#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pov s HIS 4 N 0.00 2.30 0.65 1.57 5.04 -1.26 -4.98 115.29 118.62 2pov s HIS 4 Ca 0.00 1.58 -0.16 0.00 -1.54 0.00 0.00 55.06 54.94 2pov s HIS 4 Cb 0.00 -3.34 -0.00 0.00 0.04 0.00 0.00 32.58 29.28 2pov s HIS 4 CO 0.00 -2.20 1.17 1.67 -2.34 0.00 0.00 174.74 173.04 2pov s TRP 5 N -2.13 2.38 0.00 3.88 1.48 -1.26 -4.89 118.94 118.41 2pov s TRP 5 Ca 0.71 1.56 0.00 0.00 -1.06 0.00 0.00 56.10 57.31 2pov s TRP 5 Cb -0.25 -3.35 0.00 0.00 -1.16 0.00 0.00 33.47 28.70 2pov s TRP 5 CO 0.43 -2.10 0.00 0.41 -4.06 0.00 0.00 176.95 171.63 2pov n GLY 6 N 0.09 3.10 0.05 3.67 0.00 -0.18 -5.03 105.19 106.89 2pov n GLY 6 Ca 0.12 -0.30 0.02 0.00 0.00 0.00 0.00 46.02 45.86 2pov n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2pov n TYR 7 N 0.00 0.00 -1.98 1.61 4.02 -1.26 -3.87 117.16 115.68 2pov n TYR 7 Ca 0.00 -0.45 -0.29 0.00 -0.01 0.00 0.00 57.90 57.15 2pov n TYR 7 Cb 0.00 -0.06 0.16 0.00 -0.02 0.00 0.00 39.34 39.42 2pov n TYR 7 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 2pov s GLY 8 N -1.13 1.75 0.50 2.72 0.00 -1.26 -4.59 107.32 105.30 2pov s GLY 8 Ca 0.06 -1.14 0.22 0.00 0.00 0.00 0.00 44.72 43.86 2pov s GLY 8 CO 0.01 -0.44 2.07 0.07 0.00 0.00 0.00 173.10 174.81 2pov h LYS 9 N -1.45 0.00 -0.01 2.90 2.10 -1.97 0.37 116.57 118.51 2pov h LYS 9 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 2pov h LYS 9 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 2pov h LYS 9 CO 0.43 0.12 -0.38 0.72 -2.00 0.00 0.00 179.45 178.34 2pov n HIS 10 N -4.01 0.00 -1.11 0.07 8.25 -1.26 -4.57 115.22 112.59 2pov n HIS 10 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2pov n HIS 10 Cb 0.21 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.32 2pov n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2pov n ASN 11 N -0.31 0.08 -2.83 0.41 6.94 -1.15 -4.95 115.26 113.46 2pov n ASN 11 Ca 0.06 -1.19 -0.12 0.00 -0.02 0.00 0.00 54.58 53.30 2pov n ASN 11 Cb 0.32 -0.03 0.09 0.00 -2.36 0.00 0.00 39.78 37.80 2pov n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2pov n GLY 12 N -0.03 -1.67 0.40 4.83 0.00 0.13 -1.01 105.19 107.85 2pov n GLY 12 Ca 0.00 -1.62 0.34 0.00 0.00 0.00 0.00 46.02 44.73 2pov n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2pov h PRO 13 N 0.00 0.09 0.00 1.61 0.11 -1.84 0.26 132.00 132.24 2pov h PRO 13 Ca -0.18 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.93 2pov h PRO 13 Cb 0.50 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.59 2pov h PRO 13 CO 0.12 0.06 0.00 0.39 -0.21 0.00 0.00 178.00 178.36 2pov n GLU 14 N -4.92 0.13 -0.01 1.05 -0.58 -1.26 -3.10 120.64 111.94 2pov n GLU 14 Ca 0.37 0.11 0.07 0.00 -0.42 0.00 0.00 57.16 57.28 2pov n GLU 14 Cb 1.33 -1.50 -0.12 0.00 -0.57 0.00 0.00 31.44 30.57 2pov n GLU 14 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2pov n HIS 15 N -1.42 0.00 -0.18 -0.32 8.25 0.90 -4.65 115.22 117.80 2pov n HIS 15 Ca 0.07 0.00 0.22 0.00 -0.26 0.00 0.00 57.72 57.76 2pov n HIS 15 Cb 0.22 -0.38 0.61 0.00 1.12 0.00 0.00 29.99 31.56 2pov n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 2pov h TRP 16 N 0.00 0.27 0.00 4.41 6.55 -1.44 -2.35 115.95 123.39 2pov h TRP 16 Ca -0.03 0.01 -0.00 0.00 0.95 0.00 0.00 58.89 59.82 2pov h TRP 16 Cb 0.80 -0.08 -0.00 0.00 -0.86 0.00 0.00 29.16 29.02 2pov h TRP 16 CO 0.00 0.07 -0.01 1.12 -1.05 0.00 0.00 178.44 178.57 2pov h HIS 17 N 0.20 0.00 -0.09 0.49 2.07 -1.79 0.12 115.15 116.15 2pov h HIS 17 Ca 0.42 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.93 2pov h HIS 17 Cb 1.33 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.30 2pov h HIS 17 CO -0.00 0.01 0.02 0.87 -3.07 0.00 0.00 177.93 175.76 2pov h LYS 18 N 0.00 0.15 0.00 5.12 1.57 -1.78 -2.20 116.57 119.44 2pov h LYS 18 Ca -0.00 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.68 2pov h LYS 18 Cb 0.05 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 2pov h LYS 18 CO 0.00 0.36 -0.92 -0.44 -0.57 0.00 0.00 179.45 177.88 2pov h ASP 19 N -0.08 0.00 -2.71 0.86 3.32 -1.68 -3.40 116.42 112.73 2pov h ASP 19 Ca 0.03 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.47 2pov h ASP 19 Cb 0.28 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.43 2pov h ASP 19 CO 0.00 0.23 -0.80 -0.36 -1.72 0.00 0.00 179.24 176.59 2pov s PHE 20 N -3.16 2.17 0.52 4.55 0.08 0.40 -4.98 117.98 117.55 2pov s PHE 20 Ca 0.00 -2.76 0.32 0.00 0.12 0.00 0.00 56.93 54.61 2pov s PHE 20 Cb 0.08 -1.70 1.46 0.00 -0.57 0.00 0.00 43.02 42.29 2pov s PHE 20 CO 0.77 -0.71 1.84 -1.35 -0.10 0.00 0.00 175.22 175.67 2pov h PRO 21 N 5.57 0.06 0.00 0.24 0.11 -1.62 0.31 132.00 136.67 2pov h PRO 21 Ca 0.21 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 2pov h PRO 21 Cb 0.84 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.94 2pov h PRO 21 CO 0.52 0.04 0.00 1.51 -0.21 0.00 0.00 178.00 179.86 2pov n ILE 22 N -4.28 1.81 0.26 4.15 3.06 -1.26 -2.10 119.36 121.00 2pov n ILE 22 Ca 0.23 0.48 0.18 0.00 -2.50 0.00 0.00 62.75 61.13 2pov n ILE 22 Cb 1.07 -1.45 0.90 0.00 0.54 0.00 0.00 39.64 40.71 2pov n ILE 22 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2pov h ALA 23 N 2.07 1.56 -0.44 1.51 0.00 -1.25 0.30 119.26 123.00 2pov h ALA 23 Ca 0.00 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 2pov h ALA 23 Cb 0.03 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.75 2pov h ALA 23 CO 0.00 -0.25 0.07 1.63 0.00 0.00 0.00 179.25 180.70 2pov n LYS 24 N -3.48 2.72 -0.67 0.00 5.02 -0.89 -4.96 118.16 115.89 2pov n LYS 24 Ca 0.00 -3.02 -0.21 0.00 -2.02 0.00 0.00 58.31 53.06 2pov n LYS 24 Cb 0.29 -1.94 0.18 0.00 -0.02 0.00 0.00 35.03 33.54 2pov n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2pov n GLY 25 N -0.67 -2.79 0.05 0.72 0.00 0.11 -4.99 105.19 97.62 2pov n GLY 25 Ca 0.32 -1.46 0.13 0.00 0.00 0.00 0.00 46.02 45.00 2pov n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2pov n GLU 26 N -3.90 0.16 -3.06 1.61 -0.58 -1.26 -4.34 120.64 109.26 2pov n GLU 26 Ca 0.10 0.08 -0.16 0.00 -0.42 0.00 0.00 57.16 56.77 2pov n GLU 26 Cb 0.41 -1.63 -0.01 0.00 -0.57 0.00 0.00 31.44 29.64 2pov n GLU 26 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2pov n ARG 27 N -1.88 1.00 -3.10 3.49 1.85 -1.26 -4.57 116.66 112.19 2pov n ARG 27 Ca 0.05 -3.21 -0.31 0.00 -1.00 0.00 0.00 57.85 53.38 2pov n ARG 27 Cb 0.39 -1.55 -0.05 0.00 -1.05 0.00 0.00 32.46 30.20 2pov n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 2pov s GLN 28 N -2.27 3.85 0.17 2.89 -1.52 -1.26 -2.78 119.66 118.74 2pov s GLN 28 Ca 0.36 0.46 0.08 0.00 -1.95 0.00 0.00 55.36 54.31 2pov s GLN 28 Cb 0.36 -2.47 -0.04 0.00 -0.22 0.00 0.00 33.01 30.64 2pov s GLN 28 CO -0.06 0.12 -0.17 -1.12 -0.25 0.00 0.00 175.29 173.81 2pov s SER 29 N -2.70 2.60 0.98 5.90 0.01 -1.26 -4.67 113.70 114.56 2pov s SER 29 Ca 0.51 -0.90 -0.11 0.00 1.31 0.00 0.00 55.95 56.76 2pov s SER 29 Cb -0.10 -0.15 0.15 0.00 0.21 0.00 0.00 66.02 66.13 2pov s SER 29 CO 0.24 -0.08 0.89 -0.81 0.41 0.00 0.00 173.24 173.89 2pov n PRO 30 N 0.11 -0.83 -4.01 12.44 -0.04 -1.26 -4.49 135.00 136.92 2pov n PRO 30 Ca -0.12 -1.42 -0.09 0.00 -0.04 0.00 0.00 63.50 61.84 2pov n PRO 30 Cb 0.58 -0.90 -0.08 0.00 -0.04 0.00 0.00 33.50 33.05 2pov n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2pov s VAL 31 N -2.92 0.12 0.05 0.52 -7.23 -1.26 -0.24 120.40 109.44 2pov s VAL 31 Ca 0.51 -1.57 -0.25 0.00 -1.81 0.00 0.00 61.98 58.86 2pov s VAL 31 Cb -0.01 -1.73 -0.06 0.00 0.56 0.00 0.00 36.38 35.14 2pov s VAL 31 CO 0.35 -0.55 0.76 -0.62 -0.31 0.00 0.00 175.10 174.73 2pov s ASP 32 N -2.96 7.21 -0.45 4.85 3.68 -1.26 -3.10 116.67 124.64 2pov s ASP 32 Ca 0.15 1.45 -0.16 0.00 2.13 0.00 0.00 52.55 56.11 2pov s ASP 32 Cb 0.06 -2.46 0.05 0.00 -1.45 0.00 0.00 42.92 39.11 2pov s ASP 32 CO -0.04 0.04 0.39 -0.63 0.13 0.00 0.00 175.17 175.06 2pov s ILE 33 N -0.15 5.19 -0.62 4.11 1.01 0.12 -4.93 121.20 125.93 2pov s ILE 33 Ca 0.38 -0.78 -0.25 0.00 0.00 0.00 0.00 60.65 60.00 2pov s ILE 33 Cb -0.21 -4.06 0.05 0.00 0.01 0.00 0.00 42.46 38.25 2pov s ILE 33 CO 0.23 -0.49 1.04 -0.62 0.00 0.00 0.00 174.94 175.10 2pov s ASP 34 N 2.19 6.27 0.57 3.58 2.15 -1.26 -0.91 116.67 129.25 2pov s ASP 34 Ca 0.06 -0.50 0.26 0.00 0.43 0.00 0.00 52.55 52.80 2pov s ASP 34 Cb -0.21 -2.47 1.56 0.00 -0.30 0.00 0.00 42.92 41.50 2pov s ASP 34 CO 0.09 -1.43 2.11 0.71 -0.17 0.00 0.00 175.17 176.48 2pov h THR 35 N 6.02 0.63 0.00 1.71 1.35 -1.94 -1.18 112.91 119.49 2pov h THR 35 Ca -0.27 0.00 -0.11 0.00 -0.55 0.00 0.00 66.41 65.48 2pov h THR 35 Cb 1.07 0.87 -0.02 0.00 -1.73 0.00 0.00 68.15 68.34 2pov h THR 35 CO 1.16 0.00 -0.84 0.45 -0.25 0.00 0.00 175.52 176.04 2pov h HIS 36 N 0.00 0.00 0.00 4.73 3.86 -2.03 -3.32 115.15 118.39 2pov h HIS 36 Ca 0.09 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.15 2pov h HIS 36 Cb 0.43 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.87 2pov h HIS 36 CO 0.00 0.46 -1.35 1.15 0.86 0.00 0.00 177.93 179.04 2pov h THR 37 N 0.00 0.46 -3.58 2.45 2.02 -1.78 -3.46 112.91 109.02 2pov h THR 37 Ca -0.06 -1.91 -0.53 0.00 0.77 0.00 0.00 66.41 64.68 2pov h THR 37 Cb 1.40 1.99 0.08 0.00 -1.74 0.00 0.00 68.15 69.89 2pov h THR 37 CO 0.05 0.26 0.81 0.00 0.37 0.00 0.00 175.52 177.01 2pov s ALA 38 N -2.96 3.65 -0.13 6.16 0.00 -0.52 -4.88 121.76 123.08 2pov s ALA 38 Ca -0.03 1.51 -0.03 0.00 0.00 0.00 0.00 51.96 53.41 2pov s ALA 38 Cb 0.09 -3.61 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 2pov s ALA 38 CO 0.81 -0.94 -0.03 0.21 0.00 0.00 0.00 175.76 175.81 2pov s LYS 39 N -1.09 3.38 0.21 0.00 2.20 -0.92 -4.81 119.74 118.71 2pov s LYS 39 Ca 0.58 -0.48 -0.31 0.00 -0.36 0.00 0.00 55.97 55.40 2pov s LYS 39 Cb -0.46 -2.85 -0.10 0.00 -1.51 0.00 0.00 37.83 32.91 2pov s LYS 39 CO 0.52 0.42 1.53 -0.47 -0.36 0.00 0.00 175.35 177.00 2pov s TYR 40 N -0.12 3.01 -0.31 4.03 6.14 -1.26 -0.67 117.35 128.16 2pov s TYR 40 Ca 0.03 0.78 0.02 0.00 0.64 0.00 0.00 57.07 58.53 2pov s TYR 40 Cb -0.13 -3.91 0.08 0.00 0.42 0.00 0.00 41.96 38.41 2pov s TYR 40 CO 0.02 -3.20 0.00 0.34 0.64 0.00 0.00 175.55 173.35 2pov s ASP 41 N 0.79 4.74 0.02 4.32 3.68 -0.28 -4.84 116.67 125.09 2pov s ASP 41 Ca 0.66 -1.69 0.14 0.00 2.13 0.00 0.00 52.55 53.79 2pov s ASP 41 Cb -0.44 -1.64 0.61 0.00 -1.45 0.00 0.00 42.92 40.00 2pov s ASP 41 CO 0.37 -0.31 1.45 -0.81 0.13 0.00 0.00 175.17 176.01 2pov n PRO 42 N 4.43 0.01 0.00 4.34 -0.04 -1.26 -2.19 135.00 140.29 2pov n PRO 42 Ca -0.07 0.28 0.14 0.00 -0.04 0.00 0.00 63.50 63.81 2pov n PRO 42 Cb 0.42 -1.53 0.56 0.00 -0.04 0.00 0.00 33.50 32.91 2pov n PRO 42 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2pov n SER 43 N -1.55 0.13 -4.67 3.54 3.41 -1.26 -4.80 113.62 108.42 2pov n SER 43 Ca 0.03 0.23 -0.43 0.00 -0.26 0.00 0.00 58.87 58.45 2pov n SER 43 Cb 0.16 -0.30 -0.02 0.00 -0.26 0.00 0.00 64.21 63.78 2pov n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2pov s LEU 44 N -2.93 4.25 0.69 1.04 1.43 -0.93 -5.02 118.68 117.21 2pov s LEU 44 Ca 0.15 1.87 -0.11 0.00 -1.03 0.00 0.00 54.13 55.01 2pov s LEU 44 Cb 0.19 -3.55 0.01 0.00 0.03 0.00 0.00 46.19 42.87 2pov s LEU 44 CO 0.56 -0.72 1.07 -0.54 0.23 0.00 0.00 176.35 176.95 2pov s LYS 45 N 2.96 2.97 0.36 1.70 1.02 -1.12 -4.90 119.74 122.74 2pov s LYS 45 Ca 0.59 0.65 -0.28 0.00 0.02 0.00 0.00 55.97 56.94 2pov s LYS 45 Cb -0.26 -2.02 -0.11 0.00 -0.52 0.00 0.00 37.83 34.92 2pov s LYS 45 CO 0.21 -1.00 1.48 -2.30 -0.92 0.00 0.00 175.35 172.82 2pov n PRO 46 N -3.01 2.62 -2.53 -1.68 -0.02 -1.26 -1.27 135.00 127.85 2pov n PRO 46 Ca 0.07 0.92 -0.41 0.00 -2.02 0.00 0.00 63.50 62.06 2pov n PRO 46 Cb 0.56 -2.64 -0.04 0.00 -0.02 0.00 0.00 33.50 31.35 2pov n PRO 46 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2pov s LEU 47 N -1.77 4.51 -0.22 2.45 2.96 -1.26 -1.73 118.68 123.61 2pov s LEU 47 Ca 0.55 2.10 0.02 0.00 -0.22 0.00 0.00 54.13 56.58 2pov s LEU 47 Cb -0.49 -3.61 0.05 0.00 0.50 0.00 0.00 46.19 42.64 2pov s LEU 47 CO 0.62 -0.18 -0.11 -0.55 -1.32 0.00 0.00 176.35 174.81 2pov s SER 48 N -0.31 3.83 -0.31 3.68 0.15 0.11 -4.87 113.70 115.98 2pov s SER 48 Ca 0.48 -1.09 -0.03 0.00 0.70 0.00 0.00 55.95 56.00 2pov s SER 48 Cb -0.29 -1.39 0.04 0.00 -1.71 0.00 0.00 66.02 62.67 2pov s SER 48 CO 0.36 -0.15 0.03 -0.69 1.20 0.00 0.00 173.24 173.98 2pov s VAL 49 N 1.26 3.25 -0.55 4.45 1.01 -1.26 -1.26 120.40 127.30 2pov s VAL 49 Ca -0.04 -1.25 0.01 0.00 0.00 0.00 0.00 61.98 60.70 2pov s VAL 49 Cb -0.18 -2.83 0.14 0.00 0.00 0.00 0.00 36.38 33.51 2pov s VAL 49 CO -0.07 -0.09 0.32 -0.44 0.00 0.00 0.00 175.10 174.81 2pov s SER 50 N 1.31 4.72 0.00 3.32 0.01 -0.25 -4.91 113.70 117.90 2pov s SER 50 Ca -0.03 -2.89 0.17 0.00 1.31 0.00 0.00 55.95 54.50 2pov s SER 50 Cb -0.19 -1.73 0.38 0.00 0.21 0.00 0.00 66.02 64.69 2pov s SER 50 CO -0.00 -0.30 1.30 -1.22 0.41 0.00 0.00 173.24 173.43 2pov n TYR 51 N 3.34 0.51 -0.33 2.43 0.53 -1.26 -1.49 117.16 120.90 2pov n TYR 51 Ca 0.06 -0.36 0.14 0.00 -1.02 0.00 0.00 57.90 56.73 2pov n TYR 51 Cb 0.35 -0.01 0.37 0.00 -1.03 0.00 0.00 39.34 39.02 2pov n TYR 51 CO 0.00 0.00 0.00 0.38 -1.02 0.00 0.00 176.86 176.22 2pov h ASP 52 N 3.24 0.70 -0.66 7.72 2.03 -1.99 -1.56 116.42 125.89 2pov h ASP 52 Ca 0.00 0.08 0.00 0.00 -0.73 0.00 0.00 57.03 56.38 2pov h ASP 52 Cb 0.82 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 39.28 2pov h ASP 52 CO 0.00 0.26 0.00 0.00 -1.03 0.00 0.00 179.24 178.47 2pov n GLN 53 N -4.69 3.46 -1.72 4.15 1.13 -1.26 -4.99 117.38 113.45 2pov n GLN 53 Ca 0.22 -2.82 -0.43 0.00 -1.94 0.00 0.00 57.00 52.03 2pov n GLN 53 Cb 0.60 -1.80 -0.02 0.00 0.11 0.00 0.00 30.24 29.14 2pov n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2pov n ALA 54 N 1.24 1.87 -3.80 -1.58 0.00 -0.59 -4.60 120.51 113.05 2pov n ALA 54 Ca 0.25 0.38 -0.29 0.00 0.00 0.00 0.00 53.44 53.79 2pov n ALA 54 Cb 0.81 -2.37 -0.16 0.00 0.00 0.00 0.00 19.45 17.74 2pov n ALA 54 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2pov s THR 55 N -0.24 0.92 0.51 0.00 -1.32 -1.26 -4.89 115.64 109.37 2pov s THR 55 Ca 0.64 -0.98 -0.18 0.00 -1.21 0.00 0.00 61.69 59.96 2pov s THR 55 Cb -0.56 -1.43 -0.08 0.00 -1.51 0.00 0.00 72.50 68.93 2pov s THR 55 CO 0.52 -0.30 1.00 -0.94 -2.21 0.00 0.00 174.62 172.69 2pov s SER 56 N 1.65 6.44 -0.12 8.08 1.04 -1.26 -0.57 113.70 128.96 2pov s SER 56 Ca 0.00 1.71 -0.04 0.00 0.48 0.00 0.00 55.95 58.10 2pov s SER 56 Cb -0.18 -2.53 -0.06 0.00 0.10 0.00 0.00 66.02 63.36 2pov s SER 56 CO -0.12 -0.71 -0.14 0.18 0.98 0.00 0.00 173.24 173.43 2pov n LEU 57 N -1.42 1.47 -3.90 2.42 4.77 0.77 -4.17 117.00 116.94 2pov n LEU 57 Ca 0.08 0.09 -0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2pov n LEU 57 Cb 0.53 -0.36 0.01 0.00 -2.33 0.00 0.00 43.42 41.27 2pov n LEU 57 CO 0.44 0.38 0.95 0.00 -1.33 0.00 0.00 177.39 177.82 2pov s ARG 58 N -2.22 0.86 -0.02 3.23 1.70 -1.17 -1.75 118.95 119.57 2pov s ARG 58 Ca -0.16 -0.55 0.06 0.00 -0.47 0.00 0.00 55.73 54.61 2pov s ARG 58 Cb 0.06 0.24 -0.01 0.00 -0.57 0.00 0.00 34.95 34.67 2pov s ARG 58 CO 0.22 -0.40 -0.21 -1.50 -1.08 0.00 0.00 175.30 172.33 2pov s ILE 59 N -2.16 1.66 -0.01 4.99 2.07 -0.48 -0.73 121.20 126.53 2pov s ILE 59 Ca 0.24 -0.89 0.03 0.00 -1.41 0.00 0.00 60.65 58.62 2pov s ILE 59 Cb -0.01 -1.38 -0.00 0.00 0.13 0.00 0.00 42.46 41.20 2pov s ILE 59 CO 0.02 0.47 -0.09 -0.22 -1.91 0.00 0.00 174.94 173.21 2pov s LEU 60 N -0.44 1.96 -0.46 8.50 2.96 -0.15 -1.27 118.68 129.78 2pov s LEU 60 Ca 0.07 -0.16 -0.19 0.00 -0.22 0.00 0.00 54.13 53.63 2pov s LEU 60 Cb -0.09 -0.47 0.04 0.00 0.50 0.00 0.00 46.19 46.17 2pov s LEU 60 CO -0.00 0.10 0.56 0.21 -1.32 0.00 0.00 176.35 175.90 2pov s ASN 61 N -0.11 6.24 -0.01 3.68 3.84 -0.08 -0.56 114.94 127.94 2pov s ASN 61 Ca 0.02 -0.70 0.13 0.00 0.21 0.00 0.00 52.86 52.52 2pov s ASN 61 Cb -0.05 -2.27 0.40 0.00 -0.55 0.00 0.00 41.25 38.78 2pov s ASN 61 CO -0.00 -0.76 1.32 -0.46 -2.79 0.00 0.00 177.10 174.41 2pov n ASN 62 N 5.99 2.46 0.00 -4.21 0.23 -0.74 -0.86 115.26 118.13 2pov n ASN 62 Ca -0.06 -2.04 0.00 0.00 -0.53 0.00 0.00 54.58 51.95 2pov n ASN 62 Cb 0.47 -0.32 0.00 0.00 -2.08 0.00 0.00 39.78 37.85 2pov n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2pov n GLY 63 N 1.14 2.77 0.00 4.83 0.00 -1.26 -4.77 105.19 107.90 2pov n GLY 63 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2pov n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2pov n HIS 64 N -2.00 0.00 -2.53 1.61 1.44 -1.26 -4.62 115.22 107.85 2pov n HIS 64 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2pov n HIS 64 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 2pov n HIS 64 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2pov n ALA 65 N -0.75 0.00 -2.81 1.59 0.00 -1.26 -4.80 120.51 112.47 2pov n ALA 65 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 2pov n ALA 65 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 2pov n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2pov s PHE 66 N -3.08 0.61 -0.14 0.00 -0.12 -1.26 -1.79 117.98 112.20 2pov s PHE 66 Ca 0.00 -0.12 -0.02 0.00 -0.05 0.00 0.00 56.93 56.74 2pov s PHE 66 Cb 0.00 -0.41 -0.02 0.00 -0.63 0.00 0.00 43.02 41.96 2pov s PHE 66 CO 0.00 -0.03 -0.07 -0.80 -0.05 0.00 0.00 175.22 174.28 2pov s ASN 67 N -0.06 4.57 -0.40 1.98 0.01 0.27 -4.28 114.94 117.03 2pov s ASN 67 Ca 0.01 -0.18 -0.16 0.00 -0.71 0.00 0.00 52.86 51.82 2pov s ASN 67 Cb -0.04 -1.71 0.01 0.00 0.41 0.00 0.00 41.25 39.93 2pov s ASN 67 CO -0.00 0.18 0.37 -0.69 -1.51 0.00 0.00 177.10 175.45 2pov s VAL 68 N 0.30 5.16 0.14 1.60 1.01 -0.09 -0.98 120.40 127.54 2pov s VAL 68 Ca -0.05 -0.34 -0.09 0.00 0.00 0.00 0.00 61.98 61.50 2pov s VAL 68 Cb -0.15 -3.95 -0.06 0.00 0.00 0.00 0.00 36.38 32.23 2pov s VAL 68 CO 0.04 -0.30 0.44 -1.61 0.00 0.00 0.00 175.10 173.67 2pov s GLU 69 N 1.97 3.75 0.23 2.72 2.02 0.09 -1.69 118.70 127.80 2pov s GLU 69 Ca 0.10 0.16 0.11 0.00 0.02 0.00 0.00 54.97 55.36 2pov s GLU 69 Cb -0.17 -2.87 -0.05 0.00 0.10 0.00 0.00 34.13 31.14 2pov s GLU 69 CO 0.12 0.47 -0.21 -0.06 0.02 0.00 0.00 175.26 175.60 2pov s PHE 70 N -1.57 2.22 -0.52 1.61 0.40 -0.23 -0.16 117.98 119.72 2pov s PHE 70 Ca 0.39 -0.37 -0.28 0.00 -0.60 0.00 0.00 56.93 56.07 2pov s PHE 70 Cb -0.13 -1.03 0.03 0.00 0.51 0.00 0.00 43.02 42.40 2pov s PHE 70 CO 0.21 0.58 1.12 0.34 0.70 0.00 0.00 175.22 178.16 2pov s ASP 71 N -3.09 6.52 -0.33 1.36 -1.08 0.27 -4.82 116.67 115.50 2pov s ASP 71 Ca 0.25 0.22 0.08 0.00 -0.52 0.00 0.00 52.55 52.58 2pov s ASP 71 Cb -0.06 -2.53 0.57 0.00 -1.46 0.00 0.00 42.92 39.44 2pov s ASP 71 CO 0.12 -1.31 1.62 -0.90 0.52 0.00 0.00 175.17 175.21 2pov n ASP 72 N 7.96 3.13 0.06 -0.34 3.85 -1.26 -4.51 116.55 125.43 2pov n ASP 72 Ca 0.09 -3.63 0.13 0.00 -0.71 0.00 0.00 54.79 50.67 2pov n ASP 72 Cb 0.49 -0.70 0.37 0.00 -1.35 0.00 0.00 41.12 39.93 2pov n ASP 72 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 2pov n SER 73 N -1.01 0.58 -4.36 -1.12 3.41 -1.26 -4.86 113.62 104.99 2pov n SER 73 Ca 0.40 0.33 -0.19 0.00 -0.26 0.00 0.00 58.87 59.16 2pov n SER 73 Cb 1.23 -0.34 -0.10 0.00 -0.26 0.00 0.00 64.21 64.74 2pov n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2pov s GLN 74 N -3.09 1.39 -1.14 4.33 -0.21 -1.26 -5.06 119.66 114.62 2pov s GLN 74 Ca 0.10 -1.66 -0.22 0.00 0.02 0.00 0.00 55.36 53.60 2pov s GLN 74 Cb 0.15 -1.01 -0.05 0.00 1.00 0.00 0.00 33.01 33.10 2pov s GLN 74 CO 0.63 0.08 1.88 0.34 -2.12 0.00 0.00 175.29 176.09 2pov s ASP 75 N -3.35 5.44 0.06 5.90 2.15 -1.26 -4.86 116.67 120.75 2pov s ASP 75 Ca 0.25 -1.60 -0.02 0.00 0.43 0.00 0.00 52.55 51.61 2pov s ASP 75 Cb 0.02 -2.58 -0.03 0.00 -0.30 0.00 0.00 42.92 40.03 2pov s ASP 75 CO 0.08 -2.61 0.00 -0.54 -0.17 0.00 0.00 175.17 171.94 2pov s LYS 76 N 6.11 0.65 -0.36 4.34 1.02 -1.26 -4.98 119.74 125.26 2pov s LYS 76 Ca 0.65 -1.19 -0.24 0.00 0.02 0.00 0.00 55.97 55.21 2pov s LYS 76 Cb -0.01 0.23 0.03 0.00 -0.52 0.00 0.00 37.83 37.56 2pov s LYS 76 CO 0.08 -0.14 0.49 0.00 -0.92 0.00 0.00 175.35 174.86 2pov n ALA 77 N 0.08 -2.55 -2.38 5.17 0.00 -1.22 -4.33 120.51 115.28 2pov n ALA 77 Ca -0.14 0.54 -0.31 0.00 0.00 0.00 0.00 53.44 53.53 2pov n ALA 77 Cb 0.61 -2.30 -0.14 0.00 0.00 0.00 0.00 19.45 17.62 2pov n ALA 77 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2pov s VAL 78 N -1.72 2.36 -0.12 0.00 1.01 -0.55 -0.81 120.40 120.56 2pov s VAL 78 Ca 0.26 -1.22 0.02 0.00 0.00 0.00 0.00 61.98 61.04 2pov s VAL 78 Cb -0.04 -1.92 -0.00 0.00 0.00 0.00 0.00 36.38 34.42 2pov s VAL 78 CO 0.71 0.43 -0.19 -0.22 0.00 0.00 0.00 175.10 175.82 2pov s LEU 79 N -1.10 2.35 0.00 3.92 2.96 0.59 -1.09 118.68 126.32 2pov s LEU 79 Ca 0.12 -0.47 -0.08 0.00 -0.22 0.00 0.00 54.13 53.47 2pov s LEU 79 Cb -0.10 -1.50 0.03 0.00 0.50 0.00 0.00 46.19 45.12 2pov s LEU 79 CO 0.02 0.15 0.61 2.29 -1.32 0.00 0.00 176.35 178.10 2pov n LYS 80 N 3.63 0.88 0.00 1.98 2.85 -0.38 -1.32 118.16 125.79 2pov n LYS 80 Ca -0.19 -2.31 0.00 0.00 -1.05 0.00 0.00 58.31 54.76 2pov n LYS 80 Cb 0.53 2.55 0.00 0.00 -0.65 0.00 0.00 35.03 37.46 2pov n LYS 80 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2pov n GLY 81 N -0.52 -1.62 7.00 2.58 0.00 -1.26 0.06 105.19 111.44 2pov n GLY 81 Ca -0.04 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.65 2pov n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pov n GLY 82 N 0.00 3.39 0.34 -0.02 0.00 -0.39 -1.30 105.19 107.20 2pov n GLY 82 Ca 0.00 -0.15 0.14 0.00 0.00 0.00 0.00 46.02 46.01 2pov n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2pov n PRO 83 N 13.88 1.34 -3.04 1.61 -0.04 -1.26 -2.80 135.00 144.70 2pov n PRO 83 Ca 0.00 -0.67 -0.36 0.00 -0.04 0.00 0.00 63.50 62.42 2pov n PRO 83 Cb 0.00 -1.49 -0.06 0.00 -0.04 0.00 0.00 33.50 31.91 2pov n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2pov s LEU 84 N -2.12 4.36 -0.19 1.53 1.43 -0.42 -5.06 118.68 118.20 2pov s LEU 84 Ca 0.36 1.51 -0.03 0.00 -1.03 0.00 0.00 54.13 54.94 2pov s LEU 84 Cb 0.21 -3.64 -0.02 0.00 0.03 0.00 0.00 46.19 42.77 2pov s LEU 84 CO 0.38 0.03 -0.05 -1.81 0.23 0.00 0.00 176.35 175.13 2pov s ASP 85 N -1.61 4.43 0.00 2.29 -0.00 -1.26 -4.20 116.67 116.32 2pov s ASP 85 Ca 0.44 -0.31 0.00 0.00 -0.00 0.00 0.00 52.55 52.68 2pov s ASP 85 Cb -0.17 -1.74 0.00 0.00 -0.00 0.00 0.00 42.92 41.00 2pov s ASP 85 CO 0.22 0.05 0.00 0.61 -0.00 0.00 0.00 175.17 176.05 2pov n GLY 86 N 4.33 -1.55 3.20 0.21 0.00 -1.26 -4.93 105.19 105.19 2pov n GLY 86 Ca -0.18 -1.58 -0.27 0.00 0.00 0.00 0.00 46.02 43.99 2pov n GLY 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2pov s THR 87 N 0.00 1.61 -0.11 2.61 -4.23 -1.26 -4.48 115.64 109.77 2pov s THR 87 Ca 0.00 -0.86 0.01 0.00 -1.18 0.00 0.00 61.69 59.66 2pov s THR 87 Cb 0.00 -1.35 -0.01 0.00 1.34 0.00 0.00 72.50 72.48 2pov s THR 87 CO 0.00 0.46 -0.15 -0.31 -0.54 0.00 0.00 174.62 174.08 2pov s TYR 88 N -0.37 2.75 -0.17 3.99 2.02 -0.43 -1.33 117.35 123.81 2pov s TYR 88 Ca 0.05 -0.61 -0.09 0.00 -0.37 0.00 0.00 57.07 56.05 2pov s TYR 88 Cb -0.09 -1.79 -0.05 0.00 -0.40 0.00 0.00 41.96 39.64 2pov s TYR 88 CO 0.00 -0.17 0.12 0.50 -1.57 0.00 0.00 175.55 174.43 2pov s ARG 89 N 0.16 3.94 0.16 -0.62 3.52 0.18 -0.30 118.95 125.99 2pov s ARG 89 Ca -0.08 -0.22 -0.31 0.00 -0.13 0.00 0.00 55.73 54.98 2pov s ARG 89 Cb -0.15 -3.31 -0.10 0.00 -1.56 0.00 0.00 34.95 29.83 2pov s ARG 89 CO 0.05 0.42 1.52 -1.17 -0.81 0.00 0.00 175.30 175.32 2pov s LEU 90 N -0.00 4.37 -0.04 -0.88 2.96 0.01 -1.20 118.68 123.90 2pov s LEU 90 Ca 0.09 2.56 0.02 0.00 -0.22 0.00 0.00 54.13 56.58 2pov s LEU 90 Cb -0.11 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 2pov s LEU 90 CO -0.00 -0.78 -0.01 0.00 -1.32 0.00 0.00 176.35 174.24 2pov n ILE 91 N 3.88 0.23 -3.62 6.68 3.06 -0.20 -4.56 119.36 124.83 2pov n ILE 91 Ca 0.13 -0.12 -0.03 0.00 -2.50 0.00 0.00 62.75 60.23 2pov n ILE 91 Cb 0.39 -0.82 -0.01 0.00 0.54 0.00 0.00 39.64 39.74 2pov n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2pov s GLN 92 N -2.08 0.63 0.04 9.51 1.03 -1.21 -1.07 119.66 126.50 2pov s GLN 92 Ca -0.03 -0.30 -0.00 0.00 0.04 0.00 0.00 55.36 55.06 2pov s GLN 92 Cb 0.01 0.25 -0.03 0.00 0.03 0.00 0.00 33.01 33.27 2pov s GLN 92 CO 0.12 -0.29 -0.03 -0.59 -2.54 0.00 0.00 175.29 171.96 2pov s PHE 93 N -2.75 0.40 0.35 9.60 -0.12 -0.68 -0.51 117.98 124.26 2pov s PHE 93 Ca 0.11 -0.75 -0.13 0.00 -0.05 0.00 0.00 56.93 56.10 2pov s PHE 93 Cb 0.01 -0.29 0.03 0.00 -0.63 0.00 0.00 43.02 42.14 2pov s PHE 93 CO -0.04 -0.26 0.67 -3.38 -0.05 0.00 0.00 175.22 172.16 2pov s HIS 94 N -2.50 0.34 0.29 3.49 -3.43 -0.69 -0.92 115.29 111.87 2pov s HIS 94 Ca -0.06 -0.84 0.04 0.00 -0.80 0.00 0.00 55.06 53.40 2pov s HIS 94 Cb -0.02 0.53 -0.06 0.00 -1.43 0.00 0.00 32.58 31.59 2pov s HIS 94 CO -0.05 -1.36 0.02 -0.06 -2.00 0.00 0.00 174.74 171.30 2pov s PHE 95 N -2.89 1.82 -0.04 0.38 0.40 -1.26 -0.74 117.98 115.66 2pov s PHE 95 Ca 0.19 -0.91 0.02 0.00 -0.60 0.00 0.00 56.93 55.62 2pov s PHE 95 Cb -0.04 -1.12 0.01 0.00 0.51 0.00 0.00 43.02 42.38 2pov s PHE 95 CO 0.13 0.02 -0.07 -1.01 0.70 0.00 0.00 175.22 174.99 2pov s HIS 96 N -3.31 0.84 0.22 0.36 3.76 -0.44 -4.75 115.29 111.97 2pov s HIS 96 Ca 0.33 -0.23 -0.07 0.00 -0.15 0.00 0.00 55.06 54.94 2pov s HIS 96 Cb 0.07 -0.66 -0.02 0.00 1.11 0.00 0.00 32.58 33.07 2pov s HIS 96 CO 0.13 -0.15 0.31 1.67 -0.85 0.00 0.00 174.74 175.85 2pov s TRP 97 N 0.56 0.73 0.51 1.40 -2.14 -1.22 -0.78 118.94 118.00 2pov s TRP 97 Ca -0.08 -1.03 0.06 0.00 2.66 0.00 0.00 56.10 57.71 2pov s TRP 97 Cb -0.12 -0.16 0.06 0.00 -3.10 0.00 0.00 33.47 30.15 2pov s TRP 97 CO 0.01 -0.83 0.49 0.41 -2.66 0.00 0.00 176.95 174.37 2pov n GLY 98 N -0.33 2.51 0.00 3.67 0.00 -1.16 -0.85 105.19 109.03 2pov n GLY 98 Ca -0.00 -2.27 0.12 0.00 0.00 0.00 0.00 46.02 43.87 2pov n GLY 98 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2pov n SER 99 N -2.02 0.55 -3.99 1.61 3.41 -1.26 -4.24 113.62 107.67 2pov n SER 99 Ca 0.04 -0.32 -0.09 0.00 -0.26 0.00 0.00 58.87 58.25 2pov n SER 99 Cb 0.56 0.32 -0.10 0.00 -0.26 0.00 0.00 64.21 64.73 2pov n SER 99 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2pov s LEU 100 N -3.02 2.12 0.53 1.04 1.43 -1.26 -5.05 118.68 114.48 2pov s LEU 100 Ca 0.11 -0.67 0.25 0.00 -1.03 0.00 0.00 54.13 52.78 2pov s LEU 100 Cb 0.17 0.36 1.48 0.00 0.03 0.00 0.00 46.19 48.23 2pov s LEU 100 CO 0.72 -0.49 2.13 0.44 0.23 0.00 0.00 176.35 179.37 2pov h ASP 101 N 3.73 0.00 0.05 2.29 3.45 -1.91 -2.75 116.42 121.28 2pov h ASP 101 Ca -0.33 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.13 2pov h ASP 101 Cb 1.18 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.95 2pov h ASP 101 CO 0.53 0.08 0.00 0.61 -1.57 0.00 0.00 179.24 178.89 2pov n GLY 102 N -1.03 -0.68 3.53 2.75 0.00 -1.26 -3.50 105.19 105.00 2pov n GLY 102 Ca -0.02 -0.12 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 2pov n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2pov s GLN 103 N -2.07 1.40 0.00 1.61 -2.07 -1.04 -4.70 119.66 112.79 2pov s GLN 103 Ca 0.29 -0.99 0.00 0.00 -1.82 0.00 0.00 55.36 52.84 2pov s GLN 103 Cb 0.14 0.49 0.00 0.00 -1.09 0.00 0.00 33.01 32.55 2pov s GLN 103 CO 0.25 -0.59 0.00 0.41 -1.32 0.00 0.00 175.29 174.04 2pov n GLY 104 N -0.34 2.07 3.84 2.60 0.00 -1.07 -3.01 105.19 109.28 2pov n GLY 104 Ca -0.08 -0.17 -0.31 0.00 0.00 0.00 0.00 46.02 45.46 2pov n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2pov s SER 105 N 0.00 5.91 -0.21 1.61 1.04 -0.64 -3.37 113.70 118.04 2pov s SER 105 Ca 0.00 1.58 -0.17 0.00 0.48 0.00 0.00 55.95 57.85 2pov s SER 105 Cb 0.00 -2.50 -0.12 0.00 0.10 0.00 0.00 66.02 63.50 2pov s SER 105 CO 0.00 -1.08 -0.09 -0.62 0.98 0.00 0.00 173.24 172.42 2pov n GLU 106 N -2.58 0.54 -2.43 4.02 1.02 -1.26 -4.83 120.64 115.13 2pov n GLU 106 Ca 0.07 0.44 -0.33 0.00 -0.02 0.00 0.00 57.16 57.32 2pov n GLU 106 Cb 0.54 -1.63 -0.03 0.00 -0.02 0.00 0.00 31.44 30.30 2pov n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2pov s HIS 107 N -2.45 3.19 0.15 -0.32 3.76 -1.26 -4.20 115.29 114.16 2pov s HIS 107 Ca -0.29 1.54 0.07 0.00 -0.15 0.00 0.00 55.06 56.22 2pov s HIS 107 Cb 0.07 -2.93 -0.04 0.00 1.11 0.00 0.00 32.58 30.79 2pov s HIS 107 CO 0.47 -0.63 -0.14 0.95 -0.85 0.00 0.00 174.74 174.54 2pov s THR 108 N -2.32 1.48 -0.26 1.30 -4.23 -1.18 -4.69 115.64 105.74 2pov s THR 108 Ca 0.63 -1.92 0.02 0.00 -1.18 0.00 0.00 61.69 59.24 2pov s THR 108 Cb -0.13 -1.75 0.05 0.00 1.34 0.00 0.00 72.50 72.01 2pov s THR 108 CO 0.26 -0.49 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.05 2pov s VAL 109 N -2.50 2.26 -1.48 2.29 1.01 -0.77 0.11 120.40 121.33 2pov s VAL 109 Ca 0.14 -1.54 -0.11 0.00 0.00 0.00 0.00 61.98 60.48 2pov s VAL 109 Cb -0.03 -2.30 0.06 0.00 0.00 0.00 0.00 36.38 34.12 2pov s VAL 109 CO 0.04 0.02 0.95 0.47 0.00 0.00 0.00 175.10 176.57 2pov n ASP 110 N 4.47 -4.23 0.00 3.32 10.43 -0.09 -0.52 116.55 129.93 2pov n ASP 110 Ca -0.15 -0.77 0.00 0.00 2.57 0.00 0.00 54.79 56.45 2pov n ASP 110 Cb 0.43 -4.01 0.00 0.00 1.84 0.00 0.00 41.12 39.38 2pov n ASP 110 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 2pov n LYS 111 N -4.64 0.00 -2.38 -1.24 4.76 -1.26 -4.99 118.16 108.40 2pov n LYS 111 Ca -0.03 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 54.99 2pov n LYS 111 Cb 0.56 -3.08 -0.03 0.00 -1.84 0.00 0.00 35.03 30.64 2pov n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2pov s LYS 112 N -0.30 4.42 -0.19 1.97 2.20 0.32 -4.98 119.74 123.18 2pov s LYS 112 Ca 0.00 1.81 -0.08 0.00 -0.36 0.00 0.00 55.97 57.34 2pov s LYS 112 Cb 0.00 -3.33 -0.04 0.00 -1.51 0.00 0.00 37.83 32.94 2pov s LYS 112 CO 0.00 -0.28 0.09 0.15 -0.36 0.00 0.00 175.35 174.95 2pov s LYS 113 N 1.06 4.05 0.57 4.03 1.02 -1.26 -1.85 119.74 127.36 2pov s LYS 113 Ca 0.60 -0.28 -0.01 0.00 0.02 0.00 0.00 55.97 56.29 2pov s LYS 113 Cb -0.31 -3.30 0.03 0.00 -0.52 0.00 0.00 37.83 33.74 2pov s LYS 113 CO 0.29 0.31 0.82 0.71 -0.92 0.00 0.00 175.35 176.56 2pov s TYR 114 N 0.31 2.93 0.38 3.18 1.51 -1.26 -4.60 117.35 119.81 2pov s TYR 114 Ca 0.06 0.15 0.22 0.00 -1.01 0.00 0.00 57.07 56.48 2pov s TYR 114 Cb -0.12 -2.80 1.17 0.00 -0.11 0.00 0.00 41.96 40.11 2pov s TYR 114 CO -0.01 -0.93 1.98 0.00 -1.11 0.00 0.00 175.55 175.49 2pov h ALA 115 N -0.05 1.35 -2.37 3.71 0.00 -1.41 -1.64 119.26 118.85 2pov h ALA 115 Ca -0.43 -0.18 0.18 0.00 0.00 0.00 0.00 54.91 54.48 2pov h ALA 115 Cb 1.29 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.99 2pov h ALA 115 CO 0.55 0.24 0.56 0.00 0.00 0.00 0.00 179.25 180.60 2pov s ALA 116 N -4.21 -1.66 -0.10 0.00 0.00 -1.10 -3.02 121.76 111.65 2pov s ALA 116 Ca -0.03 -0.08 -0.05 0.00 0.00 0.00 0.00 51.96 51.80 2pov s ALA 116 Cb 0.14 0.68 0.04 0.00 0.00 0.00 0.00 23.12 23.98 2pov s ALA 116 CO 0.64 -1.06 0.24 -2.00 0.00 0.00 0.00 175.76 173.58 2pov s GLU 117 N -2.63 0.20 -0.14 0.00 2.12 0.04 -1.46 118.70 116.83 2pov s GLU 117 Ca 0.17 0.51 -0.11 0.00 0.36 0.00 0.00 54.97 55.90 2pov s GLU 117 Cb -0.02 -0.11 -0.05 0.00 0.26 0.00 0.00 34.13 34.22 2pov s GLU 117 CO 0.03 -0.16 0.24 -1.17 -0.54 0.00 0.00 175.26 173.67 2pov s LEU 118 N 1.19 4.31 -0.19 2.70 2.96 0.83 -1.33 118.68 129.15 2pov s LEU 118 Ca -0.09 0.51 0.01 0.00 -0.22 0.00 0.00 54.13 54.34 2pov s LEU 118 Cb -0.10 -2.27 0.04 0.00 0.50 0.00 0.00 46.19 44.36 2pov s LEU 118 CO -0.08 0.22 -0.13 -1.00 -1.32 0.00 0.00 176.35 174.05 2pov s HIS 119 N -0.15 2.48 -0.36 5.38 3.76 0.08 -0.75 115.29 125.74 2pov s HIS 119 Ca 0.15 -1.57 -0.12 0.00 -0.15 0.00 0.00 55.06 53.37 2pov s HIS 119 Cb -0.13 -1.70 0.01 0.00 1.11 0.00 0.00 32.58 31.87 2pov s HIS 119 CO 0.04 -0.75 0.23 -0.51 -0.85 0.00 0.00 174.74 172.90 2pov s LEU 120 N 1.38 4.66 -0.14 0.89 1.43 -0.44 -1.70 118.68 124.77 2pov s LEU 120 Ca 0.01 -0.76 -0.17 0.00 -1.03 0.00 0.00 54.13 52.17 2pov s LEU 120 Cb -0.15 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 43.95 2pov s LEU 120 CO -0.09 -0.34 0.44 -0.69 0.23 0.00 0.00 176.35 175.91 2pov s VAL 121 N 1.63 5.20 0.03 -1.59 1.01 0.34 -1.19 120.40 125.83 2pov s VAL 121 Ca 0.04 0.87 0.04 0.00 0.00 0.00 0.00 61.98 62.94 2pov s VAL 121 Cb -0.18 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.39 2pov s VAL 121 CO 0.08 0.32 -0.13 -1.00 0.00 0.00 0.00 175.10 174.37 2pov s HIS 122 N 0.71 1.15 0.01 5.22 3.76 -0.42 -1.04 115.29 124.68 2pov s HIS 122 Ca 0.24 -0.34 0.05 0.00 -0.15 0.00 0.00 55.06 54.86 2pov s HIS 122 Cb -0.15 -0.69 -0.03 0.00 1.11 0.00 0.00 32.58 32.82 2pov s HIS 122 CO 0.09 0.02 -0.13 1.67 -0.85 0.00 0.00 174.74 175.54 2pov s TRP 123 N -0.80 2.70 -0.10 1.40 1.48 -0.34 -1.11 118.94 122.17 2pov s TRP 123 Ca 0.01 -0.16 -0.29 0.00 -1.06 0.00 0.00 56.10 54.60 2pov s TRP 123 Cb -0.07 -1.55 -0.05 0.00 -1.16 0.00 0.00 33.47 30.63 2pov s TRP 123 CO 0.01 0.28 1.81 1.21 -4.06 0.00 0.00 176.95 176.20 2pov s ASN 124 N -1.30 6.34 0.61 -2.66 3.84 0.80 -0.65 114.94 121.92 2pov s ASN 124 Ca 0.15 2.12 0.41 0.00 0.21 0.00 0.00 52.86 55.74 2pov s ASN 124 Cb -0.11 -2.53 2.17 0.00 -0.55 0.00 0.00 41.25 40.24 2pov s ASN 124 CO 0.05 -1.21 2.24 0.71 -2.79 0.00 0.00 177.10 176.10 2pov h THR 125 N 5.99 0.00 0.00 -5.21 1.35 -1.55 -1.95 112.91 111.54 2pov h THR 125 Ca -0.41 -0.04 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 2pov h THR 125 Cb 1.20 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 2pov h THR 125 CO 0.97 0.00 0.00 2.29 -0.25 0.00 0.00 175.52 178.53 2pov n LYS 127 N -2.96 0.04 -0.27 4.72 2.85 -1.26 -2.33 118.16 118.95 2pov n LYS 127 Ca -0.02 0.29 0.11 0.00 -1.05 0.00 0.00 58.31 57.64 2pov n LYS 127 Cb 0.08 -1.58 0.26 0.00 -0.65 0.00 0.00 35.03 33.14 2pov n LYS 127 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2pov n TYR 128 N -1.65 0.70 0.00 5.58 0.53 -0.73 -4.99 117.16 116.59 2pov n TYR 128 Ca 0.03 -0.37 0.00 0.00 -1.02 0.00 0.00 57.90 56.54 2pov n TYR 128 Cb 0.18 -0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.49 2pov n TYR 128 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2pov n GLY 129 N 1.50 1.47 3.79 2.72 0.00 -0.98 -4.46 105.19 109.22 2pov n GLY 129 Ca 0.21 -0.05 -0.09 0.00 0.00 0.00 0.00 46.02 46.09 2pov n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2pov s ASP 130 N 0.00 0.01 0.13 1.61 1.47 -1.26 -5.03 116.67 113.60 2pov s ASP 130 Ca 0.00 -1.04 -0.16 0.00 1.18 0.00 0.00 52.55 52.53 2pov s ASP 130 Cb 0.00 0.80 -0.01 0.00 -0.34 0.00 0.00 42.92 43.37 2pov s ASP 130 CO 0.00 -1.56 1.68 0.15 0.68 0.00 0.00 175.17 176.12 2pov h PHE 131 N 2.02 0.58 -0.97 2.11 3.04 -1.93 -1.86 116.94 119.92 2pov h PHE 131 Ca -0.29 -0.04 0.10 0.00 3.98 0.00 0.00 57.97 61.73 2pov h PHE 131 Cb 1.25 -0.17 -0.08 0.00 2.56 0.00 0.00 35.95 39.51 2pov h PHE 131 CO 1.12 0.52 0.61 0.78 -2.02 0.00 0.00 178.31 179.32 2pov h GLY 132 N 0.48 1.56 1.69 2.40 0.00 -1.97 -1.74 103.07 105.48 2pov h GLY 132 Ca 0.13 -0.42 -0.26 0.00 0.00 0.00 0.00 47.33 46.78 2pov h GLY 132 CO -0.01 0.19 -1.21 0.50 0.00 0.00 0.00 176.54 176.01 2pov h LYS 133 N 1.00 0.18 -0.87 4.80 1.79 -1.81 -3.34 116.57 118.32 2pov h LYS 133 Ca 0.47 -0.31 -0.00 0.00 -2.18 0.00 0.00 60.65 58.62 2pov h LYS 133 Cb 0.40 0.12 -0.04 0.00 -1.58 0.00 0.00 32.23 31.13 2pov h LYS 133 CO -0.24 1.13 0.52 0.00 -1.08 0.00 0.00 179.45 179.78 2pov h ALA 134 N 0.70 1.10 0.00 3.86 0.00 -0.56 -2.39 119.26 121.97 2pov h ALA 134 Ca -0.11 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2pov h ALA 134 Cb 1.92 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2pov h ALA 134 CO 0.18 0.56 0.00 1.33 0.00 0.00 0.00 179.25 181.32 2pov n VAL 135 N -4.42 1.11 0.55 0.00 0.24 -0.73 -1.31 118.33 113.78 2pov n VAL 135 Ca 0.09 0.28 0.10 0.00 -2.04 0.00 0.00 64.34 62.77 2pov n VAL 135 Cb 0.06 -1.11 0.26 0.00 -1.47 0.00 0.00 33.84 31.58 2pov n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2pov n GLN 136 N -1.42 2.17 -4.73 7.34 6.02 -0.90 -4.65 117.38 121.19 2pov n GLN 136 Ca 0.03 -1.79 -0.30 0.00 -0.01 0.00 0.00 57.00 54.93 2pov n GLN 136 Cb 0.10 -1.43 -0.14 0.00 1.02 0.00 0.00 30.24 29.80 2pov n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2pov s GLN 137 N -1.47 1.77 0.53 -1.09 -1.52 -0.43 -5.03 119.66 112.42 2pov s GLN 137 Ca 0.35 -1.14 0.20 0.00 -1.95 0.00 0.00 55.36 52.83 2pov s GLN 137 Cb 0.19 -2.01 1.34 0.00 -0.22 0.00 0.00 33.01 32.31 2pov s GLN 137 CO 0.26 0.50 2.09 -1.35 -0.25 0.00 0.00 175.29 176.55 2pov h PRO 138 N 4.52 0.00 -0.47 2.91 0.11 -1.85 -2.15 132.00 135.07 2pov h PRO 138 Ca -0.48 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 65.29 2pov h PRO 138 Cb 1.15 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 31.98 2pov h PRO 138 CO 0.44 0.00 -0.71 -0.40 -0.21 0.00 0.00 178.00 177.11 2pov n ASP 139 N -4.45 3.69 0.09 -2.05 3.85 -1.26 -4.16 116.55 112.26 2pov n ASP 139 Ca 0.02 -3.76 -0.07 0.00 -0.71 0.00 0.00 54.79 50.27 2pov n ASP 139 Cb 0.30 -0.41 -0.01 0.00 -1.35 0.00 0.00 41.12 39.65 2pov n ASP 139 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 2pov h GLY 140 N 1.76 0.12 -2.81 6.12 0.00 -1.16 -3.43 103.07 103.66 2pov h GLY 140 Ca 0.22 -0.22 -0.46 0.00 0.00 0.00 0.00 47.33 46.88 2pov h GLY 140 CO 0.47 0.19 -0.74 1.08 0.00 0.00 0.00 176.54 177.54 2pov s LEU 141 N -7.25 2.52 -0.07 3.11 1.43 0.33 -0.14 118.68 118.60 2pov s LEU 141 Ca -0.01 -0.97 -0.01 0.00 -1.03 0.00 0.00 54.13 52.10 2pov s LEU 141 Cb 0.10 -0.68 0.03 0.00 0.03 0.00 0.00 46.19 45.68 2pov s LEU 141 CO 0.81 -0.15 0.01 0.00 0.23 0.00 0.00 176.35 177.26 2pov s ALA 142 N -2.73 0.65 -0.16 4.21 0.00 -0.26 -0.84 121.76 122.62 2pov s ALA 142 Ca 0.20 -0.10 -0.01 0.00 0.00 0.00 0.00 51.96 52.04 2pov s ALA 142 Cb -0.02 -0.74 -0.01 0.00 0.00 0.00 0.00 23.12 22.35 2pov s ALA 142 CO 0.06 -0.49 -0.11 0.08 0.00 0.00 0.00 175.76 175.30 2pov s VAL 143 N 2.00 3.06 -0.33 0.00 1.01 -0.92 -1.30 120.40 123.92 2pov s VAL 143 Ca 0.05 -0.64 -0.18 0.00 0.00 0.00 0.00 61.98 61.22 2pov s VAL 143 Cb -0.12 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 33.93 2pov s VAL 143 CO -0.05 0.50 0.50 -0.22 0.00 0.00 0.00 175.10 175.82 2pov s LEU 144 N 0.74 4.30 -0.15 3.92 2.96 -0.34 -1.61 118.68 128.51 2pov s LEU 144 Ca -0.05 0.05 -0.07 0.00 -0.22 0.00 0.00 54.13 53.84 2pov s LEU 144 Cb -0.15 -2.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.92 2pov s LEU 144 CO 0.01 -0.43 0.09 -0.83 -1.32 0.00 0.00 176.35 173.87 2pov s GLY 145 N 1.73 2.00 -0.06 7.98 0.00 0.58 -1.33 107.32 118.22 2pov s GLY 145 Ca 0.18 -0.71 0.01 0.00 0.00 0.00 0.00 44.72 44.20 2pov s GLY 145 CO 0.13 -0.19 -0.06 -0.42 0.00 0.00 0.00 173.10 172.56 2pov s ILE 146 N -0.31 0.68 0.41 0.90 1.01 0.07 -0.92 121.20 123.05 2pov s ILE 146 Ca 0.09 -0.17 -0.22 0.00 0.00 0.00 0.00 60.65 60.35 2pov s ILE 146 Cb -0.12 -0.71 -0.10 0.00 0.01 0.00 0.00 42.46 41.54 2pov s ILE 146 CO 0.01 0.27 0.97 -0.36 0.00 0.00 0.00 174.94 175.84 2pov s PHE 147 N 1.16 3.35 -0.11 3.97 0.08 -1.26 -0.12 117.98 125.04 2pov s PHE 147 Ca -0.07 1.65 0.03 0.00 0.12 0.00 0.00 56.93 58.67 2pov s PHE 147 Cb -0.14 -2.93 0.00 0.00 -0.57 0.00 0.00 43.02 39.38 2pov s PHE 147 CO -0.01 -0.20 -0.23 -0.51 -0.10 0.00 0.00 175.22 174.17 2pov s LEU 148 N -2.90 2.07 0.19 -0.37 1.02 -0.54 -0.48 118.68 117.68 2pov s LEU 148 Ca 0.60 -0.56 0.11 0.00 0.02 0.00 0.00 54.13 54.30 2pov s LEU 148 Cb -0.14 -1.39 -0.04 0.00 0.02 0.00 0.00 46.19 44.64 2pov s LEU 148 CO 0.18 0.13 -0.24 -1.59 0.02 0.00 0.00 176.35 174.85 2pov s LYS 149 N 0.50 1.52 -0.18 1.70 -2.85 -0.57 -1.86 119.74 117.99 2pov s LYS 149 Ca -0.15 -1.53 -0.22 0.00 -1.00 0.00 0.00 55.97 53.07 2pov s LYS 149 Cb -0.17 -1.84 -0.02 0.00 -2.06 0.00 0.00 37.83 33.74 2pov s LYS 149 CO 0.06 0.40 0.67 0.08 0.10 0.00 0.00 175.35 176.65 2pov s VAL 150 N -1.69 5.00 0.00 1.79 1.01 -1.26 -1.01 120.40 124.24 2pov s VAL 150 Ca 0.21 1.29 0.00 0.00 0.00 0.00 0.00 61.98 63.48 2pov s VAL 150 Cb -0.08 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.32 2pov s VAL 150 CO 0.10 0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.93 2pov n GLY 151 N 3.64 -0.00 3.78 4.51 0.00 0.48 -4.90 105.19 112.70 2pov n GLY 151 Ca -0.00 0.55 -0.34 0.00 0.00 0.00 0.00 46.02 46.22 2pov n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2pov s SER 152 N 2.00 5.71 0.62 1.61 0.01 -1.26 -4.00 113.70 118.38 2pov s SER 152 Ca 0.00 2.06 -0.16 0.00 1.31 0.00 0.00 55.95 59.16 2pov s SER 152 Cb 0.00 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.64 2pov s SER 152 CO 0.00 -1.22 1.09 0.00 0.41 0.00 0.00 173.24 173.51 2pov s ALA 153 N -2.00 2.62 -0.42 1.44 0.00 -1.26 -2.05 121.76 120.08 2pov s ALA 153 Ca 0.70 0.51 -0.08 0.00 0.00 0.00 0.00 51.96 53.08 2pov s ALA 153 Cb -0.21 -3.28 0.09 0.00 0.00 0.00 0.00 23.12 19.72 2pov s ALA 153 CO 0.30 -1.00 0.26 0.21 0.00 0.00 0.00 175.76 175.53 2pov s LYS 154 N -3.99 2.49 0.24 0.00 2.47 -1.21 -4.77 119.74 114.97 2pov s LYS 154 Ca 0.66 -1.57 -0.04 0.00 -1.56 0.00 0.00 55.97 53.46 2pov s LYS 154 Cb -0.19 -3.76 0.45 0.00 -1.46 0.00 0.00 37.83 32.87 2pov s LYS 154 CO 0.38 -1.01 1.74 -1.35 0.16 0.00 0.00 175.35 175.27 2pov h PRO 155 N 8.35 0.46 0.00 4.03 0.11 -1.91 -1.30 132.00 141.74 2pov h PRO 155 Ca -0.21 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2pov h PRO 155 Cb 1.07 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.08 2pov h PRO 155 CO 0.76 0.30 0.00 0.41 -0.21 0.00 0.00 178.00 179.26 2pov n GLY 156 N -1.32 -0.79 0.05 -0.55 0.00 -1.26 -1.97 105.19 99.36 2pov n GLY 156 Ca 0.14 0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.30 2pov n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2pov n LEU 157 N -1.69 0.44 -0.30 0.99 7.94 -0.49 -4.49 117.00 119.40 2pov n LEU 157 Ca 0.01 0.09 0.05 0.00 -1.11 0.00 0.00 56.01 55.06 2pov n LEU 157 Cb 0.08 -0.04 0.20 0.00 0.53 0.00 0.00 43.42 44.19 2pov n LEU 157 CO 0.08 -0.05 1.13 -0.61 -1.11 0.00 0.00 177.39 176.82 2pov h GLN 158 N 0.00 0.70 -0.32 1.96 5.75 -1.39 -0.44 115.11 121.36 2pov h GLN 158 Ca 0.00 -0.04 0.03 0.00 -0.15 0.00 0.00 58.65 58.49 2pov h GLN 158 Cb 0.93 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 29.31 2pov h GLN 158 CO 0.00 0.46 0.21 0.87 -2.65 0.00 0.00 178.83 177.72 2pov h LYS 159 N 0.72 0.31 -0.10 1.69 1.57 -1.79 0.11 116.57 119.08 2pov h LYS 159 Ca 0.44 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 59.11 2pov h LYS 159 Cb 0.52 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2pov h LYS 159 CO -0.31 0.20 -0.28 0.28 -0.57 0.00 0.00 179.45 178.77 2pov h VAL 160 N 0.32 1.39 -0.71 0.50 2.07 -1.40 -3.16 116.25 115.26 2pov h VAL 160 Ca 0.13 -1.60 0.02 0.00 0.82 0.00 0.00 66.70 66.06 2pov h VAL 160 Cb 0.13 2.16 -0.04 0.00 -1.52 0.00 0.00 31.29 32.02 2pov h VAL 160 CO -0.03 0.47 0.46 0.58 0.02 0.00 0.00 177.57 179.07 2pov h VAL 161 N -0.07 1.14 0.00 2.57 2.07 -0.35 -2.79 116.25 118.82 2pov h VAL 161 Ca -0.01 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 2pov h VAL 161 Cb 0.89 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 2pov h VAL 161 CO 0.06 0.17 -0.03 0.44 0.02 0.00 0.00 177.57 178.22 2pov h ASP 162 N 0.92 0.00 0.68 0.57 3.32 -0.87 -3.01 116.42 118.03 2pov h ASP 162 Ca 0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.32 2pov h ASP 162 Cb -0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 2pov h ASP 162 CO -0.08 0.03 -0.65 0.55 -1.72 0.00 0.00 179.24 177.38 2pov n VAL 163 N -3.15 0.21 0.22 -1.35 3.14 -1.06 -4.15 118.33 112.18 2pov n VAL 163 Ca 0.00 -0.18 0.13 0.00 -2.96 0.00 0.00 64.34 61.33 2pov n VAL 163 Cb 0.30 0.04 0.74 0.00 -1.06 0.00 0.00 33.84 33.86 2pov n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2pov h LEU 164 N 0.00 0.00 -2.04 6.55 3.38 -1.47 -1.27 115.31 120.45 2pov h LEU 164 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2pov h LEU 164 Cb 0.66 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 2pov h LEU 164 CO 0.00 0.00 -0.05 -0.78 0.09 0.00 0.00 178.44 177.70 2pov h ASP 165 N 0.00 0.00 0.53 -0.43 1.82 -1.79 -1.83 116.42 114.73 2pov h ASP 165 Ca 0.06 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.70 2pov h ASP 165 Cb 0.25 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.26 2pov h ASP 165 CO -0.00 0.05 -0.20 -1.54 -1.61 0.00 0.00 179.24 175.94 2pov n SER 166 N -4.24 0.41 -2.58 2.28 3.41 -0.48 -3.96 113.62 108.47 2pov n SER 166 Ca -0.03 -0.27 -0.12 0.00 -0.26 0.00 0.00 58.87 58.20 2pov n SER 166 Cb 0.13 -0.07 0.03 0.00 -0.26 0.00 0.00 64.21 64.04 2pov n SER 166 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2pov n ILE 167 N -1.20 1.58 -0.27 -1.33 -5.35 -0.70 -4.74 119.36 107.34 2pov n ILE 167 Ca 0.10 -3.52 -0.02 0.00 -0.27 0.00 0.00 62.75 59.04 2pov n ILE 167 Cb 0.31 0.25 0.10 0.00 -1.74 0.00 0.00 39.64 38.56 2pov n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2pov h LYS 168 N 2.66 0.88 -6.20 6.28 3.64 -1.64 -3.43 116.57 118.76 2pov h LYS 168 Ca 0.03 -0.05 -0.50 0.00 -1.27 0.00 0.00 60.65 58.86 2pov h LYS 168 Cb 1.23 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 32.81 2pov h LYS 168 CO 0.49 0.59 -0.51 0.95 -2.27 0.00 0.00 179.45 178.70 2pov s THR 169 N -6.10 4.57 0.13 1.00 -4.23 -1.26 -0.01 115.64 109.74 2pov s THR 169 Ca -0.13 -1.34 -0.35 0.00 -1.18 0.00 0.00 61.69 58.69 2pov s THR 169 Cb 0.16 -3.47 -0.15 0.00 1.34 0.00 0.00 72.50 70.38 2pov s THR 169 CO 0.78 -0.35 1.50 1.17 -0.54 0.00 0.00 174.62 177.18 2pov n LYS 170 N -1.22 1.82 0.00 3.99 4.81 0.31 -2.16 118.16 125.71 2pov n LYS 170 Ca -0.08 0.66 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 2pov n LYS 170 Cb 0.58 -2.39 0.00 0.00 0.02 0.00 0.00 35.03 33.24 2pov n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2pov n GLY 171 N 3.13 3.32 3.75 3.14 0.00 -0.04 -4.43 105.19 114.06 2pov n GLY 171 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 2pov n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pov s LYS 172 N -0.95 4.78 0.12 1.61 1.02 -0.92 -4.85 119.74 120.55 2pov s LYS 172 Ca 0.00 1.57 0.01 0.00 0.02 0.00 0.00 55.97 57.56 2pov s LYS 172 Cb 0.00 -3.27 -0.04 0.00 -0.52 0.00 0.00 37.83 34.00 2pov s LYS 172 CO 0.00 0.40 -0.01 -1.54 -0.92 0.00 0.00 175.35 173.28 2pov s SER 173 N -0.94 0.84 -0.10 2.83 1.04 -1.26 -0.90 113.70 115.20 2pov s SER 173 Ca 0.43 -1.10 -0.20 0.00 0.48 0.00 0.00 55.95 55.56 2pov s SER 173 Cb -0.27 0.17 0.05 0.00 0.10 0.00 0.00 66.02 66.06 2pov s SER 173 CO 0.34 -0.58 0.50 0.00 0.98 0.00 0.00 173.24 174.48 2pov s ALA 174 N -3.79 -1.26 0.20 5.32 0.00 -0.39 -4.94 121.76 116.90 2pov s ALA 174 Ca 0.17 1.09 -0.32 0.00 0.00 0.00 0.00 51.96 52.90 2pov s ALA 174 Cb 0.07 -0.36 -0.14 0.00 0.00 0.00 0.00 23.12 22.68 2pov s ALA 174 CO -0.02 -0.28 1.30 -0.25 0.00 0.00 0.00 175.76 176.50 2pov n ASP 175 N 1.86 2.09 -3.13 0.00 8.00 -1.26 -1.38 116.55 122.72 2pov n ASP 175 Ca -0.17 1.14 -0.18 0.00 0.71 0.00 0.00 54.79 56.29 2pov n ASP 175 Cb 0.56 -1.33 -0.05 0.00 -0.02 0.00 0.00 41.12 40.28 2pov n ASP 175 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2pov n PHE 176 N 1.76 -2.06 -3.83 1.24 7.35 -0.72 -4.72 117.46 116.48 2pov n PHE 176 Ca 0.13 -2.55 -0.21 0.00 -0.76 0.00 0.00 57.45 54.06 2pov n PHE 176 Cb 0.28 0.73 -0.03 0.00 0.35 0.00 0.00 39.48 40.81 2pov n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2pov s THR 177 N 0.33 4.22 -2.09 -2.13 -4.23 -1.26 -3.01 115.64 107.48 2pov s THR 177 Ca 0.32 -1.21 0.00 0.00 -1.18 0.00 0.00 61.69 59.62 2pov s THR 177 Cb 0.03 -3.42 0.00 0.00 1.34 0.00 0.00 72.50 70.45 2pov s THR 177 CO -0.14 -0.24 0.00 0.59 -0.54 0.00 0.00 174.62 174.29 2pov n ASN 178 N -1.40 -5.38 -4.69 3.99 4.13 -1.26 -4.94 115.26 105.71 2pov n ASN 178 Ca -0.04 0.48 -0.41 0.00 1.68 0.00 0.00 54.58 56.29 2pov n ASN 178 Cb 0.58 -4.61 -0.04 0.00 -1.54 0.00 0.00 39.78 34.17 2pov n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 2pov s PHE 179 N -2.73 3.52 -0.45 3.10 5.36 -1.26 -4.99 117.98 120.52 2pov s PHE 179 Ca 0.00 1.43 -0.17 0.00 -0.96 0.00 0.00 56.93 57.23 2pov s PHE 179 Cb 0.00 -3.05 0.04 0.00 -0.34 0.00 0.00 43.02 39.67 2pov s PHE 179 CO 0.00 -0.14 0.46 0.34 -1.46 0.00 0.00 175.22 174.43 2pov s ASP 180 N 1.05 6.19 0.06 6.13 3.68 -1.26 -4.48 116.67 128.04 2pov s ASP 180 Ca 0.43 -0.87 0.11 0.00 2.13 0.00 0.00 52.55 54.36 2pov s ASP 180 Cb -0.18 -2.23 0.51 0.00 -1.45 0.00 0.00 42.92 39.57 2pov s ASP 180 CO 0.18 -0.66 1.35 -0.81 0.13 0.00 0.00 175.17 175.36 2pov n PRO 181 N 5.63 0.04 0.28 4.34 -0.04 -1.26 -2.46 135.00 141.53 2pov n PRO 181 Ca -0.08 0.40 0.15 0.00 -0.04 0.00 0.00 63.50 63.93 2pov n PRO 181 Cb 0.46 -1.59 0.83 0.00 -0.04 0.00 0.00 33.50 33.16 2pov n PRO 181 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2pov h ARG 182 N 0.00 0.00 0.00 0.54 3.08 -1.92 -1.82 114.38 114.26 2pov h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2pov h ARG 182 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.20 2pov h ARG 182 CO 0.00 0.07 0.00 0.41 -1.07 0.00 0.00 179.97 179.38 2pov n GLY 183 N -0.76 -0.87 0.52 0.04 0.00 -1.03 -2.86 105.19 100.24 2pov n GLY 183 Ca -0.02 -0.15 0.06 0.00 0.00 0.00 0.00 46.02 45.91 2pov n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2pov n LEU 184 N -0.93 2.12 -4.83 0.99 4.77 -0.68 -4.12 117.00 114.31 2pov n LEU 184 Ca 0.18 -1.06 -0.38 0.00 -0.03 0.00 0.00 56.01 54.72 2pov n LEU 184 Cb 0.08 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.10 2pov n LEU 184 CO 0.14 0.41 0.15 -0.76 -1.33 0.00 0.00 177.39 175.99 2pov s LEU 185 N -1.05 4.49 0.94 2.23 1.43 -1.13 -4.93 118.68 120.65 2pov s LEU 185 Ca 0.15 1.04 -0.14 0.00 -1.03 0.00 0.00 54.13 54.16 2pov s LEU 185 Cb 0.11 -2.67 0.16 0.00 0.03 0.00 0.00 46.19 43.81 2pov s LEU 185 CO 0.16 0.30 1.19 -2.16 0.23 0.00 0.00 176.35 176.07 2pov s PRO 186 N -1.04 0.91 0.07 1.29 0.04 -1.26 -4.98 135.00 130.02 2pov s PRO 186 Ca 0.25 0.05 -0.26 0.00 0.04 0.00 0.00 61.00 61.08 2pov s PRO 186 Cb -0.17 -1.83 -0.17 0.00 0.04 0.00 0.00 34.50 32.37 2pov s PRO 186 CO 0.15 -2.31 1.62 0.93 0.04 0.00 0.00 177.00 177.43 2pov h GLU 187 N -1.57 -0.26 -6.43 4.56 5.08 -1.92 -3.44 114.58 110.59 2pov h GLU 187 Ca -0.47 0.02 -0.54 0.00 -1.00 0.00 0.00 59.36 57.36 2pov h GLU 187 Cb 1.30 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.58 2pov h GLU 187 CO 0.54 -0.12 -0.03 0.45 -1.00 0.00 0.00 179.01 178.85 2pov s SER 188 N -5.02 6.83 -0.10 1.42 0.15 -1.26 -4.98 113.70 110.74 2pov s SER 188 Ca -0.15 1.14 0.16 0.00 0.70 0.00 0.00 55.95 57.80 2pov s SER 188 Cb 0.05 -2.31 0.57 0.00 -1.71 0.00 0.00 66.02 62.61 2pov s SER 188 CO 0.64 0.03 1.48 0.18 1.20 0.00 0.00 173.24 176.77 2pov n LEU 189 N 0.50 4.09 -4.73 3.45 4.77 -1.26 -4.72 117.00 119.10 2pov n LEU 189 Ca -0.03 -2.48 -0.42 0.00 -0.03 0.00 0.00 56.01 53.05 2pov n LEU 189 Cb 0.52 -0.48 -0.01 0.00 -2.33 0.00 0.00 43.42 41.12 2pov n LEU 189 CO 0.43 0.76 1.07 0.47 -1.33 0.00 0.00 177.39 178.78 2pov n ASP 190 N 0.55 3.35 -4.01 -1.43 10.43 -1.26 -4.90 116.55 119.28 2pov n ASP 190 Ca 0.21 1.20 -0.10 0.00 2.57 0.00 0.00 54.79 58.67 2pov n ASP 190 Cb 0.78 -1.55 -0.06 0.00 1.84 0.00 0.00 41.12 42.13 2pov n ASP 190 CO 0.00 0.00 0.00 -0.72 -1.07 0.00 0.00 177.20 175.41 2pov s TYR 191 N -0.79 0.46 0.07 1.24 -0.85 -1.26 -1.33 117.35 114.89 2pov s TYR 191 Ca 0.57 -0.80 0.09 0.00 -0.52 0.00 0.00 57.07 56.41 2pov s TYR 191 Cb -0.53 0.06 -0.03 0.00 0.38 0.00 0.00 41.96 41.84 2pov s TYR 191 CO 0.59 -0.91 -0.21 -1.58 -1.52 0.00 0.00 175.55 171.92 2pov s TRP 192 N -4.03 2.46 0.00 -3.49 0.51 0.07 -1.01 118.94 113.46 2pov s TRP 192 Ca 0.24 -0.31 -0.03 0.00 -2.12 0.00 0.00 56.10 53.87 2pov s TRP 192 Cb 0.01 -1.39 -0.01 0.00 -0.81 0.00 0.00 33.47 31.27 2pov s TRP 192 CO 0.08 0.27 0.05 -0.08 -0.51 0.00 0.00 176.95 176.76 2pov s THR 193 N -0.97 0.08 0.01 2.01 -1.32 0.32 -0.76 115.64 115.02 2pov s THR 193 Ca 0.15 -0.65 -0.28 0.00 -1.21 0.00 0.00 61.69 59.70 2pov s THR 193 Cb -0.10 -0.29 0.10 0.00 -1.51 0.00 0.00 72.50 70.70 2pov s THR 193 CO 0.06 -0.36 0.83 -0.72 -2.21 0.00 0.00 174.62 172.22 2pov s TYR 194 N -1.13 -0.40 -0.12 9.09 -0.85 -0.98 -1.27 117.35 121.68 2pov s TYR 194 Ca -0.12 0.33 -0.28 0.00 -0.52 0.00 0.00 57.07 56.47 2pov s TYR 194 Cb -0.07 0.53 -0.01 0.00 0.38 0.00 0.00 41.96 42.78 2pov s TYR 194 CO 0.00 -0.59 0.94 -1.25 -1.52 0.00 0.00 175.55 173.13 2pov s PRO 195 N -2.95 4.38 0.00 -3.49 0.04 -1.26 -1.13 135.00 130.59 2pov s PRO 195 Ca 0.03 1.25 0.00 0.00 0.04 0.00 0.00 61.00 62.32 2pov s PRO 195 Cb -0.01 -3.55 0.00 0.00 0.04 0.00 0.00 34.50 30.98 2pov s PRO 195 CO -0.08 -0.30 0.00 0.41 0.04 0.00 0.00 177.00 177.07 2pov n GLY 196 N 3.21 5.28 3.27 0.56 0.00 0.10 -4.81 105.19 112.81 2pov n GLY 196 Ca 0.07 -0.92 -0.18 0.00 0.00 0.00 0.00 46.02 45.00 2pov n GLY 196 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2pov n SER 197 N 0.00 -0.95 -4.77 1.61 3.41 -1.12 -2.50 113.62 109.30 2pov n SER 197 Ca 0.00 -3.08 -0.37 0.00 -0.26 0.00 0.00 58.87 55.15 2pov n SER 197 Cb 0.00 2.00 -0.02 0.00 -0.26 0.00 0.00 64.21 65.93 2pov n SER 197 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2pov s LEU 198 N 0.00 4.09 0.00 1.04 1.02 -0.29 -4.49 118.68 120.05 2pov s LEU 198 Ca 0.36 2.25 0.26 0.00 0.02 0.00 0.00 54.13 57.03 2pov s LEU 198 Cb 0.01 -4.17 0.72 0.00 0.02 0.00 0.00 46.19 42.77 2pov s LEU 198 CO 0.26 -0.75 1.55 0.35 0.02 0.00 0.00 176.35 177.77 2pov n THR 199 N -0.24 0.00 -4.38 5.49 -2.24 -1.26 -4.38 114.28 107.26 2pov n THR 199 Ca 0.06 -0.22 -0.24 0.00 -2.27 0.00 0.00 64.05 61.38 2pov n THR 199 Cb 0.48 0.64 -0.11 0.00 -2.10 0.00 0.00 70.33 69.24 2pov n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2pov s THR 200 N -2.27 2.10 0.57 4.28 -4.23 -1.26 -4.73 115.64 110.10 2pov s THR 200 Ca 0.29 -2.03 -0.19 0.00 -1.18 0.00 0.00 61.69 58.58 2pov s THR 200 Cb 0.20 -2.01 -0.06 0.00 1.34 0.00 0.00 72.50 71.97 2pov s THR 200 CO 0.44 -0.26 0.88 -2.65 -0.54 0.00 0.00 174.62 172.50 2pov n PRO 201 N 0.16 0.87 0.00 3.99 -0.02 -1.26 -0.48 135.00 138.26 2pov n PRO 201 Ca -0.12 0.34 0.04 0.00 -2.02 0.00 0.00 63.50 61.74 2pov n PRO 201 Cb 0.57 -2.06 0.25 0.00 -0.02 0.00 0.00 33.50 32.23 2pov n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2pov n PRO 202 N -0.69 0.61 -2.36 0.52 -0.04 -1.26 -4.98 135.00 126.80 2pov n PRO 202 Ca 0.13 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.42 2pov n PRO 202 Cb 0.46 -1.21 -0.01 0.00 -0.04 0.00 0.00 33.50 32.70 2pov n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2pov n LEU 203 N -0.71 -1.52 -4.76 1.53 4.77 0.37 -4.91 117.00 111.78 2pov n LEU 203 Ca 0.06 0.11 -0.41 0.00 -0.03 0.00 0.00 56.01 55.74 2pov n LEU 203 Cb 0.03 -2.53 -0.00 0.00 -2.33 0.00 0.00 43.42 38.59 2pov n LEU 203 CO 0.05 -0.22 1.11 0.18 -1.33 0.00 0.00 177.39 177.18 2pov n LEU 204 N -2.85 4.52 -3.95 2.23 4.77 -1.26 -4.32 117.00 116.13 2pov n LEU 204 Ca -0.19 1.21 -0.43 0.00 -0.03 0.00 0.00 56.01 56.57 2pov n LEU 204 Cb 0.64 -1.59 0.01 0.00 -2.33 0.00 0.00 43.42 40.14 2pov n LEU 204 CO 0.23 0.05 1.73 -0.62 -1.33 0.00 0.00 177.39 177.45 2pov n GLU 205 N 0.69 3.76 -0.10 3.23 1.02 -1.26 -1.14 120.64 126.84 2pov n GLU 205 Ca 0.03 -3.76 0.02 0.00 -0.02 0.00 0.00 57.16 53.43 2pov n GLU 205 Cb 0.38 -2.85 0.03 0.00 -0.02 0.00 0.00 31.44 28.98 2pov n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2pov s VAL 207 N -1.07 3.61 -0.35 0.00 1.01 -1.04 -0.52 120.40 122.04 2pov s VAL 207 Ca 0.08 -0.49 -0.13 0.00 0.00 0.00 0.00 61.98 61.45 2pov s VAL 207 Cb 0.07 -2.52 -0.00 0.00 0.00 0.00 0.00 36.38 33.93 2pov s VAL 207 CO 0.01 0.55 0.23 -0.89 0.00 0.00 0.00 175.10 175.00 2pov s THR 208 N -0.21 5.09 -0.00 3.92 2.01 -0.02 0.03 115.64 126.45 2pov s THR 208 Ca 0.02 -0.41 -0.21 0.00 0.31 0.00 0.00 61.69 61.40 2pov s THR 208 Cb -0.13 -3.68 -0.05 0.00 0.01 0.00 0.00 72.50 68.65 2pov s THR 208 CO 0.03 -0.08 0.63 0.26 -0.69 0.00 0.00 174.62 174.76 2pov s TRP 209 N 1.68 3.68 -0.29 4.92 0.52 -0.29 -2.15 118.94 127.00 2pov s TRP 209 Ca 0.05 1.24 0.00 0.00 0.02 0.00 0.00 56.10 57.41 2pov s TRP 209 Cb -0.18 -2.66 0.09 0.00 -1.15 0.00 0.00 33.47 29.58 2pov s TRP 209 CO 0.09 0.31 0.06 0.42 0.02 0.00 0.00 176.95 177.86 2pov s ILE 210 N -0.06 1.21 -0.27 2.03 1.01 -0.63 -2.33 121.20 122.15 2pov s ILE 210 Ca 0.33 -1.48 -0.09 0.00 0.00 0.00 0.00 60.65 59.41 2pov s ILE 210 Cb -0.18 -1.83 -0.03 0.00 0.01 0.00 0.00 42.46 40.43 2pov s ILE 210 CO 0.18 -0.54 0.12 -0.69 0.00 0.00 0.00 174.94 174.01 2pov s VAL 211 N 1.47 4.60 0.32 2.92 1.01 0.07 -0.31 120.40 130.48 2pov s VAL 211 Ca 0.07 -0.15 -0.28 0.00 0.00 0.00 0.00 61.98 61.61 2pov s VAL 211 Cb -0.18 -3.21 -0.10 0.00 0.00 0.00 0.00 36.38 32.90 2pov s VAL 211 CO -0.18 0.26 1.16 -0.76 0.00 0.00 0.00 175.10 175.58 2pov s LEU 212 N 1.65 4.45 0.14 3.92 1.43 -0.09 -0.75 118.68 129.43 2pov s LEU 212 Ca 0.06 2.38 -0.06 0.00 -1.03 0.00 0.00 54.13 55.48 2pov s LEU 212 Cb -0.16 -3.72 -0.03 0.00 0.03 0.00 0.00 46.19 42.31 2pov s LEU 212 CO 0.06 -0.34 1.38 0.50 0.23 0.00 0.00 176.35 178.18 2pov h LYS 213 N 3.46 0.59 -5.85 1.70 3.64 -1.55 -3.42 116.57 115.14 2pov h LYS 213 Ca -0.48 -0.47 -0.59 0.00 -1.27 0.00 0.00 60.65 57.84 2pov h LYS 213 Cb 1.22 0.10 -0.08 0.00 -0.41 0.00 0.00 32.23 33.05 2pov h LYS 213 CO 0.66 1.10 0.45 -2.00 -2.27 0.00 0.00 179.45 177.39 2pov s GLU 214 N -3.71 4.23 0.63 1.90 2.12 -1.26 -4.99 118.70 117.61 2pov s GLU 214 Ca -0.08 0.98 -0.09 0.00 0.36 0.00 0.00 54.97 56.14 2pov s GLU 214 Cb 0.10 -3.62 -0.01 0.00 0.26 0.00 0.00 34.13 30.86 2pov s GLU 214 CO 0.87 -0.45 1.00 -1.25 -0.54 0.00 0.00 175.26 174.88 2pov s PRO 215 N 2.60 3.20 0.14 4.30 0.04 -1.26 -4.62 135.00 139.40 2pov s PRO 215 Ca 0.36 0.43 0.03 0.00 0.04 0.00 0.00 61.00 61.87 2pov s PRO 215 Cb -0.16 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.21 2pov s PRO 215 CO 0.09 -0.71 0.20 0.96 0.04 0.00 0.00 177.00 177.57 2pov s ILE 216 N -3.15 4.90 -0.13 0.56 -4.36 0.37 -4.89 121.20 114.50 2pov s ILE 216 Ca 0.55 -0.84 -0.06 0.00 -0.26 0.00 0.00 60.65 60.04 2pov s ILE 216 Cb -0.11 -3.49 -0.04 0.00 1.25 0.00 0.00 42.46 40.07 2pov s ILE 216 CO 0.50 -0.06 0.08 -0.44 0.24 0.00 0.00 174.94 175.27 2pov s SER 217 N -3.04 5.88 0.13 4.36 0.01 -1.26 -1.52 113.70 118.25 2pov s SER 217 Ca 0.33 0.26 0.06 0.00 1.31 0.00 0.00 55.95 57.91 2pov s SER 217 Cb -0.11 -1.89 -0.04 0.00 0.21 0.00 0.00 66.02 64.19 2pov s SER 217 CO 0.26 0.32 -0.15 0.68 0.41 0.00 0.00 173.24 174.76 2pov s VAL 218 N -0.50 1.44 0.62 3.43 -7.23 -0.18 -3.30 120.40 114.68 2pov s VAL 218 Ca 0.11 -1.77 -0.10 0.00 -1.81 0.00 0.00 61.98 58.40 2pov s VAL 218 Cb -0.12 -1.61 -0.03 0.00 0.56 0.00 0.00 36.38 35.18 2pov s VAL 218 CO 0.02 -0.40 1.01 -0.94 -0.31 0.00 0.00 175.10 174.48 2pov s SER 219 N -2.52 6.07 0.28 4.85 1.04 -1.12 -0.38 113.70 121.91 2pov s SER 219 Ca 0.11 1.29 -0.04 0.00 0.48 0.00 0.00 55.95 57.79 2pov s SER 219 Cb -0.05 -2.32 0.36 0.00 0.10 0.00 0.00 66.02 64.11 2pov s SER 219 CO 0.04 -0.93 1.94 -1.28 0.98 0.00 0.00 173.24 173.98 2pov h SER 220 N -0.32 1.02 -0.72 7.02 0.87 -1.92 -1.95 113.55 117.55 2pov h SER 220 Ca -0.45 -0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.04 2pov h SER 220 Cb 1.21 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 62.87 2pov h SER 220 CO 0.62 0.76 0.34 -0.33 -0.53 0.00 0.00 176.83 177.70 2pov h GLU 221 N 1.19 1.06 -0.00 2.24 3.07 -1.95 0.47 114.58 120.67 2pov h GLU 221 Ca 0.32 -0.15 -0.00 0.00 -0.50 0.00 0.00 59.36 59.02 2pov h GLU 221 Cb -0.10 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 27.62 2pov h GLU 221 CO -0.06 0.83 0.00 1.96 -1.40 0.00 0.00 179.01 180.33 2pov h GLN 222 N 1.05 0.00 0.00 2.33 4.20 -1.75 -2.50 115.11 118.45 2pov h GLN 222 Ca 0.25 -0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.88 2pov h GLN 222 Cb 0.12 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 2pov h GLN 222 CO -0.03 0.30 -0.42 -0.24 -0.67 0.00 0.00 178.83 177.77 2pov h VAL 223 N -0.30 1.29 -0.35 -0.54 3.04 -1.29 -2.38 116.25 115.72 2pov h VAL 223 Ca 0.00 -1.43 -0.03 0.00 -1.01 0.00 0.00 66.70 64.22 2pov h VAL 223 Cb 0.30 1.77 -0.02 0.00 -2.01 0.00 0.00 31.29 31.33 2pov h VAL 223 CO 0.00 0.41 0.08 -0.07 -1.01 0.00 0.00 177.57 176.97 2pov h LEU 224 N 0.00 0.47 -0.94 3.16 3.38 -0.77 -1.51 115.31 119.11 2pov h LEU 224 Ca -0.00 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.80 2pov h LEU 224 Cb 0.74 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2pov h LEU 224 CO 0.05 0.48 -0.50 0.11 0.09 0.00 0.00 178.44 178.68 2pov h LYS 225 N 0.51 0.00 -0.70 1.13 1.57 -0.97 -2.40 116.57 115.70 2pov h LYS 225 Ca 0.12 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 2pov h LYS 225 Cb 0.21 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 2pov h LYS 225 CO -0.00 0.50 0.36 0.74 -0.57 0.00 0.00 179.45 180.47 2pov h PHE 226 N 0.00 0.99 0.00 -1.35 -1.00 -1.14 -2.21 116.94 112.23 2pov h PHE 226 Ca -0.00 -0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.74 2pov h PHE 226 Cb 0.94 -0.31 0.00 0.00 3.61 0.00 0.00 35.95 40.19 2pov h PHE 226 CO 0.00 0.72 0.00 0.54 -1.61 0.00 0.00 178.31 177.96 2pov n ARG 227 N -4.46 0.36 0.02 1.51 1.74 -0.92 -2.38 116.66 112.53 2pov n ARG 227 Ca 0.06 0.08 0.12 0.00 -0.77 0.00 0.00 57.85 57.34 2pov n ARG 227 Cb 0.11 -1.50 0.22 0.00 -1.02 0.00 0.00 32.46 30.27 2pov n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2pov n LYS 228 N -1.18 0.11 -0.98 5.56 5.02 -0.83 -4.39 118.16 121.46 2pov n LYS 228 Ca 0.10 0.03 -0.30 0.00 -2.02 0.00 0.00 58.31 56.11 2pov n LYS 228 Cb 0.11 -1.56 0.15 0.00 -0.02 0.00 0.00 35.03 33.70 2pov n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2pov s LEU 229 N -3.45 2.40 0.04 -0.35 1.43 -1.00 -4.84 118.68 112.91 2pov s LEU 229 Ca 0.09 1.77 0.08 0.00 -1.03 0.00 0.00 54.13 55.04 2pov s LEU 229 Cb 0.16 -4.17 -0.03 0.00 0.03 0.00 0.00 46.19 42.18 2pov s LEU 229 CO 0.71 -2.85 -0.22 0.20 0.23 0.00 0.00 176.35 174.42 2pov s ASN 230 N -3.08 3.48 0.08 2.29 0.02 0.99 -0.25 114.94 118.47 2pov s ASN 230 Ca 0.64 -0.51 0.02 0.00 -1.02 0.00 0.00 52.86 51.99 2pov s ASN 230 Cb -0.20 -0.45 -0.25 0.00 0.02 0.00 0.00 41.25 40.38 2pov s ASN 230 CO 0.58 0.26 1.14 -0.26 0.02 0.00 0.00 177.10 178.84 2pov h PHE 231 N 4.67 0.24 -4.35 2.20 0.05 -1.14 -3.35 116.94 115.26 2pov h PHE 231 Ca -0.47 -0.18 -0.47 0.00 3.82 0.00 0.00 57.97 60.67 2pov h PHE 231 Cb 1.15 -0.01 0.09 0.00 2.00 0.00 0.00 35.95 39.18 2pov h PHE 231 CO 0.51 1.15 0.36 0.54 -0.18 0.00 0.00 178.31 180.69 2pov s ASN 232 N -6.87 4.83 0.74 2.17 4.22 -1.26 -4.44 114.94 114.34 2pov s ASN 232 Ca -0.02 0.78 -0.05 0.00 -2.14 0.00 0.00 52.86 51.43 2pov s ASN 232 Cb 0.08 -1.40 0.12 0.00 1.28 0.00 0.00 41.25 41.33 2pov s ASN 232 CO 0.85 -1.67 1.03 -0.83 -2.04 0.00 0.00 177.10 174.44 2pov s GLY 233 N -4.50 1.76 0.32 0.45 0.00 -1.26 -0.53 107.32 103.56 2pov s GLY 233 Ca 0.60 -1.43 -0.29 0.00 0.00 0.00 0.00 44.72 43.60 2pov s GLY 233 CO 0.48 -0.89 1.56 1.85 0.00 0.00 0.00 173.10 176.11 2pov s GLU 234 N -5.26 4.11 0.00 2.90 2.12 -1.26 -2.24 118.70 119.08 2pov s GLU 234 Ca 0.65 2.58 0.00 0.00 0.36 0.00 0.00 54.97 58.57 2pov s GLU 234 Cb -0.07 -3.00 0.00 0.00 0.26 0.00 0.00 34.13 31.32 2pov s GLU 234 CO 0.45 -0.60 0.00 0.41 -0.54 0.00 0.00 175.26 174.98 2pov n GLY 235 N 1.58 0.56 3.80 -1.50 0.00 -1.26 -5.03 105.19 103.34 2pov n GLY 235 Ca 0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.86 2pov n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2pov s GLU 236 N -0.13 2.60 0.23 1.61 2.02 -0.95 -5.06 118.70 119.02 2pov s GLU 236 Ca 0.00 -1.37 -0.32 0.00 0.02 0.00 0.00 54.97 53.30 2pov s GLU 236 Cb 0.00 -2.37 -0.13 0.00 0.10 0.00 0.00 34.13 31.73 2pov s GLU 236 CO 0.00 0.12 1.53 -2.30 0.02 0.00 0.00 175.26 174.63 2pov n PRO 237 N -1.27 2.31 -2.23 0.39 -0.02 -1.26 -4.87 135.00 128.04 2pov n PRO 237 Ca -0.03 0.82 -0.42 0.00 -2.02 0.00 0.00 63.50 61.86 2pov n PRO 237 Cb 0.60 -2.56 -0.03 0.00 -0.02 0.00 0.00 33.50 31.49 2pov n PRO 237 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2pov s GLU 238 N 0.07 4.30 -0.26 -0.52 2.12 -1.26 -4.73 118.70 118.42 2pov s GLU 238 Ca 0.71 1.97 0.01 0.00 0.36 0.00 0.00 54.97 58.01 2pov s GLU 238 Cb -0.60 -3.51 0.07 0.00 0.26 0.00 0.00 34.13 30.35 2pov s GLU 238 CO 0.44 -0.53 -0.01 -1.21 -0.54 0.00 0.00 175.26 173.41 2pov s GLU 239 N 2.13 1.42 0.28 4.30 2.02 -1.26 -5.05 118.70 122.55 2pov s GLU 239 Ca 0.64 -1.12 -0.30 0.00 0.02 0.00 0.00 54.97 54.20 2pov s GLU 239 Cb -0.32 -2.57 -0.11 0.00 0.10 0.00 0.00 34.13 31.22 2pov s GLU 239 CO 0.27 -0.71 1.58 -0.51 0.02 0.00 0.00 175.26 175.91 2pov s LEU 240 N 1.37 4.35 -0.92 1.80 1.43 -1.26 -0.65 118.68 124.80 2pov s LEU 240 Ca -0.01 2.91 -0.24 0.00 -1.03 0.00 0.00 54.13 55.76 2pov s LEU 240 Cb -0.19 -3.63 0.04 0.00 0.03 0.00 0.00 46.19 42.44 2pov s LEU 240 CO -0.10 -0.89 1.42 -0.32 0.23 0.00 0.00 176.35 176.70 2pov s MET 241 N -0.43 3.40 0.06 1.70 -2.45 0.65 -4.65 119.30 117.58 2pov s MET 241 Ca 0.63 -0.77 -0.05 0.00 -1.25 0.00 0.00 55.69 54.25 2pov s MET 241 Cb -0.47 -4.95 -0.01 0.00 1.25 0.00 0.00 34.83 30.64 2pov s MET 241 CO 0.47 -2.25 0.10 0.14 1.05 0.00 0.00 175.02 174.53 2pov s VAL 242 N 5.51 0.16 -1.33 10.11 -7.23 -1.26 -4.44 120.40 121.92 2pov s VAL 242 Ca 0.44 -1.28 -0.04 0.00 -1.81 0.00 0.00 61.98 59.29 2pov s VAL 242 Cb -0.03 -1.17 0.02 0.00 0.56 0.00 0.00 36.38 35.75 2pov s VAL 242 CO -0.01 -0.71 0.91 0.47 -0.31 0.00 0.00 175.10 175.46 2pov n ASP 243 N 0.36 -2.93 -2.51 4.85 10.43 -0.03 -4.84 116.55 121.88 2pov n ASP 243 Ca -0.17 -0.71 -0.30 0.00 2.57 0.00 0.00 54.79 56.18 2pov n ASP 243 Cb 0.60 -4.47 0.00 0.00 1.84 0.00 0.00 41.12 39.09 2pov n ASP 243 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 2pov n ASN 244 N -3.03 6.95 -4.35 -2.24 0.23 -1.07 -4.90 115.26 106.85 2pov n ASN 244 Ca -0.18 -3.45 -0.30 0.00 -0.53 0.00 0.00 54.58 50.11 2pov n ASN 244 Cb 0.63 -1.13 -0.14 0.00 -2.08 0.00 0.00 39.78 37.06 2pov n ASN 244 CO 0.00 0.00 0.00 -1.66 -0.93 0.00 0.00 177.26 174.67 2pov s TRP 245 N -2.71 2.32 -0.05 -2.53 1.48 -1.26 -4.62 118.94 111.57 2pov s TRP 245 Ca 0.54 -0.41 -0.13 0.00 -1.06 0.00 0.00 56.10 55.04 2pov s TRP 245 Cb 0.40 -1.38 -0.05 0.00 -1.16 0.00 0.00 33.47 31.28 2pov s TRP 245 CO -0.22 0.15 0.34 0.50 -4.06 0.00 0.00 176.95 173.66 2pov s ARG 246 N -1.34 3.88 0.83 3.25 3.52 -1.26 -4.97 118.95 122.86 2pov s ARG 246 Ca 0.12 0.26 -0.12 0.00 -0.13 0.00 0.00 55.73 55.86 2pov s ARG 246 Cb -0.10 -3.25 0.09 0.00 -1.56 0.00 0.00 34.95 30.13 2pov s ARG 246 CO 0.03 0.63 1.10 -1.25 -0.81 0.00 0.00 175.30 174.99 2pov s PRO 247 N -0.79 1.83 0.30 5.12 0.04 -1.26 -4.58 135.00 135.66 2pov s PRO 247 Ca 0.21 0.67 -0.29 0.00 0.04 0.00 0.00 61.00 61.62 2pov s PRO 247 Cb -0.15 -1.89 -0.13 0.00 0.04 0.00 0.00 34.50 32.38 2pov s PRO 247 CO 0.10 -1.81 1.36 0.00 0.04 0.00 0.00 177.00 176.70 2pov n ALA 248 N -3.56 1.39 -2.61 8.56 0.00 -1.26 -4.35 120.51 118.67 2pov n ALA 248 Ca 0.07 0.38 -0.22 0.00 0.00 0.00 0.00 53.44 53.67 2pov n ALA 248 Cb 0.56 -2.29 -0.05 0.00 0.00 0.00 0.00 19.45 17.67 2pov n ALA 248 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2pov s GLN 249 N -1.26 2.56 0.18 0.00 -1.52 0.66 -4.93 119.66 115.36 2pov s GLN 249 Ca 0.60 -1.35 -0.33 0.00 -1.95 0.00 0.00 55.36 52.33 2pov s GLN 249 Cb -0.59 -2.33 -0.13 0.00 -0.22 0.00 0.00 33.01 29.74 2pov s GLN 249 CO 0.57 0.22 1.60 -2.30 -0.25 0.00 0.00 175.29 175.13 2pov n PRO 250 N -1.16 2.29 0.08 2.91 -0.02 -1.26 -4.58 135.00 133.26 2pov n PRO 250 Ca -0.04 0.83 -0.03 0.00 -2.02 0.00 0.00 63.50 62.24 2pov n PRO 250 Cb 0.60 -2.61 0.21 0.00 -0.02 0.00 0.00 33.50 31.68 2pov n PRO 250 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2pov h LEU 251 N 5.99 0.29 0.00 2.45 5.85 -1.94 -3.43 115.31 124.52 2pov h LEU 251 Ca -0.45 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.15 2pov h LEU 251 Cb 1.24 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.19 2pov h LEU 251 CO 0.89 0.67 0.00 0.29 -0.34 0.00 0.00 178.44 179.95 2pov n LYS 252 N -4.03 0.00 -1.59 1.25 5.02 -1.26 -3.13 118.16 114.42 2pov n LYS 252 Ca -0.01 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.88 2pov n LYS 252 Cb 0.48 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.47 2pov n LYS 252 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2pov n ASN 253 N 1.11 8.39 -4.05 4.39 4.05 -1.26 -4.89 115.26 122.99 2pov n ASN 253 Ca 0.00 -2.80 -0.12 0.00 0.45 0.00 0.00 54.58 52.11 2pov n ASN 253 Cb 0.00 -1.48 -0.11 0.00 1.23 0.00 0.00 39.78 39.42 2pov n ASN 253 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2pov s ARG 254 N 0.86 0.50 -0.08 1.20 0.52 -1.18 -5.10 118.95 115.67 2pov s ARG 254 Ca 0.63 -0.79 0.04 0.00 -0.52 0.00 0.00 55.73 55.09 2pov s ARG 254 Cb 0.18 -0.17 0.00 0.00 0.52 0.00 0.00 34.95 35.49 2pov s ARG 254 CO -0.07 0.01 -0.20 -1.14 0.02 0.00 0.00 175.30 173.92 2pov s GLN 255 N -1.83 2.50 -0.14 3.54 0.74 -1.26 -5.04 119.66 118.18 2pov s GLN 255 Ca -0.09 -0.73 -0.18 0.00 0.05 0.00 0.00 55.36 54.40 2pov s GLN 255 Cb -0.08 -1.97 -0.04 0.00 1.10 0.00 0.00 33.01 32.02 2pov s GLN 255 CO -0.01 0.17 0.49 0.42 -0.55 0.00 0.00 175.29 175.82 2pov s ILE 256 N 0.33 5.16 -0.00 -2.34 1.01 -1.26 -4.73 121.20 119.36 2pov s ILE 256 Ca -0.14 0.97 -0.01 0.00 0.00 0.00 0.00 60.65 61.47 2pov s ILE 256 Cb -0.16 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 2pov s ILE 256 CO 0.06 0.29 0.10 -0.54 0.00 0.00 0.00 174.94 174.85 2pov s LYS 257 N 0.89 3.13 -0.02 2.79 -0.14 -0.40 -2.17 119.74 123.83 2pov s LYS 257 Ca 0.26 -0.46 0.03 0.00 -1.36 0.00 0.00 55.97 54.43 2pov s LYS 257 Cb -0.15 -2.90 -0.03 0.00 -1.68 0.00 0.00 37.83 33.07 2pov s LYS 257 CO 0.10 0.65 -0.09 0.00 -0.76 0.00 0.00 175.35 175.26 2pov s ALA 258 N -1.23 2.93 -1.48 5.17 0.00 0.16 -0.52 121.76 126.80 2pov s ALA 258 Ca 0.24 -1.00 0.27 0.00 0.00 0.00 0.00 51.96 51.47 2pov s ALA 258 Cb -0.12 -1.10 0.91 0.00 0.00 0.00 0.00 23.12 22.81 2pov s ALA 258 CO 0.15 0.59 1.67 -1.13 0.00 0.00 0.00 175.76 177.05 2pov n SER 259 N 1.79 0.62 0.00 0.00 3.41 -0.18 -1.13 113.62 118.13 2pov n SER 259 Ca -0.16 -0.51 0.00 0.00 -0.26 0.00 0.00 58.87 57.94 2pov n SER 259 Cb 0.53 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 2pov n SER 259 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10