#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oqj s VAL 3 N 0.00 2.87 -0.09 2.52 1.01 -1.26 -4.92 120.40 120.53 2oqj s VAL 3 Ca 0.00 -0.70 -0.20 0.00 0.00 0.00 0.00 61.98 61.08 2oqj s VAL 3 Cb 0.00 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 2oqj s VAL 3 CO 0.00 0.50 0.55 -0.04 0.00 0.00 0.00 175.10 176.11 2oqj s MET 4 N 0.79 4.35 -0.36 2.72 -1.94 -1.26 -2.14 119.30 121.46 2oqj s MET 4 Ca -0.05 0.59 0.00 0.00 -1.71 0.00 0.00 55.69 54.53 2oqj s MET 4 Cb -0.15 -3.42 0.10 0.00 2.01 0.00 0.00 34.83 33.36 2oqj s MET 4 CO 0.01 0.17 0.10 0.99 -0.01 0.00 0.00 175.02 176.28 2oqj s THR 5 N 0.53 2.79 0.24 2.05 2.01 0.12 -4.42 115.64 118.95 2oqj s THR 5 Ca 0.30 -2.08 -0.13 0.00 0.31 0.00 0.00 61.69 60.09 2oqj s THR 5 Cb -0.16 -2.91 -0.08 0.00 0.01 0.00 0.00 72.50 69.36 2oqj s THR 5 CO 0.13 -0.55 0.62 -1.58 -0.69 0.00 0.00 174.62 172.55 2oqj s GLN 6 N 1.05 3.94 -0.22 4.92 0.74 -1.26 -0.50 119.66 128.33 2oqj s GLN 6 Ca 0.07 0.49 -0.12 0.00 0.05 0.00 0.00 55.36 55.85 2oqj s GLN 6 Cb -0.21 -2.66 0.07 0.00 1.10 0.00 0.00 33.01 31.32 2oqj s GLN 6 CO -0.05 0.31 0.54 0.45 -0.55 0.00 0.00 175.29 175.98 2oqj s SER 7 N -2.14 -0.70 0.80 6.67 0.15 -0.73 -4.63 113.70 113.12 2oqj s SER 7 Ca 0.47 1.19 -0.04 0.00 0.70 0.00 0.00 55.95 58.27 2oqj s SER 7 Cb -0.12 1.14 0.08 0.00 -1.71 0.00 0.00 66.02 65.41 2oqj s SER 7 CO 0.20 -0.22 0.52 -0.81 1.20 0.00 0.00 173.24 174.13 2oqj n PRO 8 N 4.43 -0.19 0.08 5.44 -0.04 -1.26 -2.44 135.00 141.01 2oqj n PRO 8 Ca -0.20 -1.03 -0.18 0.00 -0.04 0.00 0.00 63.50 62.04 2oqj n PRO 8 Cb 0.56 -0.47 -0.10 0.00 -0.04 0.00 0.00 33.50 33.45 2oqj n PRO 8 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2oqj h SER 9 N -0.55 0.71 -3.42 3.54 0.02 -1.82 -3.41 113.55 108.62 2oqj h SER 9 Ca -0.17 -0.63 -0.45 0.00 -0.84 0.00 0.00 61.79 59.70 2oqj h SER 9 Cb 0.53 -0.22 -0.34 0.00 0.14 0.00 0.00 62.40 62.51 2oqj h SER 9 CO 0.14 1.44 -0.79 -0.89 -1.14 0.00 0.00 176.83 175.60 2oqj s THR 10 N -3.08 0.73 -0.17 -2.27 2.01 -1.26 -0.83 115.64 110.78 2oqj s THR 10 Ca -0.07 -0.23 0.00 0.00 0.31 0.00 0.00 61.69 61.70 2oqj s THR 10 Cb 0.07 -0.73 0.01 0.00 0.01 0.00 0.00 72.50 71.86 2oqj s THR 10 CO 0.90 0.27 -0.17 -0.22 -0.69 0.00 0.00 174.62 174.72 2oqj s LEU 11 N 0.93 2.31 -0.27 4.42 0.20 0.29 -4.96 118.68 121.60 2oqj s LEU 11 Ca -0.11 -0.57 -0.11 0.00 0.69 0.00 0.00 54.13 54.04 2oqj s LEU 11 Cb -0.15 -1.53 -0.05 0.00 -0.43 0.00 0.00 46.19 44.04 2oqj s LEU 11 CO 0.00 0.03 0.17 -0.44 -0.29 0.00 0.00 176.35 175.83 2oqj s SER 12 N 1.14 6.02 0.28 3.68 0.01 -1.26 -0.88 113.70 122.68 2oqj s SER 12 Ca 0.01 0.02 0.03 0.00 1.31 0.00 0.00 55.95 57.33 2oqj s SER 12 Cb -0.14 -2.11 -0.03 0.00 0.21 0.00 0.00 66.02 63.95 2oqj s SER 12 CO -0.07 -0.01 0.23 0.00 0.41 0.00 0.00 173.24 173.80 2oqj s ALA 13 N 1.51 1.51 0.31 1.44 0.00 -0.45 -4.79 121.76 121.29 2oqj s ALA 13 Ca 0.07 -1.89 0.10 0.00 0.00 0.00 0.00 51.96 50.24 2oqj s ALA 13 Cb -0.15 1.42 -0.05 0.00 0.00 0.00 0.00 23.12 24.34 2oqj s ALA 13 CO 0.09 -0.64 -0.05 -1.12 0.00 0.00 0.00 175.76 174.03 2oqj s SER 14 N -3.28 4.08 -0.01 0.00 0.01 -1.26 -0.28 113.70 112.96 2oqj s SER 14 Ca 0.39 -0.94 -0.30 0.00 1.31 0.00 0.00 55.95 56.41 2oqj s SER 14 Cb 0.04 -0.53 -0.07 0.00 0.21 0.00 0.00 66.02 65.67 2oqj s SER 14 CO 0.21 -0.11 1.81 -0.69 0.41 0.00 0.00 173.24 174.87 2oqj s VAL 15 N -2.48 3.29 0.00 3.43 1.01 -1.26 -2.20 120.40 122.19 2oqj s VAL 15 Ca 0.33 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.67 2oqj s VAL 15 Cb -0.02 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.12 2oqj s VAL 15 CO 0.18 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.86 2oqj n GLY 16 N 4.33 0.55 3.75 4.51 0.00 0.18 -4.88 105.19 113.64 2oqj n GLY 16 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2oqj n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2oqj s ASP 17 N -1.90 5.17 -0.34 1.61 1.01 -0.94 -4.01 116.67 117.28 2oqj s ASP 17 Ca 0.00 2.33 -0.12 0.00 0.71 0.00 0.00 52.55 55.47 2oqj s ASP 17 Cb 0.00 -2.59 -0.01 0.00 1.01 0.00 0.00 42.92 41.33 2oqj s ASP 17 CO 0.00 -1.60 0.22 0.28 0.21 0.00 0.00 175.17 174.28 2oqj s THR 18 N -1.70 5.06 0.23 -1.27 -1.32 -1.26 -0.88 115.64 114.49 2oqj s THR 18 Ca 0.76 -0.34 0.11 0.00 -1.21 0.00 0.00 61.69 61.01 2oqj s THR 18 Cb -0.29 -3.62 -0.05 0.00 -1.51 0.00 0.00 72.50 67.04 2oqj s THR 18 CO 0.34 -0.02 -0.22 0.27 -2.21 0.00 0.00 174.62 172.78 2oqj s ILE 19 N 1.68 2.37 -0.03 5.08 -4.36 -0.80 -4.97 121.20 120.18 2oqj s ILE 19 Ca 0.05 -2.20 0.01 0.00 -0.26 0.00 0.00 60.65 58.25 2oqj s ILE 19 Cb -0.18 -2.19 0.02 0.00 1.25 0.00 0.00 42.46 41.36 2oqj s ILE 19 CO 0.09 -0.27 -0.05 0.42 0.24 0.00 0.00 174.94 175.38 2oqj s THR 20 N -2.10 0.48 -0.09 8.37 -4.23 -1.26 -1.76 115.64 115.05 2oqj s THR 20 Ca 0.25 -0.14 -0.00 0.00 -1.18 0.00 0.00 61.69 60.61 2oqj s THR 20 Cb -0.06 -0.49 -0.03 0.00 1.34 0.00 0.00 72.50 73.26 2oqj s THR 20 CO 0.12 0.19 -0.06 -0.63 -0.54 0.00 0.00 174.62 173.70 2oqj s ILE 21 N 0.61 3.72 -0.09 2.99 1.01 0.11 -4.90 121.20 124.65 2oqj s ILE 21 Ca -0.08 -0.46 0.01 0.00 0.00 0.00 0.00 60.65 60.12 2oqj s ILE 21 Cb -0.11 -2.55 -0.02 0.00 0.01 0.00 0.00 42.46 39.79 2oqj s ILE 21 CO -0.00 0.57 -0.10 0.42 0.00 0.00 0.00 174.94 175.83 2oqj s THR 22 N -0.47 3.34 -0.12 2.92 -4.23 -1.02 0.50 115.64 116.55 2oqj s THR 22 Ca 0.07 -0.59 -0.01 0.00 -1.18 0.00 0.00 61.69 59.98 2oqj s THR 22 Cb -0.12 -2.38 -0.02 0.00 1.34 0.00 0.00 72.50 71.32 2oqj s THR 22 CO 0.02 0.56 -0.08 0.00 -0.54 0.00 0.00 174.62 174.58 2oqj s ARG 24 N 0.05 3.46 -0.03 0.00 6.06 0.34 -1.38 118.95 127.45 2oqj s ARG 24 Ca -0.02 -0.60 -0.03 0.00 -2.50 0.00 0.00 55.73 52.58 2oqj s ARG 24 Cb -0.14 -2.75 -0.04 0.00 0.06 0.00 0.00 34.95 32.08 2oqj s ARG 24 CO 0.03 0.27 0.15 0.00 -2.50 0.00 0.00 175.30 173.25 2oqj s ALA 25 N 0.25 3.86 -0.28 6.12 0.00 0.95 0.10 121.76 132.77 2oqj s ALA 25 Ca -0.06 -0.76 0.28 0.00 0.00 0.00 0.00 51.96 51.42 2oqj s ALA 25 Cb -0.15 -1.84 0.90 0.00 0.00 0.00 0.00 23.12 22.04 2oqj s ALA 25 CO 0.04 0.71 1.79 0.66 0.00 0.00 0.00 175.76 178.96 2oqj h SER 26 N 4.13 0.00 -5.09 0.00 4.64 -1.76 -3.46 113.55 112.01 2oqj h SER 26 Ca -0.50 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.81 2oqj h SER 26 Cb 1.20 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.20 2oqj h SER 26 CO 0.65 0.00 0.05 0.00 -0.87 0.00 0.00 176.83 176.66 2oqj s GLN 27 N -3.39 1.50 0.28 4.77 -2.07 -1.26 -4.98 119.66 114.51 2oqj s GLN 27 Ca 0.05 -0.95 -0.30 0.00 -1.82 0.00 0.00 55.36 52.33 2oqj s GLN 27 Cb 0.08 0.53 -0.12 0.00 -1.09 0.00 0.00 33.01 32.42 2oqj s GLN 27 CO 0.57 -0.65 1.62 0.45 -1.32 0.00 0.00 175.29 175.96 2oqj n SER 28 N -0.38 3.88 0.00 12.60 2.88 -1.26 -4.67 113.62 126.68 2oqj n SER 28 Ca -0.07 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.60 2oqj n SER 28 Cb 0.62 -1.59 0.00 0.00 -0.75 0.00 0.00 64.21 62.49 2oqj n SER 28 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2oqj n ILE 29 N 2.52 0.00 0.00 2.46 5.41 -0.25 -5.00 119.36 124.50 2oqj n ILE 29 Ca 0.10 -0.47 0.00 0.00 1.00 0.00 0.00 62.75 63.38 2oqj n ILE 29 Cb 0.36 1.04 0.00 0.00 -0.71 0.00 0.00 39.64 40.33 2oqj n ILE 29 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 2oqj n GLU 30 N -0.26 0.00 -0.18 0.38 4.07 -1.26 -2.60 120.64 120.79 2oqj n GLU 30 Ca 0.00 0.00 0.04 0.00 -0.06 0.00 0.00 57.16 57.14 2oqj n GLU 30 Cb 0.01 0.00 0.06 0.00 -0.06 0.00 0.00 31.44 31.45 2oqj n GLU 30 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 2oqj n THR 31 N 0.00 0.99 -1.42 6.31 -2.24 -1.26 -1.70 114.28 114.96 2oqj n THR 31 Ca 0.00 -1.15 -0.40 0.00 -2.27 0.00 0.00 64.05 60.23 2oqj n THR 31 Cb 0.00 0.23 -0.02 0.00 -2.10 0.00 0.00 70.33 68.44 2oqj n THR 31 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 2oqj n TRP 32 N -0.71 2.59 -4.55 4.78 7.02 -1.07 -1.83 117.44 123.67 2oqj n TRP 32 Ca 0.07 -3.06 -0.25 0.00 -1.02 0.00 0.00 57.50 53.23 2oqj n TRP 32 Cb 0.58 -2.47 -0.14 0.00 -2.42 0.00 0.00 31.31 26.86 2oqj n TRP 32 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 2oqj s LEU 33 N 0.33 2.21 0.06 -0.99 2.96 -1.26 -2.77 118.68 119.22 2oqj s LEU 33 Ca 0.66 -0.57 0.05 0.00 -0.22 0.00 0.00 54.13 54.04 2oqj s LEU 33 Cb 0.17 -0.96 -0.03 0.00 0.50 0.00 0.00 46.19 45.87 2oqj s LEU 33 CO -0.07 0.14 -0.14 0.00 -1.32 0.00 0.00 176.35 174.96 2oqj s ALA 34 N -0.90 1.18 -0.07 5.97 0.00 -0.23 -1.47 121.76 126.23 2oqj s ALA 34 Ca 0.07 -0.95 0.04 0.00 0.00 0.00 0.00 51.96 51.12 2oqj s ALA 34 Cb -0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 2oqj s ALA 34 CO 0.03 0.18 -0.19 -1.58 0.00 0.00 0.00 175.76 174.20 2oqj s TRP 35 N -1.15 2.61 0.05 0.00 0.52 0.16 -1.51 118.94 119.62 2oqj s TRP 35 Ca -0.01 -0.53 0.07 0.00 0.02 0.00 0.00 56.10 55.65 2oqj s TRP 35 Cb -0.09 -1.67 -0.03 0.00 -1.15 0.00 0.00 33.47 30.53 2oqj s TRP 35 CO 0.02 -0.09 -0.21 0.71 0.02 0.00 0.00 176.95 177.40 2oqj s TYR 36 N -0.21 1.81 -0.00 -1.98 1.51 -0.00 -0.78 117.35 117.70 2oqj s TYR 36 Ca -0.01 -0.38 -0.00 0.00 -1.01 0.00 0.00 57.07 55.67 2oqj s TYR 36 Cb -0.13 -1.07 -0.04 0.00 -0.11 0.00 0.00 41.96 40.61 2oqj s TYR 36 CO 0.03 0.10 0.07 -1.14 -1.11 0.00 0.00 175.55 173.50 2oqj s GLN 37 N -1.25 3.03 -0.09 -0.62 0.74 0.08 -0.80 119.66 120.75 2oqj s GLN 37 Ca 0.07 -0.50 -0.04 0.00 0.05 0.00 0.00 55.36 54.94 2oqj s GLN 37 Cb -0.09 -2.83 0.05 0.00 1.10 0.00 0.00 33.01 31.23 2oqj s GLN 37 CO 0.02 0.64 0.19 -1.14 -0.55 0.00 0.00 175.29 174.46 2oqj s GLN 38 N -1.71 0.11 0.10 1.67 0.74 0.38 0.26 119.66 121.21 2oqj s GLN 38 Ca 0.22 0.53 -0.07 0.00 0.05 0.00 0.00 55.36 56.10 2oqj s GLN 38 Cb -0.12 -0.17 -0.06 0.00 1.10 0.00 0.00 33.01 33.77 2oqj s GLN 38 CO 0.13 -0.23 0.37 0.15 -0.55 0.00 0.00 175.29 175.16 2oqj s LYS 39 N 1.74 3.66 -0.08 1.67 -0.14 -1.26 -1.26 119.74 124.07 2oqj s LYS 39 Ca -0.04 0.00 -0.38 0.00 -1.36 0.00 0.00 55.97 54.20 2oqj s LYS 39 Cb -0.12 -2.93 -0.15 0.00 -1.68 0.00 0.00 37.83 32.95 2oqj s LYS 39 CO -0.07 0.53 1.59 -2.30 -0.76 0.00 0.00 175.35 174.34 2oqj n PRO 40 N 0.52 1.38 -1.95 -1.68 -0.02 -1.26 -1.54 135.00 130.44 2oqj n PRO 40 Ca -0.06 0.50 -0.09 0.00 -2.02 0.00 0.00 63.50 61.84 2oqj n PRO 40 Cb 0.52 -2.20 -0.01 0.00 -0.02 0.00 0.00 33.50 31.79 2oqj n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oqj n GLY 41 N 3.52 0.25 3.31 -1.23 0.00 -1.26 -5.03 105.19 104.75 2oqj n GLY 41 Ca 0.22 -0.55 -0.16 0.00 0.00 0.00 0.00 46.02 45.53 2oqj n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oqj s LYS 42 N -4.04 1.29 0.31 1.61 -0.14 -0.59 -5.14 119.74 113.03 2oqj s LYS 42 Ca 0.00 -1.65 -0.28 0.00 -1.36 0.00 0.00 55.97 52.68 2oqj s LYS 42 Cb 0.00 -0.49 -0.09 0.00 -1.68 0.00 0.00 37.83 35.57 2oqj s LYS 42 CO 0.00 -0.13 1.07 0.00 -0.76 0.00 0.00 175.35 175.53 2oqj s ALA 43 N -3.52 3.31 0.27 5.17 0.00 -1.26 -4.71 121.76 121.02 2oqj s ALA 43 Ca 0.28 0.81 -0.30 0.00 0.00 0.00 0.00 51.96 52.75 2oqj s ALA 43 Cb 0.06 -3.30 -0.11 0.00 0.00 0.00 0.00 23.12 19.77 2oqj s ALA 43 CO 0.08 -0.14 1.60 -2.14 0.00 0.00 0.00 175.76 175.16 2oqj s PRO 44 N -1.73 4.14 -0.16 0.00 0.02 -1.26 -4.71 135.00 131.29 2oqj s PRO 44 Ca 0.48 2.54 -0.07 0.00 0.02 0.00 0.00 61.00 63.97 2oqj s PRO 44 Cb -0.28 -3.05 -0.04 0.00 0.02 0.00 0.00 34.50 31.15 2oqj s PRO 44 CO 0.36 -0.63 0.08 0.15 -0.33 0.00 0.00 177.00 176.63 2oqj s LYS 45 N -0.10 3.82 0.04 5.54 -0.14 0.14 -4.93 119.74 124.11 2oqj s LYS 45 Ca 0.65 -0.28 -0.30 0.00 -1.36 0.00 0.00 55.97 54.67 2oqj s LYS 45 Cb -0.47 -3.21 -0.05 0.00 -1.68 0.00 0.00 37.83 32.42 2oqj s LYS 45 CO 0.44 0.42 1.20 -1.17 -0.76 0.00 0.00 175.35 175.48 2oqj s LEU 46 N -0.02 4.35 -0.04 3.17 2.96 -1.26 -0.74 118.68 127.10 2oqj s LEU 46 Ca 0.07 1.97 -0.08 0.00 -0.22 0.00 0.00 54.13 55.88 2oqj s LEU 46 Cb -0.12 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 42.97 2oqj s LEU 46 CO 0.01 -0.50 -0.15 0.18 -1.32 0.00 0.00 176.35 174.57 2oqj n LEU 47 N 4.22 1.24 -4.02 -0.68 4.77 0.04 -4.85 117.00 117.72 2oqj n LEU 47 Ca 0.09 0.19 -0.19 0.00 -0.03 0.00 0.00 56.01 56.08 2oqj n LEU 47 Cb 0.46 -0.49 -0.15 0.00 -2.33 0.00 0.00 43.42 40.91 2oqj n LEU 47 CO 0.55 -0.50 -0.43 -0.63 -1.33 0.00 0.00 177.39 175.05 2oqj s ILE 48 N -2.18 0.70 0.22 -0.08 1.01 -1.11 -1.28 121.20 118.48 2oqj s ILE 48 Ca -0.12 -0.37 -0.00 0.00 0.00 0.00 0.00 60.65 60.15 2oqj s ILE 48 Cb 0.02 -0.59 -0.04 0.00 0.01 0.00 0.00 42.46 41.85 2oqj s ILE 48 CO 0.18 0.20 0.11 -0.72 0.00 0.00 0.00 174.94 174.71 2oqj s TYR 49 N -0.17 1.28 -1.53 3.97 1.13 -0.02 0.35 117.35 122.37 2oqj s TYR 49 Ca 0.03 -1.29 -0.14 0.00 -1.41 0.00 0.00 57.07 54.26 2oqj s TYR 49 Cb -0.04 -0.68 0.09 0.00 -1.10 0.00 0.00 41.96 40.23 2oqj s TYR 49 CO -0.00 -0.51 0.87 1.17 -2.51 0.00 0.00 175.55 174.57 2oqj n LYS 50 N -0.33 -4.84 0.00 -3.49 3.00 -0.79 -0.34 118.16 111.36 2oqj n LYS 50 Ca 0.01 0.56 0.00 0.00 -0.00 0.00 0.00 58.31 58.88 2oqj n LYS 50 Cb 0.66 -5.40 0.00 0.00 0.00 0.00 0.00 35.03 30.28 2oqj n LYS 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2oqj n ALA 51 N -4.43 0.00 -0.73 3.14 0.00 -0.54 -4.09 120.51 113.87 2oqj n ALA 51 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2oqj n ALA 51 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 2oqj n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2oqj n SER 52 N 1.02 0.08 -4.67 0.00 3.41 -1.11 -3.15 113.62 109.20 2oqj n SER 52 Ca 0.00 -0.82 -0.42 0.00 -0.26 0.00 0.00 58.87 57.37 2oqj n SER 52 Cb 0.00 0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 63.94 2oqj n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2oqj s THR 53 N -0.02 4.79 -0.17 6.66 2.01 0.54 -4.60 115.64 124.85 2oqj s THR 53 Ca 0.00 1.83 -0.26 0.00 0.31 0.00 0.00 61.69 63.57 2oqj s THR 53 Cb 0.00 -4.23 -0.01 0.00 0.01 0.00 0.00 72.50 68.27 2oqj s THR 53 CO 0.00 -0.05 0.88 -0.22 -0.69 0.00 0.00 174.62 174.53 2oqj s LEU 54 N 2.53 4.17 0.22 4.42 2.96 -1.26 -0.85 118.68 130.87 2oqj s LEU 54 Ca 0.42 1.23 -0.31 0.00 -0.22 0.00 0.00 54.13 55.25 2oqj s LEU 54 Cb -0.16 -3.30 -0.11 0.00 0.50 0.00 0.00 46.19 43.12 2oqj s LEU 54 CO 0.11 -0.44 1.58 -0.75 -1.32 0.00 0.00 176.35 175.53 2oqj s LYS 55 N 2.30 4.18 0.38 1.98 2.20 -0.40 -4.93 119.74 125.45 2oqj s LYS 55 Ca 0.40 2.45 -0.28 0.00 -0.36 0.00 0.00 55.97 58.18 2oqj s LYS 55 Cb -0.16 -3.10 -0.11 0.00 -1.51 0.00 0.00 37.83 32.95 2oqj s LYS 55 CO 0.12 -0.61 1.47 0.95 -0.36 0.00 0.00 175.35 176.92 2oqj s THR 56 N 0.67 2.09 0.00 3.43 -4.23 -1.26 -1.98 115.64 114.37 2oqj s THR 56 Ca 0.67 0.09 0.00 0.00 -1.18 0.00 0.00 61.69 61.28 2oqj s THR 56 Cb -0.46 -3.06 0.00 0.00 1.34 0.00 0.00 72.50 70.33 2oqj s THR 56 CO 0.37 0.02 0.00 0.61 -0.54 0.00 0.00 174.62 175.09 2oqj n GLY 57 N 0.49 2.99 3.71 3.99 0.00 -1.26 -5.04 105.19 110.06 2oqj n GLY 57 Ca 0.01 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 2oqj n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oqj s VAL 58 N -2.45 3.32 0.43 1.61 1.01 -0.84 -4.97 120.40 118.51 2oqj s VAL 58 Ca 0.00 0.91 -0.25 0.00 0.00 0.00 0.00 61.98 62.65 2oqj s VAL 58 Cb 0.00 -3.59 -0.10 0.00 0.00 0.00 0.00 36.38 32.70 2oqj s VAL 58 CO 0.00 0.06 1.18 -2.65 0.00 0.00 0.00 175.10 173.69 2oqj n PRO 59 N 4.21 1.69 0.00 2.72 -0.02 -1.26 -4.88 135.00 137.46 2oqj n PRO 59 Ca 0.12 0.61 0.13 0.00 -2.02 0.00 0.00 63.50 62.34 2oqj n PRO 59 Cb 0.42 -2.28 0.76 0.00 -0.02 0.00 0.00 33.50 32.38 2oqj n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2oqj n SER 60 N 0.20 0.00 0.07 2.55 3.41 -1.26 -2.74 113.62 115.85 2oqj n SER 60 Ca 0.08 -0.77 0.12 0.00 -0.26 0.00 0.00 58.87 58.04 2oqj n SER 60 Cb 0.40 -0.02 0.46 0.00 -0.26 0.00 0.00 64.21 64.79 2oqj n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2oqj n ARG 61 N -1.02 0.15 -3.23 4.33 1.85 -1.26 -4.69 116.66 112.80 2oqj n ARG 61 Ca 0.19 0.23 -0.38 0.00 -1.00 0.00 0.00 57.85 56.89 2oqj n ARG 61 Cb 0.09 -1.71 -0.06 0.00 -1.05 0.00 0.00 32.46 29.73 2oqj n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2oqj s PHE 62 N -3.12 3.78 -0.06 2.89 0.08 -1.11 -0.66 117.98 119.78 2oqj s PHE 62 Ca 0.09 1.30 -0.26 0.00 0.12 0.00 0.00 56.93 58.18 2oqj s PHE 62 Cb 0.13 -2.52 0.06 0.00 -0.57 0.00 0.00 43.02 40.11 2oqj s PHE 62 CO 0.48 0.53 0.58 -1.54 -0.10 0.00 0.00 175.22 175.17 2oqj s SER 63 N -1.26 -0.54 0.18 1.36 1.04 -0.53 -5.01 113.70 108.95 2oqj s SER 63 Ca 0.32 0.60 0.08 0.00 0.48 0.00 0.00 55.95 57.44 2oqj s SER 63 Cb -0.19 0.55 -0.04 0.00 0.10 0.00 0.00 66.02 66.43 2oqj s SER 63 CO 0.20 -0.53 -0.16 -0.83 0.98 0.00 0.00 173.24 172.90 2oqj s GLY 64 N -1.09 1.38 0.02 7.32 0.00 -1.26 -0.42 107.32 113.27 2oqj s GLY 64 Ca -0.11 -1.55 -0.26 0.00 0.00 0.00 0.00 44.72 42.80 2oqj s GLY 64 CO 0.08 -1.62 0.60 -1.35 0.00 0.00 0.00 173.10 170.80 2oqj s SER 65 N -2.95 -0.55 0.00 1.64 1.04 -0.33 -4.29 113.70 108.25 2oqj s SER 65 Ca 0.18 0.39 0.00 0.00 0.48 0.00 0.00 55.95 57.00 2oqj s SER 65 Cb -0.03 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.61 2oqj s SER 65 CO 0.06 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.19 2oqj n GLY 66 N 0.53 2.75 3.58 7.32 0.00 -1.26 -0.54 105.19 117.57 2oqj n GLY 66 Ca -0.19 -1.68 -0.10 0.00 0.00 0.00 0.00 46.02 44.05 2oqj n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2oqj s SER 67 N 0.00 -0.37 0.36 1.61 1.04 -1.13 -4.86 113.70 110.35 2oqj s SER 67 Ca 0.00 0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.87 2oqj s SER 67 Cb 0.00 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.46 2oqj s SER 67 CO 0.00 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.51 2oqj n GLY 68 N 0.85 1.82 0.02 7.32 0.00 -0.69 -3.85 105.19 110.66 2oqj n GLY 68 Ca -0.10 -0.25 0.01 0.00 0.00 0.00 0.00 46.02 45.68 2oqj n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2oqj n THR 69 N 0.00 0.22 -4.44 2.61 -2.24 -1.26 -1.09 114.28 108.08 2oqj n THR 69 Ca 0.00 -0.25 -0.34 0.00 -2.27 0.00 0.00 64.05 61.19 2oqj n THR 69 Cb 0.00 -0.14 -0.12 0.00 -2.10 0.00 0.00 70.33 67.96 2oqj n THR 69 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2oqj s GLU 70 N -2.42 3.62 0.04 -0.78 2.12 -1.25 -0.04 118.70 119.99 2oqj s GLU 70 Ca -0.03 -0.55 0.03 0.00 0.36 0.00 0.00 54.97 54.78 2oqj s GLU 70 Cb 0.04 -2.88 -0.02 0.00 0.26 0.00 0.00 34.13 31.53 2oqj s GLU 70 CO 0.34 0.22 -0.09 -0.06 -0.54 0.00 0.00 175.26 175.13 2oqj s PHE 71 N 0.40 0.78 -0.03 5.30 0.40 -0.48 -2.83 117.98 121.52 2oqj s PHE 71 Ca -0.05 -0.45 -0.01 0.00 -0.60 0.00 0.00 56.93 55.82 2oqj s PHE 71 Cb -0.14 -0.46 0.02 0.00 0.51 0.00 0.00 43.02 42.95 2oqj s PHE 71 CO 0.03 -0.05 0.06 -0.08 0.70 0.00 0.00 175.22 175.88 2oqj s THR 72 N -1.23 -0.04 -0.12 0.64 -1.32 0.30 -0.28 115.64 113.59 2oqj s THR 72 Ca -0.07 0.14 -0.04 0.00 -1.21 0.00 0.00 61.69 60.52 2oqj s THR 72 Cb -0.09 -0.11 -0.03 0.00 -1.51 0.00 0.00 72.50 70.76 2oqj s THR 72 CO 0.01 0.06 0.02 -0.22 -2.21 0.00 0.00 174.62 172.27 2oqj s LEU 73 N 0.77 3.64 -0.06 9.08 2.96 0.18 -1.19 118.68 134.06 2oqj s LEU 73 Ca -0.06 0.12 0.01 0.00 -0.22 0.00 0.00 54.13 53.97 2oqj s LEU 73 Cb -0.09 -1.86 0.02 0.00 0.50 0.00 0.00 46.19 44.76 2oqj s LEU 73 CO -0.03 0.31 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.37 2oqj s THR 74 N -0.49 0.72 -0.28 3.68 2.01 0.44 -0.71 115.64 121.01 2oqj s THR 74 Ca 0.09 -0.19 -0.06 0.00 0.31 0.00 0.00 61.69 61.84 2oqj s THR 74 Cb -0.12 -0.74 0.01 0.00 0.01 0.00 0.00 72.50 71.66 2oqj s THR 74 CO 0.02 0.28 0.06 -0.63 -0.69 0.00 0.00 174.62 173.66 2oqj s ILE 75 N 1.15 3.81 -0.89 1.82 1.01 -0.72 -1.45 121.20 125.93 2oqj s ILE 75 Ca -0.07 -0.71 -0.15 0.00 0.00 0.00 0.00 60.65 59.72 2oqj s ILE 75 Cb -0.14 -2.94 0.20 0.00 0.01 0.00 0.00 42.46 39.58 2oqj s ILE 75 CO -0.01 0.12 0.91 -0.44 0.00 0.00 0.00 174.94 175.52 2oqj s SER 76 N 1.48 6.77 0.00 3.58 0.01 0.17 -1.90 113.70 123.81 2oqj s SER 76 Ca 0.03 -2.57 0.00 0.00 1.31 0.00 0.00 55.95 54.71 2oqj s SER 76 Cb -0.17 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 63.79 2oqj s SER 76 CO 0.01 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 173.57 2oqj n GLY 77 N 4.34 0.10 3.75 3.44 0.00 -0.95 -4.86 105.19 111.01 2oqj n GLY 77 Ca 0.18 -0.55 -0.41 0.00 0.00 0.00 0.00 46.02 45.24 2oqj n GLY 77 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oqj s LEU 78 N -0.18 4.35 0.28 0.99 1.43 -0.06 -4.66 118.68 120.83 2oqj s LEU 78 Ca 0.00 2.91 0.08 0.00 -1.03 0.00 0.00 54.13 56.09 2oqj s LEU 78 Cb 0.00 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 2oqj s LEU 78 CO 0.00 -0.89 0.12 -1.10 0.23 0.00 0.00 176.35 174.71 2oqj s GLN 79 N -0.46 2.56 0.40 1.70 -0.21 -1.26 0.51 119.66 122.90 2oqj s GLN 79 Ca 0.63 -1.31 0.17 0.00 0.02 0.00 0.00 55.36 54.87 2oqj s GLN 79 Cb -0.47 -2.33 1.06 0.00 1.00 0.00 0.00 33.01 32.28 2oqj s GLN 79 CO 0.47 0.31 1.83 0.74 -2.12 0.00 0.00 175.29 176.51 2oqj h PHE 80 N 1.64 0.61 0.00 0.91 0.04 -1.99 0.40 116.94 118.55 2oqj h PHE 80 Ca -0.46 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.33 2oqj h PHE 80 Cb 1.25 -0.18 -0.00 0.00 2.20 0.00 0.00 35.95 39.21 2oqj h PHE 80 CO 0.62 0.13 -0.03 0.22 -0.60 0.00 0.00 178.31 178.65 2oqj h ASP 81 N 0.43 0.00 0.55 2.17 3.58 -2.02 -3.05 116.42 118.08 2oqj h ASP 81 Ca 0.51 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.96 2oqj h ASP 81 Cb 1.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.30 2oqj h ASP 81 CO -0.22 0.03 -0.23 0.47 -2.88 0.00 0.00 179.24 176.40 2oqj n ASP 82 N -3.48 0.42 -4.58 2.28 8.00 0.13 -4.76 116.55 114.57 2oqj n ASP 82 Ca -0.02 -0.23 -0.42 0.00 0.71 0.00 0.00 54.79 54.83 2oqj n ASP 82 Cb 0.13 -0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 2oqj n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2oqj s PHE 83 N -2.79 2.30 0.00 1.24 0.08 -1.16 -4.87 117.98 112.79 2oqj s PHE 83 Ca 0.19 0.49 0.00 0.00 0.12 0.00 0.00 56.93 57.72 2oqj s PHE 83 Cb 0.19 -4.39 0.00 0.00 -0.57 0.00 0.00 43.02 38.25 2oqj s PHE 83 CO 0.57 -1.96 0.00 0.00 -0.10 0.00 0.00 175.22 173.73 2oqj n ALA 84 N 9.48 0.00 -2.74 5.36 0.00 -1.19 -4.98 120.51 126.45 2oqj n ALA 84 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.23 2oqj n ALA 84 Cb 0.49 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.86 2oqj n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2oqj s THR 85 N -2.76 4.55 -0.12 0.00 2.01 -0.39 -0.35 115.64 118.58 2oqj s THR 85 Ca 0.00 -0.31 0.03 0.00 0.31 0.00 0.00 61.69 61.72 2oqj s THR 85 Cb 0.00 -3.00 0.00 0.00 0.01 0.00 0.00 72.50 69.52 2oqj s THR 85 CO 0.00 0.48 -0.23 -0.31 -0.69 0.00 0.00 174.62 173.88 2oqj s TYR 86 N -1.04 2.62 -0.13 4.92 2.02 0.32 -0.47 117.35 125.59 2oqj s TYR 86 Ca 0.18 -1.20 0.00 0.00 -0.37 0.00 0.00 57.07 55.68 2oqj s TYR 86 Cb -0.12 -1.77 -0.01 0.00 -0.40 0.00 0.00 41.96 39.66 2oqj s TYR 86 CO 0.08 -0.52 -0.14 -1.01 -1.57 0.00 0.00 175.55 172.38 2oqj s HIS 87 N 0.59 2.78 0.36 2.71 3.76 0.02 -0.85 115.29 124.65 2oqj s HIS 87 Ca -0.13 -0.77 -0.03 0.00 -0.15 0.00 0.00 55.06 53.98 2oqj s HIS 87 Cb -0.17 -1.84 -0.04 0.00 1.11 0.00 0.00 32.58 31.64 2oqj s HIS 87 CO 0.03 -0.29 0.60 0.00 -0.85 0.00 0.00 174.74 174.23 2oqj s GLN 89 N -4.13 0.47 -0.18 0.00 0.74 -0.57 -2.15 119.66 113.84 2oqj s GLN 89 Ca 0.43 0.81 -0.10 0.00 0.05 0.00 0.00 55.36 56.55 2oqj s GLN 89 Cb -0.10 0.07 -0.05 0.00 1.10 0.00 0.00 33.01 34.03 2oqj s GLN 89 CO 0.36 -0.13 0.14 -1.58 -0.55 0.00 0.00 175.29 173.52 2oqj s HIS 90 N 1.13 3.45 -0.06 1.67 5.65 -0.36 -1.07 115.29 125.70 2oqj s HIS 90 Ca -0.07 0.38 0.02 0.00 0.25 0.00 0.00 55.06 55.64 2oqj s HIS 90 Cb -0.07 -2.13 0.01 0.00 -1.18 0.00 0.00 32.58 29.22 2oqj s HIS 90 CO -0.10 0.37 -0.10 1.52 -0.65 0.00 0.00 174.74 175.77 2oqj s TYR 91 N 0.12 1.24 -0.20 3.88 1.13 -1.11 -1.14 117.35 121.27 2oqj s TYR 91 Ca 0.10 -0.42 -0.27 0.00 -1.41 0.00 0.00 57.07 55.06 2oqj s TYR 91 Cb -0.11 -0.93 0.09 0.00 -1.10 0.00 0.00 41.96 39.91 2oqj s TYR 91 CO -0.01 -0.23 0.84 0.00 -2.51 0.00 0.00 175.55 173.63 2oqj s ALA 92 N 0.66 -1.85 0.00 9.51 0.00 -1.12 -4.84 121.76 124.12 2oqj s ALA 92 Ca -0.13 1.76 0.00 0.00 0.00 0.00 0.00 51.96 53.59 2oqj s ALA 92 Cb -0.15 -0.90 0.00 0.00 0.00 0.00 0.00 23.12 22.07 2oqj s ALA 92 CO 0.03 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 175.88 2oqj n GLY 93 N 1.84 4.08 0.09 0.00 0.00 -1.26 -2.30 105.19 107.65 2oqj n GLY 93 Ca -0.14 0.06 0.06 0.00 0.00 0.00 0.00 46.02 45.99 2oqj n GLY 93 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2oqj n TYR 94 N 13.93 0.00 -2.89 1.61 4.01 -1.26 -5.02 117.16 127.54 2oqj n TYR 94 Ca 0.00 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.51 2oqj n TYR 94 Cb 0.00 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.04 2oqj n TYR 94 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2oqj s SER 95 N -1.90 5.77 0.03 7.72 0.01 -0.97 -5.13 113.70 119.23 2oqj s SER 95 Ca 0.06 0.32 -0.09 0.00 1.31 0.00 0.00 55.95 57.55 2oqj s SER 95 Cb 0.09 -1.52 0.00 0.00 0.21 0.00 0.00 66.02 64.81 2oqj s SER 95 CO 0.41 -0.77 0.19 0.00 0.41 0.00 0.00 173.24 173.49 2oqj s ALA 96 N -2.62 -0.38 0.04 1.44 0.00 -1.26 -2.78 121.76 116.20 2oqj s ALA 96 Ca 0.49 -0.20 0.01 0.00 0.00 0.00 0.00 51.96 52.27 2oqj s ALA 96 Cb -0.10 0.22 -0.03 0.00 0.00 0.00 0.00 23.12 23.21 2oqj s ALA 96 CO 0.39 -0.31 -0.06 -0.08 0.00 0.00 0.00 175.76 175.69 2oqj s THR 97 N -2.17 0.43 0.13 0.00 -1.32 -0.29 -5.00 115.64 107.43 2oqj s THR 97 Ca -0.08 -1.17 0.07 0.00 -1.21 0.00 0.00 61.69 59.30 2oqj s THR 97 Cb -0.03 -0.69 -0.04 0.00 -1.51 0.00 0.00 72.50 70.23 2oqj s THR 97 CO -0.02 -0.50 -0.17 -0.36 -2.21 0.00 0.00 174.62 171.37 2oqj s PHE 98 N -1.78 1.63 0.88 9.09 0.40 -1.26 -1.23 117.98 125.70 2oqj s PHE 98 Ca -0.08 -0.49 -0.13 0.00 -0.60 0.00 0.00 56.93 55.63 2oqj s PHE 98 Cb -0.07 -0.84 0.15 0.00 0.51 0.00 0.00 43.02 42.76 2oqj s PHE 98 CO -0.01 0.23 1.23 0.20 0.70 0.00 0.00 175.22 177.56 2oqj s GLY 99 N -2.42 1.72 0.46 4.36 0.00 -0.91 -4.54 107.32 105.98 2oqj s GLY 99 Ca 0.11 -1.06 0.16 0.00 0.00 0.00 0.00 44.72 43.93 2oqj s GLY 99 CO 0.05 -0.42 1.99 1.46 0.00 0.00 0.00 173.10 176.17 2oqj h GLN 100 N -1.30 0.29 0.00 2.90 7.50 -1.87 -3.45 115.11 119.18 2oqj h GLN 100 Ca -0.44 -0.02 0.00 0.00 0.50 0.00 0.00 58.65 58.69 2oqj h GLN 100 Cb 1.27 -0.07 0.00 0.00 0.05 0.00 0.00 27.48 28.74 2oqj h GLN 100 CO 0.48 0.19 0.00 0.41 -1.50 0.00 0.00 178.83 178.42 2oqj n GLY 101 N -1.55 2.06 2.99 3.46 0.00 -1.26 -5.05 105.19 105.85 2oqj n GLY 101 Ca 0.09 -1.71 -0.30 0.00 0.00 0.00 0.00 46.02 44.10 2oqj n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oqj s THR 102 N -1.93 1.57 -0.15 2.61 2.01 -0.03 -4.57 115.64 115.14 2oqj s THR 102 Ca 0.00 -0.84 -0.23 0.00 0.31 0.00 0.00 61.69 60.92 2oqj s THR 102 Cb 0.00 -1.59 -0.02 0.00 0.01 0.00 0.00 72.50 70.89 2oqj s THR 102 CO 0.00 0.26 0.74 -0.60 -0.69 0.00 0.00 174.62 174.33 2oqj s ARG 103 N 1.45 4.31 -0.24 4.92 3.52 -0.01 -0.52 118.95 132.38 2oqj s ARG 103 Ca 0.01 0.86 -0.08 0.00 -0.13 0.00 0.00 55.73 56.40 2oqj s ARG 103 Cb -0.15 -3.54 -0.03 0.00 -1.56 0.00 0.00 34.95 29.67 2oqj s ARG 103 CO -0.09 -0.20 0.08 0.08 -0.81 0.00 0.00 175.30 174.36 2oqj s VAL 104 N 1.73 4.47 0.26 7.11 1.01 0.53 -0.54 120.40 134.96 2oqj s VAL 104 Ca 0.35 -0.12 0.06 0.00 0.00 0.00 0.00 61.98 62.27 2oqj s VAL 104 Cb -0.17 -3.08 -0.05 0.00 0.00 0.00 0.00 36.38 33.08 2oqj s VAL 104 CO 0.13 0.35 -0.06 -1.83 0.00 0.00 0.00 175.10 173.69 2oqj s GLU 105 N 1.46 1.48 -0.03 2.72 -1.05 -0.06 -3.17 118.70 120.06 2oqj s GLU 105 Ca 0.06 -1.73 -0.30 0.00 -0.15 0.00 0.00 54.97 52.85 2oqj s GLU 105 Cb -0.15 -1.04 -0.03 0.00 -0.44 0.00 0.00 34.13 32.47 2oqj s GLU 105 CO 0.04 0.03 0.98 0.42 0.95 0.00 0.00 175.26 177.68 2oqj s ILE 106 N -3.09 4.85 0.18 1.83 1.01 -1.26 -1.34 121.20 123.38 2oqj s ILE 106 Ca 0.28 2.04 -0.30 0.00 0.00 0.00 0.00 60.65 62.67 2oqj s ILE 106 Cb 0.03 -4.31 -0.08 0.00 0.01 0.00 0.00 42.46 38.12 2oqj s ILE 106 CO 0.10 0.12 1.10 -0.75 0.00 0.00 0.00 174.94 175.52 2oqj s LYS 107 N 1.25 4.60 0.32 2.79 2.47 0.61 -4.79 119.74 127.00 2oqj s LYS 107 Ca 0.51 1.71 -0.14 0.00 -1.56 0.00 0.00 55.97 56.48 2oqj s LYS 107 Cb -0.20 -3.28 0.02 0.00 -1.46 0.00 0.00 37.83 32.91 2oqj s LYS 107 CO 0.25 0.08 0.65 -0.98 0.16 0.00 0.00 175.35 175.51 2oqj s ARG 108 N -0.37 1.91 0.89 4.03 1.04 -1.26 -4.93 118.95 120.26 2oqj s ARG 108 Ca 0.49 -1.33 -0.10 0.00 -1.04 0.00 0.00 55.73 53.75 2oqj s ARG 108 Cb -0.29 0.56 0.13 0.00 -2.04 0.00 0.00 34.95 33.31 2oqj s ARG 108 CO 0.35 -0.86 1.14 0.95 -0.04 0.00 0.00 175.30 176.84 2oqj s THR 109 N -3.24 2.30 0.30 4.99 -4.23 -1.26 -4.96 115.64 109.54 2oqj s THR 109 Ca 0.18 0.10 -0.29 0.00 -1.18 0.00 0.00 61.69 60.50 2oqj s THR 109 Cb -0.04 -2.21 -0.10 0.00 1.34 0.00 0.00 72.50 71.49 2oqj s THR 109 CO 0.11 -0.13 1.41 -0.69 -0.54 0.00 0.00 174.62 174.78 2oqj s VAL 110 N -2.70 2.55 -0.07 2.29 1.01 -1.26 -4.83 120.40 117.40 2oqj s VAL 110 Ca 0.66 0.51 -0.00 0.00 0.00 0.00 0.00 61.98 63.14 2oqj s VAL 110 Cb -0.22 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 32.86 2oqj s VAL 110 CO 0.58 0.10 -0.03 0.00 0.00 0.00 0.00 175.10 175.74 2oqj s ALA 111 N -0.59 0.83 0.42 5.51 0.00 -0.04 -4.94 121.76 122.97 2oqj s ALA 111 Ca 0.55 -0.19 -0.23 0.00 0.00 0.00 0.00 51.96 52.08 2oqj s ALA 111 Cb -0.42 -0.66 -0.09 0.00 0.00 0.00 0.00 23.12 21.95 2oqj s ALA 111 CO 0.50 -0.28 1.08 0.00 0.00 0.00 0.00 175.76 177.06 2oqj s ALA 112 N 1.51 3.03 0.59 0.00 0.00 -1.26 -1.06 121.76 124.57 2oqj s ALA 112 Ca -0.01 0.74 -0.19 0.00 0.00 0.00 0.00 51.96 52.50 2oqj s ALA 112 Cb -0.13 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 2oqj s ALA 112 CO -0.04 -0.33 1.21 -2.14 0.00 0.00 0.00 175.76 174.47 2oqj s PRO 113 N -2.63 2.98 -0.37 0.00 0.02 -1.26 -4.48 135.00 129.25 2oqj s PRO 113 Ca 0.60 1.84 -0.11 0.00 0.02 0.00 0.00 61.00 63.35 2oqj s PRO 113 Cb -0.23 -1.94 0.03 0.00 0.02 0.00 0.00 34.50 32.38 2oqj s PRO 113 CO 0.28 -1.20 0.20 -1.12 -0.33 0.00 0.00 177.00 174.83 2oqj s SER 114 N -1.58 5.73 -0.10 2.53 0.01 -0.52 -4.84 113.70 114.92 2oqj s SER 114 Ca 0.77 -0.97 -0.18 0.00 1.31 0.00 0.00 55.95 56.88 2oqj s SER 114 Cb -0.31 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 63.86 2oqj s SER 114 CO 0.33 -0.38 0.49 -0.69 0.41 0.00 0.00 173.24 173.41 2oqj s VAL 115 N 1.56 5.15 0.02 3.43 1.01 -1.26 -1.24 120.40 129.06 2oqj s VAL 115 Ca 0.02 0.99 0.05 0.00 0.00 0.00 0.00 61.98 63.04 2oqj s VAL 115 Cb -0.19 -3.83 -0.02 0.00 0.00 0.00 0.00 36.38 32.34 2oqj s VAL 115 CO 0.07 0.34 -0.15 -0.36 0.00 0.00 0.00 175.10 175.00 2oqj s PHE 116 N 0.49 1.30 -0.05 5.22 0.40 -0.45 -5.00 117.98 119.89 2oqj s PHE 116 Ca 0.27 -0.31 0.06 0.00 -0.60 0.00 0.00 56.93 56.35 2oqj s PHE 116 Cb -0.16 -0.80 -0.01 0.00 0.51 0.00 0.00 43.02 42.57 2oqj s PHE 116 CO 0.11 0.02 -0.23 -1.50 0.70 0.00 0.00 175.22 174.32 2oqj s ILE 117 N -0.62 1.90 -0.11 0.64 2.07 -1.26 -0.94 121.20 122.87 2oqj s ILE 117 Ca 0.04 -0.98 0.03 0.00 -1.41 0.00 0.00 60.65 58.33 2oqj s ILE 117 Cb -0.07 -1.61 0.01 0.00 0.13 0.00 0.00 42.46 40.92 2oqj s ILE 117 CO 0.01 0.53 -0.21 -0.36 -1.91 0.00 0.00 174.94 173.00 2oqj s PHE 118 N -0.14 2.36 0.43 3.50 0.08 0.23 -5.02 117.98 119.42 2oqj s PHE 118 Ca -0.03 -1.04 -0.21 0.00 0.12 0.00 0.00 56.93 55.77 2oqj s PHE 118 Cb -0.13 -1.61 -0.11 0.00 -0.57 0.00 0.00 43.02 40.60 2oqj s PHE 118 CO 0.03 -0.46 0.96 -1.25 -0.10 0.00 0.00 175.22 174.40 2oqj s PRO 119 N 0.59 4.21 0.43 0.24 0.05 -1.26 -2.52 135.00 136.73 2oqj s PRO 119 Ca -0.14 1.16 -0.26 0.00 0.05 0.00 0.00 61.00 61.82 2oqj s PRO 119 Cb -0.17 -2.21 -0.08 0.00 0.05 0.00 0.00 34.50 32.09 2oqj s PRO 119 CO 0.04 -0.05 1.33 -1.25 0.05 0.00 0.00 177.00 177.12 2oqj s PRO 120 N -3.11 3.85 0.58 0.56 0.04 -1.23 -4.92 135.00 130.77 2oqj s PRO 120 Ca 0.62 2.21 -0.19 0.00 0.04 0.00 0.00 61.00 63.68 2oqj s PRO 120 Cb -0.10 -2.69 -0.04 0.00 0.04 0.00 0.00 34.50 31.70 2oqj s PRO 120 CO 0.15 -0.61 1.22 -1.54 0.04 0.00 0.00 177.00 176.26 2oqj s SER 121 N -0.71 5.27 0.50 6.66 1.04 -1.26 -4.88 113.70 120.31 2oqj s SER 121 Ca 0.59 2.43 0.22 0.00 0.48 0.00 0.00 55.95 59.67 2oqj s SER 121 Cb -0.39 -2.60 1.29 0.00 0.10 0.00 0.00 66.02 64.42 2oqj s SER 121 CO 0.50 -1.54 2.05 0.44 0.98 0.00 0.00 173.24 175.67 2oqj h ASP 122 N 1.04 0.00 -0.19 7.02 5.19 -1.99 -1.93 116.42 125.56 2oqj h ASP 122 Ca -0.50 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 55.87 2oqj h ASP 122 Cb 1.29 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.80 2oqj h ASP 122 CO 0.56 0.14 -0.04 -0.08 -3.12 0.00 0.00 179.24 176.70 2oqj h GLU 123 N 0.00 0.35 -0.30 3.56 4.81 -1.99 -1.86 114.58 119.15 2oqj h GLU 123 Ca -0.00 -0.13 -0.12 0.00 -0.13 0.00 0.00 59.36 58.97 2oqj h GLU 123 Cb 0.31 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 2oqj h GLU 123 CO 0.02 0.61 -0.31 0.37 -0.73 0.00 0.00 179.01 178.97 2oqj h GLN 124 N 0.07 0.64 -0.77 1.92 4.15 -1.79 -2.62 115.11 116.72 2oqj h GLN 124 Ca 0.05 -0.29 -0.02 0.00 0.77 0.00 0.00 58.65 59.16 2oqj h GLN 124 Cb 0.48 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.11 2oqj h GLN 124 CO 0.02 0.87 0.40 1.25 -1.93 0.00 0.00 178.83 179.44 2oqj h LEU 125 N 0.55 0.99 -1.54 -2.39 7.12 -1.34 -2.50 115.31 116.20 2oqj h LEU 125 Ca 0.06 -0.11 -0.03 0.00 0.13 0.00 0.00 57.88 57.93 2oqj h LEU 125 Cb 0.81 -0.25 -0.01 0.00 -0.53 0.00 0.00 40.66 40.67 2oqj h LEU 125 CO 0.07 0.82 -0.06 0.50 -0.13 0.00 0.00 178.44 179.63 2oqj h LYS 126 N 1.08 0.22 -0.00 1.25 1.63 -1.05 -2.07 116.57 117.62 2oqj h LYS 126 Ca 0.27 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 60.03 2oqj h LYS 126 Cb 0.07 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.67 2oqj h LYS 126 CO -0.04 0.30 -0.20 -1.13 -3.45 0.00 0.00 179.45 174.93 2oqj n SER 127 N -4.34 0.34 0.00 4.20 3.41 -0.98 -4.94 113.62 111.31 2oqj n SER 127 Ca -0.01 -0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 2oqj n SER 127 Cb 0.21 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 2oqj n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2oqj n GLY 128 N 1.42 1.02 3.17 5.00 0.00 -0.78 -5.09 105.19 109.93 2oqj n GLY 128 Ca 0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.89 2oqj n GLY 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oqj s THR 129 N -2.00 1.29 -0.23 2.61 2.01 -0.98 -1.35 115.64 116.99 2oqj s THR 129 Ca 0.00 -1.00 0.02 0.00 0.31 0.00 0.00 61.69 61.02 2oqj s THR 129 Cb 0.00 -1.13 0.04 0.00 0.01 0.00 0.00 72.50 71.42 2oqj s THR 129 CO 0.00 0.11 -0.14 0.00 -0.69 0.00 0.00 174.62 173.90 2oqj s ALA 130 N -0.76 2.42 -0.28 7.40 0.00 0.78 -3.25 121.76 128.07 2oqj s ALA 130 Ca 0.04 -1.52 -0.05 0.00 0.00 0.00 0.00 51.96 50.43 2oqj s ALA 130 Cb -0.08 -1.42 0.02 0.00 0.00 0.00 0.00 23.12 21.64 2oqj s ALA 130 CO 0.01 -0.87 0.03 -1.12 0.00 0.00 0.00 175.76 173.82 2oqj s SER 131 N 1.20 4.87 -0.25 0.00 0.01 -1.26 -0.64 113.70 117.63 2oqj s SER 131 Ca -0.03 -0.80 -0.09 0.00 1.31 0.00 0.00 55.95 56.34 2oqj s SER 131 Cb -0.17 -1.80 -0.04 0.00 0.21 0.00 0.00 66.02 64.21 2oqj s SER 131 CO -0.08 -0.18 0.12 -0.69 0.41 0.00 0.00 173.24 172.82 2oqj s VAL 132 N 1.43 4.79 -0.16 3.43 1.01 0.40 -3.50 120.40 127.81 2oqj s VAL 132 Ca 0.01 -0.01 -0.04 0.00 0.00 0.00 0.00 61.98 61.95 2oqj s VAL 132 Cb -0.17 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 2oqj s VAL 132 CO 0.00 0.32 -0.04 -0.69 0.00 0.00 0.00 175.10 174.69 2oqj s VAL 133 N 1.53 3.89 -0.20 2.92 1.01 -1.05 -0.32 120.40 128.19 2oqj s VAL 133 Ca 0.06 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.66 2oqj s VAL 133 Cb -0.15 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.51 2oqj s VAL 133 CO 0.06 0.49 -0.07 0.00 0.00 0.00 0.00 175.10 175.58 2oqj s LEU 135 N 1.22 3.57 -0.34 0.00 2.96 -0.12 -0.25 118.68 125.72 2oqj s LEU 135 Ca 0.02 0.00 -0.05 0.00 -0.22 0.00 0.00 54.13 53.88 2oqj s LEU 135 Cb -0.14 -1.88 0.05 0.00 0.50 0.00 0.00 46.19 44.72 2oqj s LEU 135 CO -0.02 0.19 0.10 -0.76 -1.32 0.00 0.00 176.35 174.54 2oqj s LEU 136 N 0.26 4.37 -0.18 -0.68 1.02 -0.07 -1.34 118.68 122.06 2oqj s LEU 136 Ca 0.01 -1.27 -0.07 0.00 0.02 0.00 0.00 54.13 52.81 2oqj s LEU 136 Cb -0.13 -1.84 -0.04 0.00 0.02 0.00 0.00 46.19 44.20 2oqj s LEU 136 CO 0.01 -0.35 0.06 0.21 0.02 0.00 0.00 176.35 176.31 2oqj s ASN 137 N 1.47 5.63 -0.90 2.29 2.47 -0.38 -0.93 114.94 124.59 2oqj s ASN 137 Ca -0.01 0.08 -0.06 0.00 0.42 0.00 0.00 52.86 53.28 2oqj s ASN 137 Cb -0.20 -1.96 -0.01 0.00 -1.45 0.00 0.00 41.25 37.62 2oqj s ASN 137 CO 0.01 0.17 0.73 0.59 -3.72 0.00 0.00 177.10 174.88 2oqj n ASN 138 N 3.55 -6.32 -4.58 -4.21 3.02 -1.10 -1.44 115.26 104.18 2oqj n ASN 138 Ca -0.17 -0.61 -0.25 0.00 -0.03 0.00 0.00 54.58 53.53 2oqj n ASN 138 Cb 0.52 -3.92 -0.09 0.00 -0.61 0.00 0.00 39.78 35.68 2oqj n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 2oqj s PHE 139 N -3.17 2.48 -0.27 3.10 -0.71 0.43 -4.59 117.98 115.26 2oqj s PHE 139 Ca 0.18 -0.40 -0.23 0.00 -1.04 0.00 0.00 56.93 55.43 2oqj s PHE 139 Cb -0.05 -1.32 0.08 0.00 -1.21 0.00 0.00 43.02 40.51 2oqj s PHE 139 CO 0.81 0.57 0.76 -0.47 -1.34 0.00 0.00 175.22 175.55 2oqj s TYR 140 N -2.52 -0.80 0.07 3.49 5.04 -0.23 -0.12 117.35 122.29 2oqj s TYR 140 Ca 0.33 1.86 -0.01 0.00 -2.44 0.00 0.00 57.07 56.81 2oqj s TYR 140 Cb -0.01 0.34 0.02 0.00 0.35 0.00 0.00 41.96 42.66 2oqj s TYR 140 CO 0.18 -0.39 0.08 -0.35 -1.34 0.00 0.00 175.55 173.73 2oqj n PRO 141 N 2.93 -0.80 -0.06 4.97 -0.04 -1.26 -0.86 135.00 139.88 2oqj n PRO 141 Ca -0.15 -0.12 -0.16 0.00 -0.04 0.00 0.00 63.50 63.03 2oqj n PRO 141 Cb 0.56 -0.10 -0.05 0.00 -0.04 0.00 0.00 33.50 33.86 2oqj n PRO 141 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2oqj h ARG 142 N 0.00 0.83 -5.88 0.54 2.43 -1.99 -3.44 114.38 106.87 2oqj h ARG 142 Ca -0.03 -0.57 -0.54 0.00 -0.81 0.00 0.00 59.98 58.02 2oqj h ARG 142 Cb 0.08 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 2oqj h ARG 142 CO 0.02 1.20 1.53 -1.83 -1.51 0.00 0.00 179.97 179.37 2oqj s GLU 143 N -4.00 2.78 0.02 0.20 1.03 -1.26 -4.94 118.70 112.53 2oqj s GLU 143 Ca -0.11 1.76 0.00 0.00 0.03 0.00 0.00 54.97 56.65 2oqj s GLU 143 Cb 0.09 -4.44 -0.02 0.00 -0.80 0.00 0.00 34.13 28.96 2oqj s GLU 143 CO 0.89 -2.51 -0.03 0.00 -1.33 0.00 0.00 175.26 172.28 2oqj s ALA 144 N 9.58 0.19 -0.09 -0.84 0.00 -1.26 -4.57 121.76 124.76 2oqj s ALA 144 Ca 0.98 -0.66 0.03 0.00 0.00 0.00 0.00 51.96 52.30 2oqj s ALA 144 Cb -0.27 0.16 0.01 0.00 0.00 0.00 0.00 23.12 23.02 2oqj s ALA 144 CO 0.32 -0.17 -0.18 0.15 0.00 0.00 0.00 175.76 175.87 2oqj s LYS 145 N -1.72 2.42 -0.16 0.00 -0.14 -0.36 -5.01 119.74 114.77 2oqj s LYS 145 Ca -0.13 -0.65 -0.02 0.00 -1.36 0.00 0.00 55.97 53.81 2oqj s LYS 145 Cb -0.08 -1.93 -0.01 0.00 -1.68 0.00 0.00 37.83 34.13 2oqj s LYS 145 CO -0.02 0.05 -0.10 0.08 -0.76 0.00 0.00 175.35 174.61 2oqj s VAL 146 N 0.65 3.17 -0.10 3.17 1.01 -1.26 -1.14 120.40 125.90 2oqj s VAL 146 Ca -0.13 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 61.27 2oqj s VAL 146 Cb -0.16 -2.37 0.01 0.00 0.00 0.00 0.00 36.38 33.85 2oqj s VAL 146 CO 0.04 0.49 -0.18 -1.58 0.00 0.00 0.00 175.10 173.87 2oqj s GLN 147 N 0.73 2.42 -0.15 2.72 0.74 0.13 -4.97 119.66 121.28 2oqj s GLN 147 Ca -0.05 -0.65 -0.15 0.00 0.05 0.00 0.00 55.36 54.57 2oqj s GLN 147 Cb -0.15 -1.95 -0.05 0.00 1.10 0.00 0.00 33.01 31.97 2oqj s GLN 147 CO 0.02 0.04 0.33 -1.58 -0.55 0.00 0.00 175.29 173.55 2oqj s TRP 148 N 0.69 3.47 -0.11 1.67 0.52 -1.26 -0.20 118.94 123.72 2oqj s TRP 148 Ca -0.12 0.66 0.00 0.00 0.02 0.00 0.00 56.10 56.66 2oqj s TRP 148 Cb -0.16 -2.39 0.02 0.00 -1.15 0.00 0.00 33.47 29.79 2oqj s TRP 148 CO 0.03 0.22 -0.11 0.15 0.02 0.00 0.00 176.95 177.26 2oqj s LYS 149 N 0.51 1.80 -0.27 4.98 1.02 -1.02 0.11 119.74 126.87 2oqj s LYS 149 Ca 0.19 -0.38 0.00 0.00 0.02 0.00 0.00 55.97 55.80 2oqj s LYS 149 Cb -0.13 -1.72 0.05 0.00 -0.52 0.00 0.00 37.83 35.51 2oqj s LYS 149 CO 0.05 -0.20 -0.06 0.08 -0.92 0.00 0.00 175.35 174.30 2oqj s VAL 150 N 1.45 2.61 -1.47 3.17 1.01 0.33 -1.23 120.40 126.28 2oqj s VAL 150 Ca 0.01 -1.40 -0.10 0.00 0.00 0.00 0.00 61.98 60.50 2oqj s VAL 150 Cb -0.13 -2.47 0.06 0.00 0.00 0.00 0.00 36.38 33.84 2oqj s VAL 150 CO -0.07 0.01 0.89 0.47 0.00 0.00 0.00 175.10 176.40 2oqj n ASP 151 N 4.56 -3.69 0.00 3.32 8.00 -0.84 -1.90 116.55 126.00 2oqj n ASP 151 Ca -0.14 -0.79 0.00 0.00 0.71 0.00 0.00 54.79 54.56 2oqj n ASP 151 Cb 0.44 -3.92 0.00 0.00 -0.02 0.00 0.00 41.12 37.62 2oqj n ASP 151 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2oqj n ASN 152 N -2.90 0.00 -4.69 -2.24 3.02 -1.26 -4.99 115.26 102.20 2oqj n ASN 152 Ca -0.06 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.07 2oqj n ASN 152 Cb 0.57 -0.92 -0.03 0.00 -0.61 0.00 0.00 39.78 38.79 2oqj n ASN 152 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2oqj s ALA 153 N -2.25 3.42 0.26 5.41 0.00 -0.80 -5.01 121.76 122.80 2oqj s ALA 153 Ca 0.00 0.28 -0.29 0.00 0.00 0.00 0.00 51.96 51.94 2oqj s ALA 153 Cb 0.00 -3.35 -0.09 0.00 0.00 0.00 0.00 23.12 19.68 2oqj s ALA 153 CO 0.00 -0.57 1.00 -0.48 0.00 0.00 0.00 175.76 175.71 2oqj s LEU 154 N 1.94 4.59 0.17 0.00 2.34 -1.26 -0.51 118.68 125.95 2oqj s LEU 154 Ca 0.45 2.07 -0.04 0.00 0.06 0.00 0.00 54.13 56.67 2oqj s LEU 154 Cb -0.18 -3.65 -0.05 0.00 -0.56 0.00 0.00 46.19 41.75 2oqj s LEU 154 CO 0.17 0.02 0.40 -1.10 -1.06 0.00 0.00 176.35 174.78 2oqj s GLN 155 N -1.35 3.60 -0.07 1.48 -1.52 0.12 -4.93 119.66 116.98 2oqj s GLN 155 Ca 0.43 -0.13 -0.03 0.00 -1.95 0.00 0.00 55.36 53.68 2oqj s GLN 155 Cb -0.28 -2.82 0.04 0.00 -0.22 0.00 0.00 33.01 29.73 2oqj s GLN 155 CO 0.35 0.42 0.15 0.45 -0.25 0.00 0.00 175.29 176.41 2oqj s SER 156 N -2.69 0.30 -0.23 5.90 0.15 -1.26 -4.70 113.70 111.16 2oqj s SER 156 Ca 0.41 0.31 0.00 0.00 0.70 0.00 0.00 55.95 57.37 2oqj s SER 156 Cb -0.12 0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.42 2oqj s SER 156 CO 0.26 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.12 2oqj n GLY 157 N 4.73 0.45 0.67 9.45 0.00 -1.26 -4.85 105.19 114.39 2oqj n GLY 157 Ca -0.16 -0.12 0.05 0.00 0.00 0.00 0.00 46.02 45.79 2oqj n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2oqj n ASN 158 N -0.30 2.68 -4.01 1.61 6.94 -1.26 -5.02 115.26 115.90 2oqj n ASN 158 Ca -0.02 -3.40 -0.08 0.00 -0.02 0.00 0.00 54.58 51.06 2oqj n ASN 158 Cb 0.26 -0.53 -0.10 0.00 -2.36 0.00 0.00 39.78 37.05 2oqj n ASN 158 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2oqj s SER 159 N -2.60 0.34 0.04 0.53 1.04 -1.26 -2.02 113.70 109.76 2oqj s SER 159 Ca 0.39 -0.77 0.02 0.00 0.48 0.00 0.00 55.95 56.07 2oqj s SER 159 Cb 0.35 0.21 -0.02 0.00 0.10 0.00 0.00 66.02 66.65 2oqj s SER 159 CO 0.02 -0.54 -0.08 -1.10 0.98 0.00 0.00 173.24 172.52 2oqj s GLN 160 N -3.21 0.54 0.12 4.02 -0.21 -1.10 -4.99 119.66 114.83 2oqj s GLN 160 Ca 0.00 -0.77 0.03 0.00 0.02 0.00 0.00 55.36 54.65 2oqj s GLN 160 Cb 0.03 -0.29 -0.04 0.00 1.00 0.00 0.00 33.01 33.70 2oqj s GLN 160 CO -0.07 0.05 -0.09 -1.83 -2.12 0.00 0.00 175.29 171.23 2oqj s GLU 161 N -1.62 0.96 0.00 2.91 -1.05 -1.26 -1.32 118.70 117.32 2oqj s GLU 161 Ca -0.10 -1.38 0.01 0.00 -0.15 0.00 0.00 54.97 53.36 2oqj s GLU 161 Cb -0.10 -0.47 -0.00 0.00 -0.44 0.00 0.00 34.13 33.12 2oqj s GLU 161 CO 0.00 0.04 -0.03 0.45 0.95 0.00 0.00 175.26 176.67 2oqj s SER 162 N -3.04 0.39 -0.03 0.83 0.15 -0.49 -4.99 113.70 106.51 2oqj s SER 162 Ca 0.14 -0.10 0.05 0.00 0.70 0.00 0.00 55.95 56.73 2oqj s SER 162 Cb 0.03 -0.03 -0.01 0.00 -1.71 0.00 0.00 66.02 64.30 2oqj s SER 162 CO -0.01 0.01 -0.17 -0.69 1.20 0.00 0.00 173.24 173.58 2oqj s VAL 163 N -0.21 1.37 0.62 4.45 1.01 -1.26 -0.93 120.40 125.46 2oqj s VAL 163 Ca -0.00 -0.70 -0.10 0.00 0.00 0.00 0.00 61.98 61.18 2oqj s VAL 163 Cb -0.02 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.17 2oqj s VAL 163 CO -0.00 0.39 1.00 0.42 0.00 0.00 0.00 175.10 176.91 2oqj s THR 164 N -0.09 4.20 0.62 3.92 -4.23 -0.52 -5.00 115.64 114.53 2oqj s THR 164 Ca -0.01 0.53 -0.11 0.00 -1.18 0.00 0.00 61.69 60.93 2oqj s THR 164 Cb -0.10 -3.69 -0.03 0.00 1.34 0.00 0.00 72.50 70.02 2oqj s THR 164 CO 0.01 -0.84 1.02 -1.61 -0.54 0.00 0.00 174.62 172.65 2oqj s GLU 165 N -5.15 3.52 -0.00 3.99 0.41 -1.26 -4.55 118.70 115.66 2oqj s GLU 165 Ca 0.55 0.68 -0.38 0.00 -0.41 0.00 0.00 54.97 55.41 2oqj s GLU 165 Cb -0.11 -2.10 -0.17 0.00 -1.78 0.00 0.00 34.13 29.98 2oqj s GLU 165 CO 0.51 -0.59 1.41 1.04 -0.49 0.00 0.00 175.26 177.14 2oqj n GLN 166 N -2.74 1.06 -1.91 1.61 6.02 -1.26 -4.78 117.38 115.39 2oqj n GLN 166 Ca 0.06 0.39 -0.42 0.00 -0.01 0.00 0.00 57.00 57.01 2oqj n GLN 166 Cb 0.54 -2.03 -0.03 0.00 1.02 0.00 0.00 30.24 29.75 2oqj n GLN 166 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2oqj s ASP 167 N 1.12 6.57 0.26 1.08 -1.08 0.09 -4.86 116.67 119.85 2oqj s ASP 167 Ca 0.88 2.60 0.19 0.00 -0.52 0.00 0.00 52.55 55.70 2oqj s ASP 167 Cb -1.00 -2.58 0.98 0.00 -1.46 0.00 0.00 42.92 38.86 2oqj s ASP 167 CO 0.52 -0.86 1.59 -1.54 0.52 0.00 0.00 175.17 175.40 2oqj n SER 168 N 4.56 0.50 -0.11 -0.34 3.41 -1.26 -0.08 113.62 120.31 2oqj n SER 168 Ca 0.15 0.71 -0.16 0.00 -0.26 0.00 0.00 58.87 59.30 2oqj n SER 168 Cb 0.39 -0.78 -0.06 0.00 -0.26 0.00 0.00 64.21 63.50 2oqj n SER 168 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2oqj n LYS 169 N -2.14 0.54 -0.03 4.33 4.81 -1.26 -4.77 118.16 119.64 2oqj n LYS 169 Ca -0.00 0.29 0.02 0.00 -0.87 0.00 0.00 58.31 57.74 2oqj n LYS 169 Cb 0.07 -1.50 0.04 0.00 0.02 0.00 0.00 35.03 33.66 2oqj n LYS 169 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2oqj n ASP 170 N -4.41 2.14 -2.10 3.14 5.75 -1.19 -5.01 116.55 114.88 2oqj n ASP 170 Ca -0.28 -2.19 -0.15 0.00 -0.01 0.00 0.00 54.79 52.16 2oqj n ASP 170 Cb 0.63 -0.09 -0.03 0.00 -1.03 0.00 0.00 41.12 40.60 2oqj n ASP 170 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2oqj n SER 171 N -0.58 -4.35 -4.96 -1.12 7.64 0.88 -4.91 113.62 106.22 2oqj n SER 171 Ca 0.04 0.21 -0.22 0.00 1.01 0.00 0.00 58.87 59.90 2oqj n SER 171 Cb 0.33 -3.77 -0.00 0.00 -1.01 0.00 0.00 64.21 59.76 2oqj n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2oqj s THR 172 N -2.59 4.56 0.18 0.44 -4.23 -1.26 -4.50 115.64 108.24 2oqj s THR 172 Ca 0.00 -0.64 0.07 0.00 -1.18 0.00 0.00 61.69 59.93 2oqj s THR 172 Cb 0.00 -3.65 -0.04 0.00 1.34 0.00 0.00 72.50 70.15 2oqj s THR 172 CO 0.00 -0.38 0.05 -0.31 -0.54 0.00 0.00 174.62 173.44 2oqj s TYR 173 N -2.33 2.94 0.01 3.99 2.02 0.83 -0.73 117.35 124.08 2oqj s TYR 173 Ca 0.43 -0.10 0.04 0.00 -0.37 0.00 0.00 57.07 57.06 2oqj s TYR 173 Cb -0.10 -1.41 -0.01 0.00 -0.40 0.00 0.00 41.96 40.04 2oqj s TYR 173 CO 0.35 0.52 -0.12 -1.12 -1.57 0.00 0.00 175.55 173.61 2oqj s SER 174 N -3.06 1.42 0.11 2.29 0.01 -1.26 -0.42 113.70 112.78 2oqj s SER 174 Ca 0.29 -0.30 0.09 0.00 1.31 0.00 0.00 55.95 57.34 2oqj s SER 174 Cb -0.09 -0.13 -0.04 0.00 0.21 0.00 0.00 66.02 65.97 2oqj s SER 174 CO 0.20 0.09 -0.21 -0.22 0.41 0.00 0.00 173.24 173.51 2oqj s LEU 175 N -0.61 2.55 -0.06 2.44 0.20 -0.11 -1.44 118.68 121.65 2oqj s LEU 175 Ca 0.03 -0.60 -0.01 0.00 0.69 0.00 0.00 54.13 54.24 2oqj s LEU 175 Cb -0.06 -1.44 0.03 0.00 -0.43 0.00 0.00 46.19 44.29 2oqj s LEU 175 CO 0.00 0.19 -0.01 -0.55 -0.29 0.00 0.00 176.35 175.70 2oqj s SER 176 N -1.99 1.38 -0.08 3.68 0.15 -0.10 -0.89 113.70 115.84 2oqj s SER 176 Ca 0.16 -0.09 0.02 0.00 0.70 0.00 0.00 55.95 56.74 2oqj s SER 176 Cb -0.10 -0.43 -0.02 0.00 -1.71 0.00 0.00 66.02 63.76 2oqj s SER 176 CO 0.08 -0.16 -0.14 -0.55 1.20 0.00 0.00 173.24 173.67 2oqj s SER 177 N 1.69 4.04 -0.30 5.45 0.15 0.65 -1.40 113.70 123.98 2oqj s SER 177 Ca 0.01 -0.24 0.01 0.00 0.70 0.00 0.00 55.95 56.43 2oqj s SER 177 Cb -0.13 -1.16 0.09 0.00 -1.71 0.00 0.00 66.02 63.11 2oqj s SER 177 CO -0.04 0.27 0.05 -0.89 1.20 0.00 0.00 173.24 173.83 2oqj s THR 178 N -0.30 1.54 -0.26 6.45 2.01 -0.44 -0.18 115.64 124.47 2oqj s THR 178 Ca 0.03 -1.71 -0.27 0.00 0.31 0.00 0.00 61.69 60.04 2oqj s THR 178 Cb -0.13 -2.07 0.01 0.00 0.01 0.00 0.00 72.50 70.32 2oqj s THR 178 CO 0.03 -0.52 0.97 -0.22 -0.69 0.00 0.00 174.62 174.19 2oqj s LEU 179 N 1.30 4.06 -0.19 4.42 2.96 0.57 -2.72 118.68 129.08 2oqj s LEU 179 Ca 0.07 1.16 -0.03 0.00 -0.22 0.00 0.00 54.13 55.10 2oqj s LEU 179 Cb -0.18 -3.41 -0.01 0.00 0.50 0.00 0.00 46.19 43.08 2oqj s LEU 179 CO -0.14 -0.67 -0.05 -0.89 -1.32 0.00 0.00 176.35 173.27 2oqj s THR 180 N 3.19 3.46 0.10 3.68 2.01 -0.86 -0.45 115.64 126.76 2oqj s THR 180 Ca 0.41 -0.48 0.03 0.00 0.31 0.00 0.00 61.69 61.96 2oqj s THR 180 Cb -0.14 -2.55 -0.04 0.00 0.01 0.00 0.00 72.50 69.78 2oqj s THR 180 CO 0.09 0.45 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.62 2oqj s LEU 181 N 1.06 2.44 0.45 4.42 1.43 0.19 -4.87 118.68 123.81 2oqj s LEU 181 Ca 0.01 -0.87 -0.20 0.00 -1.03 0.00 0.00 54.13 52.04 2oqj s LEU 181 Cb -0.15 -0.21 -0.10 0.00 0.03 0.00 0.00 46.19 45.77 2oqj s LEU 181 CO -0.00 -0.33 0.97 -0.94 0.23 0.00 0.00 176.35 176.28 2oqj s SER 182 N -2.62 6.77 0.22 2.29 1.04 -1.26 -0.16 113.70 119.98 2oqj s SER 182 Ca 0.07 1.72 -0.14 0.00 0.48 0.00 0.00 55.95 58.08 2oqj s SER 182 Cb -0.00 -2.54 0.25 0.00 0.10 0.00 0.00 66.02 63.83 2oqj s SER 182 CO -0.02 -0.48 1.61 0.50 0.98 0.00 0.00 173.24 175.83 2oqj h LYS 183 N 1.68 -0.03 -0.43 4.02 3.64 -1.53 -1.04 116.57 122.88 2oqj h LYS 183 Ca -0.49 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2oqj h LYS 183 Cb 1.19 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.99 2oqj h LYS 183 CO 0.61 -0.02 0.26 0.00 -2.27 0.00 0.00 179.45 178.02 2oqj h ALA 184 N 1.58 0.55 0.00 5.00 0.00 -1.93 -2.36 119.26 122.10 2oqj h ALA 184 Ca 0.32 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 2oqj h ALA 184 Cb 0.52 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2oqj h ALA 184 CO -0.71 0.05 -0.17 -0.44 0.00 0.00 0.00 179.25 177.98 2oqj h ASP 185 N 0.57 0.00 0.77 0.00 5.19 -1.72 -2.00 116.42 119.23 2oqj h ASP 185 Ca 0.15 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 56.43 2oqj h ASP 185 Cb 0.01 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.50 2oqj h ASP 185 CO -0.03 0.17 -0.66 0.22 -3.12 0.00 0.00 179.24 175.82 2oqj h TYR 186 N 0.00 0.00 0.00 4.55 3.20 -0.92 -3.13 116.97 120.67 2oqj h TYR 186 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2oqj h TYR 186 Cb 0.69 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.96 2oqj h TYR 186 CO 0.00 0.66 0.00 0.93 -1.64 0.00 0.00 178.16 178.11 2oqj h GLU 187 N 0.00 0.00 0.00 1.82 4.39 -0.84 -3.24 114.58 116.71 2oqj h GLU 187 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2oqj h GLU 187 Cb 1.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 2oqj h GLU 187 CO 0.09 0.00 0.00 1.63 -1.16 0.00 0.00 179.01 179.57 2oqj n LYS 188 N -2.74 0.20 -4.15 2.33 5.02 -1.17 -4.88 118.16 112.77 2oqj n LYS 188 Ca 0.02 0.24 -0.14 0.00 -2.02 0.00 0.00 58.31 56.42 2oqj n LYS 188 Cb 0.35 -1.77 -0.11 0.00 -0.02 0.00 0.00 35.03 33.48 2oqj n LYS 188 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2oqj s HIS 189 N -3.14 0.95 -0.06 2.13 3.76 -1.22 -5.10 115.29 112.61 2oqj s HIS 189 Ca 0.09 -0.63 -0.05 0.00 -0.15 0.00 0.00 55.06 54.32 2oqj s HIS 189 Cb 0.12 -0.54 -0.02 0.00 1.11 0.00 0.00 32.58 33.26 2oqj s HIS 189 CO 0.51 -0.04 -0.11 1.17 -0.85 0.00 0.00 174.74 175.43 2oqj n LYS 190 N 0.79 0.19 -3.33 1.40 3.00 -1.26 -4.80 118.16 114.15 2oqj n LYS 190 Ca -0.18 0.21 -0.39 0.00 -0.00 0.00 0.00 58.31 57.96 2oqj n LYS 190 Cb 0.57 -0.99 -0.07 0.00 0.00 0.00 0.00 35.03 34.54 2oqj n LYS 190 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2oqj s VAL 191 N -1.63 5.16 -0.30 3.15 0.11 -1.26 -2.38 120.40 123.24 2oqj s VAL 191 Ca -0.09 0.78 -0.03 0.00 -2.93 0.00 0.00 61.98 59.71 2oqj s VAL 191 Cb 0.01 -3.77 0.04 0.00 -1.53 0.00 0.00 36.38 31.13 2oqj s VAL 191 CO 0.13 0.20 0.02 -0.31 -3.33 0.00 0.00 175.10 171.81 2oqj s TYR 192 N 1.58 3.21 0.20 1.54 2.02 -0.77 -1.98 117.35 123.15 2oqj s TYR 192 Ca 0.20 -1.63 0.09 0.00 -0.37 0.00 0.00 57.07 55.36 2oqj s TYR 192 Cb -0.15 -2.15 -0.04 0.00 -0.40 0.00 0.00 41.96 39.22 2oqj s TYR 192 CO 0.09 -0.75 -0.10 0.00 -1.57 0.00 0.00 175.55 173.21 2oqj s ALA 193 N 1.32 2.92 -0.15 3.71 0.00 -0.36 -2.61 121.76 126.59 2oqj s ALA 193 Ca -0.03 -1.53 0.00 0.00 0.00 0.00 0.00 51.96 50.40 2oqj s ALA 193 Cb -0.19 -0.67 0.03 0.00 0.00 0.00 0.00 23.12 22.29 2oqj s ALA 193 CO -0.01 0.43 -0.10 0.00 0.00 0.00 0.00 175.76 176.08 2oqj s GLU 195 N 1.56 3.79 -0.17 0.00 2.12 0.72 -1.35 118.70 125.38 2oqj s GLU 195 Ca 0.03 -0.42 0.01 0.00 0.36 0.00 0.00 54.97 54.94 2oqj s GLU 195 Cb -0.14 -3.24 0.01 0.00 0.26 0.00 0.00 34.13 31.02 2oqj s GLU 195 CO -0.09 0.05 -0.19 0.08 -0.54 0.00 0.00 175.26 174.57 2oqj s VAL 196 N 0.97 2.23 -0.13 3.70 1.01 -0.16 0.22 120.40 128.25 2oqj s VAL 196 Ca 0.04 -0.90 -0.03 0.00 0.00 0.00 0.00 61.98 61.08 2oqj s VAL 196 Cb -0.14 -1.93 -0.03 0.00 0.00 0.00 0.00 36.38 34.28 2oqj s VAL 196 CO 0.03 0.53 -0.01 -0.89 0.00 0.00 0.00 175.10 174.76 2oqj s THR 197 N 1.11 4.17 0.15 3.92 2.01 -0.29 -1.67 115.64 125.04 2oqj s THR 197 Ca 0.00 -0.28 -0.17 0.00 0.31 0.00 0.00 61.69 61.56 2oqj s THR 197 Cb -0.14 -2.80 0.04 0.00 0.01 0.00 0.00 72.50 69.61 2oqj s THR 197 CO -0.08 0.53 0.46 -2.28 -0.69 0.00 0.00 174.62 172.57 2oqj s HIS 198 N -0.15 -0.22 0.27 4.92 2.46 -1.26 -1.22 115.29 120.09 2oqj s HIS 198 Ca 0.04 -0.08 -0.02 0.00 0.47 0.00 0.00 55.06 55.47 2oqj s HIS 198 Cb -0.13 0.33 0.37 0.00 -0.13 0.00 0.00 32.58 33.02 2oqj s HIS 198 CO 0.02 -0.77 1.80 0.37 -2.47 0.00 0.00 174.74 173.69 2oqj h GLN 199 N 2.27 0.84 0.00 2.88 4.15 -1.93 -2.52 115.11 120.80 2oqj h GLN 199 Ca -0.33 -0.19 0.00 0.00 0.77 0.00 0.00 58.65 58.91 2oqj h GLN 199 Cb 1.27 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.84 2oqj h GLN 199 CO 0.43 0.77 0.00 0.41 -1.93 0.00 0.00 178.83 178.52 2oqj n GLY 200 N -0.79 -1.33 3.55 2.39 0.00 -1.26 -4.55 105.19 103.19 2oqj n GLY 200 Ca 0.04 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 2oqj n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oqj s LEU 201 N -2.99 4.41 0.54 0.99 1.02 -0.95 -4.73 118.68 116.97 2oqj s LEU 201 Ca 0.12 -0.25 0.27 0.00 0.02 0.00 0.00 54.13 54.28 2oqj s LEU 201 Cb 0.16 -2.26 1.55 0.00 0.02 0.00 0.00 46.19 45.67 2oqj s LEU 201 CO 0.44 -0.27 2.14 0.77 0.02 0.00 0.00 176.35 179.46 2oqj h SER 202 N 8.45 0.00 -5.12 2.29 4.64 -1.82 -3.43 113.55 118.57 2oqj h SER 202 Ca -0.31 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.93 2oqj h SER 202 Cb 1.15 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.10 2oqj h SER 202 CO 0.66 0.07 -0.27 -0.94 -0.87 0.00 0.00 176.83 175.48 2oqj s SER 203 N -6.28 -0.02 0.75 4.97 1.04 -1.26 -5.14 113.70 107.77 2oqj s SER 203 Ca -0.04 -0.49 -0.15 0.00 0.48 0.00 0.00 55.95 55.76 2oqj s SER 203 Cb 0.14 0.38 0.05 0.00 0.10 0.00 0.00 66.02 66.69 2oqj s SER 203 CO 0.58 -0.74 1.23 -2.84 0.98 0.00 0.00 173.24 172.45 2oqj s PRO 204 N -3.63 1.94 -0.15 4.02 0.02 -1.26 -4.93 135.00 131.01 2oqj s PRO 204 Ca 0.03 1.84 -0.00 0.00 0.02 0.00 0.00 61.00 62.88 2oqj s PRO 204 Cb 0.03 -1.80 -0.01 0.00 0.02 0.00 0.00 34.50 32.74 2oqj s PRO 204 CO -0.10 -2.00 -0.13 0.08 -0.33 0.00 0.00 177.00 174.51 2oqj s VAL 205 N -1.93 2.90 -0.11 3.83 1.01 -0.67 -4.95 120.40 120.48 2oqj s VAL 205 Ca 0.76 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 62.01 2oqj s VAL 205 Cb -0.31 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.80 2oqj s VAL 205 CO 0.47 0.51 -0.00 -0.89 0.00 0.00 0.00 175.10 175.19 2oqj s THR 206 N 0.68 4.26 -0.01 3.92 2.01 -1.26 -0.99 115.64 124.25 2oqj s THR 206 Ca -0.07 -0.25 0.05 0.00 0.31 0.00 0.00 61.69 61.73 2oqj s THR 206 Cb -0.15 -2.82 -0.01 0.00 0.01 0.00 0.00 72.50 69.52 2oqj s THR 206 CO 0.02 0.56 -0.16 -0.54 -0.69 0.00 0.00 174.62 173.81 2oqj s LYS 207 N -0.45 1.29 0.18 4.92 -0.14 -0.45 -4.97 119.74 120.11 2oqj s LYS 207 Ca 0.08 -0.57 -0.14 0.00 -1.36 0.00 0.00 55.97 53.98 2oqj s LYS 207 Cb -0.12 -1.25 0.01 0.00 -1.68 0.00 0.00 37.83 34.79 2oqj s LYS 207 CO 0.02 0.34 0.42 -1.54 -0.76 0.00 0.00 175.35 173.83 2oqj s SER 208 N -0.38 -0.13 0.09 2.83 1.04 -1.26 -0.05 113.70 115.85 2oqj s SER 208 Ca 0.06 -0.64 -0.03 0.00 0.48 0.00 0.00 55.95 55.81 2oqj s SER 208 Cb -0.06 0.51 -0.03 0.00 0.10 0.00 0.00 66.02 66.54 2oqj s SER 208 CO -0.01 -0.98 0.07 0.72 0.98 0.00 0.00 173.24 174.03 2oqj s PHE 209 N -3.91 0.55 0.02 5.02 -0.12 -1.07 -5.02 117.98 113.45 2oqj s PHE 209 Ca 0.12 -1.00 0.01 0.00 -0.05 0.00 0.00 56.93 56.00 2oqj s PHE 209 Cb 0.01 -0.32 -0.04 0.00 -0.63 0.00 0.00 43.02 42.04 2oqj s PHE 209 CO -0.02 -0.49 0.08 -0.80 -0.05 0.00 0.00 175.22 173.94 2oqj s ASN 210 N -2.96 5.62 -0.59 1.98 0.01 -1.26 -1.84 114.94 115.90 2oqj s ASN 210 Ca 0.13 0.10 -0.26 0.00 -0.71 0.00 0.00 52.86 52.13 2oqj s ASN 210 Cb 0.07 -1.58 -0.09 0.00 0.41 0.00 0.00 41.25 40.05 2oqj s ASN 210 CO -0.05 0.25 2.40 -0.60 -1.51 0.00 0.00 177.10 177.59 2oqj s ARG 211 N -1.88 1.94 0.00 -0.60 3.52 -1.00 -5.03 118.95 115.90 2oqj s ARG 211 Ca 0.24 1.10 0.00 0.00 -0.13 0.00 0.00 55.73 56.94 2oqj s ARG 211 Cb -0.12 -4.65 0.00 0.00 -1.56 0.00 0.00 34.95 28.62 2oqj s ARG 211 CO 0.16 -3.65 0.00 0.41 -0.81 0.00 0.00 175.30 171.41