N -3.56 0.88 0.11 1.61 -2.85 -1.26 -1.38 119.74 113.29 1j9s s LYS 119 Ca 0.27 -1.41 -0.16 0.00 -1.00 0.00 0.00 55.97 53.67 1j9s s LYS 119 Cb -0.03 0.21 0.03 0.00 -2.06 0.00 0.00 37.83 35.98 1j9s s LYS 119 CO 0.11 -0.23 0.39 -0.08 0.10 0.00 0.00 175.35 175.65 1j9s s THR 120 N -4.01 0.07 -0.11 3.79 -1.32 -0.53 -5.00 115.64 108.54 1j9s s THR 120 Ca 0.21 -0.58 -0.00 0.00 -1.21 0.00 0.00 61.69 60.11 1j9s s THR 120 Cb 0.07 -1.13 0.02 0.00 -1.51 0.00 0.00 72.50 69.96 1j9s s THR 120 CO -0.00 -0.32 -0.07 -0.63 -2.21 0.00 0.00 174.62 171.39 1j9s s ILE 121 N -3.54 0.99 -0.08 5.08 1.01 -1.26 -0.59 121.20 122.81 1j9s s ILE 121 Ca 0.01 -0.27 0.02 0.00 0.00 0.00 0.00 60.65 60.41 1j9s s ILE 121 Cb 0.01 -1.01 -0.02 0.00 0.01 0.00 0.00 42.46 41.45 1j9s s ILE 121 CO -0.10 0.36 -0.13 -0.22 0.00 0.00 0.00 174.94 174.86 1j9s s LEU 122 N 1.68 2.81 -0.04 2.97 2.96 -0.47 -4.96 118.68 123.63 1j9s s LEU 122 Ca 0.04 -0.21 0.05 0.00 -0.22 0.00 0.00 54.13 53.79 1j9s s LEU 122 Cb -0.13 -1.60 -0.00 0.00 0.50 0.00 0.00 46.19 44.96 1j9s s LEU 122 CO -0.08 0.29 -0.18 -0.60 -1.32 0.00 0.00 176.35 174.46 1j9s s ARG 123 N -0.38 1.82 0.01 1.98 3.52 -1.26 -0.30 118.95 124.34 1j9s s ARG 123 Ca 0.04 -0.64 -0.08 0.00 -0.13 0.00 0.00 55.73 54.92 1j9s s ARG 123 Cb -0.12 -1.60 0.00 0.00 -1.56 0.00 0.00 34.95 31.67 1j9s s ARG 123 CO 0.02 0.27 0.16 -0.59 -0.81 0.00 0.00 175.30 174.35 1j9s s PHE 124 N -0.02 0.05 -0.18 5.12 -0.12 -0.79 -4.98 117.98 117.05 1j9s s PHE 124 Ca -0.03 -0.17 -0.21 0.00 -0.05 0.00 0.00 56.93 56.47 1j9s s PHE 124 Cb -0.11 -0.04 -0.03 0.00 -0.63 0.00 0.00 43.02 42.21 1j9s s PHE 124 CO 0.02 -0.33 0.61 0.21 -0.05 0.00 0.00 175.22 175.68 1j9s s LYS 125 N -1.76 4.24 -1.31 1.99 2.20 -1.26 -0.55 119.74 123.28 1j9s s LYS 125 Ca -0.12 0.61 -0.18 0.00 -0.36 0.00 0.00 55.97 55.93 1j9s s LYS 125 Cb -0.05 -3.55 0.07 0.00 -1.51 0.00 0.00 37.83 32.78 1j9s s LYS 125 CO 0.00 -0.17 1.78 0.00 -0.36 0.00 0.00 175.35 176.60 1j9s n ALA 126 N 4.80 3.72 0.24 3.13 0.00 -0.52 -4.77 120.51 127.11 1j9s n ALA 126 Ca -0.02 -3.86 0.14 0.00 0.00 0.00 0.00 53.44 49.70 1j9s n ALA 126 Cb 0.50 -3.60 0.35 0.00 0.00 0.00 0.00 19.45 16.70 1j9s n ALA 126 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1j9s h THR 127 N 5.43 0.02 -3.33 0.00 1.35 -1.85 0.20 112.91 114.73 1j9s h THR 127 Ca 0.46 -0.86 -0.67 0.00 -0.55 0.00 0.00 66.41 64.80 1j9s h THR 127 Cb 0.85 1.84 -0.30 0.00 -1.73 0.00 0.00 68.15 68.81 1j9s h THR 127 CO 1.50 0.01 -0.82 -0.54 -0.25 0.00 0.00 175.52 175.42 1j9s s LYS 128 N -3.37 3.24 0.12 4.72 1.02 -1.26 -4.76 119.74 119.45 1j9s s LYS 128 Ca 0.05 -0.77 -0.30 0.00 0.02 0.00 0.00 55.97 54.97 1j9s s LYS 128 Cb 0.06 -2.49 -0.06 0.00 -0.52 0.00 0.00 37.83 34.83 1j9s s LYS 128 CO 0.63 0.20 0.94 -1.25 -0.92 0.00 0.00 175.35 174.94 1j9s s PRO 129 N 0.35 4.70 0.00 -1.68 0.04 -1.26 -4.79 135.00 132.36 1j9s s PRO 129 Ca -0.14 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.32 1j9s s PRO 129 Cb -0.17 -3.36 0.00 0.00 0.04 0.00 0.00 34.50 31.01 1j9s s PRO 129 CO 0.07 0.26 0.00 0.41 0.04 0.00 0.00 177.00 177.78 1j9s n GLY 130 N 2.15 -0.70 3.78 0.56 0.00 0.48 -2.06 105.19 109.40 1j9s n GLY 130 Ca 0.01 -1.57 -0.36 0.00 0.00 0.00 0.00 46.02 44.11 1j9s n GLY 130 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j9s s VAL 131 N -2.11 5.07 0.03 1.61 -7.23 0.10 0.26 120.40 118.14 1j9s s VAL 131 Ca 0.00 0.05 0.02 0.00 -1.81 0.00 0.00 61.98 60.24 1j9s s VAL 131 Cb 0.00 -3.21 -0.02 0.00 0.56 0.00 0.00 36.38 33.71 1j9s s VAL 131 CO 0.00 0.58 -0.07 -0.36 -0.31 0.00 0.00 175.10 174.94 1j9s s PHE 132 N -0.66 0.59 0.43 2.82 0.08 -0.48 -4.48 117.98 116.28 1j9s s PHE 132 Ca 0.12 -0.46 -0.21 0.00 0.12 0.00 0.00 56.93 56.50 1j9s s PHE 132 Cb -0.12 -0.36 -0.10 0.00 -0.57 0.00 0.00 43.02 41.87 1j9s s PHE 132 CO 0.02 -0.09 0.97 0.08 -0.10 0.00 0.00 175.22 176.10 1j9s s VAL 133 N -1.25 4.23 0.04 -0.44 1.01 -1.26 -0.66 120.40 122.07 1j9s s VAL 133 Ca -0.10 1.44 0.04 0.00 0.00 0.00 0.00 61.98 63.36 1j9s s VAL 133 Cb -0.09 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.66 1j9s s VAL 133 CO 0.00 -0.26 -0.11 -0.72 0.00 0.00 0.00 175.10 174.01 1j9s s TYR 134 N -2.08 1.00 0.07 5.22 -0.85 -0.74 -1.49 117.35 118.48 1j9s s TYR 134 Ca 0.62 -0.38 -0.26 0.00 -0.52 0.00 0.00 57.07 56.53 1j9s s TYR 134 Cb -0.12 -0.59 0.09 0.00 0.38 0.00 0.00 41.96 41.72 1j9s s TYR 134 CO 0.16 0.00 0.75 -3.38 -1.52 0.00 0.00 175.55 171.57 1j9s s HIS 135 N -0.99 -0.44 0.46 -3.49 -3.43 -0.41 -0.83 115.29 106.15 1j9s s HIS 135 Ca -0.02 0.28 -0.21 0.00 -0.80 0.00 0.00 55.06 54.31 1j9s s HIS 135 Cb -0.08 0.55 -0.09 0.00 -1.43 0.00 0.00 32.58 31.53 1j9s s HIS 135 CO 0.01 -0.68 1.04 0.00 -2.00 0.00 0.00 174.74 173.10 1j9s n ALA 137 N -0.69 -0.84 -2.30 0.00 0.00 -1.26 -4.46 120.51 110.95 1j9s n ALA 137 Ca 0.08 -1.68 -0.42 0.00 0.00 0.00 0.00 53.44 51.41 1j9s n ALA 137 Cb 0.52 -1.27 -0.03 0.00 0.00 0.00 0.00 19.45 18.67 1j9s n ALA 137 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1j9s s PRO 138 N 0.43 4.32 0.01 0.00 0.02 -1.26 -4.85 135.00 133.67 1j9s s PRO 138 Ca 0.32 1.87 -0.37 0.00 0.02 0.00 0.00 61.00 62.84 1j9s s PRO 138 Cb 0.20 -3.52 -0.16 0.00 0.02 0.00 0.00 34.50 31.03 1j9s s PRO 138 CO -0.21 -0.50 1.43 -2.30 -0.33 0.00 0.00 177.00 175.09 1j9s n PRO 139 N 5.07 1.14 0.00 5.54 -0.02 -1.26 -1.10 135.00 144.38 1j9s n PRO 139 Ca 0.12 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1j9s n PRO 139 Cb 0.45 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1j9s n PRO 139 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1j9s n GLY 140 N 2.88 3.34 1.51 -1.23 0.00 -1.26 -4.80 105.19 105.64 1j9s n GLY 140 Ca 0.20 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.25 1j9s n GLY 140 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1j9s n MET 141 N -2.00 0.49 0.40 1.61 2.81 -0.25 -4.96 117.12 115.21 1j9s n MET 141 Ca 0.00 -2.39 -0.19 0.00 -1.81 0.00 0.00 57.70 53.31 1j9s n MET 141 Cb 0.00 -0.45 -0.10 0.00 -0.71 0.00 0.00 33.22 31.96 1j9s n MET 141 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1j9s h VAL 142 N 5.87 0.06 -0.42 2.03 2.07 -1.79 -2.88 116.25 121.19 1j9s h VAL 142 Ca -0.17 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.38 1j9s h VAL 142 Cb 1.69 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1j9s h VAL 142 CO 0.11 0.00 0.28 1.55 0.02 0.00 0.00 177.57 179.53 1j9s h PRO 143 N -1.12 0.45 -0.61 1.57 0.13 -1.92 -2.28 132.00 128.21 1j9s h PRO 143 Ca -0.09 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 1j9s h PRO 143 Cb 0.91 -0.10 -0.03 0.00 0.13 0.00 0.00 31.00 31.91 1j9s h PRO 143 CO 0.08 0.30 0.38 2.35 -0.23 0.00 0.00 178.00 180.88 1j9s h TRP 144 N 0.46 0.79 -0.32 1.56 7.01 -1.93 0.15 115.95 123.67 1j9s h TRP 144 Ca 0.17 0.01 -0.10 0.00 2.11 0.00 0.00 58.89 61.08 1j9s h TRP 144 Cb 0.11 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 26.90 1j9s h TRP 144 CO -0.00 0.53 -0.19 0.45 -2.79 0.00 0.00 178.44 176.43 1j9s h HIS 145 N 0.83 0.81 -0.20 2.65 3.86 -1.24 -2.46 115.15 119.40 1j9s h HIS 145 Ca 0.22 -0.21 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1j9s h HIS 145 Cb -0.05 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.23 1j9s h HIS 145 CO -0.02 0.93 0.10 0.28 0.86 0.00 0.00 177.93 180.08 1j9s h VAL 146 N 0.46 1.11 0.00 2.45 2.07 -1.10 -2.10 116.25 119.15 1j9s h VAL 146 Ca 0.07 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1j9s h VAL 146 Cb 0.74 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1j9s h VAL 146 CO 0.05 0.11 0.00 1.33 0.02 0.00 0.00 177.57 179.08 1j9s n VAL 147 N -4.89 0.02 -0.16 2.57 0.24 0.48 -1.65 118.33 114.94 1j9s n VAL 147 Ca -0.04 0.00 0.08 0.00 -2.04 0.00 0.00 64.34 62.35 1j9s n VAL 147 Cb 0.08 -0.58 0.29 0.00 -1.47 0.00 0.00 33.84 32.16 1j9s n VAL 147 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1j9s n SER 148 N -1.03 3.85 0.00 -1.34 7.64 -0.84 -4.64 113.62 117.26 1j9s n SER 148 Ca 0.20 -2.27 0.00 0.00 1.01 0.00 0.00 58.87 57.81 1j9s n SER 148 Cb 0.11 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 1j9s n SER 148 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j9s n GLY 149 N 1.15 0.77 2.99 0.23 0.00 -0.66 -1.97 105.19 107.70 1j9s n GLY 149 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 1j9s n GLY 149 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1j9s n MET 150 N -2.44 3.55 -3.46 1.61 0.00 -0.91 -4.57 117.12 110.90 1j9s n MET 150 Ca 0.00 -3.57 -0.11 0.00 0.00 0.00 0.00 57.70 54.02 1j9s n MET 150 Cb 0.00 -2.96 -0.02 0.00 0.00 0.00 0.00 33.22 30.24 1j9s n MET 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1j9s s ASN 151 N 1.33 -0.52 0.00 6.12 2.20 -1.26 -1.65 114.94 121.15 1j9s s ASN 151 Ca 0.40 -0.05 0.00 0.00 -0.94 0.00 0.00 52.86 52.28 1j9s s ASN 151 Cb 0.07 0.58 0.00 0.00 -2.00 0.00 0.00 41.25 39.91 1j9s s ASN 151 CO 0.00 -0.96 0.00 0.61 -2.94 0.00 0.00 177.10 173.81 1j9s n GLY 152 N -0.37 3.13 3.50 0.45 0.00 -0.01 -0.29 105.19 111.60 1j9s n GLY 152 Ca -0.15 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.33 1j9s n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9s s ALA 153 N -1.00 -0.96 0.17 4.61 0.00 -1.26 -1.79 121.76 121.53 1j9s s ALA 153 Ca 0.00 -0.19 0.04 0.00 0.00 0.00 0.00 51.96 51.81 1j9s s ALA 153 Cb 0.00 0.84 -0.05 0.00 0.00 0.00 0.00 23.12 23.92 1j9s s ALA 153 CO 0.00 -0.79 -0.07 0.96 0.00 0.00 0.00 175.76 175.86 1j9s s ILE 154 N -3.86 1.08 -0.10 0.00 -4.36 0.17 -2.89 121.20 111.24 1j9s s ILE 154 Ca 0.09 -2.04 0.02 0.00 -0.26 0.00 0.00 60.65 58.45 1j9s s ILE 154 Cb -0.01 -1.98 0.01 0.00 1.25 0.00 0.00 42.46 41.73 1j9s s ILE 154 CO -0.04 -0.63 -0.16 -0.32 0.24 0.00 0.00 174.94 174.04 1j9s s MET 155 N -3.79 2.22 -0.46 0.37 -2.45 0.10 -1.39 119.30 113.90 1j9s s MET 155 Ca 0.20 -0.58 -0.05 0.00 -1.25 0.00 0.00 55.69 54.01 1j9s s MET 155 Cb 0.04 -1.84 0.12 0.00 1.25 0.00 0.00 34.83 34.40 1j9s s MET 155 CO 0.03 -0.00 0.29 0.08 1.05 0.00 0.00 175.02 176.46 1j9s s VAL 156 N 0.81 3.70 0.42 10.11 1.01 0.14 -1.47 120.40 135.12 1j9s s VAL 156 Ca -0.10 -2.08 -0.22 0.00 0.00 0.00 0.00 61.98 59.57 1j9s s VAL 156 Cb -0.16 -3.48 -0.10 0.00 0.00 0.00 0.00 36.38 32.65 1j9s s VAL 156 CO 0.01 -0.75 0.99 -0.76 0.00 0.00 0.00 175.10 174.60 1j9s s LEU 157 N 1.05 4.03 0.50 3.92 1.43 -0.15 -0.38 118.68 129.09 1j9s s LEU 157 Ca 0.09 1.85 -0.22 0.00 -1.03 0.00 0.00 54.13 54.82 1j9s s LEU 157 Cb -0.23 -4.37 -0.06 0.00 0.03 0.00 0.00 46.19 41.55 1j9s s LEU 157 CO -0.03 -0.44 1.20 -2.84 0.23 0.00 0.00 176.35 174.47 1j9s s PRO 158 N -2.84 3.50 0.55 1.29 0.02 -1.26 -0.65 135.00 135.62 1j9s s PRO 158 Ca 0.60 1.85 0.26 0.00 0.02 0.00 0.00 61.00 63.74 1j9s s PRO 158 Cb -0.15 -2.28 1.47 0.00 0.02 0.00 0.00 34.50 33.55 1j9s s PRO 158 CO 0.20 -0.78 2.01 0.00 -0.33 0.00 0.00 177.00 178.09 1j9s h ARG 159 N 1.71 0.00 -0.58 5.54 3.08 -1.88 0.16 114.38 122.40 1j9s h ARG 159 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.55 1j9s h ARG 159 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.31 1j9s h ARG 159 CO 0.59 0.00 0.00 -0.85 -1.07 0.00 0.00 179.97 178.64 1j9s n GLU 160 N -4.14 2.39 0.00 0.04 0.00 -1.26 -0.12 120.64 117.56 1j9s n GLU 160 Ca 0.07 -2.09 0.00 0.00 0.00 0.00 0.00 57.16 55.14 1j9s n GLU 160 Cb 0.53 -1.47 0.00 0.00 0.00 0.00 0.00 31.44 30.50 1j9s n GLU 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1j9s n GLY 161 N 1.39 -2.41 3.85 -1.84 0.00 0.55 -4.78 105.19 101.94 1j9s n GLY 161 Ca 0.19 -1.60 -0.32 0.00 0.00 0.00 0.00 46.02 44.29 1j9s n GLY 161 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1j9s s LEU 162 N 0.00 3.96 0.04 0.99 1.43 -1.26 -4.41 118.68 119.44 1j9s s LEU 162 Ca 0.00 1.37 -0.03 0.00 -1.03 0.00 0.00 54.13 54.44 1j9s s LEU 162 Cb 0.00 -4.21 -0.02 0.00 0.03 0.00 0.00 46.19 41.99 1j9s s LEU 162 CO 0.00 -0.30 0.03 -1.00 0.23 0.00 0.00 176.35 175.31 1j9s s HIS 163 N -2.15 0.32 0.41 0.29 3.76 -1.26 -1.33 115.29 115.34 1j9s s HIS 163 Ca 0.56 -0.72 -0.05 0.00 -0.15 0.00 0.00 55.06 54.70 1j9s s HIS 163 Cb -0.10 -0.24 0.09 0.00 1.11 0.00 0.00 32.58 33.45 1j9s s HIS 163 CO 0.20 -0.35 0.56 -0.40 -0.85 0.00 0.00 174.74 173.90 1j9s n ASP 164 N 0.63 0.30 0.23 1.40 3.85 0.24 -4.86 116.55 118.34 1j9s n ASP 164 Ca -0.18 -1.36 0.16 0.00 -0.71 0.00 0.00 54.79 52.70 1j9s n ASP 164 Cb 0.59 -0.40 0.76 0.00 -1.35 0.00 0.00 41.12 40.71 1j9s n ASP 164 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 1j9s h GLY 165 N -0.59 0.00 -2.42 6.12 0.00 -1.89 -2.05 103.07 102.23 1j9s h GLY 165 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1j9s h GLY 165 CO 0.15 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.97 1j9s n LYS 166 N -2.65 2.60 -0.74 4.80 4.01 -1.26 -4.95 118.16 119.97 1j9s n LYS 166 Ca -0.01 -2.44 0.00 0.00 -0.51 0.00 0.00 58.31 55.36 1j9s n LYS 166 Cb 0.15 -1.52 0.00 0.00 -0.51 0.00 0.00 35.03 33.15 1j9s n LYS 166 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1j9s n GLY 167 N 1.51 0.71 3.74 0.72 0.00 -0.77 -5.04 105.19 106.06 1j9s n GLY 167 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1j9s n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j9s s LYS 168 N -0.26 4.50 0.48 1.61 -0.14 -1.26 -4.76 119.74 119.92 1j9s s LYS 168 Ca 0.00 1.08 -0.23 0.00 -1.36 0.00 0.00 55.97 55.45 1j9s s LYS 168 Cb 0.00 -3.37 -0.08 0.00 -1.68 0.00 0.00 37.83 32.70 1j9s s LYS 168 CO 0.00 0.25 1.23 0.00 -0.76 0.00 0.00 175.35 176.07 1j9s n ALA 169 N 2.92 1.11 -3.86 5.17 0.00 -1.26 -0.59 120.51 124.00 1j9s n ALA 169 Ca -0.02 0.18 -0.30 0.00 0.00 0.00 0.00 53.44 53.31 1j9s n ALA 169 Cb 0.50 -2.25 -0.15 0.00 0.00 0.00 0.00 19.45 17.55 1j9s n ALA 169 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1j9s s LEU 170 N -2.11 2.61 -0.20 0.00 1.43 -0.44 -4.77 118.68 115.19 1j9s s LEU 170 Ca 0.66 -1.43 -0.03 0.00 -1.03 0.00 0.00 54.13 52.31 1j9s s LEU 170 Cb -0.47 -1.06 -0.01 0.00 0.03 0.00 0.00 46.19 44.67 1j9s s LEU 170 CO 0.54 -0.33 -0.07 -0.89 0.23 0.00 0.00 176.35 175.84 1j9s s THR 171 N 1.46 3.27 0.34 5.49 2.01 -1.26 -4.19 115.64 122.75 1j9s s THR 171 Ca 0.02 -0.54 -0.07 0.00 0.31 0.00 0.00 61.69 61.41 1j9s s THR 171 Cb -0.18 -2.46 -0.06 0.00 0.01 0.00 0.00 72.50 69.81 1j9s s THR 171 CO -0.13 0.45 0.65 -0.72 -0.69 0.00 0.00 174.62 174.18 1j9s s TYR 172 N 1.23 3.47 -0.06 4.92 -0.85 -1.26 -4.86 117.35 119.95 1j9s s TYR 172 Ca 0.03 0.82 0.14 0.00 -0.52 0.00 0.00 57.07 57.53 1j9s s TYR 172 Cb -0.14 -2.25 -0.20 0.00 0.38 0.00 0.00 41.96 39.74 1j9s s TYR 172 CO -0.02 0.05 0.75 -0.44 -1.52 0.00 0.00 175.55 174.37 1j9s h ASP 173 N 1.51 0.00 -5.06 -0.18 3.32 -0.78 -3.48 116.42 111.74 1j9s h ASP 173 Ca -0.47 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.52 1j9s h ASP 173 Cb 1.19 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.60 1j9s h ASP 173 CO 0.65 0.87 -0.07 -1.59 -1.72 0.00 0.00 179.24 177.38 1j9s s LYS 174 N -2.70 1.03 0.00 3.56 -2.85 -1.09 -5.02 119.74 112.68 1j9s s LYS 174 Ca -0.04 -0.60 0.02 0.00 -1.00 0.00 0.00 55.97 54.35 1j9s s LYS 174 Cb 0.08 0.46 -0.01 0.00 -2.06 0.00 0.00 37.83 36.30 1j9s s LYS 174 CO 0.82 -0.39 -0.05 -1.50 0.10 0.00 0.00 175.35 174.32 1j9s s ILE 175 N -3.43 0.42 0.09 3.79 2.07 -1.26 -1.66 121.20 121.22 1j9s s ILE 175 Ca 0.01 -0.34 0.06 0.00 -1.41 0.00 0.00 60.65 58.97 1j9s s ILE 175 Cb 0.01 -0.38 -0.03 0.00 0.13 0.00 0.00 42.46 42.19 1j9s s ILE 175 CO -0.09 0.04 -0.16 -0.31 -1.91 0.00 0.00 174.94 172.51 1j9s s TYR 176 N -0.30 1.45 -0.21 3.50 2.02 -0.60 -4.49 117.35 118.72 1j9s s TYR 176 Ca 0.00 -0.47 0.02 0.00 -0.37 0.00 0.00 57.07 56.25 1j9s s TYR 176 Cb -0.03 -0.79 0.04 0.00 -0.40 0.00 0.00 41.96 40.77 1j9s s TYR 176 CO -0.00 0.13 -0.16 -0.47 -1.57 0.00 0.00 175.55 173.48 1j9s s TYR 177 N -1.43 2.88 -0.36 2.71 5.04 0.05 -1.07 117.35 125.16 1j9s s TYR 177 Ca 0.03 -1.86 -0.08 0.00 -2.44 0.00 0.00 57.07 52.72 1j9s s TYR 177 Cb -0.09 -1.88 0.04 0.00 0.35 0.00 0.00 41.96 40.38 1j9s s TYR 177 CO 0.03 -0.82 0.16 0.08 -1.34 0.00 0.00 175.55 173.66 1j9s s VAL 178 N 1.24 4.14 -0.20 3.14 1.01 0.11 -4.21 120.40 125.63 1j9s s VAL 178 Ca -0.00 -1.07 -0.15 0.00 0.00 0.00 0.00 61.98 60.76 1j9s s VAL 178 Cb -0.16 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 1j9s s VAL 178 CO -0.10 -0.25 0.34 -0.83 0.00 0.00 0.00 175.10 174.27 1j9s s GLY 179 N 1.55 2.10 -0.16 4.51 0.00 -1.26 -2.21 107.32 111.86 1j9s s GLY 179 Ca 0.00 -0.56 -0.08 0.00 0.00 0.00 0.00 44.72 44.09 1j9s s GLY 179 CO 0.04 0.68 0.12 1.85 0.00 0.00 0.00 173.10 175.79 1j9s s GLU 180 N 1.09 3.78 -0.09 2.90 2.12 -0.28 -2.22 118.70 126.00 1j9s s GLU 180 Ca 0.17 -0.20 0.02 0.00 0.36 0.00 0.00 54.97 55.32 1j9s s GLU 180 Cb -0.14 -3.27 0.01 0.00 0.26 0.00 0.00 34.13 30.99 1j9s s GLU 180 CO 0.07 0.53 -0.14 -1.14 -0.54 0.00 0.00 175.26 174.04 1j9s s GLN 181 N -0.32 1.99 -0.17 4.30 2.00 0.59 -4.48 119.66 123.57 1j9s s GLN 181 Ca 0.11 -0.49 -0.16 0.00 -2.00 0.00 0.00 55.36 52.82 1j9s s GLN 181 Cb -0.12 -1.70 -0.04 0.00 0.80 0.00 0.00 33.01 31.95 1j9s s GLN 181 CO 0.01 -0.04 0.41 0.16 -0.50 0.00 0.00 175.29 175.33 1j9s s ASP 182 N 0.93 6.52 0.11 6.67 3.84 -1.26 -1.17 116.67 132.30 1j9s s ASP 182 Ca -0.09 0.61 0.08 0.00 -0.00 0.00 0.00 52.55 53.15 1j9s s ASP 182 Cb -0.15 -2.24 -0.04 0.00 -1.38 0.00 0.00 42.92 39.11 1j9s s ASP 182 CO -0.00 -0.03 -0.13 -0.36 -0.00 0.00 0.00 175.17 174.65 1j9s s PHE 183 N 0.99 2.66 -0.48 2.11 0.08 -0.09 -4.76 117.98 118.49 1j9s s PHE 183 Ca 0.21 -0.20 0.03 0.00 0.12 0.00 0.00 56.93 57.09 1j9s s PHE 183 Cb -0.15 -1.40 0.15 0.00 -0.57 0.00 0.00 43.02 41.05 1j9s s PHE 183 CO 0.08 0.41 0.30 0.71 -0.10 0.00 0.00 175.22 176.61 1j9s s TYR 184 N -1.18 2.08 -0.23 0.36 1.51 -1.26 -0.91 117.35 117.72 1j9s s TYR 184 Ca 0.20 -2.55 -0.14 0.00 -1.01 0.00 0.00 57.07 53.57 1j9s s TYR 184 Cb -0.11 -1.84 -0.04 0.00 -0.11 0.00 0.00 41.96 39.86 1j9s s TYR 184 CO 0.12 -0.75 0.34 0.08 -1.11 0.00 0.00 175.55 174.23 1j9s s VAL 185 N 0.01 5.23 0.61 0.71 1.01 -1.26 -4.78 120.40 121.93 1j9s s VAL 185 Ca 0.21 0.54 -0.19 0.00 0.00 0.00 0.00 61.98 62.55 1j9s s VAL 185 Cb -0.16 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 1j9s s VAL 185 CO -0.06 0.24 1.26 -2.65 0.00 0.00 0.00 175.10 173.89 1j9s n PRO 186 N 4.69 1.26 -4.26 2.72 -0.02 -1.26 -4.89 135.00 133.24 1j9s n PRO 186 Ca -0.10 0.48 -0.21 0.00 -2.02 0.00 0.00 63.50 61.65 1j9s n PRO 186 Cb 0.51 -2.48 -0.12 0.00 -0.02 0.00 0.00 33.50 31.39 1j9s n PRO 186 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1j9s s ARG 187 N -3.11 1.08 0.81 -0.52 0.52 -1.26 -1.15 118.95 115.31 1j9s s ARG 187 Ca 0.78 -1.19 -0.07 0.00 -0.52 0.00 0.00 55.73 54.73 1j9s s ARG 187 Cb -0.40 -1.17 0.17 0.00 0.52 0.00 0.00 34.95 34.07 1j9s s ARG 187 CO 0.44 0.26 1.10 -0.40 0.02 0.00 0.00 175.30 176.72 1j9s n ASP 188 N 0.85 0.77 0.22 0.23 5.68 0.18 -4.86 116.55 119.61 1j9s n ASP 188 Ca -0.18 -1.82 0.15 0.00 -0.50 0.00 0.00 54.79 52.45 1j9s n ASP 188 Cb 0.55 -0.78 0.75 0.00 -1.14 0.00 0.00 41.12 40.50 1j9s n ASP 188 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1j9s h GLU 189 N 0.00 0.00 -0.01 0.11 4.11 -2.02 -0.36 114.58 116.41 1j9s h GLU 189 Ca -0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.07 1j9s h GLU 189 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1j9s h GLU 189 CO 0.32 0.00 -0.09 0.09 0.07 0.00 0.00 179.01 179.40 1j9s n ASN 190 N -2.57 1.27 0.00 3.06 3.02 -1.26 -4.92 115.26 113.86 1j9s n ASN 190 Ca -0.01 -1.25 0.00 0.00 -0.03 0.00 0.00 54.58 53.29 1j9s n ASN 190 Cb 0.12 0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 1j9s n ASN 190 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1j9s n GLY 191 N 1.23 0.68 3.79 7.41 0.00 -0.14 -5.05 105.19 113.12 1j9s n GLY 191 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1j9s n GLY 191 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j9s s LYS 192 N -0.36 4.07 0.28 1.61 3.01 -1.26 -4.79 119.74 122.30 1j9s s LYS 192 Ca 0.00 0.37 -0.30 0.00 -1.01 0.00 0.00 55.97 55.03 1j9s s LYS 192 Cb 0.00 -3.31 -0.10 0.00 -1.01 0.00 0.00 37.83 33.41 1j9s s LYS 192 CO 0.00 0.48 1.44 0.71 0.51 0.00 0.00 175.35 178.50 1j9s s TYR 193 N -0.40 2.95 0.39 3.18 1.51 -1.26 -0.65 117.35 123.08 1j9s s TYR 193 Ca 0.23 1.07 -0.13 0.00 -1.01 0.00 0.00 57.07 57.23 1j9s s TYR 193 Cb -0.16 -3.85 -0.08 0.00 -0.11 0.00 0.00 41.96 37.77 1j9s s TYR 193 CO 0.11 -2.68 0.80 0.15 -1.11 0.00 0.00 175.55 172.82 1j9s s LYS 194 N -0.79 3.90 0.08 -0.62 1.02 -0.30 -4.87 119.74 118.16 1j9s s LYS 194 Ca 0.57 0.64 0.10 0.00 0.02 0.00 0.00 55.97 57.30 1j9s s LYS 194 Cb -0.43 -2.36 -0.03 0.00 -0.52 0.00 0.00 37.83 34.49 1j9s s LYS 194 CO 0.47 -0.00 -0.25 0.15 -0.92 0.00 0.00 175.35 174.80 1j9s s LYS 195 N -3.56 1.70 0.09 1.68 1.02 -1.26 -4.78 119.74 114.63 1j9s s LYS 195 Ca 0.54 -1.18 0.06 0.00 0.02 0.00 0.00 55.97 55.41 1j9s s LYS 195 Cb -0.10 -1.99 -0.03 0.00 -0.52 0.00 0.00 37.83 35.19 1j9s s LYS 195 CO 0.26 0.49 -0.16 0.71 -0.92 0.00 0.00 175.35 175.73 1j9s s TYR 196 N -0.94 1.42 0.04 3.18 2.02 -1.26 -5.07 117.35 116.75 1j9s s TYR 196 Ca 0.13 -0.47 -0.19 0.00 -0.37 0.00 0.00 57.07 56.18 1j9s s TYR 196 Cb -0.10 -0.78 -0.17 0.00 -0.40 0.00 0.00 41.96 40.51 1j9s s TYR 196 CO 0.04 0.12 1.25 0.93 -1.57 0.00 0.00 175.55 176.33 1j9s h GLU 197 N 4.06 0.46 -5.82 -0.62 5.08 -2.01 -3.46 114.58 112.27 1j9s h GLU 197 Ca -0.42 -0.34 -0.50 0.00 -1.00 0.00 0.00 59.36 57.11 1j9s h GLU 197 Cb 1.19 0.06 -0.19 0.00 0.50 0.00 0.00 28.75 30.31 1j9s h GLU 197 CO 0.42 0.96 -0.78 0.00 -1.00 0.00 0.00 179.01 178.60 1j9s s ALA 198 N -3.83 1.80 0.19 3.43 0.00 -1.26 -5.07 121.76 117.02 1j9s s ALA 198 Ca -0.13 -1.37 -0.16 0.00 0.00 0.00 0.00 51.96 50.30 1j9s s ALA 198 Cb 0.05 -0.16 0.15 0.00 0.00 0.00 0.00 23.12 23.16 1j9s s ALA 198 CO 0.80 0.22 1.65 -1.35 0.00 0.00 0.00 175.76 177.08 1j9s h PRO 199 N 3.53 -0.02 -0.04 0.00 0.11 -1.95 -1.80 132.00 131.82 1j9s h PRO 199 Ca -0.42 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.70 1j9s h PRO 199 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1j9s h PRO 199 CO 0.48 -0.01 0.03 0.78 -0.21 0.00 0.00 178.00 179.07 1j9s h GLY 200 N -0.02 0.00 1.85 -0.55 0.00 -2.00 -2.34 103.07 100.01 1j9s h GLY 200 Ca 0.24 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.59 1j9s h GLY 200 CO -0.52 0.00 0.05 -0.55 0.00 0.00 0.00 176.54 175.52 1j9s h ASP 201 N 0.00 0.00 0.06 0.19 3.45 -1.75 -2.34 116.42 116.04 1j9s h ASP 201 Ca 0.02 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.48 1j9s h ASP 201 Cb 0.09 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.86 1j9s h ASP 201 CO -0.00 0.00 -0.13 0.00 -1.57 0.00 0.00 179.24 177.54 1j9s n ALA 202 N -2.54 2.82 0.13 3.45 0.00 -0.88 -4.59 120.51 118.89 1j9s n ALA 202 Ca -0.01 -0.49 -0.16 0.00 0.00 0.00 0.00 53.44 52.78 1j9s n ALA 202 Cb 0.16 -1.07 -0.09 0.00 0.00 0.00 0.00 19.45 18.46 1j9s n ALA 202 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1j9s h TYR 203 N 2.33 -1.39 -0.15 0.00 5.03 -1.51 0.85 116.97 122.13 1j9s h TYR 203 Ca 0.00 0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.37 1j9s h TYR 203 Cb 0.60 0.59 -0.03 0.00 1.55 0.00 0.00 36.73 39.44 1j9s h TYR 203 CO 0.00 -0.58 -0.04 0.93 -1.32 0.00 0.00 178.16 177.16 1j9s h GLU 204 N -0.74 0.00 -0.97 1.82 5.08 -1.81 -0.64 114.58 117.31 1j9s h GLU 204 Ca 0.00 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1j9s h GLU 204 Cb 0.74 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.94 1j9s h GLU 204 CO -0.26 0.00 0.64 -0.44 -1.00 0.00 0.00 179.01 177.96 1j9s h ASP 205 N 0.00 1.10 -0.29 1.42 3.45 -1.83 -2.49 116.42 117.78 1j9s h ASP 205 Ca 0.07 -0.02 -0.11 0.00 0.43 0.00 0.00 57.03 57.40 1j9s h ASP 205 Cb 0.11 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.61 1j9s h ASP 205 CO -0.15 0.78 -0.23 0.74 -1.57 0.00 0.00 179.24 178.81 1j9s h THR 206 N 1.29 1.30 -0.73 0.35 2.02 -0.37 -2.96 112.91 113.80 1j9s h THR 206 Ca 0.37 -1.37 -0.02 0.00 0.77 0.00 0.00 66.41 66.15 1j9s h THR 206 Cb -0.10 1.54 -0.03 0.00 -1.74 0.00 0.00 68.15 67.82 1j9s h THR 206 CO -0.09 0.44 0.37 0.58 0.37 0.00 0.00 175.52 177.19 1j9s h VAL 207 N 0.41 1.23 -0.59 3.16 2.07 -0.94 0.85 116.25 122.44 1j9s h VAL 207 Ca 0.05 -0.62 0.04 0.00 0.82 0.00 0.00 66.70 66.99 1j9s h VAL 207 Cb 0.78 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 1j9s h VAL 207 CO 0.06 0.27 0.34 0.50 0.02 0.00 0.00 177.57 178.76 1j9s h LYS 208 N 1.03 0.65 -0.56 1.57 3.64 -1.38 -0.60 116.57 120.92 1j9s h LYS 208 Ca 0.26 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.49 1j9s h LYS 208 Cb 0.08 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 1j9s h LYS 208 CO -0.04 0.43 -0.06 0.28 -2.27 0.00 0.00 179.45 177.79 1j9s h VAL 209 N 0.67 1.27 -0.92 2.00 2.07 -1.19 -2.89 116.25 117.25 1j9s h VAL 209 Ca 0.24 -1.22 0.06 0.00 0.82 0.00 0.00 66.70 66.61 1j9s h VAL 209 Cb 0.07 0.91 -0.06 0.00 -1.52 0.00 0.00 31.29 30.69 1j9s h VAL 209 CO -0.12 0.43 0.60 0.24 0.02 0.00 0.00 177.57 178.74 1j9s h MET 210 N 0.92 1.03 0.00 1.57 2.86 -0.06 -2.04 114.93 119.21 1j9s h MET 210 Ca 0.15 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1j9s h MET 210 Cb 0.63 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.06 1j9s h MET 210 CO 0.04 0.68 0.00 0.00 1.06 0.00 0.00 176.91 178.69 1j9s h ARG 211 N 1.06 0.00 0.00 1.72 3.08 -0.92 0.36 114.38 119.68 1j9s h ARG 211 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.44 1j9s h ARG 211 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1j9s h ARG 211 CO -0.15 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.00 1j9s n THR 212 N -2.71 0.13 -1.91 2.04 -2.24 -0.77 -4.88 114.28 103.95 1j9s n THR 212 Ca -0.01 0.03 -0.17 0.00 -2.27 0.00 0.00 64.05 61.63 1j9s n THR 212 Cb 0.14 -0.57 -0.05 0.00 -2.10 0.00 0.00 70.33 67.76 1j9s n THR 212 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1j9s n LEU 213 N -1.48 -1.43 -3.88 3.22 4.77 0.12 -4.94 117.00 113.37 1j9s n LEU 213 Ca 0.07 0.27 -0.30 0.00 -0.03 0.00 0.00 56.01 56.02 1j9s n LEU 213 Cb 0.31 -2.55 -0.15 0.00 -2.33 0.00 0.00 43.42 38.70 1j9s n LEU 213 CO 0.25 -0.59 -0.37 -0.89 -1.33 0.00 0.00 177.39 174.46 1j9s s THR 214 N -2.65 1.45 0.56 -5.08 2.01 -1.26 -5.12 115.64 105.55 1j9s s THR 214 Ca 0.00 -1.52 -0.19 0.00 0.31 0.00 0.00 61.69 60.29 1j9s s THR 214 Cb 0.00 -1.93 -0.05 0.00 0.01 0.00 0.00 72.50 70.53 1j9s s THR 214 CO 0.00 -0.41 1.18 -2.16 -0.69 0.00 0.00 174.62 172.54 1j9s s PRO 215 N 1.37 3.17 0.11 4.92 0.04 -1.26 -4.91 135.00 138.45 1j9s s PRO 215 Ca 0.03 1.76 0.12 0.00 0.04 0.00 0.00 61.00 62.96 1j9s s PRO 215 Cb -0.18 -2.00 -0.13 0.00 0.04 0.00 0.00 34.50 32.22 1j9s s PRO 215 CO -0.13 -1.03 1.09 1.79 0.04 0.00 0.00 177.00 178.76 1j9s h THR 216 N 1.09 1.06 -3.83 1.26 1.35 -1.38 -3.46 112.91 109.00 1j9s h THR 216 Ca -0.50 -2.67 -0.17 0.00 -0.55 0.00 0.00 66.41 62.52 1j9s h THR 216 Cb 1.28 2.48 -0.22 0.00 -1.73 0.00 0.00 68.15 69.96 1j9s h THR 216 CO 0.56 0.60 -0.65 -1.00 -0.25 0.00 0.00 175.52 174.78 1j9s s HIS 217 N -2.79 0.17 -0.20 4.73 3.76 -1.15 -4.87 115.29 114.93 1j9s s HIS 217 Ca -0.00 -0.35 -0.04 0.00 -0.15 0.00 0.00 55.06 54.51 1j9s s HIS 217 Cb 0.09 -0.13 0.07 0.00 1.11 0.00 0.00 32.58 33.71 1j9s s HIS 217 CO 0.80 -0.19 0.08 0.08 -0.85 0.00 0.00 174.74 174.67 1j9s s VAL 218 N -1.23 0.10 0.21 -0.90 1.01 -0.57 -0.91 120.40 118.11 1j9s s VAL 218 Ca -0.13 -0.39 0.04 0.00 0.00 0.00 0.00 61.98 61.50 1j9s s VAL 218 Cb -0.08 -0.79 -0.05 0.00 0.00 0.00 0.00 36.38 35.46 1j9s s VAL 218 CO -0.00 -0.34 -0.05 0.68 0.00 0.00 0.00 175.10 175.39 1j9s s VAL 219 N 2.04 1.16 -0.07 2.92 -7.23 -0.32 -0.01 120.40 118.90 1j9s s VAL 219 Ca 0.03 -2.06 -0.00 0.00 -1.81 0.00 0.00 61.98 58.13 1j9s s VAL 219 Cb -0.16 -2.19 -0.03 0.00 0.56 0.00 0.00 36.38 34.56 1j9s s VAL 219 CO -0.13 -0.47 -0.04 -0.36 -0.31 0.00 0.00 175.10 173.79 1j9s s PHE 220 N -3.33 3.03 -1.53 2.82 0.08 -1.26 -0.30 117.98 117.49 1j9s s PHE 220 Ca 0.25 0.09 -0.14 0.00 0.12 0.00 0.00 56.93 57.25 1j9s s PHE 220 Cb 0.04 -1.74 0.08 0.00 -0.57 0.00 0.00 43.02 40.84 1j9s s PHE 220 CO 0.06 0.39 0.95 -1.71 -0.10 0.00 0.00 175.22 174.81 1j9s n ASN 221 N 2.18 -4.84 0.00 1.36 4.05 -0.94 -3.01 115.26 114.06 1j9s n ASN 221 Ca -0.18 -0.74 0.00 0.00 0.45 0.00 0.00 54.58 54.10 1j9s n ASN 221 Cb 0.53 -3.87 0.00 0.00 1.23 0.00 0.00 39.78 37.68 1j9s n ASN 221 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1j9s n GLY 222 N -1.66 0.70 3.51 8.20 0.00 -0.74 -4.78 105.19 110.41 1j9s n GLY 222 Ca 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 1j9s n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9s s ALA 223 N -3.00 -1.81 0.26 4.61 0.00 -1.16 -4.61 121.76 116.04 1j9s s ALA 223 Ca 0.00 1.13 -0.30 0.00 0.00 0.00 0.00 51.96 52.79 1j9s s ALA 223 Cb 0.00 0.14 -0.11 0.00 0.00 0.00 0.00 23.12 23.16 1j9s s ALA 223 CO 0.00 -0.56 1.52 0.08 0.00 0.00 0.00 175.76 176.80 1j9s s VAL 224 N -2.43 2.39 0.00 0.00 1.01 0.06 -2.42 120.40 119.01 1j9s s VAL 224 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.31 1j9s s VAL 224 Cb -0.01 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.17 1j9s s VAL 224 CO -0.04 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.72 1j9s n GLY 225 N 2.36 0.34 0.31 4.51 0.00 -1.26 -4.85 105.19 106.60 1j9s n GLY 225 Ca 0.08 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.26 1j9s n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9s h ALA 226 N 0.00 1.52 -0.24 4.61 0.00 -1.69 -2.46 119.26 121.00 1j9s h ALA 226 Ca 0.00 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 1j9s h ALA 226 Cb 0.34 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.02 1j9s h ALA 226 CO 0.00 -0.04 -0.46 1.28 0.00 0.00 0.00 179.25 180.03 1j9s n LEU 227 N -3.78 3.55 -4.65 0.00 4.77 -1.26 -4.75 117.00 110.87 1j9s n LEU 227 Ca -0.02 -4.07 -0.30 0.00 -0.03 0.00 0.00 56.01 51.59 1j9s n LEU 227 Cb 0.12 -0.52 -0.08 0.00 -2.33 0.00 0.00 43.42 40.61 1j9s n LEU 227 CO 0.27 1.53 -0.23 0.42 -1.33 0.00 0.00 177.39 178.05 1j9s s THR 228 N -3.56 0.93 0.00 -5.08 -4.23 -0.93 -0.70 115.64 102.08 1j9s s THR 228 Ca 0.43 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.94 1j9s s THR 228 Cb 0.39 -2.25 0.00 0.00 1.34 0.00 0.00 72.50 71.97 1j9s s THR 228 CO -0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.66 1j9s n GLY 229 N -1.11 3.57 0.00 3.99 0.00 -1.26 -1.10 105.19 109.28 1j9s n GLY 229 Ca -0.13 -0.09 0.11 0.00 0.00 0.00 0.00 46.02 45.91 1j9s n GLY 229 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1j9s n ASP 230 N 4.85 0.00 -0.57 1.61 10.43 -1.26 -2.19 116.55 129.42 1j9s n ASP 230 Ca 0.00 -0.64 0.08 0.00 2.57 0.00 0.00 54.79 56.81 1j9s n ASP 230 Cb 0.00 -0.02 0.20 0.00 1.84 0.00 0.00 41.12 43.14 1j9s n ASP 230 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1j9s n LYS 231 N -1.02 2.40 -2.14 -1.24 5.02 -0.26 -5.01 118.16 115.90 1j9s n LYS 231 Ca 0.16 -2.64 -0.36 0.00 -2.02 0.00 0.00 58.31 53.45 1j9s n LYS 231 Cb 0.08 -1.66 0.02 0.00 -0.02 0.00 0.00 35.03 33.45 1j9s n LYS 231 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1j9s s ALA 232 N -2.63 2.64 0.62 7.82 0.00 -0.93 -4.02 121.76 125.26 1j9s s ALA 232 Ca 0.36 0.93 -0.12 0.00 0.00 0.00 0.00 51.96 53.12 1j9s s ALA 232 Cb 0.29 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.97 1j9s s ALA 232 CO 0.07 -0.96 1.03 -1.64 0.00 0.00 0.00 175.76 174.27 1j9s s MET 233 N -3.27 3.46 0.22 0.00 -1.94 -0.40 -4.81 119.30 112.56 1j9s s MET 233 Ca 0.74 0.86 0.07 0.00 -1.71 0.00 0.00 55.69 55.65 1j9s s MET 233 Cb -0.27 -2.06 -0.05 0.00 2.01 0.00 0.00 34.83 34.46 1j9s s MET 233 CO 0.30 -0.68 -0.11 0.95 -0.01 0.00 0.00 175.02 175.47 1j9s s THR 234 N -3.03 1.64 0.19 2.05 -4.23 -1.26 -0.41 115.64 110.59 1j9s s THR 234 Ca 0.57 -2.17 -0.23 0.00 -1.18 0.00 0.00 61.69 58.68 1j9s s THR 234 Cb -0.12 -2.14 0.07 0.00 1.34 0.00 0.00 72.50 71.65 1j9s s THR 234 CO 0.50 -0.53 0.99 0.00 -0.54 0.00 0.00 174.62 175.04 1j9s s ALA 235 N -3.03 -1.55 0.09 3.99 0.00 -1.01 -4.92 121.76 115.34 1j9s s ALA 235 Ca 0.24 -0.17 0.04 0.00 0.00 0.00 0.00 51.96 52.06 1j9s s ALA 235 Cb 0.01 0.70 -0.03 0.00 0.00 0.00 0.00 23.12 23.79 1j9s s ALA 235 CO 0.08 -1.05 -0.10 0.00 0.00 0.00 0.00 175.76 174.69 1j9s s ALA 236 N -2.65 1.08 0.21 0.00 0.00 -1.26 -1.59 121.76 117.54 1j9s s ALA 236 Ca 0.17 -1.16 -0.32 0.00 0.00 0.00 0.00 51.96 50.65 1j9s s ALA 236 Cb -0.02 0.03 -0.13 0.00 0.00 0.00 0.00 23.12 22.99 1j9s s ALA 236 CO 0.05 -0.03 1.54 0.28 0.00 0.00 0.00 175.76 177.59 1j9s n VAL 237 N 0.63 0.42 0.00 0.00 0.31 0.14 -1.15 118.33 118.69 1j9s n VAL 237 Ca -0.17 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 1j9s n VAL 237 Cb 0.57 -1.61 0.00 0.00 -0.91 0.00 0.00 33.84 31.89 1j9s n VAL 237 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1j9s n GLY 238 N 2.92 2.46 3.77 2.92 0.00 0.83 -4.98 105.19 113.11 1j9s n GLY 238 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 1j9s n GLY 238 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1j9s s GLU 239 N -0.88 4.68 -0.22 1.61 2.12 -0.30 -4.78 118.70 120.92 1j9s s GLU 239 Ca 0.00 1.37 -0.10 0.00 0.36 0.00 0.00 54.97 56.60 1j9s s GLU 239 Cb 0.00 -3.01 -0.05 0.00 0.26 0.00 0.00 34.13 31.33 1j9s s GLU 239 CO 0.00 0.39 0.14 0.15 -0.54 0.00 0.00 175.26 175.40 1j9s s LYS 240 N -1.67 4.06 -0.04 4.30 1.02 -1.26 -1.75 119.74 124.40 1j9s s LYS 240 Ca 0.46 -0.28 0.05 0.00 0.02 0.00 0.00 55.97 56.22 1j9s s LYS 240 Cb -0.22 -3.46 -0.01 0.00 -0.52 0.00 0.00 37.83 33.63 1j9s s LYS 240 CO 0.27 0.13 -0.19 0.08 -0.92 0.00 0.00 175.35 174.72 1j9s s VAL 241 N 0.84 1.60 -0.20 3.17 1.01 0.88 0.03 120.40 127.72 1j9s s VAL 241 Ca 0.07 -0.82 -0.06 0.00 0.00 0.00 0.00 61.98 61.17 1j9s s VAL 241 Cb -0.13 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 1j9s s VAL 241 CO 0.02 0.45 0.04 -0.22 0.00 0.00 0.00 175.10 175.39 1j9s s LEU 242 N -0.09 3.49 -0.30 3.92 2.96 -0.66 -0.92 118.68 127.08 1j9s s LEU 242 Ca -0.02 -0.10 -0.02 0.00 -0.22 0.00 0.00 54.13 53.77 1j9s s LEU 242 Cb -0.11 -1.89 0.05 0.00 0.50 0.00 0.00 46.19 44.73 1j9s s LEU 242 CO 0.02 0.09 0.00 -0.63 -1.32 0.00 0.00 176.35 174.51 1j9s s ILE 243 N 0.87 3.02 -0.06 6.68 1.01 0.14 -1.56 121.20 131.29 1j9s s ILE 243 Ca 0.02 -1.37 -0.20 0.00 0.00 0.00 0.00 60.65 59.10 1j9s s ILE 243 Cb -0.14 -2.74 -0.05 0.00 0.01 0.00 0.00 42.46 39.55 1j9s s ILE 243 CO 0.02 -0.11 0.57 -0.69 0.00 0.00 0.00 174.94 174.73 1j9s s VAL 244 N 1.26 5.06 -0.03 2.92 1.01 -0.24 -1.38 120.40 129.00 1j9s s VAL 244 Ca -0.05 1.16 0.03 0.00 0.00 0.00 0.00 61.98 63.12 1j9s s VAL 244 Cb -0.20 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.28 1j9s s VAL 244 CO -0.01 0.35 -0.11 -2.28 0.00 0.00 0.00 175.10 173.05 1j9s s HIS 245 N 0.32 1.12 0.08 5.22 2.46 0.02 0.05 115.29 124.56 1j9s s HIS 245 Ca 0.30 -0.29 0.02 0.00 0.47 0.00 0.00 55.06 55.56 1j9s s HIS 245 Cb -0.17 -0.79 -0.04 0.00 -0.13 0.00 0.00 32.58 31.46 1j9s s HIS 245 CO 0.15 -0.11 -0.07 -1.54 -2.47 0.00 0.00 174.74 170.69 1j9s s SER 246 N 0.15 1.06 -0.28 9.88 1.04 -0.94 -0.20 113.70 124.42 1j9s s SER 246 Ca -0.03 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 55.53 1j9s s SER 246 Cb -0.09 0.08 0.16 0.00 0.10 0.00 0.00 66.02 66.27 1j9s s SER 246 CO 0.01 -0.39 0.46 -1.58 0.98 0.00 0.00 173.24 172.72 1j9s s GLN 247 N -3.19 0.44 0.24 4.02 -0.44 -0.91 -1.12 119.66 118.70 1j9s s GLN 247 Ca 0.06 0.50 0.25 0.00 -2.50 0.00 0.00 55.36 53.66 1j9s s GLN 247 Cb 0.01 -0.12 0.91 0.00 -1.64 0.00 0.00 33.01 32.17 1j9s s GLN 247 CO -0.03 -0.82 1.74 0.00 0.50 0.00 0.00 175.29 176.68 1j9s n ALA 248 N 5.38 1.95 0.00 1.58 0.00 -1.26 0.16 120.51 128.32 1j9s n ALA 248 Ca -0.01 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1j9s n ALA 248 Cb 0.51 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1j9s n ALA 248 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1j9s n ASN 249 N -2.26 1.58 -3.83 0.00 5.15 -1.26 -3.11 115.26 111.54 1j9s n ASN 249 Ca 0.04 -0.02 -0.12 0.00 -0.60 0.00 0.00 54.58 53.88 1j9s n ASN 249 Cb 0.32 0.35 -0.10 0.00 -0.53 0.00 0.00 39.78 39.82 1j9s n ASN 249 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1j9s s ARG 250 N -0.67 0.50 0.67 1.20 3.52 -1.26 -4.66 118.95 118.25 1j9s s ARG 250 Ca 0.00 -0.25 -0.17 0.00 -0.13 0.00 0.00 55.73 55.17 1j9s s ARG 250 Cb 0.00 0.22 -0.01 0.00 -1.56 0.00 0.00 34.95 33.60 1j9s s ARG 250 CO 0.00 -0.12 1.12 -0.25 -0.81 0.00 0.00 175.30 175.24 1j9s n ASP 251 N 1.60 1.25 -3.89 -2.12 10.43 -1.26 -3.56 116.55 118.99 1j9s n ASP 251 Ca -0.21 0.76 -0.09 0.00 2.57 0.00 0.00 54.79 57.82 1j9s n ASP 251 Cb 0.56 -1.47 -0.07 0.00 1.84 0.00 0.00 41.12 41.98 1j9s n ASP 251 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 1j9s s THR 252 N -1.58 0.10 -0.40 -3.53 -1.32 -0.70 -4.85 115.64 103.36 1j9s s THR 252 Ca 0.78 -1.25 0.03 0.00 -1.21 0.00 0.00 61.69 60.05 1j9s s THR 252 Cb -0.37 -1.57 0.16 0.00 -1.51 0.00 0.00 72.50 69.21 1j9s s THR 252 CO 0.45 -0.47 0.33 0.00 -2.21 0.00 0.00 174.62 172.72 1j9s s ARG 253 N -3.91 0.82 0.57 7.08 1.70 -1.26 -1.75 118.95 122.20 1j9s s ARG 253 Ca 0.11 -1.85 -0.20 0.00 -0.47 0.00 0.00 55.73 53.31 1j9s s ARG 253 Cb 0.04 -1.31 -0.04 0.00 -0.57 0.00 0.00 34.95 33.07 1j9s s ARG 253 CO -0.06 -1.34 1.26 -2.14 -1.08 0.00 0.00 175.30 171.94 1j9s s PRO 254 N 0.37 3.05 -0.24 3.89 0.02 -1.10 0.02 135.00 141.01 1j9s s PRO 254 Ca 0.29 1.97 -0.14 0.00 0.02 0.00 0.00 61.00 63.15 1j9s s PRO 254 Cb -0.03 -2.07 0.07 0.00 0.02 0.00 0.00 34.50 32.50 1j9s s PRO 254 CO -0.14 -1.18 0.59 1.21 -0.33 0.00 0.00 177.00 177.14 1j9s s ASN 255 N -1.35 -0.79 -0.59 2.53 3.84 -0.42 -1.19 114.94 116.97 1j9s s ASN 255 Ca 0.75 1.29 -0.19 0.00 0.21 0.00 0.00 52.86 54.92 1j9s s ASN 255 Cb -0.34 1.17 0.10 0.00 -0.55 0.00 0.00 41.25 41.63 1j9s s ASN 255 CO 0.38 -0.22 0.71 -0.22 -2.79 0.00 0.00 177.10 174.96 1j9s s LEU 256 N 1.54 5.37 -0.20 3.21 2.96 -1.26 -1.61 118.68 128.69 1j9s s LEU 256 Ca -0.10 -1.42 -0.29 0.00 -0.22 0.00 0.00 54.13 52.10 1j9s s LEU 256 Cb -0.06 -2.31 -0.03 0.00 0.50 0.00 0.00 46.19 44.29 1j9s s LEU 256 CO -0.17 -1.12 1.72 -0.63 -1.32 0.00 0.00 176.35 174.84 1j9s s ILE 257 N 2.70 3.54 0.00 6.68 1.01 0.43 -1.06 121.20 134.50 1j9s s ILE 257 Ca 0.12 0.61 0.00 0.00 0.00 0.00 0.00 60.65 61.38 1j9s s ILE 257 Cb -0.24 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 38.67 1j9s s ILE 257 CO 0.06 -0.24 0.00 0.61 0.00 0.00 0.00 174.94 175.37 1j9s n GLY 258 N 4.80 1.44 0.00 6.18 0.00 -1.26 -3.32 105.19 113.02 1j9s n GLY 258 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1j9s n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j9s n GLY 259 N -1.19 5.18 3.75 -0.02 0.00 -0.23 -4.98 105.19 107.70 1j9s n GLY 259 Ca 0.00 -1.59 -0.09 0.00 0.00 0.00 0.00 46.02 44.34 1j9s n GLY 259 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1j9s s HIS 260 N 1.68 0.24 -0.58 1.61 0.09 -1.25 -4.81 115.29 112.26 1j9s s HIS 260 Ca 0.00 -0.79 -0.06 0.00 -0.00 0.00 0.00 55.06 54.22 1j9s s HIS 260 Cb 0.00 0.61 0.15 0.00 -0.00 0.00 0.00 32.58 33.35 1j9s s HIS 260 CO 0.00 -1.40 0.42 0.20 -0.00 0.00 0.00 174.74 173.96 1j9s s GLY 261 N -3.07 2.34 0.23 -2.22 0.00 -0.07 -4.75 107.32 99.77 1j9s s GLY 261 Ca 0.18 -2.99 -0.07 0.00 0.00 0.00 0.00 44.72 41.84 1j9s s GLY 261 CO 0.12 1.11 1.85 -0.55 0.00 0.00 0.00 173.10 175.63 1j9s h ASP 262 N 7.62 0.76 -3.42 1.64 3.32 -1.58 -0.68 116.42 124.09 1j9s h ASP 262 Ca -0.06 0.01 -0.34 0.00 0.02 0.00 0.00 57.03 56.66 1j9s h ASP 262 Cb 1.01 -0.15 -0.36 0.00 0.22 0.00 0.00 39.33 40.05 1j9s h ASP 262 CO 0.75 0.50 -0.74 -0.31 -1.72 0.00 0.00 179.24 177.73 1j9s s TYR 263 N -6.09 0.08 -0.10 4.55 1.51 -1.01 -2.39 117.35 113.90 1j9s s TYR 263 Ca -0.13 0.17 -0.00 0.00 -1.01 0.00 0.00 57.07 56.10 1j9s s TYR 263 Cb 0.17 -0.37 0.02 0.00 -0.11 0.00 0.00 41.96 41.67 1j9s s TYR 263 CO 0.78 -0.14 -0.07 0.08 -1.11 0.00 0.00 175.55 175.08 1j9s s VAL 264 N 1.60 0.95 -1.11 0.71 1.01 0.31 -0.03 120.40 123.85 1j9s s VAL 264 Ca -0.02 -0.25 -0.14 0.00 0.00 0.00 0.00 61.98 61.56 1j9s s VAL 264 Cb -0.13 -0.98 0.18 0.00 0.00 0.00 0.00 36.38 35.45 1j9s s VAL 264 CO -0.03 0.35 1.28 0.26 0.00 0.00 0.00 175.10 176.97 1j9s s TRP 265 N 1.65 3.51 0.39 5.22 0.51 0.21 -0.50 118.94 129.93 1j9s s TRP 265 Ca 0.03 -2.01 0.08 0.00 -2.12 0.00 0.00 56.10 52.09 1j9s s TRP 265 Cb -0.13 -4.22 0.83 0.00 -0.81 0.00 0.00 33.47 29.14 1j9s s TRP 265 CO -0.07 -1.34 1.97 0.00 -0.51 0.00 0.00 176.95 177.00 1j9s h ALA 266 N 7.55 1.79 -0.00 0.98 0.00 -1.89 0.63 119.26 128.32 1j9s h ALA 266 Ca 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1j9s h ALA 266 Cb 0.92 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1j9s h ALA 266 CO 1.16 0.10 -0.22 0.25 0.00 0.00 0.00 179.25 180.53 1j9s n THR 267 N -4.48 0.00 -0.99 0.00 -2.24 -1.26 -4.54 114.28 100.76 1j9s n THR 267 Ca 0.10 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1j9s n THR 267 Cb 0.25 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 1j9s n THR 267 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1j9s n GLY 268 N 1.46 0.87 3.48 3.38 0.00 0.18 -4.70 105.19 109.85 1j9s n GLY 268 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 1j9s n GLY 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j9s s LYS 269 N -0.01 3.71 0.58 1.61 -0.14 -1.26 0.03 119.74 124.27 1j9s s LYS 269 Ca 0.00 -0.45 0.35 0.00 -1.36 0.00 0.00 55.97 54.51 1j9s s LYS 269 Cb 0.00 -3.35 1.77 0.00 -1.68 0.00 0.00 37.83 34.58 1j9s s LYS 269 CO 0.00 -0.14 2.15 0.74 -0.76 0.00 0.00 175.35 177.34 1j9s h PHE 270 N 8.10 0.00 -0.00 3.18 0.05 -1.78 -1.96 116.94 124.53 1j9s h PHE 270 Ca -0.38 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.41 1j9s h PHE 270 Cb 1.18 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.13 1j9s h PHE 270 CO 0.67 0.04 -0.05 0.09 -0.18 0.00 0.00 178.31 178.88 1j9s n ASN 271 N -3.29 0.14 -4.60 2.17 3.02 -1.26 -4.58 115.26 106.86 1j9s n ASN 271 Ca -0.02 -0.15 -0.39 0.00 -0.03 0.00 0.00 54.58 54.00 1j9s n ASN 271 Cb 0.20 -0.24 -0.10 0.00 -0.61 0.00 0.00 39.78 39.03 1j9s n ASN 271 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1j9s s THR 272 N -2.64 5.24 0.34 3.41 2.01 -0.74 -5.04 115.64 118.22 1j9s s THR 272 Ca 0.25 0.39 -0.28 0.00 0.31 0.00 0.00 61.69 62.37 1j9s s THR 272 Cb 0.20 -3.62 -0.12 0.00 0.01 0.00 0.00 72.50 68.96 1j9s s THR 272 CO 0.49 0.20 1.24 -2.65 -0.69 0.00 0.00 174.62 173.21 1j9s n PRO 273 N 5.18 1.99 -2.47 4.92 -0.02 -1.26 -4.85 135.00 138.48 1j9s n PRO 273 Ca -0.11 0.70 -0.36 0.00 -2.02 0.00 0.00 63.50 61.71 1j9s n PRO 273 Cb 0.51 -2.26 -0.03 0.00 -0.02 0.00 0.00 33.50 31.71 1j9s n PRO 273 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1j9s s PRO 274 N -1.86 3.95 0.72 0.52 0.04 -1.26 -4.93 135.00 132.18 1j9s s PRO 274 Ca 0.56 1.54 -0.11 0.00 0.04 0.00 0.00 61.00 63.03 1j9s s PRO 274 Cb -0.58 -2.37 0.03 0.00 0.04 0.00 0.00 34.50 31.61 1j9s s PRO 274 CO 0.62 -0.34 1.07 -0.51 0.04 0.00 0.00 177.00 177.88 1j9s s ASP 275 N -1.63 5.12 0.16 6.66 1.01 0.35 -4.75 116.67 123.60 1j9s s ASP 275 Ca 0.62 1.54 0.04 0.00 0.71 0.00 0.00 52.55 55.47 1j9s s ASP 275 Cb -0.22 -2.38 -0.05 0.00 1.01 0.00 0.00 42.92 41.28 1j9s s ASP 275 CO 0.27 -1.60 -0.08 0.68 0.21 0.00 0.00 175.17 174.66 1j9s s VAL 276 N -3.07 1.11 -1.35 -1.27 -7.23 -1.26 -0.53 120.40 106.80 1j9s s VAL 276 Ca 0.59 -2.05 0.00 0.00 -1.81 0.00 0.00 61.98 58.71 1j9s s VAL 276 Cb -0.14 -1.96 0.00 0.00 0.56 0.00 0.00 36.38 34.84 1j9s s VAL 276 CO 0.55 -0.65 0.00 0.47 -0.31 0.00 0.00 175.10 175.15 1j9s n ASP 277 N -0.24 -4.64 -4.77 4.85 10.43 -0.99 -4.93 116.55 116.27 1j9s n ASP 277 Ca -0.09 0.13 -0.39 0.00 2.57 0.00 0.00 54.79 57.01 1j9s n ASP 277 Cb 0.61 -3.92 0.00 0.00 1.84 0.00 0.00 41.12 39.65 1j9s n ASP 277 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 1j9s s GLN 278 N -4.93 3.82 -0.22 -1.24 -1.52 -0.30 -4.75 119.66 110.52 1j9s s GLN 278 Ca 0.00 2.12 -0.16 0.00 -1.95 0.00 0.00 55.36 55.37 1j9s s GLN 278 Cb 0.00 -2.64 -0.11 0.00 -0.22 0.00 0.00 33.01 30.04 1j9s s GLN 278 CO 0.00 -0.60 -0.21 -0.85 -0.25 0.00 0.00 175.29 173.38 1j9s n GLU 279 N -0.12 0.55 -3.96 2.91 0.28 -1.26 -0.89 120.64 118.15 1j9s n GLU 279 Ca 0.05 0.35 -0.21 0.00 -0.16 0.00 0.00 57.16 57.19 1j9s n GLU 279 Cb 0.44 -1.56 -0.17 0.00 1.43 0.00 0.00 31.44 31.59 1j9s n GLU 279 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 1j9s s THR 280 N -2.54 0.42 0.45 3.84 2.01 -1.26 -4.25 115.64 114.31 1j9s s THR 280 Ca -0.31 0.01 0.08 0.00 0.31 0.00 0.00 61.69 61.78 1j9s s THR 280 Cb 0.09 -0.51 0.01 0.00 0.01 0.00 0.00 72.50 72.10 1j9s s THR 280 CO 0.46 0.23 0.49 -1.66 -0.69 0.00 0.00 174.62 173.45 1j9s s TRP 281 N 1.39 2.48 -0.07 4.92 -2.14 -0.33 -4.97 118.94 120.22 1j9s s TRP 281 Ca -0.04 -0.53 0.03 0.00 2.66 0.00 0.00 56.10 58.22 1j9s s TRP 281 Cb -0.13 -2.21 0.01 0.00 -3.10 0.00 0.00 33.47 28.03 1j9s s TRP 281 CO -0.03 -0.37 -0.14 0.12 -2.66 0.00 0.00 176.95 173.87 1j9s s PHE 282 N -2.49 1.62 -0.21 1.66 5.36 -1.26 -2.70 117.98 119.96 1j9s s PHE 282 Ca 0.50 -0.59 0.00 0.00 -0.96 0.00 0.00 56.93 55.89 1j9s s PHE 282 Cb -0.05 -1.15 0.05 0.00 -0.34 0.00 0.00 43.02 41.52 1j9s s PHE 282 CO 0.30 -0.28 -0.07 0.42 -1.46 0.00 0.00 175.22 174.14 1j9s s ILE 283 N 0.53 1.46 0.58 3.12 1.01 -0.72 -4.71 121.20 122.47 1j9s s ILE 283 Ca -0.13 -1.01 -0.18 0.00 0.00 0.00 0.00 60.65 59.33 1j9s s ILE 283 Cb -0.15 -1.65 -0.04 0.00 0.01 0.00 0.00 42.46 40.63 1j9s s ILE 283 CO 0.04 0.04 1.15 -2.16 0.00 0.00 0.00 174.94 174.01 1j9s s PRO 284 N 1.45 3.12 0.27 2.79 0.04 -1.26 -1.72 135.00 139.69 1j9s s PRO 284 Ca -0.03 1.63 -0.30 0.00 0.04 0.00 0.00 61.00 62.34 1j9s s PRO 284 Cb -0.17 -1.97 -0.13 0.00 0.04 0.00 0.00 34.50 32.27 1j9s s PRO 284 CO -0.07 -1.04 1.44 0.41 0.04 0.00 0.00 177.00 177.78 1j9s n GLY 285 N 0.13 0.91 0.44 0.56 0.00 -1.23 -2.06 105.19 103.94 1j9s n GLY 285 Ca 0.12 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.60 1j9s n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j9s n GLY 286 N 1.97 0.88 3.48 -0.02 0.00 0.12 -4.74 105.19 106.88 1j9s n GLY 286 Ca 0.10 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 1j9s n GLY 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9s s ALA 287 N -2.00 0.22 0.18 4.61 0.00 -0.87 -4.77 121.76 119.12 1j9s s ALA 287 Ca 0.00 -1.15 0.08 0.00 0.00 0.00 0.00 51.96 50.89 1j9s s ALA 287 Cb 0.00 1.16 -0.04 0.00 0.00 0.00 0.00 23.12 24.24 1j9s s ALA 287 CO 0.00 -0.78 -0.17 0.00 0.00 0.00 0.00 175.76 174.81 1j9s s ALA 288 N -3.96 2.01 0.16 0.00 0.00 -1.26 -2.14 121.76 116.57 1j9s s ALA 288 Ca 0.27 -1.55 -0.03 0.00 0.00 0.00 0.00 51.96 50.65 1j9s s ALA 288 Cb 0.01 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 1j9s s ALA 288 CO 0.11 0.17 0.13 0.20 0.00 0.00 0.00 175.76 176.37 1j9s s GLY 289 N -2.92 1.02 -0.00 0.00 0.00 0.72 -3.32 107.32 102.83 1j9s s GLY 289 Ca 0.18 -1.43 -0.00 0.00 0.00 0.00 0.00 44.72 43.48 1j9s s GLY 289 CO 0.07 -1.26 0.00 0.00 0.00 0.00 0.00 173.10 171.90 1j9s s ALA 290 N -4.07 -0.00 -0.05 3.20 0.00 -0.99 -0.80 121.76 119.05 1j9s s ALA 290 Ca 0.27 0.01 0.04 0.00 0.00 0.00 0.00 51.96 52.28 1j9s s ALA 290 Cb 0.06 -0.00 -0.00 0.00 0.00 0.00 0.00 23.12 23.18 1j9s s ALA 290 CO 0.05 -0.00 -0.17 0.00 0.00 0.00 0.00 175.76 175.63 1j9s s ALA 291 N 0.01 1.58 -0.15 0.00 0.00 -0.48 -0.62 121.76 122.10 1j9s s ALA 291 Ca -0.00 -0.69 -0.03 0.00 0.00 0.00 0.00 51.96 51.24 1j9s s ALA 291 Cb -0.00 -0.56 -0.02 0.00 0.00 0.00 0.00 23.12 22.54 1j9s s ALA 291 CO -0.00 0.26 -0.06 0.12 0.00 0.00 0.00 175.76 176.08 1j9s s PHE 292 N 0.16 2.98 -0.06 0.00 2.19 0.95 0.23 117.98 124.44 1j9s s PHE 292 Ca -0.07 -0.39 -0.05 0.00 0.33 0.00 0.00 56.93 56.75 1j9s s PHE 292 Cb -0.13 -1.94 0.02 0.00 -1.31 0.00 0.00 43.02 39.66 1j9s s PHE 292 CO 0.03 -0.09 0.15 -0.47 1.83 0.00 0.00 175.22 176.68 1j9s s TYR 293 N 0.39 -0.17 -0.30 10.12 5.04 -0.10 -1.55 117.35 130.79 1j9s s TYR 293 Ca -0.05 0.41 -0.08 0.00 -2.44 0.00 0.00 57.07 54.92 1j9s s TYR 293 Cb -0.15 0.05 0.01 0.00 0.35 0.00 0.00 41.96 42.22 1j9s s TYR 293 CO 0.03 -0.09 0.10 0.99 -1.34 0.00 0.00 175.55 175.25 1j9s s THR 294 N 0.14 4.14 0.26 4.34 2.01 -1.26 -0.09 115.64 125.18 1j9s s THR 294 Ca -0.00 -0.63 -0.30 0.00 0.31 0.00 0.00 61.69 61.07 1j9s s THR 294 Cb -0.02 -3.13 -0.10 0.00 0.01 0.00 0.00 72.50 69.26 1j9s s THR 294 CO -0.00 0.07 1.38 -0.36 -0.69 0.00 0.00 174.62 175.02 1j9s s PHE 295 N 1.53 3.06 -0.07 4.92 0.40 -0.71 -4.87 117.98 122.23 1j9s s PHE 295 Ca 0.03 1.17 0.02 0.00 -0.60 0.00 0.00 56.93 57.55 1j9s s PHE 295 Cb -0.17 -3.75 -0.03 0.00 0.51 0.00 0.00 43.02 39.58 1j9s s PHE 295 CO 0.03 -2.31 0.08 1.04 0.70 0.00 0.00 175.22 174.77 1j9s n GLN 296 N 1.95 4.00 -4.32 0.44 6.02 -1.26 -0.12 117.38 124.09 1j9s n GLN 296 Ca 0.05 -0.01 -0.18 0.00 -0.01 0.00 0.00 57.00 56.85 1j9s n GLN 296 Cb 0.41 -0.77 -0.14 0.00 1.02 0.00 0.00 30.24 30.76 1j9s n GLN 296 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1j9s s GLN 297 N -1.56 0.74 0.66 -1.09 -1.52 -1.26 -4.62 119.66 111.01 1j9s s GLN 297 Ca 0.00 -0.47 -0.07 0.00 -1.95 0.00 0.00 55.36 52.87 1j9s s GLN 297 Cb 0.02 -0.70 0.04 0.00 -0.22 0.00 0.00 33.01 32.14 1j9s s GLN 297 CO 0.10 0.18 0.98 -1.25 -0.25 0.00 0.00 175.29 175.05 1j9s s PRO 298 N -0.60 2.55 0.00 2.91 0.04 -1.26 -4.78 135.00 133.87 1j9s s PRO 298 Ca 0.01 -0.06 0.00 0.00 0.04 0.00 0.00 61.00 60.99 1j9s s PRO 298 Cb -0.05 -2.19 0.00 0.00 0.04 0.00 0.00 34.50 32.30 1j9s s PRO 298 CO 0.00 -1.01 0.00 0.41 0.04 0.00 0.00 177.00 176.44 1j9s n GLY 299 N -2.81 0.15 3.79 0.56 0.00 0.87 -4.92 105.19 102.84 1j9s n GLY 299 Ca 0.06 -2.30 -0.38 0.00 0.00 0.00 0.00 46.02 43.41 1j9s n GLY 299 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1j9s s ILE 300 N -0.26 4.94 0.20 -0.61 2.07 -1.26 -0.76 121.20 125.52 1j9s s ILE 300 Ca 0.00 1.07 0.10 0.00 -1.41 0.00 0.00 60.65 60.41 1j9s s ILE 300 Cb 0.00 -3.84 -0.04 0.00 0.13 0.00 0.00 42.46 38.71 1j9s s ILE 300 CO 0.00 0.49 -0.20 -0.31 -1.91 0.00 0.00 174.94 173.01 1j9s s TYR 301 N -0.58 2.05 0.08 3.50 1.51 -0.06 -4.98 117.35 118.87 1j9s s TYR 301 Ca 0.27 -0.42 0.06 0.00 -1.01 0.00 0.00 57.07 55.97 1j9s s TYR 301 Cb -0.18 -0.99 -0.04 0.00 -0.11 0.00 0.00 41.96 40.65 1j9s s TYR 301 CO 0.15 0.46 -0.06 0.00 -1.11 0.00 0.00 175.55 174.99 1j9s s ALA 302 N -2.08 3.07 -0.15 3.71 0.00 -1.21 -1.72 121.76 123.39 1j9s s ALA 302 Ca 0.20 -1.17 -0.01 0.00 0.00 0.00 0.00 51.96 50.99 1j9s s ALA 302 Cb -0.06 -1.03 0.04 0.00 0.00 0.00 0.00 23.12 22.07 1j9s s ALA 302 CO 0.09 0.66 -0.04 -0.47 0.00 0.00 0.00 175.76 176.00 1j9s s TYR 303 N -1.21 1.48 0.22 0.00 5.04 0.29 -0.43 117.35 122.74 1j9s s TYR 303 Ca 0.22 -0.89 -0.00 0.00 -2.44 0.00 0.00 57.07 53.96 1j9s s TYR 303 Cb -0.11 -1.21 -0.04 0.00 0.35 0.00 0.00 41.96 40.94 1j9s s TYR 303 CO 0.14 -0.56 0.11 0.14 -1.34 0.00 0.00 175.55 174.04 1j9s s VAL 304 N 1.71 0.24 -0.32 3.14 -7.23 -0.63 -0.47 120.40 116.83 1j9s s VAL 304 Ca 0.02 -2.00 -0.22 0.00 -1.81 0.00 0.00 61.98 57.97 1j9s s VAL 304 Cb -0.15 -2.53 -0.00 0.00 0.56 0.00 0.00 36.38 34.26 1j9s s VAL 304 CO -0.08 -0.03 0.74 0.21 -0.31 0.00 0.00 175.10 175.64 1j9s s ASN 305 N -3.22 6.59 0.00 4.85 3.84 -1.05 -1.29 114.94 124.66 1j9s s ASN 305 Ca 0.38 0.52 0.00 0.00 0.21 0.00 0.00 52.86 53.97 1j9s s ASN 305 Cb 0.07 -2.38 0.00 0.00 -0.55 0.00 0.00 41.25 38.39 1j9s s ASN 305 CO 0.12 -0.60 0.45 1.57 -2.79 0.00 0.00 177.10 175.85 1j9s n HIS 306 N 6.16 0.00 -3.11 0.43 -0.00 0.10 -4.02 115.22 114.78 1j9s n HIS 306 Ca 0.02 -0.07 -0.44 0.00 -0.00 0.00 0.00 57.72 57.23 1j9s n HIS 306 Cb 0.48 -0.10 -0.05 0.00 -0.00 0.00 0.00 29.99 30.32 1j9s n HIS 306 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1j9s s ASN 307 N -0.02 6.21 0.61 0.26 3.84 -1.26 -4.89 114.94 119.68 1j9s s ASN 307 Ca 0.00 -1.08 0.36 0.00 0.21 0.00 0.00 52.86 52.35 1j9s s ASN 307 Cb 0.00 -2.31 1.94 0.00 -0.55 0.00 0.00 41.25 40.33 1j9s s ASN 307 CO 0.00 -1.02 2.09 -0.07 -2.79 0.00 0.00 177.10 175.30 1j9s h LEU 308 N 9.97 0.00 -0.02 3.21 3.38 -1.99 -0.16 115.31 129.70 1j9s h LEU 308 Ca -0.28 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.50 1j9s h LEU 308 Cb 1.09 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.85 1j9s h LEU 308 CO 1.03 0.00 -0.71 0.40 0.09 0.00 0.00 178.44 179.26 1j9s h ILE 309 N 0.00 1.37 -0.39 1.22 2.04 -1.90 -0.12 117.51 119.74 1j9s h ILE 309 Ca 0.00 -2.08 -0.06 0.00 1.00 0.00 0.00 64.86 63.71 1j9s h ILE 309 Cb 0.24 2.46 -0.02 0.00 -0.74 0.00 0.00 36.82 38.76 1j9s h ILE 309 CO 0.00 0.62 -0.03 -0.33 0.00 0.00 0.00 178.15 178.41 1j9s h GLU 310 N 0.08 0.63 -0.00 2.37 5.08 -1.38 0.16 114.58 121.53 1j9s h GLU 310 Ca -0.08 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 1j9s h GLU 310 Cb 1.39 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.57 1j9s h GLU 310 CO 0.14 0.67 -0.06 0.00 -1.00 0.00 0.00 179.01 178.76 1j9s h ALA 311 N 1.38 0.01 0.00 3.43 0.00 -1.27 -1.37 119.26 121.43 1j9s h ALA 311 Ca 0.12 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1j9s h ALA 311 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1j9s h ALA 311 CO 0.02 -0.06 -1.30 1.19 0.00 0.00 0.00 179.25 179.10 1j9s n PHE 312 N -4.66 0.02 -0.09 0.00 3.01 -0.06 -2.65 117.46 113.03 1j9s n PHE 312 Ca -0.09 0.01 -0.13 0.00 1.01 0.00 0.00 57.45 58.24 1j9s n PHE 312 Cb 0.41 -0.20 -0.09 0.00 -0.01 0.00 0.00 39.48 39.59 1j9s n PHE 312 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1j9s n GLU 313 N -1.78 0.48 0.05 -1.08 -0.58 0.46 -4.71 120.64 113.48 1j9s n GLU 313 Ca 0.01 0.11 0.11 0.00 -0.42 0.00 0.00 57.16 56.98 1j9s n GLU 313 Cb 0.41 -1.37 0.05 0.00 -0.57 0.00 0.00 31.44 29.96 1j9s n GLU 313 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1j9s n LEU 314 N -3.04 0.65 0.00 -4.62 4.32 -0.50 -5.01 117.00 108.79 1j9s n LEU 314 Ca -0.33 0.11 0.00 0.00 -0.02 0.00 0.00 56.01 55.77 1j9s n LEU 314 Cb 0.85 -0.11 0.00 0.00 -1.62 0.00 0.00 43.42 42.54 1j9s n LEU 314 CO 0.19 -0.02 0.00 0.61 -1.22 0.00 0.00 177.39 176.94 1j9s n GLY 315 N 1.32 0.99 2.69 -0.72 0.00 -0.70 -1.51 105.19 107.26 1j9s n GLY 315 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1j9s n GLY 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9s n ALA 316 N -0.53 5.83 -3.59 4.61 0.00 0.99 -4.35 120.51 123.48 1j9s n ALA 316 Ca 0.00 -3.93 -0.12 0.00 0.00 0.00 0.00 53.44 49.39 1j9s n ALA 316 Cb 0.00 -3.38 -0.13 0.00 0.00 0.00 0.00 19.45 15.94 1j9s n ALA 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j9s s ALA 317 N 2.35 -0.58 0.32 0.00 0.00 -1.25 -2.51 121.76 120.09 1j9s s ALA 317 Ca 0.49 0.94 0.03 0.00 0.00 0.00 0.00 51.96 53.42 1j9s s ALA 317 Cb 0.14 -0.59 -0.06 0.00 0.00 0.00 0.00 23.12 22.61 1j9s s ALA 317 CO -0.07 -0.18 0.07 0.00 0.00 0.00 0.00 175.76 175.58 1j9s s ALA 318 N 1.01 2.26 0.21 0.00 0.00 0.38 -4.53 121.76 121.09 1j9s s ALA 318 Ca -0.07 -1.98 0.08 0.00 0.00 0.00 0.00 51.96 49.99 1j9s s ALA 318 Cb -0.08 0.74 -0.05 0.00 0.00 0.00 0.00 23.12 23.73 1j9s s ALA 318 CO -0.07 -0.34 -0.15 -1.01 0.00 0.00 0.00 175.76 174.19 1j9s s HIS 319 N -3.38 1.75 -0.06 0.00 3.76 0.12 -0.54 115.29 116.94 1j9s s HIS 319 Ca 0.36 -0.55 0.02 0.00 -0.15 0.00 0.00 55.06 54.74 1j9s s HIS 319 Cb 0.08 -0.81 0.02 0.00 1.11 0.00 0.00 32.58 32.98 1j9s s HIS 319 CO 0.15 0.38 -0.09 -0.06 -0.85 0.00 0.00 174.74 174.28 1j9s s PHE 320 N -2.87 1.13 -0.23 1.40 0.08 -0.70 -1.28 117.98 115.51 1j9s s PHE 320 Ca 0.22 -0.39 -0.06 0.00 0.12 0.00 0.00 56.93 56.83 1j9s s PHE 320 Cb -0.01 -0.89 -0.02 0.00 -0.57 0.00 0.00 43.02 41.53 1j9s s PHE 320 CO 0.07 -0.24 0.02 0.15 -0.10 0.00 0.00 175.22 175.12 1j9s s LYS 321 N 0.80 3.56 -0.13 0.44 1.02 0.46 -0.88 119.74 125.01 1j9s s LYS 321 Ca -0.13 -0.53 0.02 0.00 0.02 0.00 0.00 55.97 55.35 1j9s s LYS 321 Cb -0.15 -3.19 -0.00 0.00 -0.52 0.00 0.00 37.83 33.97 1j9s s LYS 321 CO 0.02 -0.16 -0.18 0.08 -0.92 0.00 0.00 175.35 174.19 1j9s s VAL 322 N 1.48 2.53 0.45 3.17 1.01 0.06 -2.39 120.40 126.70 1j9s s VAL 322 Ca 0.05 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.17 1j9s s VAL 322 Cb -0.15 -2.03 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 1j9s s VAL 322 CO 0.01 0.54 0.71 0.42 0.00 0.00 0.00 175.10 176.78 1j9s s THR 323 N 0.51 4.75 -3.20 3.92 -4.23 -0.62 -0.09 115.64 116.69 1j9s s THR 323 Ca -0.12 -0.09 0.00 0.00 -1.18 0.00 0.00 61.69 60.30 1j9s s THR 323 Cb -0.16 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 69.89 1j9s s THR 323 CO 0.05 -0.67 0.00 0.61 -0.54 0.00 0.00 174.62 174.06 1j9s n GLY 324 N -2.13 0.87 3.83 3.99 0.00 -1.26 -0.68 105.19 109.80 1j9s n GLY 324 Ca -0.01 -2.07 -0.37 0.00 0.00 0.00 0.00 46.02 43.57 1j9s n GLY 324 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1j9s s GLU 325 N -1.12 3.73 0.47 1.61 2.12 -1.26 -4.72 118.70 119.53 1j9s s GLU 325 Ca 0.00 -0.05 -0.23 0.00 0.36 0.00 0.00 54.97 55.04 1j9s s GLU 325 Cb 0.00 -3.26 -0.07 0.00 0.26 0.00 0.00 34.13 31.06 1j9s s GLU 325 CO 0.00 0.62 1.22 -0.46 -0.54 0.00 0.00 175.26 176.11 1j9s s TRP 326 N -0.62 2.76 -0.47 5.30 -0.11 -1.26 -4.46 118.94 120.07 1j9s s TRP 326 Ca 0.15 1.49 -0.03 0.00 1.22 0.00 0.00 56.10 58.92 1j9s s TRP 326 Cb -0.13 -3.51 0.13 0.00 -1.50 0.00 0.00 33.47 28.46 1j9s s TRP 326 CO 0.04 -1.86 0.28 1.21 -4.62 0.00 0.00 176.95 172.00 1j9s s ASN 327 N -1.17 5.29 0.38 5.86 3.84 -1.26 -4.96 114.94 122.91 1j9s s ASN 327 Ca 0.64 -2.25 0.28 0.00 0.21 0.00 0.00 52.86 51.73 1j9s s ASN 327 Cb -0.32 -1.85 1.26 0.00 -0.55 0.00 0.00 41.25 39.79 1j9s s ASN 327 CO 0.40 -0.51 1.84 0.44 -2.79 0.00 0.00 177.10 176.48 1j9s h ASP 328 N 7.79 0.00 -0.16 -4.21 5.19 -1.96 -2.44 116.42 120.64 1j9s h ASP 328 Ca -0.10 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.26 1j9s h ASP 328 Cb 1.02 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.53 1j9s h ASP 328 CO 0.71 0.00 -0.09 -0.78 -3.12 0.00 0.00 179.24 175.96 1j9s h ASP 329 N 0.00 0.36 -0.44 6.45 -0.00 -2.01 -3.22 116.42 117.55 1j9s h ASP 329 Ca 0.00 -0.43 -0.14 0.00 -0.00 0.00 0.00 57.03 56.46 1j9s h ASP 329 Cb 0.30 -0.10 -0.01 0.00 -0.00 0.00 0.00 39.33 39.52 1j9s h ASP 329 CO 0.00 0.71 -0.28 -0.07 -0.00 0.00 0.00 179.24 179.60 1j9s h LEU 330 N 0.01 1.01 -7.08 2.28 3.38 -1.91 -3.45 115.31 109.55 1j9s h LEU 330 Ca 0.03 -0.42 -0.06 0.00 0.09 0.00 0.00 57.88 57.52 1j9s h LEU 330 Cb 0.58 -0.28 -0.22 0.00 0.09 0.00 0.00 40.66 40.83 1j9s h LEU 330 CO 0.03 1.21 0.04 -0.32 0.09 0.00 0.00 178.44 179.49 1j9s s MET 331 N -4.57 0.76 -0.18 1.13 0.00 -0.95 -5.14 119.30 110.36 1j9s s MET 331 Ca -0.11 0.86 -0.26 0.00 0.00 0.00 0.00 55.69 56.17 1j9s s MET 331 Cb 0.12 0.37 0.07 0.00 0.00 0.00 0.00 34.83 35.39 1j9s s MET 331 CO 0.87 -0.10 0.68 -0.08 0.00 0.00 0.00 175.02 176.39 1j9s s THR 332 N 0.26 0.00 -0.58 10.11 -1.32 -1.25 -3.93 115.64 118.93 1j9s s THR 332 Ca -0.01 -0.01 -0.25 0.00 -1.21 0.00 0.00 61.69 60.21 1j9s s THR 332 Cb -0.04 -0.97 0.04 0.00 -1.51 0.00 0.00 72.50 70.02 1j9s s THR 332 CO 0.01 -0.01 1.00 -0.55 -2.21 0.00 0.00 174.62 172.86 1j9s s SER 333 N -0.26 6.32 0.14 8.08 0.15 -1.26 -4.87 113.70 122.01 1j9s s SER 333 Ca -0.04 -0.37 -0.11 0.00 0.70 0.00 0.00 55.95 56.13 1j9s s SER 333 Cb -0.03 -2.46 -0.04 0.00 -1.71 0.00 0.00 66.02 61.78 1j9s s SER 333 CO 0.04 -1.32 1.48 0.58 1.20 0.00 0.00 173.24 175.22 1j9s h VAL 334 N 6.03 1.27 -3.10 4.45 2.07 -2.02 -3.41 116.25 121.55 1j9s h VAL 334 Ca -0.26 -1.55 -0.45 0.00 0.82 0.00 0.00 66.70 65.26 1j9s h VAL 334 Cb 1.07 1.36 -0.41 0.00 -1.52 0.00 0.00 31.29 31.79 1j9s h VAL 334 CO 1.12 0.52 -0.75 -0.22 0.02 0.00 0.00 177.57 178.27 1j9s s LEU 335 N -8.90 0.37 0.67 2.57 2.96 -1.26 -5.14 118.68 109.94 1j9s s LEU 335 Ca -0.11 -0.52 -0.16 0.00 -0.22 0.00 0.00 54.13 53.12 1j9s s LEU 335 Cb 0.11 -0.25 0.01 0.00 0.50 0.00 0.00 46.19 46.55 1j9s s LEU 335 CO 0.88 -0.33 1.16 0.00 -1.32 0.00 0.00 176.35 176.75 1j9s s ALA 336 N 2.12 2.36 -0.35 5.97 0.00 -1.26 -4.85 121.76 125.75 1j9s s ALA 336 Ca 0.02 0.77 -0.43 0.00 0.00 0.00 0.00 51.96 52.32 1j9s s ALA 336 Cb -0.15 -3.40 -0.18 0.00 0.00 0.00 0.00 23.12 19.39 1j9s s ALA 336 CO -0.08 -1.45 1.64 -2.30 0.00 0.00 0.00 175.76 173.57 1j9s n PRO 337 N -2.32 0.61 -3.65 0.00 -0.02 -1.26 -4.93 135.00 123.44 1j9s n PRO 337 Ca 0.12 0.23 -0.14 0.00 -2.02 0.00 0.00 63.50 61.69 1j9s n PRO 337 Cb 0.51 -1.82 -0.07 0.00 -0.02 0.00 0.00 33.50 32.10 1j9s n PRO 337 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1j9s s SER 338 N 3.07 -0.35 0.00 2.55 1.04 -1.26 -5.29 113.70 113.45 1j9s s SER 338 Ca 1.00 0.17 0.00 0.00 0.48 0.00 0.00 55.95 57.61 1j9s s SER 338 Cb -1.26 0.43 0.00 0.00 0.10 0.00 0.00 66.02 65.29 1j9s s SER 338 CO 0.72 -0.61 0.00 0.61 0.98 0.00 0.00 173.24 174.93