#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j9t s THR 5 N 0.00 2.66 0.33 0.00 -4.23 -1.26 -4.88 115.64 108.26 1j9t s THR 5 Ca 0.00 0.09 0.02 0.00 -1.18 0.00 0.00 61.69 60.62 1j9t s THR 5 Cb 0.00 -3.19 0.28 0.00 1.34 0.00 0.00 72.50 70.93 1j9t s THR 5 CO 0.00 -0.23 1.96 0.00 -0.54 0.00 0.00 174.62 175.80 1j9t h ALA 6 N -0.76 1.56 -0.23 3.99 0.00 -2.05 -1.54 119.26 120.22 1j9t h ALA 6 Ca -0.45 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.36 1j9t h ALA 6 Cb 1.30 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1j9t h ALA 6 CO 0.64 0.35 -0.11 0.00 0.00 0.00 0.00 179.25 180.13 1j9t h ALA 7 N 1.55 0.32 -0.89 0.00 0.00 -1.98 -1.06 119.26 117.20 1j9t h ALA 7 Ca 0.32 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1j9t h ALA 7 Cb 0.09 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1j9t h ALA 7 CO -0.10 0.17 0.54 0.93 0.00 0.00 0.00 179.25 180.80 1j9t h GLU 8 N 0.19 1.20 -0.33 0.00 5.08 -1.81 -2.01 114.58 116.91 1j9t h GLU 8 Ca 0.05 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 1j9t h GLU 8 Cb 0.61 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1j9t h GLU 8 CO 0.03 0.84 -0.06 0.82 -1.00 0.00 0.00 179.01 179.64 1j9t h ILE 9 N 1.22 1.28 0.00 3.13 2.04 -1.19 -2.70 117.51 121.29 1j9t h ILE 9 Ca 0.32 -1.09 0.00 0.00 1.00 0.00 0.00 64.86 65.09 1j9t h ILE 9 Cb -0.06 1.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 1j9t h ILE 9 CO -0.06 0.36 0.00 0.00 0.00 0.00 0.00 178.15 178.44 1j9t h ALA 10 N 0.81 1.00 -0.01 1.87 0.00 -0.61 -0.69 119.26 121.64 1j9t h ALA 10 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1j9t h ALA 10 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1j9t h ALA 10 CO 0.03 0.00 -0.52 0.00 0.00 0.00 0.00 179.25 178.76 1j9t n ALA 11 N -2.06 3.66 -1.76 0.00 0.00 -0.81 -4.95 120.51 114.60 1j9t n ALA 11 Ca -0.02 -0.50 -0.35 0.00 0.00 0.00 0.00 53.44 52.56 1j9t n ALA 11 Cb 0.10 -0.96 0.01 0.00 0.00 0.00 0.00 19.45 18.60 1j9t n ALA 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1j9t s LEU 12 N -2.70 3.71 0.53 0.00 1.43 -0.27 -4.97 118.68 116.40 1j9t s LEU 12 Ca 0.17 2.25 -0.20 0.00 -1.03 0.00 0.00 54.13 55.31 1j9t s LEU 12 Cb 0.18 -4.59 -0.06 0.00 0.03 0.00 0.00 46.19 41.75 1j9t s LEU 12 CO 0.64 -1.37 1.17 -2.16 0.23 0.00 0.00 176.35 174.86 1j9t s PRO 13 N -3.33 3.40 0.20 1.29 0.04 -1.26 -4.72 135.00 130.62 1j9t s PRO 13 Ca 0.74 1.73 0.07 0.00 0.04 0.00 0.00 61.00 63.58 1j9t s PRO 13 Cb -0.26 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.12 1j9t s PRO 13 CO 0.30 -0.84 0.08 1.03 0.04 0.00 0.00 177.00 177.60 1j9t s ARG 14 N -3.10 2.63 -0.18 4.56 0.52 -1.26 -1.44 118.95 120.69 1j9t s ARG 14 Ca 0.71 -1.08 -0.05 0.00 -0.52 0.00 0.00 55.73 54.79 1j9t s ARG 14 Cb -0.27 -2.45 0.09 0.00 0.52 0.00 0.00 34.95 32.84 1j9t s ARG 14 CO 0.31 0.44 0.33 -1.14 0.02 0.00 0.00 175.30 175.27 1j9t s GLN 15 N -3.28 0.24 -0.22 3.54 0.74 -0.85 -4.93 119.66 114.90 1j9t s GLN 15 Ca 0.30 0.80 -0.23 0.00 0.05 0.00 0.00 55.36 56.28 1j9t s GLN 15 Cb -0.09 -0.02 -0.01 0.00 1.10 0.00 0.00 33.01 33.98 1j9t s GLN 15 CO 0.21 -0.34 0.75 0.15 -0.55 0.00 0.00 175.29 175.51 1j9t s LYS 16 N 2.50 4.20 -0.10 1.67 1.02 -1.26 -0.67 119.74 127.11 1j9t s LYS 16 Ca 0.02 0.82 -0.04 0.00 0.02 0.00 0.00 55.97 56.79 1j9t s LYS 16 Cb -0.13 -3.61 -0.04 0.00 -0.52 0.00 0.00 37.83 33.53 1j9t s LYS 16 CO -0.11 -0.39 0.06 0.08 -0.92 0.00 0.00 175.35 174.07 1j9t s VAL 17 N 2.41 4.82 -0.30 3.17 1.01 -0.26 -4.95 120.40 126.30 1j9t s VAL 17 Ca 0.33 -0.05 -0.08 0.00 0.00 0.00 0.00 61.98 62.17 1j9t s VAL 17 Cb -0.16 -3.06 -0.00 0.00 0.00 0.00 0.00 36.38 33.16 1j9t s VAL 17 CO 0.09 0.61 0.12 -1.83 0.00 0.00 0.00 175.10 174.10 1j9t s GLU 18 N -0.95 3.30 0.51 2.72 1.03 -1.26 -4.64 118.70 119.41 1j9t s GLU 18 Ca 0.14 -0.73 -0.20 0.00 0.03 0.00 0.00 54.97 54.21 1j9t s GLU 18 Cb -0.12 -3.48 -0.07 0.00 -0.80 0.00 0.00 34.13 29.66 1j9t s GLU 18 CO 0.03 -0.40 1.07 -0.51 -1.33 0.00 0.00 175.26 174.12 1j9t s LEU 19 N 1.58 3.79 0.14 1.83 1.43 -1.26 -4.73 118.68 121.47 1j9t s LEU 19 Ca 0.04 2.01 0.10 0.00 -1.03 0.00 0.00 54.13 55.25 1j9t s LEU 19 Cb -0.17 -4.57 -0.04 0.00 0.03 0.00 0.00 46.19 41.45 1j9t s LEU 19 CO 0.05 -0.96 -0.23 0.68 0.23 0.00 0.00 176.35 176.12 1j9t s VAL 20 N -1.93 2.05 0.37 -1.59 -7.23 -1.26 -4.99 120.40 105.82 1j9t s VAL 20 Ca 0.69 -1.80 -0.27 0.00 -1.81 0.00 0.00 61.98 58.79 1j9t s VAL 20 Cb -0.19 -1.88 -0.09 0.00 0.56 0.00 0.00 36.38 34.78 1j9t s VAL 20 CO 0.23 -0.08 1.28 -1.81 -0.31 0.00 0.00 175.10 174.41 1j9t s ASP 21 N -2.28 6.57 0.79 4.85 -0.00 -1.26 -4.63 116.67 120.70 1j9t s ASP 21 Ca 0.14 2.61 -0.13 0.00 -0.00 0.00 0.00 52.55 55.17 1j9t s ASP 21 Cb -0.09 -2.64 0.07 0.00 -0.00 0.00 0.00 42.92 40.27 1j9t s ASP 21 CO 0.07 -0.66 1.20 -2.84 -0.00 0.00 0.00 175.17 172.93 1j9t s PRO 22 N -2.03 1.79 0.00 8.23 0.02 -1.26 -2.40 135.00 139.35 1j9t s PRO 22 Ca 0.53 1.71 0.24 0.00 0.02 0.00 0.00 61.00 63.50 1j9t s PRO 22 Cb -0.38 -1.80 1.36 0.00 0.02 0.00 0.00 34.50 33.70 1j9t s PRO 22 CO 0.49 -2.09 1.88 -0.35 -0.33 0.00 0.00 177.00 176.60 1j9t n PRO 23 N -3.18 1.07 -1.70 5.54 -0.04 -1.26 -5.06 135.00 130.38 1j9t n PRO 23 Ca 0.13 -0.11 -0.31 0.00 -0.04 0.00 0.00 63.50 63.18 1j9t n PRO 23 Cb 0.51 -1.38 0.04 0.00 -0.04 0.00 0.00 33.50 32.63 1j9t n PRO 23 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1j9t s PHE 24 N -1.99 3.27 -0.04 0.54 0.40 -1.01 -0.35 117.98 118.81 1j9t s PHE 24 Ca 0.35 1.30 0.04 0.00 -0.60 0.00 0.00 56.93 58.02 1j9t s PHE 24 Cb 0.17 -2.88 -0.00 0.00 0.51 0.00 0.00 43.02 40.82 1j9t s PHE 24 CO 0.28 -1.11 -0.14 0.08 0.70 0.00 0.00 175.22 175.02 1j9t s VAL 25 N -3.14 1.16 0.74 -0.44 1.01 -1.26 -4.66 120.40 113.81 1j9t s VAL 25 Ca 0.57 -0.57 -0.16 0.00 0.00 0.00 0.00 61.98 61.83 1j9t s VAL 25 Cb -0.13 -1.01 -0.01 0.00 0.00 0.00 0.00 36.38 35.23 1j9t s VAL 25 CO 0.54 0.34 0.74 0.00 0.00 0.00 0.00 175.10 176.73 1j9t n HIS 26 N 3.21 -0.12 -1.68 5.22 1.44 -1.26 -4.88 115.22 117.14 1j9t n HIS 26 Ca -0.18 0.37 -0.43 0.00 -2.01 0.00 0.00 57.72 55.46 1j9t n HIS 26 Cb 0.53 -1.99 -0.01 0.00 0.12 0.00 0.00 29.99 28.65 1j9t n HIS 26 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1j9t n ALA 27 N -2.57 1.12 -3.82 1.59 0.00 -1.26 -4.98 120.51 110.60 1j9t n ALA 27 Ca 0.11 0.38 -0.05 0.00 0.00 0.00 0.00 53.44 53.88 1j9t n ALA 27 Cb 0.50 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.71 1j9t n ALA 27 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1j9t s HIS 28 N -0.84 -0.04 -0.10 0.00 -3.43 -1.26 -5.01 115.29 104.60 1j9t s HIS 28 Ca 0.59 -0.39 0.03 0.00 -0.80 0.00 0.00 55.06 54.49 1j9t s HIS 28 Cb -0.60 0.71 -0.00 0.00 -1.43 0.00 0.00 32.58 31.25 1j9t s HIS 28 CO 0.59 -1.07 -0.22 0.45 -2.00 0.00 0.00 174.74 172.49 1j9t s SER 29 N -3.08 3.27 0.15 7.38 0.15 -1.26 -5.01 113.70 115.29 1j9t s SER 29 Ca 0.15 -0.51 -0.17 0.00 0.70 0.00 0.00 55.95 56.12 1j9t s SER 29 Cb -0.03 -1.40 0.00 0.00 -1.71 0.00 0.00 66.02 62.88 1j9t s SER 29 CO 0.06 0.17 1.81 1.56 1.20 0.00 0.00 173.24 178.04 1j9t h GLN 30 N 6.65 0.50 -6.08 5.44 4.20 -1.97 -3.40 115.11 120.45 1j9t h GLN 30 Ca -0.21 -0.03 -0.58 0.00 0.06 0.00 0.00 58.65 57.89 1j9t h GLN 30 Cb 1.23 -0.11 -0.05 0.00 0.30 0.00 0.00 27.48 28.84 1j9t h GLN 30 CO 0.49 0.34 -0.07 0.08 -0.67 0.00 0.00 178.83 179.00 1j9t s VAL 31 N -6.15 4.90 0.19 -0.54 1.01 -1.26 -3.60 120.40 114.94 1j9t s VAL 31 Ca -0.13 1.14 -0.32 0.00 0.00 0.00 0.00 61.98 62.66 1j9t s VAL 31 Cb 0.11 -3.87 -0.12 0.00 0.00 0.00 0.00 36.38 32.49 1j9t s VAL 31 CO 0.72 0.48 1.70 0.00 0.00 0.00 0.00 175.10 178.00 1j9t n ALA 32 N 2.36 2.43 -3.15 5.51 0.00 0.79 -4.94 120.51 123.51 1j9t n ALA 32 Ca -0.09 0.40 -0.45 0.00 0.00 0.00 0.00 53.44 53.30 1j9t n ALA 32 Cb 0.51 -2.49 -0.03 0.00 0.00 0.00 0.00 19.45 17.44 1j9t n ALA 32 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1j9t s GLU 33 N 1.26 3.47 0.00 0.00 2.02 -1.26 -4.93 118.70 119.26 1j9t s GLU 33 Ca 0.77 -1.98 0.00 0.00 0.02 0.00 0.00 54.97 53.78 1j9t s GLU 33 Cb -0.55 -4.55 0.00 0.00 0.10 0.00 0.00 34.13 29.13 1j9t s GLU 33 CO 0.34 -1.50 0.00 0.41 0.02 0.00 0.00 175.26 174.53 1j9t n GLY 34 N 4.77 -0.17 2.41 -1.39 0.00 -1.26 -5.01 105.19 104.55 1j9t n GLY 34 Ca 0.12 -1.86 -0.20 0.00 0.00 0.00 0.00 46.02 44.07 1j9t n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j9t n GLY 35 N -0.22 -2.41 3.56 -0.02 0.00 -1.26 -4.96 105.19 99.88 1j9t n GLY 35 Ca 0.00 -1.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 1j9t n GLY 35 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1j9t n PRO 36 N -3.59 1.08 -3.99 1.61 -0.02 -1.26 -5.00 135.00 123.83 1j9t n PRO 36 Ca 0.10 0.39 -0.10 0.00 -2.02 0.00 0.00 63.50 61.88 1j9t n PRO 36 Cb 0.40 -1.81 -0.07 0.00 -0.02 0.00 0.00 33.50 31.99 1j9t n PRO 36 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1j9t s LYS 37 N -1.76 1.22 -0.44 -0.52 -2.85 -1.26 -4.37 119.74 109.76 1j9t s LYS 37 Ca 0.62 -1.24 -0.17 0.00 -1.00 0.00 0.00 55.97 54.19 1j9t s LYS 37 Cb -0.62 0.38 0.03 0.00 -2.06 0.00 0.00 37.83 35.57 1j9t s LYS 37 CO 0.58 -0.45 0.45 0.08 0.10 0.00 0.00 175.35 176.10 1j9t s VAL 38 N -4.00 5.09 -0.17 1.79 1.01 -0.52 -1.19 120.40 122.41 1j9t s VAL 38 Ca 0.20 -0.49 -0.20 0.00 0.00 0.00 0.00 61.98 61.49 1j9t s VAL 38 Cb 0.03 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.30 1j9t s VAL 38 CO 0.03 -0.49 0.60 -0.69 0.00 0.00 0.00 175.10 174.55 1j9t s VAL 39 N 2.11 5.06 -0.14 2.92 1.01 0.43 -2.00 120.40 129.78 1j9t s VAL 39 Ca 0.11 1.16 -0.06 0.00 0.00 0.00 0.00 61.98 63.19 1j9t s VAL 39 Cb -0.18 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 1j9t s VAL 39 CO 0.12 0.17 0.06 -1.61 0.00 0.00 0.00 175.10 173.85 1j9t s GLU 40 N 1.53 3.55 0.09 2.72 2.02 0.16 -0.92 118.70 127.84 1j9t s GLU 40 Ca 0.29 -0.31 0.03 0.00 0.02 0.00 0.00 54.97 55.01 1j9t s GLU 40 Cb -0.16 -3.08 -0.03 0.00 0.10 0.00 0.00 34.13 30.95 1j9t s GLU 40 CO 0.11 0.53 -0.09 -0.06 0.02 0.00 0.00 175.26 175.77 1j9t s PHE 41 N -0.36 0.98 -0.03 1.61 0.40 -0.63 -1.10 117.98 118.84 1j9t s PHE 41 Ca 0.09 -0.65 0.01 0.00 -0.60 0.00 0.00 56.93 55.78 1j9t s PHE 41 Cb -0.12 -0.55 0.02 0.00 0.51 0.00 0.00 43.02 42.88 1j9t s PHE 41 CO 0.02 -0.03 -0.02 0.99 0.70 0.00 0.00 175.22 176.87 1j9t s THR 42 N -2.33 0.33 -0.04 0.64 2.01 -1.26 -0.80 115.64 114.20 1j9t s THR 42 Ca 0.03 -0.04 0.01 0.00 0.31 0.00 0.00 61.69 61.99 1j9t s THR 42 Cb -0.04 -0.37 0.02 0.00 0.01 0.00 0.00 72.50 72.13 1j9t s THR 42 CO -0.00 0.16 -0.02 -0.04 -0.69 0.00 0.00 174.62 174.02 1j9t s MET 43 N 0.73 0.56 -0.19 4.92 -1.94 -0.26 -4.91 119.30 118.22 1j9t s MET 43 Ca -0.08 -0.02 -0.09 0.00 -1.71 0.00 0.00 55.69 53.78 1j9t s MET 43 Cb -0.11 -0.65 -0.05 0.00 2.01 0.00 0.00 34.83 36.03 1j9t s MET 43 CO -0.01 -0.10 0.12 0.08 -0.01 0.00 0.00 175.02 175.10 1j9t s VAL 44 N 0.92 5.29 0.06 -6.03 1.01 -1.26 -1.36 120.40 119.03 1j9t s VAL 44 Ca -0.11 0.15 -0.28 0.00 0.00 0.00 0.00 61.98 61.74 1j9t s VAL 44 Cb -0.14 -3.40 -0.05 0.00 0.00 0.00 0.00 36.38 32.79 1j9t s VAL 44 CO -0.01 0.46 0.90 -0.63 0.00 0.00 0.00 175.10 175.83 1j9t s ILE 45 N 0.22 4.66 -0.15 2.22 1.01 0.29 -1.46 121.20 127.98 1j9t s ILE 45 Ca 0.08 1.92 -0.00 0.00 0.00 0.00 0.00 60.65 62.65 1j9t s ILE 45 Cb -0.11 -4.26 0.03 0.00 0.01 0.00 0.00 42.46 38.13 1j9t s ILE 45 CO -0.01 0.30 -0.08 -1.61 0.00 0.00 0.00 174.94 173.53 1j9t s GLU 46 N 0.22 1.73 -0.29 2.79 0.41 -0.48 -4.38 118.70 118.70 1j9t s GLU 46 Ca 0.45 -0.51 -0.18 0.00 -0.41 0.00 0.00 54.97 54.32 1j9t s GLU 46 Cb -0.22 -1.98 -0.02 0.00 -1.78 0.00 0.00 34.13 30.13 1j9t s GLU 46 CO 0.27 -0.35 0.52 -1.21 -0.49 0.00 0.00 175.26 174.01 1j9t s GLU 47 N 1.59 3.91 0.09 1.61 2.02 -1.26 -1.26 118.70 125.39 1j9t s GLU 47 Ca 0.02 0.16 -0.17 0.00 0.02 0.00 0.00 54.97 55.01 1j9t s GLU 47 Cb -0.14 -3.71 0.03 0.00 0.10 0.00 0.00 34.13 30.41 1j9t s GLU 47 CO -0.09 -0.47 0.40 -1.59 0.02 0.00 0.00 175.26 173.53 1j9t s LYS 48 N 2.37 0.99 0.15 1.61 -2.85 -0.23 -5.00 119.74 116.78 1j9t s LYS 48 Ca 0.21 -0.57 -0.28 0.00 -1.00 0.00 0.00 55.97 54.34 1j9t s LYS 48 Cb -0.15 0.44 -0.07 0.00 -2.06 0.00 0.00 37.83 35.98 1j9t s LYS 48 CO 0.11 -0.36 0.86 0.15 0.10 0.00 0.00 175.35 176.20 1j9t s LYS 49 N -3.21 4.66 0.04 1.78 1.02 -1.26 -0.46 119.74 122.31 1j9t s LYS 49 Ca -0.01 1.30 0.05 0.00 0.02 0.00 0.00 55.97 57.33 1j9t s LYS 49 Cb 0.01 -3.31 -0.02 0.00 -0.52 0.00 0.00 37.83 33.98 1j9t s LYS 49 CO -0.08 0.42 -0.15 0.96 -0.92 0.00 0.00 175.35 175.59 1j9t s ILE 50 N -0.70 1.16 -0.28 2.17 -4.36 -0.74 -4.91 121.20 113.54 1j9t s ILE 50 Ca 0.40 -1.04 -0.10 0.00 -0.26 0.00 0.00 60.65 59.65 1j9t s ILE 50 Cb -0.23 -1.05 -0.03 0.00 1.25 0.00 0.00 42.46 42.39 1j9t s ILE 50 CO 0.28 0.00 0.15 -0.69 0.24 0.00 0.00 174.94 174.92 1j9t s VAL 51 N -0.88 4.86 -1.53 8.37 1.01 -1.26 -1.71 120.40 129.26 1j9t s VAL 51 Ca 0.02 -0.09 0.23 0.00 0.00 0.00 0.00 61.98 62.13 1j9t s VAL 51 Cb -0.08 -3.36 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 1j9t s VAL 51 CO 0.01 0.21 1.11 2.30 0.00 0.00 0.00 175.10 178.74 1j9t n ILE 52 N 5.01 0.00 -4.07 2.22 -5.35 -0.29 -4.82 119.36 112.06 1j9t n ILE 52 Ca -0.14 -0.12 -0.13 0.00 -0.27 0.00 0.00 62.75 62.08 1j9t n ILE 52 Cb 0.51 0.96 -0.05 0.00 -1.74 0.00 0.00 39.64 39.32 1j9t n ILE 52 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 1j9t s ASP 53 N -2.72 0.54 0.00 7.28 3.84 -1.26 -0.62 116.67 123.73 1j9t s ASP 53 Ca 0.15 -1.32 0.19 0.00 -0.00 0.00 0.00 52.55 51.57 1j9t s ASP 53 Cb 0.17 0.62 1.13 0.00 -1.38 0.00 0.00 42.92 43.46 1j9t s ASP 53 CO 0.69 -1.22 1.69 -0.90 -0.00 0.00 0.00 175.17 175.42 1j9t n ASP 54 N -1.02 0.00 -1.21 2.11 5.68 -1.26 -2.65 116.55 118.21 1j9t n ASP 54 Ca 0.00 -1.30 0.11 0.00 -0.50 0.00 0.00 54.79 53.11 1j9t n ASP 54 Cb 0.62 0.00 0.28 0.00 -1.14 0.00 0.00 41.12 40.88 1j9t n ASP 54 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1j9t n ALA 55 N -0.81 2.41 -1.05 2.12 0.00 -1.26 -4.94 120.51 116.98 1j9t n ALA 55 Ca 0.14 -1.11 -0.02 0.00 0.00 0.00 0.00 53.44 52.46 1j9t n ALA 55 Cb 0.06 -0.93 -0.01 0.00 0.00 0.00 0.00 19.45 18.58 1j9t n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j9t n GLY 56 N 1.55 0.53 3.71 0.00 0.00 -1.08 -4.99 105.19 104.91 1j9t n GLY 56 Ca 0.22 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 1j9t n GLY 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j9t s THR 57 N -2.02 2.34 0.13 2.61 2.01 -1.26 -4.89 115.64 114.56 1j9t s THR 57 Ca 0.00 0.16 0.04 0.00 0.31 0.00 0.00 61.69 62.20 1j9t s THR 57 Cb 0.00 -3.10 -0.04 0.00 0.01 0.00 0.00 72.50 69.37 1j9t s THR 57 CO 0.00 0.01 0.10 -1.61 -0.69 0.00 0.00 174.62 172.43 1j9t s GLU 58 N 1.60 2.84 -0.03 4.92 2.02 -1.26 -1.13 118.70 127.66 1j9t s GLU 58 Ca 0.75 -0.82 -0.01 0.00 0.02 0.00 0.00 54.97 54.91 1j9t s GLU 58 Cb -0.47 -2.65 0.02 0.00 0.10 0.00 0.00 34.13 31.13 1j9t s GLU 58 CO 0.33 0.52 0.06 0.08 0.02 0.00 0.00 175.26 176.26 1j9t s VAL 59 N -1.59 -0.03 -0.77 2.63 1.01 -0.69 -4.95 120.40 116.01 1j9t s VAL 59 Ca 0.30 0.10 -0.24 0.00 0.00 0.00 0.00 61.98 62.14 1j9t s VAL 59 Cb -0.11 -0.11 0.06 0.00 0.00 0.00 0.00 36.38 36.23 1j9t s VAL 59 CO 0.22 0.04 1.15 -1.00 0.00 0.00 0.00 175.10 175.52 1j9t s HIS 60 N 0.56 2.59 0.34 5.22 3.76 -1.26 -1.79 115.29 124.71 1j9t s HIS 60 Ca -0.04 -0.54 -0.23 0.00 -0.15 0.00 0.00 55.06 54.09 1j9t s HIS 60 Cb -0.06 -4.45 -0.10 0.00 1.11 0.00 0.00 32.58 29.07 1j9t s HIS 60 CO -0.02 -1.80 0.91 0.00 -0.85 0.00 0.00 174.74 172.97 1j9t s ALA 61 N 4.54 3.19 -0.37 -1.40 0.00 0.39 -4.86 121.76 123.24 1j9t s ALA 61 Ca 0.31 0.41 0.03 0.00 0.00 0.00 0.00 51.96 52.71 1j9t s ALA 61 Cb -0.10 -3.10 0.11 0.00 0.00 0.00 0.00 23.12 20.02 1j9t s ALA 61 CO 0.06 0.19 0.12 -1.64 0.00 0.00 0.00 175.76 174.49 1j9t s MET 62 N -2.41 1.34 -0.12 0.00 -1.94 -0.92 -1.07 119.30 114.17 1j9t s MET 62 Ca 0.53 -1.81 0.00 0.00 -1.71 0.00 0.00 55.69 52.70 1j9t s MET 62 Cb -0.15 -2.81 -0.01 0.00 2.01 0.00 0.00 34.83 33.87 1j9t s MET 62 CO 0.20 -1.01 -0.14 0.00 -0.01 0.00 0.00 175.02 174.07 1j9t s ALA 63 N 0.83 2.60 0.14 3.03 0.00 -0.39 -2.05 121.76 125.92 1j9t s ALA 63 Ca 0.12 -0.90 -0.31 0.00 0.00 0.00 0.00 51.96 50.88 1j9t s ALA 63 Cb -0.20 -1.18 -0.08 0.00 0.00 0.00 0.00 23.12 21.66 1j9t s ALA 63 CO -0.10 0.27 1.28 -0.06 0.00 0.00 0.00 175.76 177.15 1j9t s PHE 64 N 0.30 3.33 -1.79 0.00 0.08 -1.25 -1.38 117.98 117.29 1j9t s PHE 64 Ca -0.11 1.20 0.00 0.00 0.12 0.00 0.00 56.93 58.15 1j9t s PHE 64 Cb -0.16 -3.54 0.00 0.00 -0.57 0.00 0.00 43.02 38.75 1j9t s PHE 64 CO 0.06 -1.74 0.00 -1.71 -0.10 0.00 0.00 175.22 171.73 1j9t n ASN 65 N 3.31 -4.68 0.00 1.36 5.15 -0.54 -2.18 115.26 117.70 1j9t n ASN 65 Ca 0.08 0.42 0.00 0.00 -0.60 0.00 0.00 54.58 54.48 1j9t n ASN 65 Cb 0.44 -4.13 0.00 0.00 -0.53 0.00 0.00 39.78 35.56 1j9t n ASN 65 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1j9t n GLY 66 N -0.27 0.79 3.42 8.20 0.00 -1.10 -4.93 105.19 111.31 1j9t n GLY 66 Ca -0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.64 1j9t n GLY 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j9t s THR 67 N -3.13 1.56 -0.20 2.61 -4.23 -0.92 -4.95 115.64 106.38 1j9t s THR 67 Ca 0.00 -2.11 -0.01 0.00 -1.18 0.00 0.00 61.69 58.39 1j9t s THR 67 Cb 0.00 -2.47 0.06 0.00 1.34 0.00 0.00 72.50 71.43 1j9t s THR 67 CO 0.00 -0.28 -0.01 -0.69 -0.54 0.00 0.00 174.62 173.10 1j9t s VAL 68 N -3.06 0.93 1.05 2.29 1.01 -1.26 -3.45 120.40 117.90 1j9t s VAL 68 Ca 0.30 -0.76 -0.17 0.00 0.00 0.00 0.00 61.98 61.34 1j9t s VAL 68 Cb 0.04 -1.30 0.23 0.00 0.00 0.00 0.00 36.38 35.35 1j9t s VAL 68 CO 0.12 -0.11 1.25 -2.16 0.00 0.00 0.00 175.10 174.20 1j9t s PRO 69 N 1.68 -0.05 0.85 2.72 0.04 -1.26 -1.59 135.00 137.39 1j9t s PRO 69 Ca -0.02 -0.32 -0.11 0.00 0.04 0.00 0.00 61.00 60.59 1j9t s PRO 69 Cb -0.17 -1.76 0.10 0.00 0.04 0.00 0.00 34.50 32.71 1j9t s PRO 69 CO -0.07 -2.89 1.09 0.20 0.04 0.00 0.00 177.00 175.37 1j9t s GLY 70 N -4.57 1.65 0.75 0.56 0.00 -0.10 -4.74 107.32 100.88 1j9t s GLY 70 Ca 0.73 0.15 -0.12 0.00 0.00 0.00 0.00 44.72 45.48 1j9t s GLY 70 CO 0.54 0.57 1.12 2.56 0.00 0.00 0.00 173.10 177.89 1j9t s PRO 71 N -4.88 2.23 -0.09 2.90 0.04 -1.26 -4.47 135.00 129.47 1j9t s PRO 71 Ca 0.63 1.36 -0.24 0.00 0.04 0.00 0.00 61.00 62.78 1j9t s PRO 71 Cb -0.18 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 1j9t s PRO 71 CO 0.57 -1.69 0.76 -1.17 0.04 0.00 0.00 177.00 175.51 1j9t s LEU 72 N -5.61 4.28 -0.17 -3.56 2.96 -1.26 -4.31 118.68 111.01 1j9t s LEU 72 Ca 0.65 1.22 -0.08 0.00 -0.22 0.00 0.00 54.13 55.71 1j9t s LEU 72 Cb -0.20 -3.16 -0.04 0.00 0.50 0.00 0.00 46.19 43.28 1j9t s LEU 72 CO 0.51 -0.20 0.08 -0.04 -1.32 0.00 0.00 176.35 175.38 1j9t s MET 73 N 1.19 3.87 -0.11 1.98 -1.94 -1.14 -4.57 119.30 118.57 1j9t s MET 73 Ca 0.39 -0.29 0.03 0.00 -1.71 0.00 0.00 55.69 54.11 1j9t s MET 73 Cb -0.18 -3.22 0.00 0.00 2.01 0.00 0.00 34.83 33.44 1j9t s MET 73 CO 0.18 0.39 -0.22 0.08 -0.01 0.00 0.00 175.02 175.44 1j9t s VAL 74 N 0.05 2.18 0.34 -6.03 1.01 -1.26 -0.07 120.40 116.62 1j9t s VAL 74 Ca 0.07 -0.97 0.05 0.00 0.00 0.00 0.00 61.98 61.13 1j9t s VAL 74 Cb -0.12 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 1j9t s VAL 74 CO 0.00 0.55 0.34 1.33 0.00 0.00 0.00 175.10 177.33 1j9t n VAL 75 N 3.64 0.00 -4.33 2.92 0.24 -0.68 -4.99 118.33 115.13 1j9t n VAL 75 Ca -0.19 -2.28 -0.24 0.00 -2.04 0.00 0.00 64.34 59.59 1j9t n VAL 75 Cb 0.53 1.20 -0.08 0.00 -1.47 0.00 0.00 33.84 34.01 1j9t n VAL 75 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1j9t s HIS 76 N -3.23 2.55 0.20 6.34 3.76 -1.26 -1.36 115.29 122.29 1j9t s HIS 76 Ca 0.37 -0.37 -0.33 0.00 -0.15 0.00 0.00 55.06 54.59 1j9t s HIS 76 Cb 0.01 -1.35 -0.13 0.00 1.11 0.00 0.00 32.58 32.22 1j9t s HIS 76 CO 0.26 0.54 1.61 0.94 -0.85 0.00 0.00 174.74 177.25 1j9t n GLN 77 N -0.90 2.41 -0.99 1.40 7.27 -0.12 -1.88 117.38 124.56 1j9t n GLN 77 Ca -0.05 0.87 0.00 0.00 0.07 0.00 0.00 57.00 57.89 1j9t n GLN 77 Cb 0.61 -2.65 0.00 0.00 2.41 0.00 0.00 30.24 30.61 1j9t n GLN 77 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1j9t n ASP 78 N 3.35 -2.30 -4.87 1.69 10.43 0.92 -4.74 116.55 121.03 1j9t n ASP 78 Ca 0.15 0.00 -0.26 0.00 2.57 0.00 0.00 54.79 57.25 1j9t n ASP 78 Cb 0.32 -0.38 0.08 0.00 1.84 0.00 0.00 41.12 42.97 1j9t n ASP 78 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 1j9t s ASP 79 N -2.23 4.70 -0.08 -2.24 -0.00 -0.79 -4.66 116.67 111.37 1j9t s ASP 79 Ca 0.00 0.40 0.02 0.00 -0.00 0.00 0.00 52.55 52.97 1j9t s ASP 79 Cb 0.00 -1.00 -0.02 0.00 -0.00 0.00 0.00 42.92 41.90 1j9t s ASP 79 CO 0.00 -1.67 -0.14 -0.31 -0.00 0.00 0.00 175.17 173.05 1j9t s TYR 80 N -3.27 2.73 -0.27 4.23 1.51 -0.33 -1.63 117.35 120.31 1j9t s TYR 80 Ca 0.61 -0.33 -0.09 0.00 -1.01 0.00 0.00 57.07 56.24 1j9t s TYR 80 Cb -0.10 -1.70 -0.04 0.00 -0.11 0.00 0.00 41.96 40.01 1j9t s TYR 80 CO 0.45 0.04 0.14 -1.17 -1.11 0.00 0.00 175.55 173.90 1j9t s LEU 81 N -0.35 3.77 -0.31 -1.29 0.20 -0.04 -0.43 118.68 120.23 1j9t s LEU 81 Ca 0.03 -0.13 -0.01 0.00 0.69 0.00 0.00 54.13 54.72 1j9t s LEU 81 Cb -0.12 -2.03 0.06 0.00 -0.43 0.00 0.00 46.19 43.67 1j9t s LEU 81 CO 0.02 -0.05 0.02 -0.70 -0.29 0.00 0.00 176.35 175.35 1j9t s GLU 82 N 1.69 2.28 -0.18 1.98 2.12 -0.09 -1.64 118.70 124.85 1j9t s GLU 82 Ca 0.07 -1.40 -0.06 0.00 0.36 0.00 0.00 54.97 53.93 1j9t s GLU 82 Cb -0.16 -3.21 -0.04 0.00 0.26 0.00 0.00 34.13 30.99 1j9t s GLU 82 CO 0.08 -0.71 0.04 -1.17 -0.54 0.00 0.00 175.26 172.96 1j9t s LEU 83 N 1.19 3.61 -0.34 2.70 0.20 0.39 -1.61 118.68 124.84 1j9t s LEU 83 Ca -0.02 -0.01 -0.13 0.00 0.69 0.00 0.00 54.13 54.66 1j9t s LEU 83 Cb -0.20 -1.91 -0.02 0.00 -0.43 0.00 0.00 46.19 43.63 1j9t s LEU 83 CO -0.02 0.14 0.23 -0.89 -0.29 0.00 0.00 176.35 175.52 1j9t s THR 84 N 0.54 5.25 -0.15 3.68 2.01 0.02 -1.49 115.64 125.49 1j9t s THR 84 Ca 0.01 -0.21 -0.04 0.00 0.31 0.00 0.00 61.69 61.77 1j9t s THR 84 Cb -0.13 -3.69 -0.03 0.00 0.01 0.00 0.00 72.50 68.66 1j9t s THR 84 CO 0.01 0.01 -0.04 -0.22 -0.69 0.00 0.00 174.62 173.69 1j9t s LEU 85 N 1.72 3.26 -0.05 4.42 2.96 -0.29 -1.10 118.68 129.59 1j9t s LEU 85 Ca 0.06 -0.12 0.06 0.00 -0.22 0.00 0.00 54.13 53.91 1j9t s LEU 85 Cb -0.17 -1.78 -0.01 0.00 0.50 0.00 0.00 46.19 44.72 1j9t s LEU 85 CO 0.10 0.17 -0.25 -0.63 -1.32 0.00 0.00 176.35 174.43 1j9t s ILE 86 N 0.33 2.01 -0.48 6.68 1.01 -0.47 -1.56 121.20 128.72 1j9t s ILE 86 Ca -0.04 -1.05 0.02 0.00 0.00 0.00 0.00 60.65 59.58 1j9t s ILE 86 Cb -0.14 -1.70 0.13 0.00 0.01 0.00 0.00 42.46 40.76 1j9t s ILE 86 CO 0.03 0.56 0.24 0.21 0.00 0.00 0.00 174.94 175.97 1j9t s ASN 87 N -0.19 4.73 0.44 3.58 2.47 -0.33 -0.55 114.94 125.10 1j9t s ASN 87 Ca -0.02 -2.64 -0.23 0.00 0.42 0.00 0.00 52.86 50.38 1j9t s ASN 87 Cb -0.13 -1.70 -0.10 0.00 -1.45 0.00 0.00 41.25 37.86 1j9t s ASN 87 CO 0.03 -0.34 0.93 -2.65 -3.72 0.00 0.00 177.10 171.36 1j9t n PRO 88 N 3.66 1.18 0.34 0.43 -0.02 -1.26 0.11 135.00 139.43 1j9t n PRO 88 Ca 0.04 0.43 0.21 0.00 -2.02 0.00 0.00 63.50 62.16 1j9t n PRO 88 Cb 0.37 -1.97 1.10 0.00 -0.02 0.00 0.00 33.50 32.98 1j9t n PRO 88 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1j9t h GLU 89 N 1.31 0.00 -0.07 -0.52 4.11 -1.91 0.65 114.58 118.16 1j9t h GLU 89 Ca -0.44 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 58.88 1j9t h GLU 89 Cb 1.35 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.59 1j9t h GLU 89 CO 0.55 0.00 -0.46 1.79 0.07 0.00 0.00 179.01 180.96 1j9t h THR 90 N 0.00 1.33 -4.12 -1.06 1.35 -1.95 -3.45 112.91 105.01 1j9t h THR 90 Ca 0.00 -1.62 -0.49 0.00 -0.55 0.00 0.00 66.41 63.75 1j9t h THR 90 Cb 0.20 1.79 0.15 0.00 -1.73 0.00 0.00 68.15 68.56 1j9t h THR 90 CO -0.00 0.48 0.26 0.20 -0.25 0.00 0.00 175.52 176.20 1j9t s ASN 91 N -6.89 3.60 0.00 5.36 0.01 0.22 -4.98 114.94 112.26 1j9t s ASN 91 Ca -0.04 1.65 0.02 0.00 -0.71 0.00 0.00 52.86 53.79 1j9t s ASN 91 Cb 0.13 -2.32 -0.01 0.00 0.41 0.00 0.00 41.25 39.47 1j9t s ASN 91 CO 0.76 -2.58 0.25 0.35 -1.51 0.00 0.00 177.10 174.37 1j9t n THR 92 N -3.86 0.00 -4.37 1.60 -2.24 -1.26 -4.74 114.28 99.41 1j9t n THR 92 Ca 0.08 -0.47 -0.25 0.00 -2.27 0.00 0.00 64.05 61.15 1j9t n THR 92 Cb 0.54 1.02 -0.09 0.00 -2.10 0.00 0.00 70.33 69.70 1j9t n THR 92 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1j9t s LEU 93 N -1.47 2.83 0.30 3.22 1.43 -1.26 -4.91 118.68 118.83 1j9t s LEU 93 Ca 0.01 -0.79 -0.23 0.00 -1.03 0.00 0.00 54.13 52.09 1j9t s LEU 93 Cb 0.02 -1.42 -0.09 0.00 0.03 0.00 0.00 46.19 44.73 1j9t s LEU 93 CO 0.07 0.05 0.87 -0.32 0.23 0.00 0.00 176.35 177.25 1j9t s MET 94 N -3.30 4.43 0.14 1.70 -2.45 -1.26 -4.16 119.30 114.40 1j9t s MET 94 Ca 0.28 1.15 -0.03 0.00 -1.25 0.00 0.00 55.69 55.84 1j9t s MET 94 Cb -0.07 -2.75 -0.03 0.00 1.25 0.00 0.00 34.83 33.23 1j9t s MET 94 CO 0.16 0.28 0.12 -1.01 1.05 0.00 0.00 175.02 175.61 1j9t s HIS 95 N -1.66 0.77 0.00 4.11 0.09 -0.82 -4.99 115.29 112.79 1j9t s HIS 95 Ca 0.49 -1.13 0.00 0.00 -0.00 0.00 0.00 55.06 54.42 1j9t s HIS 95 Cb -0.17 -0.38 0.00 0.00 -0.00 0.00 0.00 32.58 32.03 1j9t s HIS 95 CO 0.22 -0.58 0.00 0.27 -0.00 0.00 0.00 174.74 174.65 1j9t n ASN 96 N -0.13 0.00 -3.74 1.40 6.94 -1.26 -1.26 115.26 117.20 1j9t n ASN 96 Ca -0.05 -0.85 -0.13 0.00 -0.02 0.00 0.00 54.58 53.53 1j9t n ASN 96 Cb 0.64 0.00 -0.11 0.00 -2.36 0.00 0.00 39.78 37.95 1j9t n ASN 96 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 1j9t s ILE 97 N -2.99 -0.00 -0.18 1.53 2.07 -1.26 -4.19 121.20 116.17 1j9t s ILE 97 Ca 0.00 0.02 0.01 0.00 -1.41 0.00 0.00 60.65 59.27 1j9t s ILE 97 Cb 0.00 -0.52 0.03 0.00 0.13 0.00 0.00 42.46 42.10 1j9t s ILE 97 CO 0.00 0.01 -0.16 -0.62 -1.91 0.00 0.00 174.94 172.26 1j9t s ASP 98 N 0.38 3.21 -0.36 4.50 -1.08 -0.51 -1.76 116.67 121.06 1j9t s ASP 98 Ca -0.02 -0.73 -0.14 0.00 -0.52 0.00 0.00 52.55 51.14 1j9t s ASP 98 Cb -0.04 -1.38 -0.01 0.00 -1.46 0.00 0.00 42.92 40.04 1j9t s ASP 98 CO -0.01 -0.06 0.31 -0.36 0.52 0.00 0.00 175.17 175.57 1j9t s PHE 99 N 1.33 3.22 0.54 -5.34 0.40 0.80 -1.97 117.98 116.96 1j9t s PHE 99 Ca 0.03 -0.24 0.41 0.00 -0.60 0.00 0.00 56.93 56.53 1j9t s PHE 99 Cb -0.14 -2.59 2.15 0.00 0.51 0.00 0.00 43.02 42.95 1j9t s PHE 99 CO -0.11 -0.45 2.28 0.45 0.70 0.00 0.00 175.22 178.09 1j9t h HIS 100 N 8.53 0.00 0.00 0.36 3.86 -1.59 -1.08 115.15 125.24 1j9t h HIS 100 Ca -0.30 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 58.89 1j9t h HIS 100 Cb 1.14 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.61 1j9t h HIS 100 CO 0.65 0.01 -0.11 0.00 0.86 0.00 0.00 177.93 179.33 1j9t h ALA 101 N 1.99 0.95 -2.11 2.45 0.00 -1.90 -3.46 119.26 117.18 1j9t h ALA 101 Ca -0.00 -0.10 -0.46 0.00 0.00 0.00 0.00 54.91 54.35 1j9t h ALA 101 Cb 0.12 -0.02 0.10 0.00 0.00 0.00 0.00 17.79 17.99 1j9t h ALA 101 CO 0.00 0.14 0.26 0.00 0.00 0.00 0.00 179.25 179.65 1j9t s ALA 102 N -3.36 3.02 -0.13 0.00 0.00 -0.41 -4.65 121.76 116.23 1j9t s ALA 102 Ca 0.04 -1.09 -0.01 0.00 0.00 0.00 0.00 51.96 50.90 1j9t s ALA 102 Cb 0.07 -2.57 0.04 0.00 0.00 0.00 0.00 23.12 20.66 1j9t s ALA 102 CO 0.64 -1.59 -0.04 0.99 0.00 0.00 0.00 175.76 175.76 1j9t s THR 103 N -3.39 0.83 0.00 0.00 2.01 -1.26 -4.79 115.64 109.04 1j9t s THR 103 Ca 0.64 -0.33 0.00 0.00 0.31 0.00 0.00 61.69 62.31 1j9t s THR 103 Cb -0.08 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.43 1j9t s THR 103 CO 0.47 0.19 0.00 0.61 -0.69 0.00 0.00 174.62 175.20 1j9t n GLY 104 N 4.98 2.86 4.26 4.40 0.00 -1.26 -4.93 105.19 115.51 1j9t n GLY 104 Ca -0.11 -1.90 -0.35 0.00 0.00 0.00 0.00 46.02 43.67 1j9t n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9t n ALA 105 N 0.19 -2.14 -3.47 4.61 0.00 -1.26 -0.54 120.51 117.91 1j9t n ALA 105 Ca 0.00 -0.46 -0.25 0.00 0.00 0.00 0.00 53.44 52.73 1j9t n ALA 105 Cb 0.00 -1.17 0.03 0.00 0.00 0.00 0.00 19.45 18.31 1j9t n ALA 105 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1j9t n LEU 106 N -4.68 -2.46 -0.09 0.00 4.77 -1.26 -0.57 117.00 112.72 1j9t n LEU 106 Ca -0.28 -0.50 -0.01 0.00 -0.03 0.00 0.00 56.01 55.19 1j9t n LEU 106 Cb 0.66 -2.64 -0.00 0.00 -2.33 0.00 0.00 43.42 39.11 1j9t n LEU 106 CO 0.82 0.35 -0.01 0.61 -1.33 0.00 0.00 177.39 177.83 1j9t n GLY 107 N -1.56 0.47 0.00 -0.72 0.00 0.30 -2.84 105.19 100.84 1j9t n GLY 107 Ca -0.02 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1j9t n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j9t n GLY 108 N -2.19 0.66 0.32 -0.02 0.00 0.27 -0.14 105.19 104.09 1j9t n GLY 108 Ca -0.01 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.02 1j9t n GLY 108 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1j9t h GLY 109 N 0.00 0.80 2.00 -0.02 0.00 -0.72 -2.08 103.07 103.06 1j9t h GLY 109 Ca 0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 1j9t h GLY 109 CO 0.00 0.33 -0.08 -1.33 0.00 0.00 0.00 176.54 175.46 1j9t h GLY 110 N 0.83 0.00 -0.97 4.60 0.00 -1.72 -3.19 103.07 102.62 1j9t h GLY 110 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1j9t h GLY 110 CO -0.03 0.00 -0.39 1.04 0.00 0.00 0.00 176.54 177.16 1j9t n LEU 111 N -3.18 1.96 -0.20 3.11 4.77 -0.92 -4.59 117.00 117.95 1j9t n LEU 111 Ca 0.01 -0.78 0.09 0.00 -0.03 0.00 0.00 56.01 55.30 1j9t n LEU 111 Cb 0.41 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.65 1j9t n LEU 111 CO 0.31 0.36 0.52 0.35 -1.33 0.00 0.00 177.39 177.60 1j9t n THR 112 N 0.05 1.97 -2.29 -5.08 -2.24 -0.83 -4.95 114.28 100.91 1j9t n THR 112 Ca 0.09 -2.50 -0.43 0.00 -2.27 0.00 0.00 64.05 58.93 1j9t n THR 112 Cb 0.43 -0.24 -0.02 0.00 -2.10 0.00 0.00 70.33 68.40 1j9t n THR 112 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1j9t s GLU 113 N -2.97 3.75 -0.07 -0.78 2.02 -1.25 -4.30 118.70 115.11 1j9t s GLU 113 Ca 0.34 1.29 0.03 0.00 0.02 0.00 0.00 54.97 56.65 1j9t s GLU 113 Cb 0.30 -3.98 0.00 0.00 0.10 0.00 0.00 34.13 30.55 1j9t s GLU 113 CO 0.01 -1.34 -0.17 0.96 0.02 0.00 0.00 175.26 174.74 1j9t s ILE 114 N 5.06 1.45 0.68 -1.63 -4.36 -0.39 -4.99 121.20 117.02 1j9t s ILE 114 Ca 0.63 -0.68 -0.06 0.00 -0.26 0.00 0.00 60.65 60.28 1j9t s ILE 114 Cb -0.19 -1.27 0.05 0.00 1.25 0.00 0.00 42.46 42.30 1j9t s ILE 114 CO 0.28 0.42 0.99 0.20 0.24 0.00 0.00 174.94 177.07 1j9t s ASN 115 N 0.38 4.93 0.16 4.36 0.02 -1.26 -1.94 114.94 121.59 1j9t s ASN 115 Ca -0.12 0.46 -0.32 0.00 -1.02 0.00 0.00 52.86 51.86 1j9t s ASN 115 Cb -0.15 -1.16 -0.12 0.00 0.02 0.00 0.00 41.25 39.84 1j9t s ASN 115 CO 0.04 -1.51 1.77 -2.65 0.02 0.00 0.00 177.10 174.77 1j9t n PRO 116 N -2.85 2.73 0.00 -0.60 -0.02 -1.26 -1.17 135.00 131.83 1j9t n PRO 116 Ca 0.08 0.99 0.00 0.00 -2.02 0.00 0.00 63.50 62.55 1j9t n PRO 116 Cb 0.60 -2.85 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 1j9t n PRO 116 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1j9t n GLY 117 N 4.06 0.58 3.61 -1.23 0.00 0.30 -4.69 105.19 107.81 1j9t n GLY 117 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 1j9t n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j9t s GLU 118 N -0.92 2.05 0.12 1.61 2.02 -0.32 -4.90 118.70 118.35 1j9t s GLU 118 Ca 0.00 -1.72 -0.08 0.00 0.02 0.00 0.00 54.97 53.19 1j9t s GLU 118 Cb 0.00 -1.93 -0.01 0.00 0.10 0.00 0.00 34.13 32.29 1j9t s GLU 118 CO 0.00 0.19 0.22 -1.59 0.02 0.00 0.00 175.26 174.10 1j9t s LYS 119 N -3.68 0.98 0.10 1.61 -2.85 -1.26 -1.19 119.74 113.45 1j9t s LYS 119 Ca 0.34 -1.08 -0.13 0.00 -1.00 0.00 0.00 55.97 54.10 1j9t s LYS 119 Cb -0.01 0.35 0.02 0.00 -2.06 0.00 0.00 37.83 36.13 1j9t s LYS 119 CO 0.19 -0.33 0.30 -0.08 0.10 0.00 0.00 175.35 175.53 1j9t s THR 120 N -3.92 0.10 -0.16 3.79 -1.32 -0.60 -5.00 115.64 108.54 1j9t s THR 120 Ca 0.11 -0.85 -0.00 0.00 -1.21 0.00 0.00 61.69 59.74 1j9t s THR 120 Cb 0.04 -1.23 0.04 0.00 -1.51 0.00 0.00 72.50 69.84 1j9t s THR 120 CO -0.06 -0.47 -0.06 -0.63 -2.21 0.00 0.00 174.62 171.19 1j9t s ILE 121 N -3.77 1.15 -0.07 5.08 1.01 -1.26 -1.14 121.20 122.20 1j9t s ILE 121 Ca 0.03 -0.58 0.03 0.00 0.00 0.00 0.00 60.65 60.13 1j9t s ILE 121 Cb 0.03 -1.27 -0.02 0.00 0.01 0.00 0.00 42.46 41.20 1j9t s ILE 121 CO -0.11 0.19 -0.14 -0.22 0.00 0.00 0.00 174.94 174.67 1j9t s LEU 122 N 1.63 2.75 -0.08 2.97 2.96 -0.55 -4.96 118.68 123.40 1j9t s LEU 122 Ca 0.02 -0.22 0.02 0.00 -0.22 0.00 0.00 54.13 53.73 1j9t s LEU 122 Cb -0.15 -1.57 0.01 0.00 0.50 0.00 0.00 46.19 44.98 1j9t s LEU 122 CO -0.08 0.30 -0.14 -0.60 -1.32 0.00 0.00 176.35 174.51 1j9t s ARG 123 N -0.47 1.96 0.07 1.98 3.52 -1.26 -0.46 118.95 124.28 1j9t s ARG 123 Ca 0.06 -0.50 0.01 0.00 -0.13 0.00 0.00 55.73 55.18 1j9t s ARG 123 Cb -0.12 -1.60 -0.03 0.00 -1.56 0.00 0.00 34.95 31.64 1j9t s ARG 123 CO 0.02 0.03 -0.06 -0.59 -0.81 0.00 0.00 175.30 173.89 1j9t s PHE 124 N 0.68 0.73 -0.28 5.12 -0.12 -0.65 -4.96 117.98 118.50 1j9t s PHE 124 Ca -0.14 -0.75 -0.18 0.00 -0.05 0.00 0.00 56.93 55.81 1j9t s PHE 124 Cb -0.16 -0.44 -0.02 0.00 -0.63 0.00 0.00 43.02 41.77 1j9t s PHE 124 CO 0.04 -0.15 0.54 0.21 -0.05 0.00 0.00 175.22 175.80 1j9t s LYS 125 N -2.85 4.00 -1.14 1.99 2.20 -1.26 -0.86 119.74 121.82 1j9t s LYS 125 Ca 0.01 0.28 -0.18 0.00 -0.36 0.00 0.00 55.97 55.72 1j9t s LYS 125 Cb -0.01 -3.68 -0.05 0.00 -1.51 0.00 0.00 37.83 32.58 1j9t s LYS 125 CO -0.03 -0.41 2.03 0.00 -0.36 0.00 0.00 175.35 176.58 1j9t n ALA 126 N 5.62 4.12 0.34 3.13 0.00 -0.65 -4.73 120.51 128.34 1j9t n ALA 126 Ca -0.04 -3.58 0.14 0.00 0.00 0.00 0.00 53.44 49.97 1j9t n ALA 126 Cb 0.49 -3.58 0.50 0.00 0.00 0.00 0.00 19.45 16.86 1j9t n ALA 126 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1j9t h THR 127 N 4.54 0.00 -3.29 0.00 1.35 -1.85 0.26 112.91 113.92 1j9t h THR 127 Ca 0.47 -0.55 -0.67 0.00 -0.55 0.00 0.00 66.41 65.11 1j9t h THR 127 Cb 0.70 1.49 -0.32 0.00 -1.73 0.00 0.00 68.15 68.30 1j9t h THR 127 CO 1.82 0.00 -0.84 -0.54 -0.25 0.00 0.00 175.52 175.71 1j9t s LYS 128 N -3.42 3.14 0.25 4.72 1.02 -1.26 -4.74 119.74 119.44 1j9t s LYS 128 Ca 0.04 -0.81 -0.29 0.00 0.02 0.00 0.00 55.97 54.93 1j9t s LYS 128 Cb 0.09 -2.46 -0.09 0.00 -0.52 0.00 0.00 37.83 34.85 1j9t s LYS 128 CO 0.54 0.11 0.93 -1.25 -0.92 0.00 0.00 175.35 174.76 1j9t s PRO 129 N 0.55 4.81 0.00 -1.68 0.04 -1.26 -4.78 135.00 132.68 1j9t s PRO 129 Ca -0.12 1.45 0.00 0.00 0.04 0.00 0.00 61.00 62.37 1j9t s PRO 129 Cb -0.16 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 31.17 1j9t s PRO 129 CO 0.04 0.49 0.00 0.41 0.04 0.00 0.00 177.00 177.98 1j9t n GLY 130 N 1.35 0.41 3.82 0.56 0.00 0.12 -2.46 105.19 109.00 1j9t n GLY 130 Ca -0.02 -1.81 -0.36 0.00 0.00 0.00 0.00 46.02 43.83 1j9t n GLY 130 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j9t s VAL 131 N -1.64 5.47 0.04 1.61 -7.23 0.91 0.44 120.40 120.01 1j9t s VAL 131 Ca 0.00 0.20 0.03 0.00 -1.81 0.00 0.00 61.98 60.40 1j9t s VAL 131 Cb 0.00 -3.43 -0.02 0.00 0.56 0.00 0.00 36.38 33.49 1j9t s VAL 131 CO 0.00 0.55 -0.09 -0.36 -0.31 0.00 0.00 175.10 174.89 1j9t s PHE 132 N -0.49 0.78 0.47 2.82 0.08 0.01 -4.47 117.98 117.17 1j9t s PHE 132 Ca 0.12 -0.44 -0.17 0.00 0.12 0.00 0.00 56.93 56.57 1j9t s PHE 132 Cb -0.12 -0.46 -0.09 0.00 -0.57 0.00 0.00 43.02 41.78 1j9t s PHE 132 CO 0.02 -0.04 0.93 0.08 -0.10 0.00 0.00 175.22 176.11 1j9t s VAL 133 N -1.18 4.53 0.01 -0.44 1.01 -1.26 -0.60 120.40 122.46 1j9t s VAL 133 Ca -0.06 1.21 0.00 0.00 0.00 0.00 0.00 61.98 63.13 1j9t s VAL 133 Cb -0.09 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 1j9t s VAL 133 CO 0.01 -0.53 -0.01 -0.72 0.00 0.00 0.00 175.10 173.84 1j9t s TYR 134 N -2.43 0.09 0.14 5.22 -0.85 -0.76 -1.57 117.35 117.19 1j9t s TYR 134 Ca 0.59 -0.16 -0.24 0.00 -0.52 0.00 0.00 57.07 56.74 1j9t s TYR 134 Cb -0.10 -0.07 0.07 0.00 0.38 0.00 0.00 41.96 42.25 1j9t s TYR 134 CO 0.25 -0.05 0.67 -3.38 -1.52 0.00 0.00 175.55 171.51 1j9t s HIS 135 N -0.43 -0.48 0.36 -3.49 -3.43 -0.83 0.00 115.29 107.00 1j9t s HIS 135 Ca -0.05 0.27 -0.27 0.00 -0.80 0.00 0.00 55.06 54.21 1j9t s HIS 135 Cb -0.03 0.57 -0.09 0.00 -1.43 0.00 0.00 32.58 31.59 1j9t s HIS 135 CO -0.00 -0.82 1.26 0.00 -2.00 0.00 0.00 174.74 173.18 1j9t n ALA 137 N 0.49 1.45 -2.02 0.00 0.00 -1.26 -4.61 120.51 114.56 1j9t n ALA 137 Ca 0.02 -2.85 -0.40 0.00 0.00 0.00 0.00 53.44 50.20 1j9t n ALA 137 Cb 0.44 -0.95 -0.05 0.00 0.00 0.00 0.00 19.45 18.89 1j9t n ALA 137 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1j9t s PRO 138 N -0.60 4.72 -0.48 0.00 0.04 -1.26 -4.94 135.00 132.48 1j9t s PRO 138 Ca 0.34 1.38 -0.27 0.00 0.04 0.00 0.00 61.00 62.49 1j9t s PRO 138 Cb 0.17 -3.32 -0.04 0.00 0.04 0.00 0.00 34.50 31.36 1j9t s PRO 138 CO -0.15 0.41 2.04 -2.14 0.04 0.00 0.00 177.00 177.20 1j9t s PRO 139 N -0.70 2.66 0.00 0.56 0.02 -1.26 -2.54 135.00 133.75 1j9t s PRO 139 Ca 0.42 1.13 0.00 0.00 0.02 0.00 0.00 61.00 62.57 1j9t s PRO 139 Cb -0.24 -4.40 0.00 0.00 0.02 0.00 0.00 34.50 29.87 1j9t s PRO 139 CO 0.29 -2.66 0.00 0.41 -0.33 0.00 0.00 177.00 174.71 1j9t n GLY 140 N 5.74 0.59 2.53 0.52 0.00 -1.26 -4.95 105.19 108.35 1j9t n GLY 140 Ca 0.26 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.16 1j9t n GLY 140 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1j9t n MET 141 N 0.00 2.36 0.00 1.61 2.81 -1.05 -4.99 117.12 117.86 1j9t n MET 141 Ca 0.00 -3.78 0.00 0.00 -1.81 0.00 0.00 57.70 52.11 1j9t n MET 141 Cb 0.00 -1.80 0.00 0.00 -0.71 0.00 0.00 33.22 30.71 1j9t n MET 141 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1j9t n VAL 142 N -0.49 0.00 -0.30 2.03 0.31 -1.19 -3.36 118.33 115.32 1j9t n VAL 142 Ca 0.22 1.15 0.13 0.00 -0.01 0.00 0.00 64.34 65.83 1j9t n VAL 142 Cb 0.83 -2.15 0.30 0.00 -0.91 0.00 0.00 33.84 31.91 1j9t n VAL 142 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1j9t h PRO 143 N 0.00 0.22 0.17 5.55 0.13 -1.93 -2.06 132.00 134.07 1j9t h PRO 143 Ca 0.00 -0.01 0.02 0.00 -0.87 0.00 0.00 66.00 65.13 1j9t h PRO 143 Cb 0.00 -0.05 -0.04 0.00 0.13 0.00 0.00 31.00 31.04 1j9t h PRO 143 CO 0.00 0.14 -0.34 2.35 -0.23 0.00 0.00 178.00 179.92 1j9t h TRP 144 N 0.22 -0.94 -0.54 1.56 7.01 -1.97 0.73 115.95 122.01 1j9t h TRP 144 Ca 0.56 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.57 1j9t h TRP 144 Cb 1.12 0.39 -0.03 0.00 -2.10 0.00 0.00 29.16 28.55 1j9t h TRP 144 CO -0.25 -0.46 0.33 0.45 -2.79 0.00 0.00 178.44 175.72 1j9t h HIS 145 N -0.60 0.71 -0.38 2.65 3.86 -1.41 -2.32 115.15 117.65 1j9t h HIS 145 Ca 0.02 0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.27 1j9t h HIS 145 Cb 0.61 -0.23 -0.04 0.00 1.06 0.00 0.00 27.41 28.81 1j9t h HIS 145 CO -0.28 0.49 0.16 0.28 0.86 0.00 0.00 177.93 179.43 1j9t h VAL 146 N 0.73 0.92 -0.08 2.45 2.07 -1.08 -1.30 116.25 119.97 1j9t h VAL 146 Ca 0.19 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1j9t h VAL 146 Cb -0.02 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1j9t h VAL 146 CO -0.04 0.06 0.00 1.33 0.02 0.00 0.00 177.57 178.94 1j9t n VAL 147 N -4.98 0.15 -0.05 2.57 0.24 0.22 -1.96 118.33 114.52 1j9t n VAL 147 Ca 0.02 -0.12 0.08 0.00 -2.04 0.00 0.00 64.34 62.28 1j9t n VAL 147 Cb 0.12 -0.07 0.19 0.00 -1.47 0.00 0.00 33.84 32.62 1j9t n VAL 147 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1j9t n SER 148 N -0.19 3.14 0.00 -1.34 7.64 -0.51 -4.66 113.62 117.71 1j9t n SER 148 Ca 0.03 -1.93 0.00 0.00 1.01 0.00 0.00 58.87 57.98 1j9t n SER 148 Cb 0.13 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 63.07 1j9t n SER 148 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j9t n GLY 149 N 0.98 0.88 2.96 0.23 0.00 -0.83 -2.16 105.19 107.25 1j9t n GLY 149 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1j9t n GLY 149 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1j9t n MET 150 N -2.19 3.54 -3.46 1.61 0.00 -0.87 -4.59 117.12 111.17 1j9t n MET 150 Ca 0.00 -3.53 -0.14 0.00 0.00 0.00 0.00 57.70 54.03 1j9t n MET 150 Cb 0.00 -2.97 -0.03 0.00 0.00 0.00 0.00 33.22 30.22 1j9t n MET 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1j9t s ASN 151 N 1.31 -0.58 0.00 6.12 2.20 -1.26 -1.43 114.94 121.30 1j9t s ASN 151 Ca 0.41 0.23 0.00 0.00 -0.94 0.00 0.00 52.86 52.56 1j9t s ASN 151 Cb 0.08 0.56 0.00 0.00 -2.00 0.00 0.00 41.25 39.89 1j9t s ASN 151 CO 0.00 -0.82 0.00 0.61 -2.94 0.00 0.00 177.10 173.95 1j9t n GLY 152 N 0.05 3.70 3.55 0.45 0.00 0.10 -0.92 105.19 112.13 1j9t n GLY 152 Ca -0.17 -0.53 -0.10 0.00 0.00 0.00 0.00 46.02 45.22 1j9t n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9t s ALA 153 N -1.14 -1.33 0.08 4.61 0.00 -1.26 -1.84 121.76 120.89 1j9t s ALA 153 Ca 0.00 0.11 0.01 0.00 0.00 0.00 0.00 51.96 52.08 1j9t s ALA 153 Cb 0.00 0.86 -0.04 0.00 0.00 0.00 0.00 23.12 23.94 1j9t s ALA 153 CO 0.00 -0.84 -0.06 0.96 0.00 0.00 0.00 175.76 175.81 1j9t s ILE 154 N -3.82 0.61 -0.11 0.00 -4.36 0.23 -2.89 121.20 110.85 1j9t s ILE 154 Ca 0.05 -1.80 0.02 0.00 -0.26 0.00 0.00 60.65 58.66 1j9t s ILE 154 Cb -0.02 -1.51 0.01 0.00 1.25 0.00 0.00 42.46 42.18 1j9t s ILE 154 CO -0.06 -0.83 -0.18 -0.32 0.24 0.00 0.00 174.94 173.80 1j9t s MET 155 N -3.54 2.49 -0.53 0.37 -2.45 0.90 -0.81 119.30 115.74 1j9t s MET 155 Ca 0.08 -0.67 -0.05 0.00 -1.25 0.00 0.00 55.69 53.80 1j9t s MET 155 Cb 0.04 -2.03 0.14 0.00 1.25 0.00 0.00 34.83 34.22 1j9t s MET 155 CO -0.05 0.00 0.36 0.08 1.05 0.00 0.00 175.02 176.46 1j9t s VAL 156 N 0.79 3.83 0.39 10.11 1.01 0.17 -1.69 120.40 135.01 1j9t s VAL 156 Ca -0.10 -2.32 -0.24 0.00 0.00 0.00 0.00 61.98 59.32 1j9t s VAL 156 Cb -0.16 -3.53 -0.09 0.00 0.00 0.00 0.00 36.38 32.60 1j9t s VAL 156 CO 0.01 -0.80 1.03 -0.76 0.00 0.00 0.00 175.10 174.58 1j9t s LEU 157 N 0.72 4.16 0.57 3.92 1.43 -0.47 0.12 118.68 129.13 1j9t s LEU 157 Ca 0.11 1.99 -0.20 0.00 -1.03 0.00 0.00 54.13 55.00 1j9t s LEU 157 Cb -0.22 -4.18 -0.04 0.00 0.03 0.00 0.00 46.19 41.78 1j9t s LEU 157 CO -0.03 -0.42 1.26 -2.84 0.23 0.00 0.00 176.35 174.54 1j9t s PRO 158 N -2.47 3.05 0.40 1.29 0.02 -1.26 -0.94 135.00 135.10 1j9t s PRO 158 Ca 0.57 1.97 0.15 0.00 0.02 0.00 0.00 61.00 63.71 1j9t s PRO 158 Cb -0.21 -2.07 1.01 0.00 0.02 0.00 0.00 34.50 33.26 1j9t s PRO 158 CO 0.26 -1.18 1.87 0.00 -0.33 0.00 0.00 177.00 177.63 1j9t h ARG 159 N 1.14 0.46 -0.54 5.54 2.47 -1.90 0.19 114.38 121.75 1j9t h ARG 159 Ca -0.51 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.19 1j9t h ARG 159 Cb 1.30 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 29.51 1j9t h ARG 159 CO 0.56 0.31 0.00 -0.85 0.56 0.00 0.00 179.97 180.55 1j9t n GLU 160 N -4.52 2.35 0.00 0.04 0.00 -1.26 -0.15 120.64 117.11 1j9t n GLU 160 Ca 0.18 -1.51 0.00 0.00 0.00 0.00 0.00 57.16 55.83 1j9t n GLU 160 Cb 0.61 -1.54 0.00 0.00 0.00 0.00 0.00 31.44 30.51 1j9t n GLU 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1j9t n GLY 161 N 0.82 -2.07 3.88 -1.84 0.00 0.05 -4.83 105.19 101.20 1j9t n GLY 161 Ca 0.14 -1.42 -0.31 0.00 0.00 0.00 0.00 46.02 44.43 1j9t n GLY 161 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1j9t s LEU 162 N 0.00 4.12 0.05 0.99 1.43 -1.26 -4.31 118.68 119.70 1j9t s LEU 162 Ca 0.00 0.94 -0.05 0.00 -1.03 0.00 0.00 54.13 53.99 1j9t s LEU 162 Cb 0.00 -3.73 -0.02 0.00 0.03 0.00 0.00 46.19 42.48 1j9t s LEU 162 CO 0.00 -0.13 0.09 -1.00 0.23 0.00 0.00 176.35 175.54 1j9t s HIS 163 N -1.91 0.26 0.00 0.29 3.76 -1.26 -0.76 115.29 115.68 1j9t s HIS 163 Ca 0.48 -0.64 0.00 0.00 -0.15 0.00 0.00 55.06 54.75 1j9t s HIS 163 Cb -0.11 -0.18 0.00 0.00 1.11 0.00 0.00 32.58 33.40 1j9t s HIS 163 CO 0.23 -0.40 0.00 -0.40 -0.85 0.00 0.00 174.74 173.31 1j9t n ASP 164 N 0.47 -0.00 0.16 1.40 5.68 0.63 -4.83 116.55 120.06 1j9t n ASP 164 Ca -0.17 -0.70 0.13 0.00 -0.50 0.00 0.00 54.79 53.55 1j9t n ASP 164 Cb 0.60 0.00 0.51 0.00 -1.14 0.00 0.00 41.12 41.09 1j9t n ASP 164 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1j9t h GLY 165 N -0.00 0.00 -1.88 6.12 0.00 -1.89 -3.09 103.07 102.33 1j9t h GLY 165 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1j9t h GLY 165 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 1j9t n LYS 166 N -2.44 2.22 -0.29 4.80 4.01 -1.26 -4.96 118.16 120.24 1j9t n LYS 166 Ca 0.02 -2.05 0.00 0.00 -0.51 0.00 0.00 58.31 55.78 1j9t n LYS 166 Cb 0.28 -1.42 0.00 0.00 -0.51 0.00 0.00 35.03 33.38 1j9t n LYS 166 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1j9t n GLY 167 N 1.18 0.77 3.77 0.72 0.00 -1.17 -5.06 105.19 105.40 1j9t n GLY 167 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1j9t n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j9t s LYS 168 N -0.71 4.67 0.29 1.61 -0.14 -1.26 -4.81 119.74 119.39 1j9t s LYS 168 Ca 0.00 1.31 -0.29 0.00 -1.36 0.00 0.00 55.97 55.63 1j9t s LYS 168 Cb 0.00 -3.14 -0.10 0.00 -1.68 0.00 0.00 37.83 32.91 1j9t s LYS 168 CO 0.00 0.47 1.12 0.00 -0.76 0.00 0.00 175.35 176.19 1j9t s ALA 169 N -1.29 3.42 -0.31 5.17 0.00 -1.26 -0.26 121.76 127.22 1j9t s ALA 169 Ca 0.42 0.94 0.04 0.00 0.00 0.00 0.00 51.96 53.35 1j9t s ALA 169 Cb -0.23 -3.35 0.08 0.00 0.00 0.00 0.00 23.12 19.63 1j9t s ALA 169 CO 0.28 -0.22 -0.01 -0.51 0.00 0.00 0.00 175.76 175.29 1j9t s LEU 170 N -1.49 4.22 -0.21 0.00 1.43 0.07 -4.82 118.68 117.87 1j9t s LEU 170 Ca 0.45 -1.85 -0.04 0.00 -1.03 0.00 0.00 54.13 51.66 1j9t s LEU 170 Cb -0.33 -1.59 -0.01 0.00 0.03 0.00 0.00 46.19 44.28 1j9t s LEU 170 CO 0.43 -0.30 -0.03 -0.89 0.23 0.00 0.00 176.35 175.78 1j9t s THR 171 N 0.99 3.56 0.11 5.49 2.01 -1.26 -4.12 115.64 122.41 1j9t s THR 171 Ca 0.03 -0.44 -0.07 0.00 0.31 0.00 0.00 61.69 61.52 1j9t s THR 171 Cb -0.19 -2.61 -0.06 0.00 0.01 0.00 0.00 72.50 69.65 1j9t s THR 171 CO -0.07 0.43 0.38 -0.72 -0.69 0.00 0.00 174.62 173.95 1j9t s TYR 172 N 1.27 3.53 -0.02 4.92 -0.85 -1.26 -4.84 117.35 120.10 1j9t s TYR 172 Ca 0.03 0.66 -0.03 0.00 -0.52 0.00 0.00 57.07 57.21 1j9t s TYR 172 Cb -0.14 -2.08 -0.28 0.00 0.38 0.00 0.00 41.96 39.84 1j9t s TYR 172 CO -0.01 0.48 0.78 -0.44 -1.52 0.00 0.00 175.55 174.84 1j9t h ASP 173 N 3.29 0.40 -4.84 -0.18 3.32 -0.85 -3.48 116.42 114.09 1j9t h ASP 173 Ca -0.48 -0.59 -0.22 0.00 0.02 0.00 0.00 57.03 55.76 1j9t h ASP 173 Cb 1.18 -0.13 -0.19 0.00 0.22 0.00 0.00 39.33 40.41 1j9t h ASP 173 CO 0.69 1.50 -0.71 -0.54 -1.72 0.00 0.00 179.24 178.46 1j9t s LYS 174 N -2.61 0.54 -0.01 3.56 1.02 -0.58 -5.01 119.74 116.65 1j9t s LYS 174 Ca -0.11 -0.87 0.01 0.00 0.02 0.00 0.00 55.97 55.02 1j9t s LYS 174 Cb 0.07 -0.13 0.01 0.00 -0.52 0.00 0.00 37.83 37.26 1j9t s LYS 174 CO 0.84 -0.00 -0.01 -1.50 -0.92 0.00 0.00 175.35 173.76 1j9t s ILE 175 N -2.06 0.13 0.05 2.17 2.07 -1.26 -0.46 121.20 121.84 1j9t s ILE 175 Ca -0.06 -0.02 0.05 0.00 -1.41 0.00 0.00 60.65 59.21 1j9t s ILE 175 Cb -0.05 -0.15 -0.02 0.00 0.13 0.00 0.00 42.46 42.36 1j9t s ILE 175 CO -0.02 0.07 -0.14 -0.31 -1.91 0.00 0.00 174.94 172.63 1j9t s TYR 176 N 0.25 1.18 -0.23 3.50 2.02 -0.42 -4.43 117.35 119.21 1j9t s TYR 176 Ca -0.02 -0.40 0.01 0.00 -0.37 0.00 0.00 57.07 56.29 1j9t s TYR 176 Cb -0.04 -0.68 0.04 0.00 -0.40 0.00 0.00 41.96 40.87 1j9t s TYR 176 CO -0.01 0.04 -0.13 -0.47 -1.57 0.00 0.00 175.55 173.42 1j9t s TYR 177 N -1.06 3.07 -0.34 2.71 5.04 0.53 -0.88 117.35 126.43 1j9t s TYR 177 Ca -0.01 -1.96 -0.10 0.00 -2.44 0.00 0.00 57.07 52.57 1j9t s TYR 177 Cb -0.09 -1.96 0.01 0.00 0.35 0.00 0.00 41.96 40.28 1j9t s TYR 177 CO 0.02 -0.83 0.17 0.08 -1.34 0.00 0.00 175.55 173.65 1j9t s VAL 178 N 1.21 4.48 -0.26 3.14 1.01 0.41 -4.13 120.40 126.26 1j9t s VAL 178 Ca -0.03 -0.69 -0.12 0.00 0.00 0.00 0.00 61.98 61.14 1j9t s VAL 178 Cb -0.17 -3.40 -0.05 0.00 0.00 0.00 0.00 36.38 32.76 1j9t s VAL 178 CO -0.07 -0.09 0.24 -0.83 0.00 0.00 0.00 175.10 174.35 1j9t s GLY 179 N 1.56 1.95 -0.19 4.51 0.00 -1.26 -2.41 107.32 111.48 1j9t s GLY 179 Ca 0.03 -0.94 -0.11 0.00 0.00 0.00 0.00 44.72 43.70 1j9t s GLY 179 CO 0.06 0.67 0.17 1.85 0.00 0.00 0.00 173.10 175.85 1j9t s GLU 180 N 1.62 4.18 -0.09 2.90 2.12 -0.57 -1.65 118.70 127.21 1j9t s GLU 180 Ca 0.10 -0.14 0.03 0.00 0.36 0.00 0.00 54.97 55.32 1j9t s GLU 180 Cb -0.15 -3.41 0.01 0.00 0.26 0.00 0.00 34.13 30.83 1j9t s GLU 180 CO 0.09 0.30 -0.19 -1.14 -0.54 0.00 0.00 175.26 173.78 1j9t s GLN 181 N 0.33 2.48 -0.22 4.30 2.00 0.13 -4.51 119.66 124.17 1j9t s GLN 181 Ca 0.10 -0.68 -0.14 0.00 -2.00 0.00 0.00 55.36 52.64 1j9t s GLN 181 Cb -0.12 -1.94 -0.04 0.00 0.80 0.00 0.00 33.01 31.71 1j9t s GLN 181 CO -0.00 0.09 0.33 0.16 -0.50 0.00 0.00 175.29 175.37 1j9t s ASP 182 N 0.54 6.33 0.05 6.67 3.84 -1.26 -1.11 116.67 131.72 1j9t s ASP 182 Ca -0.16 0.38 0.06 0.00 -0.00 0.00 0.00 52.55 52.83 1j9t s ASP 182 Cb -0.17 -2.20 -0.04 0.00 -1.38 0.00 0.00 42.92 39.14 1j9t s ASP 182 CO 0.06 -0.05 -0.12 -0.36 -0.00 0.00 0.00 175.17 174.69 1j9t s PHE 183 N 1.35 2.72 -0.54 2.11 0.08 0.04 -4.76 117.98 118.98 1j9t s PHE 183 Ca 0.15 -0.16 0.04 0.00 0.12 0.00 0.00 56.93 57.08 1j9t s PHE 183 Cb -0.15 -1.49 0.15 0.00 -0.57 0.00 0.00 43.02 40.96 1j9t s PHE 183 CO 0.07 0.35 0.34 0.71 -0.10 0.00 0.00 175.22 176.59 1j9t s TYR 184 N -1.05 2.61 -0.22 0.36 1.51 -1.26 -0.52 117.35 118.78 1j9t s TYR 184 Ca 0.18 -2.86 -0.18 0.00 -1.01 0.00 0.00 57.07 53.20 1j9t s TYR 184 Cb -0.11 -2.20 -0.03 0.00 -0.11 0.00 0.00 41.96 39.51 1j9t s TYR 184 CO 0.09 -0.70 0.49 0.08 -1.11 0.00 0.00 175.55 174.39 1j9t s VAL 185 N -0.41 5.12 0.67 0.71 1.01 -1.26 -4.76 120.40 121.48 1j9t s VAL 185 Ca 0.22 0.86 -0.17 0.00 0.00 0.00 0.00 61.98 62.89 1j9t s VAL 185 Cb -0.14 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.43 1j9t s VAL 185 CO -0.08 0.16 1.24 -2.84 0.00 0.00 0.00 175.10 173.57 1j9t s PRO 186 N 1.82 2.48 0.23 2.72 0.02 -1.26 -4.91 135.00 136.10 1j9t s PRO 186 Ca 0.22 1.87 0.06 0.00 0.02 0.00 0.00 61.00 63.17 1j9t s PRO 186 Cb -0.15 -1.86 -0.05 0.00 0.02 0.00 0.00 34.50 32.45 1j9t s PRO 186 CO 0.09 -1.60 -0.08 1.03 -0.33 0.00 0.00 177.00 176.11 1j9t s ARG 187 N -3.60 1.38 0.59 5.54 0.52 -1.26 -1.62 118.95 120.50 1j9t s ARG 187 Ca 0.78 -1.66 0.02 0.00 -0.52 0.00 0.00 55.73 54.35 1j9t s ARG 187 Cb -0.32 -0.98 0.06 0.00 0.52 0.00 0.00 34.95 34.23 1j9t s ARG 187 CO 0.40 0.07 0.82 0.16 0.02 0.00 0.00 175.30 176.78 1j9t s ASP 188 N -3.34 5.03 0.18 0.23 1.47 0.64 -4.84 116.67 116.04 1j9t s ASP 188 Ca 0.25 -0.19 0.10 0.00 1.18 0.00 0.00 52.55 53.89 1j9t s ASP 188 Cb 0.02 -0.55 0.55 0.00 -0.34 0.00 0.00 42.92 42.60 1j9t s ASP 188 CO 0.08 -1.33 1.25 -0.62 0.68 0.00 0.00 175.17 175.23 1j9t n GLU 189 N -2.44 0.07 -0.26 2.11 -0.58 -1.26 -0.06 120.64 118.21 1j9t n GLU 189 Ca 0.10 0.53 0.11 0.00 -0.42 0.00 0.00 57.16 57.48 1j9t n GLU 189 Cb 0.60 -1.81 0.27 0.00 -0.57 0.00 0.00 31.44 29.93 1j9t n GLU 189 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1j9t n ASN 190 N -1.84 3.42 -0.11 1.62 5.03 -1.26 -4.94 115.26 117.19 1j9t n ASN 190 Ca -0.01 -1.98 -0.01 0.00 0.87 0.00 0.00 54.58 53.45 1j9t n ASN 190 Cb 0.11 -0.35 -0.01 0.00 -1.02 0.00 0.00 39.78 38.52 1j9t n ASN 190 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1j9t n GLY 191 N 1.52 0.52 3.87 7.41 0.00 0.91 -5.03 105.19 114.38 1j9t n GLY 191 Ca 0.21 -0.57 -0.37 0.00 0.00 0.00 0.00 46.02 45.29 1j9t n GLY 191 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1j9t s LYS 192 N -1.39 3.56 0.14 1.61 2.20 -1.25 -4.82 119.74 119.79 1j9t s LYS 192 Ca 0.00 -0.01 -0.31 0.00 -0.36 0.00 0.00 55.97 55.29 1j9t s LYS 192 Cb 0.00 -3.20 -0.09 0.00 -1.51 0.00 0.00 37.83 33.03 1j9t s LYS 192 CO 0.00 0.75 1.45 0.71 -0.36 0.00 0.00 175.35 177.89 1j9t s TYR 193 N -1.00 3.18 0.48 4.03 1.51 -1.26 -0.26 117.35 124.02 1j9t s TYR 193 Ca 0.17 0.86 -0.14 0.00 -1.01 0.00 0.00 57.07 56.95 1j9t s TYR 193 Cb -0.13 -3.76 -0.07 0.00 -0.11 0.00 0.00 41.96 37.89 1j9t s TYR 193 CO 0.06 -2.71 0.90 0.15 -1.11 0.00 0.00 175.55 172.84 1j9t s LYS 194 N 1.04 3.86 0.15 -0.62 1.02 -0.64 -4.89 119.74 119.66 1j9t s LYS 194 Ca 0.66 0.75 0.11 0.00 0.02 0.00 0.00 55.97 57.50 1j9t s LYS 194 Cb -0.39 -2.24 -0.04 0.00 -0.52 0.00 0.00 37.83 34.64 1j9t s LYS 194 CO 0.31 -0.19 -0.24 0.15 -0.92 0.00 0.00 175.35 174.46 1j9t s LYS 195 N -4.04 1.54 0.02 1.68 1.02 -1.26 -4.74 119.74 113.95 1j9t s LYS 195 Ca 0.56 -1.36 0.03 0.00 0.02 0.00 0.00 55.97 55.21 1j9t s LYS 195 Cb -0.10 -1.94 -0.02 0.00 -0.52 0.00 0.00 37.83 35.25 1j9t s LYS 195 CO 0.33 0.44 -0.09 0.71 -0.92 0.00 0.00 175.35 175.82 1j9t s TYR 196 N -1.27 0.78 -0.34 3.18 2.02 -1.26 -5.05 117.35 115.41 1j9t s TYR 196 Ca 0.17 -0.30 0.26 0.00 -0.37 0.00 0.00 57.07 56.83 1j9t s TYR 196 Cb -0.09 -0.47 0.70 0.00 -0.40 0.00 0.00 41.96 41.70 1j9t s TYR 196 CO 0.08 -0.02 1.73 0.93 -1.57 0.00 0.00 175.55 176.71 1j9t h GLU 197 N 5.23 0.00 -3.08 -0.62 5.08 -2.01 -3.46 114.58 115.72 1j9t h GLU 197 Ca -0.33 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 57.92 1j9t h GLU 197 Cb 1.19 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.25 1j9t h GLU 197 CO 0.45 0.00 -0.25 0.00 -1.00 0.00 0.00 179.01 178.21 1j9t s ALA 198 N -3.32 -0.78 0.15 3.43 0.00 -1.26 -5.07 121.76 114.91 1j9t s ALA 198 Ca 0.06 0.26 -0.25 0.00 0.00 0.00 0.00 51.96 52.02 1j9t s ALA 198 Cb 0.07 0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.35 1j9t s ALA 198 CO 0.61 -0.31 1.59 -1.35 0.00 0.00 0.00 175.76 176.30 1j9t h PRO 199 N 3.65 -0.31 -0.24 0.00 0.11 -1.95 -1.69 132.00 131.56 1j9t h PRO 199 Ca -0.30 0.02 0.07 0.00 0.11 0.00 0.00 66.00 65.90 1j9t h PRO 199 Cb 1.18 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1j9t h PRO 199 CO 0.42 -0.21 0.19 0.78 -0.21 0.00 0.00 178.00 178.97 1j9t h GLY 200 N -0.32 0.00 1.12 -0.55 0.00 -2.00 -2.66 103.07 98.67 1j9t h GLY 200 Ca 0.14 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.58 1j9t h GLY 200 CO -0.52 0.00 0.35 -0.55 0.00 0.00 0.00 176.54 175.81 1j9t h ASP 201 N 0.00 0.20 -0.23 0.19 3.45 -1.72 -2.36 116.42 115.94 1j9t h ASP 201 Ca 0.11 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.58 1j9t h ASP 201 Cb 0.48 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 39.22 1j9t h ASP 201 CO -0.00 0.12 0.00 0.00 -1.57 0.00 0.00 179.24 177.79 1j9t n ALA 202 N -2.56 2.47 0.35 3.45 0.00 -1.00 -4.64 120.51 118.57 1j9t n ALA 202 Ca 0.08 -0.77 -0.19 0.00 0.00 0.00 0.00 53.44 52.57 1j9t n ALA 202 Cb 0.42 -0.94 -0.10 0.00 0.00 0.00 0.00 19.45 18.83 1j9t n ALA 202 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1j9t h TYR 203 N 3.76 -1.40 -0.86 0.00 5.03 -1.53 -1.11 116.97 120.87 1j9t h TYR 203 Ca 0.00 0.00 0.14 0.00 2.58 0.00 0.00 58.73 61.45 1j9t h TYR 203 Cb 0.82 0.53 -0.09 0.00 1.55 0.00 0.00 36.73 39.54 1j9t h TYR 203 CO 0.14 -0.70 0.46 1.49 -1.32 0.00 0.00 178.16 178.23 1j9t h GLU 204 N -1.09 0.65 -0.30 1.82 4.81 -1.82 -1.54 114.58 117.11 1j9t h GLU 204 Ca -0.08 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.00 1j9t h GLU 204 Cb 0.92 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.15 1j9t h GLU 204 CO -0.01 0.43 -0.24 -0.44 -0.73 0.00 0.00 179.01 178.03 1j9t h ASP 205 N 0.67 0.73 -0.64 1.04 3.45 -1.85 -3.21 116.42 116.61 1j9t h ASP 205 Ca 0.46 -0.45 -0.02 0.00 0.43 0.00 0.00 57.03 57.45 1j9t h ASP 205 Cb 0.62 -0.20 -0.03 0.00 -0.56 0.00 0.00 39.33 39.15 1j9t h ASP 205 CO -0.34 1.02 0.32 0.74 -1.57 0.00 0.00 179.24 179.41 1j9t h THR 206 N 0.44 1.22 -0.81 0.35 2.02 -0.48 -2.81 112.91 112.85 1j9t h THR 206 Ca 0.06 -0.60 0.05 0.00 0.77 0.00 0.00 66.41 66.69 1j9t h THR 206 Cb 0.79 0.43 -0.06 0.00 -1.74 0.00 0.00 68.15 67.58 1j9t h THR 206 CO 0.06 0.25 0.50 0.58 0.37 0.00 0.00 175.52 177.28 1j9t h VAL 207 N 0.88 1.06 -0.85 3.16 2.07 -1.36 0.11 116.25 121.32 1j9t h VAL 207 Ca 0.22 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 1j9t h VAL 207 Cb 0.10 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 29.88 1j9t h VAL 207 CO -0.03 0.17 0.48 0.50 0.02 0.00 0.00 177.57 178.71 1j9t h LYS 208 N 0.93 1.18 -0.34 1.57 3.64 -1.50 -0.69 116.57 121.36 1j9t h LYS 208 Ca 0.34 -0.13 -0.17 0.00 -1.27 0.00 0.00 60.65 59.42 1j9t h LYS 208 Cb 0.12 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 31.70 1j9t h LYS 208 CO -0.15 0.85 -0.46 0.28 -2.27 0.00 0.00 179.45 177.70 1j9t h VAL 209 N 1.19 1.27 -0.39 2.00 2.07 -1.14 -2.97 116.25 118.27 1j9t h VAL 209 Ca 0.30 -1.64 0.01 0.00 0.82 0.00 0.00 66.70 66.19 1j9t h VAL 209 Cb 0.01 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1j9t h VAL 209 CO -0.05 0.54 0.26 0.24 0.02 0.00 0.00 177.57 178.58 1j9t h MET 210 N 0.71 0.51 0.00 1.57 2.86 -0.25 -1.95 114.93 118.38 1j9t h MET 210 Ca 0.04 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1j9t h MET 210 Cb 1.07 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 32.61 1j9t h MET 210 CO 0.11 0.34 -0.01 0.00 1.06 0.00 0.00 176.91 178.40 1j9t h ARG 211 N 0.52 0.00 0.00 1.72 3.08 -0.97 -0.98 114.38 117.75 1j9t h ARG 211 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1j9t h ARG 211 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.00 1j9t h ARG 211 CO -0.03 0.01 0.00 0.25 -1.07 0.00 0.00 179.97 179.13 1j9t n THR 212 N -3.14 0.15 -1.71 2.04 -2.24 -0.73 -4.88 114.28 103.76 1j9t n THR 212 Ca -0.01 -0.06 -0.18 0.00 -2.27 0.00 0.00 64.05 61.52 1j9t n THR 212 Cb 0.19 -0.53 -0.06 0.00 -2.10 0.00 0.00 70.33 67.82 1j9t n THR 212 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1j9t n LEU 213 N -1.67 -1.42 -3.99 3.22 4.77 -0.37 -4.93 117.00 112.60 1j9t n LEU 213 Ca 0.07 0.37 -0.31 0.00 -0.03 0.00 0.00 56.01 56.11 1j9t n LEU 213 Cb 0.36 -2.61 -0.15 0.00 -2.33 0.00 0.00 43.42 38.68 1j9t n LEU 213 CO 0.27 -0.81 -0.34 -0.89 -1.33 0.00 0.00 177.39 174.29 1j9t s THR 214 N -2.63 2.10 0.61 -5.08 2.01 -1.26 -5.11 115.64 106.28 1j9t s THR 214 Ca 0.00 -2.15 -0.18 0.00 0.31 0.00 0.00 61.69 59.66 1j9t s THR 214 Cb 0.00 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.96 1j9t s THR 214 CO 0.00 -0.54 1.23 -2.16 -0.69 0.00 0.00 174.62 172.46 1j9t s PRO 215 N 1.01 2.83 0.18 4.92 0.04 -1.26 -4.91 135.00 137.80 1j9t s PRO 215 Ca 0.09 1.88 0.18 0.00 0.04 0.00 0.00 61.00 63.19 1j9t s PRO 215 Cb -0.19 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.43 1j9t s PRO 215 CO -0.09 -1.33 1.09 1.79 0.04 0.00 0.00 177.00 178.49 1j9t h THR 216 N 0.74 0.44 -3.59 1.26 1.35 -1.16 -3.47 112.91 108.48 1j9t h THR 216 Ca -0.50 -1.75 -0.17 0.00 -0.55 0.00 0.00 66.41 63.44 1j9t h THR 216 Cb 1.31 2.01 -0.23 0.00 -1.73 0.00 0.00 68.15 69.50 1j9t h THR 216 CO 0.54 0.25 -0.57 -1.00 -0.25 0.00 0.00 175.52 174.49 1j9t s HIS 217 N -3.05 0.03 -0.17 4.73 3.76 -1.11 -4.86 115.29 114.61 1j9t s HIS 217 Ca 0.00 -0.05 -0.04 0.00 -0.15 0.00 0.00 55.06 54.81 1j9t s HIS 217 Cb 0.08 -0.04 0.06 0.00 1.11 0.00 0.00 32.58 33.79 1j9t s HIS 217 CO 0.78 -0.18 0.08 0.08 -0.85 0.00 0.00 174.74 174.64 1j9t s VAL 218 N -0.87 0.06 0.20 -0.90 1.01 -0.36 -0.78 120.40 118.76 1j9t s VAL 218 Ca -0.10 -0.25 0.04 0.00 0.00 0.00 0.00 61.98 61.68 1j9t s VAL 218 Cb -0.06 -0.68 -0.05 0.00 0.00 0.00 0.00 36.38 35.60 1j9t s VAL 218 CO 0.01 -0.25 -0.04 0.68 0.00 0.00 0.00 175.10 175.50 1j9t s VAL 219 N 2.07 1.05 -0.05 2.92 -7.23 -0.27 0.87 120.40 119.77 1j9t s VAL 219 Ca 0.01 -2.04 -0.01 0.00 -1.81 0.00 0.00 61.98 58.14 1j9t s VAL 219 Cb -0.16 -2.15 -0.03 0.00 0.56 0.00 0.00 36.38 34.60 1j9t s VAL 219 CO -0.09 -0.49 0.01 -0.36 -0.31 0.00 0.00 175.10 173.87 1j9t s PHE 220 N -3.41 3.15 -1.55 2.82 0.08 -1.26 0.21 117.98 118.01 1j9t s PHE 220 Ca 0.24 0.16 -0.15 0.00 0.12 0.00 0.00 56.93 57.30 1j9t s PHE 220 Cb 0.05 -1.74 0.10 0.00 -0.57 0.00 0.00 43.02 40.86 1j9t s PHE 220 CO 0.05 0.48 0.87 -1.71 -0.10 0.00 0.00 175.22 174.81 1j9t n ASN 221 N 1.78 -4.35 0.00 1.36 4.05 -0.66 -2.80 115.26 114.65 1j9t n ASN 221 Ca -0.17 -0.78 0.00 0.00 0.45 0.00 0.00 54.58 54.08 1j9t n ASN 221 Cb 0.53 -3.50 0.00 0.00 1.23 0.00 0.00 39.78 38.04 1j9t n ASN 221 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1j9t n GLY 222 N -1.54 1.96 3.51 8.20 0.00 -0.62 -4.78 105.19 111.92 1j9t n GLY 222 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 1j9t n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9t s ALA 223 N -3.38 -1.80 0.24 4.61 0.00 -1.12 -4.57 121.76 115.74 1j9t s ALA 223 Ca 0.00 1.09 -0.31 0.00 0.00 0.00 0.00 51.96 52.74 1j9t s ALA 223 Cb 0.00 0.19 -0.12 0.00 0.00 0.00 0.00 23.12 23.19 1j9t s ALA 223 CO 0.00 -0.58 1.69 0.08 0.00 0.00 0.00 175.76 176.95 1j9t s VAL 224 N -2.52 2.00 0.00 0.00 1.01 0.21 -1.57 120.40 119.53 1j9t s VAL 224 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 61.98 61.99 1j9t s VAL 224 Cb -0.01 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.37 1j9t s VAL 224 CO -0.05 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.66 1j9t n GLY 225 N 3.33 0.33 0.36 4.51 0.00 -1.26 -4.86 105.19 107.61 1j9t n GLY 225 Ca 0.13 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.23 1j9t n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9t h ALA 226 N 0.00 1.74 -1.01 4.61 0.00 -1.50 -2.48 119.26 120.63 1j9t h ALA 226 Ca 0.00 -0.01 -0.66 0.00 0.00 0.00 0.00 54.91 54.24 1j9t h ALA 226 Cb 0.36 -0.18 -0.34 0.00 0.00 0.00 0.00 17.79 17.63 1j9t h ALA 226 CO 0.00 0.11 0.29 1.28 0.00 0.00 0.00 179.25 180.93 1j9t n LEU 227 N -4.49 6.60 -4.42 0.00 4.77 -1.26 -4.57 117.00 113.62 1j9t n LEU 227 Ca 0.12 -4.64 -0.23 0.00 -0.03 0.00 0.00 56.01 51.23 1j9t n LEU 227 Cb 0.29 -0.77 -0.08 0.00 -2.33 0.00 0.00 43.42 40.52 1j9t n LEU 227 CO 0.33 1.79 -0.17 0.42 -1.33 0.00 0.00 177.39 178.43 1j9t s THR 228 N -4.92 0.39 0.00 -5.08 -4.23 -0.93 -1.32 115.64 99.54 1j9t s THR 228 Ca 0.57 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.08 1j9t s THR 228 Cb 0.46 -2.41 0.00 0.00 1.34 0.00 0.00 72.50 71.88 1j9t s THR 228 CO -0.11 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.58 1j9t n GLY 229 N -0.78 3.25 0.00 3.99 0.00 -1.26 -0.70 105.19 109.69 1j9t n GLY 229 Ca -0.01 0.26 0.04 0.00 0.00 0.00 0.00 46.02 46.31 1j9t n GLY 229 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1j9t n ASP 230 N 6.27 0.00 -0.28 1.61 5.75 -1.26 -2.70 116.55 125.94 1j9t n ASP 230 Ca 0.00 0.37 0.07 0.00 -0.01 0.00 0.00 54.79 55.22 1j9t n ASP 230 Cb 0.00 -0.42 0.11 0.00 -1.03 0.00 0.00 41.12 39.78 1j9t n ASP 230 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1j9t n LYS 231 N -1.42 0.97 -2.11 0.11 5.02 0.12 -5.05 118.16 115.80 1j9t n LYS 231 Ca 0.03 -2.28 -0.38 0.00 -2.02 0.00 0.00 58.31 53.66 1j9t n LYS 231 Cb 0.09 -1.23 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 1j9t n LYS 231 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1j9t s ALA 232 N -2.15 2.96 0.50 7.82 0.00 -1.10 -4.05 121.76 125.74 1j9t s ALA 232 Ca 0.25 1.07 -0.19 0.00 0.00 0.00 0.00 51.96 53.09 1j9t s ALA 232 Cb 0.23 -3.44 -0.08 0.00 0.00 0.00 0.00 23.12 19.83 1j9t s ALA 232 CO 0.00 -0.86 1.00 -1.64 0.00 0.00 0.00 175.76 174.27 1j9t s MET 233 N -2.71 3.87 0.31 0.00 -1.94 0.09 -4.83 119.30 114.10 1j9t s MET 233 Ca 0.65 1.16 0.10 0.00 -1.71 0.00 0.00 55.69 55.89 1j9t s MET 233 Cb -0.33 -2.12 -0.06 0.00 2.01 0.00 0.00 34.83 34.34 1j9t s MET 233 CO 0.39 -0.35 -0.13 0.95 -0.01 0.00 0.00 175.02 175.88 1j9t s THR 234 N -2.28 2.26 0.12 2.05 -4.23 -1.26 -0.25 115.64 112.05 1j9t s THR 234 Ca 0.63 -2.27 -0.25 0.00 -1.18 0.00 0.00 61.69 58.62 1j9t s THR 234 Cb -0.13 -2.49 0.08 0.00 1.34 0.00 0.00 72.50 71.31 1j9t s THR 234 CO 0.24 -0.29 1.10 0.00 -0.54 0.00 0.00 174.62 175.12 1j9t s ALA 235 N -2.62 -1.83 0.05 3.99 0.00 -1.02 -4.90 121.76 115.43 1j9t s ALA 235 Ca 0.31 -0.08 0.02 0.00 0.00 0.00 0.00 51.96 52.21 1j9t s ALA 235 Cb -0.00 0.72 -0.03 0.00 0.00 0.00 0.00 23.12 23.81 1j9t s ALA 235 CO 0.15 -1.08 -0.07 0.00 0.00 0.00 0.00 175.76 174.76 1j9t s ALA 236 N -2.34 0.63 0.20 0.00 0.00 -1.26 -2.13 121.76 116.86 1j9t s ALA 236 Ca 0.21 -0.86 -0.32 0.00 0.00 0.00 0.00 51.96 50.98 1j9t s ALA 236 Cb -0.01 0.07 -0.14 0.00 0.00 0.00 0.00 23.12 23.04 1j9t s ALA 236 CO 0.03 -0.06 1.50 0.28 0.00 0.00 0.00 175.76 177.51 1j9t n VAL 237 N 1.20 0.47 0.00 0.00 0.31 -0.41 -0.79 118.33 119.11 1j9t n VAL 237 Ca -0.21 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1j9t n VAL 237 Cb 0.56 -1.53 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 1j9t n VAL 237 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1j9t n GLY 238 N 2.79 2.38 3.77 2.92 0.00 0.12 -4.99 105.19 112.17 1j9t n GLY 238 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 1j9t n GLY 238 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j9t s GLU 239 N -0.79 4.62 -0.21 1.61 2.02 0.03 -4.79 118.70 121.18 1j9t s GLU 239 Ca 0.00 1.48 -0.10 0.00 0.02 0.00 0.00 54.97 56.36 1j9t s GLU 239 Cb 0.00 -2.97 -0.05 0.00 0.10 0.00 0.00 34.13 31.21 1j9t s GLU 239 CO 0.00 0.28 0.15 0.15 0.02 0.00 0.00 175.26 175.87 1j9t s LYS 240 N -1.75 4.14 -0.03 1.61 1.02 -1.26 -2.07 119.74 121.40 1j9t s LYS 240 Ca 0.47 -0.22 0.04 0.00 0.02 0.00 0.00 55.97 56.28 1j9t s LYS 240 Cb -0.23 -3.47 -0.00 0.00 -0.52 0.00 0.00 37.83 33.60 1j9t s LYS 240 CO 0.30 0.20 -0.14 0.08 -0.92 0.00 0.00 175.35 174.86 1j9t s VAL 241 N 0.65 1.17 -0.17 3.17 1.01 0.18 -0.05 120.40 126.36 1j9t s VAL 241 Ca 0.08 -0.59 -0.06 0.00 0.00 0.00 0.00 61.98 61.42 1j9t s VAL 241 Cb -0.12 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.22 1j9t s VAL 241 CO 0.01 0.34 0.01 -0.22 0.00 0.00 0.00 175.10 175.24 1j9t s LEU 242 N -0.01 3.51 -0.32 3.92 2.96 0.39 -1.32 118.68 127.82 1j9t s LEU 242 Ca -0.01 -0.04 -0.00 0.00 -0.22 0.00 0.00 54.13 53.86 1j9t s LEU 242 Cb -0.09 -1.87 0.07 0.00 0.50 0.00 0.00 46.19 44.80 1j9t s LEU 242 CO 0.01 0.16 0.02 -0.63 -1.32 0.00 0.00 176.35 174.59 1j9t s ILE 243 N 0.43 2.79 0.04 6.68 1.01 0.34 -1.30 121.20 131.18 1j9t s ILE 243 Ca -0.00 -1.69 -0.23 0.00 0.00 0.00 0.00 60.65 58.73 1j9t s ILE 243 Cb -0.13 -2.73 -0.06 0.00 0.01 0.00 0.00 42.46 39.54 1j9t s ILE 243 CO 0.02 -0.27 0.68 -0.69 0.00 0.00 0.00 174.94 174.68 1j9t s VAL 244 N 1.15 4.77 -0.02 2.92 1.01 -0.05 -1.77 120.40 128.41 1j9t s VAL 244 Ca -0.01 1.44 0.01 0.00 0.00 0.00 0.00 61.98 63.43 1j9t s VAL 244 Cb -0.20 -4.02 0.01 0.00 0.00 0.00 0.00 36.38 32.16 1j9t s VAL 244 CO -0.03 0.42 -0.04 -2.28 0.00 0.00 0.00 175.10 173.16 1j9t s HIS 245 N -0.30 0.55 0.06 5.22 2.46 0.01 -0.44 115.29 122.86 1j9t s HIS 245 Ca 0.34 -0.11 0.01 0.00 0.47 0.00 0.00 55.06 55.77 1j9t s HIS 245 Cb -0.20 -0.45 -0.03 0.00 -0.13 0.00 0.00 32.58 31.77 1j9t s HIS 245 CO 0.21 -0.09 -0.06 -1.54 -2.47 0.00 0.00 174.74 170.79 1j9t s SER 246 N 0.39 0.78 -0.23 9.88 1.04 -1.01 0.22 113.70 124.77 1j9t s SER 246 Ca -0.04 -0.76 -0.03 0.00 0.48 0.00 0.00 55.95 55.59 1j9t s SER 246 Cb -0.08 0.09 0.12 0.00 0.10 0.00 0.00 66.02 66.25 1j9t s SER 246 CO -0.00 -0.37 0.32 -1.58 0.98 0.00 0.00 173.24 172.59 1j9t s GLN 247 N -2.66 0.29 0.17 4.02 -0.44 -0.72 -1.51 119.66 118.80 1j9t s GLN 247 Ca -0.01 0.44 0.27 0.00 -2.50 0.00 0.00 55.36 53.55 1j9t s GLN 247 Cb -0.02 -0.70 0.90 0.00 -1.64 0.00 0.00 33.01 31.55 1j9t s GLN 247 CO -0.03 -0.63 1.81 0.00 0.50 0.00 0.00 175.29 176.94 1j9t n ALA 248 N 5.35 2.28 0.00 1.58 0.00 -1.26 0.63 120.51 129.08 1j9t n ALA 248 Ca -0.04 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1j9t n ALA 248 Cb 0.50 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1j9t n ALA 248 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1j9t n ASN 249 N -2.10 1.16 -3.89 0.00 5.15 -1.26 -2.90 115.26 111.42 1j9t n ASN 249 Ca 0.06 -0.01 -0.11 0.00 -0.60 0.00 0.00 54.58 53.92 1j9t n ASN 249 Cb 0.41 0.25 -0.11 0.00 -0.53 0.00 0.00 39.78 39.80 1j9t n ASN 249 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1j9t s ARG 250 N -0.48 0.39 0.68 1.20 3.52 -1.26 -4.65 118.95 118.35 1j9t s ARG 250 Ca 0.00 -0.37 -0.17 0.00 -0.13 0.00 0.00 55.73 55.07 1j9t s ARG 250 Cb 0.00 0.16 0.01 0.00 -1.56 0.00 0.00 34.95 33.55 1j9t s ARG 250 CO 0.00 -0.08 1.20 -0.25 -0.81 0.00 0.00 175.30 175.35 1j9t n ASP 251 N 1.73 1.52 -3.90 -2.12 10.43 -1.26 -3.47 116.55 119.48 1j9t n ASP 251 Ca -0.21 0.76 -0.09 0.00 2.57 0.00 0.00 54.79 57.81 1j9t n ASP 251 Cb 0.56 -1.51 -0.07 0.00 1.84 0.00 0.00 41.12 41.94 1j9t n ASP 251 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 1j9t s THR 252 N -1.59 0.12 -0.40 -3.53 -1.32 -0.22 -4.83 115.64 103.87 1j9t s THR 252 Ca 0.79 -1.26 0.03 0.00 -1.21 0.00 0.00 61.69 60.04 1j9t s THR 252 Cb -0.36 -1.52 0.16 0.00 -1.51 0.00 0.00 72.50 69.28 1j9t s THR 252 CO 0.44 -0.53 0.32 0.00 -2.21 0.00 0.00 174.62 172.64 1j9t s ARG 253 N -3.90 0.83 0.66 7.08 1.70 -1.26 -1.41 118.95 122.64 1j9t s ARG 253 Ca 0.09 -1.93 -0.17 0.00 -0.47 0.00 0.00 55.73 53.25 1j9t s ARG 253 Cb 0.04 -1.37 -0.00 0.00 -0.57 0.00 0.00 34.95 33.05 1j9t s ARG 253 CO -0.07 -1.35 1.24 -2.14 -1.08 0.00 0.00 175.30 171.90 1j9t s PRO 254 N 0.28 2.56 -0.27 3.89 0.02 -1.12 -0.02 135.00 140.34 1j9t s PRO 254 Ca 0.30 1.90 -0.14 0.00 0.02 0.00 0.00 61.00 63.08 1j9t s PRO 254 Cb -0.02 -1.87 0.09 0.00 0.02 0.00 0.00 34.50 32.73 1j9t s PRO 254 CO -0.15 -1.55 0.65 1.21 -0.33 0.00 0.00 177.00 176.83 1j9t s ASN 255 N -1.64 -0.94 -0.60 2.53 3.84 -0.43 -1.18 114.94 116.51 1j9t s ASN 255 Ca 0.79 1.47 -0.19 0.00 0.21 0.00 0.00 52.86 55.14 1j9t s ASN 255 Cb -0.33 1.53 0.10 0.00 -0.55 0.00 0.00 41.25 42.01 1j9t s ASN 255 CO 0.39 -0.23 0.74 -0.22 -2.79 0.00 0.00 177.10 174.99 1j9t s LEU 256 N 1.90 5.30 -0.07 3.21 2.96 -1.26 -1.51 118.68 129.21 1j9t s LEU 256 Ca -0.09 -1.41 -0.30 0.00 -0.22 0.00 0.00 54.13 52.12 1j9t s LEU 256 Cb -0.07 -2.31 -0.06 0.00 0.50 0.00 0.00 46.19 44.25 1j9t s LEU 256 CO -0.19 -1.15 1.77 -0.63 -1.32 0.00 0.00 176.35 174.83 1j9t s ILE 257 N 2.81 3.41 0.00 6.68 -1.09 0.12 -1.29 121.20 131.85 1j9t s ILE 257 Ca 0.13 0.49 0.00 0.00 -2.23 0.00 0.00 60.65 59.04 1j9t s ILE 257 Cb -0.23 -3.35 0.00 0.00 -1.58 0.00 0.00 42.46 37.30 1j9t s ILE 257 CO 0.06 -0.08 0.00 0.61 -1.23 0.00 0.00 174.94 174.30 1j9t n GLY 258 N 4.45 2.72 0.00 6.18 0.00 -1.26 -3.17 105.19 114.11 1j9t n GLY 258 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1j9t n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j9t n GLY 259 N -0.90 5.21 3.74 -0.02 0.00 -0.41 -5.00 105.19 107.81 1j9t n GLY 259 Ca 0.00 -1.56 -0.10 0.00 0.00 0.00 0.00 46.02 44.36 1j9t n GLY 259 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1j9t s HIS 260 N 2.37 0.32 -0.62 1.61 0.09 -1.25 -4.83 115.29 112.98 1j9t s HIS 260 Ca 0.00 -0.90 -0.04 0.00 -0.00 0.00 0.00 55.06 54.12 1j9t s HIS 260 Cb 0.00 0.63 0.16 0.00 -0.00 0.00 0.00 32.58 33.37 1j9t s HIS 260 CO 0.00 -1.47 0.45 0.20 -0.00 0.00 0.00 174.74 173.93 1j9t s GLY 261 N -3.10 2.46 0.21 -2.22 0.00 -0.04 -4.74 107.32 99.89 1j9t s GLY 261 Ca 0.19 -3.18 -0.09 0.00 0.00 0.00 0.00 44.72 41.64 1j9t s GLY 261 CO 0.13 1.11 1.76 -0.55 0.00 0.00 0.00 173.10 175.56 1j9t h ASP 262 N 7.25 0.32 -3.40 1.64 3.32 -1.66 0.43 116.42 124.33 1j9t h ASP 262 Ca -0.02 0.07 -0.40 0.00 0.02 0.00 0.00 57.03 56.70 1j9t h ASP 262 Cb 0.97 0.02 -0.35 0.00 0.22 0.00 0.00 39.33 40.19 1j9t h ASP 262 CO 0.72 0.19 -0.76 -0.31 -1.72 0.00 0.00 179.24 177.36 1j9t s TYR 263 N -6.09 0.60 -0.13 4.55 1.51 -0.97 -1.51 117.35 115.31 1j9t s TYR 263 Ca -0.13 -0.13 -0.01 0.00 -1.01 0.00 0.00 57.07 55.79 1j9t s TYR 263 Cb 0.17 -0.64 0.04 0.00 -0.11 0.00 0.00 41.96 41.42 1j9t s TYR 263 CO 0.75 -0.22 -0.01 0.08 -1.11 0.00 0.00 175.55 175.04 1j9t s VAL 264 N 1.30 0.69 -1.19 0.71 1.01 0.37 0.07 120.40 123.35 1j9t s VAL 264 Ca -0.05 -0.31 -0.15 0.00 0.00 0.00 0.00 61.98 61.47 1j9t s VAL 264 Cb -0.13 -0.93 0.15 0.00 0.00 0.00 0.00 36.38 35.47 1j9t s VAL 264 CO -0.02 0.11 1.45 0.26 0.00 0.00 0.00 175.10 176.90 1j9t s TRP 265 N 1.82 3.37 0.26 5.22 0.51 0.43 -0.79 118.94 129.77 1j9t s TRP 265 Ca 0.02 -2.00 -0.03 0.00 -2.12 0.00 0.00 56.10 51.97 1j9t s TRP 265 Cb -0.14 -4.37 0.43 0.00 -0.81 0.00 0.00 33.47 28.58 1j9t s TRP 265 CO -0.07 -1.46 1.84 0.00 -0.51 0.00 0.00 176.95 176.75 1j9t h ALA 266 N 7.37 1.31 0.00 0.98 0.00 -1.89 0.58 119.26 127.60 1j9t h ALA 266 Ca 0.32 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1j9t h ALA 266 Cb 0.89 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1j9t h ALA 266 CO 1.26 0.22 0.00 0.25 0.00 0.00 0.00 179.25 180.98 1j9t n THR 267 N -4.65 0.01 -0.94 0.00 -2.24 -1.26 -4.47 114.28 100.73 1j9t n THR 267 Ca 0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 1j9t n THR 267 Cb 0.27 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 67.99 1j9t n THR 267 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1j9t n GLY 268 N 1.33 1.11 3.56 3.38 0.00 0.16 -4.72 105.19 110.00 1j9t n GLY 268 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 1j9t n GLY 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j9t s LYS 269 N -0.01 3.85 0.55 1.61 -0.14 -1.26 -0.06 119.74 124.28 1j9t s LYS 269 Ca 0.00 -0.38 0.33 0.00 -1.36 0.00 0.00 55.97 54.56 1j9t s LYS 269 Cb 0.00 -3.37 1.51 0.00 -1.68 0.00 0.00 37.83 34.28 1j9t s LYS 269 CO 0.00 -0.01 2.04 0.74 -0.76 0.00 0.00 175.35 177.36 1j9t h PHE 270 N 7.69 0.00 -0.00 3.18 0.05 -1.85 -2.07 116.94 123.94 1j9t h PHE 270 Ca -0.37 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.42 1j9t h PHE 270 Cb 1.18 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.13 1j9t h PHE 270 CO 0.65 0.05 -0.06 0.09 -0.18 0.00 0.00 178.31 178.86 1j9t n ASN 271 N -3.21 0.25 -4.57 2.17 3.02 -1.26 -4.58 115.26 107.08 1j9t n ASN 271 Ca -0.00 -0.43 -0.40 0.00 -0.03 0.00 0.00 54.58 53.72 1j9t n ASN 271 Cb 0.27 -0.15 -0.10 0.00 -0.61 0.00 0.00 39.78 39.19 1j9t n ASN 271 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1j9t s THR 272 N -2.49 5.21 0.24 3.41 2.01 -0.78 -5.04 115.64 118.20 1j9t s THR 272 Ca 0.30 0.17 -0.30 0.00 0.31 0.00 0.00 61.69 62.17 1j9t s THR 272 Cb 0.20 -3.72 -0.15 0.00 0.01 0.00 0.00 72.50 68.84 1j9t s THR 272 CO 0.46 0.04 1.11 -2.65 -0.69 0.00 0.00 174.62 172.90 1j9t n PRO 273 N 5.28 1.33 -2.53 4.92 -0.02 -1.26 -4.86 135.00 137.86 1j9t n PRO 273 Ca -0.10 0.47 -0.34 0.00 -2.02 0.00 0.00 63.50 61.51 1j9t n PRO 273 Cb 0.50 -1.92 -0.04 0.00 -0.02 0.00 0.00 33.50 32.03 1j9t n PRO 273 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1j9t s PRO 274 N -0.96 3.82 0.75 0.52 0.04 -1.26 -4.92 135.00 133.00 1j9t s PRO 274 Ca 0.65 1.30 -0.12 0.00 0.04 0.00 0.00 61.00 62.88 1j9t s PRO 274 Cb -0.76 -2.10 0.04 0.00 0.04 0.00 0.00 34.50 31.72 1j9t s PRO 274 CO 0.56 -0.41 1.11 -0.51 0.04 0.00 0.00 177.00 177.80 1j9t s ASP 275 N -2.11 4.98 0.10 6.66 1.01 0.03 -4.73 116.67 122.61 1j9t s ASP 275 Ca 0.66 1.10 0.03 0.00 0.71 0.00 0.00 52.55 55.05 1j9t s ASP 275 Cb -0.15 -1.82 -0.04 0.00 1.01 0.00 0.00 42.92 41.93 1j9t s ASP 275 CO 0.21 -1.64 -0.09 0.68 0.21 0.00 0.00 175.17 174.54 1j9t s VAL 276 N -3.35 0.92 -1.42 -1.27 -7.23 -1.26 -0.48 120.40 106.31 1j9t s VAL 276 Ca 0.60 -1.73 -0.05 0.00 -1.81 0.00 0.00 61.98 58.99 1j9t s VAL 276 Cb -0.12 -1.46 0.02 0.00 0.56 0.00 0.00 36.38 35.38 1j9t s VAL 276 CO 0.52 -0.63 0.40 0.47 -0.31 0.00 0.00 175.10 175.54 1j9t n ASP 277 N 0.37 -5.00 -4.77 4.85 10.43 -0.57 -4.94 116.55 116.93 1j9t n ASP 277 Ca -0.15 -0.20 -0.37 0.00 2.57 0.00 0.00 54.79 56.64 1j9t n ASP 277 Cb 0.59 -4.11 -0.00 0.00 1.84 0.00 0.00 41.12 39.44 1j9t n ASP 277 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 1j9t s GLN 278 N -5.60 3.68 -0.26 -1.24 -1.52 0.10 -4.76 119.66 110.06 1j9t s GLN 278 Ca 0.24 1.86 -0.13 0.00 -1.95 0.00 0.00 55.36 55.39 1j9t s GLN 278 Cb -0.12 -2.41 -0.14 0.00 -0.22 0.00 0.00 33.01 30.12 1j9t s GLN 278 CO 0.30 -0.64 -0.25 -0.85 -0.25 0.00 0.00 175.29 173.60 1j9t n GLU 279 N -0.52 0.60 -3.79 2.91 0.28 -1.26 -0.86 120.64 118.00 1j9t n GLU 279 Ca 0.07 0.29 -0.17 0.00 -0.16 0.00 0.00 57.16 57.19 1j9t n GLU 279 Cb 0.47 -1.53 -0.17 0.00 1.43 0.00 0.00 31.44 31.65 1j9t n GLU 279 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 1j9t s THR 280 N -2.49 0.02 0.48 3.84 2.01 -1.26 -4.21 115.64 114.02 1j9t s THR 280 Ca -0.37 0.23 0.07 0.00 0.31 0.00 0.00 61.69 61.93 1j9t s THR 280 Cb 0.13 -0.17 0.01 0.00 0.01 0.00 0.00 72.50 72.48 1j9t s THR 280 CO 0.52 0.13 0.46 -1.66 -0.69 0.00 0.00 174.62 173.38 1j9t s TRP 281 N 1.37 2.22 -0.06 4.92 -2.14 -0.32 -4.97 118.94 119.95 1j9t s TRP 281 Ca -0.05 -0.62 0.03 0.00 2.66 0.00 0.00 56.10 58.11 1j9t s TRP 281 Cb -0.13 -2.12 0.01 0.00 -3.10 0.00 0.00 33.47 28.14 1j9t s TRP 281 CO -0.03 -0.39 -0.13 0.12 -2.66 0.00 0.00 176.95 173.86 1j9t s PHE 282 N -2.58 1.49 -0.18 1.66 5.36 -1.26 -2.81 117.98 119.67 1j9t s PHE 282 Ca 0.47 -0.54 0.00 0.00 -0.96 0.00 0.00 56.93 55.90 1j9t s PHE 282 Cb -0.04 -1.08 0.04 0.00 -0.34 0.00 0.00 43.02 41.60 1j9t s PHE 282 CO 0.28 -0.26 -0.09 0.42 -1.46 0.00 0.00 175.22 174.11 1j9t s ILE 283 N 0.57 1.42 0.51 3.12 1.01 -0.50 -4.70 121.20 122.62 1j9t s ILE 283 Ca -0.13 -0.81 -0.20 0.00 0.00 0.00 0.00 60.65 59.51 1j9t s ILE 283 Cb -0.15 -1.51 -0.08 0.00 0.01 0.00 0.00 42.46 40.73 1j9t s ILE 283 CO 0.04 0.19 1.07 -2.16 0.00 0.00 0.00 174.94 174.07 1j9t s PRO 284 N 1.50 3.66 0.22 2.79 0.04 -1.26 -1.06 135.00 140.89 1j9t s PRO 284 Ca 0.00 1.44 -0.31 0.00 0.04 0.00 0.00 61.00 62.17 1j9t s PRO 284 Cb -0.15 -2.07 -0.14 0.00 0.04 0.00 0.00 34.50 32.18 1j9t s PRO 284 CO -0.08 -0.57 1.26 0.41 0.04 0.00 0.00 177.00 178.06 1j9t n GLY 285 N -0.13 0.35 1.00 0.56 0.00 -1.23 -2.22 105.19 103.52 1j9t n GLY 285 Ca 0.10 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.61 1j9t n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j9t n GLY 286 N 1.94 0.75 3.49 -0.02 0.00 0.20 -4.74 105.19 106.81 1j9t n GLY 286 Ca 0.12 -0.54 -0.10 0.00 0.00 0.00 0.00 46.02 45.51 1j9t n GLY 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9t s ALA 287 N -2.00 0.05 0.10 4.61 0.00 -0.80 -4.80 121.76 118.92 1j9t s ALA 287 Ca 0.00 -1.03 0.07 0.00 0.00 0.00 0.00 51.96 51.00 1j9t s ALA 287 Cb 0.00 1.11 -0.03 0.00 0.00 0.00 0.00 23.12 24.20 1j9t s ALA 287 CO 0.00 -0.78 -0.18 0.00 0.00 0.00 0.00 175.76 174.80 1j9t s ALA 288 N -4.04 1.60 0.26 0.00 0.00 -1.26 -1.75 121.76 116.57 1j9t s ALA 288 Ca 0.25 -1.21 0.02 0.00 0.00 0.00 0.00 51.96 51.02 1j9t s ALA 288 Cb 0.01 -0.17 -0.04 0.00 0.00 0.00 0.00 23.12 22.92 1j9t s ALA 288 CO 0.09 0.26 0.13 0.20 0.00 0.00 0.00 175.76 176.43 1j9t s GLY 289 N -2.02 1.79 -0.09 0.00 0.00 0.13 -3.14 107.32 104.00 1j9t s GLY 289 Ca 0.05 -1.80 -0.08 0.00 0.00 0.00 0.00 44.72 42.90 1j9t s GLY 289 CO 0.04 -1.55 0.24 0.00 0.00 0.00 0.00 173.10 171.83 1j9t s ALA 290 N -3.79 -0.58 0.04 3.20 0.00 -0.97 -0.81 121.76 118.85 1j9t s ALA 290 Ca 0.37 0.73 0.08 0.00 0.00 0.00 0.00 51.96 53.14 1j9t s ALA 290 Cb 0.07 -0.44 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 1j9t s ALA 290 CO 0.15 -0.13 -0.22 0.00 0.00 0.00 0.00 175.76 175.56 1j9t s ALA 291 N 0.35 1.86 -0.12 0.00 0.00 -0.73 -0.43 121.76 122.70 1j9t s ALA 291 Ca -0.02 -1.08 0.03 0.00 0.00 0.00 0.00 51.96 50.89 1j9t s ALA 291 Cb -0.03 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.71 1j9t s ALA 291 CO -0.01 0.43 -0.23 0.12 0.00 0.00 0.00 175.76 176.06 1j9t s PHE 292 N -0.76 2.61 -0.01 0.00 2.19 0.11 -0.51 117.98 121.60 1j9t s PHE 292 Ca 0.08 -1.16 -0.02 0.00 0.33 0.00 0.00 56.93 56.17 1j9t s PHE 292 Cb -0.09 -1.75 -0.00 0.00 -1.31 0.00 0.00 43.02 39.87 1j9t s PHE 292 CO 0.02 -0.49 0.04 -0.47 1.83 0.00 0.00 175.22 176.14 1j9t s TYR 293 N 0.52 0.01 -0.32 10.12 5.04 -0.43 -1.85 117.35 130.44 1j9t s TYR 293 Ca -0.14 -0.01 -0.05 0.00 -2.44 0.00 0.00 57.07 54.42 1j9t s TYR 293 Cb -0.17 -0.02 0.04 0.00 0.35 0.00 0.00 41.96 42.15 1j9t s TYR 293 CO 0.05 -0.07 0.08 0.99 -1.34 0.00 0.00 175.55 175.25 1j9t s THR 294 N -0.34 3.63 0.31 4.34 2.01 -1.26 -0.65 115.64 123.67 1j9t s THR 294 Ca -0.04 -1.13 -0.29 0.00 0.31 0.00 0.00 61.69 60.54 1j9t s THR 294 Cb -0.03 -3.03 -0.11 0.00 0.01 0.00 0.00 72.50 69.34 1j9t s THR 294 CO -0.00 -0.13 1.46 -0.36 -0.69 0.00 0.00 174.62 174.90 1j9t s PHE 295 N 1.38 2.86 0.00 4.92 0.40 -0.88 -4.85 117.98 121.81 1j9t s PHE 295 Ca -0.02 1.09 0.00 0.00 -0.60 0.00 0.00 56.93 57.40 1j9t s PHE 295 Cb -0.19 -3.90 0.00 0.00 0.51 0.00 0.00 43.02 39.44 1j9t s PHE 295 CO 0.02 -2.78 0.00 1.04 0.70 0.00 0.00 175.22 174.19 1j9t n GLN 296 N 1.51 5.00 -4.30 0.44 6.02 -1.26 0.13 117.38 124.93 1j9t n GLN 296 Ca 0.04 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.85 1j9t n GLN 296 Cb 0.40 -0.59 -0.13 0.00 1.02 0.00 0.00 30.24 30.93 1j9t n GLN 296 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1j9t s GLN 297 N -1.16 0.76 0.67 -1.09 -1.52 -1.26 -4.54 119.66 111.52 1j9t s GLN 297 Ca 0.00 -0.58 -0.06 0.00 -1.95 0.00 0.00 55.36 52.77 1j9t s GLN 297 Cb 0.00 -0.72 0.04 0.00 -0.22 0.00 0.00 33.01 32.12 1j9t s GLN 297 CO 0.00 0.18 0.97 -1.25 -0.25 0.00 0.00 175.29 174.94 1j9t s PRO 298 N -0.84 2.43 0.00 2.91 0.04 -1.26 -4.78 135.00 133.49 1j9t s PRO 298 Ca 0.00 -0.20 0.00 0.00 0.04 0.00 0.00 61.00 60.85 1j9t s PRO 298 Cb -0.06 -2.21 0.00 0.00 0.04 0.00 0.00 34.50 32.27 1j9t s PRO 298 CO 0.00 -1.06 0.00 0.41 0.04 0.00 0.00 177.00 176.39 1j9t n GLY 299 N -2.80 0.17 3.80 0.56 0.00 0.18 -4.92 105.19 102.18 1j9t n GLY 299 Ca 0.07 -2.30 -0.39 0.00 0.00 0.00 0.00 46.02 43.41 1j9t n GLY 299 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1j9t s ILE 300 N -0.43 4.70 0.05 -0.61 2.07 -1.26 -0.67 121.20 125.05 1j9t s ILE 300 Ca 0.00 1.29 0.07 0.00 -1.41 0.00 0.00 60.65 60.60 1j9t s ILE 300 Cb 0.00 -3.94 -0.02 0.00 0.13 0.00 0.00 42.46 38.63 1j9t s ILE 300 CO 0.00 0.54 -0.19 -0.31 -1.91 0.00 0.00 174.94 173.07 1j9t s TYR 301 N -1.02 1.66 -0.20 3.50 1.51 0.23 -4.97 117.35 118.07 1j9t s TYR 301 Ca 0.30 -0.37 -0.06 0.00 -1.01 0.00 0.00 57.07 55.93 1j9t s TYR 301 Cb -0.20 -0.98 -0.03 0.00 -0.11 0.00 0.00 41.96 40.64 1j9t s TYR 301 CO 0.20 0.08 0.03 0.00 -1.11 0.00 0.00 175.55 174.75 1j9t s ALA 302 N -0.84 3.18 -0.34 3.71 0.00 -1.19 -0.95 121.76 125.34 1j9t s ALA 302 Ca 0.06 -0.90 -0.08 0.00 0.00 0.00 0.00 51.96 51.04 1j9t s ALA 302 Cb -0.09 -1.85 0.03 0.00 0.00 0.00 0.00 23.12 21.21 1j9t s ALA 302 CO 0.02 -0.04 0.13 -0.47 0.00 0.00 0.00 175.76 175.39 1j9t s TYR 303 N 0.80 3.23 0.22 0.00 5.04 0.63 0.16 117.35 127.43 1j9t s TYR 303 Ca 0.02 -1.20 0.02 0.00 -2.44 0.00 0.00 57.07 53.47 1j9t s TYR 303 Cb -0.14 -2.31 -0.05 0.00 0.35 0.00 0.00 41.96 39.81 1j9t s TYR 303 CO 0.02 -0.67 0.02 0.14 -1.34 0.00 0.00 175.55 173.72 1j9t s VAL 304 N 1.46 0.78 -0.25 3.14 -7.23 -0.57 -0.19 120.40 117.54 1j9t s VAL 304 Ca 0.00 -2.00 -0.25 0.00 -1.81 0.00 0.00 61.98 57.92 1j9t s VAL 304 Cb -0.19 -2.33 -0.00 0.00 0.56 0.00 0.00 36.38 34.42 1j9t s VAL 304 CO 0.04 -0.30 0.87 0.21 -0.31 0.00 0.00 175.10 175.60 1j9t s ASN 305 N -3.26 6.87 0.00 4.85 3.84 -1.01 -1.32 114.94 124.91 1j9t s ASN 305 Ca 0.29 1.06 0.00 0.00 0.21 0.00 0.00 52.86 54.42 1j9t s ASN 305 Cb 0.06 -2.45 0.00 0.00 -0.55 0.00 0.00 41.25 38.31 1j9t s ASN 305 CO 0.08 -0.56 0.50 1.57 -2.79 0.00 0.00 177.10 175.90 1j9t n HIS 306 N 6.10 0.00 -3.19 0.43 -0.00 0.98 -4.08 115.22 115.46 1j9t n HIS 306 Ca 0.07 -0.09 -0.44 0.00 -0.00 0.00 0.00 57.72 57.26 1j9t n HIS 306 Cb 0.47 -0.11 -0.06 0.00 -0.00 0.00 0.00 29.99 30.29 1j9t n HIS 306 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1j9t s ASN 307 N 0.07 6.20 0.66 0.26 3.84 -1.26 -4.91 114.94 119.80 1j9t s ASN 307 Ca 0.00 -1.17 0.41 0.00 0.21 0.00 0.00 52.86 52.31 1j9t s ASN 307 Cb 0.00 -2.27 2.25 0.00 -0.55 0.00 0.00 41.25 40.68 1j9t s ASN 307 CO 0.00 -0.91 2.29 -0.07 -2.79 0.00 0.00 177.10 175.62 1j9t h LEU 308 N 9.57 0.00 -0.09 3.21 3.38 -1.99 0.73 115.31 130.12 1j9t h LEU 308 Ca -0.28 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.62 1j9t h LEU 308 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1j9t h LEU 308 CO 0.99 0.00 -0.23 0.40 0.09 0.00 0.00 178.44 179.69 1j9t h ILE 309 N 0.00 1.41 -0.71 1.22 2.04 -1.91 0.94 117.51 120.50 1j9t h ILE 309 Ca 0.00 -1.56 -0.02 0.00 1.00 0.00 0.00 64.86 64.28 1j9t h ILE 309 Cb 0.12 2.20 -0.03 0.00 -0.74 0.00 0.00 36.82 38.37 1j9t h ILE 309 CO -0.00 0.45 0.36 -0.33 0.00 0.00 0.00 178.15 178.63 1j9t h GLU 310 N -0.16 1.01 0.10 2.37 5.08 -1.24 0.14 114.58 121.88 1j9t h GLU 310 Ca -0.00 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1j9t h GLU 310 Cb 0.83 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1j9t h GLU 310 CO 0.05 0.76 -0.05 0.00 -1.00 0.00 0.00 179.01 178.77 1j9t h ALA 311 N 1.39 -0.13 0.00 3.43 0.00 -1.13 -1.48 119.26 121.34 1j9t h ALA 311 Ca 0.25 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1j9t h ALA 311 Cb 0.07 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1j9t h ALA 311 CO -0.04 -0.27 -1.58 1.19 0.00 0.00 0.00 179.25 178.55 1j9t n PHE 312 N -4.88 0.34 -0.12 0.00 3.01 0.32 -2.52 117.46 113.60 1j9t n PHE 312 Ca -0.08 0.10 -0.16 0.00 1.01 0.00 0.00 57.45 58.32 1j9t n PHE 312 Cb 0.28 -0.63 -0.12 0.00 -0.01 0.00 0.00 39.48 39.00 1j9t n PHE 312 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1j9t n GLU 313 N -2.36 0.65 0.05 -1.08 -0.58 0.37 -4.66 120.64 113.05 1j9t n GLU 313 Ca -0.02 0.12 0.11 0.00 -0.42 0.00 0.00 57.16 56.95 1j9t n GLU 313 Cb 0.55 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.93 1j9t n GLU 313 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1j9t n LEU 314 N -3.14 0.62 0.00 -4.62 4.32 -0.46 -5.02 117.00 108.70 1j9t n LEU 314 Ca -0.42 0.14 0.00 0.00 -0.02 0.00 0.00 56.01 55.71 1j9t n LEU 314 Cb 0.99 -0.08 0.00 0.00 -1.62 0.00 0.00 43.42 42.71 1j9t n LEU 314 CO 0.27 -0.06 0.00 0.61 -1.22 0.00 0.00 177.39 176.99 1j9t n GLY 315 N 1.28 0.97 2.46 -0.72 0.00 -0.74 -1.22 105.19 107.23 1j9t n GLY 315 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 1j9t n GLY 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j9t n ALA 316 N -0.58 6.76 -3.65 4.61 0.00 0.25 -4.27 120.51 123.65 1j9t n ALA 316 Ca 0.00 -3.54 -0.15 0.00 0.00 0.00 0.00 53.44 49.76 1j9t n ALA 316 Cb 0.00 -3.41 -0.16 0.00 0.00 0.00 0.00 19.45 15.88 1j9t n ALA 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j9t s ALA 317 N 2.59 0.08 0.35 0.00 0.00 -1.25 -2.41 121.76 121.13 1j9t s ALA 317 Ca 0.62 0.26 0.05 0.00 0.00 0.00 0.00 51.96 52.89 1j9t s ALA 317 Cb 0.16 -0.22 -0.07 0.00 0.00 0.00 0.00 23.12 22.99 1j9t s ALA 317 CO -0.06 -0.09 0.03 0.00 0.00 0.00 0.00 175.76 175.64 1j9t s ALA 318 N 0.93 2.65 0.09 0.00 0.00 0.73 -4.57 121.76 121.60 1j9t s ALA 318 Ca -0.08 -2.14 0.06 0.00 0.00 0.00 0.00 51.96 49.81 1j9t s ALA 318 Cb -0.11 0.45 -0.03 0.00 0.00 0.00 0.00 23.12 23.42 1j9t s ALA 318 CO -0.03 -0.22 -0.16 -1.01 0.00 0.00 0.00 175.76 174.34 1j9t s HIS 319 N -3.06 1.46 -0.06 0.00 3.76 -0.43 -0.27 115.29 116.69 1j9t s HIS 319 Ca 0.35 -0.46 0.04 0.00 -0.15 0.00 0.00 55.06 54.84 1j9t s HIS 319 Cb 0.09 -0.80 -0.00 0.00 1.11 0.00 0.00 32.58 32.98 1j9t s HIS 319 CO 0.16 0.13 -0.18 -0.06 -0.85 0.00 0.00 174.74 173.95 1j9t s PHE 320 N -1.43 1.84 -0.27 1.40 0.08 -0.12 -0.73 117.98 118.74 1j9t s PHE 320 Ca 0.03 -0.60 -0.03 0.00 0.12 0.00 0.00 56.93 56.45 1j9t s PHE 320 Cb -0.09 -1.25 0.03 0.00 -0.57 0.00 0.00 43.02 41.13 1j9t s PHE 320 CO 0.03 -0.23 -0.01 0.15 -0.10 0.00 0.00 175.22 175.07 1j9t s LYS 321 N 0.19 2.82 -0.13 0.44 1.02 0.66 -0.60 119.74 124.14 1j9t s LYS 321 Ca -0.08 -1.01 -0.01 0.00 0.02 0.00 0.00 55.97 54.90 1j9t s LYS 321 Cb -0.13 -3.14 -0.02 0.00 -0.52 0.00 0.00 37.83 34.01 1j9t s LYS 321 CO 0.04 -0.46 -0.10 0.08 -0.92 0.00 0.00 175.35 173.98 1j9t s VAL 322 N 1.36 3.34 0.32 3.17 1.01 0.16 -2.43 120.40 127.33 1j9t s VAL 322 Ca -0.00 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.47 1j9t s VAL 322 Cb -0.17 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.78 1j9t s VAL 322 CO -0.02 0.53 0.44 0.42 0.00 0.00 0.00 175.10 176.47 1j9t s THR 323 N 0.17 4.24 -2.49 3.92 -4.23 -0.90 0.47 115.64 116.81 1j9t s THR 323 Ca -0.05 -1.02 0.00 0.00 -1.18 0.00 0.00 61.69 59.44 1j9t s THR 323 Cb -0.15 -3.47 0.00 0.00 1.34 0.00 0.00 72.50 70.23 1j9t s THR 323 CO 0.04 -0.19 0.00 0.61 -0.54 0.00 0.00 174.62 174.54 1j9t n GLY 324 N -1.58 0.80 3.80 3.99 0.00 -1.26 -1.29 105.19 109.65 1j9t n GLY 324 Ca -0.02 -2.13 -0.39 0.00 0.00 0.00 0.00 46.02 43.49 1j9t n GLY 324 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j9t s GLU 325 N -1.00 4.31 0.28 1.61 0.41 -1.26 -4.68 118.70 118.38 1j9t s GLU 325 Ca 0.00 0.86 -0.29 0.00 -0.41 0.00 0.00 54.97 55.13 1j9t s GLU 325 Cb 0.00 -3.25 -0.10 0.00 -1.78 0.00 0.00 34.13 29.01 1j9t s GLU 325 CO 0.00 0.62 1.10 -0.46 -0.49 0.00 0.00 175.26 176.03 1j9t s TRP 326 N -1.11 3.56 -0.48 1.61 -0.11 -1.26 -4.34 118.94 116.81 1j9t s TRP 326 Ca 0.31 1.69 -0.12 0.00 1.22 0.00 0.00 56.10 59.20 1j9t s TRP 326 Cb -0.21 -3.29 0.11 0.00 -1.50 0.00 0.00 33.47 28.58 1j9t s TRP 326 CO 0.21 -0.58 0.38 1.21 -4.62 0.00 0.00 176.95 173.55 1j9t s ASN 327 N -0.89 5.88 0.38 5.86 3.84 -1.26 -4.95 114.94 123.80 1j9t s ASN 327 Ca 0.45 -1.72 0.28 0.00 0.21 0.00 0.00 52.86 52.07 1j9t s ASN 327 Cb -0.32 -2.08 1.11 0.00 -0.55 0.00 0.00 41.25 39.41 1j9t s ASN 327 CO 0.41 -0.70 1.82 0.44 -2.79 0.00 0.00 177.10 176.28 1j9t h ASP 328 N 8.60 0.00 -0.14 -4.21 5.19 -1.95 -2.71 116.42 121.19 1j9t h ASP 328 Ca -0.25 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.09 1j9t h ASP 328 Cb 1.09 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.60 1j9t h ASP 328 CO 0.89 0.00 -0.17 -0.78 -3.12 0.00 0.00 179.24 176.06 1j9t h ASP 329 N 0.00 0.40 -0.39 6.45 -0.00 -2.02 -3.24 116.42 117.63 1j9t h ASP 329 Ca 0.00 -0.50 -0.12 0.00 -0.00 0.00 0.00 57.03 56.41 1j9t h ASP 329 Cb 0.46 -0.11 -0.02 0.00 -0.00 0.00 0.00 39.33 39.66 1j9t h ASP 329 CO 0.00 0.82 -0.18 -0.07 -0.00 0.00 0.00 179.24 179.81 1j9t h LEU 330 N -0.01 0.89 -7.00 2.28 3.38 -1.96 -3.45 115.31 109.44 1j9t h LEU 330 Ca 0.02 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 57.68 1j9t h LEU 330 Cb 0.72 -0.24 -0.22 0.00 0.09 0.00 0.00 40.66 41.01 1j9t h LEU 330 CO 0.04 1.05 0.11 -0.32 0.09 0.00 0.00 178.44 179.41 1j9t s MET 331 N -4.70 0.73 -0.07 1.13 0.00 -1.03 -5.15 119.30 110.21 1j9t s MET 331 Ca -0.10 1.08 -0.19 0.00 0.00 0.00 0.00 55.69 56.47 1j9t s MET 331 Cb 0.13 0.24 0.04 0.00 0.00 0.00 0.00 34.83 35.24 1j9t s MET 331 CO 0.85 -0.12 0.44 -0.08 0.00 0.00 0.00 175.02 176.11 1j9t s THR 332 N 1.08 0.03 -0.66 10.11 -1.32 -1.26 -4.11 115.64 119.52 1j9t s THR 332 Ca -0.06 -0.23 -0.22 0.00 -1.21 0.00 0.00 61.69 59.97 1j9t s THR 332 Cb -0.05 -0.72 0.08 0.00 -1.51 0.00 0.00 72.50 70.30 1j9t s THR 332 CO -0.11 -0.13 0.94 -0.55 -2.21 0.00 0.00 174.62 172.56 1j9t s SER 333 N -0.87 6.18 0.20 8.08 0.15 -1.26 -4.87 113.70 121.31 1j9t s SER 333 Ca -0.09 -1.06 -0.10 0.00 0.70 0.00 0.00 55.95 55.39 1j9t s SER 333 Cb -0.03 -2.41 0.13 0.00 -1.71 0.00 0.00 66.02 62.00 1j9t s SER 333 CO 0.05 -1.40 1.80 0.58 1.20 0.00 0.00 173.24 175.47 1j9t h VAL 334 N 5.97 1.22 -3.20 4.45 2.07 -2.02 -3.40 116.25 121.35 1j9t h VAL 334 Ca -0.28 -0.59 -0.45 0.00 0.82 0.00 0.00 66.70 66.21 1j9t h VAL 334 Cb 1.07 0.31 -0.40 0.00 -1.52 0.00 0.00 31.29 30.76 1j9t h VAL 334 CO 1.17 0.25 -0.75 -0.22 0.02 0.00 0.00 177.57 178.04 1j9t s LEU 335 N -9.91 0.52 0.69 2.57 2.96 -1.26 -5.14 118.68 109.11 1j9t s LEU 335 Ca -0.13 -0.40 -0.14 0.00 -0.22 0.00 0.00 54.13 53.24 1j9t s LEU 335 Cb 0.14 -0.33 0.02 0.00 0.50 0.00 0.00 46.19 46.52 1j9t s LEU 335 CO 0.80 -0.29 1.12 0.00 -1.32 0.00 0.00 176.35 176.66 1j9t s ALA 336 N 2.05 2.37 -0.17 5.97 0.00 -1.26 -4.87 121.76 125.85 1j9t s ALA 336 Ca 0.03 0.57 -0.40 0.00 0.00 0.00 0.00 51.96 52.15 1j9t s ALA 336 Cb -0.15 -3.34 -0.17 0.00 0.00 0.00 0.00 23.12 19.47 1j9t s ALA 336 CO -0.07 -1.46 1.56 -2.30 0.00 0.00 0.00 175.76 173.50 1j9t n PRO 337 N -2.63 0.96 -3.71 0.00 -0.02 -1.26 -4.92 135.00 123.42 1j9t n PRO 337 Ca 0.11 0.35 -0.08 0.00 -2.02 0.00 0.00 63.50 61.86 1j9t n PRO 337 Cb 0.52 -1.99 -0.02 0.00 -0.02 0.00 0.00 33.50 31.99 1j9t n PRO 337 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1j9t s SER 338 N 2.31 -0.34 0.00 2.55 1.04 -1.26 -5.29 113.70 112.70 1j9t s SER 338 Ca 0.94 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.98 1j9t s SER 338 Cb -1.09 0.65 0.00 0.00 0.10 0.00 0.00 66.02 65.68 1j9t s SER 338 CO 0.61 -1.16 0.24 0.61 0.98 0.00 0.00 173.24 174.52