#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 2.68 0.25 0.00 -4.23 -1.26 -4.88 115.64 108.19 1j9t s THR 5 Ca 0.00 -0.21 -0.05 0.00 -1.18 0.00 0.00 61.69 60.25 1j9t s THR 5 Cb 0.00 -3.13 0.23 0.00 1.34 0.00 0.00 72.50 70.94 1j9t s THR 5 CO 0.00 -0.13 1.86 0.00 -0.54 0.00 0.00 174.62 175.81 1j9t h ALA 6 N -0.45 1.23 -0.06 3.99 0.00 -2.05 -0.87 119.26 121.05 1j9t h ALA 6 Ca -0.45 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.46 1j9t h ALA 6 Cb 1.30 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1j9t h ALA 6 CO 0.60 0.34 -0.01 0.00 0.00 0.00 0.00 179.25 180.19 1j9t h ALA 7 N 1.41 0.05 -0.93 0.00 0.00 -1.99 -0.04 119.26 117.75 1j9t h ALA 7 Ca 0.38 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.34 1j9t h ALA 7 Cb 0.14 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 1j9t h ALA 7 CO -0.16 -0.48 0.61 0.93 0.00 0.00 0.00 179.25 180.14 1j9t h GLU 8 N 0.01 1.17 -0.47 0.00 5.08 -1.73 -2.19 114.58 116.45 1j9t h GLU 8 Ca 0.03 -0.07 -0.13 0.00 -1.00 0.00 0.00 59.36 58.19 1j9t h GLU 8 Cb 0.04 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.01 1j9t h GLU 8 CO -0.06 0.78 -0.20 0.82 -1.00 0.00 0.00 179.01 179.35 1j9t h ILE 9 N 1.21 1.27 0.00 3.13 2.04 -0.81 -2.76 117.51 121.58 1j9t h ILE 9 Ca 0.36 -1.35 -0.04 0.00 1.00 0.00 0.00 64.86 64.84 1j9t h ILE 9 Cb -0.05 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 1j9t h ILE 9 CO -0.11 0.47 -0.17 0.00 0.00 0.00 0.00 178.15 178.34 1j9t h ALA 10 N 0.94 1.40 0.00 1.87 0.00 -0.55 -1.76 119.26 121.15 1j9t h ALA 10 Ca 0.11 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1j9t h ALA 10 Cb 0.76 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1j9t h ALA 10 CO 0.06 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.53 1j9t h ALA 11 N 1.83 1.00 -2.95 0.00 0.00 -1.13 -3.46 119.26 114.54 1j9t h ALA 11 Ca -0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 1j9t h ALA 11 Cb 0.38 0.00 0.13 0.00 0.00 0.00 0.00 17.79 18.30 1j9t h ALA 11 CO 0.02 0.00 0.55 -0.51 0.00 0.00 0.00 179.25 179.31 1j9t s LEU 12 N -5.73 3.79 0.61 0.00 1.43 -0.67 -4.97 118.68 113.15 1j9t s LEU 12 Ca 0.08 2.60 -0.18 0.00 -1.03 0.00 0.00 54.13 55.60 1j9t s LEU 12 Cb 0.07 -4.39 -0.02 0.00 0.03 0.00 0.00 46.19 41.88 1j9t s LEU 12 CO 0.64 -1.56 1.17 -2.16 0.23 0.00 0.00 176.35 174.67 1j9t s PRO 13 N -3.04 2.92 -0.07 1.29 0.04 -1.26 -4.79 135.00 130.09 1j9t s PRO 13 Ca 0.73 1.67 0.03 0.00 0.04 0.00 0.00 61.00 63.48 1j9t s PRO 13 Cb -0.36 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.25 1j9t s PRO 13 CO 0.42 -1.21 -0.16 1.03 0.04 0.00 0.00 177.00 177.12 1j9t s ARG 14 N -3.55 2.03 -0.09 4.56 0.52 -1.26 -1.20 118.95 119.96 1j9t s ARG 14 Ca 0.74 -0.54 0.03 0.00 -0.52 0.00 0.00 55.73 55.43 1j9t s ARG 14 Cb -0.27 -1.63 0.01 0.00 0.52 0.00 0.00 34.95 33.58 1j9t s ARG 14 CO 0.35 0.08 -0.19 1.14 0.02 0.00 0.00 175.30 176.70 1j9t s GLN 15 N 0.52 2.48 -0.21 3.54 -2.07 -0.93 -4.98 119.66 118.03 1j9t s GLN 15 Ca -0.15 -0.68 -0.19 0.00 -1.82 0.00 0.00 55.36 52.52 1j9t s GLN 15 Cb -0.16 -1.94 -0.03 0.00 -1.09 0.00 0.00 33.01 29.79 1j9t s GLN 15 CO 0.05 0.09 0.56 0.21 -1.32 0.00 0.00 175.29 174.88 1j9t s LYS 16 N 0.54 4.19 -0.07 9.60 2.47 -1.26 -0.76 119.74 134.44 1j9t s LYS 16 Ca -0.16 0.48 0.01 0.00 -1.56 0.00 0.00 55.97 54.74 1j9t s LYS 16 Cb -0.17 -3.58 -0.03 0.00 -1.46 0.00 0.00 37.83 32.60 1j9t s LYS 16 CO 0.06 -0.20 -0.07 0.08 0.16 0.00 0.00 175.35 175.38 1j9t s VAL 17 N 1.81 3.73 -0.27 4.02 1.01 -0.71 -4.96 120.40 125.03 1j9t s VAL 17 Ca 0.25 -0.47 -0.13 0.00 0.00 0.00 0.00 61.98 61.63 1j9t s VAL 17 Cb -0.16 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 1j9t s VAL 17 CO 0.10 0.60 0.29 -1.61 0.00 0.00 0.00 175.10 174.47 1j9t s GLU 18 N -0.78 3.99 0.59 2.72 8.01 -1.26 -4.66 118.70 127.31 1j9t s GLU 18 Ca 0.12 -0.12 -0.16 0.00 0.01 0.00 0.00 54.97 54.81 1j9t s GLU 18 Cb -0.11 -3.66 -0.03 0.00 -4.31 0.00 0.00 34.13 26.02 1j9t s GLU 18 CO 0.01 -0.23 1.08 -0.51 0.01 0.00 0.00 175.26 175.62 1j9t s LEU 19 N 1.92 3.54 0.19 1.80 1.43 -1.26 -4.78 118.68 121.52 1j9t s LEU 19 Ca 0.11 1.93 0.09 0.00 -1.03 0.00 0.00 54.13 55.23 1j9t s LEU 19 Cb -0.16 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.47 1j9t s LEU 19 CO 0.10 -1.26 -0.17 0.68 0.23 0.00 0.00 176.35 175.93 1j9t s VAL 20 N -2.28 1.88 0.30 -1.59 -7.23 -1.26 -4.99 120.40 105.23 1j9t s VAL 20 Ca 0.66 -2.07 -0.29 0.00 -1.81 0.00 0.00 61.98 58.47 1j9t s VAL 20 Cb -0.18 -1.97 -0.09 0.00 0.56 0.00 0.00 36.38 34.70 1j9t s VAL 20 CO 0.35 -0.41 1.10 -1.81 -0.31 0.00 0.00 175.10 174.02 1j9t s ASP 21 N -2.97 7.17 0.84 4.85 -0.00 -1.26 -4.61 116.67 120.69 1j9t s ASP 21 Ca 0.20 2.26 -0.12 0.00 -0.00 0.00 0.00 52.55 54.88 1j9t s ASP 21 Cb -0.04 -2.62 0.10 0.00 -0.00 0.00 0.00 42.92 40.36 1j9t s ASP 21 CO 0.08 -0.21 1.18 -2.84 -0.00 0.00 0.00 175.17 173.38 1j9t s PRO 22 N -1.61 1.46 0.00 8.23 0.02 -1.26 -2.16 135.00 139.69 1j9t s PRO 22 Ca 0.47 1.68 0.21 0.00 0.02 0.00 0.00 61.00 63.37 1j9t s PRO 22 Cb -0.31 -1.76 1.24 0.00 0.02 0.00 0.00 34.50 33.69 1j9t s PRO 22 CO 0.40 -2.33 1.77 -0.35 -0.33 0.00 0.00 177.00 176.16 1j9t n PRO 23 N -3.58 0.95 -1.83 5.54 -0.04 -1.26 -5.06 135.00 129.72 1j9t n PRO 23 Ca 0.13 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.29 1j9t n PRO 23 Cb 0.51 -1.34 0.04 0.00 -0.04 0.00 0.00 33.50 32.67 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 -2.00 3.34 -0.01 0.54 0.40 -0.92 -0.36 117.98 118.97 1j9t s PHE 24 Ca 0.31 1.14 0.04 0.00 -0.60 0.00 0.00 56.93 57.82 1j9t s PHE 24 Cb 0.14 -2.97 -0.01 0.00 0.51 0.00 0.00 43.02 40.69 1j9t s PHE 24 CO 0.24 -1.12 -0.13 0.08 0.70 0.00 0.00 175.22 175.00 1j9t s VAL 25 N -3.27 1.01 0.67 -0.44 1.01 -1.26 -4.65 120.40 113.47 1j9t s VAL 25 Ca 0.58 -0.56 -0.17 0.00 0.00 0.00 0.00 61.98 61.82 1j9t s VAL 25 Cb -0.12 -0.85 -0.00 0.00 0.00 0.00 0.00 36.38 35.41 1j9t s VAL 25 CO 0.53 0.27 1.20 0.00 0.00 0.00 0.00 175.10 177.10 1j9t n HIS 26 N 2.73 1.55 -1.67 5.22 1.44 -1.26 -4.88 115.22 118.34 1j9t n HIS 26 Ca -0.14 0.42 -0.43 0.00 -2.01 0.00 0.00 57.72 55.55 1j9t n HIS 26 Cb 0.56 -2.21 -0.01 0.00 0.12 0.00 0.00 29.99 28.45 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 -2.13 0.95 -3.83 1.59 0.00 -1.26 -4.98 120.51 110.86 1j9t n ALA 27 Ca 0.15 0.37 -0.06 0.00 0.00 0.00 0.00 53.44 53.90 1j9t n ALA 27 Cb 0.48 -2.21 -0.01 0.00 0.00 0.00 0.00 19.45 17.72 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 -0.95 -0.12 -0.10 0.00 -3.43 -1.26 -5.05 115.29 104.38 1j9t s HIS 28 Ca 0.58 -0.33 0.01 0.00 -0.80 0.00 0.00 55.06 54.51 1j9t s HIS 28 Cb -0.61 0.71 -0.02 0.00 -1.43 0.00 0.00 32.58 31.23 1j9t s HIS 28 CO 0.60 -1.17 -0.10 0.45 -2.00 0.00 0.00 174.74 172.52 1j9t s SER 29 N -2.97 4.30 0.04 7.38 0.15 -1.26 -5.02 113.70 116.33 1j9t s SER 29 Ca 0.12 -0.18 -0.21 0.00 0.70 0.00 0.00 55.95 56.38 1j9t s SER 29 Cb -0.05 -1.32 -0.14 0.00 -1.71 0.00 0.00 66.02 62.81 1j9t s SER 29 CO 0.06 0.27 1.43 1.56 1.20 0.00 0.00 173.24 177.76 1j9t h GLN 30 N 5.96 0.26 -5.87 5.44 4.20 -1.98 -3.41 115.11 119.71 1j9t h GLN 30 Ca -0.38 -0.10 -0.58 0.00 0.06 0.00 0.00 58.65 57.66 1j9t h GLN 30 Cb 1.18 -0.01 -0.07 0.00 0.30 0.00 0.00 27.48 28.88 1j9t h GLN 30 CO 0.54 0.55 0.13 0.08 -0.67 0.00 0.00 178.83 179.46 1j9t s VAL 31 N -4.73 5.02 0.43 -0.54 1.01 -1.26 -3.42 120.40 116.92 1j9t s VAL 31 Ca -0.14 1.35 -0.25 0.00 0.00 0.00 0.00 61.98 62.94 1j9t s VAL 31 Cb 0.05 -4.00 -0.10 0.00 0.00 0.00 0.00 36.38 32.33 1j9t s VAL 31 CO 0.72 0.18 1.22 0.00 0.00 0.00 0.00 175.10 177.21 1j9t n ALA 32 N 4.41 1.05 -3.13 5.51 0.00 0.32 -4.95 120.51 123.74 1j9t n ALA 32 Ca -0.01 0.24 -0.37 0.00 0.00 0.00 0.00 53.44 53.30 1j9t n ALA 32 Cb 0.50 -2.23 -0.12 0.00 0.00 0.00 0.00 19.45 17.60 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 -2.22 3.14 1.88 0.00 2.02 -1.26 -5.00 118.70 117.27 1j9t s GLU 33 Ca 0.62 -0.83 0.00 0.00 0.02 0.00 0.00 54.97 54.79 1j9t s GLU 33 Cb -0.51 -3.40 0.00 0.00 0.10 0.00 0.00 34.13 30.32 1j9t s GLU 33 CO 0.57 -0.43 0.00 0.41 0.02 0.00 0.00 175.26 175.83 1j9t n GLY 34 N 4.88 -1.31 3.04 -1.39 0.00 -1.26 -4.92 105.19 104.24 1j9t n GLY 34 Ca -0.14 -1.26 -0.20 0.00 0.00 0.00 0.00 46.02 44.42 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 0.00 -0.05 3.49 -0.02 0.00 -1.26 -5.01 105.19 102.34 1j9t n GLY 35 Ca 0.00 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 43.69 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 -2.71 0.73 -4.17 1.61 -0.02 -1.26 -5.00 135.00 124.18 1j9t n PRO 36 Ca 0.13 0.26 -0.11 0.00 -2.02 0.00 0.00 63.50 61.76 1j9t n PRO 36 Cb 0.46 -1.59 -0.10 0.00 -0.02 0.00 0.00 33.50 32.25 1j9t n PRO 36 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1j9t s LYS 37 N -1.60 0.85 -0.51 -0.52 1.02 -1.26 -4.40 119.74 113.32 1j9t s LYS 37 Ca 0.63 -1.33 -0.16 0.00 0.02 0.00 0.00 55.97 55.13 1j9t s LYS 37 Cb -0.63 -0.25 0.10 0.00 -0.52 0.00 0.00 37.83 36.52 1j9t s LYS 37 CO 0.58 -0.01 0.49 0.08 -0.92 0.00 0.00 175.35 175.57 1j9t s VAL 38 N -3.51 5.16 -0.22 3.17 1.01 -0.34 -0.35 120.40 125.32 1j9t s VAL 38 Ca 0.12 -1.20 -0.22 0.00 0.00 0.00 0.00 61.98 60.68 1j9t s VAL 38 Cb 0.04 -4.26 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 1j9t s VAL 38 CO -0.04 -0.77 0.69 -0.69 0.00 0.00 0.00 175.10 174.29 1j9t s VAL 39 N 1.80 4.96 -0.15 2.92 1.01 0.81 -2.18 120.40 129.56 1j9t s VAL 39 Ca 0.05 1.30 -0.10 0.00 0.00 0.00 0.00 61.98 63.24 1j9t s VAL 39 Cb -0.26 -4.00 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 1j9t s VAL 39 CO 0.05 0.04 0.17 -1.61 0.00 0.00 0.00 175.10 173.76 1j9t s GLU 40 N 2.28 3.88 0.06 2.72 2.02 0.06 -0.67 118.70 129.05 1j9t s GLU 40 Ca 0.30 -0.11 0.04 0.00 0.02 0.00 0.00 54.97 55.23 1j9t s GLU 40 Cb -0.16 -3.32 -0.03 0.00 0.10 0.00 0.00 34.13 30.73 1j9t s GLU 40 CO 0.10 0.51 -0.11 -0.06 0.02 0.00 0.00 175.26 175.71 1j9t s PHE 41 N -0.28 0.97 -0.02 1.61 0.40 -0.34 -1.73 117.98 118.59 1j9t s PHE 41 Ca 0.13 -0.47 0.03 0.00 -0.60 0.00 0.00 56.93 56.02 1j9t s PHE 41 Cb -0.12 -0.56 0.00 0.00 0.51 0.00 0.00 43.02 42.85 1j9t s PHE 41 CO 0.02 -0.00 -0.10 0.99 0.70 0.00 0.00 175.22 176.83 1j9t s THR 42 N -1.29 0.84 -0.04 0.64 2.01 -1.26 -0.39 115.64 116.14 1j9t s THR 42 Ca -0.05 -0.40 -0.02 0.00 0.31 0.00 0.00 61.69 61.53 1j9t s THR 42 Cb -0.10 -0.73 0.03 0.00 0.01 0.00 0.00 72.50 71.71 1j9t s THR 42 CO 0.01 0.25 0.09 -0.04 -0.69 0.00 0.00 174.62 174.25 1j9t s MET 43 N 0.11 0.04 -0.17 4.92 -1.94 -0.79 -4.89 119.30 116.57 1j9t s MET 43 Ca -0.02 0.28 -0.08 0.00 -1.71 0.00 0.00 55.69 54.16 1j9t s MET 43 Cb -0.08 -0.19 -0.04 0.00 2.01 0.00 0.00 34.83 36.52 1j9t s MET 43 CO 0.00 -0.16 0.09 0.08 -0.01 0.00 0.00 175.02 175.03 1j9t s VAL 44 N 1.06 5.07 0.03 -6.03 1.01 -1.26 -1.42 120.40 118.86 1j9t s VAL 44 Ca -0.08 0.06 -0.25 0.00 0.00 0.00 0.00 61.98 61.71 1j9t s VAL 44 Cb -0.11 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.94 1j9t s VAL 44 CO -0.04 0.48 0.78 -0.63 0.00 0.00 0.00 175.10 175.69 1j9t s ILE 45 N 0.10 4.78 -0.11 2.22 1.01 0.46 -1.05 121.20 128.61 1j9t s ILE 45 Ca 0.07 1.65 -0.01 0.00 0.00 0.00 0.00 60.65 62.36 1j9t s ILE 45 Cb -0.12 -4.13 0.03 0.00 0.01 0.00 0.00 42.46 38.25 1j9t s ILE 45 CO -0.00 0.33 -0.07 -1.61 0.00 0.00 0.00 174.94 173.59 1j9t s GLU 46 N 0.16 1.45 -0.19 2.79 0.41 -0.29 -4.32 118.70 118.71 1j9t s GLU 46 Ca 0.40 -0.24 -0.23 0.00 -0.41 0.00 0.00 54.97 54.49 1j9t s GLU 46 Cb -0.20 -1.56 -0.02 0.00 -1.78 0.00 0.00 34.13 30.57 1j9t s GLU 46 CO 0.23 -0.28 0.75 -1.21 -0.49 0.00 0.00 175.26 174.26 1j9t s GLU 47 N 1.73 4.24 0.02 1.61 2.02 -1.26 -1.09 118.70 125.97 1j9t s GLU 47 Ca 0.05 0.85 -0.25 0.00 0.02 0.00 0.00 54.97 55.64 1j9t s GLU 47 Cb -0.13 -3.59 0.06 0.00 0.10 0.00 0.00 34.13 30.57 1j9t s GLU 47 CO -0.08 -0.32 0.56 -1.59 0.02 0.00 0.00 175.26 173.85 1j9t s LYS 48 N 2.17 1.03 0.03 1.61 -2.85 -0.06 -5.00 119.74 116.67 1j9t s LYS 48 Ca 0.34 -0.07 -0.30 0.00 -1.00 0.00 0.00 55.97 54.94 1j9t s LYS 48 Cb -0.16 0.47 -0.04 0.00 -2.06 0.00 0.00 37.83 36.04 1j9t s LYS 48 CO 0.11 -0.35 0.96 0.15 0.10 0.00 0.00 175.35 176.31 1j9t s LYS 49 N -1.99 4.60 0.10 1.78 1.02 -1.26 -0.26 119.74 123.73 1j9t s LYS 49 Ca -0.08 1.40 0.05 0.00 0.02 0.00 0.00 55.97 57.37 1j9t s LYS 49 Cb -0.01 -3.43 -0.04 0.00 -0.52 0.00 0.00 37.83 33.83 1j9t s LYS 49 CO 0.02 0.04 -0.13 0.96 -0.92 0.00 0.00 175.35 175.32 1j9t s ILE 50 N 0.67 1.17 -0.18 2.17 -4.36 -0.35 -4.92 121.20 115.40 1j9t s ILE 50 Ca 0.50 -1.60 -0.08 0.00 -0.26 0.00 0.00 60.65 59.21 1j9t s ILE 50 Cb -0.22 -1.38 -0.04 0.00 1.25 0.00 0.00 42.46 42.07 1j9t s ILE 50 CO 0.28 -0.41 0.07 -0.69 0.24 0.00 0.00 174.94 174.43 1j9t s VAL 51 N -2.03 4.88 -1.48 8.37 1.01 -1.26 -1.45 120.40 128.44 1j9t s VAL 51 Ca 0.05 -0.00 0.14 0.00 0.00 0.00 0.00 61.98 62.17 1j9t s VAL 51 Cb -0.05 -3.20 0.23 0.00 0.00 0.00 0.00 36.38 33.35 1j9t s VAL 51 CO 0.02 0.46 1.10 2.30 0.00 0.00 0.00 175.10 178.98 1j9t n ILE 52 N 3.48 0.43 -3.87 2.22 -5.35 -0.16 -4.81 119.36 111.31 1j9t n ILE 52 Ca -0.17 -0.71 -0.08 0.00 -0.27 0.00 0.00 62.75 61.52 1j9t n ILE 52 Cb 0.52 0.95 -0.01 0.00 -1.74 0.00 0.00 39.64 39.36 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 -1.09 -0.13 0.46 7.28 3.84 -1.26 -1.23 116.67 124.54 1j9t s ASP 53 Ca 0.22 -0.82 0.22 0.00 -0.00 0.00 0.00 52.55 52.17 1j9t s ASP 53 Cb 0.13 0.75 1.13 0.00 -1.38 0.00 0.00 42.92 43.55 1j9t s ASP 53 CO 0.18 -1.42 1.95 0.44 -0.00 0.00 0.00 175.17 176.32 1j9t h ASP 54 N 2.03 0.00 0.83 2.11 3.32 -1.96 -2.28 116.42 120.47 1j9t h ASP 54 Ca -0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.81 1j9t h ASP 54 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1j9t h ASP 54 CO 0.30 0.21 0.00 0.00 -1.72 0.00 0.00 179.24 178.03 1j9t n ALA 55 N -2.32 1.78 -0.23 3.45 0.00 -1.26 -4.88 120.51 117.05 1j9t n ALA 55 Ca -0.01 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1j9t n ALA 55 Cb 0.32 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.39 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 0.26 0.87 3.68 0.00 0.00 -0.86 -5.04 105.19 104.11 1j9t n GLY 56 Ca 0.03 -0.12 -0.44 0.00 0.00 0.00 0.00 46.02 45.49 1j9t n GLY 56 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1j9t n THR 57 N -2.23 0.99 -4.03 2.61 -1.04 -1.26 -4.81 114.28 104.51 1j9t n THR 57 Ca 0.00 -0.25 -0.31 0.00 -2.04 0.00 0.00 64.05 61.46 1j9t n THR 57 Cb 0.00 -1.54 -0.06 0.00 -1.82 0.00 0.00 70.33 66.91 1j9t n THR 57 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1j9t s GLU 58 N -0.47 2.95 -0.02 -2.82 2.02 -1.26 -0.98 118.70 118.13 1j9t s GLU 58 Ca 0.67 -0.66 -0.01 0.00 0.02 0.00 0.00 54.97 55.00 1j9t s GLU 58 Cb -0.63 -2.77 0.01 0.00 0.10 0.00 0.00 34.13 30.85 1j9t s GLU 58 CO 0.50 0.57 0.04 0.08 0.02 0.00 0.00 175.26 176.47 1j9t s VAL 59 N -1.40 -0.02 -0.90 2.63 1.01 -0.53 -4.95 120.40 116.24 1j9t s VAL 59 Ca 0.30 0.07 -0.19 0.00 0.00 0.00 0.00 61.98 62.16 1j9t s VAL 59 Cb -0.12 -0.07 0.12 0.00 0.00 0.00 0.00 36.38 36.31 1j9t s VAL 59 CO 0.23 0.03 1.12 -1.00 0.00 0.00 0.00 175.10 175.48 1j9t s HIS 60 N 0.40 3.06 0.59 5.22 3.76 -1.26 -1.21 115.29 125.84 1j9t s HIS 60 Ca -0.03 -1.29 -0.14 0.00 -0.15 0.00 0.00 55.06 53.45 1j9t s HIS 60 Cb -0.05 -4.29 -0.04 0.00 1.11 0.00 0.00 32.58 29.31 1j9t s HIS 60 CO -0.01 -1.52 1.02 0.00 -0.85 0.00 0.00 174.74 173.39 1j9t s ALA 61 N 2.89 2.96 -0.33 -1.40 0.00 0.64 -4.85 121.76 121.67 1j9t s ALA 61 Ca 0.32 0.11 0.02 0.00 0.00 0.00 0.00 51.96 52.41 1j9t s ALA 61 Cb -0.06 -3.13 0.10 0.00 0.00 0.00 0.00 23.12 20.03 1j9t s ALA 61 CO -0.08 -0.65 0.07 -1.64 0.00 0.00 0.00 175.76 173.47 1j9t s MET 62 N -4.60 1.16 -0.12 0.00 -1.94 -0.79 -0.88 119.30 112.13 1j9t s MET 62 Ca 0.58 -1.55 0.02 0.00 -1.71 0.00 0.00 55.69 53.04 1j9t s MET 62 Cb -0.12 -2.70 -0.00 0.00 2.01 0.00 0.00 34.83 34.02 1j9t s MET 62 CO 0.44 -0.96 -0.20 0.00 -0.01 0.00 0.00 175.02 174.29 1j9t s ALA 63 N 1.19 2.34 0.02 3.03 0.00 -0.25 -2.09 121.76 126.01 1j9t s ALA 63 Ca 0.11 -0.97 -0.30 0.00 0.00 0.00 0.00 51.96 50.79 1j9t s ALA 63 Cb -0.18 -0.99 -0.06 0.00 0.00 0.00 0.00 23.12 21.89 1j9t s ALA 63 CO -0.15 0.21 1.34 -0.06 0.00 0.00 0.00 175.76 177.10 1j9t s PHE 64 N 0.45 3.05 -1.44 0.00 0.08 -1.25 -1.13 117.98 117.73 1j9t s PHE 64 Ca -0.14 0.96 0.00 0.00 0.12 0.00 0.00 56.93 57.88 1j9t s PHE 64 Cb -0.17 -3.60 0.00 0.00 -0.57 0.00 0.00 43.02 38.68 1j9t s PHE 64 CO 0.06 -2.11 0.00 -1.71 -0.10 0.00 0.00 175.22 171.35 1j9t n ASN 65 N 4.89 -5.23 0.00 1.36 5.15 -0.21 -2.69 115.26 118.53 1j9t n ASN 65 Ca 0.12 0.34 0.00 0.00 -0.60 0.00 0.00 54.58 54.44 1j9t n ASN 65 Cb 0.44 -3.92 0.00 0.00 -0.53 0.00 0.00 39.78 35.77 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 -0.53 0.52 3.34 8.20 0.00 -0.96 -4.95 105.19 110.82 1j9t n GLY 66 Ca -0.14 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.31 1.79 -0.21 2.61 -4.23 -1.09 -4.95 115.64 107.25 1j9t s THR 67 Ca 0.00 -2.12 0.00 0.00 -1.18 0.00 0.00 61.69 58.40 1j9t s THR 67 Cb 0.00 -1.98 0.05 0.00 1.34 0.00 0.00 72.50 71.92 1j9t s THR 67 CO 0.00 -0.49 -0.06 -0.69 -0.54 0.00 0.00 174.62 172.83 1j9t s VAL 68 N -2.64 1.46 1.02 2.29 1.01 -1.26 -3.25 120.40 119.04 1j9t s VAL 68 Ca 0.20 -1.05 -0.15 0.00 0.00 0.00 0.00 61.98 60.99 1j9t s VAL 68 Cb -0.03 -1.67 0.20 0.00 0.00 0.00 0.00 36.38 34.89 1j9t s VAL 68 CO 0.07 0.01 1.15 -2.16 0.00 0.00 0.00 175.10 174.17 1j9t s PRO 69 N 1.45 0.21 0.92 2.72 0.04 -1.26 -2.08 135.00 137.00 1j9t s PRO 69 Ca -0.03 0.09 -0.12 0.00 0.04 0.00 0.00 61.00 60.98 1j9t s PRO 69 Cb -0.17 -1.75 0.14 0.00 0.04 0.00 0.00 34.50 32.76 1j9t s PRO 69 CO -0.07 -2.79 1.09 0.20 0.04 0.00 0.00 177.00 175.48 1j9t s GLY 70 N -4.05 1.61 0.66 0.56 0.00 0.21 -4.77 107.32 101.53 1j9t s GLY 70 Ca 0.68 -0.09 -0.15 0.00 0.00 0.00 0.00 44.72 45.15 1j9t s GLY 70 CO 0.55 0.42 1.12 2.56 0.00 0.00 0.00 173.10 177.74 1j9t s PRO 71 N -4.92 2.78 -0.10 2.90 0.04 -1.26 -4.43 135.00 130.01 1j9t s PRO 71 Ca 0.64 1.44 -0.28 0.00 0.04 0.00 0.00 61.00 62.83 1j9t s PRO 71 Cb -0.18 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.40 1j9t s PRO 71 CO 0.57 -1.27 0.95 -1.17 0.04 0.00 0.00 177.00 176.12 1j9t s LEU 72 N -4.82 4.26 -0.16 -3.56 2.96 -1.26 -4.33 118.68 111.78 1j9t s LEU 72 Ca 0.68 1.47 -0.07 0.00 -0.22 0.00 0.00 54.13 55.98 1j9t s LEU 72 Cb -0.21 -3.47 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 1j9t s LEU 72 CO 0.41 -0.39 0.10 -0.04 -1.32 0.00 0.00 176.35 175.11 1j9t s MET 73 N 1.81 3.77 -0.12 1.98 -1.94 -1.14 -4.58 119.30 119.09 1j9t s MET 73 Ca 0.46 -0.25 0.03 0.00 -1.71 0.00 0.00 55.69 54.23 1j9t s MET 73 Cb -0.18 -3.22 0.01 0.00 2.01 0.00 0.00 34.83 33.44 1j9t s MET 73 CO 0.18 0.48 -0.22 0.08 -0.01 0.00 0.00 175.02 175.53 1j9t s VAL 74 N -0.19 2.01 0.31 -6.03 1.01 -1.26 -0.41 120.40 115.83 1j9t s VAL 74 Ca 0.09 -0.97 0.07 0.00 0.00 0.00 0.00 61.98 61.17 1j9t s VAL 74 Cb -0.12 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 1j9t s VAL 74 CO 0.01 0.54 0.25 1.33 0.00 0.00 0.00 175.10 177.24 1j9t n VAL 75 N 3.81 0.00 -4.33 2.92 0.24 -0.27 -4.98 118.33 115.71 1j9t n VAL 75 Ca -0.20 -2.23 -0.25 0.00 -2.04 0.00 0.00 64.34 59.62 1j9t n VAL 75 Cb 0.52 1.10 -0.09 0.00 -1.47 0.00 0.00 33.84 33.90 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 2.57 0.17 6.34 3.76 -1.26 -0.63 115.29 123.01 1j9t s HIS 76 Ca 0.36 -0.25 -0.33 0.00 -0.15 0.00 0.00 55.06 54.68 1j9t s HIS 76 Cb 0.02 -1.21 -0.15 0.00 1.11 0.00 0.00 32.58 32.35 1j9t s HIS 76 CO 0.25 0.57 1.35 0.94 -0.85 0.00 0.00 174.74 177.00 1j9t n GLN 77 N -0.26 1.59 -1.04 1.40 7.27 0.59 -1.35 117.38 125.59 1j9t n GLN 77 Ca -0.09 0.57 -0.01 0.00 0.07 0.00 0.00 57.00 57.54 1j9t n GLN 77 Cb 0.57 -2.20 -0.01 0.00 2.41 0.00 0.00 30.24 31.02 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 2.44 -3.77 -4.66 1.69 10.43 0.90 -4.73 116.55 118.85 1j9t n ASP 78 Ca 0.15 0.03 -0.26 0.00 2.57 0.00 0.00 54.79 57.28 1j9t n ASP 78 Cb 0.26 -1.38 0.11 0.00 1.84 0.00 0.00 41.12 41.95 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 -2.21 4.26 -0.07 -2.24 -0.00 -0.45 -4.65 116.67 111.31 1j9t s ASP 79 Ca 0.00 0.20 0.04 0.00 -0.00 0.00 0.00 52.55 52.79 1j9t s ASP 79 Cb 0.00 -0.63 -0.02 0.00 -0.00 0.00 0.00 42.92 42.27 1j9t s ASP 79 CO 0.00 -1.95 -0.19 -0.31 -0.00 0.00 0.00 175.17 172.72 1j9t s TYR 80 N -3.38 2.61 -0.30 4.23 1.51 0.53 -1.84 117.35 120.71 1j9t s TYR 80 Ca 0.65 -0.52 -0.10 0.00 -1.01 0.00 0.00 57.07 56.09 1j9t s TYR 80 Cb -0.08 -1.66 -0.02 0.00 -0.11 0.00 0.00 41.96 40.09 1j9t s TYR 80 CO 0.47 -0.09 0.16 -1.17 -1.11 0.00 0.00 175.55 173.81 1j9t s LEU 81 N -0.23 4.05 -0.34 -1.29 0.20 -0.32 -0.13 118.68 120.62 1j9t s LEU 81 Ca -0.00 -0.38 -0.03 0.00 0.69 0.00 0.00 54.13 54.41 1j9t s LEU 81 Cb -0.13 -2.03 0.07 0.00 -0.43 0.00 0.00 46.19 43.67 1j9t s LEU 81 CO 0.03 -0.15 0.08 -0.70 -0.29 0.00 0.00 176.35 175.32 1j9t s GLU 82 N 1.65 2.32 -0.20 1.98 2.12 0.16 -1.98 118.70 124.75 1j9t s GLU 82 Ca 0.05 -1.42 -0.08 0.00 0.36 0.00 0.00 54.97 53.89 1j9t s GLU 82 Cb -0.17 -3.35 -0.04 0.00 0.26 0.00 0.00 34.13 30.84 1j9t s GLU 82 CO 0.07 -0.77 0.07 -1.17 -0.54 0.00 0.00 175.26 172.93 1j9t s LEU 83 N 1.24 3.74 -0.37 2.70 0.20 0.37 -1.20 118.68 125.37 1j9t s LEU 83 Ca -0.00 0.01 -0.14 0.00 0.69 0.00 0.00 54.13 54.69 1j9t s LEU 83 Cb -0.21 -1.96 -0.00 0.00 -0.43 0.00 0.00 46.19 43.59 1j9t s LEU 83 CO -0.01 0.11 0.28 -0.89 -0.29 0.00 0.00 176.35 175.55 1j9t s THR 84 N 0.73 5.26 -0.19 3.68 2.01 0.47 -1.09 115.64 126.52 1j9t s THR 84 Ca 0.04 -0.37 -0.05 0.00 0.31 0.00 0.00 61.69 61.62 1j9t s THR 84 Cb -0.13 -3.81 -0.03 0.00 0.01 0.00 0.00 72.50 68.54 1j9t s THR 84 CO 0.02 -0.14 -0.01 -0.22 -0.69 0.00 0.00 174.62 173.58 1j9t s LEU 85 N 1.74 3.28 -0.12 4.42 2.96 0.17 -1.88 118.68 129.24 1j9t s LEU 85 Ca 0.06 -0.18 0.01 0.00 -0.22 0.00 0.00 54.13 53.81 1j9t s LEU 85 Cb -0.18 -1.82 -0.01 0.00 0.50 0.00 0.00 46.19 44.68 1j9t s LEU 85 CO 0.11 0.09 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.42 1j9t s ILE 86 N 0.84 2.67 -0.48 6.68 1.01 -0.50 -1.57 121.20 129.86 1j9t s ILE 86 Ca 0.00 -0.80 -0.03 0.00 0.00 0.00 0.00 60.65 59.83 1j9t s ILE 86 Cb -0.14 -2.09 0.13 0.00 0.01 0.00 0.00 42.46 40.36 1j9t s ILE 86 CO 0.02 0.53 0.28 0.21 0.00 0.00 0.00 174.94 175.98 1j9t s ASN 87 N 0.41 5.23 0.47 3.58 2.47 -0.39 -0.40 114.94 126.31 1j9t s ASN 87 Ca -0.13 -2.30 -0.24 0.00 0.42 0.00 0.00 52.86 50.61 1j9t s ASN 87 Cb -0.17 -1.83 -0.08 0.00 -1.45 0.00 0.00 41.25 37.72 1j9t s ASN 87 CO 0.06 -0.48 1.28 -2.65 -3.72 0.00 0.00 177.10 171.59 1j9t n PRO 88 N 4.23 1.83 0.10 0.43 -0.02 -1.26 0.21 135.00 140.52 1j9t n PRO 88 Ca 0.01 0.66 0.07 0.00 -2.02 0.00 0.00 63.50 62.22 1j9t n PRO 88 Cb 0.40 -2.43 0.37 0.00 -0.02 0.00 0.00 33.50 31.82 1j9t n PRO 88 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1j9t n GLU 89 N -0.29 0.09 0.12 -0.52 0.28 -1.26 -0.63 120.64 118.42 1j9t n GLU 89 Ca 0.08 0.58 0.13 0.00 -0.16 0.00 0.00 57.16 57.78 1j9t n GLU 89 Cb 0.41 -1.79 0.42 0.00 1.43 0.00 0.00 31.44 31.92 1j9t n GLU 89 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1j9t n THR 90 N -1.98 0.66 -2.00 3.84 -2.24 -1.26 -4.77 114.28 106.54 1j9t n THR 90 Ca -0.01 -0.18 -0.29 0.00 -2.27 0.00 0.00 64.05 61.31 1j9t n THR 90 Cb 0.03 -0.72 0.07 0.00 -2.10 0.00 0.00 70.33 67.61 1j9t n THR 90 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1j9t s ASN 91 N -4.53 4.97 -0.00 3.42 0.01 0.20 -5.01 114.94 113.99 1j9t s ASN 91 Ca 0.09 0.82 0.03 0.00 -0.71 0.00 0.00 52.86 53.09 1j9t s ASN 91 Cb 0.11 -1.49 -0.04 0.00 0.41 0.00 0.00 41.25 40.24 1j9t s ASN 91 CO 0.55 -1.59 0.08 0.35 -1.51 0.00 0.00 177.10 174.98 1j9t n THR 92 N -3.07 0.00 -4.04 1.60 -2.24 -1.26 -4.76 114.28 100.50 1j9t n THR 92 Ca 0.07 -0.17 -0.22 0.00 -2.27 0.00 0.00 64.05 61.46 1j9t n THR 92 Cb 0.59 0.59 -0.05 0.00 -2.10 0.00 0.00 70.33 69.37 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 -2.89 3.51 0.33 3.22 1.43 -1.26 -4.87 118.68 118.14 1j9t s LEU 93 Ca -0.00 -0.52 -0.19 0.00 -1.03 0.00 0.00 54.13 52.38 1j9t s LEU 93 Cb 0.02 -2.05 -0.09 0.00 0.03 0.00 0.00 46.19 44.09 1j9t s LEU 93 CO 0.12 -0.20 0.82 -0.32 0.23 0.00 0.00 176.35 176.99 1j9t s MET 94 N -3.87 4.19 0.14 1.70 -2.45 -1.26 -4.13 119.30 113.63 1j9t s MET 94 Ca 0.36 0.91 -0.02 0.00 -1.25 0.00 0.00 55.69 55.70 1j9t s MET 94 Cb -0.06 -2.51 -0.04 0.00 1.25 0.00 0.00 34.83 33.47 1j9t s MET 94 CO 0.24 0.18 0.09 -1.01 1.05 0.00 0.00 175.02 175.56 1j9t s HIS 95 N -1.89 0.82 0.12 4.11 0.09 -0.15 -4.97 115.29 113.42 1j9t s HIS 95 Ca 0.53 -1.19 -0.07 0.00 -0.00 0.00 0.00 55.06 54.34 1j9t s HIS 95 Cb -0.12 -0.43 0.03 0.00 -0.00 0.00 0.00 32.58 32.05 1j9t s HIS 95 CO 0.18 -0.55 0.34 0.27 -0.00 0.00 0.00 174.74 174.98 1j9t n ASN 96 N -0.12 -0.81 -3.81 1.40 6.94 -1.26 0.04 115.26 117.65 1j9t n ASN 96 Ca -0.05 -1.51 -0.12 0.00 -0.02 0.00 0.00 54.58 52.87 1j9t n ASN 96 Cb 0.64 1.33 -0.12 0.00 -2.36 0.00 0.00 39.78 39.27 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 -2.55 0.01 -0.20 1.53 2.07 -1.26 -4.27 121.20 116.53 1j9t s ILE 97 Ca 0.07 -0.08 0.01 0.00 -1.41 0.00 0.00 60.65 59.25 1j9t s ILE 97 Cb -0.02 -0.31 0.04 0.00 0.13 0.00 0.00 42.46 42.31 1j9t s ILE 97 CO 0.04 -0.04 -0.14 -0.62 -1.91 0.00 0.00 174.94 172.27 1j9t s ASP 98 N -0.08 3.50 -0.32 4.50 -1.08 -0.53 -1.72 116.67 120.95 1j9t s ASP 98 Ca -0.02 -0.90 -0.15 0.00 -0.52 0.00 0.00 52.55 50.97 1j9t s ASP 98 Cb -0.02 -1.37 -0.02 0.00 -1.46 0.00 0.00 42.92 40.04 1j9t s ASP 98 CO 0.00 -0.10 0.34 -0.36 0.52 0.00 0.00 175.17 175.57 1j9t s PHE 99 N 1.30 3.22 0.05 -5.34 0.40 0.58 -1.78 117.98 116.42 1j9t s PHE 99 Ca -0.01 0.09 0.33 0.00 -0.60 0.00 0.00 56.93 56.74 1j9t s PHE 99 Cb -0.16 -2.61 1.48 0.00 0.51 0.00 0.00 43.02 42.24 1j9t s PHE 99 CO -0.09 -0.35 1.97 0.45 0.70 0.00 0.00 175.22 177.90 1j9t h HIS 100 N 8.39 0.00 0.00 0.36 3.86 -1.51 -1.57 115.15 124.68 1j9t h HIS 100 Ca -0.31 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.90 1j9t h HIS 100 Cb 1.15 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.62 1j9t h HIS 100 CO 0.71 0.00 0.00 0.00 0.86 0.00 0.00 177.93 179.50 1j9t h ALA 101 N 2.06 1.00 -2.08 2.45 0.00 -1.91 -3.46 119.26 117.32 1j9t h ALA 101 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.46 1j9t h ALA 101 Cb 0.32 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.19 1j9t h ALA 101 CO 0.00 0.00 0.16 0.00 0.00 0.00 0.00 179.25 179.41 1j9t s ALA 102 N -3.30 3.34 -0.17 0.00 0.00 -0.59 -4.61 121.76 116.43 1j9t s ALA 102 Ca 0.06 -1.12 -0.01 0.00 0.00 0.00 0.00 51.96 50.89 1j9t s ALA 102 Cb 0.07 -2.42 0.05 0.00 0.00 0.00 0.00 23.12 20.81 1j9t s ALA 102 CO 0.63 -1.24 -0.03 0.99 0.00 0.00 0.00 175.76 176.11 1j9t s THR 103 N -3.15 0.95 0.00 0.00 2.01 -1.26 -4.75 115.64 109.43 1j9t s THR 103 Ca 0.61 -0.61 0.00 0.00 0.31 0.00 0.00 61.69 62.00 1j9t s THR 103 Cb -0.10 -1.21 0.00 0.00 0.01 0.00 0.00 72.50 71.20 1j9t s THR 103 CO 0.44 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 175.00 1j9t n GLY 104 N 4.92 3.13 4.29 4.40 0.00 -1.26 -4.94 105.19 115.72 1j9t n GLY 104 Ca -0.11 -1.95 -0.32 0.00 0.00 0.00 0.00 46.02 43.65 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 -0.60 -1.91 -3.75 4.61 0.00 -1.26 -0.05 120.51 117.56 1j9t n ALA 105 Ca 0.00 -0.37 -0.27 0.00 0.00 0.00 0.00 53.44 52.81 1j9t n ALA 105 Cb 0.00 -1.13 0.05 0.00 0.00 0.00 0.00 19.45 18.37 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 -4.50 -3.00 -0.09 0.00 4.77 -1.26 -1.05 117.00 111.87 1j9t n LEU 106 Ca -0.27 -0.67 -0.01 0.00 -0.03 0.00 0.00 56.01 55.03 1j9t n LEU 106 Cb 0.67 -2.80 -0.00 0.00 -2.33 0.00 0.00 43.42 38.96 1j9t n LEU 106 CO 0.85 0.55 -0.01 0.61 -1.33 0.00 0.00 177.39 178.06 1j9t n GLY 107 N -1.82 0.49 0.00 -0.72 0.00 0.93 -2.46 105.19 101.60 1j9t n GLY 107 Ca 0.01 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.33 1.08 0.29 -0.02 0.00 -0.47 -0.30 105.19 103.43 1j9t n GLY 108 Ca -0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.03 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 1.22 1.93 -0.02 0.00 -0.40 -1.36 103.07 104.44 1j9t h GLY 109 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.04 1j9t h GLY 109 CO 0.00 0.12 0.00 0.61 0.00 0.00 0.00 176.54 177.27 1j9t n GLY 110 N -1.31 -1.07 0.25 4.60 0.00 -0.21 -3.18 105.19 104.26 1j9t n GLY 110 Ca 0.13 -0.06 0.03 0.00 0.00 0.00 0.00 46.02 46.11 1j9t n GLY 110 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1j9t n LEU 111 N -1.47 1.92 -0.16 0.99 4.77 -0.56 -4.70 117.00 117.79 1j9t n LEU 111 Ca 0.05 -1.49 0.06 0.00 -0.03 0.00 0.00 56.01 54.60 1j9t n LEU 111 Cb 0.20 -0.05 0.08 0.00 -2.33 0.00 0.00 43.42 41.31 1j9t n LEU 111 CO 0.16 0.45 0.46 0.35 -1.33 0.00 0.00 177.39 177.49 1j9t n THR 112 N 0.14 1.20 -2.03 -5.08 -2.24 -0.93 -4.93 114.28 100.41 1j9t n THR 112 Ca 0.04 -1.41 -0.43 0.00 -2.27 0.00 0.00 64.05 59.98 1j9t n THR 112 Cb 0.23 0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.55 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 -1.76 3.42 -0.06 -0.78 2.02 -1.25 -4.13 118.70 116.15 1j9t s GLU 113 Ca 0.18 1.45 0.04 0.00 0.02 0.00 0.00 54.97 56.66 1j9t s GLU 113 Cb 0.16 -4.17 -0.00 0.00 0.10 0.00 0.00 34.13 30.22 1j9t s GLU 113 CO 0.02 -1.76 -0.19 0.96 0.02 0.00 0.00 175.26 174.31 1j9t s ILE 114 N 6.56 1.61 0.66 -1.63 -4.36 0.11 -4.97 121.20 119.18 1j9t s ILE 114 Ca 0.78 -0.79 -0.04 0.00 -0.26 0.00 0.00 60.65 60.33 1j9t s ILE 114 Cb -0.22 -1.40 0.05 0.00 1.25 0.00 0.00 42.46 42.14 1j9t s ILE 114 CO 0.33 0.46 0.94 0.20 0.24 0.00 0.00 174.94 177.11 1j9t s ASN 115 N 0.20 4.94 0.26 4.36 0.02 -1.26 -0.98 114.94 122.47 1j9t s ASN 115 Ca -0.09 0.30 -0.31 0.00 -1.02 0.00 0.00 52.86 51.73 1j9t s ASN 115 Cb -0.14 -1.01 -0.12 0.00 0.02 0.00 0.00 41.25 40.00 1j9t s ASN 115 CO 0.04 -1.47 1.58 -2.65 0.02 0.00 0.00 177.10 174.62 1j9t n PRO 116 N -2.75 2.55 -0.18 -0.60 -0.02 -1.26 -1.68 135.00 131.06 1j9t n PRO 116 Ca 0.08 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.47 1j9t n PRO 116 Cb 0.60 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 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 2.54 0.62 3.54 -1.23 0.00 0.13 -4.69 105.19 106.10 1j9t n GLY 117 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.82 1.82 0.16 1.61 2.02 -0.67 -4.88 118.70 117.94 1j9t s GLU 118 Ca 0.00 -1.90 -0.03 0.00 0.02 0.00 0.00 54.97 53.06 1j9t s GLU 118 Cb 0.00 -1.73 -0.03 0.00 0.10 0.00 0.00 34.13 32.47 1j9t s GLU 118 CO 0.00 0.17 0.13 -1.59 0.02 0.00 0.00 175.26 173.99 1j9t s LYS 119 N -3.60 1.06 0.05 1.61 -2.85 -1.26 -1.26 119.74 113.48 1j9t s LYS 119 Ca 0.32 -1.42 -0.20 0.00 -1.00 0.00 0.00 55.97 53.67 1j9t s LYS 119 Cb 0.01 0.28 0.04 0.00 -2.06 0.00 0.00 37.83 36.11 1j9t s LYS 119 CO 0.17 -0.34 0.47 -0.08 0.10 0.00 0.00 175.35 175.67 1j9t s THR 120 N -4.06 0.04 -0.14 3.79 -1.32 -0.61 -5.00 115.64 108.35 1j9t s THR 120 Ca 0.26 -0.35 0.00 0.00 -1.21 0.00 0.00 61.69 60.40 1j9t s THR 120 Cb 0.06 -0.97 0.02 0.00 -1.51 0.00 0.00 72.50 70.11 1j9t s THR 120 CO 0.04 -0.19 -0.13 -0.63 -2.21 0.00 0.00 174.62 171.50 1j9t s ILE 121 N -2.48 1.46 -0.06 5.08 1.01 -1.26 -0.65 121.20 124.30 1j9t s ILE 121 Ca -0.05 -0.56 0.04 0.00 0.00 0.00 0.00 60.65 60.07 1j9t s ILE 121 Cb -0.01 -1.38 -0.02 0.00 0.01 0.00 0.00 42.46 41.06 1j9t s ILE 121 CO -0.02 0.44 -0.16 -0.22 0.00 0.00 0.00 174.94 174.98 1j9t s LEU 122 N 1.49 2.64 -0.03 2.97 2.96 -0.25 -4.96 118.68 123.51 1j9t s LEU 122 Ca 0.04 -0.25 0.03 0.00 -0.22 0.00 0.00 54.13 53.74 1j9t s LEU 122 Cb -0.13 -1.53 -0.00 0.00 0.50 0.00 0.00 46.19 45.03 1j9t s LEU 122 CO -0.10 0.32 -0.12 -0.60 -1.32 0.00 0.00 176.35 174.53 1j9t s ARG 123 N -0.59 1.27 0.02 1.98 3.52 -1.26 -0.47 118.95 123.41 1j9t s ARG 123 Ca 0.08 -0.43 -0.09 0.00 -0.13 0.00 0.00 55.73 55.16 1j9t s ARG 123 Cb -0.11 -1.15 0.01 0.00 -1.56 0.00 0.00 34.95 32.14 1j9t s ARG 123 CO 0.01 0.18 0.19 -0.59 -0.81 0.00 0.00 175.30 174.28 1j9t s PHE 124 N 0.08 0.02 -0.18 5.12 -0.12 -0.84 -4.98 117.98 117.08 1j9t s PHE 124 Ca -0.02 -0.14 -0.22 0.00 -0.05 0.00 0.00 56.93 56.49 1j9t s PHE 124 Cb -0.09 -0.02 -0.02 0.00 -0.63 0.00 0.00 43.02 42.25 1j9t s PHE 124 CO 0.01 -0.37 0.68 0.21 -0.05 0.00 0.00 175.22 175.70 1j9t s LYS 125 N -1.93 4.25 -1.32 1.99 2.20 -1.26 -1.17 119.74 122.51 1j9t s LYS 125 Ca -0.10 0.73 -0.16 0.00 -0.36 0.00 0.00 55.97 56.08 1j9t s LYS 125 Cb -0.04 -3.56 0.09 0.00 -1.51 0.00 0.00 37.83 32.81 1j9t s LYS 125 CO -0.00 -0.22 1.80 0.00 -0.36 0.00 0.00 175.35 176.57 1j9t n ALA 126 N 4.94 4.18 0.26 3.13 0.00 -0.76 -4.74 120.51 127.51 1j9t n ALA 126 Ca -0.00 -3.96 0.15 0.00 0.00 0.00 0.00 53.44 49.63 1j9t n ALA 126 Cb 0.50 -3.45 0.47 0.00 0.00 0.00 0.00 19.45 16.97 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 4.93 0.00 -3.39 0.00 1.35 -1.86 0.26 112.91 114.19 1j9t h THR 127 Ca 0.45 -0.71 -0.67 0.00 -0.55 0.00 0.00 66.41 64.93 1j9t h THR 127 Cb 0.80 1.71 -0.30 0.00 -1.73 0.00 0.00 68.15 68.63 1j9t h THR 127 CO 1.53 0.00 -0.83 -0.54 -0.25 0.00 0.00 175.52 175.43 1j9t s LYS 128 N -3.47 3.14 0.19 4.72 1.02 -1.26 -4.74 119.74 119.34 1j9t s LYS 128 Ca 0.04 -0.80 -0.29 0.00 0.02 0.00 0.00 55.97 54.94 1j9t s LYS 128 Cb 0.07 -2.43 -0.08 0.00 -0.52 0.00 0.00 37.83 34.87 1j9t s LYS 128 CO 0.59 0.22 0.93 -1.25 -0.92 0.00 0.00 175.35 174.92 1j9t s PRO 129 N 0.28 4.78 0.00 -1.68 0.04 -1.26 -4.79 135.00 132.37 1j9t s PRO 129 Ca -0.14 1.44 0.00 0.00 0.04 0.00 0.00 61.00 62.34 1j9t s PRO 129 Cb -0.17 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 31.07 1j9t s PRO 129 CO 0.07 0.43 0.00 0.41 0.04 0.00 0.00 177.00 177.95 1j9t n GLY 130 N 1.73 0.01 3.78 0.56 0.00 -0.04 -2.34 105.19 108.88 1j9t n GLY 130 Ca -0.01 -1.70 -0.36 0.00 0.00 0.00 0.00 46.02 43.95 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 -2.01 4.94 0.03 1.61 -7.23 0.83 -0.27 120.40 118.29 1j9t s VAL 131 Ca 0.00 -0.01 0.01 0.00 -1.81 0.00 0.00 61.98 60.17 1j9t s VAL 131 Cb 0.00 -3.12 -0.02 0.00 0.56 0.00 0.00 36.38 33.80 1j9t s VAL 131 CO 0.00 0.61 -0.05 -0.36 -0.31 0.00 0.00 175.10 174.98 1j9t s PHE 132 N -0.90 0.47 0.39 2.82 0.08 0.04 -4.47 117.98 116.40 1j9t s PHE 132 Ca 0.14 -0.51 -0.18 0.00 0.12 0.00 0.00 56.93 56.50 1j9t s PHE 132 Cb -0.12 -0.30 -0.10 0.00 -0.57 0.00 0.00 43.02 41.94 1j9t s PHE 132 CO 0.03 -0.13 0.85 0.08 -0.10 0.00 0.00 175.22 175.95 1j9t s VAL 133 N -1.40 4.54 0.04 -0.44 1.01 -1.26 -0.68 120.40 122.21 1j9t s VAL 133 Ca -0.13 1.20 0.03 0.00 0.00 0.00 0.00 61.98 63.08 1j9t s VAL 133 Cb -0.10 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 1j9t s VAL 133 CO -0.00 -0.30 -0.09 -0.72 0.00 0.00 0.00 175.10 173.99 1j9t s TYR 134 N -2.13 0.79 0.03 5.22 -0.85 -0.71 -1.33 117.35 118.36 1j9t s TYR 134 Ca 0.58 -0.44 -0.28 0.00 -0.52 0.00 0.00 57.07 56.41 1j9t s TYR 134 Cb -0.10 -0.47 0.09 0.00 0.38 0.00 0.00 41.96 41.87 1j9t s TYR 134 CO 0.17 -0.04 0.90 -3.38 -1.52 0.00 0.00 175.55 171.68 1j9t s HIS 135 N -1.19 -0.31 0.38 -3.49 -3.43 -0.73 -1.04 115.29 105.48 1j9t s HIS 135 Ca -0.06 0.14 -0.26 0.00 -0.80 0.00 0.00 55.06 54.07 1j9t s HIS 135 Cb -0.09 0.56 -0.09 0.00 -1.43 0.00 0.00 32.58 31.53 1j9t s HIS 135 CO 0.01 -0.60 1.23 0.00 -2.00 0.00 0.00 174.74 173.38 1j9t n ALA 137 N 0.30 1.24 -2.65 0.00 0.00 -1.26 -4.66 120.51 113.48 1j9t n ALA 137 Ca 0.03 -2.78 -0.41 0.00 0.00 0.00 0.00 53.44 50.28 1j9t n ALA 137 Cb 0.45 -0.97 -0.05 0.00 0.00 0.00 0.00 19.45 18.87 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 -0.59 4.22 -0.20 0.00 0.04 -1.26 -4.95 135.00 132.26 1j9t s PRO 138 Ca 0.34 0.85 -0.38 0.00 0.04 0.00 0.00 61.00 61.85 1j9t s PRO 138 Cb 0.19 -3.61 -0.14 0.00 0.04 0.00 0.00 34.50 30.97 1j9t s PRO 138 CO -0.15 -0.38 1.78 -2.30 0.04 0.00 0.00 177.00 175.98 1j9t n PRO 139 N 5.51 1.50 0.00 0.56 -0.02 -1.26 -1.87 135.00 139.42 1j9t n PRO 139 Ca 0.03 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1j9t n PRO 139 Cb 0.49 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1j9t n PRO 139 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1j9t n GLY 140 N 4.22 0.36 2.61 -1.23 0.00 -1.26 -4.89 105.19 105.00 1j9t n GLY 140 Ca 0.25 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.25 1j9t n GLY 140 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1j9t n MET 141 N -1.80 1.30 0.40 1.61 0.00 -0.78 -5.04 117.12 112.80 1j9t n MET 141 Ca 0.00 -1.15 -0.16 0.00 0.00 0.00 0.00 57.70 56.39 1j9t n MET 141 Cb 0.00 0.40 -0.07 0.00 0.00 0.00 0.00 33.22 33.55 1j9t n MET 141 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 1j9t h VAL 142 N 3.77 0.00 -0.76 1.12 2.07 -1.89 -3.14 116.25 117.42 1j9t h VAL 142 Ca -0.43 -0.09 0.10 0.00 0.82 0.00 0.00 66.70 67.10 1j9t h VAL 142 Cb 1.28 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.98 1j9t h VAL 142 CO -0.18 0.00 0.40 1.55 0.02 0.00 0.00 177.57 179.36 1j9t h PRO 143 N -1.10 0.65 -0.45 1.57 0.13 -1.93 -1.78 132.00 129.09 1j9t h PRO 143 Ca -0.10 -0.04 0.03 0.00 -0.87 0.00 0.00 66.00 65.01 1j9t h PRO 143 Cb 0.78 -0.15 -0.03 0.00 0.13 0.00 0.00 31.00 31.73 1j9t h PRO 143 CO 0.17 0.43 0.25 2.35 -0.23 0.00 0.00 178.00 180.97 1j9t h TRP 144 N 0.67 0.47 -0.48 1.56 7.01 -1.97 0.15 115.95 123.36 1j9t h TRP 144 Ca 0.38 0.02 -0.12 0.00 2.11 0.00 0.00 58.89 61.27 1j9t h TRP 144 Cb 0.39 -0.15 -0.02 0.00 -2.10 0.00 0.00 29.16 27.29 1j9t h TRP 144 CO -0.09 0.26 -0.17 0.45 -2.79 0.00 0.00 178.44 176.10 1j9t h HIS 145 N 0.51 1.06 -0.29 2.65 3.86 -1.44 -2.39 115.15 119.11 1j9t h HIS 145 Ca 0.18 -0.23 -0.06 0.00 -1.16 0.00 0.00 60.37 59.10 1j9t h HIS 145 Cb 0.04 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.25 1j9t h HIS 145 CO -0.08 1.02 -0.06 0.28 0.86 0.00 0.00 177.93 179.96 1j9t h VAL 146 N 0.82 1.28 -0.06 2.45 2.07 -0.91 -2.55 116.25 119.34 1j9t h VAL 146 Ca 0.12 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.57 1j9t h VAL 146 Cb 0.72 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1j9t h VAL 146 CO 0.06 0.34 0.00 1.33 0.02 0.00 0.00 177.57 179.32 1j9t n VAL 147 N -4.52 0.12 -0.15 2.57 0.24 0.48 -1.48 118.33 115.59 1j9t n VAL 147 Ca -0.03 -0.09 0.08 0.00 -2.04 0.00 0.00 64.34 62.26 1j9t n VAL 147 Cb 0.30 -0.07 0.21 0.00 -1.47 0.00 0.00 33.84 32.81 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 -0.23 3.27 0.00 -1.34 7.64 -0.91 -4.66 113.62 117.39 1j9t n SER 148 Ca 0.02 -1.96 0.00 0.00 1.01 0.00 0.00 58.87 57.94 1j9t n SER 148 Cb 0.11 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.01 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 1.01 0.75 2.77 0.23 0.00 -0.55 -1.89 105.19 107.51 1j9t n GLY 149 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.13 3.18 -3.46 1.61 0.00 -0.89 -4.57 117.12 110.87 1j9t n MET 150 Ca 0.00 -2.97 -0.12 0.00 0.00 0.00 0.00 57.70 54.61 1j9t n MET 150 Cb 0.00 -3.13 -0.03 0.00 0.00 0.00 0.00 33.22 30.06 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 2.22 -0.52 0.00 6.12 2.20 -1.26 -1.45 114.94 122.25 1j9t s ASN 151 Ca 0.44 -0.02 0.00 0.00 -0.94 0.00 0.00 52.86 52.34 1j9t s ASN 151 Cb 0.12 0.58 0.00 0.00 -2.00 0.00 0.00 41.25 39.95 1j9t s ASN 151 CO -0.05 -0.94 0.00 0.61 -2.94 0.00 0.00 177.10 173.78 1j9t n GLY 152 N -0.30 2.75 3.54 0.45 0.00 -0.21 -0.62 105.19 110.80 1j9t n GLY 152 Ca -0.17 -0.42 -0.09 0.00 0.00 0.00 0.00 46.02 45.33 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 -1.00 -0.82 0.13 4.61 0.00 -1.26 -1.74 121.76 121.68 1j9t s ALA 153 Ca 0.00 -0.34 0.03 0.00 0.00 0.00 0.00 51.96 51.66 1j9t s ALA 153 Cb 0.00 0.88 -0.04 0.00 0.00 0.00 0.00 23.12 23.95 1j9t s ALA 153 CO 0.00 -0.82 -0.09 0.96 0.00 0.00 0.00 175.76 175.82 1j9t s ILE 154 N -3.90 0.98 -0.10 0.00 -4.36 0.14 -2.86 121.20 111.11 1j9t s ILE 154 Ca 0.11 -2.01 0.02 0.00 -0.26 0.00 0.00 60.65 58.51 1j9t s ILE 154 Cb -0.01 -1.79 0.01 0.00 1.25 0.00 0.00 42.46 41.92 1j9t s ILE 154 CO -0.01 -0.79 -0.15 -0.32 0.24 0.00 0.00 174.94 173.92 1j9t s MET 155 N -3.78 2.09 -0.43 0.37 -2.45 0.45 -0.78 119.30 114.77 1j9t s MET 155 Ca 0.15 -0.52 -0.06 0.00 -1.25 0.00 0.00 55.69 54.00 1j9t s MET 155 Cb 0.04 -1.77 0.11 0.00 1.25 0.00 0.00 34.83 34.45 1j9t s MET 155 CO -0.01 -0.03 0.26 0.08 1.05 0.00 0.00 175.02 176.36 1j9t s VAL 156 N 0.90 3.80 0.37 10.11 1.01 0.63 -1.12 120.40 136.09 1j9t s VAL 156 Ca -0.09 -1.80 -0.25 0.00 0.00 0.00 0.00 61.98 59.84 1j9t s VAL 156 Cb -0.15 -3.49 -0.10 0.00 0.00 0.00 0.00 36.38 32.64 1j9t s VAL 156 CO 0.00 -0.66 1.00 -0.76 0.00 0.00 0.00 175.10 174.68 1j9t s LEU 157 N 1.28 4.22 0.67 3.92 1.43 0.20 -0.86 118.68 129.53 1j9t s LEU 157 Ca 0.06 1.93 -0.17 0.00 -1.03 0.00 0.00 54.13 54.91 1j9t s LEU 157 Cb -0.24 -4.13 0.00 0.00 0.03 0.00 0.00 46.19 41.85 1j9t s LEU 157 CO -0.02 -0.29 1.24 -2.84 0.23 0.00 0.00 176.35 174.67 1j9t s PRO 158 N -2.35 2.50 0.55 1.29 0.02 -1.26 -0.30 135.00 135.45 1j9t s PRO 158 Ca 0.55 1.89 0.26 0.00 0.02 0.00 0.00 61.00 63.72 1j9t s PRO 158 Cb -0.20 -1.86 1.58 0.00 0.02 0.00 0.00 34.50 34.04 1j9t s PRO 158 CO 0.25 -1.59 2.17 0.00 -0.33 0.00 0.00 177.00 177.50 1j9t h ARG 159 N 0.32 0.00 -0.68 5.54 3.08 -1.90 -1.26 114.38 119.48 1j9t h ARG 159 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.55 1j9t h ARG 159 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.36 1j9t h ARG 159 CO 0.52 0.05 0.00 0.39 -1.07 0.00 0.00 179.97 179.86 1j9t n GLU 160 N -3.94 3.77 -0.20 0.04 1.02 -1.26 -0.52 120.64 119.55 1j9t n GLU 160 Ca -0.03 -2.31 0.03 0.00 -0.02 0.00 0.00 57.16 54.83 1j9t n GLU 160 Cb 0.14 -2.02 -0.01 0.00 -0.02 0.00 0.00 31.44 29.53 1j9t n GLU 160 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1j9t n GLY 161 N 0.54 -2.11 3.80 0.62 0.00 -0.48 -4.81 105.19 102.75 1j9t n GLY 161 Ca 0.20 -1.43 -0.35 0.00 0.00 0.00 0.00 46.02 44.44 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 4.22 0.06 0.99 1.43 -1.26 -4.40 118.68 119.72 1j9t s LEU 162 Ca 0.00 1.69 0.00 0.00 -1.03 0.00 0.00 54.13 54.79 1j9t s LEU 162 Cb 0.00 -4.08 -0.03 0.00 0.03 0.00 0.00 46.19 42.10 1j9t s LEU 162 CO 0.00 -0.14 -0.05 -1.00 0.23 0.00 0.00 176.35 175.40 1j9t s HIS 163 N -1.77 0.59 0.00 0.29 3.76 -1.26 -0.41 115.29 116.49 1j9t s HIS 163 Ca 0.52 -0.86 0.00 0.00 -0.15 0.00 0.00 55.06 54.57 1j9t s HIS 163 Cb -0.15 -0.39 0.00 0.00 1.11 0.00 0.00 32.58 33.15 1j9t s HIS 163 CO 0.20 -0.25 0.00 -0.40 -0.85 0.00 0.00 174.74 173.44 1j9t n ASP 164 N 0.50 -0.08 0.23 1.40 5.68 0.14 -4.83 116.55 119.60 1j9t n ASP 164 Ca -0.16 -0.76 0.09 0.00 -0.50 0.00 0.00 54.79 53.46 1j9t n ASP 164 Cb 0.59 0.00 0.55 0.00 -1.14 0.00 0.00 41.12 41.12 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 -0.04 0.00 -3.48 6.12 0.00 -1.89 -3.21 103.07 100.57 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 -3.66 4.70 -0.56 4.80 4.76 -1.26 -4.93 118.16 122.01 1j9t n LYS 166 Ca -0.01 -3.12 0.00 0.00 -2.87 0.00 0.00 58.31 52.31 1j9t n LYS 166 Cb 0.35 -2.20 0.00 0.00 -1.84 0.00 0.00 35.03 31.33 1j9t n LYS 166 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1j9t n GLY 167 N 0.75 0.77 3.75 0.72 0.00 -1.21 -5.04 105.19 104.91 1j9t n GLY 167 Ca 0.28 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.44 4.38 0.39 1.61 3.01 -1.26 -4.83 119.74 122.60 1j9t s LYS 168 Ca 0.00 0.82 -0.27 0.00 -1.01 0.00 0.00 55.97 55.51 1j9t s LYS 168 Cb 0.00 -3.37 -0.10 0.00 -1.01 0.00 0.00 37.83 33.35 1j9t s LYS 168 CO 0.00 0.28 1.41 0.00 0.51 0.00 0.00 175.35 177.55 1j9t s ALA 169 N 0.08 3.43 -0.21 5.17 0.00 -1.26 0.28 121.76 129.24 1j9t s ALA 169 Ca 0.34 1.45 -0.00 0.00 0.00 0.00 0.00 51.96 53.74 1j9t s ALA 169 Cb -0.18 -3.57 0.06 0.00 0.00 0.00 0.00 23.12 19.43 1j9t s ALA 169 CO 0.18 -0.99 -0.03 -0.51 0.00 0.00 0.00 175.76 174.41 1j9t s LEU 170 N -2.26 2.07 -0.24 0.00 1.43 0.45 -4.77 118.68 115.36 1j9t s LEU 170 Ca 0.55 -1.00 -0.01 0.00 -1.03 0.00 0.00 54.13 52.64 1j9t s LEU 170 Cb -0.43 -0.99 0.03 0.00 0.03 0.00 0.00 46.19 44.82 1j9t s LEU 170 CO 0.58 -0.24 -0.08 -0.89 0.23 0.00 0.00 176.35 175.94 1j9t s THR 171 N 1.55 2.72 0.39 5.49 2.01 -1.26 -4.01 115.64 122.52 1j9t s THR 171 Ca -0.04 -1.06 -0.13 0.00 0.31 0.00 0.00 61.69 60.77 1j9t s THR 171 Cb -0.18 -2.38 -0.07 0.00 0.01 0.00 0.00 72.50 69.88 1j9t s THR 171 CO -0.07 0.22 0.78 -0.72 -0.69 0.00 0.00 174.62 174.14 1j9t s TYR 172 N 1.30 3.43 -0.07 4.92 -0.85 -1.26 -4.87 117.35 119.95 1j9t s TYR 172 Ca -0.00 1.14 -0.02 0.00 -0.52 0.00 0.00 57.07 57.67 1j9t s TYR 172 Cb -0.16 -2.51 -0.26 0.00 0.38 0.00 0.00 41.96 39.40 1j9t s TYR 172 CO -0.05 -0.06 0.57 -0.44 -1.52 0.00 0.00 175.55 174.05 1j9t h ASP 173 N 1.56 0.34 -4.77 -0.18 3.32 -0.73 -3.48 116.42 112.49 1j9t h ASP 173 Ca -0.47 -0.65 -0.20 0.00 0.02 0.00 0.00 57.03 55.72 1j9t h ASP 173 Cb 1.18 -0.11 -0.15 0.00 0.22 0.00 0.00 39.33 40.47 1j9t h ASP 173 CO 0.64 1.57 -0.69 -0.54 -1.72 0.00 0.00 179.24 178.50 1j9t s LYS 174 N -2.58 0.78 0.00 3.56 1.02 -0.99 -5.03 119.74 116.50 1j9t s LYS 174 Ca -0.15 -1.31 0.01 0.00 0.02 0.00 0.00 55.97 54.54 1j9t s LYS 174 Cb 0.07 -0.10 -0.00 0.00 -0.52 0.00 0.00 37.83 37.27 1j9t s LYS 174 CO 0.81 -0.04 -0.03 -1.50 -0.92 0.00 0.00 175.35 173.67 1j9t s ILE 175 N -3.70 0.20 0.01 2.17 2.07 -1.26 -1.36 121.20 119.32 1j9t s ILE 175 Ca 0.11 -0.23 0.03 0.00 -1.41 0.00 0.00 60.65 59.15 1j9t s ILE 175 Cb 0.06 -0.20 -0.01 0.00 0.13 0.00 0.00 42.46 42.44 1j9t s ILE 175 CO -0.06 -0.03 -0.10 -0.31 -1.91 0.00 0.00 174.94 172.54 1j9t s TYR 176 N -0.26 0.84 -0.28 3.50 2.02 -0.45 -4.52 117.35 118.20 1j9t s TYR 176 Ca -0.01 -0.26 -0.02 0.00 -0.37 0.00 0.00 57.07 56.41 1j9t s TYR 176 Cb -0.02 -0.52 0.03 0.00 -0.40 0.00 0.00 41.96 41.05 1j9t s TYR 176 CO -0.00 -0.01 -0.01 -0.47 -1.57 0.00 0.00 175.55 173.48 1j9t s TYR 177 N -0.57 3.17 -0.46 2.71 5.04 0.51 -0.93 117.35 126.82 1j9t s TYR 177 Ca 0.00 -1.63 -0.13 0.00 -2.44 0.00 0.00 57.07 52.88 1j9t s TYR 177 Cb -0.06 -2.11 0.08 0.00 0.35 0.00 0.00 41.96 40.23 1j9t s TYR 177 CO 0.00 -0.75 0.35 0.08 -1.34 0.00 0.00 175.55 173.89 1j9t s VAL 178 N 1.32 4.76 -0.17 3.14 1.01 0.16 -4.25 120.40 126.37 1j9t s VAL 178 Ca -0.02 -1.29 -0.18 0.00 0.00 0.00 0.00 61.98 60.48 1j9t s VAL 178 Cb -0.18 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 1j9t s VAL 178 CO -0.02 -0.59 0.51 -0.83 0.00 0.00 0.00 175.10 174.16 1j9t s GLY 179 N 2.51 2.19 -0.15 4.51 0.00 -1.26 -1.95 107.32 113.18 1j9t s GLY 179 Ca 0.04 -0.32 -0.05 0.00 0.00 0.00 0.00 44.72 44.38 1j9t s GLY 179 CO 0.04 0.97 0.04 1.85 0.00 0.00 0.00 173.10 176.00 1j9t s GLU 180 N 1.27 3.62 -0.09 2.90 2.12 -0.25 -1.70 118.70 126.56 1j9t s GLU 180 Ca 0.25 -0.36 0.02 0.00 0.36 0.00 0.00 54.97 55.24 1j9t s GLU 180 Cb -0.15 -3.06 0.01 0.00 0.26 0.00 0.00 34.13 31.19 1j9t s GLU 180 CO 0.10 0.44 -0.14 -1.14 -0.54 0.00 0.00 175.26 173.98 1j9t s GLN 181 N -0.13 2.03 -0.22 4.30 2.00 0.77 -4.45 119.66 123.96 1j9t s GLN 181 Ca 0.06 -0.51 -0.16 0.00 -2.00 0.00 0.00 55.36 52.75 1j9t s GLN 181 Cb -0.12 -1.68 -0.04 0.00 0.80 0.00 0.00 33.01 31.97 1j9t s GLN 181 CO 0.01 0.00 0.40 0.16 -0.50 0.00 0.00 175.29 175.37 1j9t s ASP 182 N 0.78 6.39 0.02 6.67 3.84 -1.26 -1.47 116.67 131.64 1j9t s ASP 182 Ca -0.12 0.46 0.04 0.00 -0.00 0.00 0.00 52.55 52.94 1j9t s ASP 182 Cb -0.16 -2.23 -0.03 0.00 -1.38 0.00 0.00 42.92 39.12 1j9t s ASP 182 CO 0.02 -0.12 -0.09 -0.36 -0.00 0.00 0.00 175.17 174.62 1j9t s PHE 183 N 1.58 2.81 -0.59 2.11 0.08 0.52 -4.76 117.98 119.73 1j9t s PHE 183 Ca 0.18 -0.09 0.04 0.00 0.12 0.00 0.00 56.93 57.18 1j9t s PHE 183 Cb -0.15 -1.57 0.16 0.00 -0.57 0.00 0.00 43.02 40.89 1j9t s PHE 183 CO 0.08 0.35 0.40 0.71 -0.10 0.00 0.00 175.22 176.66 1j9t s TYR 184 N -1.00 2.95 -0.20 0.36 1.51 -1.26 -0.28 117.35 119.44 1j9t s TYR 184 Ca 0.17 -3.05 -0.20 0.00 -1.01 0.00 0.00 57.07 52.98 1j9t s TYR 184 Cb -0.11 -2.38 -0.03 0.00 -0.11 0.00 0.00 41.96 39.33 1j9t s TYR 184 CO 0.08 -0.65 0.57 0.08 -1.11 0.00 0.00 175.55 174.52 1j9t s VAL 185 N -0.79 5.06 0.63 0.71 1.01 -1.26 -4.77 120.40 121.00 1j9t s VAL 185 Ca 0.23 1.07 -0.18 0.00 0.00 0.00 0.00 61.98 63.10 1j9t s VAL 185 Cb -0.10 -3.89 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 1j9t s VAL 185 CO -0.12 0.14 1.30 -2.84 0.00 0.00 0.00 175.10 173.58 1j9t s PRO 186 N 1.78 2.64 0.18 2.72 0.02 -1.26 -4.88 135.00 136.20 1j9t s PRO 186 Ca 0.26 2.07 0.09 0.00 0.02 0.00 0.00 61.00 63.45 1j9t s PRO 186 Cb -0.16 -1.89 -0.04 0.00 0.02 0.00 0.00 34.50 32.43 1j9t s PRO 186 CO 0.10 -1.54 -0.19 1.03 -0.33 0.00 0.00 177.00 176.07 1j9t s ARG 187 N -3.33 1.36 0.69 5.54 0.52 -1.26 -1.21 118.95 121.26 1j9t s ARG 187 Ca 0.81 -1.47 -0.03 0.00 -0.52 0.00 0.00 55.73 54.53 1j9t s ARG 187 Cb -0.37 -1.46 0.14 0.00 0.52 0.00 0.00 34.95 33.78 1j9t s ARG 187 CO 0.40 0.30 0.95 -0.40 0.02 0.00 0.00 175.30 176.57 1j9t n ASP 188 N 0.18 1.03 0.33 0.23 5.68 0.11 -4.84 116.55 119.27 1j9t n ASP 188 Ca -0.12 -1.93 0.21 0.00 -0.50 0.00 0.00 54.79 52.45 1j9t n ASP 188 Cb 0.57 -0.64 1.13 0.00 -1.14 0.00 0.00 41.12 41.05 1j9t n ASP 188 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1j9t h GLU 189 N 0.00 0.00 -0.00 0.11 4.39 -2.02 0.24 114.58 117.30 1j9t h GLU 189 Ca -0.31 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.39 1j9t h GLU 189 Cb 1.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.75 1j9t h GLU 189 CO 0.31 0.00 -0.11 0.09 -1.16 0.00 0.00 179.01 178.15 1j9t n ASN 190 N -3.26 0.56 0.00 1.42 3.02 -1.26 -4.89 115.26 110.84 1j9t n ASN 190 Ca -0.03 -0.68 0.00 0.00 -0.03 0.00 0.00 54.58 53.84 1j9t n ASN 190 Cb 0.08 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 1j9t n ASN 190 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1j9t n GLY 191 N 1.26 0.41 3.85 7.41 0.00 0.86 -5.04 105.19 113.95 1j9t n GLY 191 Ca 0.15 -0.99 -0.37 0.00 0.00 0.00 0.00 46.02 44.81 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 -1.80 3.68 0.28 1.61 2.47 -1.25 -4.77 119.74 119.95 1j9t s LYS 192 Ca 0.00 0.10 -0.30 0.00 -1.56 0.00 0.00 55.97 54.21 1j9t s LYS 192 Cb 0.00 -3.22 -0.11 0.00 -1.46 0.00 0.00 37.83 33.05 1j9t s LYS 192 CO 0.00 0.71 1.52 0.71 0.16 0.00 0.00 175.35 178.46 1j9t s TYR 193 N -0.96 2.86 0.30 4.03 1.51 -1.26 0.09 117.35 123.92 1j9t s TYR 193 Ca 0.18 0.90 -0.14 0.00 -1.01 0.00 0.00 57.07 57.00 1j9t s TYR 193 Cb -0.14 -3.96 -0.09 0.00 -0.11 0.00 0.00 41.96 37.66 1j9t s TYR 193 CO 0.08 -3.18 0.70 0.15 -1.11 0.00 0.00 175.55 172.19 1j9t s LYS 194 N -0.51 3.97 0.15 -0.62 1.02 -0.35 -4.83 119.74 118.56 1j9t s LYS 194 Ca 0.61 0.59 0.09 0.00 0.02 0.00 0.00 55.97 57.28 1j9t s LYS 194 Cb -0.45 -2.48 -0.04 0.00 -0.52 0.00 0.00 37.83 34.34 1j9t s LYS 194 CO 0.46 0.19 -0.13 0.15 -0.92 0.00 0.00 175.35 175.10 1j9t s LYS 195 N -2.94 1.94 0.06 1.68 1.02 -1.26 -4.78 119.74 115.46 1j9t s LYS 195 Ca 0.53 -1.21 0.03 0.00 0.02 0.00 0.00 55.97 55.33 1j9t s LYS 195 Cb -0.10 -2.15 -0.03 0.00 -0.52 0.00 0.00 37.83 35.03 1j9t s LYS 195 CO 0.18 0.46 -0.09 0.71 -0.92 0.00 0.00 175.35 175.69 1j9t s TYR 196 N -1.42 0.83 0.09 3.18 2.02 -1.26 -5.06 117.35 115.72 1j9t s TYR 196 Ca 0.22 -0.53 -0.09 0.00 -0.37 0.00 0.00 57.07 56.29 1j9t s TYR 196 Cb -0.10 -0.48 -0.21 0.00 -0.40 0.00 0.00 41.96 40.78 1j9t s TYR 196 CO 0.13 -0.05 1.20 0.93 -1.57 0.00 0.00 175.55 176.18 1j9t h GLU 197 N 4.27 0.52 -5.55 -0.62 5.08 -2.01 -3.46 114.58 112.82 1j9t h GLU 197 Ca -0.37 -0.63 -0.45 0.00 -1.00 0.00 0.00 59.36 56.91 1j9t h GLU 197 Cb 1.20 0.20 -0.22 0.00 0.50 0.00 0.00 28.75 30.42 1j9t h GLU 197 CO 0.43 1.25 -0.79 0.00 -1.00 0.00 0.00 179.01 178.90 1j9t s ALA 198 N -3.11 1.33 0.38 3.43 0.00 -1.26 -5.04 121.76 117.49 1j9t s ALA 198 Ca -0.07 -1.04 0.10 0.00 0.00 0.00 0.00 51.96 50.94 1j9t s ALA 198 Cb 0.07 -0.15 0.86 0.00 0.00 0.00 0.00 23.12 23.90 1j9t s ALA 198 CO 0.90 0.22 1.93 -1.00 0.00 0.00 0.00 175.76 177.81 1j9t h PRO 199 N 4.33 0.61 -0.40 0.00 0.13 -1.95 -1.67 132.00 133.06 1j9t h PRO 199 Ca -0.42 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 64.62 1j9t h PRO 199 Cb 1.19 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 1j9t h PRO 199 CO 0.40 0.40 0.03 0.78 -0.23 0.00 0.00 178.00 179.38 1j9t h GLY 200 N 0.63 0.66 0.56 1.56 0.00 -1.99 -2.80 103.07 101.69 1j9t h GLY 200 Ca 0.36 -0.39 0.17 0.00 0.00 0.00 0.00 47.33 47.47 1j9t h GLY 200 CO -0.13 0.37 0.53 -0.55 0.00 0.00 0.00 176.54 176.76 1j9t h ASP 201 N 0.59 0.32 1.34 0.19 3.45 -1.72 -2.41 116.42 118.18 1j9t h ASP 201 Ca 0.13 0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.61 1j9t h ASP 201 Cb 0.34 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 39.07 1j9t h ASP 201 CO 0.01 0.15 -0.42 0.00 -1.57 0.00 0.00 179.24 177.41 1j9t h ALA 202 N 1.64 0.76 -0.61 3.45 0.00 -1.59 -3.42 119.26 119.49 1j9t h ALA 202 Ca 0.39 0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.39 1j9t h ALA 202 Cb 1.03 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.71 1j9t h ALA 202 CO -0.11 0.00 -0.43 -0.92 0.00 0.00 0.00 179.25 177.78 1j9t h TYR 203 N 0.00 -1.27 -0.38 0.00 5.03 -1.50 -0.33 116.97 118.52 1j9t h TYR 203 Ca 0.00 0.08 -0.00 0.00 2.58 0.00 0.00 58.73 61.39 1j9t h TYR 203 Cb 0.88 0.64 -0.02 0.00 1.55 0.00 0.00 36.73 39.78 1j9t h TYR 203 CO 0.00 -0.42 0.24 1.49 -1.32 0.00 0.00 178.16 178.15 1j9t h GLU 204 N -0.21 0.52 -0.77 1.82 4.81 -1.81 -0.20 114.58 118.74 1j9t h GLU 204 Ca 0.19 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.32 1j9t h GLU 204 Cb 0.56 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 1j9t h GLU 204 CO -0.71 0.38 0.27 -0.44 -0.73 0.00 0.00 179.01 177.78 1j9t h ASP 205 N 0.51 1.10 -0.36 1.04 3.45 -1.79 -2.83 116.42 117.54 1j9t h ASP 205 Ca 0.14 -0.19 -0.05 0.00 0.43 0.00 0.00 57.03 57.35 1j9t h ASP 205 Cb -0.01 -0.29 -0.01 0.00 -0.56 0.00 0.00 39.33 38.46 1j9t h ASP 205 CO -0.03 1.00 0.02 0.74 -1.57 0.00 0.00 179.24 179.41 1j9t h THR 206 N 1.14 1.25 -0.98 0.35 2.02 -0.71 -2.75 112.91 113.23 1j9t h THR 206 Ca 0.25 -0.93 0.09 0.00 0.77 0.00 0.00 66.41 66.59 1j9t h THR 206 Cb 0.27 1.16 -0.07 0.00 -1.74 0.00 0.00 68.15 67.77 1j9t h THR 206 CO -0.01 0.31 0.63 0.58 0.37 0.00 0.00 175.52 177.39 1j9t h VAL 207 N 0.43 1.01 -0.48 3.16 2.07 -0.94 0.90 116.25 122.40 1j9t h VAL 207 Ca 0.10 -0.36 0.02 0.00 0.82 0.00 0.00 66.70 67.28 1j9t h VAL 207 Cb 0.42 -0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.02 1j9t h VAL 207 CO 0.01 0.19 0.29 0.50 0.02 0.00 0.00 177.57 178.59 1j9t h LYS 208 N 1.06 0.57 -0.33 1.57 3.64 -1.25 -0.72 116.57 121.12 1j9t h LYS 208 Ca 0.45 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.73 1j9t h LYS 208 Cb 0.32 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 1j9t h LYS 208 CO -0.20 0.38 -0.04 0.28 -2.27 0.00 0.00 179.45 177.59 1j9t h VAL 209 N 0.59 1.27 -0.94 2.00 2.07 -0.94 -2.87 116.25 117.44 1j9t h VAL 209 Ca 0.19 -1.06 0.12 0.00 0.82 0.00 0.00 66.70 66.77 1j9t h VAL 209 Cb -0.00 1.30 -0.08 0.00 -1.52 0.00 0.00 31.29 30.99 1j9t h VAL 209 CO -0.08 0.34 0.60 0.24 0.02 0.00 0.00 177.57 178.70 1j9t h MET 210 N 0.39 0.85 0.00 1.57 2.86 -0.53 -0.68 114.93 119.39 1j9t h MET 210 Ca 0.09 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1j9t h MET 210 Cb 0.52 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.99 1j9t h MET 210 CO 0.03 0.56 -0.00 0.00 1.06 0.00 0.00 176.91 178.55 1j9t h ARG 211 N 0.87 0.00 0.00 1.72 3.08 -0.90 -0.33 114.38 118.83 1j9t h ARG 211 Ca 0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.51 1j9t h ARG 211 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1j9t h ARG 211 CO -0.22 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 178.93 1j9t n THR 212 N -3.10 0.06 -1.82 2.04 -2.24 -0.26 -4.88 114.28 104.07 1j9t n THR 212 Ca -0.02 0.02 -0.15 0.00 -2.27 0.00 0.00 64.05 61.62 1j9t n THR 212 Cb 0.13 -0.53 -0.04 0.00 -2.10 0.00 0.00 70.33 67.78 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 -1.43 -1.24 -3.95 3.22 4.77 -0.13 -4.93 117.00 113.31 1j9t n LEU 213 Ca 0.09 0.28 -0.31 0.00 -0.03 0.00 0.00 56.01 56.04 1j9t n LEU 213 Cb 0.30 -2.32 -0.15 0.00 -2.33 0.00 0.00 43.42 38.92 1j9t n LEU 213 CO 0.25 -0.56 -0.31 -0.89 -1.33 0.00 0.00 177.39 174.55 1j9t s THR 214 N -2.48 2.03 0.54 -5.08 2.01 -1.26 -5.11 115.64 106.27 1j9t s THR 214 Ca 0.00 -2.28 -0.21 0.00 0.31 0.00 0.00 61.69 59.51 1j9t s THR 214 Cb 0.00 -2.49 -0.05 0.00 0.01 0.00 0.00 72.50 69.97 1j9t s THR 214 CO 0.00 -0.64 1.26 -2.16 -0.69 0.00 0.00 174.62 172.38 1j9t s PRO 215 N 0.89 3.27 0.19 4.92 0.04 -1.26 -4.91 135.00 138.13 1j9t s PRO 215 Ca 0.12 1.98 0.14 0.00 0.04 0.00 0.00 61.00 63.27 1j9t s PRO 215 Cb -0.20 -2.20 -0.04 0.00 0.04 0.00 0.00 34.50 32.11 1j9t s PRO 215 CO -0.10 -1.01 1.24 1.79 0.04 0.00 0.00 177.00 178.96 1j9t h THR 216 N 1.39 0.90 -3.68 1.26 1.35 -0.99 -3.46 112.91 109.69 1j9t h THR 216 Ca -0.50 -2.36 -0.21 0.00 -0.55 0.00 0.00 66.41 62.78 1j9t h THR 216 Cb 1.28 2.39 -0.26 0.00 -1.73 0.00 0.00 68.15 69.83 1j9t h THR 216 CO 0.57 0.51 -0.67 -1.00 -0.25 0.00 0.00 175.52 174.69 1j9t s HIS 217 N -2.90 0.00 -0.23 4.73 3.76 -1.01 -4.85 115.29 114.79 1j9t s HIS 217 Ca 0.02 0.00 -0.02 0.00 -0.15 0.00 0.00 55.06 54.91 1j9t s HIS 217 Cb 0.08 -0.02 0.07 0.00 1.11 0.00 0.00 32.58 33.83 1j9t s HIS 217 CO 0.78 -0.06 0.05 0.08 -0.85 0.00 0.00 174.74 174.74 1j9t s VAL 218 N -0.26 0.60 0.22 -0.90 1.01 -0.50 -0.35 120.40 120.22 1j9t s VAL 218 Ca -0.03 -0.80 0.06 0.00 0.00 0.00 0.00 61.98 61.20 1j9t s VAL 218 Cb -0.02 -1.21 -0.05 0.00 0.00 0.00 0.00 36.38 35.10 1j9t s VAL 218 CO -0.00 -0.36 -0.07 0.68 0.00 0.00 0.00 175.10 175.35 1j9t s VAL 219 N 1.80 1.40 -0.09 2.92 -7.23 -0.54 0.28 120.40 118.94 1j9t s VAL 219 Ca 0.02 -2.11 -0.02 0.00 -1.81 0.00 0.00 61.98 58.07 1j9t s VAL 219 Cb -0.17 -2.20 -0.03 0.00 0.56 0.00 0.00 36.38 34.54 1j9t s VAL 219 CO -0.14 -0.47 -0.01 -0.36 -0.31 0.00 0.00 175.10 173.81 1j9t s PHE 220 N -3.18 3.12 -1.51 2.82 0.08 -1.26 -0.16 117.98 117.89 1j9t s PHE 220 Ca 0.25 0.12 -0.13 0.00 0.12 0.00 0.00 56.93 57.29 1j9t s PHE 220 Cb 0.03 -1.80 0.08 0.00 -0.57 0.00 0.00 43.02 40.76 1j9t s PHE 220 CO 0.07 0.39 0.87 -1.71 -0.10 0.00 0.00 175.22 174.75 1j9t n ASN 221 N 2.33 -4.72 0.00 1.36 4.05 -0.69 -3.11 115.26 114.48 1j9t n ASN 221 Ca -0.18 -0.69 0.00 0.00 0.45 0.00 0.00 54.58 54.16 1j9t n ASN 221 Cb 0.53 -3.79 0.00 0.00 1.23 0.00 0.00 39.78 37.76 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 -1.59 1.58 3.53 8.20 0.00 -0.88 -4.80 105.19 111.24 1j9t n GLY 222 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.54 -1.86 0.27 4.61 0.00 -1.18 -4.57 121.76 115.49 1j9t s ALA 223 Ca 0.00 1.25 -0.31 0.00 0.00 0.00 0.00 51.96 52.90 1j9t s ALA 223 Cb 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 23.12 22.98 1j9t s ALA 223 CO 0.00 -0.53 1.48 0.28 0.00 0.00 0.00 175.76 176.99 1j9t n VAL 224 N 0.17 1.03 -0.96 0.00 0.31 -0.37 -1.78 118.33 116.73 1j9t n VAL 224 Ca -0.10 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 1j9t n VAL 224 Cb 0.60 -1.69 0.00 0.00 -0.91 0.00 0.00 33.84 31.84 1j9t n VAL 224 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1j9t n GLY 225 N 2.10 0.16 0.34 2.92 0.00 -1.26 -4.82 105.19 104.63 1j9t n GLY 225 Ca 0.10 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.29 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 1.96 -1.43 4.61 0.00 -1.55 -2.52 119.26 120.33 1j9t h ALA 226 Ca 0.00 -0.01 -0.65 0.00 0.00 0.00 0.00 54.91 54.26 1j9t h ALA 226 Cb 0.63 0.02 -0.37 0.00 0.00 0.00 0.00 17.79 18.06 1j9t h ALA 226 CO 0.00 -0.34 -0.18 1.28 0.00 0.00 0.00 179.25 180.01 1j9t n LEU 227 N -3.98 5.54 -4.20 0.00 4.77 -1.26 -4.77 117.00 113.10 1j9t n LEU 227 Ca 0.03 -5.16 -0.12 0.00 -0.03 0.00 0.00 56.01 50.73 1j9t n LEU 227 Cb 0.36 -0.66 -0.10 0.00 -2.33 0.00 0.00 43.42 40.69 1j9t n LEU 227 CO 0.30 2.11 -0.24 0.42 -1.33 0.00 0.00 177.39 178.65 1j9t s THR 228 N -5.29 0.00 0.00 -5.08 -4.23 -0.95 -1.61 115.64 98.48 1j9t s THR 228 Ca 0.49 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.00 1j9t s THR 228 Cb 0.39 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.74 1j9t s THR 228 CO -0.25 -0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.44 1j9t n GLY 229 N -0.27 2.72 0.00 3.99 0.00 -1.26 -1.86 105.19 108.51 1j9t n GLY 229 Ca 0.02 -0.39 0.03 0.00 0.00 0.00 0.00 46.02 45.68 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 2.47 0.00 -0.41 1.61 5.75 -1.26 -1.15 116.55 123.56 1j9t n ASP 230 Ca 0.00 0.26 0.05 0.00 -0.01 0.00 0.00 54.79 55.09 1j9t n ASP 230 Cb 0.00 -0.32 0.13 0.00 -1.03 0.00 0.00 41.12 39.89 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 -1.32 2.67 -2.04 0.11 5.02 -0.78 -5.02 118.16 116.80 1j9t n LYS 231 Ca 0.02 -2.13 -0.35 0.00 -2.02 0.00 0.00 58.31 53.83 1j9t n LYS 231 Cb 0.05 -1.34 0.03 0.00 -0.02 0.00 0.00 35.03 33.74 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 -1.67 2.57 0.75 7.82 0.00 -0.30 -3.87 121.76 127.05 1j9t s ALA 232 Ca 0.22 0.87 -0.11 0.00 0.00 0.00 0.00 51.96 52.94 1j9t s ALA 232 Cb 0.15 -3.40 0.04 0.00 0.00 0.00 0.00 23.12 19.91 1j9t s ALA 232 CO 0.08 -1.07 1.08 -1.64 0.00 0.00 0.00 175.76 174.20 1j9t s MET 233 N -3.44 2.50 0.09 0.00 -1.94 -0.36 -4.82 119.30 111.32 1j9t s MET 233 Ca 0.74 0.98 0.02 0.00 -1.71 0.00 0.00 55.69 55.73 1j9t s MET 233 Cb -0.27 -1.94 -0.04 0.00 2.01 0.00 0.00 34.83 34.60 1j9t s MET 233 CO 0.32 -1.42 -0.08 0.95 -0.01 0.00 0.00 175.02 174.79 1j9t s THR 234 N -3.00 0.75 0.17 2.05 -4.23 -1.26 -0.22 115.64 109.91 1j9t s THR 234 Ca 0.60 -1.70 -0.14 0.00 -1.18 0.00 0.00 61.69 59.27 1j9t s THR 234 Cb -0.15 -1.40 0.05 0.00 1.34 0.00 0.00 72.50 72.34 1j9t s THR 234 CO 0.55 -0.69 0.69 0.00 -0.54 0.00 0.00 174.62 174.64 1j9t n ALA 235 N 0.40 -1.75 -2.63 3.99 0.00 -0.73 -4.91 120.51 114.88 1j9t n ALA 235 Ca -0.15 -0.78 -0.08 0.00 0.00 0.00 0.00 53.44 52.42 1j9t n ALA 235 Cb 0.59 0.50 -0.10 0.00 0.00 0.00 0.00 19.45 20.43 1j9t n ALA 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j9t s ALA 236 N -1.75 0.23 0.25 0.00 0.00 -1.26 -2.07 121.76 117.15 1j9t s ALA 236 Ca 0.15 -0.80 -0.31 0.00 0.00 0.00 0.00 51.96 51.01 1j9t s ALA 236 Cb -0.02 0.21 -0.13 0.00 0.00 0.00 0.00 23.12 23.17 1j9t s ALA 236 CO 0.05 -0.26 1.39 0.28 0.00 0.00 0.00 175.76 177.23 1j9t n VAL 237 N 0.96 1.05 0.00 0.00 0.31 -0.38 -0.76 118.33 119.51 1j9t n VAL 237 Ca -0.20 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 63.87 1j9t n VAL 237 Cb 0.58 -1.48 0.00 0.00 -0.91 0.00 0.00 33.84 32.03 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 2.02 3.19 3.74 2.92 0.00 0.12 -4.99 105.19 112.20 1j9t n GLY 238 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1j9t n GLY 238 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1j9t s GLU 239 N -0.44 4.50 -0.21 1.61 2.12 0.06 -4.72 118.70 121.61 1j9t s GLU 239 Ca 0.00 1.90 -0.13 0.00 0.36 0.00 0.00 54.97 57.10 1j9t s GLU 239 Cb 0.00 -3.22 -0.05 0.00 0.26 0.00 0.00 34.13 31.12 1j9t s GLU 239 CO 0.00 -0.06 0.27 0.15 -0.54 0.00 0.00 175.26 175.07 1j9t s LYS 240 N -0.48 4.14 -0.04 4.30 1.02 -1.26 -1.80 119.74 125.62 1j9t s LYS 240 Ca 0.52 -0.04 0.04 0.00 0.02 0.00 0.00 55.97 56.51 1j9t s LYS 240 Cb -0.33 -3.52 -0.00 0.00 -0.52 0.00 0.00 37.83 33.46 1j9t s LYS 240 CO 0.38 0.05 -0.16 0.08 -0.92 0.00 0.00 175.35 174.78 1j9t s VAL 241 N 1.05 1.37 -0.19 3.17 1.01 0.24 0.10 120.40 127.15 1j9t s VAL 241 Ca 0.13 -0.68 -0.07 0.00 0.00 0.00 0.00 61.98 61.36 1j9t s VAL 241 Cb -0.14 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 1j9t s VAL 241 CO 0.05 0.40 0.05 -0.22 0.00 0.00 0.00 175.10 175.38 1j9t s LEU 242 N 0.05 3.63 -0.36 3.92 2.96 -0.47 -1.45 118.68 126.97 1j9t s LEU 242 Ca -0.04 -0.03 -0.02 0.00 -0.22 0.00 0.00 54.13 53.83 1j9t s LEU 242 Cb -0.11 -1.92 0.08 0.00 0.50 0.00 0.00 46.19 44.74 1j9t s LEU 242 CO 0.02 0.12 0.11 -0.63 -1.32 0.00 0.00 176.35 174.65 1j9t s ILE 243 N 0.68 3.12 -0.04 6.68 1.01 0.11 -1.33 121.20 131.41 1j9t s ILE 243 Ca 0.02 -1.78 -0.22 0.00 0.00 0.00 0.00 60.65 58.68 1j9t s ILE 243 Cb -0.13 -3.00 -0.04 0.00 0.01 0.00 0.00 42.46 39.29 1j9t s ILE 243 CO 0.02 -0.44 0.64 -0.69 0.00 0.00 0.00 174.94 174.47 1j9t s VAL 244 N 1.18 5.00 -0.03 2.92 1.01 -0.11 -1.36 120.40 129.01 1j9t s VAL 244 Ca 0.03 1.33 0.03 0.00 0.00 0.00 0.00 61.98 63.36 1j9t s VAL 244 Cb -0.21 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.19 1j9t s VAL 244 CO -0.03 0.33 -0.10 -2.28 0.00 0.00 0.00 175.10 173.01 1j9t s HIS 245 N 0.38 1.08 0.08 5.22 2.46 -0.27 0.40 115.29 124.64 1j9t s HIS 245 Ca 0.34 -0.28 0.02 0.00 0.47 0.00 0.00 55.06 55.62 1j9t s HIS 245 Cb -0.18 -0.76 -0.03 0.00 -0.13 0.00 0.00 32.58 31.48 1j9t s HIS 245 CO 0.17 -0.11 -0.08 -1.54 -2.47 0.00 0.00 174.74 170.72 1j9t s SER 246 N 0.15 1.10 -0.27 9.88 1.04 -0.82 -0.37 113.70 124.41 1j9t s SER 246 Ca -0.03 -0.80 -0.01 0.00 0.48 0.00 0.00 55.95 55.59 1j9t s SER 246 Cb -0.09 0.06 0.15 0.00 0.10 0.00 0.00 66.02 66.24 1j9t s SER 246 CO 0.01 -0.33 0.45 -1.58 0.98 0.00 0.00 173.24 172.76 1j9t s GLN 247 N -2.81 0.42 0.00 4.02 -0.44 -0.91 -1.09 119.66 118.85 1j9t s GLN 247 Ca 0.03 0.58 0.30 0.00 -2.50 0.00 0.00 55.36 53.76 1j9t s GLN 247 Cb -0.02 -0.17 1.37 0.00 -1.64 0.00 0.00 33.01 32.56 1j9t s GLN 247 CO -0.02 -0.73 1.97 0.00 0.50 0.00 0.00 175.29 177.02 1j9t n ALA 248 N 5.38 2.56 0.00 1.58 0.00 -1.26 0.50 120.51 129.27 1j9t n ALA 248 Ca -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1j9t n ALA 248 Cb 0.50 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.51 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 -1.26 0.76 -3.87 0.00 5.15 -1.26 -3.23 115.26 111.55 1j9t n ASN 249 Ca 0.13 0.00 -0.11 0.00 -0.60 0.00 0.00 54.58 53.99 1j9t n ASN 249 Cb 0.27 0.13 -0.12 0.00 -0.53 0.00 0.00 39.78 39.54 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 -0.50 0.25 0.69 1.20 3.52 -1.26 -4.65 118.95 118.20 1j9t s ARG 250 Ca 0.00 -0.14 -0.16 0.00 -0.13 0.00 0.00 55.73 55.29 1j9t s ARG 250 Cb 0.00 0.11 -0.02 0.00 -1.56 0.00 0.00 34.95 33.48 1j9t s ARG 250 CO 0.00 -0.05 0.87 -0.25 -0.81 0.00 0.00 175.30 175.06 1j9t n ASP 251 N 2.34 0.18 -3.94 -2.12 10.43 -1.26 -3.72 116.55 118.47 1j9t n ASP 251 Ca -0.17 0.68 -0.09 0.00 2.57 0.00 0.00 54.79 57.78 1j9t n ASP 251 Cb 0.57 -1.36 -0.07 0.00 1.84 0.00 0.00 41.12 42.10 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 -1.77 0.09 -0.39 -3.53 -1.32 -0.18 -4.82 115.64 103.71 1j9t s THR 252 Ca 0.72 -1.34 0.03 0.00 -1.21 0.00 0.00 61.69 59.89 1j9t s THR 252 Cb -0.36 -1.71 0.16 0.00 -1.51 0.00 0.00 72.50 69.08 1j9t s THR 252 CO 0.51 -0.39 0.32 0.00 -2.21 0.00 0.00 174.62 172.84 1j9t s ARG 253 N -3.94 0.78 0.43 7.08 1.70 -1.26 -1.60 118.95 122.14 1j9t s ARG 253 Ca 0.14 -1.75 -0.25 0.00 -0.47 0.00 0.00 55.73 53.40 1j9t s ARG 253 Cb 0.04 -1.27 -0.08 0.00 -0.57 0.00 0.00 34.95 33.06 1j9t s ARG 253 CO -0.03 -1.32 1.33 -2.14 -1.08 0.00 0.00 175.30 172.07 1j9t s PRO 254 N 0.49 3.82 -0.15 3.89 0.02 -1.09 0.72 135.00 142.70 1j9t s PRO 254 Ca 0.27 2.22 -0.08 0.00 0.02 0.00 0.00 61.00 63.43 1j9t s PRO 254 Cb -0.06 -2.68 0.05 0.00 0.02 0.00 0.00 34.50 31.84 1j9t s PRO 254 CO -0.12 -0.63 0.35 1.21 -0.33 0.00 0.00 177.00 177.48 1j9t s ASN 255 N -0.72 -0.43 -0.63 2.53 3.84 0.02 -1.05 114.94 118.51 1j9t s ASN 255 Ca 0.59 0.77 -0.18 0.00 0.21 0.00 0.00 52.86 54.25 1j9t s ASN 255 Cb -0.39 0.65 0.12 0.00 -0.55 0.00 0.00 41.25 41.07 1j9t s ASN 255 CO 0.50 -0.18 0.71 -0.22 -2.79 0.00 0.00 177.10 175.12 1j9t s LEU 256 N 1.34 5.60 -0.05 3.21 2.96 -1.26 -1.52 118.68 128.97 1j9t s LEU 256 Ca -0.09 -1.63 -0.30 0.00 -0.22 0.00 0.00 54.13 51.89 1j9t s LEU 256 Cb -0.09 -2.29 -0.06 0.00 0.50 0.00 0.00 46.19 44.25 1j9t s LEU 256 CO -0.11 -1.03 1.79 -0.63 -1.32 0.00 0.00 176.35 175.05 1j9t s ILE 257 N 2.32 3.36 0.00 6.68 -1.09 0.13 -1.04 121.20 131.57 1j9t s ILE 257 Ca 0.12 0.43 0.00 0.00 -2.23 0.00 0.00 60.65 58.97 1j9t s ILE 257 Cb -0.23 -3.30 0.00 0.00 -1.58 0.00 0.00 42.46 37.36 1j9t s ILE 257 CO 0.04 -0.06 0.00 0.61 -1.23 0.00 0.00 174.94 174.30 1j9t n GLY 258 N 4.42 1.98 0.00 6.18 0.00 -1.26 -3.16 105.19 113.34 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 -1.53 5.28 3.76 -0.02 0.00 -0.20 -4.98 105.19 107.49 1j9t n GLY 259 Ca 0.00 -1.46 -0.10 0.00 0.00 0.00 0.00 46.02 44.46 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 2.12 0.27 -0.63 1.61 0.09 -1.25 -4.81 115.29 112.69 1j9t s HIS 260 Ca 0.00 -0.89 -0.04 0.00 -0.00 0.00 0.00 55.06 54.13 1j9t s HIS 260 Cb 0.00 0.71 0.16 0.00 -0.00 0.00 0.00 32.58 33.45 1j9t s HIS 260 CO 0.00 -1.53 0.45 0.20 -0.00 0.00 0.00 174.74 173.87 1j9t s GLY 261 N -3.10 2.48 0.21 -2.22 0.00 -0.21 -4.76 107.32 99.73 1j9t s GLY 261 Ca 0.18 -3.21 -0.09 0.00 0.00 0.00 0.00 44.72 41.60 1j9t s GLY 261 CO 0.13 1.11 1.72 -0.55 0.00 0.00 0.00 173.10 175.51 1j9t h ASP 262 N 7.19 0.07 -3.36 1.64 3.32 -1.58 -1.44 116.42 122.27 1j9t h ASP 262 Ca -0.02 0.10 -0.41 0.00 0.02 0.00 0.00 57.03 56.73 1j9t h ASP 262 Cb 0.97 0.13 -0.36 0.00 0.22 0.00 0.00 39.33 40.28 1j9t h ASP 262 CO 0.72 0.04 -0.76 -0.31 -1.72 0.00 0.00 179.24 177.21 1j9t s TYR 263 N -6.10 0.58 -0.10 4.55 1.51 -0.99 -1.99 117.35 114.81 1j9t s TYR 263 Ca -0.13 -0.12 -0.00 0.00 -1.01 0.00 0.00 57.07 55.81 1j9t s TYR 263 Cb 0.18 -0.67 0.02 0.00 -0.11 0.00 0.00 41.96 41.38 1j9t s TYR 263 CO 0.74 -0.25 -0.07 0.08 -1.11 0.00 0.00 175.55 174.94 1j9t s VAL 264 N 1.53 0.94 -1.13 0.71 1.01 0.33 -0.24 120.40 123.55 1j9t s VAL 264 Ca -0.02 -0.25 -0.13 0.00 0.00 0.00 0.00 61.98 61.59 1j9t s VAL 264 Cb -0.13 -0.96 0.21 0.00 0.00 0.00 0.00 36.38 35.50 1j9t s VAL 264 CO -0.03 0.35 1.25 0.26 0.00 0.00 0.00 175.10 176.93 1j9t s TRP 265 N 1.61 3.75 0.28 5.22 0.51 -0.06 -0.04 118.94 130.21 1j9t s TRP 265 Ca 0.02 -2.25 0.00 0.00 -2.12 0.00 0.00 56.10 51.76 1j9t s TRP 265 Cb -0.13 -4.12 0.52 0.00 -0.81 0.00 0.00 33.47 28.93 1j9t s TRP 265 CO -0.06 -1.23 1.85 0.00 -0.51 0.00 0.00 176.95 177.00 1j9t h ALA 266 N 7.18 1.49 -0.00 0.98 0.00 -1.89 0.15 119.26 127.16 1j9t h ALA 266 Ca 0.24 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1j9t h ALA 266 Cb 0.90 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1j9t h ALA 266 CO 1.12 0.28 -0.00 0.25 0.00 0.00 0.00 179.25 180.90 1j9t n THR 267 N -4.59 0.00 -0.88 0.00 -2.24 -1.26 -4.44 114.28 100.87 1j9t n THR 267 Ca 0.18 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 1j9t n THR 267 Cb 0.31 -0.49 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 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 1.20 0.70 3.46 3.38 0.00 0.48 -4.76 105.19 109.65 1j9t n GLY 268 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.29 3.68 0.55 1.61 -0.14 -1.26 -0.12 119.74 123.77 1j9t s LYS 269 Ca 0.00 -0.46 0.28 0.00 -1.36 0.00 0.00 55.97 54.43 1j9t s LYS 269 Cb 0.00 -3.34 1.60 0.00 -1.68 0.00 0.00 37.83 34.41 1j9t s LYS 269 CO 0.00 -0.17 2.15 0.74 -0.76 0.00 0.00 175.35 177.31 1j9t h PHE 270 N 8.20 0.00 -0.00 3.18 0.05 -1.83 -1.57 116.94 124.96 1j9t h PHE 270 Ca -0.38 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.41 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 0.67 0.07 -0.01 0.09 -0.18 0.00 0.00 178.31 178.95 1j9t n ASN 271 N -3.76 0.13 -4.47 2.17 3.02 -1.26 -4.53 115.26 106.56 1j9t n ASN 271 Ca -0.02 -0.71 -0.41 0.00 -0.03 0.00 0.00 54.58 53.41 1j9t n ASN 271 Cb 0.17 -0.10 -0.11 0.00 -0.61 0.00 0.00 39.78 39.13 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 -2.23 5.05 0.16 3.41 2.01 -0.59 -5.04 115.64 118.40 1j9t s THR 272 Ca 0.39 -0.49 -0.32 0.00 0.31 0.00 0.00 61.69 61.58 1j9t s THR 272 Cb 0.21 -3.69 -0.17 0.00 0.01 0.00 0.00 72.50 68.86 1j9t s THR 272 CO 0.41 -0.13 0.91 -2.65 -0.69 0.00 0.00 174.62 172.48 1j9t n PRO 273 N 5.08 0.55 -2.36 4.92 -0.02 -1.26 -4.85 135.00 137.07 1j9t n PRO 273 Ca -0.12 0.20 -0.33 0.00 -2.02 0.00 0.00 63.50 61.22 1j9t n PRO 273 Cb 0.48 -1.52 -0.02 0.00 -0.02 0.00 0.00 33.50 32.43 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 -0.63 3.65 0.66 0.52 0.04 -1.26 -4.92 135.00 133.06 1j9t s PRO 274 Ca 0.72 1.26 -0.11 0.00 0.04 0.00 0.00 61.00 62.92 1j9t s PRO 274 Cb -0.95 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 31.50 1j9t s PRO 274 CO 0.55 -0.55 1.05 -0.51 0.04 0.00 0.00 177.00 177.59 1j9t s ASP 275 N -2.38 5.79 0.17 6.66 1.01 0.95 -4.74 116.67 124.12 1j9t s ASP 275 Ca 0.65 1.46 0.06 0.00 0.71 0.00 0.00 52.55 55.44 1j9t s ASP 275 Cb -0.15 -2.42 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 1j9t s ASP 275 CO 0.27 -1.16 -0.13 0.68 0.21 0.00 0.00 175.17 175.04 1j9t s VAL 276 N -3.14 1.48 -1.34 -1.27 -7.23 -1.26 -0.51 120.40 107.12 1j9t s VAL 276 Ca 0.57 -2.05 -0.04 0.00 -1.81 0.00 0.00 61.98 58.65 1j9t s VAL 276 Cb -0.12 -1.87 0.02 0.00 0.56 0.00 0.00 36.38 34.97 1j9t s VAL 276 CO 0.54 -0.59 0.30 0.47 -0.31 0.00 0.00 175.10 175.51 1j9t n ASP 277 N -0.10 -4.66 -4.77 4.85 10.43 -0.84 -4.93 116.55 116.53 1j9t n ASP 277 Ca -0.10 -0.13 -0.39 0.00 2.57 0.00 0.00 54.79 56.74 1j9t n ASP 277 Cb 0.60 -3.86 -0.01 0.00 1.84 0.00 0.00 41.12 39.68 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 -5.49 4.01 -0.23 -1.24 -1.52 -0.56 -4.78 119.66 109.84 1j9t s GLN 278 Ca 0.20 1.94 -0.16 0.00 -1.95 0.00 0.00 55.36 55.39 1j9t s GLN 278 Cb -0.10 -2.69 -0.12 0.00 -0.22 0.00 0.00 33.01 29.88 1j9t s GLN 278 CO 0.24 -0.39 -0.18 -0.85 -0.25 0.00 0.00 175.29 173.85 1j9t n GLU 279 N 0.07 0.56 -4.15 2.91 0.28 -1.26 -1.04 120.64 118.00 1j9t n GLU 279 Ca 0.04 0.37 -0.20 0.00 -0.16 0.00 0.00 57.16 57.21 1j9t n GLU 279 Cb 0.46 -1.57 -0.16 0.00 1.43 0.00 0.00 31.44 31.59 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 -2.51 0.53 0.47 3.84 2.01 -1.26 -4.21 115.64 114.50 1j9t s THR 280 Ca -0.32 -0.11 0.07 0.00 0.31 0.00 0.00 61.69 61.64 1j9t s THR 280 Cb 0.09 -0.56 -0.00 0.00 0.01 0.00 0.00 72.50 72.04 1j9t s THR 280 CO 0.47 0.23 0.36 -1.66 -0.69 0.00 0.00 174.62 173.33 1j9t s TRP 281 N 0.95 2.25 -0.07 4.92 -2.14 -0.22 -4.97 118.94 119.66 1j9t s TRP 281 Ca -0.11 -0.65 0.02 0.00 2.66 0.00 0.00 56.10 58.02 1j9t s TRP 281 Cb -0.14 -2.03 0.02 0.00 -3.10 0.00 0.00 33.47 28.21 1j9t s TRP 281 CO -0.00 -0.22 -0.11 0.12 -2.66 0.00 0.00 176.95 174.09 1j9t s PHE 282 N -2.62 1.39 -0.19 1.66 5.36 -1.26 -2.68 117.98 119.63 1j9t s PHE 282 Ca 0.42 -0.54 0.01 0.00 -0.96 0.00 0.00 56.93 55.86 1j9t s PHE 282 Cb -0.01 -1.05 0.04 0.00 -0.34 0.00 0.00 43.02 41.65 1j9t s PHE 282 CO 0.24 -0.31 -0.12 0.42 -1.46 0.00 0.00 175.22 173.99 1j9t s ILE 283 N 0.87 1.72 0.52 3.12 1.01 -0.63 -4.68 121.20 123.13 1j9t s ILE 283 Ca -0.11 -0.98 -0.19 0.00 0.00 0.00 0.00 60.65 59.37 1j9t s ILE 283 Cb -0.15 -1.73 -0.07 0.00 0.01 0.00 0.00 42.46 40.52 1j9t s ILE 283 CO 0.01 0.25 1.08 -2.16 0.00 0.00 0.00 174.94 174.12 1j9t s PRO 284 N 1.38 3.55 0.24 2.79 0.04 -1.26 -1.01 135.00 140.72 1j9t s PRO 284 Ca 0.00 1.46 -0.31 0.00 0.04 0.00 0.00 61.00 62.19 1j9t s PRO 284 Cb -0.15 -2.05 -0.13 0.00 0.04 0.00 0.00 34.50 32.20 1j9t s PRO 284 CO -0.09 -0.66 1.41 0.41 0.04 0.00 0.00 177.00 178.11 1j9t n GLY 285 N -0.12 0.78 0.55 0.56 0.00 -1.24 -2.35 105.19 103.36 1j9t n GLY 285 Ca 0.10 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.62 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 2.18 0.88 3.51 -0.02 0.00 0.18 -4.74 105.19 107.18 1j9t n GLY 286 Ca 0.12 -0.30 -0.09 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.31 0.13 4.61 0.00 -0.89 -4.79 121.76 118.51 1j9t s ALA 287 Ca 0.00 -0.75 0.10 0.00 0.00 0.00 0.00 51.96 51.31 1j9t s ALA 287 Cb 0.00 0.97 -0.04 0.00 0.00 0.00 0.00 23.12 24.05 1j9t s ALA 287 CO 0.00 -0.79 -0.23 0.00 0.00 0.00 0.00 175.76 174.74 1j9t s ALA 288 N -3.98 2.14 0.29 0.00 0.00 -1.26 -2.14 121.76 116.81 1j9t s ALA 288 Ca 0.18 -1.41 0.02 0.00 0.00 0.00 0.00 51.96 50.75 1j9t s ALA 288 Cb 0.00 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 1j9t s ALA 288 CO 0.04 0.42 0.14 0.20 0.00 0.00 0.00 175.76 176.56 1j9t s GLY 289 N -2.16 1.94 -0.12 0.00 0.00 0.51 -3.08 107.32 104.40 1j9t s GLY 289 Ca 0.12 -1.78 -0.13 0.00 0.00 0.00 0.00 44.72 42.94 1j9t s GLY 289 CO 0.06 -1.58 0.35 0.00 0.00 0.00 0.00 173.10 171.93 1j9t s ALA 290 N -3.67 -0.87 0.01 3.20 0.00 -1.03 -1.11 121.76 118.28 1j9t s ALA 290 Ca 0.36 0.93 0.05 0.00 0.00 0.00 0.00 51.96 53.30 1j9t s ALA 290 Cb 0.06 -0.51 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 1j9t s ALA 290 CO 0.16 -0.18 -0.15 0.00 0.00 0.00 0.00 175.76 175.59 1j9t s ALA 291 N 0.02 1.29 -0.13 0.00 0.00 -0.47 -0.88 121.76 121.58 1j9t s ALA 291 Ca -0.02 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.22 1j9t s ALA 291 Cb -0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 1j9t s ALA 291 CO 0.01 0.30 -0.16 0.12 0.00 0.00 0.00 175.76 176.02 1j9t s PHE 292 N -0.52 2.74 -0.04 0.00 2.19 0.67 0.05 117.98 123.07 1j9t s PHE 292 Ca 0.05 -0.86 -0.04 0.00 0.33 0.00 0.00 56.93 56.41 1j9t s PHE 292 Cb -0.07 -1.82 0.01 0.00 -1.31 0.00 0.00 43.02 39.83 1j9t s PHE 292 CO 0.00 -0.34 0.12 -0.47 1.83 0.00 0.00 175.22 176.36 1j9t s TYR 293 N 0.47 -0.09 -0.30 10.12 5.04 -0.53 -1.55 117.35 130.53 1j9t s TYR 293 Ca -0.11 0.21 -0.05 0.00 -2.44 0.00 0.00 57.07 54.68 1j9t s TYR 293 Cb -0.16 0.02 0.02 0.00 0.35 0.00 0.00 41.96 42.19 1j9t s TYR 293 CO 0.05 -0.10 0.05 0.99 -1.34 0.00 0.00 175.55 175.20 1j9t s THR 294 N -0.23 3.63 0.32 4.34 2.01 -1.26 -0.59 115.64 123.87 1j9t s THR 294 Ca -0.03 -0.91 -0.29 0.00 0.31 0.00 0.00 61.69 60.77 1j9t s THR 294 Cb -0.02 -2.93 -0.10 0.00 0.01 0.00 0.00 72.50 69.46 1j9t s THR 294 CO 0.00 0.03 1.35 -0.36 -0.69 0.00 0.00 174.62 174.95 1j9t s PHE 295 N 1.42 2.98 0.00 4.92 0.40 -0.74 -4.87 117.98 122.09 1j9t s PHE 295 Ca 0.00 1.32 0.00 0.00 -0.60 0.00 0.00 56.93 57.65 1j9t s PHE 295 Cb -0.18 -3.75 0.00 0.00 0.51 0.00 0.00 43.02 39.60 1j9t s PHE 295 CO 0.01 -2.15 0.00 1.04 0.70 0.00 0.00 175.22 174.82 1j9t n GLN 296 N 0.99 5.44 -4.24 0.44 6.02 -1.26 0.14 117.38 124.91 1j9t n GLN 296 Ca 0.01 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.83 1j9t n GLN 296 Cb 0.41 -0.44 -0.14 0.00 1.02 0.00 0.00 30.24 31.09 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 -0.87 0.60 0.73 -1.09 -1.52 -1.26 -4.63 119.66 111.62 1j9t s GLN 297 Ca 0.00 -0.38 -0.07 0.00 -1.95 0.00 0.00 55.36 52.96 1j9t s GLN 297 Cb 0.00 -0.55 0.08 0.00 -0.22 0.00 0.00 33.01 32.32 1j9t s GLN 297 CO 0.00 0.14 1.04 -1.25 -0.25 0.00 0.00 175.29 174.98 1j9t s PRO 298 N -0.47 2.03 0.00 2.91 0.04 -1.26 -4.77 135.00 133.47 1j9t s PRO 298 Ca 0.01 -0.31 0.00 0.00 0.04 0.00 0.00 61.00 60.74 1j9t s PRO 298 Cb -0.04 -2.15 0.00 0.00 0.04 0.00 0.00 34.50 32.35 1j9t s PRO 298 CO -0.00 -1.36 0.00 0.41 0.04 0.00 0.00 177.00 176.09 1j9t n GLY 299 N -3.00 -0.36 3.82 0.56 0.00 0.12 -4.94 105.19 101.40 1j9t n GLY 299 Ca 0.09 -2.26 -0.37 0.00 0.00 0.00 0.00 46.02 43.48 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 0.03 -0.61 2.07 -1.26 -1.61 121.20 124.09 1j9t s ILE 300 Ca 0.00 1.16 0.06 0.00 -1.41 0.00 0.00 60.65 60.46 1j9t s ILE 300 Cb 0.00 -3.86 -0.02 0.00 0.13 0.00 0.00 42.46 38.71 1j9t s ILE 300 CO 0.00 0.38 -0.17 -0.31 -1.91 0.00 0.00 174.94 172.93 1j9t s TYR 301 N -1.31 1.53 -0.26 3.50 1.51 -0.36 -4.96 117.35 117.00 1j9t s TYR 301 Ca 0.35 -0.34 -0.07 0.00 -1.01 0.00 0.00 57.07 56.00 1j9t s TYR 301 Cb -0.18 -0.93 -0.01 0.00 -0.11 0.00 0.00 41.96 40.73 1j9t s TYR 301 CO 0.20 0.05 0.05 0.00 -1.11 0.00 0.00 175.55 174.74 1j9t s ALA 302 N -0.72 3.07 -0.31 3.71 0.00 -1.19 -0.69 121.76 125.63 1j9t s ALA 302 Ca 0.05 -1.22 -0.12 0.00 0.00 0.00 0.00 51.96 50.68 1j9t s ALA 302 Cb -0.08 -2.02 -0.03 0.00 0.00 0.00 0.00 23.12 20.98 1j9t s ALA 302 CO 0.01 -0.59 0.20 -0.47 0.00 0.00 0.00 175.76 174.91 1j9t s TYR 303 N 1.56 3.21 0.14 0.00 5.04 -0.01 0.21 117.35 127.51 1j9t s TYR 303 Ca 0.05 -0.09 -0.02 0.00 -2.44 0.00 0.00 57.07 54.57 1j9t s TYR 303 Cb -0.15 -2.41 -0.03 0.00 0.35 0.00 0.00 41.96 39.71 1j9t s TYR 303 CO 0.02 -0.27 0.10 0.14 -1.34 0.00 0.00 175.55 174.19 1j9t s VAL 304 N 1.73 0.09 -0.22 3.14 -7.23 -0.57 -0.23 120.40 117.10 1j9t s VAL 304 Ca 0.06 -1.83 -0.27 0.00 -1.81 0.00 0.00 61.98 58.13 1j9t s VAL 304 Cb -0.17 -2.04 -0.00 0.00 0.56 0.00 0.00 36.38 34.73 1j9t s VAL 304 CO 0.10 -0.41 0.93 0.21 -0.31 0.00 0.00 175.10 175.62 1j9t s ASN 305 N -3.04 6.98 0.00 4.85 3.84 -1.00 -0.80 114.94 125.76 1j9t s ASN 305 Ca 0.24 1.22 0.00 0.00 0.21 0.00 0.00 52.86 54.53 1j9t s ASN 305 Cb 0.07 -2.49 0.00 0.00 -0.55 0.00 0.00 41.25 38.28 1j9t s ASN 305 CO 0.02 -0.56 0.70 1.57 -2.79 0.00 0.00 177.10 176.04 1j9t n HIS 306 N 5.98 0.00 -3.31 0.43 -0.00 0.22 -3.96 115.22 114.58 1j9t n HIS 306 Ca 0.08 -0.24 -0.44 0.00 -0.00 0.00 0.00 57.72 57.11 1j9t n HIS 306 Cb 0.47 -0.17 -0.07 0.00 -0.00 0.00 0.00 29.99 30.22 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 0.49 6.17 0.60 0.26 3.84 -1.26 -4.92 114.94 120.13 1j9t s ASN 307 Ca 0.00 -1.28 0.30 0.00 0.21 0.00 0.00 52.86 52.10 1j9t s ASN 307 Cb 0.00 -2.22 1.75 0.00 -0.55 0.00 0.00 41.25 40.23 1j9t s ASN 307 CO 0.00 -0.75 2.13 -0.07 -2.79 0.00 0.00 177.10 175.62 1j9t h LEU 308 N 9.05 0.00 -0.19 3.21 3.38 -1.99 0.59 115.31 129.36 1j9t h LEU 308 Ca -0.28 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.59 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 0.93 0.00 -0.26 0.40 0.09 0.00 0.00 178.44 179.60 1j9t h ILE 309 N 0.00 1.34 -0.68 1.22 2.04 -1.91 0.67 117.51 120.19 1j9t h ILE 309 Ca 0.06 -1.46 -0.04 0.00 1.00 0.00 0.00 64.86 64.43 1j9t h ILE 309 Cb 0.41 1.83 -0.03 0.00 -0.74 0.00 0.00 36.82 38.29 1j9t h ILE 309 CO -0.00 0.44 0.28 -0.33 0.00 0.00 0.00 178.15 178.54 1j9t h GLU 310 N 0.18 1.02 0.35 2.37 5.08 -1.29 0.19 114.58 122.47 1j9t h GLU 310 Ca 0.02 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.18 1j9t h GLU 310 Cb 0.83 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1j9t h GLU 310 CO 0.06 0.84 -0.17 0.00 -1.00 0.00 0.00 179.01 178.74 1j9t h ALA 311 N 1.13 -0.47 0.00 3.43 0.00 -0.99 -1.65 119.26 120.71 1j9t h ALA 311 Ca 0.23 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1j9t h ALA 311 Cb 0.20 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1j9t h ALA 311 CO -0.02 -0.63 -1.70 1.19 0.00 0.00 0.00 179.25 178.08 1j9t n PHE 312 N -5.19 0.21 -0.12 0.00 3.01 0.22 -2.33 117.46 113.25 1j9t n PHE 312 Ca -0.10 0.06 -0.16 0.00 1.01 0.00 0.00 57.45 58.26 1j9t n PHE 312 Cb 0.26 -0.56 -0.13 0.00 -0.01 0.00 0.00 39.48 39.04 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 -2.29 0.66 0.03 -1.08 -0.58 0.58 -4.62 120.64 113.34 1j9t n GLU 313 Ca -0.03 0.12 0.11 0.00 -0.42 0.00 0.00 57.16 56.95 1j9t n GLU 313 Cb 0.55 -1.53 0.08 0.00 -0.57 0.00 0.00 31.44 29.97 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 -3.17 0.63 0.00 -4.62 4.32 -0.69 -5.01 117.00 108.47 1j9t n LEU 314 Ca -0.43 0.02 0.00 0.00 -0.02 0.00 0.00 56.01 55.58 1j9t n LEU 314 Cb 1.02 -0.13 0.00 0.00 -1.62 0.00 0.00 43.42 42.69 1j9t n LEU 314 CO 0.30 0.04 0.00 0.61 -1.22 0.00 0.00 177.39 177.12 1j9t n GLY 315 N 1.39 0.77 2.44 -0.72 0.00 -0.79 -1.41 105.19 106.87 1j9t n GLY 315 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.93 6.98 -3.49 4.61 0.00 0.14 -4.27 120.51 123.56 1j9t n ALA 316 Ca 0.00 -3.77 -0.13 0.00 0.00 0.00 0.00 53.44 49.54 1j9t n ALA 316 Cb 0.00 -3.22 -0.14 0.00 0.00 0.00 0.00 19.45 16.09 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 1.34 -0.28 0.37 0.00 0.00 -1.24 -2.39 121.76 119.56 1j9t s ALA 317 Ca 0.61 0.57 0.04 0.00 0.00 0.00 0.00 51.96 53.18 1j9t s ALA 317 Cb 0.17 -0.37 -0.06 0.00 0.00 0.00 0.00 23.12 22.86 1j9t s ALA 317 CO -0.07 -0.12 0.06 0.00 0.00 0.00 0.00 175.76 175.62 1j9t s ALA 318 N 0.79 2.73 0.12 0.00 0.00 0.68 -4.51 121.76 121.57 1j9t s ALA 318 Ca -0.06 -1.85 0.05 0.00 0.00 0.00 0.00 51.96 50.10 1j9t s ALA 318 Cb -0.08 0.53 -0.04 0.00 0.00 0.00 0.00 23.12 23.54 1j9t s ALA 318 CO -0.04 -0.26 -0.12 -1.01 0.00 0.00 0.00 175.76 174.33 1j9t s HIS 319 N -3.14 1.29 -0.06 0.00 3.76 -0.64 -0.83 115.29 115.68 1j9t s HIS 319 Ca 0.32 -0.61 0.05 0.00 -0.15 0.00 0.00 55.06 54.66 1j9t s HIS 319 Cb 0.07 -0.68 -0.01 0.00 1.11 0.00 0.00 32.58 33.08 1j9t s HIS 319 CO 0.15 0.10 -0.21 -0.06 -0.85 0.00 0.00 174.74 173.87 1j9t s PHE 320 N -2.42 2.10 -0.25 1.40 0.08 0.14 -1.23 117.98 117.80 1j9t s PHE 320 Ca 0.09 -0.66 -0.07 0.00 0.12 0.00 0.00 56.93 56.41 1j9t s PHE 320 Cb -0.03 -1.40 -0.03 0.00 -0.57 0.00 0.00 43.02 40.99 1j9t s PHE 320 CO 0.02 -0.22 0.07 0.15 -0.10 0.00 0.00 175.22 175.13 1j9t s LYS 321 N 0.02 3.63 -0.13 0.44 1.02 0.70 -1.22 119.74 124.20 1j9t s LYS 321 Ca -0.06 -0.49 0.02 0.00 0.02 0.00 0.00 55.97 55.46 1j9t s LYS 321 Cb -0.13 -3.32 0.01 0.00 -0.52 0.00 0.00 37.83 33.86 1j9t s LYS 321 CO 0.04 -0.20 -0.20 0.08 -0.92 0.00 0.00 175.35 174.14 1j9t s VAL 322 N 1.61 1.93 0.39 3.17 1.01 -0.63 -1.77 120.40 126.11 1j9t s VAL 322 Ca 0.06 -0.90 -0.01 0.00 0.00 0.00 0.00 61.98 61.13 1j9t s VAL 322 Cb -0.15 -1.71 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 1j9t s VAL 322 CO 0.03 0.52 0.62 0.42 0.00 0.00 0.00 175.10 176.70 1j9t s THR 323 N 0.85 4.88 0.00 3.92 -4.23 -0.88 0.16 115.64 120.35 1j9t s THR 323 Ca -0.07 -0.31 0.00 0.00 -1.18 0.00 0.00 61.69 60.13 1j9t s THR 323 Cb -0.15 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 69.88 1j9t s THR 323 CO -0.02 -0.59 0.00 0.61 -0.54 0.00 0.00 174.62 174.08 1j9t n GLY 324 N -1.95 1.74 3.76 3.99 0.00 -1.26 -1.25 105.19 110.22 1j9t n GLY 324 Ca -0.03 -1.94 -0.39 0.00 0.00 0.00 0.00 46.02 43.66 1j9t n GLY 324 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1j9t s GLU 325 N -1.35 4.40 0.42 1.61 2.56 -1.26 -4.64 118.70 120.43 1j9t s GLU 325 Ca 0.00 0.89 -0.25 0.00 0.00 0.00 0.00 54.97 55.61 1j9t s GLU 325 Cb 0.00 -3.34 -0.08 0.00 2.00 0.00 0.00 34.13 32.71 1j9t s GLU 325 CO 0.00 0.36 1.20 -0.46 -0.56 0.00 0.00 175.26 175.80 1j9t s TRP 326 N -0.25 2.95 -0.37 5.30 -0.11 -1.26 -4.45 118.94 120.75 1j9t s TRP 326 Ca 0.34 1.52 -0.05 0.00 1.22 0.00 0.00 56.10 59.13 1j9t s TRP 326 Cb -0.19 -3.45 0.08 0.00 -1.50 0.00 0.00 33.47 28.40 1j9t s TRP 326 CO 0.20 -1.55 0.15 1.21 -4.62 0.00 0.00 176.95 172.35 1j9t s ASN 327 N -1.12 5.26 0.22 5.86 3.84 -1.26 -4.97 114.94 122.78 1j9t s ASN 327 Ca 0.59 -1.58 0.25 0.00 0.21 0.00 0.00 52.86 52.32 1j9t s ASN 327 Cb -0.32 -1.84 0.91 0.00 -0.55 0.00 0.00 41.25 39.45 1j9t s ASN 327 CO 0.40 -0.44 1.74 0.47 -2.79 0.00 0.00 177.10 176.48 1j9t n ASP 328 N 4.71 0.69 -0.03 -4.21 9.92 -1.25 -2.52 116.55 123.85 1j9t n ASP 328 Ca -0.08 0.62 -0.15 0.00 -0.53 0.00 0.00 54.79 54.65 1j9t n ASP 328 Cb 0.43 -0.78 -0.09 0.00 -0.64 0.00 0.00 41.12 40.03 1j9t n ASP 328 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 1j9t h ASP 329 N 0.00 0.43 -0.52 -2.24 -0.00 -2.01 -3.24 116.42 108.83 1j9t h ASP 329 Ca 0.00 -0.63 -0.12 0.00 -0.00 0.00 0.00 57.03 56.28 1j9t h ASP 329 Cb 0.52 -0.13 -0.02 0.00 -0.00 0.00 0.00 39.33 39.71 1j9t h ASP 329 CO 0.00 0.98 -0.13 -0.07 -0.00 0.00 0.00 179.24 180.02 1j9t h LEU 330 N -0.11 1.02 -7.00 2.28 3.38 -1.97 -3.45 115.31 109.46 1j9t h LEU 330 Ca -0.02 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 1j9t h LEU 330 Cb 0.96 -0.28 -0.21 0.00 0.09 0.00 0.00 40.66 41.22 1j9t h LEU 330 CO 0.07 1.15 0.12 -0.32 0.09 0.00 0.00 178.44 179.55 1j9t s MET 331 N -4.80 0.77 -0.04 1.13 0.00 -1.05 -5.15 119.30 110.17 1j9t s MET 331 Ca -0.12 1.04 -0.16 0.00 0.00 0.00 0.00 55.69 56.45 1j9t s MET 331 Cb 0.13 0.31 0.03 0.00 0.00 0.00 0.00 34.83 35.30 1j9t s MET 331 CO 0.86 -0.11 0.36 -0.08 0.00 0.00 0.00 175.02 176.05 1j9t s THR 332 N 0.76 0.04 -0.70 10.11 -1.32 -1.25 -3.96 115.64 119.32 1j9t s THR 332 Ca -0.03 -0.35 -0.22 0.00 -1.21 0.00 0.00 61.69 59.89 1j9t s THR 332 Cb -0.05 -0.64 0.08 0.00 -1.51 0.00 0.00 72.50 70.38 1j9t s THR 332 CO -0.06 -0.19 0.97 -0.55 -2.21 0.00 0.00 174.62 172.59 1j9t s SER 333 N -1.05 6.24 0.21 8.08 0.15 -1.26 -4.87 113.70 121.20 1j9t s SER 333 Ca -0.11 -1.18 -0.09 0.00 0.70 0.00 0.00 55.95 55.27 1j9t s SER 333 Cb -0.04 -2.41 0.17 0.00 -1.71 0.00 0.00 66.02 62.02 1j9t s SER 333 CO 0.04 -1.37 1.83 0.58 1.20 0.00 0.00 173.24 175.52 1j9t h VAL 334 N 5.96 1.24 -3.10 4.45 2.07 -2.01 -3.39 116.25 121.47 1j9t h VAL 334 Ca -0.22 -0.61 -0.47 0.00 0.82 0.00 0.00 66.70 66.22 1j9t h VAL 334 Cb 1.06 0.18 -0.41 0.00 -1.52 0.00 0.00 31.29 30.61 1j9t h VAL 334 CO 1.17 0.27 -0.75 -0.22 0.02 0.00 0.00 177.57 178.06 1j9t s LEU 335 N -9.91 0.47 0.74 2.57 2.96 -1.26 -5.14 118.68 109.10 1j9t s LEU 335 Ca -0.13 -0.61 -0.14 0.00 -0.22 0.00 0.00 54.13 53.03 1j9t s LEU 335 Cb 0.16 -0.29 0.04 0.00 0.50 0.00 0.00 46.19 46.60 1j9t s LEU 335 CO 0.81 -0.34 1.15 0.00 -1.32 0.00 0.00 176.35 176.66 1j9t s ALA 336 N 2.10 2.16 -0.22 5.97 0.00 -1.26 -4.84 121.76 125.66 1j9t s ALA 336 Ca 0.02 0.65 -0.41 0.00 0.00 0.00 0.00 51.96 52.21 1j9t s ALA 336 Cb -0.16 -3.39 -0.18 0.00 0.00 0.00 0.00 23.12 19.39 1j9t s ALA 336 CO -0.09 -1.79 1.51 -2.30 0.00 0.00 0.00 175.76 173.09 1j9t n PRO 337 N -2.95 0.63 -3.71 0.00 -0.02 -1.26 -4.93 135.00 122.76 1j9t n PRO 337 Ca 0.12 0.23 -0.08 0.00 -2.02 0.00 0.00 63.50 61.74 1j9t n PRO 337 Cb 0.51 -1.82 -0.02 0.00 -0.02 0.00 0.00 33.50 32.15 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 2.19 -0.36 0.00 2.55 1.04 -1.26 -5.29 113.70 112.57 1j9t s SER 338 Ca 0.96 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 57.00 1j9t s SER 338 Cb -1.20 0.67 0.00 0.00 0.10 0.00 0.00 66.02 65.59 1j9t s SER 338 CO 0.65 -1.19 0.00 0.61 0.98 0.00 0.00 173.24 174.29