#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uwx s ILE 4 N 0.00 1.65 0.04 -0.61 -1.16 -1.26 -5.08 121.20 114.78 1uwx s ILE 4 Ca 0.00 -0.69 -0.16 0.00 -0.51 0.00 0.00 60.65 59.30 1uwx s ILE 4 Cb 0.00 -1.54 -0.06 0.00 0.61 0.00 0.00 42.46 41.47 1uwx s ILE 4 CO 0.00 0.47 0.47 -0.69 -2.81 0.00 0.00 174.94 172.38 1uwx s VAL 5 N 1.45 4.93 -0.27 4.00 1.01 -1.26 -4.70 120.40 125.57 1uwx s VAL 5 Ca 0.05 0.92 0.02 0.00 0.00 0.00 0.00 61.98 62.97 1uwx s VAL 5 Cb -0.13 -3.76 0.07 0.00 0.00 0.00 0.00 36.38 32.56 1uwx s VAL 5 CO -0.11 0.52 -0.06 -0.04 0.00 0.00 0.00 175.10 175.41 1uwx s MET 6 N -1.23 1.92 -0.22 2.72 -1.94 -1.26 -0.85 119.30 118.44 1uwx s MET 6 Ca 0.27 -1.34 -0.10 0.00 -1.71 0.00 0.00 55.69 52.82 1uwx s MET 6 Cb -0.17 -2.84 -0.05 0.00 2.01 0.00 0.00 34.83 33.78 1uwx s MET 6 CO 0.16 -0.65 0.14 0.99 -0.01 0.00 0.00 175.02 175.65 1uwx s THR 7 N 1.16 5.27 -0.29 2.05 2.01 -0.49 -4.08 115.64 121.27 1uwx s THR 7 Ca -0.05 0.15 0.02 0.00 0.31 0.00 0.00 61.69 62.12 1uwx s THR 7 Cb -0.19 -3.44 0.07 0.00 0.01 0.00 0.00 72.50 68.94 1uwx s THR 7 CO -0.06 0.38 -0.04 -1.58 -0.69 0.00 0.00 174.62 172.63 1uwx s GLN 8 N 0.85 2.16 0.13 4.92 0.74 -1.26 -0.54 119.66 126.65 1uwx s GLN 8 Ca 0.07 -1.43 0.08 0.00 0.05 0.00 0.00 55.36 54.13 1uwx s GLN 8 Cb -0.13 -3.06 -0.04 0.00 1.10 0.00 0.00 33.01 30.88 1uwx s GLN 8 CO 0.03 -0.67 -0.12 0.95 -0.55 0.00 0.00 175.29 174.93 1uwx s THR 9 N 1.11 3.20 0.81 -0.34 -4.23 -1.24 -4.34 115.64 110.62 1uwx s THR 9 Ca -0.04 -1.42 -0.05 0.00 -1.18 0.00 0.00 61.69 59.00 1uwx s THR 9 Cb -0.20 -2.51 0.17 0.00 1.34 0.00 0.00 72.50 71.29 1uwx s THR 9 CO -0.04 0.05 1.11 -2.16 -0.54 0.00 0.00 174.62 173.04 1uwx s PRO 10 N -2.36 1.21 0.21 3.99 0.05 -1.26 -2.71 135.00 134.13 1uwx s PRO 10 Ca 0.21 -1.05 0.00 0.00 0.05 0.00 0.00 61.00 60.21 1uwx s PRO 10 Cb -0.10 -2.19 0.17 0.00 0.05 0.00 0.00 34.50 32.43 1uwx s PRO 10 CO 0.13 -1.85 1.52 0.00 0.05 0.00 0.00 177.00 176.86 1uwx h ALA 11 N -0.92 0.76 -3.77 8.56 0.00 -1.82 -3.42 119.26 118.65 1uwx h ALA 11 Ca -0.37 -0.53 -0.35 0.00 0.00 0.00 0.00 54.91 53.66 1uwx h ALA 11 Cb 1.25 -0.08 -0.30 0.00 0.00 0.00 0.00 17.79 18.66 1uwx h ALA 11 CO 0.36 0.71 -0.76 0.45 0.00 0.00 0.00 179.25 180.01 1uwx s SER 12 N -6.92 0.69 -0.06 0.00 0.15 -1.26 -2.27 113.70 104.02 1uwx s SER 12 Ca -0.06 -0.10 0.01 0.00 0.70 0.00 0.00 55.95 56.50 1uwx s SER 12 Cb 0.11 -0.17 0.02 0.00 -1.71 0.00 0.00 66.02 64.28 1uwx s SER 12 CO 0.82 0.02 -0.06 -1.10 1.20 0.00 0.00 173.24 174.13 1uwx s GLN 13 N 0.22 1.06 -0.07 5.44 -1.52 -0.62 -4.97 119.66 119.21 1uwx s GLN 13 Ca -0.02 -0.15 -0.14 0.00 -1.95 0.00 0.00 55.36 53.10 1uwx s GLN 13 Cb -0.06 -1.09 -0.05 0.00 -0.22 0.00 0.00 33.01 31.59 1uwx s GLN 13 CO -0.00 -0.13 0.35 -1.12 -0.25 0.00 0.00 175.29 174.14 1uwx s SER 14 N 1.19 6.65 0.36 5.90 0.01 -1.26 -0.71 113.70 125.83 1uwx s SER 14 Ca -0.06 0.78 -0.09 0.00 1.31 0.00 0.00 55.95 57.89 1uwx s SER 14 Cb -0.14 -2.21 0.03 0.00 0.21 0.00 0.00 66.02 63.91 1uwx s SER 14 CO -0.02 0.25 0.63 0.00 0.41 0.00 0.00 173.24 174.51 1uwx n ALA 15 N 2.45 -1.08 -2.47 1.44 0.00 -0.72 -4.91 120.51 115.22 1uwx n ALA 15 Ca -0.14 -1.36 -0.23 0.00 0.00 0.00 0.00 53.44 51.71 1uwx n ALA 15 Cb 0.52 1.09 -0.10 0.00 0.00 0.00 0.00 19.45 20.96 1uwx n ALA 15 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1uwx s SER 16 N -3.02 3.16 0.23 0.00 0.01 -1.26 -0.85 113.70 111.97 1uwx s SER 16 Ca 0.21 -1.18 -0.32 0.00 1.31 0.00 0.00 55.95 55.97 1uwx s SER 16 Cb -0.03 -0.24 -0.13 0.00 0.21 0.00 0.00 66.02 65.83 1uwx s SER 16 CO 0.15 -0.26 1.59 0.18 0.41 0.00 0.00 173.24 175.31 1uwx n LEU 17 N -0.66 3.73 0.00 2.44 4.77 -1.26 -2.40 117.00 123.62 1uwx n LEU 17 Ca -0.05 1.11 0.00 0.00 -0.03 0.00 0.00 56.01 57.04 1uwx n LEU 17 Cb 0.63 -1.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.20 1uwx n LEU 17 CO 0.41 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1uwx n GLY 18 N 2.89 1.82 3.92 -0.72 0.00 -0.60 -4.87 105.19 107.63 1uwx n GLY 18 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 1uwx n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uwx s GLU 19 N -0.18 3.01 0.06 1.61 2.02 -1.01 -4.46 118.70 119.75 1uwx s GLU 19 Ca 0.00 -0.09 0.04 0.00 0.02 0.00 0.00 54.97 54.94 1uwx s GLU 19 Cb 0.00 -2.34 -0.04 0.00 0.10 0.00 0.00 34.13 31.85 1uwx s GLU 19 CO 0.00 -0.56 -0.01 -1.54 0.02 0.00 0.00 175.26 173.17 1uwx s SER 20 N -4.27 4.99 0.09 -0.19 1.04 -1.25 -1.79 113.70 112.32 1uwx s SER 20 Ca 0.52 -0.14 0.05 0.00 0.48 0.00 0.00 55.95 56.85 1uwx s SER 20 Cb -0.10 -1.21 -0.03 0.00 0.10 0.00 0.00 66.02 64.78 1uwx s SER 20 CO 0.44 0.21 -0.12 0.68 0.98 0.00 0.00 173.24 175.42 1uwx s VAL 21 N -1.23 1.05 -0.08 5.02 -7.23 -0.80 -5.02 120.40 112.11 1uwx s VAL 21 Ca 0.24 -1.49 0.02 0.00 -1.81 0.00 0.00 61.98 58.93 1uwx s VAL 21 Cb -0.12 -1.23 0.01 0.00 0.56 0.00 0.00 36.38 35.61 1uwx s VAL 21 CO 0.16 -0.40 -0.13 -0.89 -0.31 0.00 0.00 175.10 173.52 1uwx s THR 22 N -1.88 1.27 -0.09 5.32 2.01 -1.26 -2.22 115.64 118.79 1uwx s THR 22 Ca 0.02 -0.54 -0.01 0.00 0.31 0.00 0.00 61.69 61.47 1uwx s THR 22 Cb -0.06 -1.16 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 1uwx s THR 22 CO 0.01 0.39 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.68 1uwx s ILE 23 N 0.78 4.06 0.40 1.82 1.01 0.05 -4.94 121.20 124.38 1uwx s ILE 23 Ca -0.12 -0.34 0.06 0.00 0.00 0.00 0.00 60.65 60.26 1uwx s ILE 23 Cb -0.16 -2.71 0.00 0.00 0.01 0.00 0.00 42.46 39.61 1uwx s ILE 23 CO 0.02 0.58 0.56 0.42 0.00 0.00 0.00 174.94 176.52 1uwx s THR 24 N -0.62 3.45 -0.26 2.92 -4.23 -1.10 -0.81 115.64 114.99 1uwx s THR 24 Ca 0.10 -0.93 -0.06 0.00 -1.18 0.00 0.00 61.69 59.61 1uwx s THR 24 Cb -0.12 -3.19 0.13 0.00 1.34 0.00 0.00 72.50 70.66 1uwx s THR 24 CO 0.02 -0.08 0.54 0.00 -0.54 0.00 0.00 174.62 174.56 1uwx s LEU 26 N 2.77 3.24 0.36 0.00 2.96 0.30 -1.81 118.68 126.50 1uwx s LEU 26 Ca 0.03 -0.25 -0.19 0.00 -0.22 0.00 0.00 54.13 53.50 1uwx s LEU 26 Cb -0.13 -1.84 -0.10 0.00 0.50 0.00 0.00 46.19 44.62 1uwx s LEU 26 CO -0.17 0.01 0.86 0.00 -1.32 0.00 0.00 176.35 175.72 1uwx s ALA 27 N 1.35 3.19 0.23 5.97 0.00 -0.48 -1.39 121.76 130.62 1uwx s ALA 27 Ca 0.04 0.27 -0.01 0.00 0.00 0.00 0.00 51.96 52.27 1uwx s ALA 27 Cb -0.15 -3.00 0.24 0.00 0.00 0.00 0.00 23.12 20.22 1uwx s ALA 27 CO 0.01 0.22 1.61 1.03 0.00 0.00 0.00 175.76 178.63 1uwx h SER 28 N 2.29 0.59 -2.80 0.00 0.87 -1.33 -3.46 113.55 109.70 1uwx h SER 28 Ca -0.48 -0.25 -0.52 0.00 -1.23 0.00 0.00 61.79 59.30 1uwx h SER 28 Cb 1.18 -0.16 -0.14 0.00 -0.44 0.00 0.00 62.40 62.84 1uwx h SER 28 CO 0.63 0.91 -0.59 -1.10 -0.53 0.00 0.00 176.83 176.15 1uwx s GLN 29 N -4.29 1.77 0.11 2.24 -0.21 -1.26 -4.97 119.66 113.05 1uwx s GLN 29 Ca -0.07 -2.01 -0.31 0.00 0.02 0.00 0.00 55.36 52.98 1uwx s GLN 29 Cb 0.13 -0.99 -0.09 0.00 1.00 0.00 0.00 33.01 33.05 1uwx s GLN 29 CO 0.82 -0.22 1.59 0.95 -2.12 0.00 0.00 175.29 176.31 1uwx s THR 30 N -3.17 2.89 -0.36 -0.19 -4.23 -1.26 -4.63 115.64 104.69 1uwx s THR 30 Ca 0.33 0.52 0.04 0.00 -1.18 0.00 0.00 61.69 61.39 1uwx s THR 30 Cb 0.08 -3.33 0.10 0.00 1.34 0.00 0.00 72.50 70.68 1uwx s THR 30 CO 0.15 0.02 1.02 -0.38 -0.54 0.00 0.00 174.62 174.89 1uwx n ILE 31 N 4.33 0.84 0.00 2.99 -0.00 0.03 -5.02 119.36 122.53 1uwx n ILE 31 Ca 0.15 -0.92 0.00 0.00 -0.00 0.00 0.00 62.75 61.98 1uwx n ILE 31 Cb 0.40 0.60 0.00 0.00 -0.00 0.00 0.00 39.64 40.63 1uwx n ILE 31 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1uwx n GLY 32 N -0.07 3.60 0.04 7.39 0.00 -1.25 -2.11 105.19 112.77 1uwx n GLY 32 Ca 0.04 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1uwx n GLY 32 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uwx n THR 33 N 0.00 0.45 -1.33 2.61 -2.24 -1.26 -1.40 114.28 111.11 1uwx n THR 33 Ca 0.00 -0.47 -0.41 0.00 -2.27 0.00 0.00 64.05 60.91 1uwx n THR 33 Cb 0.00 0.73 -0.06 0.00 -2.10 0.00 0.00 70.33 68.90 1uwx n THR 33 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 1uwx n TRP 34 N -0.25 2.05 -3.76 4.78 7.02 -0.90 -3.02 117.44 123.37 1uwx n TRP 34 Ca 0.01 -1.75 -0.13 0.00 -1.02 0.00 0.00 57.50 54.61 1uwx n TRP 34 Cb 0.43 -1.88 -0.12 0.00 -2.42 0.00 0.00 31.31 27.31 1uwx n TRP 34 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 1uwx s LEU 35 N 3.03 0.75 0.09 -0.99 2.96 -1.26 -0.51 118.68 122.75 1uwx s LEU 35 Ca 0.59 0.51 0.07 0.00 -0.22 0.00 0.00 54.13 55.09 1uwx s LEU 35 Cb 0.12 0.79 -0.03 0.00 0.50 0.00 0.00 46.19 47.56 1uwx s LEU 35 CO 0.12 -0.12 -0.19 0.00 -1.32 0.00 0.00 176.35 174.83 1uwx s ALA 36 N 0.69 1.67 -0.05 5.97 0.00 -0.36 -1.64 121.76 128.04 1uwx s ALA 36 Ca -0.05 -1.18 0.05 0.00 0.00 0.00 0.00 51.96 50.79 1uwx s ALA 36 Cb -0.06 -0.22 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 1uwx s ALA 36 CO -0.04 0.32 -0.20 -1.58 0.00 0.00 0.00 175.76 174.27 1uwx s TRP 37 N -1.15 2.55 0.08 0.00 0.52 0.57 -0.92 118.94 120.58 1uwx s TRP 37 Ca 0.05 -0.40 0.08 0.00 0.02 0.00 0.00 56.10 55.85 1uwx s TRP 37 Cb -0.10 -1.61 -0.03 0.00 -1.15 0.00 0.00 33.47 30.59 1uwx s TRP 37 CO 0.04 0.00 -0.21 0.71 0.02 0.00 0.00 176.95 177.51 1uwx s TYR 38 N -0.48 1.80 -0.03 -1.98 1.51 0.13 -0.51 117.35 117.79 1uwx s TYR 38 Ca 0.06 -0.40 -0.00 0.00 -1.01 0.00 0.00 57.07 55.72 1uwx s TYR 38 Cb -0.12 -1.02 -0.04 0.00 -0.11 0.00 0.00 41.96 40.67 1uwx s TYR 38 CO 0.01 0.15 0.02 -1.14 -1.11 0.00 0.00 175.55 173.48 1uwx s GLN 39 N -1.57 2.91 -0.17 -0.62 0.74 0.81 -1.26 119.66 120.49 1uwx s GLN 39 Ca 0.07 -0.51 -0.01 0.00 0.05 0.00 0.00 55.36 54.96 1uwx s GLN 39 Cb -0.09 -2.75 0.05 0.00 1.10 0.00 0.00 33.01 31.31 1uwx s GLN 39 CO 0.03 0.66 -0.01 -1.14 -0.55 0.00 0.00 175.29 174.28 1uwx s GLN 40 N -1.34 1.02 0.54 1.67 0.74 0.16 -0.81 119.66 121.65 1uwx s GLN 40 Ca 0.18 -0.45 -0.14 0.00 0.05 0.00 0.00 55.36 55.00 1uwx s GLN 40 Cb -0.12 -1.99 -0.06 0.00 1.10 0.00 0.00 33.01 31.95 1uwx s GLN 40 CO 0.08 -0.52 0.98 0.15 -0.55 0.00 0.00 175.29 175.43 1uwx s LYS 41 N 1.74 3.80 0.06 1.67 1.02 -1.26 -2.64 119.74 124.14 1uwx s LYS 41 Ca -0.00 0.82 -0.33 0.00 0.02 0.00 0.00 55.97 56.48 1uwx s LYS 41 Cb -0.16 -2.14 -0.12 0.00 -0.52 0.00 0.00 37.83 34.89 1uwx s LYS 41 CO -0.07 -0.36 1.77 -2.30 -0.92 0.00 0.00 175.35 173.47 1uwx n PRO 42 N -2.01 2.39 -1.00 -1.68 -0.02 -1.26 -2.10 135.00 129.33 1uwx n PRO 42 Ca 0.06 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 1uwx n PRO 42 Cb 0.54 -2.71 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 1uwx n PRO 42 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uwx n GLY 43 N 4.04 0.45 3.64 -1.23 0.00 -1.26 -5.03 105.19 105.79 1uwx n GLY 43 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 1uwx n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uwx s LYS 44 N -0.26 1.99 0.37 1.61 -0.14 -0.89 -5.14 119.74 117.27 1uwx s LYS 44 Ca 0.00 -2.14 -0.09 0.00 -1.36 0.00 0.00 55.97 52.37 1uwx s LYS 44 Cb 0.00 -1.61 -0.06 0.00 -1.68 0.00 0.00 37.83 34.47 1uwx s LYS 44 CO 0.00 -0.09 0.71 -1.54 -0.76 0.00 0.00 175.35 173.67 1uwx s SER 45 N -3.73 6.52 0.74 2.83 1.04 -1.26 -4.69 113.70 115.15 1uwx s SER 45 Ca 0.31 1.03 -0.16 0.00 0.48 0.00 0.00 55.95 57.61 1uwx s SER 45 Cb 0.09 -2.28 -0.04 0.00 0.10 0.00 0.00 66.02 63.89 1uwx s SER 45 CO 0.16 -0.33 0.47 -2.65 0.98 0.00 0.00 173.24 171.87 1uwx n PRO 46 N -1.14 0.24 -3.77 4.02 -0.02 -1.26 -4.65 135.00 128.42 1uwx n PRO 46 Ca 0.01 0.12 -0.15 0.00 -2.02 0.00 0.00 63.50 61.47 1uwx n PRO 46 Cb 0.54 -1.79 -0.16 0.00 -0.02 0.00 0.00 33.50 32.07 1uwx n PRO 46 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1uwx s GLN 47 N -2.76 -0.03 0.20 -0.52 0.74 0.01 -4.94 119.66 112.35 1uwx s GLN 47 Ca 0.64 0.19 -0.31 0.00 0.05 0.00 0.00 55.36 55.93 1uwx s GLN 47 Cb -0.34 -0.24 -0.10 0.00 1.10 0.00 0.00 33.01 33.44 1uwx s GLN 47 CO 0.59 -0.16 1.47 -1.17 -0.55 0.00 0.00 175.29 175.47 1uwx s LEU 48 N 1.03 4.38 -0.09 3.68 2.96 -1.26 -0.14 118.68 129.25 1uwx s LEU 48 Ca -0.09 2.58 -0.02 0.00 -0.22 0.00 0.00 54.13 56.39 1uwx s LEU 48 Cb -0.12 -3.61 -0.05 0.00 0.50 0.00 0.00 46.19 42.91 1uwx s LEU 48 CO -0.03 -0.73 -0.09 0.18 -1.32 0.00 0.00 176.35 174.36 1uwx n LEU 49 N 3.16 1.99 -3.87 -0.68 4.32 0.34 -4.81 117.00 117.43 1uwx n LEU 49 Ca 0.10 0.02 -0.18 0.00 -0.02 0.00 0.00 56.01 55.93 1uwx n LEU 49 Cb 0.40 -0.28 -0.16 0.00 -1.62 0.00 0.00 43.42 41.76 1uwx n LEU 49 CO 0.60 0.45 -0.39 -0.63 -1.22 0.00 0.00 177.39 176.20 1uwx s ILE 50 N -2.17 0.35 0.26 -0.08 -1.09 -1.08 -0.89 121.20 116.51 1uwx s ILE 50 Ca -0.12 -0.05 0.08 0.00 -2.23 0.00 0.00 60.65 58.33 1uwx s ILE 50 Cb 0.04 -0.39 -0.05 0.00 -1.58 0.00 0.00 42.46 40.48 1uwx s ILE 50 CO 0.18 0.17 -0.12 -0.72 -1.23 0.00 0.00 174.94 173.22 1uwx s TYR 51 N 0.73 1.99 -1.46 3.97 -0.85 -0.23 -0.32 117.35 121.18 1uwx s TYR 51 Ca -0.08 -0.57 -0.09 0.00 -0.52 0.00 0.00 57.07 55.81 1uwx s TYR 51 Cb -0.12 -1.02 0.04 0.00 0.38 0.00 0.00 41.96 41.25 1uwx s TYR 51 CO -0.01 0.42 0.75 0.00 -1.52 0.00 0.00 175.55 175.19 1uwx n ALA 52 N -0.55 -1.12 0.00 9.51 0.00 -0.93 -1.11 120.51 126.31 1uwx n ALA 52 Ca -0.06 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1uwx n ALA 52 Cb 0.62 -4.00 0.00 0.00 0.00 0.00 0.00 19.45 16.07 1uwx n ALA 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uwx n ALA 53 N -4.02 0.00 -0.12 0.00 0.00 -0.65 -4.23 120.51 111.49 1uwx n ALA 53 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1uwx n ALA 53 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 1uwx n ALA 53 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1uwx n THR 54 N 0.00 0.00 -3.27 0.00 -2.24 -1.17 -3.26 114.28 104.33 1uwx n THR 54 Ca 0.00 -0.22 -0.39 0.00 -2.27 0.00 0.00 64.05 61.17 1uwx n THR 54 Cb 0.00 1.12 -0.07 0.00 -2.10 0.00 0.00 70.33 69.29 1uwx n THR 54 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1uwx s SER 55 N -0.34 6.58 -0.01 3.42 0.01 -0.27 -4.58 113.70 118.51 1uwx s SER 55 Ca 0.00 0.70 -0.30 0.00 1.31 0.00 0.00 55.95 57.66 1uwx s SER 55 Cb 0.00 -2.29 -0.04 0.00 0.21 0.00 0.00 66.02 63.91 1uwx s SER 55 CO 0.00 -0.13 1.12 -0.76 0.41 0.00 0.00 173.24 173.88 1uwx s LEU 56 N 1.36 4.33 0.73 2.44 1.43 -1.26 -1.06 118.68 126.63 1uwx s LEU 56 Ca 0.24 1.80 -0.14 0.00 -1.03 0.00 0.00 54.13 55.01 1uwx s LEU 56 Cb -0.15 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.54 1uwx s LEU 56 CO 0.10 -0.45 1.14 0.00 0.23 0.00 0.00 176.35 177.37 1uwx s ALA 57 N 1.51 2.21 0.29 4.21 0.00 -0.07 -4.93 121.76 124.98 1uwx s ALA 57 Ca 0.55 0.63 -0.30 0.00 0.00 0.00 0.00 51.96 52.84 1uwx s ALA 57 Cb -0.24 -3.38 -0.11 0.00 0.00 0.00 0.00 23.12 19.39 1uwx s ALA 57 CO 0.25 -1.70 1.50 -0.51 0.00 0.00 0.00 175.76 175.29 1uwx s ASP 58 N -2.50 6.52 0.00 0.00 1.01 -1.26 -2.38 116.67 118.05 1uwx s ASP 58 Ca 0.69 2.82 0.00 0.00 0.71 0.00 0.00 52.55 56.77 1uwx s ASP 58 Cb -0.23 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.06 1uwx s ASP 58 CO 0.46 -0.79 0.00 0.61 0.21 0.00 0.00 175.17 175.66 1uwx n GLY 59 N 1.90 0.58 3.73 0.21 0.00 -1.26 -5.02 105.19 105.33 1uwx n GLY 59 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1uwx n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uwx s VAL 60 N -2.63 4.74 0.45 1.61 1.01 -1.00 -5.03 120.40 119.55 1uwx s VAL 60 Ca 0.00 1.85 -0.25 0.00 0.00 0.00 0.00 61.98 63.58 1uwx s VAL 60 Cb 0.00 -4.22 -0.08 0.00 0.00 0.00 0.00 36.38 32.08 1uwx s VAL 60 CO 0.00 0.28 1.43 -2.84 0.00 0.00 0.00 175.10 173.97 1uwx s PRO 61 N 0.36 3.67 0.51 2.72 0.02 -1.26 -4.93 135.00 136.09 1uwx s PRO 61 Ca 0.44 2.43 0.36 0.00 0.02 0.00 0.00 61.00 64.26 1uwx s PRO 61 Cb -0.21 -2.65 1.52 0.00 0.02 0.00 0.00 34.50 33.17 1uwx s PRO 61 CO 0.26 -0.83 1.70 0.77 -0.33 0.00 0.00 177.00 178.57 1uwx h SER 62 N 2.31 0.11 -0.67 2.53 0.02 -2.00 -2.66 113.55 113.19 1uwx h SER 62 Ca -0.51 0.04 0.15 0.00 -0.84 0.00 0.00 61.79 60.63 1uwx h SER 62 Cb 1.27 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.80 1uwx h SER 62 CO 0.61 -0.03 0.46 0.03 -1.14 0.00 0.00 176.83 176.76 1uwx h ARG 63 N 0.07 0.25 -6.68 3.45 3.08 -1.95 -3.42 114.38 109.18 1uwx h ARG 63 Ca 0.72 -0.01 -0.50 0.00 0.07 0.00 0.00 59.98 60.25 1uwx h ARG 63 Cb 2.62 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 32.60 1uwx h ARG 63 CO -0.13 0.16 0.38 -0.06 -1.07 0.00 0.00 179.97 179.25 1uwx s PHE 64 N -5.25 3.84 0.14 3.04 0.40 -1.00 -2.01 117.98 117.13 1uwx s PHE 64 Ca -0.07 1.82 -0.17 0.00 -0.60 0.00 0.00 56.93 57.91 1uwx s PHE 64 Cb 0.20 -3.07 0.04 0.00 0.51 0.00 0.00 43.02 40.70 1uwx s PHE 64 CO 0.75 0.14 0.43 -1.54 0.70 0.00 0.00 175.22 175.71 1uwx s SER 65 N -0.61 -0.27 0.08 1.36 1.04 -0.18 -5.00 113.70 110.13 1uwx s SER 65 Ca 0.44 -0.31 0.02 0.00 0.48 0.00 0.00 55.95 56.58 1uwx s SER 65 Cb -0.26 0.50 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 1uwx s SER 65 CO 0.32 -0.89 -0.07 -0.83 0.98 0.00 0.00 173.24 172.76 1uwx s GLY 66 N -2.81 0.70 0.10 7.32 0.00 -1.26 -0.61 107.32 110.76 1uwx s GLY 66 Ca 0.04 -1.23 -0.15 0.00 0.00 0.00 0.00 44.72 43.38 1uwx s GLY 66 CO -0.11 -1.32 0.35 -1.35 0.00 0.00 0.00 173.10 170.67 1uwx s SER 67 N -2.75 -0.16 0.00 1.64 1.04 0.13 -4.45 113.70 109.15 1uwx s SER 67 Ca 0.07 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.16 1uwx s SER 67 Cb 0.02 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.58 1uwx s SER 67 CO -0.04 -0.80 0.00 0.61 0.98 0.00 0.00 173.24 173.99 1uwx n GLY 68 N -0.07 1.93 3.62 7.32 0.00 -1.26 -0.39 105.19 116.34 1uwx n GLY 68 Ca -0.16 -2.16 -0.04 0.00 0.00 0.00 0.00 46.02 43.66 1uwx n GLY 68 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uwx s SER 69 N 0.00 -0.10 0.04 1.61 1.04 -1.18 -4.86 113.70 110.26 1uwx s SER 69 Ca 0.00 0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.49 1uwx s SER 69 Cb 0.00 0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.21 1uwx s SER 69 CO 0.00 -0.12 0.00 0.61 0.98 0.00 0.00 173.24 174.71 1uwx n GLY 70 N 0.28 1.42 0.00 7.32 0.00 -0.49 -4.13 105.19 109.59 1uwx n GLY 70 Ca -0.00 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1uwx n GLY 70 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uwx n THR 71 N 0.00 0.00 -3.48 2.61 -2.24 -1.26 -0.79 114.28 109.12 1uwx n THR 71 Ca 0.00 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.40 1uwx n THR 71 Cb 0.00 -0.47 -0.09 0.00 -2.10 0.00 0.00 70.33 67.67 1uwx n THR 71 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1uwx s LYS 72 N -1.69 4.05 0.01 -0.78 2.20 -1.26 -1.39 119.74 120.88 1uwx s LYS 72 Ca 0.00 -0.05 0.03 0.00 -0.36 0.00 0.00 55.97 55.58 1uwx s LYS 72 Cb 0.00 -3.61 -0.01 0.00 -1.51 0.00 0.00 37.83 32.70 1uwx s LYS 72 CO 0.00 -0.15 -0.08 -0.06 -0.36 0.00 0.00 175.35 174.70 1uwx s PHE 73 N 1.67 0.71 0.09 4.03 0.40 -0.75 -3.08 117.98 121.05 1uwx s PHE 73 Ca 0.13 -0.24 0.03 0.00 -0.60 0.00 0.00 56.93 56.25 1uwx s PHE 73 Cb -0.15 -0.44 -0.04 0.00 0.51 0.00 0.00 43.02 42.90 1uwx s PHE 73 CO 0.09 -0.02 -0.09 -1.12 0.70 0.00 0.00 175.22 174.77 1uwx s SER 74 N -0.66 1.32 -0.09 1.36 0.01 0.47 -1.37 113.70 114.76 1uwx s SER 74 Ca -0.01 -0.82 0.01 0.00 1.31 0.00 0.00 55.95 56.45 1uwx s SER 74 Cb -0.05 0.03 0.02 0.00 0.21 0.00 0.00 66.02 66.22 1uwx s SER 74 CO 0.00 -0.29 -0.11 0.12 0.41 0.00 0.00 173.24 173.37 1uwx s PHE 75 N -2.54 1.50 -0.03 2.43 5.36 0.01 -0.69 117.98 124.02 1uwx s PHE 75 Ca 0.05 -0.64 0.06 0.00 -0.96 0.00 0.00 56.93 55.44 1uwx s PHE 75 Cb -0.02 -1.15 -0.01 0.00 -0.34 0.00 0.00 43.02 41.49 1uwx s PHE 75 CO -0.01 -0.38 -0.21 0.21 -1.46 0.00 0.00 175.22 173.37 1uwx s LYS 76 N 1.05 1.90 -0.14 10.12 2.20 0.21 -0.77 119.74 134.32 1uwx s LYS 76 Ca -0.07 -0.77 -0.00 0.00 -0.36 0.00 0.00 55.97 54.77 1uwx s LYS 76 Cb -0.15 -1.76 -0.01 0.00 -1.51 0.00 0.00 37.83 34.41 1uwx s LYS 76 CO -0.01 0.41 -0.14 0.42 -0.36 0.00 0.00 175.35 175.68 1uwx s ILE 77 N -0.35 2.91 -0.04 5.43 1.01 -0.94 -1.02 121.20 128.21 1uwx s ILE 77 Ca 0.04 -0.70 0.13 0.00 0.00 0.00 0.00 60.65 60.12 1uwx s ILE 77 Cb -0.10 -2.23 -0.23 0.00 0.01 0.00 0.00 42.46 39.91 1uwx s ILE 77 CO 0.01 0.52 0.67 -1.54 0.00 0.00 0.00 174.94 174.59 1uwx n SER 78 N 3.78 0.88 -3.45 3.58 3.41 -0.85 -1.90 113.62 119.07 1uwx n SER 78 Ca -0.18 0.42 -0.14 0.00 -0.26 0.00 0.00 58.87 58.71 1uwx n SER 78 Cb 0.52 -0.07 -0.11 0.00 -0.26 0.00 0.00 64.21 64.30 1uwx n SER 78 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1uwx s SER 79 N -6.09 0.75 0.17 4.04 0.01 -1.25 -3.78 113.70 107.54 1uwx s SER 79 Ca -0.05 0.08 -0.30 0.00 1.31 0.00 0.00 55.95 56.99 1uwx s SER 79 Cb 0.08 0.76 -0.08 0.00 0.21 0.00 0.00 66.02 66.99 1uwx s SER 79 CO 0.83 -0.30 1.24 -0.76 0.41 0.00 0.00 173.24 174.65 1uwx s LEU 80 N 2.44 4.42 0.24 2.44 1.43 -0.74 -4.70 118.68 124.21 1uwx s LEU 80 Ca 0.09 2.25 0.08 0.00 -1.03 0.00 0.00 54.13 55.52 1uwx s LEU 80 Cb -0.15 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.43 1uwx s LEU 80 CO -0.13 -0.45 0.09 -1.10 0.23 0.00 0.00 176.35 174.98 1uwx s GLN 81 N 0.09 2.60 0.34 1.70 -0.21 -1.26 -1.56 119.66 121.36 1uwx s GLN 81 Ca 0.56 -1.20 0.17 0.00 0.02 0.00 0.00 55.36 54.91 1uwx s GLN 81 Cb -0.34 -2.38 1.18 0.00 1.00 0.00 0.00 33.01 32.48 1uwx s GLN 81 CO 0.35 0.40 1.48 0.00 -2.12 0.00 0.00 175.29 175.40 1uwx n ALA 82 N -0.88 0.89 0.31 6.09 0.00 -1.26 -0.39 120.51 125.28 1uwx n ALA 82 Ca -0.08 0.96 0.16 0.00 0.00 0.00 0.00 53.44 54.49 1uwx n ALA 82 Cb 0.58 -0.92 0.70 0.00 0.00 0.00 0.00 19.45 19.81 1uwx n ALA 82 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1uwx h GLU 83 N 0.00 0.00 0.00 0.00 5.08 -2.02 -3.24 114.58 114.39 1uwx h GLU 83 Ca 0.76 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.12 1uwx h GLU 83 Cb 1.97 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.22 1uwx h GLU 83 CO -0.75 0.00 -0.24 -0.25 -1.00 0.00 0.00 179.01 176.77 1uwx n ASP 84 N -2.75 0.73 -3.74 1.42 8.00 0.48 -4.56 116.55 116.14 1uwx n ASP 84 Ca 0.00 0.38 -0.42 0.00 0.71 0.00 0.00 54.79 55.47 1uwx n ASP 84 Cb 0.22 -0.41 -0.00 0.00 -0.02 0.00 0.00 41.12 40.91 1uwx n ASP 84 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1uwx n PHE 85 N -2.16 3.09 -2.85 1.24 3.01 -1.23 -4.80 117.46 113.77 1uwx n PHE 85 Ca 0.05 -2.88 0.00 0.00 1.01 0.00 0.00 57.45 55.63 1uwx n PHE 85 Cb 0.43 -2.21 0.00 0.00 -0.01 0.00 0.00 39.48 37.69 1uwx n PHE 85 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 1uwx n VAL 86 N 3.88 0.00 -3.82 -4.37 0.24 -1.24 -4.70 118.33 108.33 1uwx n VAL 86 Ca 0.49 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 62.47 1uwx n VAL 86 Cb 0.35 0.00 -0.04 0.00 -1.47 0.00 0.00 33.84 32.68 1uwx n VAL 86 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1uwx s SER 87 N 1.00 6.42 -0.01 -1.34 0.01 -1.08 -1.30 113.70 117.40 1uwx s SER 87 Ca 0.00 0.41 0.02 0.00 1.31 0.00 0.00 55.95 57.69 1uwx s SER 87 Cb 0.00 -2.02 -0.00 0.00 0.21 0.00 0.00 66.02 64.21 1uwx s SER 87 CO 0.00 0.13 -0.06 -0.31 0.41 0.00 0.00 173.24 173.41 1uwx s TYR 88 N -1.55 0.64 -0.03 2.43 1.51 0.05 -0.66 117.35 119.73 1uwx s TYR 88 Ca 0.37 -0.13 0.04 0.00 -1.01 0.00 0.00 57.07 56.34 1uwx s TYR 88 Cb -0.13 -0.44 -0.00 0.00 -0.11 0.00 0.00 41.96 41.28 1uwx s TYR 88 CO 0.26 -0.04 -0.15 0.71 -1.11 0.00 0.00 175.55 175.21 1uwx s TYR 89 N 0.02 1.52 0.33 2.71 1.51 -0.39 -1.36 117.35 121.68 1uwx s TYR 89 Ca 0.00 -0.40 -0.04 0.00 -1.01 0.00 0.00 57.07 55.62 1uwx s TYR 89 Cb -0.05 -1.02 -0.05 0.00 -0.11 0.00 0.00 41.96 40.73 1uwx s TYR 89 CO -0.00 -0.13 0.59 0.00 -1.11 0.00 0.00 175.55 174.90 1uwx s GLN 91 N -3.87 0.11 -0.12 0.00 0.74 -0.10 0.28 119.66 116.69 1uwx s GLN 91 Ca 0.44 0.29 -0.21 0.00 0.05 0.00 0.00 55.36 55.93 1uwx s GLN 91 Cb -0.10 -0.09 -0.03 0.00 1.10 0.00 0.00 33.01 33.88 1uwx s GLN 91 CO 0.33 -0.11 0.62 -1.14 -0.55 0.00 0.00 175.29 174.44 1uwx s GLN 92 N 0.75 4.34 -0.22 1.67 -0.44 -0.29 -1.23 119.66 124.25 1uwx s GLN 92 Ca -0.06 0.68 0.11 0.00 -2.50 0.00 0.00 55.36 53.59 1uwx s GLN 92 Cb -0.08 -3.49 0.43 0.00 -1.64 0.00 0.00 33.01 28.24 1uwx s GLN 92 CO -0.04 -0.01 1.21 1.28 0.50 0.00 0.00 175.29 178.23 1uwx n LEU 93 N 4.17 3.15 -0.07 3.68 4.77 0.33 -3.86 117.00 129.17 1uwx n LEU 93 Ca -0.03 -4.00 -0.22 0.00 -0.03 0.00 0.00 56.01 51.73 1uwx n LEU 93 Cb 0.51 -0.44 -0.12 0.00 -2.33 0.00 0.00 43.42 41.04 1uwx n LEU 93 CO 0.45 1.53 -0.77 -0.24 -1.33 0.00 0.00 177.39 177.03 1uwx n SER 94 N -0.93 1.97 -3.76 -1.43 2.88 -1.26 -4.91 113.62 106.18 1uwx n SER 94 Ca 0.24 0.31 -0.13 0.00 -1.33 0.00 0.00 58.87 57.96 1uwx n SER 94 Cb 0.78 -0.88 -0.09 0.00 -0.75 0.00 0.00 64.21 63.27 1uwx n SER 94 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1uwx s SER 95 N -6.97 -0.18 0.39 -3.46 1.04 -1.26 -5.14 113.70 98.11 1uwx s SER 95 Ca -0.28 0.07 -0.25 0.00 0.48 0.00 0.00 55.95 55.97 1uwx s SER 95 Cb 0.07 0.31 -0.09 0.00 0.10 0.00 0.00 66.02 66.41 1uwx s SER 95 CO 0.64 -0.45 1.08 0.42 0.98 0.00 0.00 173.24 175.91 1uwx s THR 95 N -1.35 3.58 0.33 2.02 -4.23 -1.26 -3.94 115.64 110.79 1uwx s THR 95 Ca -0.13 1.27 -0.26 0.00 -1.18 0.00 0.00 61.69 61.38 1uwx s THR 95 Cb -0.05 -3.69 -0.10 0.00 1.34 0.00 0.00 72.50 70.01 1uwx s THR 95 CO 0.04 0.06 0.97 -2.16 -0.54 0.00 0.00 174.62 173.00 1uwx s PRO 95 N -2.35 4.54 -1.15 3.99 0.04 -1.26 -4.82 135.00 133.99 1uwx s PRO 95 Ca 0.56 1.41 -0.19 0.00 0.04 0.00 0.00 61.00 62.82 1uwx s PRO 95 Cb -0.25 -2.82 -0.04 0.00 0.04 0.00 0.00 34.50 31.43 1uwx s PRO 95 CO 0.31 0.22 2.00 0.66 0.04 0.00 0.00 177.00 180.23 1uwx n TYR 96 N 0.57 3.01 -1.68 0.56 0.53 -1.25 -4.78 117.16 114.11 1uwx n TYR 96 Ca 0.02 -2.32 -0.44 0.00 -1.02 0.00 0.00 57.90 54.15 1uwx n TYR 96 Cb 0.49 -2.28 -0.02 0.00 -1.03 0.00 0.00 39.34 36.51 1uwx n TYR 96 CO 0.00 0.00 0.00 2.41 -1.02 0.00 0.00 176.86 178.25 1uwx n THR 97 N 6.04 1.36 -3.50 -0.72 -1.04 -1.25 -4.61 114.28 110.55 1uwx n THR 97 Ca 0.50 -0.34 -0.32 0.00 -2.04 0.00 0.00 64.05 61.85 1uwx n THR 97 Cb 0.42 -1.53 -0.05 0.00 -1.82 0.00 0.00 70.33 67.34 1uwx n THR 97 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1uwx s PHE 100 N -0.45 3.44 1.05 -1.42 0.40 -1.26 -1.14 117.98 118.60 1uwx s PHE 100 Ca 0.63 0.77 -0.12 0.00 -0.60 0.00 0.00 56.93 57.61 1uwx s PHE 100 Cb -0.61 -2.18 0.22 0.00 0.51 0.00 0.00 43.02 40.96 1uwx s PHE 100 CO 0.54 0.32 1.07 0.20 0.70 0.00 0.00 175.22 178.05 1uwx s GLY 101 N -2.38 1.57 0.00 4.36 0.00 0.14 -4.69 107.32 106.32 1uwx s GLY 101 Ca 0.45 -0.16 0.27 0.00 0.00 0.00 0.00 44.72 45.28 1uwx s GLY 101 CO 0.22 0.47 1.93 0.61 0.00 0.00 0.00 173.10 176.34 1uwx n GLY 102 N -0.19 -1.10 0.00 0.20 0.00 -1.26 -4.78 105.19 98.06 1uwx n GLY 102 Ca 0.05 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1uwx n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uwx n GLY 103 N 0.92 -1.66 3.09 -0.02 0.00 -1.26 -5.05 105.19 101.21 1uwx n GLY 103 Ca 0.15 -1.41 -0.24 0.00 0.00 0.00 0.00 46.02 44.52 1uwx n GLY 103 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uwx s THR 104 N -3.52 1.20 -0.19 2.61 2.01 -0.47 -4.64 115.64 112.64 1uwx s THR 104 Ca 0.00 -0.60 -0.06 0.00 0.31 0.00 0.00 61.69 61.34 1uwx s THR 104 Cb 0.00 -1.04 -0.03 0.00 0.01 0.00 0.00 72.50 71.44 1uwx s THR 104 CO 0.00 0.35 0.03 -0.75 -0.69 0.00 0.00 174.62 173.56 1uwx s LYS 105 N 0.06 3.78 -0.08 4.92 2.20 -0.96 -0.77 119.74 128.88 1uwx s LYS 105 Ca -0.03 -0.44 -0.23 0.00 -0.36 0.00 0.00 55.97 54.91 1uwx s LYS 105 Cb -0.10 -3.15 -0.04 0.00 -1.51 0.00 0.00 37.83 33.03 1uwx s LYS 105 CO 0.01 0.12 0.69 -0.51 -0.36 0.00 0.00 175.35 175.31 1uwx s LEU 106 N 0.75 4.30 0.26 5.43 1.02 -0.42 -1.59 118.68 128.43 1uwx s LEU 106 Ca 0.02 1.15 0.08 0.00 0.02 0.00 0.00 54.13 55.40 1uwx s LEU 106 Cb -0.14 -3.06 -0.05 0.00 0.02 0.00 0.00 46.19 42.95 1uwx s LEU 106 CO 0.02 -0.13 -0.11 -1.83 0.02 0.00 0.00 176.35 174.32 1uwx s GLU 106 N 0.91 1.51 -0.10 1.70 4.04 0.11 -3.67 118.70 123.20 1uwx s GLU 106 Ca 0.37 -1.73 -0.18 0.00 0.04 0.00 0.00 54.97 53.47 1uwx s GLU 106 Cb -0.17 -1.25 -0.04 0.00 0.02 0.00 0.00 34.13 32.68 1uwx s GLU 106 CO 0.17 0.13 0.47 0.42 -1.84 0.00 0.00 175.26 174.61 1uwx s ILE 107 N -2.91 5.15 0.31 1.83 1.01 -1.26 -1.75 121.20 123.58 1uwx s ILE 107 Ca 0.27 0.95 -0.28 0.00 0.00 0.00 0.00 60.65 61.60 1uwx s ILE 107 Cb 0.01 -3.81 -0.09 0.00 0.01 0.00 0.00 42.46 38.58 1uwx s ILE 107 CO 0.11 0.36 1.06 -0.75 0.00 0.00 0.00 174.94 175.72 1uwx s LYS 108 N 0.37 4.52 0.35 2.79 2.20 -0.03 -4.86 119.74 125.09 1uwx s LYS 108 Ca 0.26 1.66 -0.06 0.00 -0.36 0.00 0.00 55.97 57.47 1uwx s LYS 108 Cb -0.15 -2.99 0.01 0.00 -1.51 0.00 0.00 37.83 33.19 1uwx s LYS 108 CO 0.11 0.15 0.54 -0.98 -0.36 0.00 0.00 175.35 174.81 1uwx s ARG 109 N -1.76 1.97 0.45 4.03 1.70 -1.26 -4.93 118.95 119.15 1uwx s ARG 109 Ca 0.48 -1.68 -0.22 0.00 -0.47 0.00 0.00 55.73 53.85 1uwx s ARG 109 Cb -0.28 0.48 -0.08 0.00 -0.57 0.00 0.00 34.95 34.50 1uwx s ARG 109 CO 0.35 -0.84 1.06 0.00 -1.08 0.00 0.00 175.30 174.79 1uwx s ALA 110 N -2.93 2.95 0.56 7.88 0.00 -1.26 -4.98 121.76 123.98 1uwx s ALA 110 Ca 0.27 0.69 -0.21 0.00 0.00 0.00 0.00 51.96 52.71 1uwx s ALA 110 Cb -0.01 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 1uwx s ALA 110 CO 0.18 -0.33 1.35 -0.51 0.00 0.00 0.00 175.76 176.45 1uwx s ASP 111 N -1.75 5.18 -0.11 0.00 1.01 -1.26 -4.80 116.67 114.94 1uwx s ASP 111 Ca 0.64 2.74 -0.05 0.00 0.71 0.00 0.00 52.55 56.59 1uwx s ASP 111 Cb -0.20 -2.63 0.05 0.00 1.01 0.00 0.00 42.92 41.15 1uwx s ASP 111 CO 0.25 -1.63 0.25 0.00 0.21 0.00 0.00 175.17 174.24 1uwx s ALA 112 N -1.32 -0.56 0.38 5.23 0.00 -0.20 -4.92 121.76 120.38 1uwx s ALA 112 Ca 0.73 0.99 -0.26 0.00 0.00 0.00 0.00 51.96 53.43 1uwx s ALA 112 Cb -0.40 -0.69 -0.09 0.00 0.00 0.00 0.00 23.12 21.95 1uwx s ALA 112 CO 0.46 -0.26 1.16 0.00 0.00 0.00 0.00 175.76 177.12 1uwx s ALA 113 N 1.43 3.20 0.39 0.00 0.00 -1.26 -1.25 121.76 124.26 1uwx s ALA 113 Ca -0.08 0.96 -0.27 0.00 0.00 0.00 0.00 51.96 52.57 1uwx s ALA 113 Cb -0.11 -3.37 -0.09 0.00 0.00 0.00 0.00 23.12 19.55 1uwx s ALA 113 CO -0.09 -0.47 1.36 -1.25 0.00 0.00 0.00 175.76 175.32 1uwx s PRO 114 N -2.19 4.04 -0.26 0.00 0.04 -1.26 -4.55 135.00 130.81 1uwx s PRO 114 Ca 0.55 2.30 -0.19 0.00 0.04 0.00 0.00 61.00 63.70 1uwx s PRO 114 Cb -0.31 -2.85 -0.02 0.00 0.04 0.00 0.00 34.50 31.36 1uwx s PRO 114 CO 0.39 -0.49 0.58 0.99 0.04 0.00 0.00 177.00 178.51 1uwx s THR 115 N -1.19 5.02 -0.13 1.26 2.01 -0.18 -4.84 115.64 117.58 1uwx s THR 115 Ca 0.55 0.98 -0.01 0.00 0.31 0.00 0.00 61.69 63.51 1uwx s THR 115 Cb -0.41 -3.90 -0.02 0.00 0.01 0.00 0.00 72.50 68.18 1uwx s THR 115 CO 0.54 0.03 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.71 1uwx s VAL 116 N 2.43 3.38 -0.03 3.82 1.01 -1.26 -0.54 120.40 129.21 1uwx s VAL 116 Ca 0.24 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.69 1uwx s VAL 116 Cb -0.15 -2.44 0.01 0.00 0.00 0.00 0.00 36.38 33.80 1uwx s VAL 116 CO 0.09 0.52 -0.07 -0.44 0.00 0.00 0.00 175.10 175.20 1uwx s SER 117 N 0.27 1.02 -0.01 3.32 0.01 -0.37 -4.91 113.70 113.03 1uwx s SER 117 Ca -0.07 -0.15 0.02 0.00 1.31 0.00 0.00 55.95 57.06 1uwx s SER 117 Cb -0.15 -0.33 -0.03 0.00 0.21 0.00 0.00 66.02 65.72 1uwx s SER 117 CO 0.04 0.03 -0.05 -0.51 0.41 0.00 0.00 173.24 173.16 1uwx s ILE 118 N 0.37 3.77 -0.06 1.44 2.07 -1.26 -1.29 121.20 126.24 1uwx s ILE 118 Ca -0.05 -0.69 -0.01 0.00 -1.41 0.00 0.00 60.65 58.49 1uwx s ILE 118 Cb -0.09 -2.63 0.03 0.00 0.13 0.00 0.00 42.46 39.89 1uwx s ILE 118 CO 0.00 0.42 -0.01 -0.36 -1.91 0.00 0.00 174.94 173.09 1uwx s PHE 119 N -0.99 0.65 0.98 3.50 0.08 0.19 -5.01 117.98 117.39 1uwx s PHE 119 Ca 0.17 -0.16 -0.12 0.00 0.12 0.00 0.00 56.93 56.94 1uwx s PHE 119 Cb -0.11 -0.74 0.18 0.00 -0.57 0.00 0.00 43.02 41.77 1uwx s PHE 119 CO 0.07 -0.29 1.08 -2.14 -0.10 0.00 0.00 175.22 173.85 1uwx s PRO 120 N 1.71 0.55 0.41 0.24 0.02 -1.26 -1.71 135.00 134.96 1uwx s PRO 120 Ca 0.01 0.81 -0.26 0.00 0.02 0.00 0.00 61.00 61.58 1uwx s PRO 120 Cb -0.13 -1.73 -0.10 0.00 0.02 0.00 0.00 34.50 32.57 1uwx s PRO 120 CO -0.04 -2.73 1.29 -2.30 -0.33 0.00 0.00 177.00 172.89 1uwx n PRO 121 N -4.22 1.99 -2.12 5.54 -0.02 -1.16 -4.82 135.00 130.19 1uwx n PRO 121 Ca 0.06 0.71 -0.34 0.00 -2.02 0.00 0.00 63.50 61.91 1uwx n PRO 121 Cb 0.55 -2.40 0.01 0.00 -0.02 0.00 0.00 33.50 31.65 1uwx n PRO 121 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1uwx s SER 122 N -0.49 5.66 0.49 2.55 1.04 -1.26 -4.93 113.70 116.75 1uwx s SER 122 Ca 0.60 2.02 0.17 0.00 0.48 0.00 0.00 55.95 59.22 1uwx s SER 122 Cb -0.51 -2.56 1.20 0.00 0.10 0.00 0.00 66.02 64.24 1uwx s SER 122 CO 0.59 -1.26 2.04 0.77 0.98 0.00 0.00 173.24 176.36 1uwx h SER 123 N 0.77 0.16 -0.06 7.02 4.64 -1.99 -2.35 113.55 121.74 1uwx h SER 123 Ca -0.48 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 60.87 1uwx h SER 123 Cb 1.24 -0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 63.26 1uwx h SER 123 CO 0.57 0.10 -0.15 -0.33 -0.87 0.00 0.00 176.83 176.15 1uwx h GLU 124 N 0.18 -0.21 -0.40 4.77 3.07 -2.00 -2.11 114.58 117.87 1uwx h GLU 124 Ca 0.18 0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 59.02 1uwx h GLU 124 Cb 0.47 0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.42 1uwx h GLU 124 CO -0.03 -0.14 0.13 0.37 -1.40 0.00 0.00 179.01 177.94 1uwx h GLN 125 N -0.22 0.62 -0.93 2.33 4.15 -1.82 -3.23 115.11 116.00 1uwx h GLN 125 Ca 0.07 -0.13 0.08 0.00 0.77 0.00 0.00 58.65 59.44 1uwx h GLN 125 Cb 0.32 -0.09 -0.07 0.00 0.21 0.00 0.00 27.48 27.85 1uwx h GLN 125 CO -0.19 0.62 0.58 -0.07 -1.93 0.00 0.00 178.83 177.84 1uwx h LEU 126 N 0.50 0.90 -1.14 -2.39 3.38 -1.22 -1.31 115.31 114.02 1uwx h LEU 126 Ca 0.13 0.03 0.17 0.00 0.09 0.00 0.00 57.88 58.29 1uwx h LEU 126 Cb 0.26 -0.16 -0.09 0.00 0.09 0.00 0.00 40.66 40.76 1uwx h LEU 126 CO -0.00 0.54 0.61 0.74 0.09 0.00 0.00 178.44 180.42 1uwx h THR 127 N 1.01 0.77 0.00 0.22 2.02 -1.40 -1.04 112.91 114.50 1uwx h THR 127 Ca 0.43 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 67.35 1uwx h THR 127 Cb 0.27 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.64 1uwx h THR 127 CO -0.21 0.14 0.00 -1.54 0.37 0.00 0.00 175.52 174.28 1uwx n SER 128 N -4.65 0.00 0.00 4.18 3.41 -0.50 -4.93 113.62 111.12 1uwx n SER 128 Ca 0.21 -0.46 0.00 0.00 -0.26 0.00 0.00 58.87 58.35 1uwx n SER 128 Cb 0.53 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 1uwx n SER 128 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uwx n GLY 129 N 1.10 0.75 3.72 5.00 0.00 -0.39 -5.08 105.19 110.29 1uwx n GLY 129 Ca 0.18 -0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 1uwx n GLY 129 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1uwx s GLY 130 N -2.06 2.23 -0.28 -0.02 0.00 -1.16 -2.32 107.32 103.70 1uwx s GLY 130 Ca 0.00 -2.04 0.01 0.00 0.00 0.00 0.00 44.72 42.69 1uwx s GLY 130 CO 0.00 -1.88 0.46 0.00 0.00 0.00 0.00 173.10 171.68 1uwx s ALA 131 N -2.56 -1.54 -0.18 3.20 0.00 -0.79 -3.45 121.76 116.45 1uwx s ALA 131 Ca 0.40 0.73 -0.04 0.00 0.00 0.00 0.00 51.96 53.04 1uwx s ALA 131 Cb 0.02 -2.09 -0.02 0.00 0.00 0.00 0.00 23.12 21.02 1uwx s ALA 131 CO 0.22 -1.61 -0.02 -1.12 0.00 0.00 0.00 175.76 173.23 1uwx s SER 132 N 2.64 4.80 -0.23 0.00 0.01 -1.26 -0.50 113.70 119.15 1uwx s SER 132 Ca 0.12 -0.18 -0.09 0.00 1.31 0.00 0.00 55.95 57.11 1uwx s SER 132 Cb -0.13 -1.80 -0.04 0.00 0.21 0.00 0.00 66.02 64.25 1uwx s SER 132 CO -0.25 0.10 0.13 -0.69 0.41 0.00 0.00 173.24 172.94 1uwx s VAL 133 N 0.75 5.04 -0.08 3.43 1.01 0.65 -3.00 120.40 128.20 1uwx s VAL 133 Ca -0.01 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.04 1uwx s VAL 133 Cb -0.14 -3.34 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 1uwx s VAL 133 CO 0.02 0.36 -0.06 -0.69 0.00 0.00 0.00 175.10 174.73 1uwx s VAL 134 N 1.09 3.76 -0.09 2.92 1.01 -0.70 -0.63 120.40 127.77 1uwx s VAL 134 Ca 0.06 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 61.63 1uwx s VAL 134 Cb -0.14 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.69 1uwx s VAL 134 CO 0.04 0.58 -0.22 0.00 0.00 0.00 0.00 175.10 175.50 1uwx s PHE 136 N 0.34 3.45 -0.36 0.00 0.08 -0.41 -1.16 117.98 119.92 1uwx s PHE 136 Ca -0.17 0.37 0.03 0.00 0.12 0.00 0.00 56.93 57.27 1uwx s PHE 136 Cb -0.17 -2.02 0.11 0.00 -0.57 0.00 0.00 43.02 40.36 1uwx s PHE 136 CO 0.08 0.48 0.10 -0.51 -0.10 0.00 0.00 175.22 175.27 1uwx s LEU 137 N -0.34 3.83 -0.04 -0.37 1.02 0.43 -1.24 118.68 121.98 1uwx s LEU 137 Ca 0.11 -2.15 0.01 0.00 0.02 0.00 0.00 54.13 52.12 1uwx s LEU 137 Cb -0.12 -1.37 -0.03 0.00 0.02 0.00 0.00 46.19 44.69 1uwx s LEU 137 CO 0.01 -0.36 -0.04 0.20 0.02 0.00 0.00 176.35 176.17 1uwx s ASN 138 N 0.91 4.81 -1.17 2.29 0.01 0.30 -0.28 114.94 121.82 1uwx s ASN 138 Ca 0.12 -0.03 -0.00 0.00 -0.71 0.00 0.00 52.86 52.23 1uwx s ASN 138 Cb -0.20 -1.21 0.00 0.00 0.41 0.00 0.00 41.25 40.25 1uwx s ASN 138 CO -0.11 0.32 0.97 0.59 -1.51 0.00 0.00 177.10 177.37 1uwx n ASN 139 N 1.84 -2.12 -4.96 -1.22 3.02 -0.65 -1.01 115.26 110.16 1uwx n ASN 139 Ca -0.17 -0.60 -0.19 0.00 -0.03 0.00 0.00 54.58 53.59 1uwx n ASN 139 Cb 0.53 -4.99 -0.01 0.00 -0.61 0.00 0.00 39.78 34.70 1uwx n ASN 139 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1uwx s PHE 140 N -3.35 3.08 -0.27 3.10 -0.71 0.43 -4.62 117.98 115.65 1uwx s PHE 140 Ca 0.01 -0.23 -0.20 0.00 -1.04 0.00 0.00 56.93 55.46 1uwx s PHE 140 Cb -0.01 -1.95 0.07 0.00 -1.21 0.00 0.00 43.02 39.93 1uwx s PHE 140 CO 0.71 0.03 0.69 -0.47 -1.34 0.00 0.00 175.22 174.84 1uwx s TYR 141 N -2.20 -0.89 1.02 3.49 6.14 -0.38 -0.58 117.35 123.95 1uwx s TYR 141 Ca 0.44 1.96 -0.17 0.00 0.64 0.00 0.00 57.07 59.94 1uwx s TYR 141 Cb -0.09 0.42 0.22 0.00 0.42 0.00 0.00 41.96 42.93 1uwx s TYR 141 CO 0.30 -0.43 1.28 -1.25 0.64 0.00 0.00 175.55 176.08 1uwx s PRO 142 N 0.92 0.21 0.60 4.97 0.04 -1.26 -1.03 135.00 139.46 1uwx s PRO 142 Ca -0.04 -0.33 0.39 0.00 0.04 0.00 0.00 61.00 61.06 1uwx s PRO 142 Cb -0.05 -1.79 1.97 0.00 0.04 0.00 0.00 34.50 34.67 1uwx s PRO 142 CO -0.08 -2.71 2.19 1.57 0.04 0.00 0.00 177.00 178.01 1uwx h LYS 143 N -1.86 0.00 -6.58 4.56 2.10 -1.98 -3.44 116.57 109.38 1uwx h LYS 143 Ca -0.44 0.00 -0.52 0.00 -2.00 0.00 0.00 60.65 57.68 1uwx h LYS 143 Cb 1.25 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.57 1uwx h LYS 143 CO 0.37 0.00 0.43 -0.51 -2.00 0.00 0.00 179.45 177.74 1uwx s ASP 144 N -5.28 7.35 -0.08 7.07 1.01 -1.26 -4.99 116.67 120.48 1uwx s ASP 144 Ca -0.02 1.92 -0.30 0.00 0.71 0.00 0.00 52.55 54.86 1uwx s ASP 144 Cb 0.11 -2.59 0.10 0.00 1.01 0.00 0.00 42.92 41.55 1uwx s ASP 144 CO 0.45 -0.19 0.86 -0.51 0.21 0.00 0.00 175.17 175.99 1uwx s ILE 145 N 0.12 0.00 -0.02 0.77 2.07 -1.26 -4.65 121.20 118.23 1uwx s ILE 145 Ca 0.50 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.75 1uwx s ILE 145 Cb -0.26 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.34 1uwx s ILE 145 CO 0.32 0.00 -0.04 0.21 -1.91 0.00 0.00 174.94 173.51 1uwx s ASN 146 N -1.46 0.68 -0.07 4.50 3.84 -0.79 -4.99 114.94 116.66 1uwx s ASN 146 Ca -0.03 -0.09 0.05 0.00 0.21 0.00 0.00 52.86 52.99 1uwx s ASN 146 Cb -0.00 -0.22 -0.01 0.00 -0.55 0.00 0.00 41.25 40.46 1uwx s ASN 146 CO 0.02 -0.00 -0.21 0.54 -2.79 0.00 0.00 177.10 174.66 1uwx s VAL 147 N 0.41 2.43 -0.05 -5.21 0.11 -1.26 -0.44 120.40 116.38 1uwx s VAL 147 Ca -0.05 -0.93 0.04 0.00 -2.93 0.00 0.00 61.98 58.12 1uwx s VAL 147 Cb -0.08 -1.93 -0.00 0.00 -1.53 0.00 0.00 36.38 32.84 1uwx s VAL 147 CO -0.00 0.57 -0.18 -0.54 -3.33 0.00 0.00 175.10 171.61 1uwx s LYS 148 N -0.18 2.00 -0.05 1.54 1.02 -0.49 -4.96 119.74 118.61 1uwx s LYS 148 Ca -0.02 -0.65 -0.11 0.00 0.02 0.00 0.00 55.97 55.21 1uwx s LYS 148 Cb -0.14 -1.69 -0.05 0.00 -0.52 0.00 0.00 37.83 35.44 1uwx s LYS 148 CO 0.03 0.22 0.28 -1.58 -0.92 0.00 0.00 175.35 173.39 1uwx s TRP 149 N 0.13 3.66 0.01 3.18 0.52 -1.26 -0.22 118.94 124.97 1uwx s TRP 149 Ca -0.07 0.76 0.05 0.00 0.02 0.00 0.00 56.10 56.86 1uwx s TRP 149 Cb -0.13 -2.12 -0.02 0.00 -1.15 0.00 0.00 33.47 30.06 1uwx s TRP 149 CO 0.03 0.69 -0.15 0.15 0.02 0.00 0.00 176.95 177.69 1uwx s LYS 150 N -1.09 1.11 -0.13 4.98 1.02 0.16 -1.22 119.74 124.56 1uwx s LYS 150 Ca 0.20 -0.66 0.01 0.00 0.02 0.00 0.00 55.97 55.54 1uwx s LYS 150 Cb -0.14 -1.11 0.02 0.00 -0.52 0.00 0.00 37.83 36.08 1uwx s LYS 150 CO 0.09 0.29 -0.16 0.42 -0.92 0.00 0.00 175.35 175.07 1uwx s ILE 151 N -0.59 1.66 -1.77 2.17 1.01 0.01 -1.82 121.20 121.87 1uwx s ILE 151 Ca 0.04 -0.72 -0.16 0.00 0.00 0.00 0.00 60.65 59.81 1uwx s ILE 151 Cb -0.07 -1.52 0.16 0.00 0.01 0.00 0.00 42.46 41.04 1uwx s ILE 151 CO 0.00 0.47 0.44 0.47 0.00 0.00 0.00 174.94 176.33 1uwx n ASP 152 N 4.40 -1.14 0.00 3.58 8.00 -0.51 -0.34 116.55 130.54 1uwx n ASP 152 Ca -0.19 -1.23 0.00 0.00 0.71 0.00 0.00 54.79 54.08 1uwx n ASP 152 Cb 0.51 -1.74 0.00 0.00 -0.02 0.00 0.00 41.12 39.87 1uwx n ASP 152 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1uwx n GLY 153 N -1.54 1.28 3.64 0.44 0.00 -1.26 -5.02 105.19 102.72 1uwx n GLY 153 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 1uwx n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uwx s LYS 154 N -0.09 4.01 0.31 1.61 3.01 0.54 -5.02 119.74 124.11 1uwx s LYS 154 Ca 0.00 -0.31 -0.29 0.00 -1.01 0.00 0.00 55.97 54.36 1uwx s LYS 154 Cb 0.00 -3.39 -0.12 0.00 -1.01 0.00 0.00 37.83 33.31 1uwx s LYS 154 CO 0.00 0.14 1.50 -1.91 0.51 0.00 0.00 175.35 175.59 1uwx n GLU 155 N 4.00 2.50 -3.87 1.68 2.13 -1.26 -0.81 120.64 125.01 1uwx n GLU 155 Ca -0.16 0.89 -0.21 0.00 0.66 0.00 0.00 57.16 58.34 1uwx n GLU 155 Cb 0.52 -2.61 -0.17 0.00 0.27 0.00 0.00 31.44 29.45 1uwx n GLU 155 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1uwx s ARG 156 N -1.04 0.53 -0.14 5.31 6.06 -0.36 -4.88 118.95 124.43 1uwx s ARG 156 Ca 0.61 0.08 0.09 0.00 -2.50 0.00 0.00 55.73 54.01 1uwx s ARG 156 Cb -0.53 -0.80 -0.15 0.00 0.06 0.00 0.00 34.95 33.53 1uwx s ARG 156 CO 0.54 -0.23 -0.01 1.04 -2.50 0.00 0.00 175.30 174.14 1uwx n GLN 157 N 4.73 1.43 -2.58 5.12 3.00 -1.26 -4.26 117.38 123.56 1uwx n GLN 157 Ca -0.14 0.02 -0.41 0.00 -0.01 0.00 0.00 57.00 56.46 1uwx n GLN 157 Cb 0.50 -1.34 -0.04 0.00 0.00 0.00 0.00 30.24 29.37 1uwx n GLN 157 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.06 178.27 1uwx s ASN 158 N -4.91 7.30 0.00 1.08 2.47 -1.26 -3.43 114.94 116.18 1uwx s ASN 158 Ca -0.11 1.92 0.00 0.00 0.42 0.00 0.00 52.86 55.08 1uwx s ASN 158 Cb 0.04 -2.59 0.00 0.00 -1.45 0.00 0.00 41.25 37.26 1uwx s ASN 158 CO 0.49 -0.25 0.00 0.61 -3.72 0.00 0.00 177.10 174.24 1uwx n GLY 159 N 2.53 0.81 3.69 1.21 0.00 -1.26 -4.87 105.19 107.30 1uwx n GLY 159 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 1uwx n GLY 159 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uwx s VAL 160 N -2.09 5.34 -0.15 1.61 1.01 -1.22 -1.04 120.40 123.85 1uwx s VAL 160 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.29 1uwx s VAL 160 Cb 0.00 -3.54 0.03 0.00 0.00 0.00 0.00 36.38 32.86 1uwx s VAL 160 CO 0.00 0.36 -0.12 -0.22 0.00 0.00 0.00 175.10 175.12 1uwx s LEU 161 N 0.82 1.69 -0.06 3.92 0.20 -0.14 -4.98 118.68 120.13 1uwx s LEU 161 Ca 0.11 -0.52 0.01 0.00 0.69 0.00 0.00 54.13 54.41 1uwx s LEU 161 Cb -0.13 -1.12 -0.03 0.00 -0.43 0.00 0.00 46.19 44.48 1uwx s LEU 161 CO 0.03 -0.08 -0.06 0.20 -0.29 0.00 0.00 176.35 176.15 1uwx s ASN 162 N 1.52 4.74 0.02 3.68 0.01 -1.26 -1.23 114.94 122.42 1uwx s ASN 162 Ca 0.04 -0.01 0.00 0.00 -0.71 0.00 0.00 52.86 52.19 1uwx s ASN 162 Cb -0.13 -1.21 -0.02 0.00 0.41 0.00 0.00 41.25 40.30 1uwx s ASN 162 CO -0.10 0.36 -0.04 -0.55 -1.51 0.00 0.00 177.10 175.26 1uwx s SER 163 N -0.88 0.35 -0.01 -1.22 0.15 -0.33 -5.01 113.70 106.75 1uwx s SER 163 Ca 0.13 -0.49 0.02 0.00 0.70 0.00 0.00 55.95 56.30 1uwx s SER 163 Cb -0.11 0.08 -0.00 0.00 -1.71 0.00 0.00 66.02 64.28 1uwx s SER 163 CO 0.02 -0.27 -0.05 0.26 1.20 0.00 0.00 173.24 174.40 1uwx s TRP 164 N -1.40 0.49 0.57 3.44 0.51 -1.26 -0.74 118.94 120.55 1uwx s TRP 164 Ca -0.14 -0.09 -0.08 0.00 -2.12 0.00 0.00 56.10 53.66 1uwx s TRP 164 Cb -0.10 -0.35 -0.03 0.00 -0.81 0.00 0.00 33.47 32.19 1uwx s TRP 164 CO -0.01 -0.03 0.93 0.95 -0.51 0.00 0.00 176.95 178.28 1uwx s THR 165 N 0.02 4.62 0.82 2.01 -4.23 -1.00 -5.04 115.64 112.84 1uwx s THR 165 Ca 0.00 0.50 -0.12 0.00 -1.18 0.00 0.00 61.69 60.90 1uwx s THR 165 Cb -0.04 -3.81 0.08 0.00 1.34 0.00 0.00 72.50 70.08 1uwx s THR 165 CO -0.00 -0.94 1.10 -1.81 -0.54 0.00 0.00 174.62 172.43 1uwx s ASP 166 N -4.17 4.28 0.11 3.99 -0.00 -1.26 -4.58 116.67 115.03 1uwx s ASP 166 Ca 0.52 1.31 -0.36 0.00 -0.00 0.00 0.00 52.55 54.03 1uwx s ASP 166 Cb -0.11 -2.03 -0.16 0.00 -0.00 0.00 0.00 42.92 40.62 1uwx s ASP 166 CO 0.49 -2.10 1.31 1.67 -0.00 0.00 0.00 175.17 176.54 1uwx n GLN 167 N -3.52 1.18 -2.02 8.23 7.27 -1.26 -4.80 117.38 122.45 1uwx n GLN 167 Ca 0.07 0.42 -0.41 0.00 0.07 0.00 0.00 57.00 57.15 1uwx n GLN 167 Cb 0.56 -2.04 -0.02 0.00 2.41 0.00 0.00 30.24 31.15 1uwx n GLN 167 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1uwx s ASP 168 N 0.40 6.66 0.28 1.69 -1.08 0.02 -4.91 116.67 119.73 1uwx s ASP 168 Ca 0.82 2.68 0.06 0.00 -0.52 0.00 0.00 52.55 55.59 1uwx s ASP 168 Cb -0.93 -2.63 0.40 0.00 -1.46 0.00 0.00 42.92 38.31 1uwx s ASP 168 CO 0.48 -0.68 1.67 0.77 0.52 0.00 0.00 175.17 177.92 1uwx h SER 169 N 4.69 0.26 0.00 -0.34 4.64 -1.92 -1.72 113.55 119.16 1uwx h SER 169 Ca -0.47 -0.12 -0.03 0.00 -0.47 0.00 0.00 61.79 60.71 1uwx h SER 169 Cb 1.22 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1uwx h SER 169 CO 0.75 0.68 -0.29 0.50 -0.87 0.00 0.00 176.83 177.61 1uwx h LYS 170 N 0.20 0.00 -0.00 4.77 3.64 -2.00 -3.43 116.57 119.75 1uwx h LYS 170 Ca 0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1uwx h LYS 170 Cb 0.89 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.71 1uwx h LYS 170 CO 0.07 0.27 -0.52 -0.40 -2.27 0.00 0.00 179.45 176.61 1uwx n ASP 171 N -4.67 1.02 -0.95 4.20 3.85 -1.25 -5.01 116.55 113.74 1uwx n ASP 171 Ca -0.07 -1.01 -0.10 0.00 -0.71 0.00 0.00 54.79 52.89 1uwx n ASP 171 Cb 0.23 0.78 -0.03 0.00 -1.35 0.00 0.00 41.12 40.75 1uwx n ASP 171 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 1uwx n SER 172 N -0.85 -3.96 -4.83 -1.12 7.64 -0.65 -4.98 113.62 104.87 1uwx n SER 172 Ca 0.04 0.16 -0.21 0.00 1.01 0.00 0.00 58.87 59.87 1uwx n SER 172 Cb 0.26 -2.70 0.09 0.00 -1.01 0.00 0.00 64.21 60.85 1uwx n SER 172 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1uwx n THR 173 N -3.19 0.00 -4.35 0.44 -2.24 -1.26 -4.61 114.28 99.07 1uwx n THR 173 Ca -0.11 -1.82 -0.23 0.00 -2.27 0.00 0.00 64.05 59.62 1uwx n THR 173 Cb 0.44 -0.66 -0.11 0.00 -2.10 0.00 0.00 70.33 67.89 1uwx n THR 173 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1uwx s TYR 174 N -2.86 1.90 0.13 4.78 2.02 0.26 -0.80 117.35 122.78 1uwx s TYR 174 Ca 0.64 -0.45 0.05 0.00 -0.37 0.00 0.00 57.07 56.94 1uwx s TYR 174 Cb -0.04 -0.94 -0.04 0.00 -0.40 0.00 0.00 41.96 40.53 1uwx s TYR 174 CO 0.42 0.36 -0.11 -1.12 -1.57 0.00 0.00 175.55 173.53 1uwx s SER 175 N -2.69 1.77 0.00 2.29 0.01 -1.26 -0.43 113.70 113.39 1uwx s SER 175 Ca 0.17 -0.95 -0.01 0.00 1.31 0.00 0.00 55.95 56.47 1uwx s SER 175 Cb -0.06 -0.02 -0.01 0.00 0.21 0.00 0.00 66.02 66.15 1uwx s SER 175 CO 0.07 -0.29 0.02 -0.32 0.41 0.00 0.00 173.24 173.13 1uwx s MET 176 N -3.41 0.18 -0.07 12.44 1.75 0.62 -2.37 119.30 128.43 1uwx s MET 176 Ca 0.13 -0.24 0.04 0.00 -1.25 0.00 0.00 55.69 54.38 1uwx s MET 176 Cb 0.00 0.07 -0.00 0.00 2.84 0.00 0.00 34.83 37.74 1uwx s MET 176 CO 0.01 -0.03 -0.21 0.45 -0.65 0.00 0.00 175.02 174.59 1uwx s SER 177 N -0.66 2.69 -0.08 1.11 0.15 0.08 -0.43 113.70 116.56 1uwx s SER 177 Ca -0.07 -0.46 0.01 0.00 0.70 0.00 0.00 55.95 56.12 1uwx s SER 177 Cb -0.05 -1.01 0.02 0.00 -1.71 0.00 0.00 66.02 63.27 1uwx s SER 177 CO -0.00 0.16 -0.08 -0.55 1.20 0.00 0.00 173.24 173.97 1uwx s SER 178 N 0.20 1.70 -0.15 5.45 0.15 -0.31 -1.18 113.70 119.57 1uwx s SER 178 Ca -0.11 -0.24 0.01 0.00 0.70 0.00 0.00 55.95 56.31 1uwx s SER 178 Cb -0.15 -0.71 0.02 0.00 -1.71 0.00 0.00 66.02 63.47 1uwx s SER 178 CO 0.05 -0.06 -0.17 -0.89 1.20 0.00 0.00 173.24 173.38 1uwx s THR 179 N 1.19 1.75 -0.34 6.45 2.01 -0.37 -0.74 115.64 125.60 1uwx s THR 179 Ca -0.05 -0.76 -0.11 0.00 0.31 0.00 0.00 61.69 61.07 1uwx s THR 179 Cb -0.14 -1.60 -0.00 0.00 0.01 0.00 0.00 72.50 70.76 1uwx s THR 179 CO -0.02 0.49 0.20 -0.22 -0.69 0.00 0.00 174.62 174.38 1uwx s LEU 180 N 1.24 4.42 -0.16 4.42 2.96 0.20 -0.96 118.68 130.80 1uwx s LEU 180 Ca 0.01 -0.61 -0.04 0.00 -0.22 0.00 0.00 54.13 53.27 1uwx s LEU 180 Cb -0.14 -2.06 -0.03 0.00 0.50 0.00 0.00 46.19 44.47 1uwx s LEU 180 CO -0.08 -0.26 -0.04 -0.89 -1.32 0.00 0.00 176.35 173.76 1uwx s THR 181 N 1.64 3.89 0.33 3.68 2.01 -0.21 -0.26 115.64 126.72 1uwx s THR 181 Ca 0.05 -0.36 0.03 0.00 0.31 0.00 0.00 61.69 61.72 1uwx s THR 181 Cb -0.18 -2.71 -0.05 0.00 0.01 0.00 0.00 72.50 69.58 1uwx s THR 181 CO 0.08 0.49 0.09 -0.76 -0.69 0.00 0.00 174.62 173.83 1uwx s LEU 182 N 0.36 1.99 0.57 4.42 1.43 0.34 -4.66 118.68 123.13 1uwx s LEU 182 Ca -0.04 -1.45 -0.17 0.00 -1.03 0.00 0.00 54.13 51.44 1uwx s LEU 182 Cb -0.14 -0.21 -0.04 0.00 0.03 0.00 0.00 46.19 45.83 1uwx s LEU 182 CO 0.03 -0.71 1.07 0.42 0.23 0.00 0.00 176.35 177.39 1uwx s THR 183 N -3.40 3.62 0.24 5.49 -4.23 -1.26 -1.88 115.64 114.22 1uwx s THR 183 Ca 0.34 0.85 -0.07 0.00 -1.18 0.00 0.00 61.69 61.63 1uwx s THR 183 Cb 0.07 -3.34 0.24 0.00 1.34 0.00 0.00 72.50 70.81 1uwx s THR 183 CO 0.15 -0.37 1.66 0.50 -0.54 0.00 0.00 174.62 176.01 1uwx h LYS 184 N 0.73 0.15 -0.75 3.99 3.64 -1.66 -0.89 116.57 121.78 1uwx h LYS 184 Ca -0.48 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 58.89 1uwx h LYS 184 Cb 1.23 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.98 1uwx h LYS 184 CO 0.57 0.10 0.44 -0.44 -2.27 0.00 0.00 179.45 177.85 1uwx h ASP 185 N 0.15 0.91 -0.06 4.20 3.45 -1.92 -1.32 116.42 121.83 1uwx h ASP 185 Ca 0.39 -0.07 -0.17 0.00 0.43 0.00 0.00 57.03 57.61 1uwx h ASP 185 Cb 0.67 -0.23 -0.00 0.00 -0.56 0.00 0.00 39.33 39.20 1uwx h ASP 185 CO -0.58 0.72 -0.55 -0.08 -1.57 0.00 0.00 179.24 177.18 1uwx h GLU 186 N 1.03 0.65 -0.96 3.56 4.81 -1.85 -3.18 114.58 118.64 1uwx h GLU 186 Ca 0.27 -0.41 0.03 0.00 -0.13 0.00 0.00 59.36 59.12 1uwx h GLU 186 Cb -0.01 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.36 1uwx h GLU 186 CO -0.05 1.02 0.63 -0.92 -0.73 0.00 0.00 179.01 178.97 1uwx h TYR 187 N 0.50 1.17 0.00 0.92 3.20 -0.62 -2.56 116.97 119.58 1uwx h TYR 187 Ca 0.01 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1uwx h TYR 187 Cb 1.11 -0.39 0.00 0.00 1.54 0.00 0.00 36.73 38.99 1uwx h TYR 187 CO 0.05 0.69 0.00 0.39 -1.64 0.00 0.00 178.16 177.65 1uwx n GLU 188 N -4.43 0.56 0.00 1.82 -0.58 -0.55 -3.26 120.64 114.19 1uwx n GLU 188 Ca 0.13 0.02 0.11 0.00 -0.42 0.00 0.00 57.16 57.00 1uwx n GLU 188 Cb 0.08 -1.50 0.09 0.00 -0.57 0.00 0.00 31.44 29.54 1uwx n GLU 188 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1uwx n ARG 189 N -1.20 0.89 -4.28 3.49 1.74 -0.96 -4.95 116.66 111.38 1uwx n ARG 189 Ca 0.16 -0.69 -0.16 0.00 -0.77 0.00 0.00 57.85 56.40 1uwx n ARG 189 Cb 0.18 -1.49 -0.10 0.00 -1.02 0.00 0.00 32.46 30.04 1uwx n ARG 189 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1uwx s HIS 190 N -2.58 1.41 -0.13 -1.55 3.76 -1.20 -5.10 115.29 109.89 1uwx s HIS 190 Ca 0.18 -0.78 -0.06 0.00 -0.15 0.00 0.00 55.06 54.25 1uwx s HIS 190 Cb 0.18 -0.74 -0.06 0.00 1.11 0.00 0.00 32.58 33.08 1uwx s HIS 190 CO 0.61 0.09 -0.16 -1.71 -0.85 0.00 0.00 174.74 172.71 1uwx n ASN 191 N -0.28 1.09 -4.55 1.40 4.05 -1.26 -4.80 115.26 110.90 1uwx n ASN 191 Ca -0.09 0.14 -0.35 0.00 0.45 0.00 0.00 54.58 54.74 1uwx n ASN 191 Cb 0.61 -0.37 -0.11 0.00 1.23 0.00 0.00 39.78 41.14 1uwx n ASN 191 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 1uwx s SER 192 N -6.10 5.28 -0.07 1.20 0.15 -1.26 0.16 113.70 113.05 1uwx s SER 192 Ca -0.18 -0.04 0.04 0.00 0.70 0.00 0.00 55.95 56.46 1uwx s SER 192 Cb 0.07 -1.90 0.00 0.00 -1.71 0.00 0.00 66.02 62.48 1uwx s SER 192 CO 0.23 0.13 -0.19 -0.31 1.20 0.00 0.00 173.24 174.30 1uwx s TYR 193 N 0.64 2.04 -0.02 3.44 2.02 -0.50 -1.43 117.35 123.55 1uwx s TYR 193 Ca 0.02 -0.75 0.00 0.00 -0.37 0.00 0.00 57.07 55.97 1uwx s TYR 193 Cb -0.14 -1.39 0.03 0.00 -0.40 0.00 0.00 41.96 40.06 1uwx s TYR 193 CO 0.02 -0.30 0.02 0.99 -1.57 0.00 0.00 175.55 174.71 1uwx s THR 194 N 0.33 -0.04 -0.06 -0.71 2.01 -0.76 -1.74 115.64 114.68 1uwx s THR 194 Ca -0.13 0.18 0.03 0.00 0.31 0.00 0.00 61.69 62.08 1uwx s THR 194 Cb -0.16 -0.08 -0.02 0.00 0.01 0.00 0.00 72.50 72.25 1uwx s THR 194 CO 0.05 0.08 -0.14 0.00 -0.69 0.00 0.00 174.62 173.92 1uwx s GLU 196 N -0.59 1.32 -0.21 0.00 2.02 0.70 -2.22 118.70 119.72 1uwx s GLU 196 Ca 0.08 -0.28 -0.08 0.00 0.02 0.00 0.00 54.97 54.72 1uwx s GLU 196 Cb -0.11 -1.63 -0.04 0.00 0.10 0.00 0.00 34.13 32.45 1uwx s GLU 196 CO 0.01 -0.33 0.09 0.00 0.02 0.00 0.00 175.26 175.05 1uwx s ALA 197 N 1.74 3.44 -0.21 5.21 0.00 0.75 -1.40 121.76 131.29 1uwx s ALA 197 Ca 0.04 -0.84 -0.08 0.00 0.00 0.00 0.00 51.96 51.07 1uwx s ALA 197 Cb -0.13 -2.07 -0.04 0.00 0.00 0.00 0.00 23.12 20.88 1uwx s ALA 197 CO -0.08 -0.03 0.09 0.99 0.00 0.00 0.00 175.76 176.74 1uwx s THR 198 N 0.75 4.88 -0.05 0.00 2.01 0.41 -0.81 115.64 122.82 1uwx s THR 198 Ca 0.05 0.00 -0.24 0.00 0.31 0.00 0.00 61.69 61.81 1uwx s THR 198 Cb -0.13 -3.23 0.05 0.00 0.01 0.00 0.00 72.50 69.20 1uwx s THR 198 CO 0.02 0.41 0.53 -2.28 -0.69 0.00 0.00 174.62 172.61 1uwx s HIS 199 N 0.75 -0.48 0.55 4.92 5.04 -1.26 -1.88 115.29 122.92 1uwx s HIS 199 Ca 0.05 0.85 0.24 0.00 -1.54 0.00 0.00 55.06 54.65 1uwx s HIS 199 Cb -0.13 0.28 1.46 0.00 0.04 0.00 0.00 32.58 34.23 1uwx s HIS 199 CO 0.02 -0.50 2.09 -0.22 -2.34 0.00 0.00 174.74 173.79 1uwx h LYS 200 N 3.53 0.00 0.00 2.88 3.64 -1.94 -2.12 116.57 122.56 1uwx h LYS 200 Ca -0.28 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1uwx h LYS 200 Cb 1.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1uwx h LYS 200 CO 0.37 0.00 0.00 0.25 -2.27 0.00 0.00 179.45 177.80 1uwx n THR 201 N -4.21 0.94 -3.79 1.00 -2.24 -1.26 -4.71 114.28 100.00 1uwx n THR 201 Ca 0.03 0.24 -0.14 0.00 -2.27 0.00 0.00 64.05 61.91 1uwx n THR 201 Cb 0.34 -1.06 -0.15 0.00 -2.10 0.00 0.00 70.33 67.35 1uwx n THR 201 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1uwx s SER 202 N -3.45 0.03 0.10 3.42 0.15 -0.80 -5.00 113.70 108.15 1uwx s SER 202 Ca 0.06 0.06 -0.17 0.00 0.70 0.00 0.00 55.95 56.60 1uwx s SER 202 Cb 0.09 -0.02 -0.06 0.00 -1.71 0.00 0.00 66.02 64.33 1uwx s SER 202 CO 0.31 -0.10 1.55 0.74 1.20 0.00 0.00 173.24 176.95 1uwx h THR 203 N 5.95 1.25 -3.80 6.45 2.02 -1.84 -3.41 112.91 119.53 1uwx h THR 203 Ca -0.40 -0.90 -0.50 0.00 0.77 0.00 0.00 66.41 65.39 1uwx h THR 203 Cb 1.15 1.23 0.03 0.00 -1.74 0.00 0.00 68.15 68.82 1uwx h THR 203 CO 0.48 0.29 0.19 -0.94 0.37 0.00 0.00 175.52 175.91 1uwx s SER 204 N -6.00 6.34 0.48 4.18 1.04 -1.26 -5.03 113.70 113.45 1uwx s SER 204 Ca -0.13 1.11 -0.23 0.00 0.48 0.00 0.00 55.95 57.17 1uwx s SER 204 Cb 0.08 -2.33 -0.07 0.00 0.10 0.00 0.00 66.02 63.81 1uwx s SER 204 CO 0.76 -0.60 1.32 -2.84 0.98 0.00 0.00 173.24 172.86 1uwx s PRO 205 N -4.59 3.53 -0.36 4.02 0.02 -1.26 -4.86 135.00 131.51 1uwx s PRO 205 Ca 0.50 2.15 -0.20 0.00 0.02 0.00 0.00 61.00 63.48 1uwx s PRO 205 Cb -0.10 -2.46 0.00 0.00 0.02 0.00 0.00 34.50 31.96 1uwx s PRO 205 CO 0.43 -0.85 0.60 0.42 -0.33 0.00 0.00 177.00 177.27 1uwx s ILE 206 N -1.33 4.93 0.02 2.83 1.01 0.01 -4.88 121.20 123.78 1uwx s ILE 206 Ca 0.65 0.50 0.08 0.00 0.00 0.00 0.00 60.65 61.88 1uwx s ILE 206 Cb -0.38 -4.05 -0.02 0.00 0.01 0.00 0.00 42.46 38.02 1uwx s ILE 206 CO 0.47 -0.29 -0.24 0.68 0.00 0.00 0.00 174.94 175.55 1uwx s VAL 207 N 2.61 1.94 0.21 2.92 -7.23 -1.26 -0.18 120.40 119.42 1uwx s VAL 207 Ca 0.23 -1.20 0.11 0.00 -1.81 0.00 0.00 61.98 59.31 1uwx s VAL 207 Cb -0.15 -1.65 -0.05 0.00 0.56 0.00 0.00 36.38 35.10 1uwx s VAL 207 CO 0.14 0.40 -0.23 -0.54 -0.31 0.00 0.00 175.10 174.57 1uwx s LYS 208 N -0.95 1.53 0.15 4.82 -0.14 -0.94 -5.03 119.74 119.18 1uwx s LYS 208 Ca 0.10 -1.57 -0.19 0.00 -1.36 0.00 0.00 55.97 52.95 1uwx s LYS 208 Cb -0.09 -1.79 0.05 0.00 -1.68 0.00 0.00 37.83 34.31 1uwx s LYS 208 CO 0.01 0.38 0.49 0.45 -0.76 0.00 0.00 175.35 175.92 1uwx s SER 209 N -2.84 -0.36 -0.03 2.83 0.15 -1.26 -2.08 113.70 110.11 1uwx s SER 209 Ca 0.22 -0.23 -0.24 0.00 0.70 0.00 0.00 55.95 56.41 1uwx s SER 209 Cb -0.07 0.54 0.05 0.00 -1.71 0.00 0.00 66.02 64.83 1uwx s SER 209 CO 0.11 -0.93 0.52 0.72 1.20 0.00 0.00 173.24 174.86 1uwx s PHE 210 N -3.79 -0.45 -0.23 3.44 -0.12 -0.71 -5.01 117.98 111.10 1uwx s PHE 210 Ca 0.03 0.76 -0.12 0.00 -0.05 0.00 0.00 56.93 57.55 1uwx s PHE 210 Cb 0.00 0.27 -0.05 0.00 -0.63 0.00 0.00 43.02 42.62 1uwx s PHE 210 CO -0.11 -0.51 0.21 -0.80 -0.05 0.00 0.00 175.22 173.95 1uwx s ASN 211 N -1.25 6.20 0.50 1.98 0.02 -1.26 -1.41 114.94 119.72 1uwx s ASN 211 Ca -0.12 0.21 0.20 0.00 -1.02 0.00 0.00 52.86 52.13 1uwx s ASN 211 Cb -0.02 -2.13 1.25 0.00 0.02 0.00 0.00 41.25 40.37 1uwx s ASN 211 CO 0.08 0.05 2.01 -0.09 0.02 0.00 0.00 177.10 179.16 1uwx h ARG 212 N 7.38 0.14 0.00 -0.60 2.43 -0.60 -3.49 114.38 119.63 1uwx h ARG 212 Ca -0.38 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.78 1uwx h ARG 212 Cb 1.17 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1uwx h ARG 212 CO 0.68 0.09 0.00 -1.71 -1.51 0.00 0.00 179.97 177.52