#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g1l s LYS 2 N 0.00 4.13 -0.04 0.03 2.20 -1.26 -5.02 119.74 119.79 1g1l s LYS 2 Ca 0.00 2.62 0.05 0.00 -0.36 0.00 0.00 55.97 58.28 1g1l s LYS 2 Cb 0.00 -3.56 -0.03 0.00 -1.51 0.00 0.00 37.83 32.73 1g1l s LYS 2 CO 0.00 -0.85 -0.17 0.50 -0.36 0.00 0.00 175.35 174.47 1g1l s ARG 3 N 2.66 2.39 0.04 4.03 3.52 -1.26 -4.25 118.95 126.07 1g1l s ARG 3 Ca 0.81 -0.76 -0.07 0.00 -0.13 0.00 0.00 55.73 55.58 1g1l s ARG 3 Cb -0.47 -2.29 -0.05 0.00 -1.56 0.00 0.00 34.95 30.58 1g1l s ARG 3 CO 0.36 0.60 0.31 0.15 -0.81 0.00 0.00 175.30 175.92 1g1l s LYS 4 N -0.76 3.63 0.14 5.12 1.02 0.25 -4.65 119.74 124.49 1g1l s LYS 4 Ca 0.11 -0.02 0.08 0.00 0.02 0.00 0.00 55.97 56.17 1g1l s LYS 4 Cb -0.10 -3.04 -0.04 0.00 -0.52 0.00 0.00 37.83 34.13 1g1l s LYS 4 CO 0.01 0.61 -0.10 0.20 -0.92 0.00 0.00 175.35 175.14 1g1l s GLY 5 N -1.80 1.75 -0.04 -3.33 0.00 -0.20 -0.88 107.32 102.82 1g1l s GLY 5 Ca 0.30 -1.37 0.01 0.00 0.00 0.00 0.00 44.72 43.67 1g1l s GLY 5 CO 0.18 -1.36 -0.04 -0.42 0.00 0.00 0.00 173.10 171.45 1g1l s ILE 6 N -1.46 0.50 -0.23 0.90 1.01 0.71 -0.99 121.20 121.64 1g1l s ILE 6 Ca 0.23 -0.10 -0.07 0.00 0.00 0.00 0.00 60.65 60.71 1g1l s ILE 6 Cb -0.10 -0.53 -0.03 0.00 0.01 0.00 0.00 42.46 41.81 1g1l s ILE 6 CO 0.14 0.22 0.05 -0.63 0.00 0.00 0.00 174.94 174.72 1g1l s ILE 7 N 0.92 4.28 -0.49 2.92 1.01 0.62 -0.72 121.20 129.74 1g1l s ILE 7 Ca -0.11 -0.19 -0.19 0.00 0.00 0.00 0.00 60.65 60.16 1g1l s ILE 7 Cb -0.14 -2.98 0.05 0.00 0.01 0.00 0.00 42.46 39.39 1g1l s ILE 7 CO -0.00 0.37 0.62 -0.22 0.00 0.00 0.00 174.94 175.71 1g1l s LEU 8 N 1.36 4.87 -0.20 2.97 2.96 -0.62 -0.92 118.68 129.10 1g1l s LEU 8 Ca 0.05 -0.79 0.14 0.00 -0.22 0.00 0.00 54.13 53.31 1g1l s LEU 8 Cb -0.15 -2.49 0.44 0.00 0.50 0.00 0.00 46.19 44.50 1g1l s LEU 8 CO 0.03 -0.85 1.19 0.00 -1.32 0.00 0.00 176.35 175.40 1g1l n ALA 9 N 6.16 3.64 -2.07 5.97 0.00 0.15 -0.25 120.51 134.10 1g1l n ALA 9 Ca -0.06 -3.18 0.00 0.00 0.00 0.00 0.00 53.44 50.20 1g1l n ALA 9 Cb 0.46 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.42 1g1l n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g1l n GLY 10 N -0.63 2.15 0.00 0.00 0.00 -1.18 -4.56 105.19 100.98 1g1l n GLY 10 Ca 0.22 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1g1l n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g1l n GLY 11 N 5.00 -1.37 0.12 -0.02 0.00 -1.26 -4.79 105.19 102.87 1g1l n GLY 11 Ca 0.00 -1.58 0.07 0.00 0.00 0.00 0.00 46.02 44.50 1g1l n GLY 11 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1g1l h SER 12 N 0.00 0.00 -2.06 1.61 4.64 -1.99 -3.47 113.55 112.28 1g1l h SER 12 Ca 0.00 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.93 1g1l h SER 12 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.02 1g1l h SER 12 CO 0.00 0.24 -0.44 0.61 -0.87 0.00 0.00 176.83 176.37 1g1l n GLY 13 N 1.25 0.45 0.27 -0.77 0.00 -1.26 -4.90 105.19 100.23 1g1l n GLY 13 Ca -0.03 -0.08 0.03 0.00 0.00 0.00 0.00 46.02 45.94 1g1l n GLY 13 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1g1l h THR 14 N 0.00 0.32 -0.27 2.61 2.02 -1.95 -0.26 112.91 115.39 1g1l h THR 14 Ca -0.44 -0.02 0.08 0.00 0.77 0.00 0.00 66.41 66.81 1g1l h THR 14 Cb 1.31 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 1g1l h THR 14 CO 0.56 0.01 0.30 0.03 0.37 0.00 0.00 175.52 176.78 1g1l h ARG 15 N 0.05 0.00 -0.02 6.66 3.08 -1.90 -1.18 114.38 121.06 1g1l h ARG 15 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 1g1l h ARG 15 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1g1l h ARG 15 CO -0.69 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 179.49 1g1l n LEU 16 N -3.75 1.71 -4.58 3.04 4.77 -0.11 -4.62 117.00 113.46 1g1l n LEU 16 Ca 0.04 -0.57 -0.41 0.00 -0.03 0.00 0.00 56.01 55.04 1g1l n LEU 16 Cb 0.44 -0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.55 1g1l n LEU 16 CO 0.27 0.29 0.46 1.41 -1.33 0.00 0.00 177.39 178.49 1g1l n HIS 17 N 0.34 0.74 1.30 -1.77 8.25 -0.45 -1.60 115.22 122.04 1g1l n HIS 17 Ca 0.18 0.54 0.12 0.00 -0.26 0.00 0.00 57.72 58.31 1g1l n HIS 17 Cb 0.39 -2.16 0.43 0.00 1.12 0.00 0.00 29.99 29.76 1g1l n HIS 17 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1g1l n PRO 18 N 0.05 1.77 -0.34 -0.41 -0.04 -1.26 -4.88 135.00 129.88 1g1l n PRO 18 Ca 0.10 -1.13 0.07 0.00 -0.04 0.00 0.00 63.50 62.50 1g1l n PRO 18 Cb 0.41 -1.45 0.23 0.00 -0.04 0.00 0.00 33.50 32.65 1g1l n PRO 18 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1g1l h ALA 19 N 4.26 1.45 -0.05 0.55 0.00 -1.70 -0.63 119.26 123.14 1g1l h ALA 19 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1g1l h ALA 19 Cb 0.54 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1g1l h ALA 19 CO 0.00 0.16 0.00 0.25 0.00 0.00 0.00 179.25 179.66 1g1l n THR 20 N -4.67 0.07 0.09 0.00 -2.24 -1.22 -2.45 114.28 103.86 1g1l n THR 20 Ca 0.18 -0.07 -0.13 0.00 -2.27 0.00 0.00 64.05 61.76 1g1l n THR 20 Cb 0.37 0.03 -0.10 0.00 -2.10 0.00 0.00 70.33 68.53 1g1l n THR 20 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1g1l h LEU 21 N 0.31 0.34 0.19 3.22 3.38 -1.44 -3.35 115.31 117.96 1g1l h LEU 21 Ca 0.00 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 1g1l h LEU 21 Cb 0.07 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1g1l h LEU 21 CO 0.00 1.22 -0.09 0.00 0.09 0.00 0.00 178.44 179.66 1g1l h ALA 22 N 0.74 -0.25 -2.75 1.53 0.00 -1.58 -3.48 119.26 113.48 1g1l h ALA 22 Ca -0.09 -0.22 -0.30 0.00 0.00 0.00 0.00 54.91 54.30 1g1l h ALA 22 Cb 1.80 0.10 -0.18 0.00 0.00 0.00 0.00 17.79 19.50 1g1l h ALA 22 CO 0.17 -0.37 -0.73 0.42 0.00 0.00 0.00 179.25 178.75 1g1l s ILE 23 N -3.85 0.86 0.52 0.00 1.01 -1.23 -5.14 121.20 113.37 1g1l s ILE 23 Ca -0.13 -1.59 -0.22 0.00 0.00 0.00 0.00 60.65 58.70 1g1l s ILE 23 Cb 0.01 -1.29 -0.07 0.00 0.01 0.00 0.00 42.46 41.12 1g1l s ILE 23 CO 0.52 -0.57 1.16 -0.24 0.00 0.00 0.00 174.94 175.81 1g1l n SER 24 N 0.62 1.84 -0.23 3.58 2.88 -1.26 -4.31 113.62 116.75 1g1l n SER 24 Ca -0.17 0.96 0.14 0.00 -1.33 0.00 0.00 58.87 58.47 1g1l n SER 24 Cb 0.58 -1.47 0.43 0.00 -0.75 0.00 0.00 64.21 63.00 1g1l n SER 24 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1g1l h LYS 25 N 1.30 0.55 0.00 -1.46 3.64 -1.90 -1.94 116.57 116.76 1g1l h LYS 25 Ca -0.48 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 1g1l h LYS 25 Cb 1.33 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1g1l h LYS 25 CO 0.56 0.36 0.00 1.04 -2.27 0.00 0.00 179.45 179.14 1g1l n GLN 26 N -4.53 0.47 0.00 1.90 3.00 -1.26 -1.99 117.38 114.98 1g1l n GLN 26 Ca 0.16 0.02 0.10 0.00 -0.01 0.00 0.00 57.00 57.27 1g1l n GLN 26 Cb 0.51 -1.50 -0.10 0.00 0.00 0.00 0.00 30.24 29.15 1g1l n GLN 26 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1g1l n LEU 27 N -1.25 1.18 -4.78 1.08 4.77 -0.74 -1.43 117.00 115.84 1g1l n LEU 27 Ca 0.15 -0.55 -0.35 0.00 -0.03 0.00 0.00 56.01 55.23 1g1l n LEU 27 Cb 0.21 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1g1l n LEU 27 CO 0.21 0.27 0.76 -0.76 -1.33 0.00 0.00 177.39 176.55 1g1l s LEU 28 N -2.90 3.73 0.38 2.23 1.43 -0.84 -4.47 118.68 118.24 1g1l s LEU 28 Ca 0.10 2.09 -0.25 0.00 -1.03 0.00 0.00 54.13 55.05 1g1l s LEU 28 Cb 0.16 -4.57 -0.09 0.00 0.03 0.00 0.00 46.19 41.72 1g1l s LEU 28 CO 0.81 -1.15 1.03 -2.16 0.23 0.00 0.00 176.35 175.12 1g1l s PRO 29 N -3.37 4.25 -0.50 1.29 0.04 -1.26 -0.52 135.00 134.93 1g1l s PRO 29 Ca 0.71 1.49 -0.04 0.00 0.04 0.00 0.00 61.00 63.20 1g1l s PRO 29 Cb -0.22 -2.61 0.13 0.00 0.04 0.00 0.00 34.50 31.85 1g1l s PRO 29 CO 0.27 -0.06 0.31 0.08 0.04 0.00 0.00 177.00 177.64 1g1l s VAL 30 N -1.64 3.56 0.00 -0.36 1.01 -0.40 -4.79 120.40 117.78 1g1l s VAL 30 Ca 0.56 -2.38 0.00 0.00 0.00 0.00 0.00 61.98 60.16 1g1l s VAL 30 Cb -0.22 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 32.78 1g1l s VAL 30 CO 0.27 -0.77 0.00 0.00 0.00 0.00 0.00 175.10 174.60 1g1l n TYR 31 N 4.19 0.00 -0.21 5.22 9.36 -1.26 -3.31 117.16 131.15 1g1l n TYR 31 Ca 0.01 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.23 1g1l n TYR 31 Cb 0.40 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.11 1g1l n TYR 31 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 1g1l n ASP 32 N 3.10 0.79 -3.63 2.98 5.75 -1.26 -5.08 116.55 119.20 1g1l n ASP 32 Ca 0.00 -1.00 -0.13 0.00 -0.01 0.00 0.00 54.79 53.65 1g1l n ASP 32 Cb 0.00 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.03 1g1l n ASP 32 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1g1l s LYS 33 N -0.00 0.98 0.45 0.11 -2.85 -1.21 -5.11 119.74 112.11 1g1l s LYS 33 Ca 0.00 -0.36 -0.25 0.00 -1.00 0.00 0.00 55.97 54.35 1g1l s LYS 33 Cb 0.00 0.44 -0.08 0.00 -2.06 0.00 0.00 37.83 36.13 1g1l s LYS 33 CO 0.00 -0.35 1.41 -2.30 0.10 0.00 0.00 175.35 174.21 1g1l n PRO 34 N 0.37 2.19 -0.28 1.78 -0.02 -1.26 -1.27 135.00 136.50 1g1l n PRO 34 Ca -0.18 0.78 0.10 0.00 -2.02 0.00 0.00 63.50 62.18 1g1l n PRO 34 Cb 0.60 -2.59 0.24 0.00 -0.02 0.00 0.00 33.50 31.73 1g1l n PRO 34 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1g1l h MET 35 N 2.23 0.20 -0.60 -0.52 1.85 -0.86 -0.65 114.93 116.59 1g1l h MET 35 Ca -0.50 -0.01 0.17 0.00 -0.61 0.00 0.00 59.70 58.74 1g1l h MET 35 Cb 1.27 -0.05 -0.03 0.00 0.43 0.00 0.00 31.60 33.23 1g1l h MET 35 CO 0.61 0.14 0.42 0.97 -0.40 0.00 0.00 176.91 178.65 1g1l h ILE 36 N 0.21 0.72 -1.00 1.77 2.10 -1.48 -1.35 117.51 118.49 1g1l h ILE 36 Ca 0.50 -0.02 0.24 0.00 1.08 0.00 0.00 64.86 66.66 1g1l h ILE 36 Cb 0.95 0.67 -0.09 0.00 -1.09 0.00 0.00 36.82 37.26 1g1l h ILE 36 CO -0.62 0.01 0.64 1.88 -1.08 0.00 0.00 178.15 178.98 1g1l h TYR 37 N 0.04 0.67 0.39 2.19 -1.99 -1.42 -2.36 116.97 114.49 1g1l h TYR 37 Ca 0.28 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 61.02 1g1l h TYR 37 Cb 1.08 -0.20 0.00 0.00 2.00 0.00 0.00 36.73 39.61 1g1l h TYR 37 CO -0.00 0.11 -0.19 1.88 -0.00 0.00 0.00 178.16 179.96 1g1l h TYR 38 N 0.44 -0.49 -0.14 4.88 -1.99 -1.40 -0.08 116.97 118.20 1g1l h TYR 38 Ca 0.55 -0.01 -0.05 0.00 2.00 0.00 0.00 58.73 61.22 1g1l h TYR 38 Cb 1.34 0.16 -0.01 0.00 2.00 0.00 0.00 36.73 40.22 1g1l h TYR 38 CO -0.00 -0.17 -0.14 -1.00 -0.00 0.00 0.00 178.16 176.85 1g1l h PRO 39 N -0.96 0.21 -0.12 4.88 0.13 -1.71 -1.81 132.00 132.62 1g1l h PRO 39 Ca -0.05 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1g1l h PRO 39 Cb 0.54 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.64 1g1l h PRO 39 CO 0.09 0.36 0.06 1.25 -0.23 0.00 0.00 178.00 179.54 1g1l h LEU 40 N 0.20 0.16 -1.56 1.56 5.85 -1.39 -1.72 115.31 118.41 1g1l h LEU 40 Ca 0.04 -0.10 0.06 0.00 0.84 0.00 0.00 57.88 58.72 1g1l h LEU 40 Cb 0.38 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 1g1l h LEU 40 CO 0.02 0.21 0.37 0.28 -0.34 0.00 0.00 178.44 178.99 1g1l h SER 41 N 0.09 0.48 -0.01 1.25 0.02 -0.57 -0.85 113.55 113.96 1g1l h SER 41 Ca 0.04 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1g1l h SER 41 Cb 0.09 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.53 1g1l h SER 41 CO -0.01 0.32 0.00 0.74 -1.14 0.00 0.00 176.83 176.74 1g1l h THR 42 N 0.55 1.18 -0.68 -2.27 2.02 -0.71 0.91 112.91 113.92 1g1l h THR 42 Ca 0.24 -0.55 0.04 0.00 0.77 0.00 0.00 66.41 66.91 1g1l h THR 42 Cb 0.25 1.54 -0.05 0.00 -1.74 0.00 0.00 68.15 68.16 1g1l h THR 42 CO -0.07 0.14 0.41 -0.07 0.37 0.00 0.00 175.52 176.31 1g1l h LEU 43 N -0.21 0.66 -0.87 2.58 3.38 -0.85 -2.00 115.31 118.01 1g1l h LEU 43 Ca 0.00 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.02 1g1l h LEU 43 Cb 0.23 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 1g1l h LEU 43 CO 0.00 0.45 0.56 0.24 0.09 0.00 0.00 178.44 179.77 1g1l h MET 44 N 0.79 1.04 0.00 1.13 2.86 -0.96 -1.35 114.93 118.45 1g1l h MET 44 Ca 0.28 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 1g1l h MET 44 Cb 0.07 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 31.50 1g1l h MET 44 CO -0.13 0.69 0.00 -0.07 1.06 0.00 0.00 176.91 178.46 1g1l h LEU 45 N 1.07 0.00 -0.30 1.22 3.38 -0.33 -0.49 115.31 119.86 1g1l h LEU 45 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1g1l h LEU 45 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1g1l h LEU 45 CO -0.12 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.41 1g1l n ALA 46 N -2.06 2.58 -0.79 1.53 0.00 -0.59 -4.63 120.51 116.55 1g1l n ALA 46 Ca 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1g1l n ALA 46 Cb 0.30 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.52 1g1l n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g1l n GLY 47 N 0.87 0.55 3.62 0.00 0.00 -0.19 -4.75 105.19 105.29 1g1l n GLY 47 Ca 0.14 -0.48 -0.38 0.00 0.00 0.00 0.00 46.02 45.29 1g1l n GLY 47 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1g1l s ILE 48 N -2.00 5.27 -0.16 -0.61 1.01 -0.74 -4.89 121.20 119.08 1g1l s ILE 48 Ca 0.00 0.36 0.12 0.00 0.00 0.00 0.00 60.65 61.13 1g1l s ILE 48 Cb 0.00 -3.60 -0.17 0.00 0.01 0.00 0.00 42.46 38.70 1g1l s ILE 48 CO 0.00 0.25 0.33 0.54 0.00 0.00 0.00 174.94 176.06 1g1l n ARG 49 N 4.86 1.13 -3.89 2.79 1.74 -1.26 -3.70 116.66 118.33 1g1l n ARG 49 Ca -0.12 -0.08 -0.35 0.00 -0.77 0.00 0.00 57.85 56.53 1g1l n ARG 49 Cb 0.51 -1.22 -0.14 0.00 -1.02 0.00 0.00 32.46 30.60 1g1l n ARG 49 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1g1l s GLU 50 N -2.64 2.53 -0.05 5.56 2.12 -1.26 -0.84 118.70 124.13 1g1l s GLU 50 Ca -0.02 -1.21 0.00 0.00 0.36 0.00 0.00 54.97 54.11 1g1l s GLU 50 Cb 0.08 -3.20 0.02 0.00 0.26 0.00 0.00 34.13 31.29 1g1l s GLU 50 CO 0.50 -0.60 -0.03 0.42 -0.54 0.00 0.00 175.26 175.01 1g1l s ILE 51 N 1.29 0.45 -0.20 -3.70 1.01 -0.51 -1.03 121.20 118.50 1g1l s ILE 51 Ca -0.04 -0.04 -0.13 0.00 0.00 0.00 0.00 60.65 60.44 1g1l s ILE 51 Cb -0.19 -0.51 -0.05 0.00 0.01 0.00 0.00 42.46 41.72 1g1l s ILE 51 CO -0.01 0.22 0.25 -0.22 0.00 0.00 0.00 174.94 175.18 1g1l s LEU 52 N 1.13 4.17 -0.29 2.97 2.96 -0.16 -1.07 118.68 128.37 1g1l s LEU 52 Ca -0.08 0.33 -0.08 0.00 -0.22 0.00 0.00 54.13 54.08 1g1l s LEU 52 Cb -0.14 -2.28 -0.01 0.00 0.50 0.00 0.00 46.19 44.27 1g1l s LEU 52 CO -0.01 0.05 0.11 -0.63 -1.32 0.00 0.00 176.35 174.55 1g1l s ILE 53 N 0.88 4.34 -0.20 6.68 1.01 0.13 -0.28 121.20 133.76 1g1l s ILE 53 Ca 0.13 -0.46 -0.10 0.00 0.00 0.00 0.00 60.65 60.22 1g1l s ILE 53 Cb -0.13 -3.19 -0.05 0.00 0.01 0.00 0.00 42.46 39.10 1g1l s ILE 53 CO 0.04 0.12 0.12 -0.63 0.00 0.00 0.00 174.94 174.60 1g1l s ILE 54 N 1.58 5.30 0.36 2.92 1.01 -0.10 -2.03 121.20 130.23 1g1l s ILE 54 Ca 0.04 0.15 -0.01 0.00 0.00 0.00 0.00 60.65 60.83 1g1l s ILE 54 Cb -0.17 -3.42 0.00 0.00 0.01 0.00 0.00 42.46 38.89 1g1l s ILE 54 CO 0.04 0.44 0.47 -0.55 0.00 0.00 0.00 174.94 175.35 1g1l s SER 55 N 0.40 1.09 0.95 3.58 0.15 -0.96 0.32 113.70 119.22 1g1l s SER 55 Ca 0.07 -1.55 -0.11 0.00 0.70 0.00 0.00 55.95 55.05 1g1l s SER 55 Cb -0.11 0.67 0.16 0.00 -1.71 0.00 0.00 66.02 65.03 1g1l s SER 55 CO -0.01 -1.31 1.09 0.42 1.20 0.00 0.00 173.24 174.62 1g1l s THR 56 N -2.96 2.46 0.26 6.45 -4.23 -1.26 0.02 115.64 116.37 1g1l s THR 56 Ca 0.31 0.15 -0.05 0.00 -1.18 0.00 0.00 61.69 60.92 1g1l s THR 56 Cb -0.00 -2.47 0.26 0.00 1.34 0.00 0.00 72.50 71.63 1g1l s THR 56 CO 0.22 -0.20 1.93 -0.65 -0.54 0.00 0.00 174.62 175.39 1g1l h PRO 57 N -1.80 1.30 0.00 3.99 0.11 -1.87 -1.42 132.00 132.31 1g1l h PRO 57 Ca -0.50 -0.08 -0.12 0.00 0.11 0.00 0.00 66.00 65.40 1g1l h PRO 57 Cb 1.29 -0.29 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 1g1l h PRO 57 CO 0.51 0.86 -0.59 -0.56 -0.21 0.00 0.00 178.00 178.01 1g1l h GLN 58 N 1.34 0.00 0.00 1.05 -0.00 -1.96 -3.29 115.11 112.25 1g1l h GLN 58 Ca 0.37 0.00 -0.08 0.00 -0.00 0.00 0.00 58.65 58.93 1g1l h GLN 58 Cb -0.15 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.32 1g1l h GLN 58 CO -0.08 0.59 -1.58 -0.25 -0.00 0.00 0.00 178.83 177.50 1g1l n ASP 59 N -3.54 0.48 -0.19 0.06 8.00 -1.09 -4.33 116.55 115.94 1g1l n ASP 59 Ca -0.00 0.20 -0.00 0.00 0.71 0.00 0.00 54.79 55.70 1g1l n ASP 59 Cb 0.66 0.94 0.09 0.00 -0.02 0.00 0.00 41.12 42.78 1g1l n ASP 59 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1g1l h THR 60 N 0.00 0.51 0.00 -3.53 2.02 -1.33 0.30 112.91 110.88 1g1l h THR 60 Ca -0.10 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 1g1l h THR 60 Cb 1.28 0.40 -0.00 0.00 -1.74 0.00 0.00 68.15 68.09 1g1l h THR 60 CO 0.01 0.02 -0.10 -0.65 0.37 0.00 0.00 175.52 175.18 1g1l h PRO 61 N 0.10 0.00 -0.10 6.66 0.11 -1.78 -1.01 132.00 135.99 1g1l h PRO 61 Ca 0.30 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 66.18 1g1l h PRO 61 Cb 0.48 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.60 1g1l h PRO 61 CO -0.51 0.10 -0.85 0.00 -0.21 0.00 0.00 178.00 176.53 1g1l h ARG 62 N 0.00 0.72 -0.47 1.05 3.08 -1.18 -1.34 114.38 116.24 1g1l h ARG 62 Ca -0.00 -0.64 -0.10 0.00 0.07 0.00 0.00 59.98 59.31 1g1l h ARG 62 Cb 0.36 0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 1g1l h ARG 62 CO 0.01 1.24 -0.10 0.74 -1.07 0.00 0.00 179.97 180.79 1g1l h PHE 63 N 0.47 1.00 -0.97 3.04 -1.00 -0.82 -2.25 116.94 116.41 1g1l h PHE 63 Ca -0.07 -0.21 0.14 0.00 2.81 0.00 0.00 57.97 60.64 1g1l h PHE 63 Cb 1.48 -0.25 -0.08 0.00 3.61 0.00 0.00 35.95 40.71 1g1l h PHE 63 CO 0.09 0.97 0.61 1.96 -1.61 0.00 0.00 178.31 180.33 1g1l h GLN 64 N 0.73 0.82 -0.39 1.51 4.20 -1.04 -0.07 115.11 120.88 1g1l h GLN 64 Ca 0.12 -0.05 -0.09 0.00 0.06 0.00 0.00 58.65 58.69 1g1l h GLN 64 Cb 0.64 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.23 1g1l h GLN 64 CO 0.04 0.54 -0.12 0.37 -0.67 0.00 0.00 178.83 179.00 1g1l h GLN 65 N 0.84 0.76 -0.04 1.46 4.15 -1.03 0.48 115.11 121.74 1g1l h GLN 65 Ca 0.50 -0.30 -0.01 0.00 0.77 0.00 0.00 58.65 59.61 1g1l h GLN 65 Cb 0.67 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 28.32 1g1l h GLN 65 CO -0.27 0.91 -0.01 1.25 -1.93 0.00 0.00 178.83 178.78 1g1l h LEU 66 N 0.57 0.08 0.00 -2.39 5.85 -1.01 -3.39 115.31 115.01 1g1l h LEU 66 Ca 0.09 -0.40 -0.08 0.00 0.84 0.00 0.00 57.88 58.33 1g1l h LEU 66 Cb 0.65 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 1g1l h LEU 66 CO 0.04 0.46 -2.00 0.18 -0.34 0.00 0.00 178.44 176.79 1g1l n LEU 67 N -4.84 0.00 0.00 2.25 4.77 -0.07 -5.08 117.00 114.03 1g1l n LEU 67 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1g1l n LEU 67 Cb 0.23 0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1g1l n LEU 67 CO 0.34 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1g1l n GLY 68 N 1.48 0.90 0.24 -0.72 0.00 0.16 -3.28 105.19 103.97 1g1l n GLY 68 Ca -0.10 -0.73 0.14 0.00 0.00 0.00 0.00 46.02 45.33 1g1l n GLY 68 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1g1l n ASP 69 N -2.82 0.89 0.00 1.61 5.68 -1.26 -4.78 116.55 115.87 1g1l n ASP 69 Ca 0.00 -0.94 0.00 0.00 -0.50 0.00 0.00 54.79 53.35 1g1l n ASP 69 Cb 0.00 0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 1g1l n ASP 69 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1g1l n GLY 70 N 1.25 1.38 0.25 6.12 0.00 -1.21 -0.86 105.19 112.13 1g1l n GLY 70 Ca 0.15 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.21 1g1l n GLY 70 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1g1l h SER 71 N 0.00 0.22 0.51 1.61 4.64 -1.85 -0.32 113.55 118.36 1g1l h SER 71 Ca 0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1g1l h SER 71 Cb 0.00 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 1g1l h SER 71 CO 0.00 0.34 0.00 0.78 -0.87 0.00 0.00 176.83 177.08 1g1l h ASN 72 N 0.23 0.00 -0.30 4.97 2.35 -1.91 -1.37 115.58 119.56 1g1l h ASN 72 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1g1l h ASN 72 Cb 0.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.67 1g1l h ASN 72 CO 0.01 0.00 0.00 0.79 -1.65 0.00 0.00 177.43 176.58 1g1l n TRP 73 N -2.40 0.45 -1.23 1.19 8.01 -0.37 -4.97 117.44 118.11 1g1l n TRP 73 Ca 0.01 -0.54 -0.08 0.00 -1.31 0.00 0.00 57.50 55.57 1g1l n TRP 73 Cb 0.17 -0.06 -0.03 0.00 -2.01 0.00 0.00 31.31 29.38 1g1l n TRP 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1g1l n GLY 74 N 0.28 1.00 3.75 6.99 0.00 -0.52 -4.74 105.19 111.94 1g1l n GLY 74 Ca 0.11 -0.61 -0.23 0.00 0.00 0.00 0.00 46.02 45.29 1g1l n GLY 74 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1g1l s LEU 75 N -1.84 3.27 -0.42 0.99 1.43 -0.27 -4.95 118.68 116.89 1g1l s LEU 75 Ca 0.00 -0.79 0.02 0.00 -1.03 0.00 0.00 54.13 52.32 1g1l s LEU 75 Cb 0.00 -1.75 0.11 0.00 0.03 0.00 0.00 46.19 44.59 1g1l s LEU 75 CO 0.00 -0.35 0.17 -0.62 0.23 0.00 0.00 176.35 175.78 1g1l s ASP 76 N -3.88 4.84 -0.13 2.29 2.15 -0.02 -2.77 116.67 119.15 1g1l s ASP 76 Ca 0.39 -2.38 -0.07 0.00 0.43 0.00 0.00 52.55 50.92 1g1l s ASP 76 Cb -0.02 -1.70 -0.04 0.00 -0.30 0.00 0.00 42.92 40.86 1g1l s ASP 76 CO 0.23 -0.39 0.13 -0.76 -0.17 0.00 0.00 175.17 174.21 1g1l s LEU 77 N 0.61 4.31 0.24 -1.34 1.43 -0.04 -1.43 118.68 122.46 1g1l s LEU 77 Ca 0.12 0.41 0.04 0.00 -1.03 0.00 0.00 54.13 53.67 1g1l s LEU 77 Cb -0.21 -2.06 -0.05 0.00 0.03 0.00 0.00 46.19 43.90 1g1l s LEU 77 CO -0.05 0.37 -0.01 -1.10 0.23 0.00 0.00 176.35 175.79 1g1l s GLN 78 N -0.81 1.38 0.01 1.70 -0.21 -0.24 -4.62 119.66 116.88 1g1l s GLN 78 Ca 0.14 -1.70 0.02 0.00 0.02 0.00 0.00 55.36 53.83 1g1l s GLN 78 Cb -0.12 -0.72 -0.01 0.00 1.00 0.00 0.00 33.01 33.16 1g1l s GLN 78 CO 0.03 -0.07 -0.05 0.71 -2.12 0.00 0.00 175.29 173.78 1g1l s TYR 79 N -3.34 0.47 0.02 0.91 1.51 -1.26 -0.69 117.35 114.96 1g1l s TYR 79 Ca 0.29 -0.24 -0.09 0.00 -1.01 0.00 0.00 57.07 56.02 1g1l s TYR 79 Cb 0.05 -0.29 0.01 0.00 -0.11 0.00 0.00 41.96 41.62 1g1l s TYR 79 CO 0.09 -0.04 0.19 0.00 -1.11 0.00 0.00 175.55 174.68 1g1l s ALA 80 N -0.59 -0.40 -0.07 3.71 0.00 -0.86 -4.94 121.76 118.61 1g1l s ALA 80 Ca -0.03 -0.17 -0.12 0.00 0.00 0.00 0.00 51.96 51.64 1g1l s ALA 80 Cb -0.05 0.21 -0.05 0.00 0.00 0.00 0.00 23.12 23.23 1g1l s ALA 80 CO -0.00 -0.31 0.29 0.08 0.00 0.00 0.00 175.76 175.83 1g1l s VAL 81 N -2.10 5.25 -0.32 0.00 1.01 -1.26 -2.28 120.40 120.69 1g1l s VAL 81 Ca -0.09 0.57 -0.11 0.00 0.00 0.00 0.00 61.98 62.36 1g1l s VAL 81 Cb -0.03 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 1g1l s VAL 81 CO -0.01 0.56 0.18 -1.58 0.00 0.00 0.00 175.10 174.24 1g1l s GLN 82 N -0.78 3.32 0.25 2.72 0.74 0.10 -4.91 119.66 121.11 1g1l s GLN 82 Ca 0.19 -0.74 -0.05 0.00 0.05 0.00 0.00 55.36 54.81 1g1l s GLN 82 Cb -0.14 -3.64 0.32 0.00 1.10 0.00 0.00 33.01 30.65 1g1l s GLN 82 CO 0.08 -0.45 1.89 -1.35 -0.55 0.00 0.00 175.29 174.91 1g1l h PRO 83 N 8.39 1.14 -3.63 1.67 0.11 -1.97 -3.36 132.00 134.35 1g1l h PRO 83 Ca -0.31 -0.07 -0.14 0.00 0.11 0.00 0.00 66.00 65.59 1g1l h PRO 83 Cb 1.14 -0.26 -0.20 0.00 0.11 0.00 0.00 31.00 31.80 1g1l h PRO 83 CO 0.63 0.76 -0.52 0.45 -0.21 0.00 0.00 178.00 179.10 1g1l s SER 84 N -5.94 0.09 -1.41 -2.05 0.15 -1.26 -4.80 113.70 98.48 1g1l s SER 84 Ca -0.13 -0.31 -0.14 0.00 0.70 0.00 0.00 55.95 56.07 1g1l s SER 84 Cb 0.19 0.20 0.06 0.00 -1.71 0.00 0.00 66.02 64.75 1g1l s SER 84 CO 0.81 -0.39 2.11 -0.81 1.20 0.00 0.00 173.24 176.16 1g1l n PRO 85 N 1.32 3.00 -0.84 5.44 -0.04 -1.26 -4.61 135.00 138.02 1g1l n PRO 85 Ca -0.22 -2.82 0.07 0.00 -0.04 0.00 0.00 63.50 60.49 1g1l n PRO 85 Cb 0.56 -3.26 0.39 0.00 -0.04 0.00 0.00 33.50 31.15 1g1l n PRO 85 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1g1l n ASP 86 N 6.05 5.52 0.00 3.54 8.00 -1.26 -4.97 116.55 133.43 1g1l n ASP 86 Ca 0.50 -2.91 0.00 0.00 0.71 0.00 0.00 54.79 53.09 1g1l n ASP 86 Cb 0.39 -0.67 0.00 0.00 -0.02 0.00 0.00 41.12 40.83 1g1l n ASP 86 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1g1l n GLY 87 N 0.56 4.62 0.33 0.44 0.00 -1.26 -1.17 105.19 108.70 1g1l n GLY 87 Ca 0.27 -1.16 0.08 0.00 0.00 0.00 0.00 46.02 45.22 1g1l n GLY 87 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1g1l h LEU 88 N 0.00 0.39 -0.86 0.99 3.38 -1.84 -1.69 115.31 115.68 1g1l h LEU 88 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1g1l h LEU 88 Cb 0.00 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1g1l h LEU 88 CO 0.00 0.26 0.00 0.00 0.09 0.00 0.00 178.44 178.79 1g1l h ALA 89 N 1.73 1.00 0.00 1.53 0.00 -1.47 -0.57 119.26 121.47 1g1l h ALA 89 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1g1l h ALA 89 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1g1l h ALA 89 CO -0.05 0.00 0.00 1.96 0.00 0.00 0.00 179.25 181.16 1g1l h GLN 90 N 0.00 0.00 -0.23 0.00 4.20 -1.48 -2.00 115.11 115.59 1g1l h GLN 90 Ca 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 1g1l h GLN 90 Cb 0.48 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 1g1l h GLN 90 CO 0.00 0.00 0.14 0.00 -0.67 0.00 0.00 178.83 178.30 1g1l h ALA 91 N 2.01 1.82 0.00 3.87 0.00 -1.27 -0.59 119.26 125.09 1g1l h ALA 91 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1g1l h ALA 91 Cb 0.05 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1g1l h ALA 91 CO 0.00 0.16 -0.03 0.74 0.00 0.00 0.00 179.25 180.12 1g1l h PHE 92 N 0.31 0.00 0.02 0.00 -1.00 -1.58 0.40 116.94 115.09 1g1l h PHE 92 Ca 0.08 0.00 -0.27 0.00 2.81 0.00 0.00 57.97 60.59 1g1l h PHE 92 Cb -0.02 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.51 1g1l h PHE 92 CO 0.00 0.00 -1.49 1.28 -1.61 0.00 0.00 178.31 176.49 1g1l n LEU 93 N -2.51 1.99 -0.31 1.54 4.77 -0.73 -2.70 117.00 119.05 1g1l n LEU 93 Ca 0.05 0.38 -0.01 0.00 -0.03 0.00 0.00 56.01 56.40 1g1l n LEU 93 Cb 0.46 -0.98 0.12 0.00 -2.33 0.00 0.00 43.42 40.70 1g1l n LEU 93 CO 0.32 0.39 1.21 0.40 -1.33 0.00 0.00 177.39 178.38 1g1l h ILE 94 N -0.83 1.10 -0.40 -0.08 2.04 -1.20 -2.86 117.51 115.27 1g1l h ILE 94 Ca -0.39 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.11 1g1l h ILE 94 Cb 1.44 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 1g1l h ILE 94 CO -0.18 0.19 0.00 0.61 0.00 0.00 0.00 178.15 178.76 1g1l n GLY 95 N -1.33 2.02 0.04 5.37 0.00 0.13 -4.56 105.19 106.86 1g1l n GLY 95 Ca 0.11 -0.56 -0.12 0.00 0.00 0.00 0.00 46.02 45.45 1g1l n GLY 95 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1g1l h GLU 96 N 2.62 0.00 -0.59 1.61 4.81 -1.29 0.33 114.58 122.07 1g1l h GLU 96 Ca 0.00 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 1g1l h GLU 96 Cb 1.16 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.52 1g1l h GLU 96 CO 0.21 0.10 0.11 0.66 -0.73 0.00 0.00 179.01 179.36 1g1l h SER 97 N -0.10 0.93 -0.44 1.04 4.64 -1.84 -1.60 113.55 116.18 1g1l h SER 97 Ca 0.00 -0.26 0.08 0.00 -0.47 0.00 0.00 61.79 61.14 1g1l h SER 97 Cb 0.10 -0.25 -0.07 0.00 -0.31 0.00 0.00 62.40 61.88 1g1l h SER 97 CO -0.00 0.95 0.05 0.15 -0.87 0.00 0.00 176.83 177.11 1g1l h PHE 98 N 0.88 0.06 -0.58 4.77 3.57 -1.78 -2.87 116.94 120.99 1g1l h PHE 98 Ca 0.18 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 1g1l h PHE 98 Cb 0.41 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.16 1g1l h PHE 98 CO 0.03 -0.05 0.24 0.82 -2.23 0.00 0.00 178.31 177.13 1g1l h ILE 99 N 0.16 1.22 0.00 1.41 2.04 -0.70 -3.47 117.51 118.18 1g1l h ILE 99 Ca 0.22 -0.68 0.00 0.00 1.00 0.00 0.00 64.86 65.40 1g1l h ILE 99 Cb 0.30 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 1g1l h ILE 99 CO -0.33 0.27 0.00 0.61 0.00 0.00 0.00 178.15 178.70 1g1l n GLY 100 N -0.84 3.22 2.45 5.37 0.00 -0.62 -2.72 105.19 112.05 1g1l n GLY 100 Ca 0.03 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1g1l n GLY 100 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1g1l n ASN 101 N 3.60 6.33 -4.45 1.61 3.02 -1.26 -4.98 115.26 119.13 1g1l n ASN 101 Ca 0.00 -3.78 -0.24 0.00 -0.03 0.00 0.00 54.58 50.53 1g1l n ASN 101 Cb 0.00 -0.74 -0.10 0.00 -0.61 0.00 0.00 39.78 38.33 1g1l n ASN 101 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1g1l s ASP 102 N -2.44 3.48 0.69 6.41 1.01 -1.10 -5.04 116.67 119.68 1g1l s ASP 102 Ca 0.54 -0.99 -0.16 0.00 0.71 0.00 0.00 52.55 52.65 1g1l s ASP 102 Cb 0.44 -0.28 0.02 0.00 1.01 0.00 0.00 42.92 44.11 1g1l s ASP 102 CO -0.15 0.04 1.21 -0.76 0.21 0.00 0.00 175.17 175.73 1g1l s LEU 103 N -3.29 3.41 0.17 1.23 1.43 -1.26 -4.54 118.68 115.82 1g1l s LEU 103 Ca 0.27 2.37 -0.02 0.00 -1.03 0.00 0.00 54.13 55.72 1g1l s LEU 103 Cb -0.05 -4.59 -0.04 0.00 0.03 0.00 0.00 46.19 41.54 1g1l s LEU 103 CO 0.13 -2.09 0.12 -0.94 0.23 0.00 0.00 176.35 173.81 1g1l s SER 104 N -1.92 0.20 -0.09 2.29 1.04 -0.44 -0.59 113.70 114.19 1g1l s SER 104 Ca 0.75 -1.25 -0.06 0.00 0.48 0.00 0.00 55.95 55.87 1g1l s SER 104 Cb -0.30 0.36 0.03 0.00 0.10 0.00 0.00 66.02 66.21 1g1l s SER 104 CO 0.42 -0.81 0.23 0.00 0.98 0.00 0.00 173.24 174.06 1g1l s ALA 105 N -4.09 -0.54 -0.10 5.32 0.00 -0.06 -0.43 121.76 121.86 1g1l s ALA 105 Ca 0.30 0.78 0.02 0.00 0.00 0.00 0.00 51.96 53.06 1g1l s ALA 105 Cb 0.07 -0.48 -0.01 0.00 0.00 0.00 0.00 23.12 22.69 1g1l s ALA 105 CO 0.06 -0.15 -0.16 -1.17 0.00 0.00 0.00 175.76 174.35 1g1l s LEU 106 N 0.65 2.58 -0.00 0.00 2.96 0.46 -0.21 118.68 125.13 1g1l s LEU 106 Ca -0.04 -0.35 0.06 0.00 -0.22 0.00 0.00 54.13 53.58 1g1l s LEU 106 Cb -0.06 -1.55 -0.02 0.00 0.50 0.00 0.00 46.19 45.06 1g1l s LEU 106 CO -0.04 0.21 -0.18 0.54 -1.32 0.00 0.00 176.35 175.56 1g1l s VAL 107 N 0.09 1.44 0.16 1.68 0.11 0.10 -0.66 120.40 123.32 1g1l s VAL 107 Ca -0.07 -0.84 -0.30 0.00 -2.93 0.00 0.00 61.98 57.85 1g1l s VAL 107 Cb -0.15 -1.21 -0.07 0.00 -1.53 0.00 0.00 36.38 33.42 1g1l s VAL 107 CO 0.05 0.36 0.97 -0.76 -3.33 0.00 0.00 175.10 172.39 1g1l s LEU 108 N -0.55 4.54 0.56 2.54 1.43 -0.56 -1.59 118.68 125.05 1g1l s LEU 108 Ca 0.07 1.88 0.27 0.00 -1.03 0.00 0.00 54.13 55.31 1g1l s LEU 108 Cb -0.07 -3.60 1.65 0.00 0.03 0.00 0.00 46.19 44.20 1g1l s LEU 108 CO -0.00 -0.02 2.19 1.23 0.23 0.00 0.00 176.35 179.98 1g1l h GLY 109 N 5.11 0.00 -2.53 -3.19 0.00 -0.98 -2.47 103.07 99.01 1g1l h GLY 109 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 1g1l h GLY 109 CO 0.71 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.34 1g1l n ASP 110 N -3.90 4.51 -4.76 0.19 5.68 -1.26 -4.54 116.55 112.48 1g1l n ASP 110 Ca -0.03 -2.66 -0.36 0.00 -0.50 0.00 0.00 54.79 51.24 1g1l n ASP 110 Cb 0.12 -0.55 -0.08 0.00 -1.14 0.00 0.00 41.12 39.48 1g1l n ASP 110 CO 0.00 0.00 0.00 0.20 -1.33 0.00 0.00 177.20 176.07 1g1l s ASN 111 N -1.19 6.27 -0.18 -1.12 0.02 -0.93 -2.07 114.94 115.74 1g1l s ASN 111 Ca 0.46 0.31 0.01 0.00 -1.02 0.00 0.00 52.86 52.61 1g1l s ASN 111 Cb 0.33 -2.10 0.03 0.00 0.02 0.00 0.00 41.25 39.53 1g1l s ASN 111 CO 0.17 0.22 -0.14 -0.22 0.02 0.00 0.00 177.10 177.15 1g1l s LEU 112 N 0.10 2.18 0.04 0.60 0.20 -0.28 -4.15 118.68 117.36 1g1l s LEU 112 Ca 0.10 -0.76 0.04 0.00 0.69 0.00 0.00 54.13 54.21 1g1l s LEU 112 Cb -0.11 -1.31 -0.04 0.00 -0.43 0.00 0.00 46.19 44.30 1g1l s LEU 112 CO -0.00 -0.09 -0.07 -0.31 -0.29 0.00 0.00 176.35 175.59 1g1l s TYR 113 N 1.37 2.85 -0.23 5.38 1.51 -1.26 -1.03 117.35 125.94 1g1l s TYR 113 Ca 0.01 -0.07 -0.22 0.00 -1.01 0.00 0.00 57.07 55.78 1g1l s TYR 113 Cb -0.15 -1.55 0.06 0.00 -0.11 0.00 0.00 41.96 40.21 1g1l s TYR 113 CO -0.10 0.39 0.62 -0.47 -1.11 0.00 0.00 175.55 174.88 1g1l s TYR 114 N -1.08 -0.68 0.00 2.71 5.04 0.19 -4.99 117.35 118.55 1g1l s TYR 114 Ca 0.19 1.64 0.00 0.00 -2.44 0.00 0.00 57.07 56.46 1g1l s TYR 114 Cb -0.11 0.24 0.00 0.00 0.35 0.00 0.00 41.96 42.44 1g1l s TYR 114 CO 0.10 -0.34 0.00 0.41 -1.34 0.00 0.00 175.55 174.38 1g1l n GLY 115 N 2.68 -0.02 3.72 8.97 0.00 -1.26 -0.26 105.19 119.01 1g1l n GLY 115 Ca -0.14 -1.25 -0.42 0.00 0.00 0.00 0.00 46.02 44.21 1g1l n GLY 115 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1g1l s HIS 116 N -2.00 3.11 -1.75 1.61 2.46 -1.26 -2.69 115.29 114.76 1g1l s HIS 116 Ca 0.00 0.71 0.00 0.00 0.47 0.00 0.00 55.06 56.24 1g1l s HIS 116 Cb 0.00 -3.87 0.00 0.00 -0.13 0.00 0.00 32.58 28.58 1g1l s HIS 116 CO 0.00 -3.15 0.00 -0.25 -2.47 0.00 0.00 174.74 168.87 1g1l n ASP 117 N 3.93 -5.10 -0.15 9.88 9.92 -1.26 -4.86 116.55 128.91 1g1l n ASP 117 Ca 0.13 0.31 -0.01 0.00 -0.53 0.00 0.00 54.79 54.70 1g1l n ASP 117 Cb 0.39 -4.15 0.24 0.00 -0.64 0.00 0.00 41.12 36.97 1g1l n ASP 117 CO 0.00 0.00 0.00 0.15 0.13 0.00 0.00 177.20 177.48 1g1l h PHE 118 N 0.00 0.85 -0.67 1.24 3.57 -1.92 -2.26 116.94 117.74 1g1l h PHE 118 Ca -0.37 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.17 1g1l h PHE 118 Cb 1.18 -0.27 -0.06 0.00 2.79 0.00 0.00 35.95 39.60 1g1l h PHE 118 CO 0.48 0.62 0.36 1.12 -2.23 0.00 0.00 178.31 178.66 1g1l h HIS 119 N 0.86 0.66 -0.34 0.41 2.07 -1.89 0.77 115.15 117.69 1g1l h HIS 119 Ca 0.21 0.03 -0.14 0.00 -2.85 0.00 0.00 60.37 57.62 1g1l h HIS 119 Cb 0.07 -0.20 -0.01 0.00 2.57 0.00 0.00 27.41 29.85 1g1l h HIS 119 CO 0.01 0.30 -0.36 0.93 -3.07 0.00 0.00 177.93 175.74 1g1l h GLU 120 N 0.66 0.78 -0.47 5.12 3.07 -1.84 -1.41 114.58 120.50 1g1l h GLU 120 Ca 0.31 -0.39 0.03 0.00 -0.50 0.00 0.00 59.36 58.80 1g1l h GLU 120 Cb 0.22 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.10 1g1l h GLU 120 CO -0.20 1.02 0.26 1.25 -1.40 0.00 0.00 179.01 179.94 1g1l h LEU 121 N 0.65 0.41 -0.33 1.33 5.85 -0.82 -0.60 115.31 121.79 1g1l h LEU 121 Ca 0.06 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 1g1l h LEU 121 Cb 0.91 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 1g1l h LEU 121 CO 0.08 0.29 0.07 -0.07 -0.34 0.00 0.00 178.44 178.47 1g1l h LEU 122 N 0.52 0.52 -0.93 2.25 3.38 -0.80 -2.88 115.31 117.37 1g1l h LEU 122 Ca 0.19 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1g1l h LEU 122 Cb 0.05 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1g1l h LEU 122 CO -0.11 0.63 0.47 1.23 0.09 0.00 0.00 178.44 180.75 1g1l h GLY 123 N 0.38 1.31 1.00 0.83 0.00 -1.03 0.15 103.07 105.71 1g1l h GLY 123 Ca 0.10 -0.61 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 1g1l h GLY 123 CO 0.00 0.58 0.33 1.76 0.00 0.00 0.00 176.54 179.21 1g1l h SER 124 N 1.23 0.62 -0.39 0.19 0.02 -1.08 -1.00 113.55 113.14 1g1l h SER 124 Ca 0.31 -0.04 -0.15 0.00 -0.84 0.00 0.00 61.79 61.06 1g1l h SER 124 Cb 0.05 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 1g1l h SER 124 CO -0.05 0.48 -0.35 0.00 -1.14 0.00 0.00 176.83 175.77 1g1l h ALA 125 N 1.17 0.56 0.00 3.77 0.00 -1.26 -3.08 119.26 120.42 1g1l h ALA 125 Ca 0.19 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 1g1l h ALA 125 Cb -0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1g1l h ALA 125 CO -0.04 0.64 -0.40 1.03 0.00 0.00 0.00 179.25 180.49 1g1l h SER 126 N 0.74 0.00 0.86 0.00 0.87 -0.54 -2.79 113.55 112.69 1g1l h SER 126 Ca 0.07 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 1g1l h SER 126 Cb 0.94 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.90 1g1l h SER 126 CO 0.09 0.40 -0.31 0.00 -0.53 0.00 0.00 176.83 176.47 1g1l n GLN 127 N -3.52 0.10 -1.51 2.24 6.02 -0.39 -4.82 117.38 115.50 1g1l n GLN 127 Ca -0.00 0.05 -0.34 0.00 -0.01 0.00 0.00 57.00 56.70 1g1l n GLN 127 Cb 0.53 -1.58 0.08 0.00 1.02 0.00 0.00 30.24 30.29 1g1l n GLN 127 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1g1l s ARG 128 N -3.05 2.31 -0.11 -1.09 0.52 -1.05 -4.96 118.95 111.53 1g1l s ARG 128 Ca 0.11 1.62 0.15 0.00 -0.52 0.00 0.00 55.73 57.09 1g1l s ARG 128 Cb 0.16 -1.87 0.25 0.00 0.52 0.00 0.00 34.95 34.01 1g1l s ARG 128 CO 0.64 -1.67 1.13 1.04 0.02 0.00 0.00 175.30 176.46 1g1l n GLN 129 N -2.68 1.04 -3.57 3.54 6.02 -1.26 -5.05 117.38 115.41 1g1l n GLN 129 Ca 0.12 -2.32 -0.13 0.00 -0.01 0.00 0.00 57.00 54.66 1g1l n GLN 129 Cb 0.51 -1.30 -0.05 0.00 1.02 0.00 0.00 30.24 30.42 1g1l n GLN 129 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1g1l s THR 130 N -2.32 0.03 0.00 5.09 -1.32 -1.26 -4.95 115.64 110.92 1g1l s THR 130 Ca 0.26 -0.28 0.00 0.00 -1.21 0.00 0.00 61.69 60.47 1g1l s THR 130 Cb 0.24 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.23 1g1l s THR 130 CO 0.01 -0.15 0.00 0.61 -2.21 0.00 0.00 174.62 172.88 1g1l n GLY 131 N 0.28 -0.02 3.37 6.08 0.00 -1.26 -4.80 105.19 108.84 1g1l n GLY 131 Ca -0.18 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 44.57 1g1l n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g1l s ALA 132 N -1.78 2.33 -0.05 4.61 0.00 -0.40 -1.16 121.76 125.31 1g1l s ALA 132 Ca 0.00 -1.34 0.04 0.00 0.00 0.00 0.00 51.96 50.66 1g1l s ALA 132 Cb 0.00 -0.46 -0.00 0.00 0.00 0.00 0.00 23.12 22.66 1g1l s ALA 132 CO 0.00 0.54 -0.16 -1.12 0.00 0.00 0.00 175.76 175.02 1g1l s SER 133 N -1.56 2.10 0.15 0.00 0.01 0.05 -0.26 113.70 114.19 1g1l s SER 133 Ca 0.13 -0.35 -0.01 0.00 1.31 0.00 0.00 55.95 57.03 1g1l s SER 133 Cb -0.10 -0.67 -0.04 0.00 0.21 0.00 0.00 66.02 65.42 1g1l s SER 133 CO 0.04 0.13 0.07 0.68 0.41 0.00 0.00 173.24 174.57 1g1l s VAL 134 N 0.16 0.08 -0.06 3.43 -7.23 -0.60 -1.02 120.40 115.16 1g1l s VAL 134 Ca -0.06 -1.92 0.04 0.00 -1.81 0.00 0.00 61.98 58.22 1g1l s VAL 134 Cb -0.12 -2.14 0.00 0.00 0.56 0.00 0.00 36.38 34.68 1g1l s VAL 134 CO 0.03 -0.37 -0.17 -0.36 -0.31 0.00 0.00 175.10 173.91 1g1l s PHE 135 N -4.07 1.82 -0.14 2.82 0.40 -1.26 -1.26 117.98 116.29 1g1l s PHE 135 Ca 0.27 -0.59 -0.05 0.00 -0.60 0.00 0.00 56.93 55.96 1g1l s PHE 135 Cb 0.07 -1.24 -0.04 0.00 0.51 0.00 0.00 43.02 42.33 1g1l s PHE 135 CO 0.04 -0.23 0.03 0.00 0.70 0.00 0.00 175.22 175.76 1g1l s ALA 136 N 0.21 3.32 -0.04 5.36 0.00 0.36 -1.39 121.76 129.57 1g1l s ALA 136 Ca -0.08 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.11 1g1l s ALA 136 Cb -0.13 -1.70 0.03 0.00 0.00 0.00 0.00 23.12 21.31 1g1l s ALA 136 CO 0.04 0.36 -0.01 -0.47 0.00 0.00 0.00 175.76 175.68 1g1l s TYR 137 N -0.16 0.46 0.15 0.00 5.04 -0.11 -0.93 117.35 121.80 1g1l s TYR 137 Ca 0.06 -0.06 -0.31 0.00 -2.44 0.00 0.00 57.07 54.31 1g1l s TYR 137 Cb -0.12 -0.54 -0.09 0.00 0.35 0.00 0.00 41.96 41.55 1g1l s TYR 137 CO 0.02 -0.18 1.48 -1.58 -1.34 0.00 0.00 175.55 173.95 1g1l s HIS 138 N 1.23 3.14 0.11 4.97 5.65 -1.26 -1.14 115.29 128.00 1g1l s HIS 138 Ca -0.07 0.79 0.01 0.00 0.25 0.00 0.00 55.06 56.05 1g1l s HIS 138 Cb -0.13 -3.82 -0.04 0.00 -1.18 0.00 0.00 32.58 27.41 1g1l s HIS 138 CO -0.02 -2.93 -0.03 0.14 -0.65 0.00 0.00 174.74 171.25 1g1l s VAL 139 N 1.05 0.56 0.15 0.89 -7.23 -0.24 -4.95 120.40 110.64 1g1l s VAL 139 Ca 0.67 -1.93 -0.05 0.00 -1.81 0.00 0.00 61.98 58.86 1g1l s VAL 139 Cb -0.41 -1.80 -0.12 0.00 0.56 0.00 0.00 36.38 34.61 1g1l s VAL 139 CO 0.31 -0.76 1.39 0.25 -0.31 0.00 0.00 175.10 175.99 1g1l h LEU 140 N 2.92 0.63 -6.29 1.32 5.85 -1.95 -3.40 115.31 114.39 1g1l h LEU 140 Ca -0.35 -0.42 -0.59 0.00 0.84 0.00 0.00 57.88 57.36 1g1l h LEU 140 Cb 1.17 -0.19 -0.41 0.00 0.37 0.00 0.00 40.66 41.61 1g1l h LEU 140 CO 0.64 1.17 -0.77 0.47 -0.34 0.00 0.00 178.44 179.61 1g1l n ASP 141 N -3.87 2.21 0.32 1.25 8.00 -1.26 -4.92 116.55 118.29 1g1l n ASP 141 Ca -0.05 -3.09 0.19 0.00 0.71 0.00 0.00 54.79 52.55 1g1l n ASP 141 Cb 0.72 -0.66 1.07 0.00 -0.02 0.00 0.00 41.12 42.23 1g1l n ASP 141 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1g1l h PRO 142 N 4.46 0.00 0.00 -0.24 0.13 -1.88 -2.70 132.00 131.77 1g1l h PRO 142 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1g1l h PRO 142 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1g1l h PRO 142 CO 0.67 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.59 1g1l n GLU 143 N -3.47 0.15 0.00 0.86 0.00 -1.26 -1.57 120.64 115.35 1g1l n GLU 143 Ca -0.03 0.60 0.14 0.00 0.00 0.00 0.00 57.16 57.87 1g1l n GLU 143 Cb 0.08 -1.95 0.65 0.00 0.00 0.00 0.00 31.44 30.22 1g1l n GLU 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1g1l n ARG 144 N -2.26 1.13 -4.36 3.44 1.74 -1.02 -4.18 116.66 111.16 1g1l n ARG 144 Ca -0.01 -0.46 -0.19 0.00 -0.77 0.00 0.00 57.85 56.42 1g1l n ARG 144 Cb 0.07 -1.49 -0.09 0.00 -1.02 0.00 0.00 32.46 29.93 1g1l n ARG 144 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1g1l s TYR 145 N -2.18 1.63 0.19 -1.55 1.51 -0.61 -4.85 117.35 111.49 1g1l s TYR 145 Ca 0.37 -1.31 -0.30 0.00 -1.01 0.00 0.00 57.07 54.81 1g1l s TYR 145 Cb 0.21 -0.92 -0.09 0.00 -0.11 0.00 0.00 41.96 41.05 1g1l s TYR 145 CO 0.40 -0.44 1.39 0.20 -1.11 0.00 0.00 175.55 175.99 1g1l s GLY 146 N -3.40 2.21 -0.07 0.71 0.00 -1.26 -1.24 107.32 104.27 1g1l s GLY 146 Ca 0.35 1.20 0.05 0.00 0.00 0.00 0.00 44.72 46.32 1g1l s GLY 146 CO 0.17 2.26 -0.24 0.14 0.00 0.00 0.00 173.10 175.42 1g1l s VAL 147 N 0.42 1.98 -0.14 1.40 1.01 0.49 -0.51 120.40 125.07 1g1l s VAL 147 Ca 0.61 -1.01 -0.02 0.00 0.00 0.00 0.00 61.98 61.55 1g1l s VAL 147 Cb -0.39 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 1g1l s VAL 147 CO 0.37 0.55 -0.06 0.54 0.00 0.00 0.00 175.10 176.49 1g1l s VAL 148 N -0.01 3.66 -0.11 2.92 0.11 -0.63 -1.61 120.40 124.74 1g1l s VAL 148 Ca -0.07 -0.45 -0.03 0.00 -2.93 0.00 0.00 61.98 58.49 1g1l s VAL 148 Cb -0.15 -2.57 -0.03 0.00 -1.53 0.00 0.00 36.38 32.10 1g1l s VAL 148 CO 0.05 0.52 0.02 -0.70 -3.33 0.00 0.00 175.10 171.65 1g1l s GLU 149 N 0.20 3.20 0.16 1.54 2.12 -0.62 -4.43 118.70 120.87 1g1l s GLU 149 Ca -0.04 -0.38 0.08 0.00 0.36 0.00 0.00 54.97 55.00 1g1l s GLU 149 Cb -0.14 -2.89 -0.04 0.00 0.26 0.00 0.00 34.13 31.31 1g1l s GLU 149 CO 0.03 0.63 -0.10 -0.06 -0.54 0.00 0.00 175.26 175.22 1g1l s PHE 150 N -0.66 2.66 0.83 5.30 0.40 -1.26 -0.44 117.98 124.81 1g1l s PHE 150 Ca 0.11 -0.21 -0.13 0.00 -0.60 0.00 0.00 56.93 56.10 1g1l s PHE 150 Cb -0.12 -1.32 0.19 0.00 0.51 0.00 0.00 43.02 42.28 1g1l s PHE 150 CO 0.02 0.49 1.13 -0.40 0.70 0.00 0.00 175.22 177.16 1g1l n ASP 151 N 0.21 0.19 0.21 1.36 5.68 0.71 -4.88 116.55 120.03 1g1l n ASP 151 Ca -0.12 -1.47 0.15 0.00 -0.50 0.00 0.00 54.79 52.85 1g1l n ASP 151 Cb 0.55 -0.85 0.72 0.00 -1.14 0.00 0.00 41.12 40.40 1g1l n ASP 151 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1g1l h GLN 152 N 0.00 0.00 -0.02 0.11 1.08 -2.01 -1.74 115.11 112.53 1g1l h GLN 152 Ca -0.36 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.84 1g1l h GLN 152 Cb 1.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.46 1g1l h GLN 152 CO 0.27 0.00 -0.09 0.41 -0.95 0.00 0.00 178.83 178.47 1g1l n GLY 153 N -0.71 -0.01 0.69 3.46 0.00 -1.26 -4.92 105.19 102.44 1g1l n GLY 153 Ca -0.01 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1g1l n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g1l n GLY 154 N 1.25 0.77 3.72 -0.02 0.00 -0.65 -5.06 105.19 105.20 1g1l n GLY 154 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1g1l n GLY 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1g1l s LYS 155 N -0.71 4.38 0.17 1.61 2.20 -1.26 -4.80 119.74 121.33 1g1l s LYS 155 Ca 0.00 0.66 -0.32 0.00 -0.36 0.00 0.00 55.97 55.95 1g1l s LYS 155 Cb 0.00 -3.43 -0.12 0.00 -1.51 0.00 0.00 37.83 32.77 1g1l s LYS 155 CO 0.00 0.13 1.75 0.00 -0.36 0.00 0.00 175.35 176.87 1g1l n ALA 156 N 3.64 2.48 0.00 3.13 0.00 -1.26 -0.21 120.51 128.29 1g1l n ALA 156 Ca -0.04 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1g1l n ALA 156 Cb 0.51 -2.53 0.00 0.00 0.00 0.00 0.00 19.45 17.43 1g1l n ALA 156 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1g1l n ILE 157 N 4.16 0.00 -3.64 0.00 -5.35 0.42 -4.88 119.36 110.07 1g1l n ILE 157 Ca 0.17 0.00 -0.12 0.00 -0.27 0.00 0.00 62.75 62.53 1g1l n ILE 157 Cb 0.35 0.27 -0.05 0.00 -1.74 0.00 0.00 39.64 38.47 1g1l n ILE 157 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1g1l s SER 158 N -1.80 -0.27 -0.03 7.28 1.04 -1.18 -5.01 113.70 113.73 1g1l s SER 158 Ca 0.00 -0.15 0.02 0.00 0.48 0.00 0.00 55.95 56.30 1g1l s SER 158 Cb 0.00 0.46 0.01 0.00 0.10 0.00 0.00 66.02 66.58 1g1l s SER 158 CO 0.00 -0.77 -0.09 -0.76 0.98 0.00 0.00 173.24 172.60 1g1l s LEU 159 N -2.43 1.74 -0.02 2.42 1.43 -1.26 -1.59 118.68 118.97 1g1l s LEU 159 Ca -0.01 -0.20 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 1g1l s LEU 159 Cb 0.01 -0.57 0.01 0.00 0.03 0.00 0.00 46.19 45.66 1g1l s LEU 159 CO -0.07 0.06 -0.03 -1.61 0.23 0.00 0.00 176.35 174.92 1g1l s GLU 160 N 0.29 0.42 -0.24 1.70 2.02 -0.63 -4.98 118.70 117.27 1g1l s GLU 160 Ca -0.05 -0.09 -0.20 0.00 0.02 0.00 0.00 54.97 54.65 1g1l s GLU 160 Cb -0.10 -0.46 -0.02 0.00 0.10 0.00 0.00 34.13 33.65 1g1l s GLU 160 CO 0.01 0.01 0.61 -2.00 0.02 0.00 0.00 175.26 173.91 1g1l s GLU 161 N 0.35 4.13 -1.35 1.61 2.56 -1.26 -0.38 118.70 124.36 1g1l s GLU 161 Ca -0.04 0.53 -0.06 0.00 0.00 0.00 0.00 54.97 55.40 1g1l s GLU 161 Cb -0.07 -3.63 0.00 0.00 2.00 0.00 0.00 34.13 32.43 1g1l s GLU 161 CO -0.00 -0.36 0.48 1.63 -0.56 0.00 0.00 175.26 176.44 1g1l n LYS 162 N 5.52 -2.58 -2.07 4.30 5.02 -0.37 -4.90 118.16 123.07 1g1l n LYS 162 Ca -0.01 0.37 -0.41 0.00 -2.02 0.00 0.00 58.31 56.24 1g1l n LYS 162 Cb 0.49 -4.27 -0.02 0.00 -0.02 0.00 0.00 35.03 31.20 1g1l n LYS 162 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1g1l s PRO 163 N -6.55 4.30 0.41 1.97 0.04 -1.26 -4.91 135.00 129.00 1g1l s PRO 163 Ca 0.12 2.23 0.10 0.00 0.04 0.00 0.00 61.00 63.49 1g1l s PRO 163 Cb -0.05 -3.13 0.86 0.00 0.04 0.00 0.00 34.50 32.22 1g1l s PRO 163 CO 0.90 -0.37 1.96 -0.07 0.04 0.00 0.00 177.00 179.46 1g1l h LEU 164 N 5.07 0.22 -6.94 -3.56 3.38 -1.90 -3.32 115.31 108.26 1g1l h LEU 164 Ca -0.46 -0.03 -0.61 0.00 0.09 0.00 0.00 57.88 56.87 1g1l h LEU 164 Cb 1.22 -0.06 -0.40 0.00 0.09 0.00 0.00 40.66 41.51 1g1l h LEU 164 CO 0.77 0.32 -0.72 -1.61 0.09 0.00 0.00 178.44 177.30 1g1l s GLU 165 N -4.86 1.68 0.36 1.13 2.02 -1.26 -4.98 118.70 112.79 1g1l s GLU 165 Ca -0.06 -2.54 -0.28 0.00 0.02 0.00 0.00 54.97 52.11 1g1l s GLU 165 Cb 0.16 -2.63 -0.11 0.00 0.10 0.00 0.00 34.13 31.65 1g1l s GLU 165 CO 0.72 -1.24 1.44 -2.30 0.02 0.00 0.00 175.26 173.90 1g1l n PRO 166 N 2.84 2.52 0.05 0.39 -0.02 -1.25 -4.91 135.00 134.62 1g1l n PRO 166 Ca 0.16 0.88 0.13 0.00 -2.02 0.00 0.00 63.50 62.66 1g1l n PRO 166 Cb 0.37 -2.58 0.48 0.00 -0.02 0.00 0.00 33.50 31.76 1g1l n PRO 166 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1g1l n LYS 167 N 0.59 0.13 -3.60 -0.52 5.02 -1.26 -4.90 118.16 113.61 1g1l n LYS 167 Ca 0.03 0.09 -0.10 0.00 -2.02 0.00 0.00 58.31 56.32 1g1l n LYS 167 Cb 0.38 -1.64 0.01 0.00 -0.02 0.00 0.00 35.03 33.76 1g1l n LYS 167 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1g1l n SER 168 N -1.85 -1.89 -1.60 4.39 3.41 -1.26 -4.92 113.62 109.90 1g1l n SER 168 Ca 0.06 -2.53 0.10 0.00 -0.26 0.00 0.00 58.87 56.24 1g1l n SER 168 Cb 0.38 3.22 0.36 0.00 -0.26 0.00 0.00 64.21 67.91 1g1l n SER 168 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1g1l n ASN 169 N -1.53 4.76 -4.51 4.04 3.02 -1.26 -4.83 115.26 114.94 1g1l n ASN 169 Ca -0.06 -2.41 -0.41 0.00 -0.03 0.00 0.00 54.58 51.67 1g1l n ASN 169 Cb 0.54 -0.58 -0.10 0.00 -0.61 0.00 0.00 39.78 39.03 1g1l n ASN 169 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1g1l s TYR 170 N -1.77 3.23 0.28 3.10 1.51 -1.26 -1.07 117.35 121.36 1g1l s TYR 170 Ca 0.52 -0.30 -0.11 0.00 -1.01 0.00 0.00 57.07 56.17 1g1l s TYR 170 Cb 0.33 -2.52 -0.08 0.00 -0.11 0.00 0.00 41.96 39.58 1g1l s TYR 170 CO 0.26 -0.42 0.63 0.00 -1.11 0.00 0.00 175.55 174.91 1g1l s ALA 171 N 1.73 3.47 -0.37 3.71 0.00 -0.29 -1.60 121.76 128.40 1g1l s ALA 171 Ca 0.06 -0.16 -0.17 0.00 0.00 0.00 0.00 51.96 51.69 1g1l s ALA 171 Cb -0.18 -2.57 0.00 0.00 0.00 0.00 0.00 23.12 20.38 1g1l s ALA 171 CO 0.10 0.41 0.44 0.08 0.00 0.00 0.00 175.76 176.79 1g1l s VAL 172 N -1.92 5.08 0.93 0.00 1.01 0.34 -0.93 120.40 124.91 1g1l s VAL 172 Ca 0.50 0.03 -0.12 0.00 0.00 0.00 0.00 61.98 62.39 1g1l s VAL 172 Cb -0.11 -3.94 0.15 0.00 0.00 0.00 0.00 36.38 32.48 1g1l s VAL 172 CO 0.21 -0.24 1.12 0.42 0.00 0.00 0.00 175.10 176.60 1g1l s THR 173 N 2.21 2.18 -0.14 3.92 -4.23 -0.49 -4.44 115.64 114.64 1g1l s THR 173 Ca 0.14 0.06 -0.05 0.00 -1.18 0.00 0.00 61.69 60.66 1g1l s THR 173 Cb -0.16 -2.71 -0.15 0.00 1.34 0.00 0.00 72.50 70.82 1g1l s THR 173 CO 0.13 -0.08 3.26 0.61 -0.54 0.00 0.00 174.62 178.00 1g1l n GLY 174 N -1.78 3.41 2.82 3.99 0.00 -1.26 -4.74 105.19 107.62 1g1l n GLY 174 Ca 0.06 -1.35 -0.17 0.00 0.00 0.00 0.00 46.02 44.56 1g1l n GLY 174 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1g1l s LEU 175 N -0.70 -0.07 -0.03 0.99 2.96 -1.26 -1.50 118.68 119.08 1g1l s LEU 175 Ca 0.61 0.24 0.00 0.00 -0.22 0.00 0.00 54.13 54.75 1g1l s LEU 175 Cb 0.32 0.27 0.03 0.00 0.50 0.00 0.00 46.19 47.31 1g1l s LEU 175 CO -0.07 -0.26 0.01 -0.31 -1.32 0.00 0.00 176.35 174.41 1g1l s TYR 176 N 2.29 0.22 -0.15 5.38 1.51 0.17 -4.29 117.35 122.48 1g1l s TYR 176 Ca 0.03 0.05 -0.00 0.00 -1.01 0.00 0.00 57.07 56.14 1g1l s TYR 176 Cb -0.13 -0.36 -0.01 0.00 -0.11 0.00 0.00 41.96 41.35 1g1l s TYR 176 CO -0.07 -0.12 -0.13 -0.06 -1.11 0.00 0.00 175.55 174.07 1g1l s PHE 177 N 1.10 2.82 0.07 2.71 0.40 -0.19 -0.40 117.98 124.49 1g1l s PHE 177 Ca -0.09 -0.76 0.07 0.00 -0.60 0.00 0.00 56.93 55.55 1g1l s PHE 177 Cb -0.13 -1.88 -0.03 0.00 0.51 0.00 0.00 43.02 41.49 1g1l s PHE 177 CO -0.02 -0.30 -0.18 0.71 0.70 0.00 0.00 175.22 176.13 1g1l s TYR 178 N 0.57 1.56 0.00 0.36 1.51 0.42 -0.77 117.35 121.00 1g1l s TYR 178 Ca -0.08 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.58 1g1l s TYR 178 Cb -0.16 -0.89 0.00 0.00 -0.11 0.00 0.00 41.96 40.81 1g1l s TYR 178 CO 0.03 0.11 0.00 -0.40 -1.11 0.00 0.00 175.55 174.19 1g1l n ASP 179 N 1.48 0.00 0.00 2.29 5.68 -0.31 -1.33 116.55 124.36 1g1l n ASP 179 Ca -0.19 -0.47 0.13 0.00 -0.50 0.00 0.00 54.79 53.76 1g1l n ASP 179 Cb 0.54 0.00 0.73 0.00 -1.14 0.00 0.00 41.12 41.25 1g1l n ASP 179 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1g1l n GLN 180 N -0.47 0.70 0.10 0.11 6.02 -1.26 -3.38 117.38 119.20 1g1l n GLN 180 Ca 0.00 0.01 0.13 0.00 -0.01 0.00 0.00 57.00 57.13 1g1l n GLN 180 Cb 0.00 -1.50 0.39 0.00 1.02 0.00 0.00 30.24 30.15 1g1l n GLN 180 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1g1l n GLN 181 N -1.06 0.26 -0.18 -1.09 6.02 -1.26 -4.36 117.38 115.71 1g1l n GLN 181 Ca 0.18 0.20 -0.11 0.00 -0.01 0.00 0.00 57.00 57.26 1g1l n GLN 181 Cb 0.11 -1.80 0.01 0.00 1.02 0.00 0.00 30.24 29.58 1g1l n GLN 181 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.06 175.81 1g1l h VAL 182 N 0.00 1.27 -0.48 5.09 3.04 -1.94 -2.77 116.25 120.46 1g1l h VAL 182 Ca 0.00 -1.30 -0.00 0.00 -1.01 0.00 0.00 66.70 64.38 1g1l h VAL 182 Cb 0.74 1.01 -0.02 0.00 -2.01 0.00 0.00 31.29 31.00 1g1l h VAL 182 CO 0.00 0.46 0.28 0.58 -1.01 0.00 0.00 177.57 177.88 1g1l h VAL 183 N 0.90 1.15 -0.39 1.51 2.07 -1.87 -0.13 116.25 119.49 1g1l h VAL 183 Ca 0.13 -0.36 -0.06 0.00 0.82 0.00 0.00 66.70 67.23 1g1l h VAL 183 Cb 0.72 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 1g1l h VAL 183 CO 0.05 0.16 -0.00 0.44 0.02 0.00 0.00 177.57 178.24 1g1l h ASP 184 N 0.64 0.59 0.02 0.57 3.32 -1.80 0.50 116.42 120.25 1g1l h ASP 184 Ca 0.17 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 1g1l h ASP 184 Cb 0.01 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.40 1g1l h ASP 184 CO -0.03 0.66 -0.01 0.40 -1.72 0.00 0.00 179.24 178.54 1g1l h ILE 185 N 0.59 1.06 -0.77 0.35 2.04 -1.18 -2.75 117.51 116.85 1g1l h ILE 185 Ca 0.12 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.74 1g1l h ILE 185 Cb 0.38 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 37.65 1g1l h ILE 185 CO 0.01 0.06 0.48 0.00 0.00 0.00 0.00 178.15 178.71 1g1l h ALA 186 N 0.86 1.39 0.00 1.87 0.00 -0.52 -1.88 119.26 120.98 1g1l h ALA 186 Ca -0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1g1l h ALA 186 Cb 0.12 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1g1l h ALA 186 CO 0.00 0.54 -0.14 0.00 0.00 0.00 0.00 179.25 179.65 1g1l h ARG 187 N 1.06 0.00 -0.01 0.00 3.08 -0.73 -2.03 114.38 115.76 1g1l h ARG 187 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.33 1g1l h ARG 187 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.98 1g1l h ARG 187 CO -0.06 0.14 -0.39 -0.25 -1.07 0.00 0.00 179.97 178.35 1g1l n ASP 188 N -4.06 1.13 -4.77 7.04 8.00 -0.73 -4.95 116.55 118.21 1g1l n ASP 188 Ca -0.02 -0.91 -0.36 0.00 0.71 0.00 0.00 54.79 54.21 1g1l n ASP 188 Cb 0.22 0.27 -0.01 0.00 -0.02 0.00 0.00 41.12 41.59 1g1l n ASP 188 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1g1l s LEU 189 N -2.61 3.84 0.18 0.64 1.43 -0.76 -5.06 118.68 116.34 1g1l s LEU 189 Ca 0.20 2.19 0.11 0.00 -1.03 0.00 0.00 54.13 55.60 1g1l s LEU 189 Cb 0.19 -4.48 -0.04 0.00 0.03 0.00 0.00 46.19 41.89 1g1l s LEU 189 CO 0.58 -1.08 -0.24 -0.54 0.23 0.00 0.00 176.35 175.30 1g1l s LYS 190 N -3.10 1.52 0.48 1.70 -0.14 -1.26 -5.08 119.74 113.86 1g1l s LYS 190 Ca 0.69 -1.49 -0.24 0.00 -1.36 0.00 0.00 55.97 53.57 1g1l s LYS 190 Cb -0.25 -1.86 -0.08 0.00 -1.68 0.00 0.00 37.83 33.96 1g1l s LYS 190 CO 0.28 0.41 1.32 -2.30 -0.76 0.00 0.00 175.35 174.30 1g1l n PRO 191 N 0.34 1.89 -2.02 -1.68 -0.02 -1.26 -4.73 135.00 127.52 1g1l n PRO 191 Ca -0.13 0.68 -0.29 0.00 -2.02 0.00 0.00 63.50 61.74 1g1l n PRO 191 Cb 0.56 -2.49 0.19 0.00 -0.02 0.00 0.00 33.50 31.73 1g1l n PRO 191 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1g1l s SER 192 N -0.66 3.11 0.38 2.55 1.04 0.53 -4.84 113.70 115.81 1g1l s SER 192 Ca 0.65 0.12 0.04 0.00 0.48 0.00 0.00 55.95 57.24 1g1l s SER 192 Cb -0.46 -0.14 0.74 0.00 0.10 0.00 0.00 66.02 66.25 1g1l s SER 192 CO 0.55 -2.72 2.03 -0.65 0.98 0.00 0.00 173.24 173.42 1g1l h PRO 193 N -1.57 0.70 0.00 4.02 0.11 -1.94 0.69 132.00 134.01 1g1l h PRO 193 Ca -0.43 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1g1l h PRO 193 Cb 1.23 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1g1l h PRO 193 CO 0.35 0.46 0.00 0.54 -0.21 0.00 0.00 178.00 179.14 1g1l n ARG 194 N -4.46 0.12 -0.84 1.05 1.74 -1.26 -4.84 116.66 108.19 1g1l n ARG 194 Ca 0.05 0.57 0.00 0.00 -0.77 0.00 0.00 57.85 57.70 1g1l n ARG 194 Cb 0.05 -1.86 0.00 0.00 -1.02 0.00 0.00 32.46 29.63 1g1l n ARG 194 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1g1l n GLY 195 N -1.06 0.64 3.28 -0.13 0.00 0.24 -5.07 105.19 103.08 1g1l n GLY 195 Ca -0.00 -0.73 -0.18 0.00 0.00 0.00 0.00 46.02 45.11 1g1l n GLY 195 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1g1l s GLU 196 N -1.74 1.15 -0.63 1.61 0.41 -1.26 -4.78 118.70 113.46 1g1l s GLU 196 Ca 0.00 -1.38 -0.23 0.00 -0.41 0.00 0.00 54.97 52.95 1g1l s GLU 196 Cb 0.00 -1.00 0.06 0.00 -1.78 0.00 0.00 34.13 31.42 1g1l s GLU 196 CO 0.00 0.18 0.94 -0.51 -0.49 0.00 0.00 175.26 175.38 1g1l s LEU 197 N -2.80 4.36 0.20 1.80 1.43 -0.32 -0.34 118.68 123.02 1g1l s LEU 197 Ca 0.14 -0.87 -0.27 0.00 -1.03 0.00 0.00 54.13 52.11 1g1l s LEU 197 Cb -0.03 -2.49 -0.08 0.00 0.03 0.00 0.00 46.19 43.61 1g1l s LEU 197 CO 0.04 -1.38 0.84 -1.61 0.23 0.00 0.00 176.35 174.47 1g1l s GLU 198 N 3.97 4.65 0.32 1.70 0.41 -1.26 -1.34 118.70 127.15 1g1l s GLU 198 Ca 0.23 1.26 0.14 0.00 -0.41 0.00 0.00 54.97 56.20 1g1l s GLU 198 Cb -0.16 -3.22 0.50 0.00 -1.78 0.00 0.00 34.13 29.48 1g1l s GLU 198 CO 0.12 0.53 1.67 0.97 -0.49 0.00 0.00 175.26 178.05 1g1l h ILE 199 N 3.18 1.17 -0.02 -1.63 6.09 -1.95 -2.10 117.51 122.26 1g1l h ILE 199 Ca -0.46 -1.84 -0.09 0.00 -1.37 0.00 0.00 64.86 61.09 1g1l h ILE 199 Cb 1.20 2.05 -0.01 0.00 0.47 0.00 0.00 36.82 40.53 1g1l h ILE 199 CO 0.67 0.49 -0.43 0.74 -3.07 0.00 0.00 178.15 176.55 1g1l h THR 200 N 0.00 1.31 -0.10 2.19 2.02 -1.99 0.03 112.91 116.38 1g1l h THR 200 Ca -0.01 -1.49 -0.19 0.00 0.77 0.00 0.00 66.41 65.49 1g1l h THR 200 Cb 1.01 1.79 -0.00 0.00 -1.74 0.00 0.00 68.15 69.20 1g1l h THR 200 CO 0.07 0.43 -0.74 0.44 0.37 0.00 0.00 175.52 176.09 1g1l h ASP 201 N 0.03 0.58 0.13 4.18 3.32 -1.80 -0.25 116.42 122.61 1g1l h ASP 201 Ca -0.00 -0.38 0.01 0.00 0.02 0.00 0.00 57.03 56.68 1g1l h ASP 201 Cb 0.78 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 1g1l h ASP 201 CO 0.06 1.13 -0.18 0.58 -1.72 0.00 0.00 179.24 179.10 1g1l h VAL 202 N 0.33 0.59 -0.48 -1.35 2.07 -0.83 -2.18 116.25 114.39 1g1l h VAL 202 Ca -0.03 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.50 1g1l h VAL 202 Cb 1.32 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 1g1l h VAL 202 CO 0.13 0.00 0.32 0.78 0.02 0.00 0.00 177.57 178.82 1g1l h ASN 203 N -0.37 0.53 0.19 0.57 2.35 -0.80 -1.96 115.58 116.10 1g1l h ASN 203 Ca 0.02 -0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.65 1g1l h ASN 203 Cb 0.37 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 1g1l h ASN 203 CO -0.08 0.38 -0.38 -0.09 -1.65 0.00 0.00 177.43 175.61 1g1l h ARG 204 N 0.62 0.26 -0.46 0.81 2.43 -0.84 -0.34 114.38 116.87 1g1l h ARG 204 Ca 0.18 -0.12 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 1g1l h ARG 204 Cb -0.02 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 1g1l h ARG 204 CO -0.04 0.61 0.13 0.00 -1.51 0.00 0.00 179.97 179.15 1g1l h ALA 205 N 1.39 0.60 -0.80 2.80 0.00 -0.72 0.15 119.26 122.68 1g1l h ALA 205 Ca 0.02 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1g1l h ALA 205 Cb 0.77 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 1g1l h ALA 205 CO 0.06 0.27 0.47 1.88 0.00 0.00 0.00 179.25 181.93 1g1l h TYR 206 N 0.60 1.07 -0.45 0.00 -1.99 -1.12 -2.94 116.97 112.15 1g1l h TYR 206 Ca 0.15 -0.01 -0.04 0.00 2.00 0.00 0.00 58.73 60.83 1g1l h TYR 206 Cb 0.29 -0.35 -0.02 0.00 2.00 0.00 0.00 36.73 38.65 1g1l h TYR 206 CO 0.02 0.73 0.12 1.25 -0.00 0.00 0.00 178.16 180.27 1g1l h LEU 207 N 1.11 0.68 -1.42 3.88 5.85 -0.70 -0.07 115.31 124.64 1g1l h LEU 207 Ca 0.29 -0.22 0.07 0.00 0.84 0.00 0.00 57.88 58.85 1g1l h LEU 207 Cb -0.02 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 40.79 1g1l h LEU 207 CO -0.05 0.72 0.46 -0.33 -0.34 0.00 0.00 178.44 178.90 1g1l h GLU 208 N 0.60 0.68 -0.16 1.25 5.08 -0.88 -1.29 114.58 119.84 1g1l h GLU 208 Ca 0.14 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1g1l h GLU 208 Cb 0.30 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1g1l h GLU 208 CO -0.00 0.45 0.00 0.54 -1.00 0.00 0.00 179.01 179.00 1g1l n ARG 209 N -4.48 1.52 -1.70 2.33 1.74 -0.89 -4.92 116.66 110.26 1g1l n ARG 209 Ca 0.10 -0.79 -0.11 0.00 -0.77 0.00 0.00 57.85 56.28 1g1l n ARG 209 Cb 0.25 -1.29 -0.03 0.00 -1.02 0.00 0.00 32.46 30.37 1g1l n ARG 209 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1g1l n GLY 210 N 0.96 0.70 0.23 -0.13 0.00 -0.49 -4.92 105.19 101.54 1g1l n GLY 210 Ca 0.12 -0.46 0.07 0.00 0.00 0.00 0.00 46.02 45.75 1g1l n GLY 210 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1g1l n GLN 211 N -2.43 2.03 -3.59 1.61 6.02 -0.09 -4.96 117.38 115.97 1g1l n GLN 211 Ca -0.12 -2.35 -0.39 0.00 -0.01 0.00 0.00 57.00 54.13 1g1l n GLN 211 Cb 0.47 -1.43 -0.11 0.00 1.02 0.00 0.00 30.24 30.19 1g1l n GLN 211 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1g1l s LEU 212 N -2.34 4.17 -0.29 1.08 2.96 -1.19 -1.28 118.68 121.79 1g1l s LEU 212 Ca 0.26 -0.24 -0.16 0.00 -0.22 0.00 0.00 54.13 53.77 1g1l s LEU 212 Cb 0.22 -2.10 -0.03 0.00 0.50 0.00 0.00 46.19 44.79 1g1l s LEU 212 CO 0.04 -0.13 0.43 -0.55 -1.32 0.00 0.00 176.35 174.82 1g1l s SER 213 N 1.72 6.30 -0.38 3.68 0.15 0.63 -4.92 113.70 120.88 1g1l s SER 213 Ca 0.06 0.22 -0.08 0.00 0.70 0.00 0.00 55.95 56.85 1g1l s SER 213 Cb -0.17 -2.24 0.05 0.00 -1.71 0.00 0.00 66.02 61.96 1g1l s SER 213 CO 0.10 -0.29 0.18 -0.69 1.20 0.00 0.00 173.24 173.74 1g1l s VAL 214 N 2.19 4.10 -0.07 4.45 1.01 -1.26 -1.56 120.40 129.26 1g1l s VAL 214 Ca 0.17 -1.18 -0.14 0.00 0.00 0.00 0.00 61.98 60.82 1g1l s VAL 214 Cb -0.16 -3.39 -0.05 0.00 0.00 0.00 0.00 36.38 32.78 1g1l s VAL 214 CO 0.11 -0.32 0.36 -1.61 0.00 0.00 0.00 175.10 173.64 1g1l s GLU 215 N 1.44 4.03 -0.02 2.72 0.41 -0.39 -4.92 118.70 121.97 1g1l s GLU 215 Ca 0.01 0.28 -0.30 0.00 -0.41 0.00 0.00 54.97 54.55 1g1l s GLU 215 Cb -0.21 -3.31 -0.03 0.00 -1.78 0.00 0.00 34.13 28.81 1g1l s GLU 215 CO 0.03 0.50 1.03 0.42 -0.49 0.00 0.00 175.26 176.75 1g1l s ILE 216 N -0.39 4.68 -0.41 -1.63 -1.09 -1.26 -0.49 121.20 120.61 1g1l s ILE 216 Ca 0.21 1.93 -0.18 0.00 -2.23 0.00 0.00 60.65 60.39 1g1l s ILE 216 Cb -0.15 -4.24 0.02 0.00 -1.58 0.00 0.00 42.46 36.51 1g1l s ILE 216 CO 0.09 0.11 0.48 -0.32 -1.23 0.00 0.00 174.94 174.07 1g1l s MET 217 N 1.34 3.21 0.97 2.79 -2.45 -0.11 -4.89 119.30 120.16 1g1l s MET 217 Ca 0.52 -0.61 -0.13 0.00 -1.25 0.00 0.00 55.69 54.23 1g1l s MET 217 Cb -0.22 -3.94 0.17 0.00 1.25 0.00 0.00 34.83 32.10 1g1l s MET 217 CO 0.25 -0.85 1.11 0.20 1.05 0.00 0.00 175.02 176.79 1g1l s GLY 218 N 1.84 1.57 0.58 2.11 0.00 -1.26 -4.56 107.32 107.60 1g1l s GLY 218 Ca 0.15 -0.47 0.37 0.00 0.00 0.00 0.00 44.72 44.76 1g1l s GLY 218 CO 0.15 0.14 2.09 0.07 0.00 0.00 0.00 173.10 175.54 1g1l h ARG 219 N -1.77 0.00 0.00 2.90 0.11 -1.96 -1.00 114.38 112.66 1g1l h ARG 219 Ca -0.53 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.55 1g1l h ARG 219 Cb 1.33 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.41 1g1l h ARG 219 CO 0.59 0.00 -0.01 0.78 0.10 0.00 0.00 179.97 181.43 1g1l h GLY 220 N 1.41 0.00 -3.69 0.08 0.00 -1.98 -3.43 103.07 95.46 1g1l h GLY 220 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 1g1l h GLY 220 CO 0.00 0.00 -0.09 -0.19 0.00 0.00 0.00 176.54 176.26 1g1l s TYR 221 N -3.96 3.47 -0.19 5.60 1.51 -0.38 -4.73 117.35 118.67 1g1l s TYR 221 Ca -0.02 0.95 -0.11 0.00 -1.01 0.00 0.00 57.07 56.88 1g1l s TYR 221 Cb 0.11 -2.31 -0.05 0.00 -0.11 0.00 0.00 41.96 39.60 1g1l s TYR 221 CO 0.47 0.30 0.17 0.00 -1.11 0.00 0.00 175.55 175.38 1g1l s ALA 222 N -1.74 3.68 -0.20 3.71 0.00 0.64 -4.96 121.76 122.89 1g1l s ALA 222 Ca 0.45 -0.63 -0.00 0.00 0.00 0.00 0.00 51.96 51.78 1g1l s ALA 222 Cb -0.12 -2.21 0.05 0.00 0.00 0.00 0.00 23.12 20.84 1g1l s ALA 222 CO 0.20 0.17 -0.05 -0.46 0.00 0.00 0.00 175.76 175.62 1g1l s TRP 223 N 0.31 2.00 0.19 0.00 -0.00 -1.26 -0.63 118.94 119.54 1g1l s TRP 223 Ca 0.10 -1.39 0.09 0.00 -0.00 0.00 0.00 56.10 54.91 1g1l s TRP 223 Cb -0.12 -1.43 -0.04 0.00 -0.00 0.00 0.00 33.47 31.88 1g1l s TRP 223 CO -0.00 -0.69 -0.18 -0.51 -0.00 0.00 0.00 176.95 175.56 1g1l s LEU 224 N 1.53 2.49 -0.00 5.86 1.43 -0.20 -5.00 118.68 124.79 1g1l s LEU 224 Ca -0.02 -0.93 0.04 0.00 -1.03 0.00 0.00 54.13 52.19 1g1l s LEU 224 Cb -0.17 -0.84 -0.01 0.00 0.03 0.00 0.00 46.19 45.19 1g1l s LEU 224 CO -0.07 -0.05 -0.14 1.51 0.23 0.00 0.00 176.35 177.83 1g1l s ASP 225 N -2.96 1.59 -0.31 2.29 1.47 -1.26 -1.13 116.67 116.35 1g1l s ASP 225 Ca 0.20 -0.27 0.00 0.00 1.18 0.00 0.00 52.55 53.66 1g1l s ASP 225 Cb -0.04 -0.17 0.30 0.00 -0.34 0.00 0.00 42.92 42.67 1g1l s ASP 225 CO 0.08 0.15 1.79 0.35 0.68 0.00 0.00 175.17 178.22 1g1l n THR 226 N 2.62 2.59 0.20 2.11 -2.24 -0.88 -4.50 114.28 114.19 1g1l n THR 226 Ca -0.15 -1.48 0.08 0.00 -2.27 0.00 0.00 64.05 60.22 1g1l n THR 226 Cb 0.55 -1.05 0.32 0.00 -2.10 0.00 0.00 70.33 68.05 1g1l n THR 226 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1g1l h GLY 227 N 2.41 0.00 -2.33 3.38 0.00 -1.92 -3.40 103.07 101.21 1g1l h GLY 227 Ca 0.34 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 47.11 1g1l h GLY 227 CO 0.76 0.00 -0.60 -0.51 0.00 0.00 0.00 176.54 176.18 1g1l s THR 228 N -3.45 3.04 0.17 4.70 -4.23 -1.26 -4.41 115.64 110.19 1g1l s THR 228 Ca 0.02 -1.87 -0.14 0.00 -1.18 0.00 0.00 61.69 58.52 1g1l s THR 228 Cb 0.09 -2.86 0.06 0.00 1.34 0.00 0.00 72.50 71.13 1g1l s THR 228 CO 0.67 -0.26 1.80 0.45 -0.54 0.00 0.00 174.62 176.74 1g1l h HIS 229 N 1.76 0.70 -0.46 3.99 3.86 -1.88 -1.28 115.15 121.84 1g1l h HIS 229 Ca -0.43 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 58.75 1g1l h HIS 229 Cb 1.25 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 29.47 1g1l h HIS 229 CO 0.67 0.49 0.23 -0.44 0.86 0.00 0.00 177.93 179.75 1g1l h ASP 230 N 0.71 0.60 -0.65 2.45 3.32 -1.97 -2.67 116.42 118.21 1g1l h ASP 230 Ca 0.19 -0.12 -0.05 0.00 0.02 0.00 0.00 57.03 57.07 1g1l h ASP 230 Cb 0.00 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 1g1l h ASP 230 CO -0.03 0.54 0.21 0.77 -1.72 0.00 0.00 179.24 179.01 1g1l h SER 231 N 0.61 0.93 -0.58 6.45 4.64 -1.79 -1.96 113.55 121.85 1g1l h SER 231 Ca 0.16 -0.20 -0.07 0.00 -0.47 0.00 0.00 61.79 61.21 1g1l h SER 231 Cb 0.10 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 61.92 1g1l h SER 231 CO -0.02 0.89 0.12 0.25 -0.87 0.00 0.00 176.83 177.19 1g1l h LEU 232 N 0.93 0.93 0.02 5.97 5.85 -1.18 -0.73 115.31 127.10 1g1l h LEU 232 Ca 0.21 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1g1l h LEU 232 Cb 0.28 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.07 1g1l h LEU 232 CO -0.01 0.92 -0.01 0.25 -0.34 0.00 0.00 178.44 179.25 1g1l h LEU 233 N 0.93 -0.03 -1.05 2.25 5.85 -1.25 -1.30 115.31 120.71 1g1l h LEU 233 Ca 0.19 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1g1l h LEU 233 Cb 0.37 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 1g1l h LEU 233 CO 0.01 0.11 0.51 -0.33 -0.34 0.00 0.00 178.44 178.40 1g1l h GLU 234 N -0.16 1.16 -0.71 1.25 5.08 -1.21 -1.85 114.58 118.14 1g1l h GLU 234 Ca -0.00 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.21 1g1l h GLU 234 Cb 0.15 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 1g1l h GLU 234 CO 0.00 0.82 0.28 0.00 -1.00 0.00 0.00 179.01 179.11 1g1l h ALA 235 N 1.38 0.93 -0.68 3.43 0.00 -0.81 -0.80 119.26 122.71 1g1l h ALA 235 Ca 0.31 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1g1l h ALA 235 Cb -0.05 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 1g1l h ALA 235 CO -0.06 0.56 0.40 0.78 0.00 0.00 0.00 179.25 180.93 1g1l h GLY 236 N 1.02 0.99 1.69 0.00 0.00 -0.62 -1.67 103.07 104.48 1g1l h GLY 236 Ca 0.24 -0.42 -0.08 0.00 0.00 0.00 0.00 47.33 47.07 1g1l h GLY 236 CO -0.02 0.40 -0.21 -1.61 0.00 0.00 0.00 176.54 175.10 1g1l h GLN 237 N 0.92 0.37 0.30 4.80 5.75 -1.09 -0.52 115.11 125.65 1g1l h GLN 237 Ca 0.24 -0.12 -0.01 0.00 -0.15 0.00 0.00 58.65 58.61 1g1l h GLN 237 Cb -0.02 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.51 1g1l h GLN 237 CO -0.04 0.57 -0.14 0.35 -2.65 0.00 0.00 178.83 176.91 1g1l h PHE 238 N 0.33 -0.37 -0.64 3.99 3.57 -0.85 -1.84 116.94 121.13 1g1l h PHE 238 Ca 0.06 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.63 1g1l h PHE 238 Cb 0.57 0.12 -0.06 0.00 2.79 0.00 0.00 35.95 39.37 1g1l h PHE 238 CO 0.01 -0.06 0.31 0.82 -2.23 0.00 0.00 178.31 177.16 1g1l h ILE 239 N -0.70 0.86 -0.32 1.41 1.08 -1.22 -2.58 117.51 116.05 1g1l h ILE 239 Ca -0.04 -0.19 0.02 0.00 -0.39 0.00 0.00 64.86 64.26 1g1l h ILE 239 Cb 0.48 0.27 -0.02 0.00 -3.07 0.00 0.00 36.82 34.48 1g1l h ILE 239 CO 0.07 0.10 0.17 0.00 -0.69 0.00 0.00 178.15 177.80 1g1l h ALA 240 N 1.39 0.39 -0.50 1.87 0.00 -1.05 -0.68 119.26 120.69 1g1l h ALA 240 Ca 0.31 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.26 1g1l h ALA 240 Cb 0.30 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1g1l h ALA 240 CO -0.25 -0.20 0.27 1.15 0.00 0.00 0.00 179.25 180.22 1g1l h THR 241 N 0.36 0.99 0.33 0.00 2.02 -1.17 0.12 112.91 115.55 1g1l h THR 241 Ca 0.13 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 1g1l h THR 241 Cb 0.02 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 1g1l h THR 241 CO -0.07 0.10 -0.16 -0.07 0.37 0.00 0.00 175.52 175.68 1g1l h LEU 242 N 0.52 -0.38 -0.29 2.58 3.38 -1.05 -2.43 115.31 117.65 1g1l h LEU 242 Ca 0.21 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.13 1g1l h LEU 242 Cb 0.09 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1g1l h LEU 242 CO -0.13 -0.14 0.10 -0.33 0.09 0.00 0.00 178.44 178.03 1g1l h GLU 243 N -0.61 0.22 0.00 1.13 5.08 -1.04 -0.54 114.58 118.83 1g1l h GLU 243 Ca -0.05 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 1g1l h GLU 243 Cb 0.44 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1g1l h GLU 243 CO 0.07 0.15 -0.24 -0.91 -1.00 0.00 0.00 179.01 177.08 1g1l h ASN 244 N 0.23 0.00 0.31 1.42 2.35 -0.99 -1.41 115.58 117.50 1g1l h ASN 244 Ca 0.13 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.56 1g1l h ASN 244 Cb 0.10 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.50 1g1l h ASN 244 CO -0.13 0.24 -1.38 -0.09 -1.65 0.00 0.00 177.43 174.42 1g1l h ARG 245 N 0.00 0.50 0.00 0.81 9.65 -1.12 -3.38 114.38 120.84 1g1l h ARG 245 Ca -0.00 -0.81 -0.26 0.00 -1.10 0.00 0.00 59.98 57.81 1g1l h ARG 245 Cb 0.46 0.29 -0.04 0.00 -1.39 0.00 0.00 29.97 29.29 1g1l h ARG 245 CO 0.03 1.38 -1.68 1.04 2.80 0.00 0.00 179.97 183.55 1g1l n GLN 246 N -3.70 0.63 -1.25 0.20 6.02 -0.24 -4.95 117.38 114.10 1g1l n GLN 246 Ca -0.14 0.25 -0.08 0.00 -0.01 0.00 0.00 57.00 57.01 1g1l n GLN 246 Cb 1.06 -1.77 -0.04 0.00 1.02 0.00 0.00 30.24 30.51 1g1l n GLN 246 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1g1l n GLY 247 N 1.52 1.01 3.32 1.08 0.00 -0.55 -5.03 105.19 106.55 1g1l n GLY 247 Ca -0.16 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 44.98 1g1l n GLY 247 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1g1l s LEU 248 N -1.90 2.40 -0.01 0.99 1.43 -1.25 -5.10 118.68 115.24 1g1l s LEU 248 Ca 0.00 -0.81 0.01 0.00 -1.03 0.00 0.00 54.13 52.30 1g1l s LEU 248 Cb 0.00 -0.85 -0.04 0.00 0.03 0.00 0.00 46.19 45.33 1g1l s LEU 248 CO 0.00 -0.00 -0.01 -0.54 0.23 0.00 0.00 176.35 176.02 1g1l s LYS 249 N -2.54 2.76 -0.04 1.70 1.02 -1.26 -4.30 119.74 117.08 1g1l s LYS 249 Ca 0.13 -0.61 -0.21 0.00 0.02 0.00 0.00 55.97 55.30 1g1l s LYS 249 Cb -0.07 -2.65 -0.05 0.00 -0.52 0.00 0.00 37.83 34.55 1g1l s LYS 249 CO 0.06 0.63 0.62 0.08 -0.92 0.00 0.00 175.35 175.82 1g1l s VAL 250 N -1.04 4.98 -1.23 3.17 1.01 -1.26 -4.49 120.40 121.53 1g1l s VAL 250 Ca 0.18 1.29 -0.04 0.00 0.00 0.00 0.00 61.98 63.41 1g1l s VAL 250 Cb -0.11 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.31 1g1l s VAL 250 CO 0.09 0.35 1.05 0.00 0.00 0.00 0.00 175.10 176.59 1g1l n ALA 251 N 3.17 -1.60 -2.66 5.51 0.00 -1.26 -4.97 120.51 118.70 1g1l n ALA 251 Ca -0.05 0.17 -0.43 0.00 0.00 0.00 0.00 53.44 53.13 1g1l n ALA 251 Cb 0.51 -3.87 -0.05 0.00 0.00 0.00 0.00 19.45 16.04 1g1l n ALA 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1g1l h PRO 253 N 9.14 0.23 -0.39 0.00 0.11 -1.93 -1.33 132.00 137.84 1g1l h PRO 253 Ca -0.26 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.70 1g1l h PRO 253 Cb 1.08 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1g1l h PRO 253 CO 1.02 0.15 -0.29 0.93 -0.21 0.00 0.00 178.00 179.61 1g1l h GLU 254 N 0.24 0.84 0.01 1.05 3.07 -1.95 0.63 114.58 118.48 1g1l h GLU 254 Ca 0.16 -0.38 -0.00 0.00 -0.50 0.00 0.00 59.36 58.63 1g1l h GLU 254 Cb 0.32 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.21 1g1l h GLU 254 CO -0.03 1.02 -0.01 1.49 -1.40 0.00 0.00 179.01 180.09 1g1l h GLU 255 N 0.72 -0.01 -0.64 2.33 4.81 -1.69 -2.09 114.58 117.99 1g1l h GLU 255 Ca 0.08 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1g1l h GLU 255 Cb 0.84 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.19 1g1l h GLU 255 CO 0.07 0.31 0.39 0.82 -0.73 0.00 0.00 179.01 179.87 1g1l h ILE 256 N -0.34 1.18 -0.41 2.32 2.04 -1.14 0.11 117.51 121.27 1g1l h ILE 256 Ca -0.00 -0.40 0.06 0.00 1.00 0.00 0.00 64.86 65.52 1g1l h ILE 256 Cb 0.33 0.30 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 1g1l h ILE 256 CO 0.00 0.19 0.09 0.00 0.00 0.00 0.00 178.15 178.43 1g1l h ALA 257 N 1.20 0.45 -0.43 1.87 0.00 -0.86 0.03 119.26 121.53 1g1l h ALA 257 Ca 0.23 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 1g1l h ALA 257 Cb -0.03 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1g1l h ALA 257 CO -0.04 -0.31 0.16 -0.92 0.00 0.00 0.00 179.25 178.13 1g1l h TYR 258 N 0.22 0.67 -0.15 0.00 3.20 -0.67 -0.02 116.97 120.21 1g1l h TYR 258 Ca 0.20 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 61.98 1g1l h TYR 258 Cb 0.24 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 1g1l h TYR 258 CO -0.20 0.59 -0.06 0.00 -1.64 0.00 0.00 178.16 176.86 1g1l h ARG 259 N 0.55 0.23 -0.01 1.82 3.08 -0.38 -2.06 114.38 117.61 1g1l h ARG 259 Ca 0.14 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1g1l h ARG 259 Cb 0.22 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1g1l h ARG 259 CO -0.01 0.30 -0.11 1.04 -1.07 0.00 0.00 179.97 180.12 1g1l n GLN 260 N -4.34 0.83 -1.64 0.04 1.13 -0.04 -4.92 117.38 108.44 1g1l n GLN 260 Ca -0.01 -0.33 -0.09 0.00 -1.94 0.00 0.00 57.00 54.63 1g1l n GLN 260 Cb 0.21 -1.49 -0.02 0.00 0.11 0.00 0.00 30.24 29.05 1g1l n GLN 260 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1g1l n LYS 261 N -0.79 -0.64 0.16 -1.09 5.02 -0.78 -4.91 118.16 115.12 1g1l n LYS 261 Ca 0.15 0.64 0.12 0.00 -2.02 0.00 0.00 58.31 57.21 1g1l n LYS 261 Cb 0.28 -4.56 0.17 0.00 -0.02 0.00 0.00 35.03 30.90 1g1l n LYS 261 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 1g1l h TRP 262 N 0.00 0.00 -3.91 2.13 6.55 -1.24 -3.44 115.95 116.04 1g1l h TRP 262 Ca -0.19 0.00 -0.27 0.00 0.95 0.00 0.00 58.89 59.38 1g1l h TRP 262 Cb 0.81 0.00 -0.19 0.00 -0.86 0.00 0.00 29.16 28.92 1g1l h TRP 262 CO 0.24 0.00 -0.73 0.96 -1.05 0.00 0.00 178.44 177.86 1g1l s ILE 263 N -3.22 0.64 0.56 1.49 -4.36 -1.18 -4.35 121.20 110.78 1g1l s ILE 263 Ca 0.06 -1.36 0.05 0.00 -0.26 0.00 0.00 60.65 59.14 1g1l s ILE 263 Cb 0.08 -0.97 0.06 0.00 1.25 0.00 0.00 42.46 42.89 1g1l s ILE 263 CO 0.69 -0.52 0.78 1.51 0.24 0.00 0.00 174.94 177.64 1g1l s ASP 264 N -2.03 5.11 0.21 4.36 1.47 -1.26 -4.44 116.67 120.09 1g1l s ASP 264 Ca -0.03 -0.45 -0.11 0.00 1.18 0.00 0.00 52.55 53.14 1g1l s ASP 264 Cb -0.05 -0.27 0.28 0.00 -0.34 0.00 0.00 42.92 42.53 1g1l s ASP 264 CO -0.01 -1.27 1.67 0.00 0.68 0.00 0.00 175.17 176.24 1g1l h ALA 265 N 0.11 0.59 -0.97 2.11 0.00 -1.99 -1.52 119.26 117.59 1g1l h ALA 265 Ca -0.37 0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.75 1g1l h ALA 265 Cb 1.28 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 19.33 1g1l h ALA 265 CO 0.44 -0.39 0.64 0.00 0.00 0.00 0.00 179.25 179.94 1g1l h ALA 266 N 1.54 1.35 -0.21 0.00 0.00 -1.99 -1.20 119.26 118.74 1g1l h ALA 266 Ca 0.31 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1g1l h ALA 266 Cb 0.49 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1g1l h ALA 266 CO -0.50 0.58 0.13 1.96 0.00 0.00 0.00 179.25 181.42 1g1l h GLN 267 N 1.26 0.27 -0.14 0.00 4.20 -1.81 -2.14 115.11 116.75 1g1l h GLN 267 Ca 0.37 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 59.06 1g1l h GLN 267 Cb -0.06 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 1g1l h GLN 267 CO -0.10 0.18 0.05 1.25 -0.67 0.00 0.00 178.83 179.54 1g1l h LEU 268 N 0.27 0.19 -1.12 1.46 5.85 -0.84 -1.70 115.31 119.43 1g1l h LEU 268 Ca 0.08 -0.17 0.13 0.00 0.84 0.00 0.00 57.88 58.76 1g1l h LEU 268 Cb -0.02 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 40.87 1g1l h LEU 268 CO -0.02 0.31 0.61 -0.08 -0.34 0.00 0.00 178.44 178.92 1g1l h GLU 269 N 0.06 0.84 -0.67 1.25 4.81 -1.18 0.10 114.58 119.78 1g1l h GLU 269 Ca 0.05 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1g1l h GLU 269 Cb 0.18 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 1g1l h GLU 269 CO -0.00 0.55 0.25 0.87 -0.73 0.00 0.00 179.01 179.95 1g1l h LYS 270 N 0.86 1.02 -0.62 1.92 1.57 -0.80 -2.38 116.57 118.14 1g1l h LYS 270 Ca 0.48 -0.20 -0.06 0.00 -1.87 0.00 0.00 60.65 59.00 1g1l h LYS 270 Cb 0.60 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 1g1l h LYS 270 CO -0.25 0.86 0.14 -0.07 -0.57 0.00 0.00 179.45 179.57 1g1l h LEU 271 N 0.96 0.92 -1.00 2.94 3.38 -0.19 -3.13 115.31 119.19 1g1l h LEU 271 Ca 0.22 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1g1l h LEU 271 Cb 0.24 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1g1l h LEU 271 CO -0.01 0.90 -0.09 0.00 0.09 0.00 0.00 178.44 179.32 1g1l h ALA 272 N 1.22 1.16 -0.06 1.53 0.00 -0.70 -3.36 119.26 119.05 1g1l h ALA 272 Ca 0.20 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1g1l h ALA 272 Cb 0.35 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 1g1l h ALA 272 CO 0.00 0.53 -0.52 0.00 0.00 0.00 0.00 179.25 179.27 1g1l h ALA 273 N 1.33 -0.86 0.00 0.00 0.00 -1.38 0.20 119.26 118.55 1g1l h ALA 273 Ca 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1g1l h ALA 273 Cb 0.50 0.94 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1g1l h ALA 273 CO 0.03 -1.07 0.00 -0.35 0.00 0.00 0.00 179.25 177.86 1g1l n PRO 274 N -5.45 0.02 -0.06 0.00 -0.04 -1.26 -2.52 135.00 125.69 1g1l n PRO 274 Ca -0.06 0.37 0.05 0.00 -0.04 0.00 0.00 63.50 63.82 1g1l n PRO 274 Cb 0.39 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.43 1g1l n PRO 274 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1g1l n LEU 275 N -1.45 2.22 0.25 1.53 4.77 0.60 -4.72 117.00 120.20 1g1l n LEU 275 Ca 0.02 -1.33 0.16 0.00 -0.03 0.00 0.00 56.01 54.83 1g1l n LEU 275 Cb 0.06 -0.07 0.66 0.00 -2.33 0.00 0.00 43.42 41.73 1g1l n LEU 275 CO 0.05 0.48 0.97 0.00 -1.33 0.00 0.00 177.39 177.56 1g1l h ALA 276 N 2.05 1.00 0.00 -1.18 0.00 -0.99 -2.07 119.26 118.07 1g1l h ALA 276 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1g1l h ALA 276 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1g1l h ALA 276 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.88 1g1l n LYS 277 N -2.94 0.60 -4.57 0.00 4.76 -1.26 -4.46 118.16 110.28 1g1l n LYS 277 Ca 0.01 0.01 -0.27 0.00 -2.87 0.00 0.00 58.31 55.19 1g1l n LYS 277 Cb 0.29 -1.50 -0.09 0.00 -1.84 0.00 0.00 35.03 31.89 1g1l n LYS 277 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1g1l s ASN 278 N -2.36 3.18 0.40 4.39 2.20 -0.82 -5.04 114.94 116.88 1g1l s ASN 278 Ca 0.34 -1.53 0.13 0.00 -0.94 0.00 0.00 52.86 50.86 1g1l s ASN 278 Cb 0.20 0.18 0.81 0.00 -2.00 0.00 0.00 41.25 40.44 1g1l s ASN 278 CO 0.40 -0.74 1.88 1.23 -2.94 0.00 0.00 177.10 176.94 1g1l h GLY 279 N 1.77 0.00 0.76 0.45 0.00 -1.87 -2.15 103.07 102.03 1g1l h GLY 279 Ca -0.40 -0.00 -0.07 0.00 0.00 0.00 0.00 47.33 46.85 1g1l h GLY 279 CO 0.69 0.00 -0.19 -1.82 0.00 0.00 0.00 176.54 175.22 1g1l h TYR 280 N 0.00 0.47 -0.60 5.60 3.20 -1.95 -0.33 116.97 123.37 1g1l h TYR 280 Ca -0.00 -0.15 0.03 0.00 3.14 0.00 0.00 58.73 61.74 1g1l h TYR 280 Cb 0.54 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.68 1g1l h TYR 280 CO 0.00 0.80 0.36 0.78 -1.64 0.00 0.00 178.16 178.46 1g1l h GLY 281 N 0.01 0.85 1.10 1.82 0.00 -1.30 -1.88 103.07 103.66 1g1l h GLY 281 Ca 0.02 -0.27 0.03 0.00 0.00 0.00 0.00 47.33 47.10 1g1l h GLY 281 CO 0.04 0.23 0.55 1.46 0.00 0.00 0.00 176.54 178.83 1g1l h GLN 282 N 0.71 1.05 -0.07 4.80 4.20 -1.12 -1.65 115.11 123.02 1g1l h GLN 282 Ca 0.24 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.87 1g1l h GLN 282 Cb 0.03 -0.24 -0.00 0.00 0.30 0.00 0.00 27.48 27.57 1g1l h GLN 282 CO -0.10 0.69 -0.01 -0.92 -0.67 0.00 0.00 178.83 177.81 1g1l h TYR 283 N 1.08 0.15 -0.74 2.96 3.20 -0.73 -0.89 116.97 122.00 1g1l h TYR 283 Ca 0.33 -0.03 0.14 0.00 3.14 0.00 0.00 58.73 62.31 1g1l h TYR 283 Cb -0.03 -0.04 -0.10 0.00 1.54 0.00 0.00 36.73 38.11 1g1l h TYR 283 CO -0.00 0.45 0.28 -0.07 -1.64 0.00 0.00 178.16 177.18 1g1l h LEU 284 N -0.19 0.23 -0.54 2.82 3.38 -0.68 -1.09 115.31 119.25 1g1l h LEU 284 Ca 0.02 0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.11 1g1l h LEU 284 Cb 0.40 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1g1l h LEU 284 CO 0.01 0.08 0.35 0.11 0.09 0.00 0.00 178.44 179.08 1g1l h LYS 285 N 0.41 0.70 -0.26 1.13 1.57 -1.00 -2.61 116.57 116.51 1g1l h LYS 285 Ca 0.41 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 59.12 1g1l h LYS 285 Cb 0.63 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1g1l h LYS 285 CO -0.41 0.47 0.06 -0.09 -0.57 0.00 0.00 179.45 178.90 1g1l h ARG 286 N 0.72 0.37 0.00 3.15 2.43 0.06 -2.30 114.38 118.82 1g1l h ARG 286 Ca 0.20 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1g1l h ARG 286 Cb -0.08 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.40 1g1l h ARG 286 CO -0.05 0.35 -0.07 -0.07 -1.51 0.00 0.00 179.97 178.62 1g1l h LEU 287 N 0.37 0.00 -1.23 3.80 3.38 -0.93 -2.49 115.31 118.21 1g1l h LEU 287 Ca 0.09 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 1g1l h LEU 287 Cb 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1g1l h LEU 287 CO -0.00 0.07 -0.32 -0.07 0.09 0.00 0.00 178.44 178.21 1g1l h LEU 288 N 0.00 0.00 -2.79 1.67 3.38 -1.48 -3.28 115.31 112.82 1g1l h LEU 288 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1g1l h LEU 288 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1g1l h LEU 288 CO 0.01 0.32 -0.03 0.35 0.09 0.00 0.00 178.44 179.17 1g1l n THR 289 N -3.69 1.22 -5.10 0.22 -2.24 -1.01 -5.01 114.28 98.69 1g1l n THR 289 Ca -0.01 -1.38 -0.30 0.00 -2.27 0.00 0.00 64.05 60.09 1g1l n THR 289 Cb 0.42 0.24 -0.17 0.00 -2.10 0.00 0.00 70.33 68.72 1g1l n THR 289 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1g1l s GLU 290 N -1.62 2.50 -0.21 -0.78 2.12 -0.97 -5.10 118.70 114.64 1g1l s GLU 290 Ca 0.13 -0.79 -0.25 0.00 0.36 0.00 0.00 54.97 54.42 1g1l s GLU 290 Cb 0.11 -2.02 -0.01 0.00 0.26 0.00 0.00 34.13 32.48 1g1l s GLU 290 CO 0.01 0.24 0.85 0.99 -0.54 0.00 0.00 175.26 176.81 1g1l s THR 291 N 0.15 4.85 -0.25 -1.70 2.01 -1.26 -4.83 115.64 114.60 1g1l s THR 291 Ca -0.10 1.63 -0.03 0.00 0.31 0.00 0.00 61.69 63.49 1g1l s THR 291 Cb -0.15 -4.14 0.01 0.00 0.01 0.00 0.00 72.50 68.23 1g1l s THR 291 CO 0.05 -0.03 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.23 1g1l s VAL 292 N 2.53 3.22 -2.00 3.82 1.01 -1.26 -5.20 120.40 122.52 1g1l s VAL 292 Ca 0.37 -0.81 0.27 0.00 0.00 0.00 0.00 61.98 61.81 1g1l s VAL 292 Cb -0.16 -2.59 0.76 0.00 0.00 0.00 0.00 36.38 34.40 1g1l s VAL 292 CO 0.10 0.24 1.95 -1.22 0.00 0.00 0.00 175.10 176.17