#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wub s ILE 17 N 0.00 4.72 0.00 1.39 1.01 -1.26 -3.96 121.20 123.10 2wub s ILE 17 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 60.65 59.84 2wub s ILE 17 Cb 0.00 -4.51 0.00 0.00 0.01 0.00 0.00 42.46 37.96 2wub s ILE 17 CO 0.00 -1.16 0.00 0.61 0.00 0.00 0.00 174.94 174.39 2wub n GLY 18 N 5.28 0.80 1.49 6.18 0.00 -1.26 -4.78 105.19 112.90 2wub n GLY 18 Ca -0.08 -1.61 0.18 0.00 0.00 0.00 0.00 46.02 44.51 2wub n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wub n GLY 19 N 0.00 -3.14 0.00 -0.02 0.00 -1.26 -4.89 105.19 95.87 2wub n GLY 19 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.97 2wub n GLY 19 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wub n SER 20 N -4.40 -0.00 -4.94 1.61 3.41 -1.14 -4.91 113.62 103.24 2wub n SER 20 Ca -0.08 -0.24 -0.24 0.00 -0.26 0.00 0.00 58.87 58.05 2wub n SER 20 Cb 0.70 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.63 2wub n SER 20 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2wub s SER 21 N -1.01 6.32 0.17 4.04 0.15 -1.26 -3.58 113.70 118.53 2wub s SER 21 Ca 0.00 0.37 0.08 0.00 0.70 0.00 0.00 55.95 57.11 2wub s SER 21 Cb 0.00 -2.00 -0.04 0.00 -1.71 0.00 0.00 66.02 62.27 2wub s SER 21 CO 0.00 -0.20 -0.09 -0.55 1.20 0.00 0.00 173.24 173.60 2wub s SER 22 N -3.84 4.33 0.16 5.45 0.15 -1.10 -4.62 113.70 114.22 2wub s SER 22 Ca 0.39 -0.53 0.07 0.00 0.70 0.00 0.00 55.95 56.58 2wub s SER 22 Cb -0.10 -0.77 -0.04 0.00 -1.71 0.00 0.00 66.02 63.40 2wub s SER 22 CO 0.33 0.12 -0.03 -0.76 1.20 0.00 0.00 173.24 174.10 2wub s LEU 23 N -2.72 3.23 0.25 3.45 1.43 -1.26 -4.79 118.68 118.27 2wub s LEU 23 Ca 0.24 -0.41 -0.31 0.00 -1.03 0.00 0.00 54.13 52.62 2wub s LEU 23 Cb -0.09 -1.91 -0.12 0.00 0.03 0.00 0.00 46.19 44.09 2wub s LEU 23 CO 0.15 0.11 1.60 -2.65 0.23 0.00 0.00 176.35 175.79 2wub n PRO 24 N 0.06 2.58 -0.00 1.29 -0.02 -1.26 -1.91 135.00 135.74 2wub n PRO 24 Ca -0.10 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 2wub n PRO 24 Cb 0.55 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 2wub n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wub n GLY 25 N 2.73 1.27 0.27 -1.23 0.00 -1.26 -4.88 105.19 102.09 2wub n GLY 25 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.26 2wub n GLY 25 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2wub h SER 26 N 0.00 0.00 -1.28 1.61 0.02 -1.72 -3.29 113.55 108.90 2wub h SER 26 Ca 0.00 0.00 -0.43 0.00 -0.84 0.00 0.00 61.79 60.52 2wub h SER 26 Cb 0.00 0.00 -0.30 0.00 0.14 0.00 0.00 62.40 62.24 2wub h SER 26 CO 0.00 0.11 -0.89 1.41 -1.14 0.00 0.00 176.83 176.32 2wub n HIS 27 N -3.70 -1.38 0.33 3.45 8.25 -1.26 -4.98 115.22 115.94 2wub n HIS 27 Ca -0.02 -2.95 0.22 0.00 -0.26 0.00 0.00 57.72 54.71 2wub n HIS 27 Cb 0.22 0.34 1.15 0.00 1.12 0.00 0.00 29.99 32.82 2wub n HIS 27 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2wub h PRO 28 N 3.85 0.00 0.00 -0.41 0.13 -1.74 -0.69 132.00 133.14 2wub h PRO 28 Ca -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2wub h PRO 28 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 2wub h PRO 28 CO 0.41 0.00 -0.23 0.11 -0.23 0.00 0.00 178.00 178.05 2wub h TRP 29 N 0.00 0.00 -3.29 1.56 0.09 -1.60 -2.93 115.95 109.77 2wub h TRP 29 Ca -0.00 0.00 -0.53 0.00 0.09 0.00 0.00 58.89 58.45 2wub h TRP 29 Cb 0.06 0.00 0.04 0.00 0.08 0.00 0.00 29.16 29.34 2wub h TRP 29 CO 0.00 0.00 0.71 -1.17 0.09 0.00 0.00 178.44 178.07 2wub s LEU 30 N -4.48 4.40 -0.05 0.11 2.96 -0.27 -0.50 118.68 120.84 2wub s LEU 30 Ca 0.09 2.49 0.05 0.00 -0.22 0.00 0.00 54.13 56.54 2wub s LEU 30 Cb 0.12 -3.61 -0.01 0.00 0.50 0.00 0.00 46.19 43.20 2wub s LEU 30 CO 0.65 -0.62 -0.22 0.00 -1.32 0.00 0.00 176.35 174.83 2wub s ALA 31 N 0.29 1.93 -0.33 5.97 0.00 0.23 -4.19 121.76 125.66 2wub s ALA 31 Ca 0.60 -0.91 -0.17 0.00 0.00 0.00 0.00 51.96 51.48 2wub s ALA 31 Cb -0.39 -0.62 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 2wub s ALA 31 CO 0.38 0.36 0.44 0.00 0.00 0.00 0.00 175.76 176.94 2wub s ALA 32 N -0.06 3.50 -0.38 0.00 0.00 -0.61 -0.92 121.76 123.28 2wub s ALA 32 Ca -0.04 -1.03 -0.12 0.00 0.00 0.00 0.00 51.96 50.77 2wub s ALA 32 Cb -0.13 -2.90 0.03 0.00 0.00 0.00 0.00 23.12 20.12 2wub s ALA 32 CO 0.03 -1.06 0.22 0.42 0.00 0.00 0.00 175.76 175.37 2wub s ILE 33 N 2.21 4.67 -0.71 0.00 1.01 0.64 -1.10 121.20 127.91 2wub s ILE 33 Ca 0.16 -0.84 -0.19 0.00 0.00 0.00 0.00 60.65 59.78 2wub s ILE 33 Cb -0.16 -3.61 0.12 0.00 0.01 0.00 0.00 42.46 38.82 2wub s ILE 33 CO 0.12 -0.25 0.86 -0.31 0.00 0.00 0.00 174.94 175.36 2wub s TYR 34 N 1.57 3.06 -1.05 3.97 2.02 0.65 -1.19 117.35 126.38 2wub s TYR 34 Ca 0.02 -1.12 -0.12 0.00 -0.37 0.00 0.00 57.07 55.49 2wub s TYR 34 Cb -0.19 -4.10 0.23 0.00 -0.40 0.00 0.00 41.96 37.49 2wub s TYR 34 CO 0.07 -1.37 1.10 0.42 -1.57 0.00 0.00 175.55 174.20 2wub s ILE 35 N 2.62 5.62 0.00 2.71 1.01 -0.88 -0.74 121.20 131.54 2wub s ILE 35 Ca 0.19 -2.89 0.00 0.00 0.00 0.00 0.00 60.65 57.95 2wub s ILE 35 Cb -0.17 -4.65 0.00 0.00 0.01 0.00 0.00 42.46 37.65 2wub s ILE 35 CO 0.01 -1.26 0.00 0.61 0.00 0.00 0.00 174.94 174.30 2wub n GLY 36 N 3.51 1.43 0.00 6.18 0.00 0.11 -1.91 105.19 114.52 2wub n GLY 36 Ca 0.24 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.54 2wub n GLY 36 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wub n ASP 39 N 4.54 0.42 -2.50 1.61 10.43 -1.26 -5.06 116.55 124.73 2wub n ASP 39 Ca 0.00 -0.76 -0.04 0.00 2.57 0.00 0.00 54.79 56.56 2wub n ASP 39 Cb 0.00 0.23 0.01 0.00 1.84 0.00 0.00 41.12 43.20 2wub n ASP 39 CO 0.00 0.00 0.00 -0.24 -1.07 0.00 0.00 177.20 175.89 2wub n SER 40 N -0.23 0.53 -3.69 -2.24 2.88 -0.80 -5.14 113.62 104.94 2wub n SER 40 Ca 0.00 -1.27 -0.14 0.00 -1.33 0.00 0.00 58.87 56.13 2wub n SER 40 Cb 0.06 -0.06 -0.09 0.00 -0.75 0.00 0.00 64.21 63.37 2wub n SER 40 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 2wub s PHE 41 N 0.23 -0.59 0.23 0.66 5.36 -1.26 -2.07 117.98 120.54 2wub s PHE 41 Ca 0.09 1.43 -0.03 0.00 -0.96 0.00 0.00 56.93 57.47 2wub s PHE 41 Cb -0.01 0.20 -0.03 0.00 -0.34 0.00 0.00 43.02 42.85 2wub s PHE 41 CO 0.06 -0.29 0.24 0.00 -1.46 0.00 0.00 175.22 173.77 2wub s ALA 43 N -4.01 2.94 0.36 0.00 0.00 -0.71 -0.26 121.76 120.07 2wub s ALA 43 Ca 0.35 -2.11 -0.07 0.00 0.00 0.00 0.00 51.96 50.13 2wub s ALA 43 Cb 0.05 -0.00 0.02 0.00 0.00 0.00 0.00 23.12 23.18 2wub s ALA 43 CO 0.13 0.05 0.58 0.20 0.00 0.00 0.00 175.76 176.72 2wub s GLY 44 N -3.61 1.10 -0.07 0.00 0.00 -0.10 -3.43 107.32 101.22 2wub s GLY 44 Ca 0.33 -1.25 -0.00 0.00 0.00 0.00 0.00 44.72 43.79 2wub s GLY 44 CO 0.16 -0.76 -0.03 -0.56 0.00 0.00 0.00 173.10 171.91 2wub s SER 45 N -3.18 1.44 0.06 1.64 0.01 -0.20 -0.60 113.70 112.87 2wub s SER 45 Ca 0.25 -0.14 -0.31 0.00 1.31 0.00 0.00 55.95 57.06 2wub s SER 45 Cb -0.02 -0.52 -0.07 0.00 0.21 0.00 0.00 66.02 65.61 2wub s SER 45 CO 0.17 -0.12 1.51 -0.22 0.41 0.00 0.00 173.24 175.00 2wub s LEU 46 N 1.47 4.35 0.00 2.44 2.96 0.34 -1.01 118.68 129.23 2wub s LEU 46 Ca -0.02 2.35 0.00 0.00 -0.22 0.00 0.00 54.13 56.24 2wub s LEU 46 Cb -0.13 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 42.99 2wub s LEU 46 CO -0.03 -0.78 0.34 1.33 -1.32 0.00 0.00 176.35 175.88 2wub n VAL 47 N 4.49 0.00 -3.47 1.68 0.24 -0.74 -0.41 118.33 120.13 2wub n VAL 47 Ca 0.14 -0.47 -0.12 0.00 -2.04 0.00 0.00 64.34 61.85 2wub n VAL 47 Cb 0.42 1.04 -0.03 0.00 -1.47 0.00 0.00 33.84 33.80 2wub n VAL 47 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2wub s HIS 48 N -0.26 -0.51 0.63 6.34 5.65 -1.20 -4.84 115.29 121.10 2wub s HIS 48 Ca 0.00 0.47 0.30 0.00 0.25 0.00 0.00 55.06 56.09 2wub s HIS 48 Cb 0.00 0.52 1.65 0.00 -1.18 0.00 0.00 32.58 33.57 2wub s HIS 48 CO 0.00 -0.71 1.99 0.00 -0.65 0.00 0.00 174.74 175.37 2wub h THR 49 N 2.23 0.22 0.00 0.89 1.03 -1.96 -2.16 112.91 113.15 2wub h THR 49 Ca -0.29 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.11 2wub h THR 49 Cb 1.25 0.72 0.00 0.00 -1.07 0.00 0.00 68.15 69.05 2wub h THR 49 CO 0.36 0.00 -0.09 0.00 -0.01 0.00 0.00 175.52 175.78 2wub s TRP 51 N -1.43 1.11 -0.02 0.00 0.52 -0.81 -1.40 118.94 116.90 2wub s TRP 51 Ca 0.13 -0.34 0.01 0.00 0.02 0.00 0.00 56.10 55.92 2wub s TRP 51 Cb 0.11 -0.67 0.01 0.00 -1.15 0.00 0.00 33.47 31.78 2wub s TRP 51 CO 0.01 0.02 -0.03 0.08 0.02 0.00 0.00 176.95 177.05 2wub s VAL 52 N -0.80 0.36 -0.23 4.03 1.01 0.27 -1.79 120.40 123.25 2wub s VAL 52 Ca 0.01 -0.09 -0.09 0.00 0.00 0.00 0.00 61.98 61.80 2wub s VAL 52 Cb -0.07 -0.37 -0.05 0.00 0.00 0.00 0.00 36.38 35.89 2wub s VAL 52 CO 0.01 0.15 0.12 -0.69 0.00 0.00 0.00 175.10 174.70 2wub s VAL 53 N 0.53 5.10 0.06 2.92 1.01 -0.18 -0.36 120.40 129.48 2wub s VAL 53 Ca -0.06 0.09 0.01 0.00 0.00 0.00 0.00 61.98 62.01 2wub s VAL 53 Cb -0.09 -3.36 -0.00 0.00 0.00 0.00 0.00 36.38 32.93 2wub s VAL 53 CO -0.01 0.37 0.06 -0.24 0.00 0.00 0.00 175.10 175.29 2wub n SER 54 N 4.17 -0.15 -4.78 3.32 2.88 -0.71 -1.04 113.62 117.31 2wub n SER 54 Ca -0.16 -1.34 -0.39 0.00 -1.33 0.00 0.00 58.87 55.66 2wub n SER 54 Cb 0.52 0.32 -0.06 0.00 -0.75 0.00 0.00 64.21 64.25 2wub n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wub s ALA 55 N -2.06 3.52 0.43 -1.46 0.00 -1.26 -0.41 121.76 120.53 2wub s ALA 55 Ca 0.06 0.07 0.14 0.00 0.00 0.00 0.00 51.96 52.22 2wub s ALA 55 Cb 0.00 -2.72 0.93 0.00 0.00 0.00 0.00 23.12 21.33 2wub s ALA 55 CO 0.04 0.27 1.95 0.00 0.00 0.00 0.00 175.76 178.02 2wub h ALA 56 N 5.08 1.63 0.00 0.00 0.00 -1.74 -2.70 119.26 121.53 2wub h ALA 56 Ca -0.47 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2wub h ALA 56 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2wub h ALA 56 CO 0.67 0.28 0.00 -2.39 0.00 0.00 0.00 179.25 177.81 2wub n HIS 57 N -4.27 0.70 0.30 0.00 1.44 -1.26 -1.69 115.22 110.44 2wub n HIS 57 Ca -0.02 0.30 0.15 0.00 -2.01 0.00 0.00 57.72 56.14 2wub n HIS 57 Cb 0.28 -0.98 0.54 0.00 0.12 0.00 0.00 29.99 29.95 2wub n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2wub n PHE 59 N -2.94 0.00 0.31 0.00 3.72 -0.68 -4.73 117.46 113.15 2wub n PHE 59 Ca 0.02 -0.06 0.15 0.00 -0.05 0.00 0.00 57.45 57.50 2wub n PHE 59 Cb 0.35 -0.01 0.79 0.00 -0.94 0.00 0.00 39.48 39.67 2wub n PHE 59 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2wub h SER 60 N 0.10 0.00 -0.34 4.37 4.64 -1.50 0.41 113.55 121.22 2wub h SER 60 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wub h SER 60 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2wub h SER 60 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2wub n HIS 60 N -2.80 1.14 -1.21 4.77 1.44 -1.26 -5.06 115.22 112.25 2wub n HIS 60 Ca -0.02 -0.40 0.00 0.00 -2.01 0.00 0.00 57.72 55.29 2wub n HIS 60 Cb 0.35 -0.30 0.00 0.00 0.12 0.00 0.00 29.99 30.15 2wub n HIS 60 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 2wub n SER 60 N 0.40 -0.15 -4.62 4.39 7.64 0.14 -5.21 113.62 116.21 2wub n SER 60 Ca 0.16 0.41 -0.34 0.00 1.01 0.00 0.00 58.87 60.11 2wub n SER 60 Cb 0.75 -1.56 -0.10 0.00 -1.01 0.00 0.00 64.21 62.29 2wub n SER 60 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2wub s PRO 60 N -2.22 3.59 0.54 1.43 0.02 -1.26 -5.18 135.00 131.93 2wub s PRO 60 Ca 0.00 -0.40 0.28 0.00 0.02 0.00 0.00 61.00 60.90 2wub s PRO 60 Cb 0.00 -3.01 1.45 0.00 0.02 0.00 0.00 34.50 32.96 2wub s PRO 60 CO 0.00 0.41 1.94 0.00 -0.33 0.00 0.00 177.00 179.02 2wub h ARG 61 N 6.18 0.00 0.00 5.54 3.08 -1.96 0.07 114.38 127.28 2wub h ARG 61 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.65 2wub h ARG 61 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 2wub h ARG 61 CO 0.63 0.00 0.00 -0.44 -1.07 0.00 0.00 179.97 179.09 2wub h ASP 62 N 0.00 0.00 -0.28 7.04 5.19 -2.01 -2.69 116.42 123.67 2wub h ASP 62 Ca 0.32 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.73 2wub h ASP 62 Cb 1.32 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.83 2wub h ASP 62 CO -0.00 0.00 0.00 -1.54 -3.12 0.00 0.00 179.24 174.58 2wub n SER 63 N -2.93 3.23 -4.48 6.45 3.41 0.01 -4.90 113.62 114.41 2wub n SER 63 Ca -0.00 -1.97 -0.39 0.00 -0.26 0.00 0.00 58.87 56.24 2wub n SER 63 Cb 0.23 -0.17 -0.11 0.00 -0.26 0.00 0.00 64.21 63.89 2wub n SER 63 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2wub s VAL 64 N -1.65 4.90 -0.09 -3.33 1.01 -1.01 -0.71 120.40 119.51 2wub s VAL 64 Ca 0.36 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 62.05 2wub s VAL 64 Cb 0.22 -3.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.09 2wub s VAL 64 CO 0.31 0.04 -0.19 -0.55 0.00 0.00 0.00 175.10 174.71 2wub s SER 65 N 1.66 3.52 -0.22 3.32 0.15 0.08 -3.58 113.70 118.63 2wub s SER 65 Ca 0.05 -0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.29 2wub s SER 65 Cb -0.17 -1.24 0.03 0.00 -1.71 0.00 0.00 66.02 62.92 2wub s SER 65 CO 0.08 0.21 -0.12 -0.69 1.20 0.00 0.00 173.24 173.92 2wub s VAL 66 N 0.06 2.45 -0.20 4.45 1.01 -0.25 -0.25 120.40 127.67 2wub s VAL 66 Ca -0.08 -1.09 -0.05 0.00 0.00 0.00 0.00 61.98 60.76 2wub s VAL 66 Cb -0.15 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.00 2wub s VAL 66 CO 0.05 0.30 0.01 -0.69 0.00 0.00 0.00 175.10 174.77 2wub s VAL 67 N 1.27 4.08 0.11 2.92 1.01 -0.26 -0.37 120.40 129.15 2wub s VAL 67 Ca 0.00 -0.27 0.02 0.00 0.00 0.00 0.00 61.98 61.73 2wub s VAL 67 Cb -0.16 -2.84 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 2wub s VAL 67 CO -0.08 0.43 0.19 -0.76 0.00 0.00 0.00 175.10 174.88 2wub s LEU 68 N 0.91 4.14 -1.06 3.92 1.43 0.11 -1.58 118.68 126.54 2wub s LEU 68 Ca 0.01 0.11 -0.06 0.00 -1.03 0.00 0.00 54.13 53.17 2wub s LEU 68 Cb -0.14 -2.75 0.01 0.00 0.03 0.00 0.00 46.19 43.34 2wub s LEU 68 CO 0.02 0.12 0.77 0.61 0.23 0.00 0.00 176.35 178.10 2wub n GLY 69 N -0.04 -0.18 3.81 -3.19 0.00 -1.25 -0.73 105.19 103.60 2wub n GLY 69 Ca -0.07 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 2wub n GLY 69 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2wub s GLN 70 N -5.83 3.20 -0.02 1.61 0.74 -1.26 -4.05 119.66 114.05 2wub s GLN 70 Ca 0.38 -0.35 -0.00 0.00 0.05 0.00 0.00 55.36 55.44 2wub s GLN 70 Cb -0.17 -2.97 -0.01 0.00 1.10 0.00 0.00 33.01 30.96 2wub s GLN 70 CO 0.47 0.70 -0.02 1.58 -0.55 0.00 0.00 175.29 177.47 2wub n HIS 71 N 1.53 0.00 -3.66 1.67 -0.00 -1.26 -4.97 115.22 108.54 2wub n HIS 71 Ca -0.16 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.19 2wub n HIS 71 Cb 0.53 -0.07 -0.06 0.00 -0.00 0.00 0.00 29.99 30.39 2wub n HIS 71 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 2wub s PHE 72 N -2.04 3.59 0.16 1.57 0.08 -1.26 -1.19 117.98 118.89 2wub s PHE 72 Ca -0.03 0.68 -0.32 0.00 0.12 0.00 0.00 56.93 57.39 2wub s PHE 72 Cb 0.01 -2.17 -0.11 0.00 -0.57 0.00 0.00 43.02 40.17 2wub s PHE 72 CO 0.04 0.55 1.78 0.34 -0.10 0.00 0.00 175.22 177.82 2wub n PHE 73 N 2.45 2.65 -2.09 0.36 7.35 -0.63 -2.32 117.46 125.23 2wub n PHE 73 Ca -0.16 -0.04 -0.19 0.00 -0.76 0.00 0.00 57.45 56.31 2wub n PHE 73 Cb 0.53 -2.70 -0.03 0.00 0.35 0.00 0.00 39.48 37.63 2wub n PHE 73 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 2wub n ASN 74 N 4.83 -5.19 -4.07 -2.13 2.85 -1.26 -4.96 115.26 105.34 2wub n ASN 74 Ca 0.17 0.19 -0.31 0.00 -0.11 0.00 0.00 54.58 54.53 2wub n ASN 74 Cb 0.36 -4.45 -0.16 0.00 1.24 0.00 0.00 39.78 36.77 2wub n ASN 74 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 2wub s ARG 75 N -4.51 2.55 -0.09 1.20 1.81 -0.98 -5.12 118.95 113.81 2wub s ARG 75 Ca 0.00 -0.66 -0.09 0.00 -1.72 0.00 0.00 55.73 53.25 2wub s ARG 75 Cb 0.00 -2.24 -0.05 0.00 -0.45 0.00 0.00 34.95 32.22 2wub s ARG 75 CO 0.00 -0.18 0.22 -0.08 -0.68 0.00 0.00 175.30 174.58 2wub s THR 76 N 1.30 5.36 0.00 0.02 -1.32 -1.26 -4.62 115.64 115.12 2wub s THR 76 Ca 0.02 0.40 0.00 0.00 -1.21 0.00 0.00 61.69 60.90 2wub s THR 76 Cb -0.13 -3.50 0.00 0.00 -1.51 0.00 0.00 72.50 67.36 2wub s THR 76 CO -0.09 0.60 0.00 0.35 -2.21 0.00 0.00 174.62 173.27 2wub n THR 77 N 2.00 0.00 1.14 5.08 -2.24 -1.26 -5.02 114.28 113.98 2wub n THR 77 Ca -0.18 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.71 2wub n THR 77 Cb 0.54 -0.00 0.36 0.00 -2.10 0.00 0.00 70.33 69.13 2wub n THR 77 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2wub n ASP 78 N -0.27 1.97 0.00 3.42 5.75 -1.26 -3.83 116.55 122.32 2wub n ASP 78 Ca 0.00 -1.73 0.00 0.00 -0.01 0.00 0.00 54.79 53.05 2wub n ASP 78 Cb 0.00 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 39.99 2wub n ASP 78 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 2wub n VAL 79 N 0.52 0.00 -2.89 2.12 0.24 -1.26 -5.04 118.33 112.01 2wub n VAL 79 Ca 0.17 -0.41 -0.39 0.00 -2.04 0.00 0.00 64.34 61.67 2wub n VAL 79 Cb 0.39 1.14 -0.06 0.00 -1.47 0.00 0.00 33.84 33.84 2wub n VAL 79 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2wub s THR 80 N -0.19 4.28 -0.26 3.34 -4.23 -1.25 -4.69 115.64 112.65 2wub s THR 80 Ca 0.00 1.78 0.02 0.00 -1.18 0.00 0.00 61.69 62.31 2wub s THR 80 Cb 0.00 -4.14 0.05 0.00 1.34 0.00 0.00 72.50 69.76 2wub s THR 80 CO 0.00 0.41 -0.10 -1.10 -0.54 0.00 0.00 174.62 173.29 2wub s GLN 81 N -1.42 2.37 -0.13 3.99 -0.21 0.10 -4.83 119.66 119.52 2wub s GLN 81 Ca 0.41 -1.27 -0.12 0.00 0.02 0.00 0.00 55.36 54.40 2wub s GLN 81 Cb -0.22 -2.91 -0.05 0.00 1.00 0.00 0.00 33.01 30.83 2wub s GLN 81 CO 0.27 -0.53 0.27 0.99 -2.12 0.00 0.00 175.29 174.16 2wub s THR 82 N 1.15 5.31 0.10 -0.19 2.01 -1.26 0.03 115.64 122.79 2wub s THR 82 Ca -0.07 0.50 0.05 0.00 0.31 0.00 0.00 61.69 62.49 2wub s THR 82 Cb -0.19 -3.59 -0.03 0.00 0.01 0.00 0.00 72.50 68.69 2wub s THR 82 CO -0.05 0.46 -0.14 -0.36 -0.69 0.00 0.00 174.62 173.84 2wub s PHE 83 N -0.01 1.30 0.20 4.92 0.40 0.50 -4.98 117.98 120.31 2wub s PHE 83 Ca 0.16 -0.52 -0.00 0.00 -0.60 0.00 0.00 56.93 55.97 2wub s PHE 83 Cb -0.13 -0.71 -0.04 0.00 0.51 0.00 0.00 43.02 42.65 2wub s PHE 83 CO 0.05 0.09 0.39 0.20 0.70 0.00 0.00 175.22 176.65 2wub s GLY 84 N -2.12 1.76 0.00 4.36 0.00 -1.26 -1.09 107.32 108.98 2wub s GLY 84 Ca 0.04 -0.85 -0.06 0.00 0.00 0.00 0.00 44.72 43.84 2wub s GLY 84 CO 0.02 -0.81 0.25 -0.26 0.00 0.00 0.00 173.10 172.30 2wub s ILE 85 N -1.87 5.33 0.03 0.90 -4.36 -1.23 -0.80 121.20 119.19 2wub s ILE 85 Ca 0.38 0.11 0.07 0.00 -0.26 0.00 0.00 60.65 60.94 2wub s ILE 85 Cb -0.11 -3.55 -0.23 0.00 1.25 0.00 0.00 42.46 39.81 2wub s ILE 85 CO 0.29 0.37 0.93 -0.33 0.24 0.00 0.00 174.94 176.44 2wub h GLU 86 N 3.98 0.06 0.00 0.37 4.39 0.43 -3.45 114.58 120.36 2wub h GLU 86 Ca -0.50 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 59.10 2wub h GLU 86 Cb 1.20 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 2wub h GLU 86 CO 0.66 0.83 0.00 0.36 -1.16 0.00 0.00 179.01 179.71 2wub n LYS 87 N -3.26 0.00 -5.16 2.33 2.85 -1.21 -5.01 118.16 108.71 2wub n LYS 87 Ca -0.11 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 56.83 2wub n LYS 87 Cb 1.01 0.00 -0.17 0.00 -0.65 0.00 0.00 35.03 35.22 2wub n LYS 87 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 177.40 178.87 2wub s TYR 88 N -2.00 2.60 -0.34 5.58 1.13 -1.26 -1.50 117.35 121.56 2wub s TYR 88 Ca 0.00 -0.98 0.01 0.00 -1.41 0.00 0.00 57.07 54.69 2wub s TYR 88 Cb 0.00 -1.73 0.09 0.00 -1.10 0.00 0.00 41.96 39.22 2wub s TYR 88 CO 0.00 -0.39 0.06 0.42 -2.51 0.00 0.00 175.55 173.13 2wub s ILE 89 N 0.33 2.62 1.05 -3.49 1.01 0.38 -4.91 121.20 118.19 2wub s ILE 89 Ca -0.18 -2.04 -0.13 0.00 0.00 0.00 0.00 60.65 58.30 2wub s ILE 89 Cb -0.18 -2.78 0.22 0.00 0.01 0.00 0.00 42.46 39.73 2wub s ILE 89 CO 0.08 -0.48 1.08 -2.84 0.00 0.00 0.00 174.94 172.79 2wub s PRO 90 N 1.04 0.01 0.23 2.79 0.02 -1.26 -0.22 135.00 137.60 2wub s PRO 90 Ca 0.05 0.52 -0.30 0.00 0.02 0.00 0.00 61.00 61.30 2wub s PRO 90 Cb -0.20 -1.69 -0.09 0.00 0.02 0.00 0.00 34.50 32.54 2wub s PRO 90 CO -0.06 -3.02 1.27 -0.47 -0.33 0.00 0.00 177.00 174.40 2wub s TYR 91 N -2.87 3.28 0.39 6.54 5.04 -0.67 -4.82 117.35 124.23 2wub s TYR 91 Ca 0.66 1.33 0.23 0.00 -2.44 0.00 0.00 57.07 56.86 2wub s TYR 91 Cb -0.20 -3.56 1.35 0.00 0.35 0.00 0.00 41.96 39.91 2wub s TYR 91 CO 0.59 -1.64 1.59 1.15 -1.34 0.00 0.00 175.55 175.90 2wub h THR 92 N 3.55 0.05 -0.20 4.34 2.02 -1.92 0.14 112.91 120.90 2wub h THR 92 Ca -0.46 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 66.71 2wub h THR 92 Cb 1.22 -0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 2wub h THR 92 CO 0.74 0.01 0.00 0.18 0.37 0.00 0.00 175.52 176.82 2wub n LEU 93 N -5.09 3.21 -4.70 2.58 4.77 -1.26 -4.98 117.00 111.53 2wub n LEU 93 Ca 0.38 -1.24 -0.43 0.00 -0.03 0.00 0.00 56.01 54.68 2wub n LEU 93 Cb 1.32 -0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 42.28 2wub n LEU 93 CO 0.07 0.62 1.00 0.00 -1.33 0.00 0.00 177.39 177.74 2wub n TYR 94 N 1.41 2.35 -4.24 -1.77 9.36 0.50 -4.98 117.16 119.79 2wub n TYR 94 Ca 0.16 0.47 -0.27 0.00 3.32 0.00 0.00 57.90 61.58 2wub n TYR 94 Cb 0.60 -2.46 -0.17 0.00 -0.63 0.00 0.00 39.34 36.68 2wub n TYR 94 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2wub s SER 95 N 0.01 2.22 0.54 2.98 0.15 -1.26 -4.97 113.70 113.37 2wub s SER 95 Ca 0.61 -0.36 0.23 0.00 0.70 0.00 0.00 55.95 57.12 2wub s SER 95 Cb -0.58 -0.95 1.49 0.00 -1.71 0.00 0.00 66.02 64.26 2wub s SER 95 CO 0.56 -0.04 2.16 1.62 1.20 0.00 0.00 173.24 178.75 2wub h VAL 96 N 6.05 0.77 -0.30 4.45 3.04 -1.96 -0.69 116.25 127.61 2wub h VAL 96 Ca -0.32 -0.15 -0.10 0.00 -1.01 0.00 0.00 66.70 65.12 2wub h VAL 96 Cb 1.16 1.09 -0.06 0.00 -2.01 0.00 0.00 31.29 31.47 2wub h VAL 96 CO 0.46 0.04 0.13 0.49 -1.01 0.00 0.00 177.57 177.68 2wub n PHE 97 N -4.11 0.99 -2.68 3.17 0.99 -1.26 -3.69 117.46 110.87 2wub n PHE 97 Ca -0.03 -0.65 -0.05 0.00 -0.00 0.00 0.00 57.45 56.72 2wub n PHE 97 Cb 0.13 -0.39 0.08 0.00 -1.00 0.00 0.00 39.48 38.30 2wub n PHE 97 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 2wub n ASN 98 N 0.05 -1.55 -0.27 4.37 5.15 -0.28 -5.06 115.26 117.68 2wub n ASN 98 Ca 0.17 -2.31 0.07 0.00 -0.60 0.00 0.00 54.58 51.91 2wub n ASN 98 Cb 0.78 1.28 0.21 0.00 -0.53 0.00 0.00 39.78 41.52 2wub n ASN 98 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2wub h PRO 99 N 2.10 0.37 -0.05 1.20 0.13 -1.60 -2.74 132.00 131.40 2wub h PRO 99 Ca -0.32 -0.02 0.02 0.00 -0.87 0.00 0.00 66.00 64.80 2wub h PRO 99 Cb 1.21 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 2wub h PRO 99 CO -0.03 0.24 0.16 0.66 -0.23 0.00 0.00 178.00 178.80 2wub h SER 99 N 0.38 0.00 -3.10 1.44 4.64 -1.94 -3.37 113.55 111.60 2wub h SER 99 Ca 0.45 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 61.13 2wub h SER 99 Cb 0.75 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.72 2wub h SER 99 CO -0.47 0.00 -0.53 -0.62 -0.87 0.00 0.00 176.83 174.34 2wub s ASP 100 N -5.13 5.94 -1.34 4.97 2.15 -1.03 -4.24 116.67 117.98 2wub s ASP 100 Ca -0.04 0.24 0.00 0.00 0.43 0.00 0.00 52.55 53.18 2wub s ASP 100 Cb 0.12 -1.96 0.00 0.00 -0.30 0.00 0.00 42.92 40.78 2wub s ASP 100 CO 0.41 0.27 0.00 1.41 -0.17 0.00 0.00 175.17 177.09 2wub n HIS 101 N 2.89 -0.39 -1.67 -5.34 8.25 -1.26 -4.47 115.22 113.22 2wub n HIS 101 Ca -0.18 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.01 2wub n HIS 101 Cb 0.53 -2.83 -0.08 0.00 1.12 0.00 0.00 29.99 28.73 2wub n HIS 101 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2wub n ASP 102 N -0.55 2.33 -3.70 0.41 2.03 -1.26 -4.57 116.55 111.24 2wub n ASP 102 Ca -0.16 -2.62 -0.11 0.00 0.52 0.00 0.00 54.79 52.42 2wub n ASP 102 Cb 0.56 -1.55 -0.10 0.00 -0.72 0.00 0.00 41.12 39.31 2wub n ASP 102 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2wub s LEU 103 N 10.64 -0.08 0.03 -2.67 2.96 -1.26 -4.06 118.68 124.24 2wub s LEU 103 Ca 0.71 0.96 0.01 0.00 -0.22 0.00 0.00 54.13 55.60 2wub s LEU 103 Cb 0.01 1.52 -0.02 0.00 0.50 0.00 0.00 46.19 48.20 2wub s LEU 103 CO 0.17 -0.19 -0.05 0.54 -1.32 0.00 0.00 176.35 175.50 2wub s VAL 104 N 1.08 0.34 -0.29 1.68 0.11 0.46 -1.66 120.40 122.12 2wub s VAL 104 Ca -0.07 -0.84 -0.04 0.00 -2.93 0.00 0.00 61.98 58.10 2wub s VAL 104 Cb -0.07 -0.42 0.03 0.00 -1.53 0.00 0.00 36.38 34.40 2wub s VAL 104 CO -0.10 -0.33 0.03 -0.76 -3.33 0.00 0.00 175.10 170.61 2wub s LEU 105 N -1.24 3.75 -0.22 2.54 1.43 0.69 -1.74 118.68 123.89 2wub s LEU 105 Ca -0.10 -0.96 -0.11 0.00 -1.03 0.00 0.00 54.13 51.94 2wub s LEU 105 Cb -0.08 -1.78 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 2wub s LEU 105 CO -0.00 -0.21 0.18 -0.63 0.23 0.00 0.00 176.35 175.91 2wub s ILE 106 N 1.38 5.36 -0.27 -0.59 1.01 0.52 -0.47 121.20 128.13 2wub s ILE 106 Ca -0.01 0.24 -0.09 0.00 0.00 0.00 0.00 60.65 60.79 2wub s ILE 106 Cb -0.18 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 2wub s ILE 106 CO -0.00 0.37 0.13 -0.60 0.00 0.00 0.00 174.94 174.84 2wub s ARG 107 N 0.86 3.81 0.49 2.79 3.52 -0.56 -0.57 118.95 129.29 2wub s ARG 107 Ca 0.09 -0.39 -0.16 0.00 -0.13 0.00 0.00 55.73 55.14 2wub s ARG 107 Cb -0.13 -3.50 -0.08 0.00 -1.56 0.00 0.00 34.95 29.68 2wub s ARG 107 CO 0.03 -0.18 0.95 -0.51 -0.81 0.00 0.00 175.30 174.78 2wub s LEU 108 N 1.69 3.67 0.31 -0.88 1.43 -0.50 0.10 118.68 124.50 2wub s LEU 108 Ca 0.07 1.51 -0.28 0.00 -1.03 0.00 0.00 54.13 54.40 2wub s LEU 108 Cb -0.16 -4.44 -0.09 0.00 0.03 0.00 0.00 46.19 41.53 2wub s LEU 108 CO 0.07 -0.55 1.03 -0.54 0.23 0.00 0.00 176.35 176.60 2wub s LYS 109 N -3.98 4.57 0.39 1.70 1.02 0.02 -4.56 119.74 118.89 2wub s LYS 109 Ca 0.58 1.61 -0.25 0.00 0.02 0.00 0.00 55.97 57.92 2wub s LYS 109 Cb -0.10 -3.00 -0.09 0.00 -0.52 0.00 0.00 37.83 34.12 2wub s LYS 109 CO 0.30 0.20 1.13 0.15 -0.92 0.00 0.00 175.35 176.22 2wub s LYS 110 N -1.72 4.13 -0.43 1.68 1.02 -1.26 -4.70 119.74 118.46 2wub s LYS 110 Ca 0.48 1.75 0.08 0.00 0.02 0.00 0.00 55.97 58.30 2wub s LYS 110 Cb -0.27 -2.69 0.41 0.00 -0.52 0.00 0.00 37.83 34.77 2wub s LYS 110 CO 0.34 -0.23 1.03 1.63 -0.92 0.00 0.00 175.35 177.20 2wub n LYS 111 N 0.13 2.78 0.00 1.68 4.76 0.20 -4.98 118.16 122.73 2wub n LYS 111 Ca 0.04 -4.23 0.00 0.00 -2.87 0.00 0.00 58.31 51.25 2wub n LYS 111 Cb 0.47 -2.00 0.00 0.00 -1.84 0.00 0.00 35.03 31.66 2wub n LYS 111 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wub n GLY 111 N -0.31 0.13 0.12 0.72 0.00 -1.26 -4.59 105.19 100.00 2wub n GLY 111 Ca 0.31 -1.40 0.12 0.00 0.00 0.00 0.00 46.02 45.05 2wub n GLY 111 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2wub h ASP 111 N 0.00 0.00 -2.27 1.61 2.03 -2.03 -3.47 116.42 112.29 2wub h ASP 111 Ca 0.00 -0.05 -0.08 0.00 -0.73 0.00 0.00 57.03 56.17 2wub h ASP 111 Cb 0.00 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.48 2wub h ASP 111 CO 0.00 0.03 -0.05 -2.11 -1.03 0.00 0.00 179.24 176.07 2wub n ARG 111 N -2.44 0.14 0.00 4.15 1.85 -1.26 -5.13 116.66 113.97 2wub n ARG 111 Ca 0.04 -0.67 0.00 0.00 -1.00 0.00 0.00 57.85 56.22 2wub n ARG 111 Cb 0.46 0.62 0.00 0.00 -1.05 0.00 0.00 32.46 32.49 2wub n ARG 111 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2wub s ALA 112 N -3.05 3.45 -0.07 0.00 0.00 0.15 -4.69 121.76 117.54 2wub s ALA 112 Ca 0.00 1.25 0.02 0.00 0.00 0.00 0.00 51.96 53.23 2wub s ALA 112 Cb 0.00 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 2wub s ALA 112 CO 0.00 -0.67 -0.11 0.95 0.00 0.00 0.00 175.76 175.94 2wub s THR 113 N -1.17 3.37 0.52 0.00 -4.23 -1.26 -4.77 115.64 108.10 2wub s THR 113 Ca 0.50 -0.60 -0.21 0.00 -1.18 0.00 0.00 61.69 60.20 2wub s THR 113 Cb -0.39 -2.36 -0.06 0.00 1.34 0.00 0.00 72.50 71.03 2wub s THR 113 CO 0.52 0.59 1.22 -0.13 -0.54 0.00 0.00 174.62 176.28 2wub s ARG 114 N -0.68 3.36 0.08 3.99 0.52 -1.26 -4.76 118.95 120.20 2wub s ARG 114 Ca 0.10 1.88 -0.11 0.00 -0.52 0.00 0.00 55.73 57.09 2wub s ARG 114 Cb -0.11 -2.20 0.04 0.00 0.52 0.00 0.00 34.95 33.19 2wub s ARG 114 CO 0.01 -0.91 0.50 -1.13 0.02 0.00 0.00 175.30 173.79 2wub n SER 115 N -0.99 -0.80 0.06 0.23 3.41 -0.73 -4.93 113.62 109.87 2wub n SER 115 Ca 0.10 -1.40 0.11 0.00 -0.26 0.00 0.00 58.87 57.42 2wub n SER 115 Cb 0.48 1.29 0.44 0.00 -0.26 0.00 0.00 64.21 66.16 2wub n SER 115 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2wub n GLN 116 N -0.35 0.11 0.00 4.33 7.27 -1.26 -3.25 117.38 124.23 2wub n GLN 116 Ca -0.01 0.27 0.00 0.00 0.07 0.00 0.00 57.00 57.33 2wub n GLN 116 Cb 0.28 -1.68 -0.00 0.00 2.41 0.00 0.00 30.24 31.24 2wub n GLN 116 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 2wub n PHE 117 N -1.89 0.00 -3.71 3.69 3.72 -1.26 -4.54 117.46 113.48 2wub n PHE 117 Ca 0.04 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.15 2wub n PHE 117 Cb 0.26 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.64 2wub n PHE 117 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2wub s VAL 118 N -0.67 0.58 -0.02 -4.37 1.01 -1.20 -3.94 120.40 111.80 2wub s VAL 118 Ca 0.00 -0.90 -0.01 0.00 0.00 0.00 0.00 61.98 61.08 2wub s VAL 118 Cb 0.00 -1.26 0.01 0.00 0.00 0.00 0.00 36.38 35.13 2wub s VAL 118 CO 0.01 -0.45 0.03 -1.10 0.00 0.00 0.00 175.10 173.60 2wub s GLN 119 N 1.80 0.02 0.14 2.72 -1.52 -1.11 -1.78 119.66 119.94 2wub s GLN 119 Ca 0.04 0.08 -0.30 0.00 -1.95 0.00 0.00 55.36 53.24 2wub s GLN 119 Cb -0.17 -0.05 -0.07 0.00 -0.22 0.00 0.00 33.01 32.51 2wub s GLN 119 CO -0.18 -0.04 1.05 -1.25 -0.25 0.00 0.00 175.29 174.62 2wub s PRO 120 N 0.28 4.62 0.68 2.91 0.04 -1.26 -1.71 135.00 140.56 2wub s PRO 120 Ca -0.02 1.62 -0.11 0.00 0.04 0.00 0.00 61.00 62.53 2wub s PRO 120 Cb -0.03 -3.32 -0.00 0.00 0.04 0.00 0.00 34.50 31.19 2wub s PRO 120 CO -0.01 0.10 1.06 -1.50 0.04 0.00 0.00 177.00 176.70 2wub s ILE 121 N -0.04 4.00 0.25 0.56 2.07 0.45 -4.94 121.20 123.56 2wub s ILE 121 Ca 0.49 0.65 -0.16 0.00 -1.41 0.00 0.00 60.65 60.23 2wub s ILE 121 Cb -0.27 -3.56 -0.08 0.00 0.13 0.00 0.00 42.46 38.68 2wub s ILE 121 CO 0.32 -0.85 0.68 0.00 -1.91 0.00 0.00 174.94 173.18 2wub s LEU 123 N -2.49 4.24 1.41 0.00 1.43 -1.26 -0.62 118.68 121.38 2wub s LEU 123 Ca 0.47 0.81 -0.22 0.00 -1.03 0.00 0.00 54.13 54.16 2wub s LEU 123 Cb -0.13 -2.74 0.35 0.00 0.03 0.00 0.00 46.19 43.70 2wub s LEU 123 CO 0.19 -0.07 0.82 -0.81 0.23 0.00 0.00 176.35 176.71 2wub n PRO 124 N 4.05 -4.42 -3.87 1.29 -0.04 -1.26 -4.92 135.00 125.83 2wub n PRO 124 Ca -0.06 -1.31 -0.31 0.00 -0.04 0.00 0.00 63.50 61.78 2wub n PRO 124 Cb 0.51 -1.88 -0.04 0.00 -0.04 0.00 0.00 33.50 32.05 2wub n PRO 124 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2wub s GLU 125 N -4.82 3.48 0.10 0.54 0.41 -1.26 -4.90 118.70 112.24 2wub s GLU 125 Ca 0.64 -0.37 -0.36 0.00 -0.41 0.00 0.00 54.97 54.46 2wub s GLU 125 Cb -0.12 -3.00 -0.17 0.00 -1.78 0.00 0.00 34.13 29.06 2wub s GLU 125 CO 0.54 0.58 1.28 -2.30 -0.49 0.00 0.00 175.26 174.87 2wub n PRO 126 N 0.23 1.04 0.00 0.39 -0.02 -1.26 -1.94 135.00 133.44 2wub n PRO 126 Ca -0.04 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 2wub n PRO 126 Cb 0.51 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 2wub n PRO 126 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wub n GLY 127 N 2.33 0.51 3.62 -1.23 0.00 -1.23 -4.93 105.19 104.26 2wub n GLY 127 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 2wub n GLY 127 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wub n SER 128 N 0.03 0.60 -3.71 1.61 3.41 -0.82 -5.03 113.62 109.72 2wub n SER 128 Ca 0.00 0.70 -0.16 0.00 -0.26 0.00 0.00 58.87 59.15 2wub n SER 128 Cb 0.00 -1.41 -0.09 0.00 -0.26 0.00 0.00 64.21 62.45 2wub n SER 128 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2wub s THR 129 N -1.73 0.00 0.04 6.66 -4.23 -1.26 -4.85 115.64 110.26 2wub s THR 129 Ca 0.74 -1.97 0.08 0.00 -1.18 0.00 0.00 61.69 59.37 2wub s THR 129 Cb -0.36 -2.50 -0.03 0.00 1.34 0.00 0.00 72.50 70.95 2wub s THR 129 CO 0.49 0.00 -0.23 -0.36 -0.54 0.00 0.00 174.62 173.98 2wub s PHE 130 N -3.73 2.43 0.24 3.99 0.40 -1.26 -5.10 117.98 114.96 2wub s PHE 130 Ca 0.39 -0.34 -0.31 0.00 -0.60 0.00 0.00 56.93 56.07 2wub s PHE 130 Cb 0.04 -1.43 -0.13 0.00 0.51 0.00 0.00 43.02 42.01 2wub s PHE 130 CO 0.21 0.17 1.50 -0.35 0.70 0.00 0.00 175.22 177.45 2wub n PRO 131 N 1.74 2.28 -1.64 0.24 -0.04 -1.26 -4.90 135.00 131.42 2wub n PRO 131 Ca -0.17 0.82 -0.42 0.00 -0.04 0.00 0.00 63.50 63.69 2wub n PRO 131 Cb 0.52 -2.53 0.00 0.00 -0.04 0.00 0.00 33.50 31.45 2wub n PRO 131 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wub n ALA 132 N 2.30 0.56 0.00 0.55 0.00 -1.26 -1.31 120.51 121.34 2wub n ALA 132 Ca 0.12 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.86 2wub n ALA 132 Cb 0.33 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.64 2wub n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wub n GLY 133 N 1.03 1.70 3.74 0.00 0.00 0.60 -4.93 105.19 107.33 2wub n GLY 133 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2wub n GLY 133 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2wub n HIS 134 N -2.00 2.72 -2.74 1.61 -0.00 -0.43 -4.43 115.22 109.95 2wub n HIS 134 Ca 0.00 0.42 -0.42 0.00 -0.00 0.00 0.00 57.72 57.71 2wub n HIS 134 Cb 0.00 -2.52 -0.04 0.00 -0.00 0.00 0.00 29.99 27.44 2wub n HIS 134 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.34 176.49 2wub s LYS 135 N -1.46 3.20 0.31 1.57 1.02 -1.26 -0.96 119.74 122.16 2wub s LYS 135 Ca 0.58 -0.47 0.06 0.00 0.02 0.00 0.00 55.97 56.16 2wub s LYS 135 Cb -0.52 -4.17 -0.02 0.00 -0.52 0.00 0.00 37.83 32.61 2wub s LYS 135 CO 0.58 -1.85 0.39 0.00 -0.92 0.00 0.00 175.35 173.55 2wub s GLN 137 N -4.07 1.23 0.00 0.00 0.74 0.75 -0.77 119.66 117.55 2wub s GLN 137 Ca 0.41 -1.27 -0.01 0.00 0.05 0.00 0.00 55.36 54.54 2wub s GLN 137 Cb -0.09 -1.51 -0.01 0.00 1.10 0.00 0.00 33.01 32.51 2wub s GLN 137 CO 0.29 0.34 0.01 0.96 -0.55 0.00 0.00 175.29 176.35 2wub s ILE 138 N -1.34 0.06 0.08 -2.34 -4.36 -1.05 -1.78 121.20 110.48 2wub s ILE 138 Ca 0.11 -0.51 0.01 0.00 -0.26 0.00 0.00 60.65 60.00 2wub s ILE 138 Cb -0.09 -0.19 -0.04 0.00 1.25 0.00 0.00 42.46 43.39 2wub s ILE 138 CO 0.05 -0.28 -0.06 0.00 0.24 0.00 0.00 174.94 174.90 2wub s ALA 139 N -0.83 0.85 0.00 2.27 0.00 -1.26 -0.61 121.76 122.18 2wub s ALA 139 Ca -0.09 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.60 2wub s ALA 139 Cb -0.06 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.23 2wub s ALA 139 CO -0.00 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 175.92 2wub n GLY 140 N 0.12 1.83 1.99 0.00 0.00 0.76 -4.71 105.19 105.18 2wub n GLY 140 Ca -0.13 -0.83 -0.19 0.00 0.00 0.00 0.00 46.02 44.87 2wub n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2wub n TRP 141 N -0.55 2.49 -0.84 1.61 8.01 -1.26 -2.91 117.44 123.99 2wub n TRP 141 Ca 0.00 -1.57 -0.29 0.00 -1.31 0.00 0.00 57.50 54.33 2wub n TRP 141 Cb 0.00 -0.81 0.25 0.00 -2.01 0.00 0.00 31.31 28.75 2wub n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2wub n GLY 142 N -0.80 -3.06 3.68 6.99 0.00 -1.26 -1.85 105.19 108.89 2wub n GLY 142 Ca 0.48 -1.44 -0.42 0.00 0.00 0.00 0.00 46.02 44.63 2wub n GLY 142 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2wub s HIS 143 N -2.73 2.66 -1.32 1.61 3.76 -1.06 -3.10 115.29 115.11 2wub s HIS 143 Ca 0.68 0.71 0.00 0.00 -0.15 0.00 0.00 55.06 56.31 2wub s HIS 143 Cb -0.08 -3.69 0.00 0.00 1.11 0.00 0.00 32.58 29.92 2wub s HIS 143 CO 0.53 -2.63 0.58 1.28 -0.85 0.00 0.00 174.74 173.66 2wub n LEU 144 N 5.96 0.60 -3.39 0.89 4.77 -1.25 -3.93 117.00 120.65 2wub n LEU 144 Ca 0.14 -0.30 0.02 0.00 -0.03 0.00 0.00 56.01 55.84 2wub n LEU 144 Cb 0.44 -0.30 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 2wub n LEU 144 CO 0.59 0.15 0.49 -0.62 -1.33 0.00 0.00 177.39 176.67 2wub s ASP 145 N -0.44 -0.75 0.41 -1.43 2.15 -1.26 -4.64 116.67 110.70 2wub s ASP 145 Ca 0.00 0.88 0.09 0.00 0.43 0.00 0.00 52.55 53.95 2wub s ASP 145 Cb 0.00 1.80 0.91 0.00 -0.30 0.00 0.00 42.92 45.33 2wub s ASP 145 CO 0.00 -0.14 2.02 -0.33 -0.17 0.00 0.00 175.17 176.55 2wub h GLU 146 N 7.71 0.51 0.00 4.34 5.08 -1.97 -3.28 114.58 126.97 2wub h GLU 146 Ca -0.17 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2wub h GLU 146 Cb 1.12 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.26 2wub h GLU 146 CO 0.08 0.33 0.00 0.09 -1.00 0.00 0.00 179.01 178.51 2wub n ASN 147 N -4.47 0.00 -3.45 1.42 3.02 -1.26 -4.65 115.26 105.86 2wub n ASN 147 Ca 0.06 0.60 0.00 0.00 -0.03 0.00 0.00 54.58 55.21 2wub n ASN 147 Cb 0.18 -0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 2wub n ASN 147 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2wub n VAL 148 N -1.01 0.00 -4.08 2.41 0.31 -1.24 -5.10 118.33 109.62 2wub n VAL 148 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.26 2wub n VAL 148 Cb 0.00 -0.81 -0.10 0.00 -0.91 0.00 0.00 33.84 32.02 2wub n VAL 148 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2wub s SER 149 N -1.45 0.47 0.00 4.52 0.15 -1.26 -4.89 113.70 111.24 2wub s SER 149 Ca 0.00 -0.96 0.00 0.00 0.70 0.00 0.00 55.95 55.69 2wub s SER 149 Cb 0.00 0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 2wub s SER 149 CO 0.00 -0.58 0.00 0.61 1.20 0.00 0.00 173.24 174.47 2wub n GLY 150 N 0.21 3.94 3.72 9.45 0.00 -1.26 -5.03 105.19 116.22 2wub n GLY 150 Ca -0.15 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.80 2wub n GLY 150 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wub s TYR 151 N 0.00 3.50 -0.26 1.61 2.02 -1.26 -4.05 117.35 118.90 2wub s TYR 151 Ca 0.00 1.41 -0.31 0.00 -0.37 0.00 0.00 57.07 57.80 2wub s TYR 151 Cb 0.00 -3.35 -0.08 0.00 -0.40 0.00 0.00 41.96 38.13 2wub s TYR 151 CO 0.00 -0.98 2.20 0.45 -1.57 0.00 0.00 175.55 175.65 2wub n SER 152 N 3.69 2.87 -0.25 2.29 2.88 -0.77 -4.80 113.62 119.52 2wub n SER 152 Ca 0.08 0.31 0.27 0.00 -1.33 0.00 0.00 58.87 58.20 2wub n SER 152 Cb 0.47 -1.45 0.65 0.00 -0.75 0.00 0.00 64.21 63.13 2wub n SER 152 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2wub h SER 153 N 13.89 0.17 -3.86 -3.46 4.64 -1.91 -3.40 113.55 119.61 2wub h SER 153 Ca -0.36 0.03 -0.68 0.00 -0.47 0.00 0.00 61.79 60.30 2wub h SER 153 Cb 1.27 -0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.15 2wub h SER 153 CO 0.98 0.05 -0.83 -0.55 -0.87 0.00 0.00 176.83 175.61 2wub s SER 154 N -5.44 3.66 0.34 4.97 0.15 -1.26 -1.60 113.70 114.52 2wub s SER 154 Ca -0.06 -0.59 -0.29 0.00 0.70 0.00 0.00 55.95 55.71 2wub s SER 154 Cb 0.23 -0.44 -0.11 0.00 -1.71 0.00 0.00 66.02 63.98 2wub s SER 154 CO 0.79 0.20 1.53 -0.22 1.20 0.00 0.00 173.24 176.73 2wub s LEU 155 N -1.93 4.33 -0.00 3.45 2.96 -0.33 -4.86 118.68 122.29 2wub s LEU 155 Ca 0.16 3.00 0.06 0.00 -0.22 0.00 0.00 54.13 57.13 2wub s LEU 155 Cb -0.10 -3.65 -0.02 0.00 0.50 0.00 0.00 46.19 42.92 2wub s LEU 155 CO 0.08 -0.88 -0.19 -0.13 -1.32 0.00 0.00 176.35 173.91 2wub s ARG 156 N -1.45 1.45 0.26 1.98 1.81 -1.14 -2.71 118.95 119.15 2wub s ARG 156 Ca 0.57 -0.72 0.07 0.00 -1.72 0.00 0.00 55.73 53.93 2wub s ARG 156 Cb -0.47 -1.44 -0.05 0.00 -0.45 0.00 0.00 34.95 32.54 2wub s ARG 156 CO 0.57 0.39 -0.09 -1.83 -0.68 0.00 0.00 175.30 173.66 2wub s GLU 157 N -0.61 1.50 0.19 3.54 -1.05 -1.23 -0.17 118.70 120.87 2wub s GLU 157 Ca 0.07 -1.73 -0.08 0.00 -0.15 0.00 0.00 54.97 53.08 2wub s GLU 157 Cb -0.07 -1.18 -0.02 0.00 -0.44 0.00 0.00 34.13 32.41 2wub s GLU 157 CO -0.00 0.09 0.28 0.00 0.95 0.00 0.00 175.26 176.59 2wub s ALA 158 N -2.97 0.26 -0.24 -0.84 0.00 0.22 -2.88 121.76 115.31 2wub s ALA 158 Ca 0.28 -1.11 0.03 0.00 0.00 0.00 0.00 51.96 51.15 2wub s ALA 158 Cb 0.02 1.03 0.05 0.00 0.00 0.00 0.00 23.12 24.23 2wub s ALA 158 CO 0.11 -0.68 -0.13 -0.51 0.00 0.00 0.00 175.76 174.55 2wub s LEU 159 N -3.03 3.17 -0.06 0.00 1.43 -1.26 -2.52 118.68 116.40 2wub s LEU 159 Ca 0.24 -1.24 0.05 0.00 -1.03 0.00 0.00 54.13 52.15 2wub s LEU 159 Cb 0.03 -1.53 -0.01 0.00 0.03 0.00 0.00 46.19 44.71 2wub s LEU 159 CO 0.05 -0.15 -0.23 0.68 0.23 0.00 0.00 176.35 176.93 2wub s VAL 160 N 1.14 2.26 0.03 -1.59 -7.23 0.05 -4.96 120.40 110.10 2wub s VAL 160 Ca -0.06 -0.99 -0.18 0.00 -1.81 0.00 0.00 61.98 58.94 2wub s VAL 160 Cb -0.19 -1.84 -0.06 0.00 0.56 0.00 0.00 36.38 34.85 2wub s VAL 160 CO -0.07 0.57 0.52 -2.16 -0.31 0.00 0.00 175.10 173.65 2wub s PRO 161 N -0.16 4.15 0.19 4.82 0.04 -1.26 -1.17 135.00 141.61 2wub s PRO 161 Ca -0.03 0.63 -0.31 0.00 0.04 0.00 0.00 61.00 61.33 2wub s PRO 161 Cb -0.14 -3.26 -0.10 0.00 0.04 0.00 0.00 34.50 31.05 2wub s PRO 161 CO 0.04 0.59 1.47 -0.51 0.04 0.00 0.00 177.00 178.62 2wub s LEU 162 N -0.87 4.38 -0.10 -3.56 1.43 -0.13 -1.95 118.68 117.88 2wub s LEU 162 Ca 0.28 2.57 -0.05 0.00 -1.03 0.00 0.00 54.13 55.90 2wub s LEU 162 Cb -0.18 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.39 2wub s LEU 162 CO 0.17 -0.73 0.09 -0.69 0.23 0.00 0.00 176.35 175.43 2wub s VAL 163 N 0.62 5.09 0.52 -1.59 1.01 -0.97 0.22 120.40 125.29 2wub s VAL 163 Ca 0.64 0.03 -0.22 0.00 0.00 0.00 0.00 61.98 62.43 2wub s VAL 163 Cb -0.41 -3.20 -0.06 0.00 0.00 0.00 0.00 36.38 32.70 2wub s VAL 163 CO 0.36 0.60 1.24 0.00 0.00 0.00 0.00 175.10 177.30 2wub n ALA 164 N 1.98 1.16 0.34 5.51 0.00 -1.26 -4.42 120.51 123.83 2wub n ALA 164 Ca -0.19 0.15 0.15 0.00 0.00 0.00 0.00 53.44 53.54 2wub n ALA 164 Cb 0.54 -2.27 0.60 0.00 0.00 0.00 0.00 19.45 18.33 2wub n ALA 164 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2wub h ASP 165 N 1.43 0.00 1.08 0.00 3.32 -1.97 -0.36 116.42 119.92 2wub h ASP 165 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 2wub h ASP 165 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 2wub h ASP 165 CO 0.57 0.00 0.00 1.41 -1.72 0.00 0.00 179.24 179.50 2wub n HIS 166 N -2.65 0.22 0.06 4.55 8.25 -1.26 -1.92 115.22 122.47 2wub n HIS 166 Ca 0.01 0.07 0.01 0.00 -0.26 0.00 0.00 57.72 57.55 2wub n HIS 166 Cb 0.26 -0.61 -0.01 0.00 1.12 0.00 0.00 29.99 30.75 2wub n HIS 166 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2wub n LYS 167 N -1.68 4.50 0.07 -0.41 4.76 -0.65 -4.15 118.16 120.59 2wub n LYS 167 Ca 0.06 -0.01 -0.17 0.00 -2.87 0.00 0.00 58.31 55.33 2wub n LYS 167 Cb 0.35 -0.72 -0.14 0.00 -1.84 0.00 0.00 35.03 32.68 2wub n LYS 167 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2wub n SER 169 N -3.47 3.25 -4.76 0.00 2.88 -0.81 -2.70 113.62 108.01 2wub n SER 169 Ca -0.17 -1.96 -0.39 0.00 -1.33 0.00 0.00 58.87 55.02 2wub n SER 169 Cb 1.05 -0.26 0.01 0.00 -0.75 0.00 0.00 64.21 64.25 2wub n SER 169 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2wub s SER 170 N -1.42 6.02 0.01 -3.46 0.15 -1.24 -3.92 113.70 109.83 2wub s SER 170 Ca 0.39 2.67 0.00 0.00 0.70 0.00 0.00 55.95 59.71 2wub s SER 170 Cb 0.22 -2.63 0.03 0.00 -1.71 0.00 0.00 66.02 61.92 2wub s SER 170 CO 0.31 -1.05 0.97 -0.81 1.20 0.00 0.00 173.24 173.86 2wub n PRO 170 N -0.24 0.00 0.00 5.44 -0.04 -1.26 -1.60 135.00 137.30 2wub n PRO 170 Ca 0.06 0.46 0.14 0.00 -0.04 0.00 0.00 63.50 64.11 2wub n PRO 170 Cb 0.44 -1.56 0.50 0.00 -0.04 0.00 0.00 33.50 32.84 2wub n PRO 170 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2wub n GLU 170 N -1.47 1.03 0.00 0.54 0.00 -1.26 -4.86 120.64 114.62 2wub n GLU 170 Ca -0.00 -0.53 0.00 0.00 0.00 0.00 0.00 57.16 56.63 2wub n GLU 170 Cb 0.05 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 30.00 2wub n GLU 170 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 2wub n VAL 171 N -0.52 0.00 -0.02 3.84 0.24 -0.63 -5.09 118.33 116.15 2wub n VAL 171 Ca 0.15 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.44 2wub n VAL 171 Cb 0.32 0.00 -0.00 0.00 -1.47 0.00 0.00 33.84 32.69 2wub n VAL 171 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2wub n TYR 172 N 0.00 0.22 0.00 6.34 4.01 -1.24 -4.93 117.16 121.55 2wub n TYR 172 Ca 0.00 0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.84 2wub n TYR 172 Cb 0.00 -0.36 0.00 0.00 -0.31 0.00 0.00 39.34 38.67 2wub n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wub n GLY 173 N 1.70 0.28 0.27 2.72 0.00 -1.10 -4.04 105.19 105.03 2wub n GLY 173 Ca -0.02 0.52 -0.09 0.00 0.00 0.00 0.00 46.02 46.43 2wub n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wub h ALA 174 N -0.64 -0.78 -0.22 4.61 0.00 -1.91 -3.07 119.26 117.25 2wub h ALA 174 Ca 0.00 -0.05 -0.70 0.00 0.00 0.00 0.00 54.91 54.15 2wub h ALA 174 Cb 0.00 0.74 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 2wub h ALA 174 CO 0.00 -0.86 3.20 -0.25 0.00 0.00 0.00 179.25 181.34 2wub n ASP 175 N -4.17 6.88 -3.43 0.00 9.92 -1.26 -4.76 116.55 119.74 2wub n ASP 175 Ca -0.04 -2.81 -0.21 0.00 -0.53 0.00 0.00 54.79 51.19 2wub n ASP 175 Cb 0.23 -1.54 -0.11 0.00 -0.64 0.00 0.00 41.12 39.06 2wub n ASP 175 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2wub s ILE 176 N 1.66 -0.23 0.31 0.53 -1.09 -1.16 -5.02 121.20 116.18 2wub s ILE 176 Ca 0.57 -0.86 -0.03 0.00 -2.23 0.00 0.00 60.65 58.11 2wub s ILE 176 Cb 0.16 -0.93 -0.04 0.00 -1.58 0.00 0.00 42.46 40.07 2wub s ILE 176 CO -0.07 -0.63 0.54 -0.94 -1.23 0.00 0.00 174.94 172.61 2wub s SER 177 N 1.88 6.38 0.00 3.58 1.04 -1.26 -4.93 113.70 120.38 2wub s SER 177 Ca 0.12 0.59 0.03 0.00 0.48 0.00 0.00 55.95 57.18 2wub s SER 177 Cb -0.16 -2.09 0.17 0.00 0.10 0.00 0.00 66.02 64.04 2wub s SER 177 CO -0.21 -0.23 0.63 -0.81 0.98 0.00 0.00 173.24 173.60 2wub n PRO 178 N -1.25 0.10 -0.18 4.02 -0.04 -1.26 -1.38 135.00 135.01 2wub n PRO 178 Ca -0.03 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.53 2wub n PRO 178 Cb 0.55 -1.47 0.27 0.00 -0.04 0.00 0.00 33.50 32.81 2wub n PRO 178 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2wub n ASN 179 N -0.97 2.54 -4.16 3.54 3.02 -1.26 -4.90 115.26 113.07 2wub n ASN 179 Ca 0.02 -1.90 -0.10 0.00 -0.03 0.00 0.00 54.58 52.57 2wub n ASN 179 Cb 0.01 -0.23 -0.10 0.00 -0.61 0.00 0.00 39.78 38.85 2wub n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2wub s MET 180 N -1.54 0.83 0.26 3.52 -1.94 -0.48 -0.09 119.30 119.86 2wub s MET 180 Ca 0.34 -1.35 0.02 0.00 -1.71 0.00 0.00 55.69 53.00 2wub s MET 180 Cb 0.19 -0.04 -0.04 0.00 2.01 0.00 0.00 34.83 36.95 2wub s MET 180 CO 0.26 -0.09 0.18 -0.48 -0.01 0.00 0.00 175.02 174.88 2wub s LEU 181 N -3.03 1.43 0.19 -0.03 2.34 0.60 -4.75 118.68 115.43 2wub s LEU 181 Ca 0.14 -1.53 0.07 0.00 0.06 0.00 0.00 54.13 52.87 2wub s LEU 181 Cb 0.06 0.40 -0.04 0.00 -0.56 0.00 0.00 46.19 46.06 2wub s LEU 181 CO -0.04 -0.92 0.04 0.00 -1.06 0.00 0.00 176.35 174.37 2wub s ALA 183 N -1.83 -2.27 0.00 0.00 0.00 -0.97 -2.30 121.76 114.39 2wub s ALA 183 Ca 0.29 2.05 0.00 0.00 0.00 0.00 0.00 51.96 54.30 2wub s ALA 183 Cb -0.09 -1.70 0.00 0.00 0.00 0.00 0.00 23.12 21.33 2wub s ALA 183 CO 0.20 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.08 2wub n GLY 184 N 3.07 0.64 0.00 0.00 0.00375.47 -0.65 105.19 483.72 2wub n GLY 184 Ca -0.16 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.33 2wub n GLY 184 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wub n TYR 184 N 6.12 0.00 -1.49 1.61 4.02 0.12 -4.00 117.16 123.54 2wub n TYR 184 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2wub n TYR 184 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 2wub n TYR 184 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2wub n PHE 185 N 0.00 0.00 -2.74 -0.72 3.01 -1.26 -1.83 117.46 113.93 2wub n PHE 185 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.38 2wub n PHE 185 Cb 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 39.48 39.53 2wub n PHE 185 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 2wub n ASP 186 N 0.00 -2.64 -1.76 4.37 3.85 -1.26 -3.86 116.55 115.25 2wub n ASP 186 Ca 0.00 -3.09 0.00 0.00 -0.71 0.00 0.00 54.79 50.99 2wub n ASP 186 Cb 0.58 1.67 0.00 0.00 -1.35 0.00 0.00 41.12 42.02 2wub n ASP 186 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2wub s ALA 190 N -0.38 2.71 0.05 0.00 0.00 -1.26 -4.77 121.76 118.10 2wub s ALA 190 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 50.92 2wub s ALA 190 Cb 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 23.12 22.19 2wub s ALA 190 CO 0.00 0.57 0.00 0.00 0.00 0.00 0.00 175.76 176.33 2wub s GLN 192 N 0.24 3.21 0.00 0.00 -2.07 -1.26 -3.55 119.66 116.23 2wub s GLN 192 Ca 0.00 1.35 0.00 0.00 -1.82 0.00 0.00 55.36 54.89 2wub s GLN 192 Cb 0.00 -2.01 0.00 0.00 -1.09 0.00 0.00 33.01 29.91 2wub s GLN 192 CO 0.00 -0.92 0.00 0.41 -1.32 0.00 0.00 175.29 173.46 2wub n GLY 193 N -0.56 0.67 0.22 2.60 0.00 -1.26 -2.57 105.19 104.29 2wub n GLY 193 Ca 0.10 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.18 2wub n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wub n ASP 194 N 0.00 1.20 -4.67 1.61 8.00 -1.23 -4.09 116.55 117.37 2wub n ASP 194 Ca 0.00 -1.10 -0.47 0.00 0.71 0.00 0.00 54.79 53.93 2wub n ASP 194 Cb 0.00 0.57 -0.04 0.00 -0.02 0.00 0.00 41.12 41.63 2wub n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2wub n SER 195 N -0.41 3.19 0.00 -2.24 7.64 -1.26 0.19 113.62 120.73 2wub n SER 195 Ca 0.04 1.04 0.00 0.00 1.01 0.00 0.00 58.87 60.97 2wub n SER 195 Cb 0.24 -1.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.04 2wub n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wub n GLY 196 N 3.79 2.95 3.56 0.23 0.00 0.15 -1.74 105.19 114.13 2wub n GLY 196 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 2wub n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wub n GLY 197 N -0.69 -1.08 3.89 -0.02 0.00 0.13 -3.95 105.19 103.46 2wub n GLY 197 Ca 0.00 -0.72 -0.29 0.00 0.00 0.00 0.00 46.02 45.01 2wub n GLY 197 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wub s PRO 198 N -4.16 3.12 -0.56 1.61 0.04 -1.26 -0.28 135.00 133.51 2wub s PRO 198 Ca 0.63 0.36 0.04 0.00 0.04 0.00 0.00 61.00 62.07 2wub s PRO 198 Cb -0.23 -2.15 0.16 0.00 0.04 0.00 0.00 34.50 32.33 2wub s PRO 198 CO 0.62 -0.74 0.40 -1.17 0.04 0.00 0.00 177.00 176.14 2wub s LEU 199 N -5.14 3.40 0.37 -3.56 2.96 -0.59 -4.40 118.68 111.71 2wub s LEU 199 Ca 0.55 -3.38 -0.16 0.00 -0.22 0.00 0.00 54.13 50.92 2wub s LEU 199 Cb -0.11 -1.17 -0.09 0.00 0.50 0.00 0.00 46.19 45.33 2wub s LEU 199 CO 0.50 -0.15 0.81 0.00 -1.32 0.00 0.00 176.35 176.18 2wub s ALA 200 N -0.65 3.24 -0.02 5.97 0.00 -0.73 -2.01 121.76 127.56 2wub s ALA 200 Ca 0.26 0.09 -0.07 0.00 0.00 0.00 0.00 51.96 52.24 2wub s ALA 200 Cb -0.06 -2.87 0.01 0.00 0.00 0.00 0.00 23.12 20.20 2wub s ALA 200 CO -0.14 0.20 0.15 0.00 0.00 0.00 0.00 175.76 175.97 2wub s GLU 202 N -0.82 3.11 -0.30 0.00 2.02 -1.26 -1.83 118.70 119.62 2wub s GLU 202 Ca -0.09 -0.79 -0.10 0.00 0.02 0.00 0.00 54.97 54.00 2wub s GLU 202 Cb -0.05 -2.72 0.17 0.00 0.10 0.00 0.00 34.13 31.62 2wub s GLU 202 CO 0.01 -0.05 0.84 0.21 0.02 0.00 0.00 175.26 176.29 2wub s LYS 203 N -4.32 0.40 -1.74 1.61 2.20 -0.44 -4.90 119.74 112.55 2wub s LYS 203 Ca 0.46 0.87 0.00 0.00 -0.36 0.00 0.00 55.97 56.94 2wub s LYS 203 Cb -0.10 0.51 0.00 0.00 -1.51 0.00 0.00 37.83 36.74 2wub s LYS 203 CO 0.34 -0.26 0.00 0.09 -0.36 0.00 0.00 175.35 175.16 2wub n ASN 204 N 5.28 -5.36 0.00 1.43 3.02 -1.26 -1.42 115.26 116.95 2wub n ASN 204 Ca -0.07 0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 2wub n ASN 204 Cb 0.52 -4.45 0.00 0.00 -0.61 0.00 0.00 39.78 35.24 2wub n ASN 204 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wub n GLY 205 N -0.90 0.81 3.78 7.41 0.00 -1.26 -5.03 105.19 110.01 2wub n GLY 205 Ca -0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 2wub n GLY 205 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wub s VAL 206 N -3.17 5.03 -0.15 1.61 1.01 -0.51 -5.08 120.40 119.14 2wub s VAL 206 Ca 0.00 0.03 -0.13 0.00 0.00 0.00 0.00 61.98 61.88 2wub s VAL 206 Cb 0.00 -3.18 -0.05 0.00 0.00 0.00 0.00 36.38 33.15 2wub s VAL 206 CO 0.00 0.59 0.28 0.00 0.00 0.00 0.00 175.10 175.97 2wub s ALA 207 N -0.79 3.63 0.10 5.51 0.00 -1.26 -1.32 121.76 127.62 2wub s ALA 207 Ca 0.13 -0.47 0.10 0.00 0.00 0.00 0.00 51.96 51.73 2wub s ALA 207 Cb -0.12 -2.35 -0.04 0.00 0.00 0.00 0.00 23.12 20.62 2wub s ALA 207 CO 0.03 0.16 -0.26 0.71 0.00 0.00 0.00 175.76 176.39 2wub s TYR 208 N 0.25 2.33 -0.96 0.00 1.51 -0.76 -2.21 117.35 117.50 2wub s TYR 208 Ca 0.16 -0.38 -0.19 0.00 -1.01 0.00 0.00 57.07 55.65 2wub s TYR 208 Cb -0.13 -1.30 0.12 0.00 -0.11 0.00 0.00 41.96 40.54 2wub s TYR 208 CO 0.04 0.28 1.20 -1.17 -1.11 0.00 0.00 175.55 174.79 2wub s LEU 209 N -1.81 4.83 0.12 -1.29 2.96 0.20 -2.31 118.68 121.38 2wub s LEU 209 Ca 0.14 -2.03 -0.07 0.00 -0.22 0.00 0.00 54.13 51.95 2wub s LEU 209 Cb -0.10 -2.42 -0.10 0.00 0.50 0.00 0.00 46.19 44.06 2wub s LEU 209 CO 0.05 -1.11 1.31 0.22 -1.32 0.00 0.00 176.35 175.50 2wub h TYR 210 N 8.85 0.76 -4.22 5.38 3.20 -1.73 -3.39 116.97 125.82 2wub h TYR 210 Ca 0.18 -0.39 -0.23 0.00 3.14 0.00 0.00 58.73 61.43 2wub h TYR 210 Cb 1.01 -0.10 -0.11 0.00 1.54 0.00 0.00 36.73 39.08 2wub h TYR 210 CO 1.18 1.20 -0.33 0.20 -1.64 0.00 0.00 178.16 178.77 2wub s GLY 211 N -4.33 1.33 -0.10 1.82 0.00 -1.06 -2.40 107.32 102.58 2wub s GLY 211 Ca -0.07 -1.47 0.02 0.00 0.00 0.00 0.00 44.72 43.19 2wub s GLY 211 CO 0.88 -1.07 -0.13 -0.42 0.00 0.00 0.00 173.10 172.35 2wub s ILE 212 N -3.67 1.33 -0.47 0.90 1.01 -1.00 -1.55 121.20 117.76 2wub s ILE 212 Ca 0.32 -0.55 -0.26 0.00 0.00 0.00 0.00 60.65 60.16 2wub s ILE 212 Cb 0.02 -1.23 -0.06 0.00 0.01 0.00 0.00 42.46 41.19 2wub s ILE 212 CO 0.16 0.41 2.32 -0.63 0.00 0.00 0.00 174.94 177.20 2wub s ILE 213 N 1.01 3.05 0.00 2.92 1.01 0.62 -1.34 121.20 128.47 2wub s ILE 213 Ca -0.07 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.61 2wub s ILE 213 Cb -0.15 -3.11 0.00 0.00 0.01 0.00 0.00 42.46 39.21 2wub s ILE 213 CO -0.01 -0.11 0.00 -1.20 0.00 0.00 0.00 174.94 173.62 2wub n SER 214 N 15.01 0.00 -3.80 3.58 7.64 -1.23 0.30 113.62 135.11 2wub n SER 214 Ca 0.34 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.81 2wub n SER 214 Cb 0.53 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.71 2wub n SER 214 CO 0.00 0.00 0.00 1.87 -3.01 0.00 0.00 175.04 173.90 2wub n TRP 215 N -0.24 -0.43 -4.39 1.43 -0.00 -1.26 -4.45 117.44 108.10 2wub n TRP 215 Ca 0.00 0.84 -0.19 0.00 -0.00 0.00 0.00 57.50 58.14 2wub n TRP 215 Cb 0.00 -1.69 -0.15 0.00 -0.00 0.00 0.00 31.31 29.47 2wub n TRP 215 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 177.69 177.89 2wub s GLY 216 N -0.86 0.47 0.00 5.87 0.00 -1.26 -4.95 107.32 106.59 2wub s GLY 216 Ca 0.55 -0.39 0.00 0.00 0.00 0.00 0.00 44.72 44.88 2wub s GLY 216 CO 0.48 -0.28 0.00 0.00 0.00 0.00 0.00 173.10 173.30 2wub n GLY 221 N 0.00 0.48 0.22 0.00 0.00 -1.26 -4.27 105.19 100.35 2wub n GLY 221 Ca 0.00 -1.84 0.03 0.00 0.00 0.00 0.00 46.02 44.21 2wub n GLY 221 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wub n LYS 224 N -1.24 -0.51 -1.90 1.61 5.02 -1.25 -5.03 118.16 114.86 2wub n LYS 224 Ca 0.00 0.41 -0.29 0.00 -2.02 0.00 0.00 58.31 56.41 2wub n LYS 224 Cb 0.00 -0.59 0.11 0.00 -0.02 0.00 0.00 35.03 34.53 2wub n LYS 224 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2wub s PRO 225 N -3.20 1.72 0.44 1.97 0.04 -0.76 -4.52 135.00 130.69 2wub s PRO 225 Ca 0.00 0.03 0.08 0.00 0.04 0.00 0.00 61.00 61.15 2wub s PRO 225 Cb 0.00 -1.93 0.01 0.00 0.04 0.00 0.00 34.50 32.62 2wub s PRO 225 CO 0.00 -1.75 0.54 0.20 0.04 0.00 0.00 177.00 176.03 2wub s GLY 226 N -4.62 1.98 -0.11 0.56 0.00 0.17 -4.89 107.32 100.42 2wub s GLY 226 Ca 0.64 -1.76 0.03 0.00 0.00 0.00 0.00 44.72 43.63 2wub s GLY 226 CO 0.50 -1.57 -0.21 0.14 0.00 0.00 0.00 173.10 171.96 2wub s VAL 227 N -2.42 2.33 0.19 1.40 1.01 -1.26 -2.28 120.40 119.38 2wub s VAL 227 Ca 0.54 -0.92 0.10 0.00 0.00 0.00 0.00 61.98 61.69 2wub s VAL 227 Cb -0.08 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 2wub s VAL 227 CO 0.32 0.55 -0.19 -0.31 0.00 0.00 0.00 175.10 175.47 2wub s TYR 228 N 0.37 1.99 -0.05 5.22 1.51 -0.15 -3.54 117.35 122.71 2wub s TYR 228 Ca -0.16 -0.43 -0.30 0.00 -1.01 0.00 0.00 57.07 55.17 2wub s TYR 228 Cb -0.17 -0.96 -0.02 0.00 -0.11 0.00 0.00 41.96 40.69 2wub s TYR 228 CO 0.07 0.43 1.02 0.99 -1.11 0.00 0.00 175.55 176.96 2wub s THR 229 N -2.13 4.73 -0.88 -0.71 2.01 -0.45 -0.29 115.64 117.91 2wub s THR 229 Ca 0.20 1.98 -0.23 0.00 0.31 0.00 0.00 61.69 63.95 2wub s THR 229 Cb -0.06 -4.27 -0.14 0.00 0.01 0.00 0.00 72.50 68.04 2wub s THR 229 CO 0.09 0.07 1.92 -1.14 -0.69 0.00 0.00 174.62 174.87 2wub n ARG 230 N 4.51 1.48 -0.25 4.92 0.63 0.87 -2.37 116.66 126.44 2wub n ARG 230 Ca 0.08 -2.03 0.22 0.00 -0.92 0.00 0.00 57.85 55.20 2wub n ARG 230 Cb 0.49 -3.18 0.41 0.00 0.45 0.00 0.00 32.46 30.64 2wub n ARG 230 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2wub n VAL 231 N 6.65 -0.32 -0.18 5.15 0.31 -1.01 0.26 118.33 129.18 2wub n VAL 231 Ca 0.48 1.59 0.21 0.00 -0.01 0.00 0.00 64.34 66.61 2wub n VAL 231 Cb 0.43 -2.53 0.59 0.00 -0.91 0.00 0.00 33.84 31.41 2wub n VAL 231 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wub h ALA 232 N 1.54 2.39 0.00 3.52 0.00 -1.83 0.18 119.26 125.07 2wub h ALA 232 Ca 0.62 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.53 2wub h ALA 232 Cb 1.59 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.38 2wub h ALA 232 CO -0.62 -0.64 0.00 0.09 0.00 0.00 0.00 179.25 178.08 2wub n ASN 233 N -4.43 0.00 0.00 0.00 3.02 0.14 -3.11 115.26 110.88 2wub n ASN 233 Ca 0.17 -0.80 0.00 0.00 -0.03 0.00 0.00 54.58 53.92 2wub n ASN 233 Cb 0.73 -0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.90 2wub n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2wub n TYR 234 N -1.00 0.00 -0.35 3.10 4.01 0.01 -4.78 117.16 118.15 2wub n TYR 234 Ca 0.19 -0.09 0.08 0.00 -0.16 0.00 0.00 57.90 57.93 2wub n TYR 234 Cb 0.09 -0.01 0.25 0.00 -0.31 0.00 0.00 39.34 39.36 2wub n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2wub h VAL 235 N 0.81 0.85 0.45 -0.72 2.07 -1.39 0.15 116.25 118.46 2wub h VAL 235 Ca 0.00 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.19 2wub h VAL 235 Cb 0.41 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.06 2wub h VAL 235 CO 0.00 0.16 -0.21 0.44 0.02 0.00 0.00 177.57 177.98 2wub h ASP 236 N 0.90 -0.51 -0.85 0.57 3.32 -1.86 -0.05 116.42 117.93 2wub h ASP 236 Ca 0.51 -0.06 0.09 0.00 0.02 0.00 0.00 57.03 57.59 2wub h ASP 236 Cb 0.59 0.13 -0.07 0.00 0.22 0.00 0.00 39.33 40.20 2wub h ASP 236 CO -0.30 -0.24 0.50 -0.25 -1.72 0.00 0.00 179.24 177.23 2wub h TRP 237 N -0.77 0.92 -0.52 4.55 7.01 -1.77 0.66 115.95 126.02 2wub h TRP 237 Ca -0.06 0.03 -0.12 0.00 2.11 0.00 0.00 58.89 60.85 2wub h TRP 237 Cb 0.54 -0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 27.30 2wub h TRP 237 CO -0.01 0.39 -0.14 0.82 -2.79 0.00 0.00 178.44 176.71 2wub h ILE 238 N 0.85 1.27 -0.37 2.65 2.04 -0.64 -2.35 117.51 120.96 2wub h ILE 238 Ca 0.41 -1.29 -0.10 0.00 1.00 0.00 0.00 64.86 64.87 2wub h ILE 238 Cb 0.35 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 2wub h ILE 238 CO -0.24 0.45 -0.18 0.78 0.00 0.00 0.00 178.15 178.97 2wub h ASN 239 N 0.89 0.70 -0.97 1.72 2.35 -0.17 -2.40 115.58 117.71 2wub h ASN 239 Ca 0.13 -0.23 0.05 0.00 -0.55 0.00 0.00 56.30 55.70 2wub h ASN 239 Cb 0.70 -0.19 -0.06 0.00 0.05 0.00 0.00 38.32 38.82 2wub h ASN 239 CO 0.05 0.89 0.63 -0.78 -1.65 0.00 0.00 177.43 176.57 2wub h ASP 240 N 0.63 1.03 -0.37 5.81 3.58 -0.60 0.15 116.42 126.64 2wub h ASP 240 Ca 0.10 -0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.50 2wub h ASP 240 Cb 0.66 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.46 2wub h ASP 240 CO 0.05 0.69 0.06 0.03 -2.88 0.00 0.00 179.24 177.19 2wub h ARG 241 N 1.19 0.62 0.00 0.28 2.47 -0.95 -3.37 114.38 114.61 2wub h ARG 241 Ca 0.40 -0.17 0.00 0.00 -1.26 0.00 0.00 59.98 58.95 2wub h ARG 241 Cb 0.07 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 2wub h ARG 241 CO -0.13 0.68 0.00 -0.89 0.56 0.00 0.00 179.97 180.19 2wub n ILE 242 N -4.55 0.00 -1.63 2.04 5.41 -0.91 -4.86 119.36 114.86 2wub n ILE 242 Ca -0.01 0.39 0.00 0.00 1.00 0.00 0.00 62.75 64.12 2wub n ILE 242 Cb 0.23 -1.08 0.00 0.00 -0.71 0.00 0.00 39.64 38.08 2wub n ILE 242 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 176.55 174.44 2wub n ARG 243 N -1.51 -0.24 0.00 0.38 -4.01 0.48 -5.10 116.66 106.66 2wub n ARG 243 Ca 0.00 -0.12 0.00 0.00 -1.04 0.00 0.00 57.85 56.69 2wub n ARG 243 Cb 0.00 0.22 0.00 0.00 -3.04 0.00 0.00 32.46 29.64 2wub n ARG 243 CO 0.00 0.00 0.00 -2.30 -3.04 0.00 0.00 177.63 172.29