#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wcv s LEU 2 N 0.00 2.19 0.48 -0.89 1.43 -1.26 -5.14 118.68 115.48 2wcv s LEU 2 Ca 0.00 -0.64 -0.20 0.00 -1.03 0.00 0.00 54.13 52.26 2wcv s LEU 2 Cb 0.00 0.26 -0.09 0.00 0.03 0.00 0.00 46.19 46.39 2wcv s LEU 2 CO 0.00 -0.43 1.03 -0.54 0.23 0.00 0.00 176.35 176.63 2wcv s LYS 3 N -2.40 3.85 0.00 1.70 1.02 -1.26 -3.54 119.74 119.11 2wcv s LYS 3 Ca -0.07 1.32 0.00 0.00 0.02 0.00 0.00 55.97 57.24 2wcv s LYS 3 Cb -0.03 -2.10 0.00 0.00 -0.52 0.00 0.00 37.83 35.18 2wcv s LYS 3 CO -0.04 -0.38 0.00 0.25 -0.92 0.00 0.00 175.35 174.25 2wcv n THR 4 N -0.95 0.00 -4.96 2.17 -2.24 -1.26 -4.95 114.28 102.09 2wcv n THR 4 Ca 0.09 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.54 2wcv n THR 4 Cb 0.53 -0.22 -0.15 0.00 -2.10 0.00 0.00 70.33 68.39 2wcv n THR 4 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2wcv s ILE 5 N -1.91 2.76 -0.01 2.28 1.01 -1.23 -5.07 121.20 119.03 2wcv s ILE 5 Ca 0.00 -0.80 -0.36 0.00 0.00 0.00 0.00 60.65 59.49 2wcv s ILE 5 Cb 0.00 -2.09 -0.15 0.00 0.01 0.00 0.00 42.46 40.23 2wcv s ILE 5 CO 0.00 0.56 1.59 -0.24 0.00 0.00 0.00 174.94 176.85 2wcv n SER 6 N 2.95 2.50 0.00 3.58 2.88 -1.26 -4.63 113.62 119.64 2wcv n SER 6 Ca -0.18 1.07 0.09 0.00 -1.33 0.00 0.00 58.87 58.53 2wcv n SER 6 Cb 0.52 -1.27 0.49 0.00 -0.75 0.00 0.00 64.21 63.20 2wcv n SER 6 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2wcv n PRO 7 N 4.14 0.39 0.07 -1.46 -0.04 -1.26 -2.49 135.00 134.33 2wcv n PRO 7 Ca 0.21 0.07 0.13 0.00 -0.04 0.00 0.00 63.50 63.87 2wcv n PRO 7 Cb 0.22 -1.50 0.48 0.00 -0.04 0.00 0.00 33.50 32.66 2wcv n PRO 7 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2wcv n LEU 8 N -1.17 0.49 -4.55 1.53 4.77 -1.26 -4.67 117.00 112.14 2wcv n LEU 8 Ca 0.11 0.55 -0.42 0.00 -0.03 0.00 0.00 56.01 56.22 2wcv n LEU 8 Cb 0.11 -0.41 -0.08 0.00 -2.33 0.00 0.00 43.42 40.71 2wcv n LEU 8 CO 0.12 -0.15 0.22 -0.63 -1.33 0.00 0.00 177.39 175.62 2wcv s ILE 9 N -3.08 5.01 0.70 -0.08 1.01 -1.04 -4.99 121.20 118.73 2wcv s ILE 9 Ca 0.11 0.23 -0.15 0.00 0.00 0.00 0.00 60.65 60.85 2wcv s ILE 9 Cb 0.14 -3.99 0.02 0.00 0.01 0.00 0.00 42.46 38.65 2wcv s ILE 9 CO 0.54 -0.26 1.16 -0.94 0.00 0.00 0.00 174.94 175.44 2wcv s SER 10 N 1.79 4.62 0.26 3.58 1.04 -1.26 -4.79 113.70 118.93 2wcv s SER 10 Ca 0.18 2.18 -0.02 0.00 0.48 0.00 0.00 55.95 58.77 2wcv s SER 10 Cb -0.16 -2.57 0.51 0.00 0.10 0.00 0.00 66.02 63.90 2wcv s SER 10 CO 0.14 -1.97 1.75 -0.65 0.98 0.00 0.00 173.24 173.49 2wcv h PRO 11 N -0.15 0.56 -0.68 4.02 0.11 -1.97 -1.06 132.00 132.82 2wcv h PRO 11 Ca -0.47 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 2wcv h PRO 11 Cb 1.27 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 2wcv h PRO 11 CO 0.52 0.37 0.17 1.49 -0.21 0.00 0.00 178.00 180.34 2wcv h GLU 12 N 0.57 1.07 -0.43 1.05 4.57 -2.00 -1.94 114.58 117.49 2wcv h GLU 12 Ca 0.45 -0.25 -0.10 0.00 -1.18 0.00 0.00 59.36 58.28 2wcv h GLU 12 Cb 0.64 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.07 2wcv h GLU 12 CO -0.37 0.94 -0.16 1.25 -1.18 0.00 0.00 179.01 179.50 2wcv h LEU 13 N 1.02 0.80 -0.46 1.64 5.85 -1.70 -0.66 115.31 121.80 2wcv h LEU 13 Ca 0.22 -0.26 0.06 0.00 0.84 0.00 0.00 57.88 58.74 2wcv h LEU 13 Cb 0.35 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 2wcv h LEU 13 CO 0.00 0.96 0.16 0.25 -0.34 0.00 0.00 178.44 179.47 2wcv h LEU 14 N 0.71 0.16 0.02 2.25 5.85 -0.80 0.22 115.31 123.71 2wcv h LEU 14 Ca 0.11 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 2wcv h LEU 14 Cb 0.66 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.73 2wcv h LEU 14 CO 0.05 0.12 -0.01 0.50 -0.34 0.00 0.00 178.44 178.76 2wcv h LYS 15 N 0.33 -0.03 -0.03 1.25 3.64 -0.97 -2.11 116.57 118.65 2wcv h LYS 15 Ca 0.22 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.63 2wcv h LYS 15 Cb 0.23 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 2wcv h LYS 15 CO -0.23 0.06 -0.15 0.28 -2.27 0.00 0.00 179.45 177.14 2wcv h VAL 16 N -0.11 0.63 -0.70 2.00 2.07 -0.48 0.27 116.25 119.94 2wcv h VAL 16 Ca -0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 2wcv h VAL 16 Cb 0.10 0.63 -0.09 0.00 -1.52 0.00 0.00 31.29 30.40 2wcv h VAL 16 CO 0.00 0.00 0.22 -0.07 0.02 0.00 0.00 177.57 177.75 2wcv h LEU 17 N -0.23 0.15 -0.69 2.57 3.38 -0.50 -1.48 115.31 118.51 2wcv h LEU 17 Ca 0.06 0.11 -0.12 0.00 0.09 0.00 0.00 57.88 58.02 2wcv h LEU 17 Cb 0.31 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2wcv h LEU 17 CO -0.17 0.05 -0.27 0.00 0.09 0.00 0.00 178.44 178.14 2wcv h ALA 18 N 1.53 0.87 0.00 1.53 0.00 -0.77 -2.85 119.26 119.56 2wcv h ALA 18 Ca 0.38 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2wcv h ALA 18 Cb 0.58 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2wcv h ALA 18 CO -0.41 0.63 -0.16 0.93 0.00 0.00 0.00 179.25 180.23 2wcv h GLU 19 N 0.62 0.00 -6.93 0.00 5.08 0.02 -3.44 114.58 109.93 2wcv h GLU 19 Ca 0.08 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.91 2wcv h GLU 19 Cb 0.78 0.00 0.08 0.00 0.50 0.00 0.00 28.75 30.12 2wcv h GLU 19 CO 0.06 0.16 0.66 -1.64 -1.00 0.00 0.00 179.01 177.26 2wcv s MET 20 N -3.89 4.10 0.38 2.33 -1.94 -0.72 -5.03 119.30 114.54 2wcv s MET 20 Ca -0.01 2.28 0.01 0.00 -1.71 0.00 0.00 55.69 56.26 2wcv s MET 20 Cb 0.11 -2.90 0.01 0.00 2.01 0.00 0.00 34.83 34.07 2wcv s MET 20 CO 0.60 -0.43 0.09 0.41 -0.01 0.00 0.00 175.02 175.69 2wcv n GLY 21 N 0.66 3.45 3.67 -0.03 0.00 -1.26 -5.01 105.19 106.67 2wcv n GLY 21 Ca 0.02 -2.31 -0.48 0.00 0.00 0.00 0.00 46.02 43.25 2wcv n GLY 21 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2wcv n HIS 22 N -1.10 2.20 0.00 1.61 -0.00 -1.26 -1.50 115.22 115.18 2wcv n HIS 22 Ca -0.11 0.23 0.00 0.00 -0.00 0.00 0.00 57.72 57.84 2wcv n HIS 22 Cb 0.47 -2.56 0.00 0.00 -0.00 0.00 0.00 29.99 27.90 2wcv n HIS 22 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2wcv n GLY 23 N 3.69 2.38 3.76 1.57 0.00 0.14 -4.99 105.19 111.73 2wcv n GLY 23 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 2wcv n GLY 23 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wcv s ASP 24 N -1.93 5.81 -0.03 1.61 1.01 -0.56 -4.63 116.67 117.95 2wcv s ASP 24 Ca 0.00 2.50 0.05 0.00 0.71 0.00 0.00 52.55 55.81 2wcv s ASP 24 Cb 0.00 -2.62 -0.03 0.00 1.01 0.00 0.00 42.92 41.29 2wcv s ASP 24 CO 0.00 -1.18 -0.18 -1.61 0.21 0.00 0.00 175.17 172.41 2wcv s GLU 25 N -2.78 2.33 -0.01 8.23 2.02 -1.26 -1.40 118.70 125.84 2wcv s GLU 25 Ca 0.67 -0.80 0.03 0.00 0.02 0.00 0.00 54.97 54.88 2wcv s GLU 25 Cb -0.33 -2.27 -0.01 0.00 0.10 0.00 0.00 34.13 31.62 2wcv s GLU 25 CO 0.40 0.59 -0.09 -1.50 0.02 0.00 0.00 175.26 174.69 2wcv s ILE 26 N -0.74 0.69 -0.11 -1.63 2.07 -0.63 -0.37 121.20 120.49 2wcv s ILE 26 Ca 0.12 -0.38 0.00 0.00 -1.41 0.00 0.00 60.65 58.98 2wcv s ILE 26 Cb -0.10 -0.58 -0.02 0.00 0.13 0.00 0.00 42.46 41.88 2wcv s ILE 26 CO 0.01 0.19 -0.11 -0.63 -1.91 0.00 0.00 174.94 172.50 2wcv s ILE 27 N -0.22 3.31 -0.39 2.00 1.01 -1.02 -1.09 121.20 124.80 2wcv s ILE 27 Ca 0.03 -0.59 -0.05 0.00 0.00 0.00 0.00 60.65 60.05 2wcv s ILE 27 Cb -0.03 -2.38 0.09 0.00 0.01 0.00 0.00 42.46 40.15 2wcv s ILE 27 CO -0.00 0.54 0.19 -0.36 0.00 0.00 0.00 174.94 175.31 2wcv s PHE 28 N -0.06 3.46 0.36 3.97 0.40 -0.16 0.37 117.98 126.31 2wcv s PHE 28 Ca -0.01 -2.08 0.02 0.00 -0.60 0.00 0.00 56.93 54.25 2wcv s PHE 28 Cb -0.14 -2.98 -0.02 0.00 0.51 0.00 0.00 43.02 40.39 2wcv s PHE 28 CO 0.03 -0.91 0.55 -1.54 0.70 0.00 0.00 175.22 174.05 2wcv s SER 29 N 1.84 6.13 0.91 1.36 1.04 0.07 -1.66 113.70 123.38 2wcv s SER 29 Ca 0.04 0.28 -0.15 0.00 0.48 0.00 0.00 55.95 56.61 2wcv s SER 29 Cb -0.22 -1.77 0.16 0.00 0.10 0.00 0.00 66.02 64.28 2wcv s SER 29 CO -0.02 -0.40 1.27 1.51 0.98 0.00 0.00 173.24 176.58 2wcv s ASP 30 N -4.10 3.59 0.02 7.02 1.47 -1.26 -1.60 116.67 121.81 2wcv s ASP 30 Ca 0.42 0.45 0.12 0.00 1.18 0.00 0.00 52.55 54.72 2wcv s ASP 30 Cb -0.10 -0.65 0.53 0.00 -0.34 0.00 0.00 42.92 42.36 2wcv s ASP 30 CO 0.35 -2.45 1.39 0.00 0.68 0.00 0.00 175.17 175.14 2wcv n ALA 31 N -3.62 1.54 1.04 2.11 0.00 0.87 -2.77 120.51 119.68 2wcv n ALA 31 Ca 0.13 -0.03 0.11 0.00 0.00 0.00 0.00 53.44 53.65 2wcv n ALA 31 Cb 0.60 -1.20 0.05 0.00 0.00 0.00 0.00 19.45 18.90 2wcv n ALA 31 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2wcv n HIS 32 N -1.54 0.00 -2.20 0.00 8.25 -1.26 -4.97 115.22 113.49 2wcv n HIS 32 Ca 0.03 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.08 2wcv n HIS 32 Cb 0.14 -0.06 -0.03 0.00 1.12 0.00 0.00 29.99 31.16 2wcv n HIS 32 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 2wcv s PHE 33 N -2.77 3.19 -1.07 4.41 5.36 -1.11 -4.91 117.98 121.07 2wcv s PHE 33 Ca 0.14 1.40 -0.08 0.00 -0.96 0.00 0.00 56.93 57.42 2wcv s PHE 33 Cb 0.17 -3.60 -0.13 0.00 -0.34 0.00 0.00 43.02 39.12 2wcv s PHE 33 CO 0.70 -1.68 3.15 -0.35 -1.46 0.00 0.00 175.22 175.58 2wcv n PRO 34 N 1.39 3.18 -0.28 10.12 -0.04 -1.26 -4.71 135.00 143.40 2wcv n PRO 34 Ca 0.02 -1.88 0.02 0.00 -0.04 0.00 0.00 63.50 61.62 2wcv n PRO 34 Cb 0.42 -2.53 0.15 0.00 -0.04 0.00 0.00 33.50 31.51 2wcv n PRO 34 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wcv h ALA 35 N 4.31 1.11 0.00 0.55 0.00 -1.95 -3.00 119.26 120.28 2wcv h ALA 35 Ca 0.64 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.58 2wcv h ALA 35 Cb 0.68 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2wcv h ALA 35 CO 1.26 0.08 0.00 0.45 0.00 0.00 0.00 179.25 181.04 2wcv h HIS 36 N 0.76 0.00 -0.02 0.00 3.86 -1.93 -3.03 115.15 114.78 2wcv h HIS 36 Ca 0.38 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.59 2wcv h HIS 36 Cb 0.33 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.80 2wcv h HIS 36 CO -0.07 0.00 -0.15 -1.13 0.86 0.00 0.00 177.93 177.44 2wcv n SER 37 N -2.56 2.58 -0.09 2.45 3.41 -1.13 -4.47 113.62 113.81 2wcv n SER 37 Ca 0.01 -1.79 -0.14 0.00 -0.26 0.00 0.00 58.87 56.69 2wcv n SER 37 Cb 0.25 0.16 -0.04 0.00 -0.26 0.00 0.00 64.21 64.31 2wcv n SER 37 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 2wcv h MET 38 N 3.75 0.80 0.00 4.33 2.86 -1.59 -3.49 114.93 121.59 2wcv h MET 38 Ca 0.00 -0.47 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 2wcv h MET 38 Cb 0.87 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.57 2wcv h MET 38 CO 0.00 1.10 0.00 0.41 1.06 0.00 0.00 176.91 179.48 2wcv n GLY 39 N 0.29 3.52 3.68 8.32 0.00 -1.26 -4.45 105.19 115.30 2wcv n GLY 39 Ca -0.04 -0.71 -0.30 0.00 0.00 0.00 0.00 46.02 44.96 2wcv n GLY 39 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wcv s PRO 40 N 0.00 1.04 0.39 1.61 0.04 -1.26 -4.95 135.00 131.87 2wcv s PRO 40 Ca 0.00 1.09 -0.27 0.00 0.04 0.00 0.00 61.00 61.85 2wcv s PRO 40 Cb 0.00 -1.76 -0.10 0.00 0.04 0.00 0.00 34.50 32.67 2wcv s PRO 40 CO 0.00 -2.47 1.47 1.14 0.04 0.00 0.00 177.00 177.19 2wcv s GLN 41 N -4.78 4.01 -0.05 4.56 -2.07 -1.26 -4.70 119.66 115.37 2wcv s GLN 41 Ca 0.65 2.54 0.02 0.00 -1.82 0.00 0.00 55.36 56.75 2wcv s GLN 41 Cb -0.20 -2.90 -0.03 0.00 -1.09 0.00 0.00 33.01 28.79 2wcv s GLN 41 CO 0.58 -0.60 -0.09 0.08 -1.32 0.00 0.00 175.29 173.94 2wcv s VAL 42 N -1.14 3.55 -0.08 3.63 1.01 -1.26 -0.69 120.40 125.42 2wcv s VAL 42 Ca 0.55 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.96 2wcv s VAL 42 Cb -0.46 -2.45 0.01 0.00 0.00 0.00 0.00 36.38 33.48 2wcv s VAL 42 CO 0.62 0.56 -0.15 -0.63 0.00 0.00 0.00 175.10 175.50 2wcv s ILE 43 N -0.83 1.38 0.12 2.22 1.01 0.08 -4.96 121.20 120.22 2wcv s ILE 43 Ca 0.13 -0.61 -0.21 0.00 0.00 0.00 0.00 60.65 59.96 2wcv s ILE 43 Cb -0.11 -1.25 -0.07 0.00 0.01 0.00 0.00 42.46 41.04 2wcv s ILE 43 CO 0.02 0.41 0.64 -0.13 0.00 0.00 0.00 174.94 175.89 2wcv s ARG 44 N 0.73 4.30 -0.31 2.79 1.81 -1.26 -1.35 118.95 125.67 2wcv s ARG 44 Ca -0.12 0.86 0.19 0.00 -1.72 0.00 0.00 55.73 54.93 2wcv s ARG 44 Cb -0.16 -3.20 0.47 0.00 -0.45 0.00 0.00 34.95 31.61 2wcv s ARG 44 CO 0.03 0.59 0.97 0.00 -0.68 0.00 0.00 175.30 176.21 2wcv n ALA 45 N 1.55 3.30 -0.31 2.13 0.00 0.24 -4.91 120.51 122.50 2wcv n ALA 45 Ca -0.08 -3.08 0.34 0.00 0.00 0.00 0.00 53.44 50.63 2wcv n ALA 45 Cb 0.50 -0.93 0.74 0.00 0.00 0.00 0.00 19.45 19.76 2wcv n ALA 45 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2wcv h ASP 46 N 2.94 0.02 -0.60 0.00 3.32 -1.86 -1.72 116.42 118.52 2wcv h ASP 46 Ca -0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.95 2wcv h ASP 46 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 2wcv h ASP 46 CO 0.45 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.59 2wcv n GLY 47 N -1.76 2.46 3.46 2.75 0.00 -1.26 -3.84 105.19 107.01 2wcv n GLY 47 Ca 0.25 -0.77 -0.25 0.00 0.00 0.00 0.00 46.02 45.25 2wcv n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wcv s LEU 48 N -1.69 2.57 0.14 0.99 1.43 -0.65 -4.92 118.68 116.54 2wcv s LEU 48 Ca 0.47 -0.99 0.02 0.00 -1.03 0.00 0.00 54.13 52.59 2wcv s LEU 48 Cb 0.30 -1.12 -0.04 0.00 0.03 0.00 0.00 46.19 45.36 2wcv s LEU 48 CO 0.23 0.05 0.27 -0.76 0.23 0.00 0.00 176.35 176.38 2wcv s LEU 49 N -3.35 4.34 0.22 1.79 1.02 -1.26 0.34 118.68 121.77 2wcv s LEU 49 Ca 0.28 0.19 -0.08 0.00 0.02 0.00 0.00 54.13 54.55 2wcv s LEU 49 Cb -0.06 -2.93 0.28 0.00 0.02 0.00 0.00 46.19 43.51 2wcv s LEU 49 CO 0.14 0.07 1.81 0.58 0.02 0.00 0.00 176.35 178.97 2wcv h VAL 50 N 1.70 0.96 -0.51 -1.59 2.07 -1.92 0.55 116.25 117.52 2wcv h VAL 50 Ca -0.48 -0.25 0.15 0.00 0.82 0.00 0.00 66.70 66.94 2wcv h VAL 50 Cb 1.19 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 2wcv h VAL 50 CO 0.70 0.13 0.38 0.77 0.02 0.00 0.00 177.57 179.57 2wcv h SER 51 N 0.73 0.00 -0.08 0.57 4.64 -1.94 -0.62 113.55 116.86 2wcv h SER 51 Ca 0.32 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.63 2wcv h SER 51 Cb 0.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2wcv h SER 51 CO -0.19 0.00 -0.01 0.44 -0.87 0.00 0.00 176.83 176.20 2wcv h ASP 52 N 0.00 0.14 -0.37 4.97 3.32 -1.27 -2.60 116.42 120.60 2wcv h ASP 52 Ca 0.24 -0.33 -0.14 0.00 0.02 0.00 0.00 57.03 56.82 2wcv h ASP 52 Cb 1.00 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 2wcv h ASP 52 CO -0.00 0.44 -0.30 -0.07 -1.72 0.00 0.00 179.24 177.58 2wcv h LEU 53 N -0.17 0.95 -0.11 1.55 3.38 -1.12 -2.35 115.31 117.44 2wcv h LEU 53 Ca 0.02 -0.39 0.04 0.00 0.09 0.00 0.00 57.88 57.64 2wcv h LEU 53 Cb 0.37 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 2wcv h LEU 53 CO 0.01 1.17 -0.14 -0.07 0.09 0.00 0.00 178.44 179.49 2wcv h LEU 54 N 0.76 -0.45 -1.28 1.67 4.07 -1.18 0.34 115.31 119.24 2wcv h LEU 54 Ca 0.08 0.08 -0.07 0.00 0.08 0.00 0.00 57.88 58.06 2wcv h LEU 54 Cb 0.88 0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.82 2wcv h LEU 54 CO 0.08 -0.19 -0.31 -0.61 -1.08 0.00 0.00 178.44 176.32 2wcv h GLN 55 N -0.19 0.00 0.04 1.13 4.15 -1.45 -0.73 115.11 118.05 2wcv h GLN 55 Ca 0.09 0.00 -0.25 0.00 0.77 0.00 0.00 58.65 59.25 2wcv h GLN 55 Cb 0.31 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.01 2wcv h GLN 55 CO -0.22 0.31 -1.05 0.00 -1.93 0.00 0.00 178.83 175.94 2wcv h ALA 56 N 1.69 0.23 0.00 3.38 0.00 -0.81 -3.37 119.26 120.37 2wcv h ALA 56 Ca -0.00 -0.74 -0.23 0.00 0.00 0.00 0.00 54.91 53.94 2wcv h ALA 56 Cb 0.68 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 2wcv h ALA 56 CO 0.04 0.79 -1.58 -0.89 0.00 0.00 0.00 179.25 177.61 2wcv n ILE 57 N -3.75 1.41 -0.26 0.00 -0.00 0.11 -4.48 119.36 112.39 2wcv n ILE 57 Ca -0.09 -0.75 0.17 0.00 -0.00 0.00 0.00 62.75 62.09 2wcv n ILE 57 Cb 0.89 -0.89 0.47 0.00 -0.00 0.00 0.00 39.64 40.11 2wcv n ILE 57 CO 0.00 0.00 0.00 -0.29 -0.00 0.00 0.00 176.55 176.26 2wcv h ILE 58 N 0.00 0.71 0.00 1.39 6.09 -1.30 0.24 117.51 124.63 2wcv h ILE 58 Ca -0.23 -0.17 0.00 0.00 -1.37 0.00 0.00 64.86 63.09 2wcv h ILE 58 Cb 1.81 0.18 0.00 0.00 0.47 0.00 0.00 36.82 39.28 2wcv h ILE 58 CO 0.06 0.09 0.00 -0.81 -3.07 0.00 0.00 178.15 174.42 2wcv n PRO 59 N -4.54 0.03 -0.08 2.19 -0.04 -1.26 -3.17 135.00 128.12 2wcv n PRO 59 Ca 0.19 0.18 -0.08 0.00 -0.04 0.00 0.00 63.50 63.76 2wcv n PRO 59 Cb 0.65 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.48 2wcv n PRO 59 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2wcv n LEU 60 N -1.48 0.15 -4.39 1.53 4.32 0.68 -4.96 117.00 112.85 2wcv n LEU 60 Ca 0.05 -0.01 -0.42 0.00 -0.02 0.00 0.00 56.01 55.61 2wcv n LEU 60 Cb 0.20 0.34 -0.10 0.00 -1.62 0.00 0.00 43.42 42.24 2wcv n LEU 60 CO 0.16 0.42 -0.07 0.12 -1.22 0.00 0.00 177.39 176.80 2wcv s PHE 61 N -2.39 3.26 0.01 -1.77 5.36 -0.31 -5.07 117.98 117.07 2wcv s PHE 61 Ca -0.09 -0.91 -0.30 0.00 -0.96 0.00 0.00 56.93 54.66 2wcv s PHE 61 Cb 0.05 -2.77 -0.04 0.00 -0.34 0.00 0.00 43.02 39.92 2wcv s PHE 61 CO 0.64 -0.70 1.17 -2.00 -1.46 0.00 0.00 175.22 172.88 2wcv s GLU 62 N 1.60 4.42 0.29 10.12 2.56 -1.26 -4.81 118.70 131.62 2wcv s GLU 62 Ca 0.04 1.69 -0.24 0.00 0.00 0.00 0.00 54.97 56.46 2wcv s GLU 62 Cb -0.21 -3.44 -0.09 0.00 2.00 0.00 0.00 34.13 32.38 2wcv s GLU 62 CO 0.07 -0.31 0.86 -0.51 -0.56 0.00 0.00 175.26 174.82 2wcv s LEU 63 N 1.51 4.34 0.37 2.70 1.43 -1.26 -0.05 118.68 127.71 2wcv s LEU 63 Ca 0.57 1.68 -0.27 0.00 -1.03 0.00 0.00 54.13 55.07 2wcv s LEU 63 Cb -0.27 -3.86 -0.10 0.00 0.03 0.00 0.00 46.19 41.99 2wcv s LEU 63 CO 0.26 -0.03 1.32 -0.62 0.23 0.00 0.00 176.35 177.51 2wcv s ASP 64 N -1.64 6.52 0.00 2.29 -1.08 -0.46 -3.87 116.67 118.43 2wcv s ASP 64 Ca 0.48 2.70 0.10 0.00 -0.52 0.00 0.00 52.55 55.30 2wcv s ASP 64 Cb -0.18 -2.65 -0.10 0.00 -1.46 0.00 0.00 42.92 38.54 2wcv s ASP 64 CO 0.23 -0.71 0.43 -1.54 0.52 0.00 0.00 175.17 174.10 2wcv n SER 65 N 0.45 0.52 -0.16 -0.34 3.41 -1.26 -4.22 113.62 112.00 2wcv n SER 65 Ca 0.02 -0.76 0.14 0.00 -0.26 0.00 0.00 58.87 58.01 2wcv n SER 65 Cb 0.42 0.96 0.55 0.00 -0.26 0.00 0.00 64.21 65.88 2wcv n SER 65 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2wcv n TYR 66 N -1.17 0.00 -3.53 7.33 4.02 -1.26 -4.92 117.16 117.64 2wcv n TYR 66 Ca 0.02 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.82 2wcv n TYR 66 Cb 0.16 -0.16 -0.02 0.00 -0.02 0.00 0.00 39.34 39.30 2wcv n TYR 66 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2wcv s ALA 67 N -2.46 -1.72 -0.24 -0.72 0.00 -1.26 -5.10 121.76 110.26 2wcv s ALA 67 Ca 0.28 0.71 -0.33 0.00 0.00 0.00 0.00 51.96 52.63 2wcv s ALA 67 Cb 0.20 0.58 -0.09 0.00 0.00 0.00 0.00 23.12 23.81 2wcv s ALA 67 CO 0.48 -0.77 2.13 -2.30 0.00 0.00 0.00 175.76 175.30 2wcv n PRO 68 N -0.32 1.63 0.19 0.00 -0.02 -1.26 -4.72 135.00 130.50 2wcv n PRO 68 Ca -0.10 0.49 0.06 0.00 -2.02 0.00 0.00 63.50 61.93 2wcv n PRO 68 Cb 0.62 -2.76 0.30 0.00 -0.02 0.00 0.00 33.50 31.65 2wcv n PRO 68 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2wcv h PRO 69 N 12.49 0.00 -4.64 0.52 0.13 -1.87 -3.44 132.00 135.19 2wcv h PRO 69 Ca -0.37 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.19 2wcv h PRO 69 Cb 1.28 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 32.06 2wcv h PRO 69 CO 0.98 0.35 -0.83 -0.51 -0.23 0.00 0.00 178.00 177.77 2wcv s LEU 70 N -6.84 1.64 -0.03 1.56 1.43 -1.26 -0.80 118.68 114.38 2wcv s LEU 70 Ca 0.01 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.72 2wcv s LEU 70 Cb 0.10 -1.05 0.01 0.00 0.03 0.00 0.00 46.19 45.28 2wcv s LEU 70 CO 0.68 -0.01 -0.06 -0.69 0.23 0.00 0.00 176.35 176.50 2wcv s VAL 71 N 1.13 0.60 0.40 -1.59 1.01 -0.67 -2.23 120.40 119.06 2wcv s VAL 71 Ca -0.04 -0.23 0.04 0.00 0.00 0.00 0.00 61.98 61.75 2wcv s VAL 71 Cb -0.14 -0.57 -0.05 0.00 0.00 0.00 0.00 36.38 35.62 2wcv s VAL 71 CO -0.03 0.21 0.04 -0.04 0.00 0.00 0.00 175.10 175.28 2wcv s MET 72 N 0.43 1.91 -0.05 2.72 -1.94 0.22 -0.18 119.30 122.40 2wcv s MET 72 Ca -0.06 -2.12 -0.15 0.00 -1.71 0.00 0.00 55.69 51.65 2wcv s MET 72 Cb -0.10 -1.22 -0.05 0.00 2.01 0.00 0.00 34.83 35.47 2wcv s MET 72 CO 0.00 -0.22 0.40 1.41 -0.01 0.00 0.00 175.02 176.60 2wcv s MET 73 N -3.80 4.05 0.13 2.03 1.75 -1.25 -1.30 119.30 120.91 2wcv s MET 73 Ca 0.28 0.37 -0.21 0.00 -1.25 0.00 0.00 55.69 54.88 2wcv s MET 73 Cb 0.07 -3.30 -0.07 0.00 2.84 0.00 0.00 34.83 34.37 2wcv s MET 73 CO 0.14 0.51 0.65 0.00 -0.65 0.00 0.00 175.02 175.66 2wcv s ALA 74 N -0.48 3.52 0.35 4.11 0.00 0.50 -4.81 121.76 124.96 2wcv s ALA 74 Ca 0.23 0.13 -0.28 0.00 0.00 0.00 0.00 51.96 52.04 2wcv s ALA 74 Cb -0.16 -2.74 -0.10 0.00 0.00 0.00 0.00 23.12 20.12 2wcv s ALA 74 CO 0.11 0.36 1.30 0.00 0.00 0.00 0.00 175.76 177.54 2wcv s ALA 75 N -1.22 3.42 0.49 0.00 0.00 -1.26 -3.86 121.76 119.33 2wcv s ALA 75 Ca 0.34 1.24 -0.21 0.00 0.00 0.00 0.00 51.96 53.33 2wcv s ALA 75 Cb -0.20 -3.48 -0.08 0.00 0.00 0.00 0.00 23.12 19.37 2wcv s ALA 75 CO 0.21 -0.68 1.07 0.14 0.00 0.00 0.00 175.76 176.50 2wcv s VAL 76 N -1.18 3.58 0.13 0.00 -7.23 -1.26 -4.93 120.40 109.51 2wcv s VAL 76 Ca 0.51 1.03 -0.31 0.00 -1.81 0.00 0.00 61.98 61.40 2wcv s VAL 76 Cb -0.39 -3.44 -0.10 0.00 0.56 0.00 0.00 36.38 33.01 2wcv s VAL 76 CO 0.51 -0.17 1.80 -1.83 -0.31 0.00 0.00 175.10 175.10 2wcv s GLU 77 N -3.11 4.14 0.00 4.82 -1.05 -1.26 -1.56 118.70 120.68 2wcv s GLU 77 Ca 0.67 2.57 0.00 0.00 -0.15 0.00 0.00 54.97 58.06 2wcv s GLU 77 Cb -0.20 -3.55 0.00 0.00 -0.44 0.00 0.00 34.13 29.95 2wcv s GLU 77 CO 0.24 -0.82 0.00 0.41 0.95 0.00 0.00 175.26 176.03 2wcv n GLY 78 N 4.18 0.99 3.39 -3.83 0.00 -1.26 -5.09 105.19 103.57 2wcv n GLY 78 Ca 0.17 -0.01 -0.19 0.00 0.00 0.00 0.00 46.02 45.99 2wcv n GLY 78 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wcv s ASP 79 N -2.01 2.23 -0.08 1.61 -1.08 -0.60 -5.16 116.67 111.57 2wcv s ASP 79 Ca 0.00 -1.26 0.01 0.00 -0.52 0.00 0.00 52.55 50.79 2wcv s ASP 79 Cb 0.00 -0.06 -0.02 0.00 -1.46 0.00 0.00 42.92 41.37 2wcv s ASP 79 CO 0.00 -0.49 -0.11 -0.89 0.52 0.00 0.00 175.17 174.19 2wcv s THR 80 N -3.28 3.28 0.23 1.71 2.01 -1.26 -4.85 115.64 113.48 2wcv s THR 80 Ca 0.31 -0.62 0.11 0.00 0.31 0.00 0.00 61.69 61.80 2wcv s THR 80 Cb 0.06 -2.34 -0.05 0.00 0.01 0.00 0.00 72.50 70.19 2wcv s THR 80 CO 0.11 0.57 -0.22 -0.22 -0.69 0.00 0.00 174.62 174.17 2wcv s LEU 81 N -0.36 2.51 -0.28 4.42 0.20 -1.26 -4.83 118.68 119.08 2wcv s LEU 81 Ca 0.04 -0.94 -0.08 0.00 0.69 0.00 0.00 54.13 53.84 2wcv s LEU 81 Cb -0.12 -1.11 -0.01 0.00 -0.43 0.00 0.00 46.19 44.51 2wcv s LEU 81 CO 0.02 0.07 0.09 -0.62 -0.29 0.00 0.00 176.35 175.62 2wcv s ASP 82 N -3.07 5.19 0.40 3.68 2.15 -1.26 -4.99 116.67 118.78 2wcv s ASP 82 Ca 0.25 -0.43 0.07 0.00 0.43 0.00 0.00 52.55 52.87 2wcv s ASP 82 Cb -0.06 -1.92 0.85 0.00 -0.30 0.00 0.00 42.92 41.49 2wcv s ASP 82 CO 0.12 -0.12 2.04 -0.65 -0.17 0.00 0.00 175.17 176.39 2wcv h PRO 83 N 8.26 0.56 -0.34 4.34 0.11 -2.00 -2.84 132.00 140.09 2wcv h PRO 83 Ca -0.35 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.64 2wcv h PRO 83 Cb 1.15 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 2wcv h PRO 83 CO 0.60 0.37 -0.17 0.93 -0.21 0.00 0.00 178.00 179.52 2wcv h GLU 84 N 0.58 0.62 -0.07 1.05 4.39 -2.00 -3.17 114.58 115.97 2wcv h GLU 84 Ca 0.18 -0.21 0.04 0.00 0.34 0.00 0.00 59.36 59.71 2wcv h GLU 84 Cb 0.02 -0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 28.57 2wcv h GLU 84 CO -0.04 0.75 -0.36 0.28 -1.16 0.00 0.00 179.01 178.48 2wcv h VAL 85 N 0.55 0.24 0.00 3.13 2.07 -1.93 -0.81 116.25 119.50 2wcv h VAL 85 Ca 0.09 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.59 2wcv h VAL 85 Cb 0.60 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2wcv h VAL 85 CO 0.04 0.00 -0.12 -0.08 0.02 0.00 0.00 177.57 177.43 2wcv h GLU 86 N -0.47 0.00 -0.02 1.57 4.81 -1.71 -2.45 114.58 116.32 2wcv h GLU 86 Ca 0.07 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2wcv h GLU 86 Cb 0.59 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 2wcv h GLU 86 CO -0.33 0.12 0.00 -0.09 -0.73 0.00 0.00 179.01 177.98 2wcv h ARG 87 N 0.00 0.04 0.00 1.92 9.65 -1.16 -2.46 114.38 122.37 2wcv h ARG 87 Ca -0.00 -0.01 -0.05 0.00 -1.10 0.00 0.00 59.98 58.82 2wcv h ARG 87 Cb 0.24 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.81 2wcv h ARG 87 CO 0.02 0.32 -0.24 0.07 2.80 0.00 0.00 179.97 182.93 2wcv h ARG 88 N -0.25 0.00 -0.21 0.20 0.11 -1.16 -1.99 114.38 111.08 2wcv h ARG 88 Ca 0.01 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.07 2wcv h ARG 88 Cb 0.30 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.37 2wcv h ARG 88 CO 0.00 0.24 0.06 1.88 0.10 0.00 0.00 179.97 182.25 2wcv h TYR 89 N 0.00 0.35 -0.70 4.08 -1.99 -1.38 0.48 116.97 117.82 2wcv h TYR 89 Ca -0.00 -0.04 -0.00 0.00 2.00 0.00 0.00 58.73 60.69 2wcv h TYR 89 Cb 0.91 -0.10 -0.03 0.00 2.00 0.00 0.00 36.73 39.51 2wcv h TYR 89 CO 0.00 0.43 0.43 0.00 -0.00 0.00 0.00 178.16 179.02 2wcv h ARG 90 N 0.17 0.94 -0.44 4.88 3.08 -1.27 -0.00 114.38 121.74 2wcv h ARG 90 Ca 0.07 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 59.99 2wcv h ARG 90 Cb 0.25 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 2wcv h ARG 90 CO -0.00 0.66 0.07 -0.91 -1.07 0.00 0.00 179.97 178.73 2wcv h ASN 91 N 0.95 0.69 -0.47 7.04 2.35 -1.01 -1.09 115.58 124.04 2wcv h ASN 91 Ca 0.25 -0.26 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 2wcv h ASN 91 Cb -0.04 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.12 2wcv h ASN 91 CO -0.05 0.77 0.15 0.00 -1.65 0.00 0.00 177.43 176.65 2wcv h ALA 92 N 0.94 1.28 -0.00 -0.83 0.00 0.36 -2.70 119.26 118.31 2wcv h ALA 92 Ca 0.13 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2wcv h ALA 92 Cb 0.37 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2wcv h ALA 92 CO 0.01 0.51 -0.15 1.28 0.00 0.00 0.00 179.25 180.90 2wcv n LEU 93 N -4.30 0.22 -4.51 0.00 4.77 -0.05 -4.08 117.00 109.06 2wcv n LEU 93 Ca 0.04 0.26 -0.42 0.00 -0.03 0.00 0.00 56.01 55.85 2wcv n LEU 93 Cb 0.20 -0.36 -0.04 0.00 -2.33 0.00 0.00 43.42 40.90 2wcv n LEU 93 CO 0.39 0.05 0.88 -0.44 -1.33 0.00 0.00 177.39 176.95 2wcv s SER 94 N -2.87 6.25 -0.14 -1.43 0.01 -0.44 -4.57 113.70 110.51 2wcv s SER 94 Ca 0.17 -0.54 -0.19 0.00 1.31 0.00 0.00 55.95 56.70 2wcv s SER 94 Cb 0.19 -2.47 -0.24 0.00 0.21 0.00 0.00 66.02 63.71 2wcv s SER 94 CO 0.56 -1.47 0.46 -0.07 0.41 0.00 0.00 173.24 173.13 2wcv h LEU 95 N 11.68 0.20 0.00 2.44 3.38 -1.86 -3.46 115.31 127.68 2wcv h LEU 95 Ca -0.27 -0.76 0.00 0.00 0.09 0.00 0.00 57.88 56.93 2wcv h LEU 95 Cb 1.07 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2wcv h LEU 95 CO 1.17 1.51 -0.35 0.00 0.09 0.00 0.00 178.44 180.86 2wcv n ALA 97 N -3.07 2.59 -1.18 1.53 0.00 -1.26 -5.09 120.51 114.03 2wcv n ALA 97 Ca -0.26 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.86 2wcv n ALA 97 Cb 0.78 0.18 0.11 0.00 0.00 0.00 0.00 19.45 20.51 2wcv n ALA 97 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2wcv s PRO 98 N -1.73 1.96 0.08 0.00 0.04 -1.26 -5.04 135.00 129.05 2wcv s PRO 98 Ca 0.00 1.52 0.06 0.00 0.04 0.00 0.00 61.00 62.62 2wcv s PRO 98 Cb 0.00 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.66 2wcv s PRO 98 CO 0.00 -1.92 -0.06 0.00 0.04 0.00 0.00 177.00 175.06 2wcv n PRO 100 N 0.79 -0.61 -1.44 0.00 -0.02 -1.26 -4.91 135.00 127.55 2wcv n PRO 100 Ca -0.13 -0.15 -0.33 0.00 -2.02 0.00 0.00 63.50 60.87 2wcv n PRO 100 Cb 0.52 -1.67 0.09 0.00 -0.02 0.00 0.00 33.50 32.42 2wcv n PRO 100 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2wcv s ASP 101 N -1.80 4.38 -0.14 2.55 1.11 -1.26 -4.97 116.67 116.54 2wcv s ASP 101 Ca 0.54 2.17 -0.03 0.00 0.18 0.00 0.00 52.55 55.40 2wcv s ASP 101 Cb -0.17 -2.57 -0.03 0.00 1.07 0.00 0.00 42.92 41.23 2wcv s ASP 101 CO 0.69 -2.13 -0.03 -0.63 1.18 0.00 0.00 175.17 174.25 2wcv s ILE 102 N -2.27 3.94 -0.05 0.77 1.01 -1.26 -4.55 121.20 118.79 2wcv s ILE 102 Ca 0.70 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 61.03 2wcv s ILE 102 Cb -0.24 -2.71 -0.03 0.00 0.01 0.00 0.00 42.46 39.49 2wcv s ILE 102 CO 0.46 0.51 -0.11 -0.63 0.00 0.00 0.00 174.94 175.17 2wcv s ILE 103 N 0.17 3.35 -0.14 2.92 1.01 -0.95 -4.94 121.20 122.61 2wcv s ILE 103 Ca -0.01 -0.66 -0.06 0.00 0.00 0.00 0.00 60.65 59.91 2wcv s ILE 103 Cb -0.14 -2.35 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 2wcv s ILE 103 CO 0.03 0.56 0.07 -0.13 0.00 0.00 0.00 174.94 175.47 2wcv s ARG 104 N -0.87 3.57 0.21 2.79 1.81 -1.26 -0.61 118.95 124.59 2wcv s ARG 104 Ca 0.13 -0.30 0.11 0.00 -1.72 0.00 0.00 55.73 53.95 2wcv s ARG 104 Cb -0.11 -3.10 -0.05 0.00 -0.45 0.00 0.00 34.95 31.24 2wcv s ARG 104 CO 0.02 0.53 -0.23 0.96 -0.68 0.00 0.00 175.30 175.90 2wcv s ILE 105 N -0.35 2.36 0.44 1.52 -4.36 -0.42 -4.79 121.20 115.59 2wcv s ILE 105 Ca 0.09 -2.11 -0.25 0.00 -0.26 0.00 0.00 60.65 58.12 2wcv s ILE 105 Cb -0.12 -2.15 -0.08 0.00 1.25 0.00 0.00 42.46 41.36 2wcv s ILE 105 CO 0.02 -0.18 1.35 0.54 0.24 0.00 0.00 174.94 176.91 2wcv s ASN 106 N -2.84 6.05 0.26 4.36 2.20 -1.26 -0.37 114.94 123.33 2wcv s ASN 106 Ca 0.22 2.76 0.03 0.00 -0.94 0.00 0.00 52.86 54.94 2wcv s ASN 106 Cb -0.07 -2.64 0.67 0.00 -2.00 0.00 0.00 41.25 37.21 2wcv s ASN 106 CO 0.11 -1.04 1.27 -2.11 -2.94 0.00 0.00 177.10 172.39 2wcv n ARG 107 N -0.11 -0.06 -0.19 3.55 1.85 -1.25 0.02 116.66 120.46 2wcv n ARG 107 Ca 0.05 1.21 -0.10 0.00 -1.00 0.00 0.00 57.85 58.00 2wcv n ARG 107 Cb 0.43 -1.94 0.01 0.00 -1.05 0.00 0.00 32.46 29.91 2wcv n ARG 107 CO 0.00 0.00 0.00 0.74 -0.01 0.00 0.00 177.63 178.36 2wcv h PHE 108 N 0.00 1.16 -0.44 2.89 0.04 -1.95 -1.08 116.94 117.57 2wcv h PHE 108 Ca 0.51 -0.24 -0.03 0.00 2.80 0.00 0.00 57.97 61.02 2wcv h PHE 108 Cb 1.10 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 38.94 2wcv h PHE 108 CO -0.37 1.06 0.15 0.00 -0.60 0.00 0.00 178.31 178.55 2wcv h ALA 109 N 0.93 1.44 -0.31 2.45 0.00 -0.75 -0.65 119.26 122.38 2wcv h ALA 109 Ca 0.15 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2wcv h ALA 109 Cb 0.66 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2wcv h ALA 109 CO 0.05 0.42 -0.21 0.35 0.00 0.00 0.00 179.25 179.86 2wcv h PHE 110 N 0.62 0.81 -0.22 0.00 3.57 -0.59 -2.45 116.94 118.68 2wcv h PHE 110 Ca 0.15 -0.22 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 2wcv h PHE 110 Cb 0.17 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 2wcv h PHE 110 CO 0.01 0.94 0.11 1.88 -2.23 0.00 0.00 178.31 179.02 2wcv h TYR 111 N 0.45 0.30 -1.00 0.41 0.99 -0.80 0.47 116.97 117.79 2wcv h TYR 111 Ca 0.06 -0.01 0.20 0.00 2.00 0.00 0.00 58.73 60.98 2wcv h TYR 111 Cb 0.75 -0.10 -0.10 0.00 1.00 0.00 0.00 36.73 38.29 2wcv h TYR 111 CO 0.06 0.28 0.61 1.49 -0.00 0.00 0.00 178.16 180.61 2wcv h GLU 112 N 0.24 0.69 0.00 4.88 4.81 -1.07 0.14 114.58 124.27 2wcv h GLU 112 Ca 0.08 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.12 2wcv h GLU 112 Cb 0.08 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 2wcv h GLU 112 CO -0.01 0.45 -0.84 -0.09 -0.73 0.00 0.00 179.01 177.79 2wcv h ARG 113 N 0.71 0.00 0.00 1.92 2.43 -1.00 -3.16 114.38 115.29 2wcv h ARG 113 Ca 0.57 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.67 2wcv h ARG 113 Cb 0.97 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.51 2wcv h ARG 113 CO -0.36 0.51 -0.32 0.00 -1.51 0.00 0.00 179.97 178.29 2wcv h ALA 114 N 1.40 1.19 0.00 2.80 0.00 0.15 -2.53 119.26 122.26 2wcv h ALA 114 Ca -0.05 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 2wcv h ALA 114 Cb 1.51 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.24 2wcv h ALA 114 CO 0.07 0.40 -0.09 1.96 0.00 0.00 0.00 179.25 181.60 2wcv h GLN 115 N 0.00 0.00 -0.24 0.00 4.20 -1.02 -2.77 115.11 115.29 2wcv h GLN 115 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2wcv h GLN 115 Cb 0.69 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.47 2wcv h GLN 115 CO 0.04 0.09 0.00 1.63 -0.67 0.00 0.00 178.83 179.92 2wcv n LYS 116 N -3.37 1.98 -1.34 1.46 5.02 -0.97 -4.46 118.16 116.48 2wcv n LYS 116 Ca -0.01 -1.77 -0.31 0.00 -2.02 0.00 0.00 58.31 54.20 2wcv n LYS 116 Cb 0.26 -1.28 0.08 0.00 -0.02 0.00 0.00 35.03 34.07 2wcv n LYS 116 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wcv s ALA 117 N -1.02 2.30 0.18 7.82 0.00 -1.04 -4.91 121.76 125.08 2wcv s ALA 117 Ca 0.22 0.29 -0.08 0.00 0.00 0.00 0.00 51.96 52.39 2wcv s ALA 117 Cb 0.12 -3.27 0.06 0.00 0.00 0.00 0.00 23.12 20.03 2wcv s ALA 117 CO 0.17 -1.68 1.58 0.35 0.00 0.00 0.00 175.76 176.18 2wcv h PHE 118 N -0.96 1.07 -2.52 0.00 3.04 -1.05 -3.42 116.94 113.10 2wcv h PHE 118 Ca -0.44 -0.25 0.12 0.00 3.98 0.00 0.00 57.97 61.38 2wcv h PHE 118 Cb 1.23 -0.25 -0.09 0.00 2.56 0.00 0.00 35.95 39.40 2wcv h PHE 118 CO 0.58 1.05 0.41 0.00 -2.02 0.00 0.00 178.31 178.33 2wcv s ALA 119 N -4.66 -1.60 -0.05 2.41 0.00 -1.25 -4.21 121.76 112.40 2wcv s ALA 119 Ca -0.11 0.27 0.01 0.00 0.00 0.00 0.00 51.96 52.13 2wcv s ALA 119 Cb 0.13 0.66 0.02 0.00 0.00 0.00 0.00 23.12 23.93 2wcv s ALA 119 CO 0.86 -0.94 -0.03 0.42 0.00 0.00 0.00 175.76 176.07 2wcv s ILE 120 N -3.42 0.48 -0.34 0.00 1.01 0.14 -2.43 121.20 116.65 2wcv s ILE 120 Ca 0.09 -0.07 -0.06 0.00 0.00 0.00 0.00 60.65 60.62 2wcv s ILE 120 Cb -0.02 -0.53 0.04 0.00 0.01 0.00 0.00 42.46 41.96 2wcv s ILE 120 CO -0.01 0.22 0.09 -0.69 0.00 0.00 0.00 174.94 174.56 2wcv s VAL 121 N 1.09 3.65 -0.24 2.92 1.01 0.16 -0.74 120.40 128.24 2wcv s VAL 121 Ca -0.08 -1.20 -0.18 0.00 0.00 0.00 0.00 61.98 60.51 2wcv s VAL 121 Cb -0.14 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 2wcv s VAL 121 CO -0.01 -0.19 0.52 -0.51 0.00 0.00 0.00 175.10 174.91 2wcv s ILE 122 N 1.37 5.08 0.08 2.22 2.07 -0.45 -0.75 121.20 130.81 2wcv s ILE 122 Ca -0.02 0.92 0.01 0.00 -1.41 0.00 0.00 60.65 60.15 2wcv s ILE 122 Cb -0.20 -3.84 0.01 0.00 0.13 0.00 0.00 42.46 38.57 2wcv s ILE 122 CO 0.02 0.12 0.09 0.35 -1.91 0.00 0.00 174.94 173.61 2wcv n THR 123 N 4.92 0.00 0.43 4.00 -2.24 -0.63 -0.59 114.28 120.18 2wcv n THR 123 Ca -0.04 -0.30 0.10 0.00 -2.27 0.00 0.00 64.05 61.54 2wcv n THR 123 Cb 0.50 -0.70 0.26 0.00 -2.10 0.00 0.00 70.33 68.29 2wcv n THR 123 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wcv n GLY 124 N 4.01 1.39 3.68 3.38 0.00 0.15 -2.68 105.19 115.13 2wcv n GLY 124 Ca 0.01 -0.60 -0.52 0.00 0.00 0.00 0.00 46.02 44.91 2wcv n GLY 124 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wcv n GLU 125 N 1.06 1.67 -0.01 1.61 -0.58 -1.18 -4.61 120.64 118.60 2wcv n GLU 125 Ca 0.18 0.61 -0.01 0.00 -0.42 0.00 0.00 57.16 57.52 2wcv n GLU 125 Cb 0.47 -2.37 -0.12 0.00 -0.57 0.00 0.00 31.44 28.86 2wcv n GLU 125 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 2wcv n ARG 126 N 5.43 0.65 -1.68 3.49 0.63 -1.26 -0.09 116.66 123.82 2wcv n ARG 126 Ca 0.23 0.09 -0.41 0.00 -0.92 0.00 0.00 57.85 56.83 2wcv n ARG 126 Cb 0.22 -1.68 0.01 0.00 0.45 0.00 0.00 32.46 31.46 2wcv n ARG 126 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2wcv n ALA 127 N -2.47 1.03 -1.77 5.13 0.00 -1.26 -4.91 120.51 116.26 2wcv n ALA 127 Ca -0.15 0.28 -0.38 0.00 0.00 0.00 0.00 53.44 53.20 2wcv n ALA 127 Cb 0.88 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 18.12 2wcv n ALA 127 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2wcv s LYS 128 N -2.07 3.64 -1.32 0.00 1.02 -1.26 -3.38 119.74 116.37 2wcv s LYS 128 Ca 0.60 1.93 -0.00 0.00 0.02 0.00 0.00 55.97 58.52 2wcv s LYS 128 Cb -0.54 -2.42 -0.00 0.00 -0.52 0.00 0.00 37.83 34.35 2wcv s LYS 128 CO 0.59 -0.69 0.64 0.66 -0.92 0.00 0.00 175.35 175.63 2wcv n TYR 129 N -0.52 -1.86 -0.37 3.18 4.02 -1.26 -4.50 117.16 115.84 2wcv n TYR 129 Ca 0.07 0.82 0.11 0.00 -0.01 0.00 0.00 57.90 58.89 2wcv n TYR 129 Cb 0.47 -4.25 0.33 0.00 -0.02 0.00 0.00 39.34 35.86 2wcv n TYR 129 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2wcv n GLY 130 N -1.65 2.46 3.74 2.72 0.00 -1.22 -4.75 105.19 106.49 2wcv n GLY 130 Ca -0.30 -0.80 -0.41 0.00 0.00 0.00 0.00 46.02 44.51 2wcv n GLY 130 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wcv s ASN 131 N -0.96 7.17 -0.01 1.61 0.01 -1.26 -4.29 114.94 117.21 2wcv s ASN 131 Ca 0.49 2.20 -0.02 0.00 -0.71 0.00 0.00 52.86 54.82 2wcv s ASN 131 Cb 0.27 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 39.32 2wcv s ASN 131 CO 0.30 -0.29 0.04 -0.51 -1.51 0.00 0.00 177.10 175.13 2wcv s ILE 132 N -0.32 0.02 -0.09 0.60 2.07 -0.66 -3.86 121.20 118.96 2wcv s ILE 132 Ca 0.50 -0.16 0.02 0.00 -1.41 0.00 0.00 60.65 59.60 2wcv s ILE 132 Cb -0.32 -0.11 -0.02 0.00 0.13 0.00 0.00 42.46 42.14 2wcv s ILE 132 CO 0.37 -0.09 -0.13 -0.22 -1.91 0.00 0.00 174.94 172.97 2wcv s LEU 133 N -0.25 2.79 -0.06 8.50 0.20 0.74 -0.99 118.68 129.61 2wcv s LEU 133 Ca -0.03 -0.22 0.05 0.00 0.69 0.00 0.00 54.13 54.62 2wcv s LEU 133 Cb -0.02 -1.60 -0.01 0.00 -0.43 0.00 0.00 46.19 44.13 2wcv s LEU 133 CO -0.00 0.27 -0.22 -0.76 -0.29 0.00 0.00 176.35 175.36 2wcv s LEU 134 N -0.29 2.27 -0.15 -0.68 1.02 -0.25 -1.66 118.68 118.94 2wcv s LEU 134 Ca 0.03 -0.43 -0.02 0.00 0.02 0.00 0.00 54.13 53.73 2wcv s LEU 134 Cb -0.13 -1.43 -0.02 0.00 0.02 0.00 0.00 46.19 44.63 2wcv s LEU 134 CO 0.03 0.26 -0.07 -0.75 0.02 0.00 0.00 176.35 175.84 2wcv s LYS 135 N -0.25 3.57 0.20 1.70 2.20 0.02 -1.60 119.74 125.58 2wcv s LYS 135 Ca -0.01 -0.58 -0.28 0.00 -0.36 0.00 0.00 55.97 54.75 2wcv s LYS 135 Cb -0.13 -2.81 -0.08 0.00 -1.51 0.00 0.00 37.83 33.30 2wcv s LYS 135 CO 0.03 0.24 0.86 0.21 -0.36 0.00 0.00 175.35 176.32 2wcv s LYS 136 N 0.35 4.71 0.00 4.03 2.20 -0.49 -1.36 119.74 129.18 2wcv s LYS 136 Ca -0.07 1.32 0.00 0.00 -0.36 0.00 0.00 55.97 56.87 2wcv s LYS 136 Cb -0.15 -3.28 0.00 0.00 -1.51 0.00 0.00 37.83 32.90 2wcv s LYS 136 CO 0.04 0.53 0.00 0.41 -0.36 0.00 0.00 175.35 175.97 2wcv n GLY 137 N 1.58 1.69 3.41 5.54 0.00 0.92 0.24 105.19 118.57 2wcv n GLY 137 Ca -0.04 -1.96 -0.44 0.00 0.00 0.00 0.00 46.02 43.58 2wcv n GLY 137 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wcv s VAL 138 N 2.04 4.66 -0.14 1.61 1.01 -1.26 -4.11 120.40 124.21 2wcv s VAL 138 Ca 0.00 -0.92 -0.34 0.00 0.00 0.00 0.00 61.98 60.72 2wcv s VAL 138 Cb 0.00 -4.61 -0.11 0.00 0.00 0.00 0.00 36.38 31.66 2wcv s VAL 138 CO 0.00 -1.30 1.95 0.41 0.00 0.00 0.00 175.10 176.16 2wcv n THR 139 N 5.61 0.51 1.54 3.92 -1.04 -1.26 -5.03 114.28 118.53 2wcv n THR 139 Ca -0.01 -0.16 0.12 0.00 -2.04 0.00 0.00 64.05 61.96 2wcv n THR 139 Cb 0.45 -1.89 0.73 0.00 -1.82 0.00 0.00 70.33 67.79 2wcv n THR 139 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62