#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gra n GLY 0 N 0.00 2.37 3.77 -0.13 0.00 -1.26 -5.07 105.19 104.87 2gra n GLY 0 Ca 0.00 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 45.15 2gra n GLY 0 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2gra s MET 1 N -1.22 4.66 0.10 1.61 0.00 -1.26 -5.04 119.30 118.15 2gra s MET 1 Ca 0.14 1.33 0.09 0.00 0.00 0.00 0.00 55.69 57.24 2gra s MET 1 Cb 0.12 -3.07 -0.04 0.00 0.00 0.00 0.00 34.83 31.85 2gra s MET 1 CO 0.01 0.43 -0.22 -1.12 0.00 0.00 0.00 175.02 174.12 2gra s SER 2 N -1.38 2.70 0.12 1.11 0.01 -1.26 -5.01 113.70 110.00 2gra s SER 2 Ca 0.44 -0.69 0.08 0.00 1.31 0.00 0.00 55.95 57.09 2gra s SER 2 Cb -0.22 -0.16 -0.04 0.00 0.21 0.00 0.00 66.02 65.81 2gra s SER 2 CO 0.27 0.09 -0.20 -0.69 0.41 0.00 0.00 173.24 173.13 2gra s VAL 3 N -1.11 1.72 -0.05 3.43 1.01 -1.01 -0.86 120.40 123.52 2gra s VAL 3 Ca 0.08 -1.65 -0.10 0.00 0.00 0.00 0.00 61.98 60.31 2gra s VAL 3 Cb -0.10 -1.63 0.02 0.00 0.00 0.00 0.00 36.38 34.67 2gra s VAL 3 CO 0.04 -0.15 0.24 -0.83 0.00 0.00 0.00 175.10 174.41 2gra s GLY 4 N -2.14 -0.13 -0.11 4.51 0.00 -1.03 -0.95 107.32 107.49 2gra s GLY 4 Ca 0.09 0.41 0.04 0.00 0.00 0.00 0.00 44.72 45.26 2gra s GLY 4 CO 0.05 0.27 -0.24 -1.36 0.00 0.00 0.00 173.10 171.82 2gra s PHE 5 N -0.64 2.58 -0.29 1.90 0.40 0.22 -0.66 117.98 121.49 2gra s PHE 5 Ca -0.07 -1.10 -0.24 0.00 -0.60 0.00 0.00 56.93 54.92 2gra s PHE 5 Cb -0.04 -1.73 0.00 0.00 0.51 0.00 0.00 43.02 41.76 2gra s PHE 5 CO 0.02 -0.45 0.81 0.42 0.70 0.00 0.00 175.22 176.72 2gra s ILE 6 N 0.42 4.78 0.00 0.64 -1.09 0.57 -1.57 121.20 124.96 2gra s ILE 6 Ca -0.17 1.30 0.00 0.00 -2.23 0.00 0.00 60.65 59.55 2gra s ILE 6 Cb -0.18 -4.16 0.00 0.00 -1.58 0.00 0.00 42.46 36.55 2gra s ILE 6 CO 0.07 -0.23 0.00 0.61 -1.23 0.00 0.00 174.94 174.17 2gra n GLY 7 N 4.08 -2.48 0.00 6.18 0.00 -0.94 -2.51 105.19 109.52 2gra n GLY 7 Ca 0.05 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.04 2gra n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gra n ALA 8 N 0.13 0.00 0.00 4.61 0.00 -0.70 -4.52 120.51 120.03 2gra n ALA 8 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2gra n ALA 8 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2gra n ALA 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gra n GLY 9 N 3.79 -0.55 0.00 0.00 0.00 -1.26 -4.06 105.19 103.11 2gra n GLY 9 Ca 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.28 2gra n GLY 9 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2gra n GLN 10 N -0.58 0.00 -0.24 1.61 -0.06 -1.26 -2.11 117.38 114.75 2gra n GLN 10 Ca 0.00 0.21 0.23 0.00 -2.00 0.00 0.00 57.00 55.44 2gra n GLN 10 Cb 0.00 -0.82 0.43 0.00 -4.06 0.00 0.00 30.24 25.79 2gra n GLN 10 CO 0.00 0.00 0.00 -0.11 -0.20 0.00 0.00 177.06 176.75 2gra n LEU 11 N -0.53 0.24 0.24 1.69 7.94 -1.26 0.87 117.00 126.20 2gra n LEU 11 Ca 0.00 1.22 -0.17 0.00 -1.11 0.00 0.00 56.01 55.96 2gra n LEU 11 Cb 0.00 -0.59 -0.09 0.00 0.53 0.00 0.00 43.42 43.27 2gra n LEU 11 CO 0.00 -1.37 0.58 0.00 -1.11 0.00 0.00 177.39 175.49 2gra h ALA 12 N 1.47 -0.94 -0.58 1.96 0.00 -1.61 -1.89 119.26 117.68 2gra h ALA 12 Ca 0.62 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.45 2gra h ALA 12 Cb 1.63 0.64 -0.06 0.00 0.00 0.00 0.00 17.79 20.00 2gra h ALA 12 CO -0.57 -1.07 0.26 0.35 0.00 0.00 0.00 179.25 178.22 2gra h PHE 13 N -0.85 0.46 -0.01 0.00 3.57 0.10 0.40 116.94 120.61 2gra h PHE 13 Ca -0.03 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2gra h PHE 13 Cb 0.77 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.38 2gra h PHE 13 CO -0.25 0.18 -0.11 0.00 -2.23 0.00 0.00 178.31 175.90 2gra h ALA 14 N 1.36 -0.56 -0.22 2.41 0.00 -0.91 0.38 119.26 121.72 2gra h ALA 14 Ca 0.28 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.21 2gra h ALA 14 Cb 0.26 0.62 -0.04 0.00 0.00 0.00 0.00 17.79 18.63 2gra h ALA 14 CO -0.23 -0.60 -0.05 -0.07 0.00 0.00 0.00 179.25 178.29 2gra h LEU 15 N -0.13 -0.20 -0.99 0.00 4.07 -1.27 0.39 115.31 117.18 2gra h LEU 15 Ca 0.00 0.07 0.18 0.00 0.08 0.00 0.00 57.88 58.21 2gra h LEU 15 Cb 0.14 0.13 -0.18 0.00 1.08 0.00 0.00 40.66 41.84 2gra h LEU 15 CO -0.08 -0.07 -0.31 0.00 -1.08 0.00 0.00 178.44 176.90 2gra h ALA 16 N 1.22 0.43 0.08 1.53 0.00 0.23 0.15 119.26 122.88 2gra h ALA 16 Ca 0.10 0.34 -0.00 0.00 0.00 0.00 0.00 54.91 55.35 2gra h ALA 16 Cb 0.16 0.86 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2gra h ALA 16 CO -0.22 -0.49 -0.04 -0.22 0.00 0.00 0.00 179.25 178.28 2gra h LYS 17 N -0.00 -0.10 -0.73 0.00 3.64 0.10 -2.79 116.57 116.69 2gra h LYS 17 Ca 0.42 0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.93 2gra h LYS 17 Cb 0.67 0.02 -0.13 0.00 -0.41 0.00 0.00 32.23 32.38 2gra h LYS 17 CO -1.00 0.42 -0.31 0.78 -2.27 0.00 0.00 179.45 177.07 2gra h GLY 18 N -0.70 0.12 0.78 5.01 0.00 0.10 0.53 103.07 108.92 2gra h GLY 18 Ca -0.01 0.40 0.05 0.00 0.00 0.00 0.00 47.33 47.77 2gra h GLY 18 CO 0.02 -0.23 0.62 0.74 0.00 0.00 0.00 176.54 177.68 2gra h PHE 19 N -0.08 1.15 0.64 5.60 0.05 -0.84 0.98 116.94 124.43 2gra h PHE 19 Ca 0.30 0.03 -0.03 0.00 3.82 0.00 0.00 57.97 62.09 2gra h PHE 19 Cb 0.57 -0.38 0.01 0.00 2.00 0.00 0.00 35.95 38.15 2gra h PHE 19 CO -0.68 0.62 -0.31 1.15 -0.18 0.00 0.00 178.31 178.91 2gra h THR 20 N 1.15 0.21 -0.84 -1.55 2.02 -0.23 -1.43 112.91 112.23 2gra h THR 20 Ca 0.40 -0.29 0.06 0.00 0.77 0.00 0.00 66.41 67.35 2gra h THR 20 Cb 0.11 0.28 -0.06 0.00 -1.74 0.00 0.00 68.15 66.73 2gra h THR 20 CO -0.16 0.03 0.52 0.00 0.37 0.00 0.00 175.52 176.28 2gra h ALA 21 N -0.92 1.15 0.00 6.16 0.00 0.14 0.26 119.26 126.05 2gra h ALA 21 Ca -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2gra h ALA 21 Cb 0.70 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2gra h ALA 21 CO 0.14 0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.65 2gra n ALA 22 N -2.35 1.25 -2.20 0.00 0.00 0.34 -4.82 120.51 112.72 2gra n ALA 22 Ca 0.12 0.09 -0.12 0.00 0.00 0.00 0.00 53.44 53.53 2gra n ALA 22 Cb 0.18 -1.24 -0.01 0.00 0.00 0.00 0.00 19.45 18.38 2gra n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gra n GLY 23 N -0.89 -0.09 0.07 0.00 0.00 0.91 -4.92 105.19 100.27 2gra n GLY 23 Ca 0.00 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 45.52 2gra n GLY 23 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2gra h VAL 24 N 0.00 1.52 -3.74 1.61 2.07 -1.45 -3.48 116.25 112.79 2gra h VAL 24 Ca -0.29 -1.72 -0.08 0.00 0.82 0.00 0.00 66.70 65.43 2gra h VAL 24 Cb 1.20 2.67 -0.12 0.00 -1.52 0.00 0.00 31.29 33.52 2gra h VAL 24 CO 0.34 0.44 -0.24 -1.48 0.02 0.00 0.00 177.57 176.65 2gra s LEU 25 N -8.72 0.77 0.65 2.57 2.34 -1.24 -5.05 118.68 109.99 2gra s LEU 25 Ca -0.17 -0.76 -0.13 0.00 0.06 0.00 0.00 54.13 53.14 2gra s LEU 25 Cb -0.01 1.42 -0.02 0.00 -0.56 0.00 0.00 46.19 47.02 2gra s LEU 25 CO 0.66 -0.92 1.05 0.00 -1.06 0.00 0.00 176.35 176.08 2gra s ALA 26 N -3.94 2.76 0.18 1.48 0.00 -1.26 -4.30 121.76 116.68 2gra s ALA 26 Ca 0.14 0.17 -0.11 0.00 0.00 0.00 0.00 51.96 52.17 2gra s ALA 26 Cb 0.02 -3.18 0.07 0.00 0.00 0.00 0.00 23.12 20.04 2gra s ALA 26 CO -0.01 -0.99 1.68 0.00 0.00 0.00 0.00 175.76 176.44 2gra h ALA 27 N -0.23 0.81 0.00 0.00 0.00 -1.90 -1.33 119.26 116.62 2gra h ALA 27 Ca -0.45 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.22 2gra h ALA 27 Cb 1.21 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2gra h ALA 27 CO 0.58 0.53 0.00 -2.39 0.00 0.00 0.00 179.25 177.97 2gra n HIS 28 N -4.33 0.00 0.52 0.00 -0.00 -1.17 -0.99 115.22 109.25 2gra n HIS 28 Ca 0.03 0.00 0.09 0.00 -0.00 0.00 0.00 57.72 57.85 2gra n HIS 28 Cb 0.25 -0.36 0.25 0.00 -0.00 0.00 0.00 29.99 30.14 2gra n HIS 28 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2gra n LYS 29 N -1.36 2.16 -4.41 -1.40 4.76 -0.50 -4.71 118.16 112.70 2gra n LYS 29 Ca 0.04 -1.78 -0.27 0.00 -2.87 0.00 0.00 58.31 53.43 2gra n LYS 29 Cb 0.09 -1.42 -0.11 0.00 -1.84 0.00 0.00 35.03 31.74 2gra n LYS 29 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2gra s ILE 30 N -1.43 2.44 0.01 -0.18 1.01 -0.16 -2.41 121.20 120.47 2gra s ILE 30 Ca 0.35 -1.99 0.01 0.00 0.00 0.00 0.00 60.65 59.01 2gra s ILE 30 Cb 0.19 -2.17 -0.01 0.00 0.01 0.00 0.00 42.46 40.48 2gra s ILE 30 CO 0.25 -0.12 -0.03 -0.32 0.00 0.00 0.00 174.94 174.73 2gra s MET 31 N -2.69 0.24 -0.01 2.79 1.75 -0.12 -1.76 119.30 119.51 2gra s MET 31 Ca 0.21 -0.23 0.00 0.00 -1.25 0.00 0.00 55.69 54.42 2gra s MET 31 Cb -0.08 -0.15 0.01 0.00 2.84 0.00 0.00 34.83 37.45 2gra s MET 31 CO 0.10 0.03 -0.01 0.00 -0.65 0.00 0.00 175.02 174.50 2gra s ALA 32 N -0.40 0.14 -0.22 4.11 0.00 -0.04 0.71 121.76 126.05 2gra s ALA 32 Ca -0.03 0.01 -0.23 0.00 0.00 0.00 0.00 51.96 51.72 2gra s ALA 32 Cb -0.03 -0.09 -0.02 0.00 0.00 0.00 0.00 23.12 22.98 2gra s ALA 32 CO -0.00 0.00 0.73 -1.12 0.00 0.00 0.00 175.76 175.37 2gra s SER 33 N 0.23 6.76 -1.07 0.00 0.01 -0.61 -1.47 113.70 117.55 2gra s SER 33 Ca -0.02 0.94 -0.07 0.00 1.31 0.00 0.00 55.95 58.11 2gra s SER 33 Cb -0.04 -2.39 0.27 0.00 0.21 0.00 0.00 66.02 64.07 2gra s SER 33 CO -0.01 -0.39 1.09 -1.54 0.41 0.00 0.00 173.24 172.80 2gra n SER 34 N 5.52 5.35 0.00 2.44 3.41 -0.40 -1.72 113.62 128.23 2gra n SER 34 Ca 0.02 -3.09 0.00 0.00 -0.26 0.00 0.00 58.87 55.54 2gra n SER 34 Cb 0.49 -1.30 0.00 0.00 -0.26 0.00 0.00 64.21 63.13 2gra n SER 34 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2gra n PRO 35 N 2.47 0.00 -3.43 4.33 -0.04 -1.26 -4.47 135.00 132.60 2gra n PRO 35 Ca 0.24 0.22 -0.12 0.00 -0.04 0.00 0.00 63.50 63.79 2gra n PRO 35 Cb 0.38 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.32 2gra n PRO 35 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2gra s ASP 36 N -2.44 -0.57 -0.22 3.54 -1.08 -1.26 -5.13 116.67 109.51 2gra s ASP 36 Ca 0.00 0.03 -0.03 0.00 -0.52 0.00 0.00 52.55 52.03 2gra s ASP 36 Cb 0.00 0.59 -0.00 0.00 -1.46 0.00 0.00 42.92 42.05 2gra s ASP 36 CO 0.00 -0.95 -0.05 -0.04 0.52 0.00 0.00 175.17 174.65 2gra s MET 37 N -3.63 3.30 -0.04 4.34 -1.94 -1.26 -4.96 119.30 115.11 2gra s MET 37 Ca 0.01 -0.67 -0.02 0.00 -1.71 0.00 0.00 55.69 53.29 2gra s MET 37 Cb -0.01 -2.99 0.02 0.00 2.01 0.00 0.00 34.83 33.86 2gra s MET 37 CO -0.12 -0.22 0.09 0.16 -0.01 0.00 0.00 175.02 174.92 2gra s ASP 38 N 1.46 -0.07 0.42 3.03 -4.77 -1.26 -5.03 116.67 110.44 2gra s ASP 38 Ca 0.05 0.19 0.14 0.00 -3.30 0.00 0.00 52.55 49.63 2gra s ASP 38 Cb -0.14 0.13 1.00 0.00 -1.09 0.00 0.00 42.92 42.82 2gra s ASP 38 CO -0.04 -0.08 1.93 -0.07 0.70 0.00 0.00 175.17 177.61 2gra h LEU 39 N 6.61 0.43 0.00 2.11 3.38 -1.98 -2.80 115.31 123.06 2gra h LEU 39 Ca -0.34 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2gra h LEU 39 Cb 1.17 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2gra h LEU 39 CO 0.45 0.24 0.00 0.00 0.09 0.00 0.00 178.44 179.22 2gra n ALA 40 N -2.51 0.00 -0.50 1.53 0.00 -1.26 -3.39 120.51 114.39 2gra n ALA 40 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 2gra n ALA 40 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 2gra n ALA 40 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2gra n THR 41 N 0.00 0.00 0.00 0.00 -1.04 -1.25 -2.98 114.28 109.00 2gra n THR 41 Ca 0.00 1.25 0.00 0.00 -2.04 0.00 0.00 64.05 63.26 2gra n THR 41 Cb 0.00 -2.04 0.00 0.00 -1.82 0.00 0.00 70.33 66.47 2gra n THR 41 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2gra n VAL 42 N -1.57 0.00 -0.34 12.58 0.31 -1.16 -2.28 118.33 125.87 2gra n VAL 42 Ca 0.00 1.22 -0.05 0.00 -0.01 0.00 0.00 64.34 65.50 2gra n VAL 42 Cb 0.00 -1.69 -0.03 0.00 -0.91 0.00 0.00 33.84 31.22 2gra n VAL 42 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2gra n SER 43 N -2.21 -0.72 -0.22 4.52 2.88 -1.07 -0.39 113.62 116.41 2gra n SER 43 Ca 0.00 1.48 -0.11 0.00 -1.33 0.00 0.00 58.87 58.90 2gra n SER 43 Cb 0.00 -0.26 -0.08 0.00 -0.75 0.00 0.00 64.21 63.12 2gra n SER 43 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2gra h ALA 44 N 0.78 -0.58 -0.67 -1.46 0.00 -1.35 0.84 119.26 116.82 2gra h ALA 44 Ca 0.21 0.06 0.14 0.00 0.00 0.00 0.00 54.91 55.33 2gra h ALA 44 Cb 0.42 1.13 -0.11 0.00 0.00 0.00 0.00 17.79 19.23 2gra h ALA 44 CO -0.81 -0.96 -0.01 -0.07 0.00 0.00 0.00 179.25 177.40 2gra h LEU 45 N -0.26 -0.31 0.12 0.00 3.38 -0.38 0.59 115.31 118.45 2gra h LEU 45 Ca 0.13 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.27 2gra h LEU 45 Cb 0.55 0.30 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 2gra h LEU 45 CO -0.71 -0.14 -0.32 0.03 0.09 0.00 0.00 178.44 177.40 2gra h ARG 46 N 0.11 -0.47 -0.79 1.13 3.08 0.06 -0.21 114.38 117.29 2gra h ARG 46 Ca 0.35 0.03 0.19 0.00 0.07 0.00 0.00 59.98 60.62 2gra h ARG 46 Cb 0.59 0.11 -0.14 0.00 0.08 0.00 0.00 29.97 30.61 2gra h ARG 46 CO -0.58 -0.31 0.06 0.87 -1.07 0.00 0.00 179.97 178.94 2gra h LYS 47 N -0.49 0.12 -0.97 0.04 1.57 0.03 0.90 116.57 117.78 2gra h LYS 47 Ca -0.01 -0.01 0.27 0.00 -1.87 0.00 0.00 60.65 59.03 2gra h LYS 47 Cb 0.47 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.71 2gra h LYS 47 CO -0.15 0.08 0.68 1.98 -0.57 0.00 0.00 179.45 181.48 2gra h MET 48 N 0.13 0.07 0.00 3.15 4.05 0.18 -3.45 114.93 119.06 2gra h MET 48 Ca 0.45 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.87 2gra h MET 48 Cb 0.82 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.61 2gra h MET 48 CO -0.67 0.05 0.00 0.41 0.23 0.00 0.00 176.91 176.93 2gra n GLY 49 N -1.69 0.69 3.80 1.39 0.00 0.31 -4.88 105.19 104.81 2gra n GLY 49 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 2gra n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gra s VAL 50 N -2.00 3.78 -0.04 1.61 0.11 -0.95 -3.05 120.40 119.85 2gra s VAL 50 Ca 0.00 0.72 -0.14 0.00 -2.93 0.00 0.00 61.98 59.63 2gra s VAL 50 Cb 0.00 -3.31 -0.05 0.00 -1.53 0.00 0.00 36.38 31.49 2gra s VAL 50 CO 0.00 -0.61 0.38 -0.54 -3.33 0.00 0.00 175.10 171.00 2gra s LYS 51 N -4.47 3.96 -0.03 1.54 1.02 -0.72 -4.44 119.74 116.60 2gra s LYS 51 Ca 0.62 0.33 0.03 0.00 0.02 0.00 0.00 55.97 56.97 2gra s LYS 51 Cb -0.16 -3.27 -0.00 0.00 -0.52 0.00 0.00 37.83 33.88 2gra s LYS 51 CO 0.45 0.58 -0.13 -0.51 -0.92 0.00 0.00 175.35 174.83 2gra s LEU 52 N -0.69 1.87 -0.03 3.17 1.43 -1.26 -0.86 118.68 122.31 2gra s LEU 52 Ca 0.22 -0.26 -0.03 0.00 -1.03 0.00 0.00 54.13 53.04 2gra s LEU 52 Cb -0.16 -0.73 0.01 0.00 0.03 0.00 0.00 46.19 45.34 2gra s LEU 52 CO 0.11 0.12 0.08 -0.89 0.23 0.00 0.00 176.35 175.99 2gra s THR 53 N 0.05 -0.00 -2.00 5.49 2.01 -0.54 -4.96 115.64 115.68 2gra s THR 53 Ca -0.02 0.01 0.10 0.00 0.31 0.00 0.00 61.69 62.09 2gra s THR 53 Cb -0.09 -0.12 0.28 0.00 0.01 0.00 0.00 72.50 72.58 2gra s THR 53 CO 0.01 0.00 1.32 -0.81 -0.69 0.00 0.00 174.62 174.45 2gra n PRO 54 N 3.08 0.93 -3.92 4.92 -0.04 -1.26 -1.27 135.00 137.44 2gra n PRO 54 Ca -0.13 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 62.98 2gra n PRO 54 Cb 0.59 -1.17 -0.14 0.00 -0.04 0.00 0.00 33.50 32.75 2gra n PRO 54 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2gra s HIS 55 N -2.00 3.20 0.57 0.54 3.76 -1.26 -4.69 115.29 115.41 2gra s HIS 55 Ca 0.15 -1.75 0.32 0.00 -0.15 0.00 0.00 55.06 53.62 2gra s HIS 55 Cb 0.07 -2.10 1.85 0.00 1.11 0.00 0.00 32.58 33.51 2gra s HIS 55 CO 0.11 -0.78 2.24 -0.91 -0.85 0.00 0.00 174.74 174.56 2gra h ASN 56 N 8.01 0.00 0.04 1.40 2.35 -1.97 -2.58 115.58 122.84 2gra h ASN 56 Ca -0.25 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.50 2gra h ASN 56 Cb 1.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.45 2gra h ASN 56 CO 0.55 0.02 -0.02 0.11 -1.65 0.00 0.00 177.43 176.43 2gra h LYS 57 N 0.00 -0.06 -0.92 0.81 1.57 -1.94 -2.77 116.57 113.27 2gra h LYS 57 Ca -0.00 0.00 0.26 0.00 -1.87 0.00 0.00 60.65 59.04 2gra h LYS 57 Cb 0.06 0.01 -0.15 0.00 0.08 0.00 0.00 32.23 32.23 2gra h LYS 57 CO 0.00 0.50 0.29 1.49 -0.57 0.00 0.00 179.45 181.17 2gra h GLU 58 N -0.66 0.20 0.00 3.15 4.81 -1.88 0.16 114.58 120.36 2gra h GLU 58 Ca -0.01 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2gra h GLU 58 Cb 0.58 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.92 2gra h GLU 58 CO 0.01 0.13 0.00 2.41 -0.73 0.00 0.00 179.01 180.83 2gra n THR 59 N -5.22 0.00 -0.19 0.32 -1.04 -1.14 -2.27 114.28 104.74 2gra n THR 59 Ca 0.24 1.32 0.08 0.00 -2.04 0.00 0.00 64.05 63.65 2gra n THR 59 Cb 0.77 -2.13 0.16 0.00 -1.82 0.00 0.00 70.33 67.31 2gra n THR 59 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2gra n VAL 60 N -1.75 -0.24 -0.22 12.58 0.31 -0.01 0.26 118.33 129.26 2gra n VAL 60 Ca 0.00 1.24 -0.07 0.00 -0.01 0.00 0.00 64.34 65.49 2gra n VAL 60 Cb 0.00 -1.80 0.03 0.00 -0.91 0.00 0.00 33.84 31.16 2gra n VAL 60 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 2gra h GLN 61 N 0.00 0.89 0.00 5.55 4.20 -1.22 -2.05 115.11 122.48 2gra h GLN 61 Ca 0.33 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.89 2gra h GLN 61 Cb 0.68 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.31 2gra h GLN 61 CO -0.53 0.75 0.00 1.58 -0.67 0.00 0.00 178.83 179.96 2gra n HIS 62 N -4.48 0.00 -4.42 2.96 -0.00 0.72 -4.77 115.22 105.23 2gra n HIS 62 Ca 0.04 0.00 -0.31 0.00 0.46 0.00 0.00 57.72 57.91 2gra n HIS 62 Cb 0.15 -0.09 -0.16 0.00 -0.12 0.00 0.00 29.99 29.77 2gra n HIS 62 CO 0.00 0.00 0.00 -1.54 0.46 0.00 0.00 176.34 175.26 2gra s SER 63 N -2.17 2.85 0.00 0.26 1.04 -0.75 -4.32 113.70 110.61 2gra s SER 63 Ca 0.29 -0.54 -0.20 0.00 0.48 0.00 0.00 55.95 55.98 2gra s SER 63 Cb 0.15 -1.31 -0.23 0.00 0.10 0.00 0.00 66.02 64.73 2gra s SER 63 CO 0.28 0.03 1.10 0.44 0.98 0.00 0.00 173.24 176.07 2gra h ASP 64 N 7.56 0.52 -3.32 7.02 5.19 -1.28 -3.43 116.42 128.68 2gra h ASP 64 Ca -0.35 -0.75 -0.64 0.00 -0.62 0.00 0.00 57.03 54.67 2gra h ASP 64 Cb 1.17 -0.16 -0.22 0.00 0.18 0.00 0.00 39.33 40.30 2gra h ASP 64 CO 0.54 1.20 -0.68 0.54 -3.12 0.00 0.00 179.24 177.72 2gra s VAL 65 N -3.24 3.76 -0.18 -1.35 0.11 -1.02 -2.46 120.40 116.03 2gra s VAL 65 Ca -0.13 -0.41 -0.02 0.00 -2.93 0.00 0.00 61.98 58.49 2gra s VAL 65 Cb 0.03 -2.63 -0.01 0.00 -1.53 0.00 0.00 36.38 32.24 2gra s VAL 65 CO 0.82 0.50 -0.09 -0.22 -3.33 0.00 0.00 175.10 172.78 2gra s LEU 66 N 0.29 2.76 -0.15 2.54 2.96 0.98 -2.45 118.68 125.61 2gra s LEU 66 Ca -0.04 -0.38 -0.06 0.00 -0.22 0.00 0.00 54.13 53.42 2gra s LEU 66 Cb -0.14 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.84 2gra s LEU 66 CO 0.03 0.06 0.08 -0.36 -1.32 0.00 0.00 176.35 174.84 2gra s PHE 67 N 0.98 3.34 -1.04 5.38 0.40 0.16 -0.10 117.98 127.11 2gra s PHE 67 Ca -0.01 0.25 -0.05 0.00 -0.60 0.00 0.00 56.93 56.52 2gra s PHE 67 Cb -0.15 -1.99 0.28 0.00 0.51 0.00 0.00 43.02 41.68 2gra s PHE 67 CO -0.01 0.40 1.20 1.28 0.70 0.00 0.00 175.22 178.79 2gra n LEU 68 N 2.80 5.60 -2.73 -0.37 4.77 -0.55 -0.32 117.00 126.21 2gra n LEU 68 Ca -0.18 -5.15 -0.28 0.00 -0.03 0.00 0.00 56.01 50.37 2gra n LEU 68 Cb 0.53 -1.29 -0.08 0.00 -2.33 0.00 0.00 43.42 40.26 2gra n LEU 68 CO 0.33 1.57 2.23 0.00 -1.33 0.00 0.00 177.39 180.18 2gra n ALA 69 N 1.95 6.80 -2.49 -1.18 0.00 -1.04 -3.53 120.51 121.00 2gra n ALA 69 Ca 0.25 -2.97 -0.24 0.00 0.00 0.00 0.00 53.44 50.48 2gra n ALA 69 Cb 0.36 -2.64 -0.10 0.00 0.00 0.00 0.00 19.45 17.07 2gra n ALA 69 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2gra s VAL 70 N 0.17 2.11 0.50 0.00 1.01 -1.24 -4.56 120.40 118.39 2gra s VAL 70 Ca 0.64 -2.22 -0.23 0.00 0.00 0.00 0.00 61.98 60.16 2gra s VAL 70 Cb 0.27 -2.50 -0.06 0.00 0.00 0.00 0.00 36.38 34.09 2gra s VAL 70 CO -0.08 -0.29 1.38 -0.54 0.00 0.00 0.00 175.10 175.57 2gra s LYS 71 N -3.62 3.40 0.35 2.72 1.02 -1.26 -4.76 119.74 117.59 2gra s LYS 71 Ca 0.31 2.30 0.15 0.00 0.02 0.00 0.00 55.97 58.75 2gra s LYS 71 Cb 0.01 -2.44 1.05 0.00 -0.52 0.00 0.00 37.83 35.94 2gra s LYS 71 CO 0.15 -1.01 1.70 -1.35 -0.92 0.00 0.00 175.35 173.92 2gra h PRO 72 N 1.86 0.39 0.00 -1.68 0.11 -1.92 -1.15 132.00 129.61 2gra h PRO 72 Ca -0.51 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.45 2gra h PRO 72 Cb 1.28 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 2gra h PRO 72 CO 0.59 0.26 -0.67 1.12 -0.21 0.00 0.00 178.00 179.09 2gra h HIS 73 N 0.40 0.00 0.09 0.65 2.07 -1.95 -3.31 115.15 113.10 2gra h HIS 73 Ca 0.69 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 58.20 2gra h HIS 73 Cb 1.57 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.55 2gra h HIS 73 CO -0.01 0.61 -0.04 0.82 -3.07 0.00 0.00 177.93 176.24 2gra h ILE 74 N 0.00 1.13 -0.11 6.12 1.08 -1.58 -3.30 117.51 120.84 2gra h ILE 74 Ca -0.02 -0.82 0.01 0.00 -0.39 0.00 0.00 64.86 63.64 2gra h ILE 74 Cb 1.48 1.65 -0.01 0.00 -3.07 0.00 0.00 36.82 36.86 2gra h ILE 74 CO 0.08 0.20 -0.07 -0.38 -0.69 0.00 0.00 178.15 177.29 2gra n ILE 75 N -4.97 -0.08 -0.26 -0.67 2.08 -0.98 0.17 119.36 114.66 2gra n ILE 75 Ca -0.08 0.46 0.07 0.00 0.56 0.00 0.00 62.75 63.76 2gra n ILE 75 Cb 0.22 -0.59 0.16 0.00 -0.75 0.00 0.00 39.64 38.67 2gra n ILE 75 CO 0.00 0.00 0.00 -2.65 0.56 0.00 0.00 176.55 174.46 2gra n PRO 76 N -3.20 -0.06 0.00 0.38 -0.02 -1.24 0.12 135.00 130.98 2gra n PRO 76 Ca 0.00 1.13 0.00 0.00 -2.02 0.00 0.00 63.50 62.61 2gra n PRO 76 Cb 0.03 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 2gra n PRO 76 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2gra n PHE 77 N -5.11 0.00 -0.24 6.00 3.01 0.45 -3.39 117.46 118.17 2gra n PHE 77 Ca 0.14 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.58 2gra n PHE 77 Cb 0.46 -0.34 -0.00 0.00 -0.01 0.00 0.00 39.48 39.59 2gra n PHE 77 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 2gra n ILE 78 N -1.51 -0.35 -0.31 4.37 2.08 0.15 0.42 119.36 124.22 2gra n ILE 78 Ca 0.00 1.44 0.30 0.00 0.56 0.00 0.00 62.75 65.05 2gra n ILE 78 Cb 0.00 -1.86 0.54 0.00 -0.75 0.00 0.00 39.64 37.57 2gra n ILE 78 CO 0.00 0.00 0.00 -0.11 0.56 0.00 0.00 176.55 177.00 2gra n LEU 79 N -4.85 0.30 -0.03 1.39 7.94 0.33 -1.97 117.00 120.11 2gra n LEU 79 Ca 0.05 1.47 -0.01 0.00 -1.11 0.00 0.00 56.01 56.41 2gra n LEU 79 Cb 0.22 -0.72 -0.00 0.00 0.53 0.00 0.00 43.42 43.45 2gra n LEU 79 CO -0.09 -1.64 -0.04 0.44 -1.11 0.00 0.00 177.39 174.95 2gra h ASP 80 N 0.00 0.00 -0.61 1.96 3.32 -0.07 -1.29 116.42 119.73 2gra h ASP 80 Ca 0.77 0.00 0.23 0.00 0.02 0.00 0.00 57.03 58.05 2gra h ASP 80 Cb 2.11 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 41.54 2gra h ASP 80 CO -0.66 0.33 0.23 1.21 -1.72 0.00 0.00 179.24 178.64 2gra n GLU 81 N -3.65 -0.04 -0.03 3.56 2.13 -0.83 0.10 120.64 121.88 2gra n GLU 81 Ca -0.01 0.87 0.06 0.00 0.66 0.00 0.00 57.16 58.74 2gra n GLU 81 Cb 0.03 -1.51 -0.15 0.00 0.27 0.00 0.00 31.44 30.08 2gra n GLU 81 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 2gra n ILE 82 N -4.51 0.28 -0.48 6.31 2.08 -0.86 -4.45 119.36 117.73 2gra n ILE 82 Ca 0.21 -0.53 0.42 0.00 0.56 0.00 0.00 62.75 63.40 2gra n ILE 82 Cb 0.70 -0.08 0.69 0.00 -0.75 0.00 0.00 39.64 40.20 2gra n ILE 82 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2gra h GLY 83 N 3.69 0.00 0.25 7.39 0.00 0.19 0.29 103.07 114.88 2gra h GLY 83 Ca -0.11 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 2gra h GLY 83 CO 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 176.54 176.43 2gra h ALA 84 N 0.91 -0.35 0.00 3.60 0.00 -1.77 -3.34 119.26 118.31 2gra h ALA 84 Ca 0.73 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.57 2gra h ALA 84 Cb 3.25 0.13 0.00 0.00 0.00 0.00 0.00 17.79 21.17 2gra h ALA 84 CO -0.01 -0.33 0.20 -0.25 0.00 0.00 0.00 179.25 178.87 2gra n ASP 85 N -4.78 0.39 -4.74 0.00 8.00 0.95 -4.70 116.55 111.65 2gra n ASP 85 Ca -0.04 0.61 -0.42 0.00 0.71 0.00 0.00 54.79 55.65 2gra n ASP 85 Cb 0.13 -0.59 -0.02 0.00 -0.02 0.00 0.00 41.12 40.62 2gra n ASP 85 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2gra s ILE 86 N -3.36 2.36 0.00 0.53 2.07 -0.80 -4.88 121.20 117.12 2gra s ILE 86 Ca -0.02 0.30 0.00 0.00 -1.41 0.00 0.00 60.65 59.52 2gra s ILE 86 Cb 0.04 -3.19 0.00 0.00 0.13 0.00 0.00 42.46 39.44 2gra s ILE 86 CO 0.14 0.04 0.00 -0.62 -1.91 0.00 0.00 174.94 172.59 2gra n GLU 87 N 2.52 2.86 -0.04 3.50 -0.58 -1.26 -4.88 120.64 122.76 2gra n GLU 87 Ca 0.09 0.00 -0.16 0.00 -0.42 0.00 0.00 57.16 56.66 2gra n GLU 87 Cb 0.39 0.00 -0.14 0.00 -0.57 0.00 0.00 31.44 31.12 2gra n GLU 87 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2gra n ASP 88 N -0.18 1.55 -0.19 1.62 8.00 -1.26 -4.29 116.55 121.80 2gra n ASP 88 Ca 0.00 0.15 -0.08 0.00 0.71 0.00 0.00 54.79 55.57 2gra n ASP 88 Cb 0.00 -0.35 0.02 0.00 -0.02 0.00 0.00 41.12 40.77 2gra n ASP 88 CO 0.00 0.00 0.00 0.08 -0.39 0.00 0.00 177.20 176.89 2gra h ARG 89 N 0.03 0.81 -5.71 -1.24 0.11 -1.97 -3.46 114.38 102.96 2gra h ARG 89 Ca -0.44 -0.16 -0.71 0.00 0.10 0.00 0.00 59.98 58.77 2gra h ARG 89 Cb 2.03 -0.13 0.07 0.00 1.11 0.00 0.00 29.97 33.05 2gra h ARG 89 CO 0.04 0.72 -0.13 0.72 0.10 0.00 0.00 179.97 181.42 2gra n HIS 90 N -4.50 0.25 -4.51 4.08 8.25 -1.26 -4.94 115.22 112.58 2gra n HIS 90 Ca 0.02 0.98 -0.31 0.00 -0.26 0.00 0.00 57.72 58.15 2gra n HIS 90 Cb 0.17 -1.95 -0.16 0.00 1.12 0.00 0.00 29.99 29.17 2gra n HIS 90 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2gra s ILE 91 N -0.32 1.90 -0.25 1.59 1.01 -1.03 -4.51 121.20 119.59 2gra s ILE 91 Ca 0.78 -0.87 -0.07 0.00 0.00 0.00 0.00 60.65 60.49 2gra s ILE 91 Cb -1.10 -1.70 -0.03 0.00 0.01 0.00 0.00 42.46 39.65 2gra s ILE 91 CO 0.54 0.52 0.05 -0.69 0.00 0.00 0.00 174.94 175.36 2gra s VAL 92 N 0.96 4.18 -0.24 2.92 1.01 -0.64 -0.01 120.40 128.58 2gra s VAL 92 Ca -0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 61.98 61.71 2gra s VAL 92 Cb -0.15 -2.95 0.03 0.00 0.00 0.00 0.00 36.38 33.31 2gra s VAL 92 CO -0.04 0.35 -0.08 0.68 0.00 0.00 0.00 175.10 176.01 2gra s VAL 93 N 1.60 2.67 -0.14 2.92 -7.23 0.86 -0.47 120.40 120.61 2gra s VAL 93 Ca 0.06 -1.11 0.00 0.00 -1.81 0.00 0.00 61.98 59.13 2gra s VAL 93 Cb -0.15 -2.36 -0.01 0.00 0.56 0.00 0.00 36.38 34.42 2gra s VAL 93 CO 0.03 0.20 -0.14 -0.55 -0.31 0.00 0.00 175.10 174.33 2gra s SER 94 N 1.29 3.86 -0.20 4.85 0.15 -1.12 -1.48 113.70 121.05 2gra s SER 94 Ca -0.01 -0.39 -0.00 0.00 0.70 0.00 0.00 55.95 56.25 2gra s SER 94 Cb -0.17 -1.59 0.02 0.00 -1.71 0.00 0.00 66.02 62.57 2gra s SER 94 CO -0.06 0.13 -0.14 0.00 1.20 0.00 0.00 173.24 174.37 2gra s ALA 96 N 1.33 -3.18 0.55 0.00 0.00 -1.26 -4.49 121.76 114.70 2gra s ALA 96 Ca 0.04 1.83 -0.18 0.00 0.00 0.00 0.00 51.96 53.65 2gra s ALA 96 Cb -0.14 -2.25 -0.10 0.00 0.00 0.00 0.00 23.12 20.63 2gra s ALA 96 CO -0.09 -0.96 0.44 0.00 0.00 0.00 0.00 175.76 175.15 2gra n ALA 97 N 4.59 -1.42 -0.02 0.00 0.00 -1.26 -3.36 120.51 119.04 2gra n ALA 97 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2gra n ALA 97 Cb 0.55 -1.77 0.00 0.00 0.00 0.00 0.00 19.45 18.23 2gra n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gra n GLY 98 N 1.88 1.77 0.96 0.00 0.00 -1.26 -4.79 105.19 103.75 2gra n GLY 98 Ca 0.11 0.01 -0.17 0.00 0.00 0.00 0.00 46.02 45.96 2gra n GLY 98 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2gra n VAL 99 N 0.00 0.00 -2.99 1.61 0.31 -1.21 -4.86 118.33 111.19 2gra n VAL 99 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.05 2gra n VAL 99 Cb 0.00 -0.14 -0.02 0.00 -0.91 0.00 0.00 33.84 32.78 2gra n VAL 99 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2gra s THR 100 N 1.18 4.93 0.02 2.52 2.01 -1.26 -4.92 115.64 120.12 2gra s THR 100 Ca 0.30 0.19 -0.12 0.00 0.31 0.00 0.00 61.69 62.37 2gra s THR 100 Cb -0.41 -3.79 -0.06 0.00 0.01 0.00 0.00 72.50 68.25 2gra s THR 100 CO 0.20 -0.58 1.18 0.40 -0.69 0.00 0.00 174.62 175.14 2gra h ILE 101 N 0.85 0.00 -0.12 1.82 1.08 -1.99 -1.39 117.51 117.76 2gra h ILE 101 Ca -0.48 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.01 2gra h ILE 101 Cb 1.20 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.93 2gra h ILE 101 CO 0.63 0.00 -0.07 -0.24 -0.69 0.00 0.00 178.15 177.78 2gra n SER 102 N -3.23 -0.13 -0.39 1.72 2.88 -1.26 0.12 113.62 113.32 2gra n SER 102 Ca -0.05 0.93 0.31 0.00 -1.33 0.00 0.00 58.87 58.74 2gra n SER 102 Cb 0.16 -0.38 0.61 0.00 -0.75 0.00 0.00 64.21 63.85 2gra n SER 102 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2gra h SER 103 N 0.00 0.29 -0.17 -3.46 4.64 -1.92 0.36 113.55 113.28 2gra h SER 103 Ca 0.02 0.09 -0.10 0.00 -0.47 0.00 0.00 61.79 61.34 2gra h SER 103 Cb 0.05 0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2gra h SER 103 CO -0.12 -0.04 -0.27 0.40 -0.87 0.00 0.00 176.83 175.93 2gra h ILE 104 N 0.20 1.35 0.12 0.95 2.04 0.85 -3.30 117.51 119.71 2gra h ILE 104 Ca 0.70 -1.49 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 2gra h ILE 104 Cb 2.14 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 40.12 2gra h ILE 104 CO -0.31 0.45 -0.06 -0.33 0.00 0.00 0.00 178.15 177.90 2gra h GLU 105 N 0.13 -0.16 -3.34 2.37 5.08 0.11 -3.08 114.58 115.69 2gra h GLU 105 Ca 0.02 0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.26 2gra h GLU 105 Cb 0.84 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.13 2gra h GLU 105 CO 0.06 0.03 1.16 1.63 -1.00 0.00 0.00 179.01 180.89 2gra n LYS 106 N -5.09 0.78 0.00 2.33 5.02 -0.21 0.84 118.16 121.83 2gra n LYS 106 Ca -0.08 -0.67 0.00 0.00 -2.02 0.00 0.00 58.31 55.54 2gra n LYS 106 Cb 0.15 -1.98 0.00 0.00 -0.02 0.00 0.00 35.03 33.19 2gra n LYS 106 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2gra n LYS 107 N 3.93 0.00 0.12 1.97 4.76 -1.21 -4.86 118.16 122.87 2gra n LYS 107 Ca 0.17 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.72 2gra n LYS 107 Cb 0.13 0.00 0.03 0.00 -1.84 0.00 0.00 35.03 33.35 2gra n LYS 107 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2gra h LEU 108 N 0.00 0.00 -0.96 -0.35 3.38 -0.23 -3.16 115.31 113.99 2gra h LEU 108 Ca 0.00 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2gra h LEU 108 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2gra h LEU 108 CO 0.00 0.00 -0.28 0.28 0.09 0.00 0.00 178.44 178.53 2gra h SER 109 N 0.00 0.42 0.00 -0.43 0.02 0.25 -1.57 113.55 112.23 2gra h SER 109 Ca 0.00 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 2gra h SER 109 Cb 0.99 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.42 2gra h SER 109 CO 0.00 0.69 0.00 0.00 -1.14 0.00 0.00 176.83 176.38 2gra n ALA 110 N -2.48 1.64 -2.65 3.77 0.00 -1.19 -4.41 120.51 115.19 2gra n ALA 110 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2gra n ALA 110 Cb 0.42 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.87 2gra n ALA 110 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2gra n PHE 111 N -0.08 0.00 -1.26 0.00 3.01 -0.60 -5.06 117.46 113.47 2gra n PHE 111 Ca 0.00 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.03 2gra n PHE 111 Cb 0.04 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.48 2gra n PHE 111 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2gra n ARG 112 N 0.00 0.00 0.00 -1.08 5.12 -1.19 -4.87 116.66 114.64 2gra n ARG 112 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2gra n ARG 112 Cb 0.00 -0.91 0.00 0.00 -1.16 0.00 0.00 32.46 30.39 2gra n ARG 112 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 2gra n PRO 113 N 0.93 0.00 -4.00 5.56 -0.02 -1.26 -4.31 135.00 131.91 2gra n PRO 113 Ca 0.16 0.62 -0.32 0.00 -2.02 0.00 0.00 63.50 61.94 2gra n PRO 113 Cb 0.24 -1.31 -0.15 0.00 -0.02 0.00 0.00 33.50 32.26 2gra n PRO 113 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gra s ALA 114 N -3.23 2.89 -0.06 3.55 0.00 -1.26 -4.77 121.76 118.87 2gra s ALA 114 Ca 0.00 -2.44 -0.30 0.00 0.00 0.00 0.00 51.96 49.22 2gra s ALA 114 Cb 0.00 -1.97 -0.05 0.00 0.00 0.00 0.00 23.12 21.10 2gra s ALA 114 CO 0.00 -1.64 1.47 -2.14 0.00 0.00 0.00 175.76 173.45 2gra s PRO 115 N 0.95 4.23 -0.54 0.00 0.02 -1.26 -4.94 135.00 133.46 2gra s PRO 115 Ca 0.08 1.98 -0.26 0.00 0.02 0.00 0.00 61.00 62.82 2gra s PRO 115 Cb -0.19 -3.78 0.03 0.00 0.02 0.00 0.00 34.50 30.58 2gra s PRO 115 CO -0.07 -0.72 1.05 1.03 -0.33 0.00 0.00 177.00 177.96 2gra s ARG 116 N 3.32 3.48 -0.02 5.54 0.52 -1.26 -3.81 118.95 126.72 2gra s ARG 116 Ca 0.65 0.10 0.01 0.00 -0.52 0.00 0.00 55.73 55.98 2gra s ARG 116 Cb -0.30 -4.00 0.01 0.00 0.52 0.00 0.00 34.95 31.19 2gra s ARG 116 CO 0.25 -1.50 -0.04 0.08 0.02 0.00 0.00 175.30 174.11 2gra s VAL 117 N 4.34 0.40 -0.04 3.52 1.01 -1.26 -1.62 120.40 126.75 2gra s VAL 117 Ca 0.38 -0.11 0.06 0.00 0.00 0.00 0.00 61.98 62.31 2gra s VAL 117 Cb -0.10 -0.40 -0.01 0.00 0.00 0.00 0.00 36.38 35.87 2gra s VAL 117 CO 0.24 0.16 -0.23 -0.63 0.00 0.00 0.00 175.10 174.65 2gra s ILE 118 N 0.51 1.84 -0.18 2.22 -1.09 0.38 -0.51 121.20 124.36 2gra s ILE 118 Ca -0.06 -0.96 -0.23 0.00 -2.23 0.00 0.00 60.65 57.17 2gra s ILE 118 Cb -0.09 -1.55 -0.02 0.00 -1.58 0.00 0.00 42.46 39.22 2gra s ILE 118 CO -0.00 0.52 0.73 -0.60 -1.23 0.00 0.00 174.94 174.35 2gra s ARG 119 N -0.24 4.26 0.15 2.79 3.52 0.15 -2.77 118.95 126.82 2gra s ARG 119 Ca 0.00 0.82 0.05 0.00 -0.13 0.00 0.00 55.73 56.48 2gra s ARG 119 Cb -0.12 -3.57 -0.04 0.00 -1.56 0.00 0.00 34.95 29.67 2gra s ARG 119 CO 0.02 -0.27 0.08 0.00 -0.81 0.00 0.00 175.30 174.33 2gra s MET 121 N -2.94 0.50 0.00 0.00 0.00 -0.62 -4.35 119.30 111.89 2gra s MET 121 Ca 0.29 0.98 0.00 0.00 0.00 0.00 0.00 55.69 56.97 2gra s MET 121 Cb -0.10 0.56 0.00 0.00 0.00 0.00 0.00 34.83 35.29 2gra s MET 121 CO 0.22 -0.45 0.00 0.25 0.00 0.00 0.00 175.02 175.03 2gra n THR 122 N 5.41 0.00 -4.01 10.11 -2.24 -1.26 -0.77 114.28 121.52 2gra n THR 122 Ca -0.04 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.63 2gra n THR 122 Cb 0.51 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.69 2gra n THR 122 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2gra s ASN 123 N 1.00 0.13 0.27 3.42 2.20 -1.26 -4.64 114.94 116.06 2gra s ASN 123 Ca 0.00 -1.07 -0.02 0.00 -0.94 0.00 0.00 52.86 50.83 2gra s ASN 123 Cb 0.00 0.61 0.43 0.00 -2.00 0.00 0.00 41.25 40.29 2gra s ASN 123 CO 0.00 -1.20 1.89 0.71 -2.94 0.00 0.00 177.10 175.56 2gra h THR 124 N 2.22 1.09 0.00 0.54 1.35 -1.94 -3.00 112.91 113.18 2gra h THR 124 Ca -0.27 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.19 2gra h THR 124 Cb 1.25 -0.17 0.00 0.00 -1.73 0.00 0.00 68.15 67.50 2gra h THR 124 CO 0.37 0.21 0.62 -2.65 -0.25 0.00 0.00 175.52 173.82 2gra n PRO 125 N -4.50 0.01 0.10 4.72 -0.02 -1.26 0.11 135.00 134.16 2gra n PRO 125 Ca 0.15 0.26 0.08 0.00 -2.02 0.00 0.00 63.50 61.97 2gra n PRO 125 Cb 0.19 -2.10 0.55 0.00 -0.02 0.00 0.00 33.50 32.11 2gra n PRO 125 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2gra h VAL 126 N 0.00 1.00 0.00 -1.45 2.07 -1.79 0.12 116.25 116.21 2gra h VAL 126 Ca 0.00 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 2gra h VAL 126 Cb 1.25 0.72 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 2gra h VAL 126 CO 0.00 0.05 -0.01 0.58 0.02 0.00 0.00 177.57 178.21 2gra h VAL 127 N 0.25 0.11 -0.15 2.57 2.07 0.65 0.11 116.25 121.86 2gra h VAL 127 Ca 0.11 -0.10 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 2gra h VAL 127 Cb 0.13 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2gra h VAL 127 CO -0.02 0.01 -0.07 0.55 0.02 0.00 0.00 177.57 178.06 2gra n VAL 128 N -3.23 2.18 -3.00 2.57 3.14 -0.28 -4.49 118.33 115.22 2gra n VAL 128 Ca -0.02 -2.32 -0.21 0.00 -2.96 0.00 0.00 64.34 58.83 2gra n VAL 128 Cb 0.11 -0.26 0.01 0.00 -1.06 0.00 0.00 33.84 32.64 2gra n VAL 128 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2gra n ARG 129 N -1.02 -3.72 -0.12 1.45 1.74 0.37 -4.83 116.66 110.53 2gra n ARG 129 Ca 0.21 0.72 0.02 0.00 -0.77 0.00 0.00 57.85 58.04 2gra n ARG 129 Cb 0.80 -5.48 0.03 0.00 -1.02 0.00 0.00 32.46 26.80 2gra n ARG 129 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2gra n GLU 130 N -3.66 1.19 -0.64 5.56 -0.58 0.28 -1.90 120.64 120.87 2gra n GLU 130 Ca -0.10 -1.36 -0.28 0.00 -0.42 0.00 0.00 57.16 55.00 2gra n GLU 130 Cb 0.60 -0.87 0.24 0.00 -0.57 0.00 0.00 31.44 30.84 2gra n GLU 130 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2gra s GLY 131 N -1.14 1.55 -0.29 0.62 0.00 -0.87 -4.65 107.32 102.54 2gra s GLY 131 Ca 0.07 -0.16 0.02 0.00 0.00 0.00 0.00 44.72 44.65 2gra s GLY 131 CO 0.01 0.55 0.01 0.00 0.00 0.00 0.00 173.10 173.66 2gra s ALA 132 N -2.54 2.31 -0.03 3.20 0.00 -1.26 -2.15 121.76 121.29 2gra s ALA 132 Ca 0.68 -1.92 0.05 0.00 0.00 0.00 0.00 51.96 50.77 2gra s ALA 132 Cb -0.24 -1.70 -0.03 0.00 0.00 0.00 0.00 23.12 21.16 2gra s ALA 132 CO 0.63 -1.48 -0.17 -0.08 0.00 0.00 0.00 175.76 174.67 2gra s THR 133 N 1.21 2.84 0.06 0.00 -1.32 -1.14 -4.16 115.64 113.13 2gra s THR 133 Ca 0.03 -0.88 0.04 0.00 -1.21 0.00 0.00 61.69 59.68 2gra s THR 133 Cb -0.19 -2.11 -0.03 0.00 -1.51 0.00 0.00 72.50 68.67 2gra s THR 133 CO -0.11 0.54 -0.12 0.54 -2.21 0.00 0.00 174.62 173.26 2gra s VAL 134 N -0.75 0.94 0.13 5.08 0.11 0.05 -1.65 120.40 124.31 2gra s VAL 134 Ca 0.12 -1.23 0.00 0.00 -2.93 0.00 0.00 61.98 57.93 2gra s VAL 134 Cb -0.10 -0.93 -0.04 0.00 -1.53 0.00 0.00 36.38 33.77 2gra s VAL 134 CO 0.01 -0.27 0.02 -0.72 -3.33 0.00 0.00 175.10 170.82 2gra s TYR 135 N -1.30 0.94 -0.14 1.54 -0.85 -0.78 -1.59 117.35 115.17 2gra s TYR 135 Ca -0.04 -1.13 0.00 0.00 -0.52 0.00 0.00 57.07 55.38 2gra s TYR 135 Cb -0.10 -0.54 0.02 0.00 0.38 0.00 0.00 41.96 41.72 2gra s TYR 135 CO 0.02 -0.39 -0.13 0.00 -1.52 0.00 0.00 175.55 173.53 2gra s ALA 136 N -3.89 1.71 0.07 9.51 0.00 0.73 -0.08 121.76 129.81 2gra s ALA 136 Ca 0.22 -0.80 -0.31 0.00 0.00 0.00 0.00 51.96 51.07 2gra s ALA 136 Cb 0.07 -1.00 -0.07 0.00 0.00 0.00 0.00 23.12 22.13 2gra s ALA 136 CO 0.01 -0.36 1.34 -0.08 0.00 0.00 0.00 175.76 176.67 2gra s THR 137 N 1.48 3.63 1.17 0.00 -1.32 -1.26 0.34 115.64 119.68 2gra s THR 137 Ca 0.04 1.13 -0.20 0.00 -1.21 0.00 0.00 61.69 61.46 2gra s THR 137 Cb -0.13 -3.73 0.28 0.00 -1.51 0.00 0.00 72.50 67.42 2gra s THR 137 CO -0.09 0.06 1.19 -0.83 -2.21 0.00 0.00 174.62 172.74 2gra s GLY 138 N 1.29 1.66 0.05 6.08 0.00 0.33 -4.90 107.32 111.83 2gra s GLY 138 Ca 0.63 -1.16 -0.24 0.00 0.00 0.00 0.00 44.72 43.94 2gra s GLY 138 CO 0.29 -0.25 1.55 -0.84 0.00 0.00 0.00 173.10 173.84 2gra h THR 139 N -2.43 1.12 -0.65 0.90 2.02 -1.86 -3.05 112.91 108.95 2gra h THR 139 Ca -0.43 -0.44 0.00 0.00 0.77 0.00 0.00 66.41 66.31 2gra h THR 139 Cb 1.26 1.42 0.00 0.00 -1.74 0.00 0.00 68.15 69.09 2gra h THR 139 CO 0.29 0.11 0.00 1.41 0.37 0.00 0.00 175.52 177.71 2gra n HIS 140 N -5.01 1.42 -2.68 3.16 8.25 -1.25 -4.90 115.22 114.21 2gra n HIS 140 Ca -0.08 -0.60 -0.43 0.00 -0.26 0.00 0.00 57.72 56.35 2gra n HIS 140 Cb 0.13 -0.22 -0.02 0.00 1.12 0.00 0.00 29.99 31.00 2gra n HIS 140 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2gra s ALA 141 N -1.75 3.48 0.95 -1.41 0.00 -1.16 -4.32 121.76 117.55 2gra s ALA 141 Ca 0.51 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.33 2gra s ALA 141 Cb 0.32 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.80 2gra s ALA 141 CO 0.26 -1.50 0.00 1.04 0.00 0.00 0.00 175.76 175.55 2gra n GLN 142 N 6.84 2.22 -0.06 0.00 6.02 -1.26 -4.70 117.38 126.45 2gra n GLN 142 Ca 0.11 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 57.03 2gra n GLN 142 Cb 0.47 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.71 2gra n GLN 142 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2gra n VAL 143 N 0.00 1.30 0.12 5.09 0.31 -1.26 -4.19 118.33 119.70 2gra n VAL 143 Ca 0.00 0.21 0.06 0.00 -0.01 0.00 0.00 64.34 64.60 2gra n VAL 143 Cb 0.00 -2.13 0.32 0.00 -0.91 0.00 0.00 33.84 31.12 2gra n VAL 143 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2gra n GLU 144 N -4.10 0.08 0.14 5.55 0.00 -1.26 -0.37 120.64 120.69 2gra n GLU 144 Ca -0.10 0.53 -0.06 0.00 0.00 0.00 0.00 57.16 57.53 2gra n GLU 144 Cb 0.38 -1.93 -0.03 0.00 0.00 0.00 0.00 31.44 29.86 2gra n GLU 144 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 2gra h ASP 145 N 0.00 -0.34 -0.20 4.31 3.32 -1.94 -0.52 116.42 121.05 2gra h ASP 145 Ca 0.00 0.01 0.05 0.00 0.02 0.00 0.00 57.03 57.12 2gra h ASP 145 Cb 0.34 0.09 -0.07 0.00 0.22 0.00 0.00 39.33 39.91 2gra h ASP 145 CO 0.00 -0.11 -0.34 1.23 -1.72 0.00 0.00 179.24 178.30 2gra h GLY 146 N -0.66 -0.44 -0.42 2.75 0.00 -0.87 0.21 103.07 103.63 2gra h GLY 146 Ca -0.04 0.42 0.30 0.00 0.00 0.00 0.00 47.33 48.01 2gra h GLY 146 CO 0.07 -0.22 0.59 3.21 0.00 0.00 0.00 176.54 180.19 2gra h ARG 147 N -0.38 0.38 -0.02 4.80 3.08 -1.08 0.76 114.38 121.93 2gra h ARG 147 Ca 0.11 -0.02 -0.15 0.00 0.07 0.00 0.00 59.98 59.99 2gra h ARG 147 Cb 0.56 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 2gra h ARG 147 CO -0.41 0.25 -0.67 1.25 -1.07 0.00 0.00 179.97 179.33 2gra h LEU 148 N 0.39 0.12 0.75 3.04 5.85 0.10 -2.92 115.31 122.65 2gra h LEU 148 Ca 0.71 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 59.31 2gra h LEU 148 Cb 1.57 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 42.57 2gra h LEU 148 CO -0.55 0.75 -0.36 -0.03 -0.34 0.00 0.00 178.44 177.91 2gra h MET 149 N 0.07 -0.97 -0.08 1.25 4.05 0.29 -2.52 114.93 117.02 2gra h MET 149 Ca -0.01 0.07 0.02 0.00 -0.28 0.00 0.00 59.70 59.49 2gra h MET 149 Cb 1.19 0.22 -0.04 0.00 -0.80 0.00 0.00 31.60 32.16 2gra h MET 149 CO 0.09 -0.63 -0.38 0.93 0.23 0.00 0.00 176.91 177.15 2gra h GLU 150 N -1.06 -0.40 -0.93 0.39 4.39 -1.22 0.61 114.58 116.38 2gra h GLU 150 Ca -0.10 0.03 0.23 0.00 0.34 0.00 0.00 59.36 59.85 2gra h GLU 150 Cb 0.78 0.09 -0.17 0.00 -0.10 0.00 0.00 28.75 29.35 2gra h GLU 150 CO 0.17 -0.27 -0.05 1.96 -1.16 0.00 0.00 179.01 179.66 2gra h GLN 151 N -0.42 0.03 0.76 2.33 4.20 -1.57 1.58 115.11 122.02 2gra h GLN 151 Ca 0.02 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 2gra h GLN 151 Cb 0.48 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.25 2gra h GLN 151 CO -0.30 0.02 -0.45 1.25 -0.67 0.00 0.00 178.83 178.68 2gra h LEU 152 N 0.03 -1.12 0.00 1.46 7.12 -0.69 -2.56 115.31 119.55 2gra h LEU 152 Ca 0.52 0.06 -0.01 0.00 0.13 0.00 0.00 57.88 58.58 2gra h LEU 152 Cb 0.97 0.32 -0.00 0.00 -0.53 0.00 0.00 40.66 41.42 2gra h LEU 152 CO -0.88 -0.71 -0.31 -0.07 -0.13 0.00 0.00 178.44 176.34 2gra h LEU 153 N -1.13 0.00 -0.27 2.25 3.38 -0.05 -3.00 115.31 116.49 2gra h LEU 153 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2gra h LEU 153 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 2gra h LEU 153 CO 0.11 0.02 0.00 -1.20 0.09 0.00 0.00 178.44 177.47 2gra n SER 154 N -2.98 0.39 -0.07 -0.43 7.64 0.53 -2.21 113.62 116.48 2gra n SER 154 Ca 0.03 0.58 0.15 0.00 1.01 0.00 0.00 58.87 60.63 2gra n SER 154 Cb 0.55 -0.67 0.72 0.00 -1.01 0.00 0.00 64.21 63.80 2gra n SER 154 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2gra n SER 155 N -1.91 0.27 -3.17 6.43 3.41 -0.97 -3.93 113.62 113.75 2gra n SER 155 Ca 0.04 -0.57 -0.21 0.00 -0.26 0.00 0.00 58.87 57.87 2gra n SER 155 Cb 0.26 -0.12 -0.05 0.00 -0.26 0.00 0.00 64.21 64.04 2gra n SER 155 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2gra n VAL 156 N -1.01 -0.46 0.00 -3.33 0.31 -0.94 -4.76 118.33 108.14 2gra n VAL 156 Ca 0.17 -4.15 0.00 0.00 -0.01 0.00 0.00 64.34 60.35 2gra n VAL 156 Cb 0.23 -1.13 0.00 0.00 -0.91 0.00 0.00 33.84 32.04 2gra n VAL 156 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2gra n GLY 157 N 0.94 0.68 3.24 2.92 0.00 -0.80 -3.25 105.19 108.92 2gra n GLY 157 Ca 0.22 -2.03 -0.34 0.00 0.00 0.00 0.00 46.02 43.87 2gra n GLY 157 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2gra n PHE 158 N 0.75 -2.12 -3.24 1.61 7.35 -0.92 -4.12 117.46 116.78 2gra n PHE 158 Ca 0.00 0.21 0.04 0.00 -0.76 0.00 0.00 57.45 56.94 2gra n PHE 158 Cb 0.00 -1.60 -0.03 0.00 0.35 0.00 0.00 39.48 38.20 2gra n PHE 158 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2gra s THR 160 N 2.56 0.12 0.58 0.00 -1.32 -0.66 -4.90 115.64 112.02 2gra s THR 160 Ca -0.02 -0.96 -0.14 0.00 -1.21 0.00 0.00 61.69 59.36 2gra s THR 160 Cb -0.06 -0.74 -0.05 0.00 -1.51 0.00 0.00 72.50 70.14 2gra s THR 160 CO -0.14 -0.53 1.01 -0.70 -2.21 0.00 0.00 174.62 172.05 2gra s GLU 161 N -2.22 3.71 -0.06 7.08 2.12 -1.26 -1.87 118.70 126.20 2gra s GLU 161 Ca -0.08 0.87 -0.21 0.00 0.36 0.00 0.00 54.97 55.91 2gra s GLU 161 Cb -0.03 -2.10 0.04 0.00 0.26 0.00 0.00 34.13 32.30 2gra s GLU 161 CO -0.03 -0.48 0.48 0.08 -0.54 0.00 0.00 175.26 174.78 2gra s VAL 162 N -2.90 0.03 -0.45 3.70 1.01 0.88 -4.80 120.40 117.86 2gra s VAL 162 Ca 0.57 -0.21 -0.28 0.00 0.00 0.00 0.00 61.98 62.07 2gra s VAL 162 Cb -0.11 -0.77 -0.02 0.00 0.00 0.00 0.00 36.38 35.49 2gra s VAL 162 CO 0.43 -0.12 1.83 -0.70 0.00 0.00 0.00 175.10 176.55 2gra s GLU 163 N -0.94 3.01 0.06 2.72 2.56 -1.26 -4.26 118.70 120.60 2gra s GLU 163 Ca -0.10 1.08 0.03 0.00 0.00 0.00 0.00 54.97 55.98 2gra s GLU 163 Cb -0.03 -4.28 0.23 0.00 2.00 0.00 0.00 34.13 32.05 2gra s GLU 163 CO 0.05 -2.25 0.28 -1.91 -0.56 0.00 0.00 175.26 170.87 2gra n GLU 164 N 8.73 -0.01 0.00 4.30 2.13 -1.26 -0.79 120.64 133.74 2gra n GLU 164 Ca 0.22 0.25 0.00 0.00 0.66 0.00 0.00 57.16 58.29 2gra n GLU 164 Cb 0.49 -0.44 0.00 0.00 0.27 0.00 0.00 31.44 31.77 2gra n GLU 164 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 2gra n ASP 165 N -3.45 0.00 -0.11 4.31 3.85 -1.26 -0.98 116.55 118.91 2gra n ASP 165 Ca 0.07 0.14 -0.16 0.00 -0.71 0.00 0.00 54.79 54.13 2gra n ASP 165 Cb 0.22 -0.14 -0.13 0.00 -1.35 0.00 0.00 41.12 39.72 2gra n ASP 165 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 2gra n LEU 166 N -1.10 2.07 -0.31 -2.12 4.77 0.03 -4.50 117.00 115.85 2gra n LEU 166 Ca 0.00 -0.06 0.27 0.00 -0.03 0.00 0.00 56.01 56.19 2gra n LEU 166 Cb 0.01 -0.50 0.42 0.00 -2.33 0.00 0.00 43.42 41.02 2gra n LEU 166 CO 0.00 0.80 0.91 -0.38 -1.33 0.00 0.00 177.39 177.38 2gra n ILE 167 N -3.13 0.00 -0.05 -0.08 2.08 -0.15 0.43 119.36 118.47 2gra n ILE 167 Ca -0.41 0.91 -0.14 0.00 0.56 0.00 0.00 62.75 63.67 2gra n ILE 167 Cb 1.04 -1.56 -0.12 0.00 -0.75 0.00 0.00 39.64 38.25 2gra n ILE 167 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 2gra h ASP 168 N 0.00 0.06 0.24 4.38 5.19 -1.79 -2.72 116.42 121.78 2gra h ASP 168 Ca 0.48 -0.87 -0.00 0.00 -0.62 0.00 0.00 57.03 56.02 2gra h ASP 168 Cb 2.22 -0.02 -0.01 0.00 0.18 0.00 0.00 39.33 41.70 2gra h ASP 168 CO -0.01 0.92 -0.18 0.00 -3.12 0.00 0.00 179.24 176.86 2gra h ALA 169 N 0.14 -0.41 -0.30 3.45 0.00 -0.31 0.18 119.26 122.01 2gra h ALA 169 Ca -0.01 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 54.91 2gra h ALA 169 Cb 0.94 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2gra h ALA 169 CO 0.02 -0.75 0.58 0.28 0.00 0.00 0.00 179.25 179.38 2gra h VAL 170 N -0.43 0.14 0.15 0.00 2.07 -1.48 0.55 116.25 117.25 2gra h VAL 170 Ca -0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 2gra h VAL 170 Cb 0.37 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 2gra h VAL 170 CO -0.01 0.00 -0.07 0.74 0.02 0.00 0.00 177.57 178.25 2gra h THR 171 N 0.00 1.00 -0.23 2.57 2.02 -0.32 -0.37 112.91 117.58 2gra h THR 171 Ca 0.14 -0.99 0.05 0.00 0.77 0.00 0.00 66.41 66.39 2gra h THR 171 Cb 1.29 1.57 -0.05 0.00 -1.74 0.00 0.00 68.15 69.23 2gra h THR 171 CO -0.00 0.22 -0.10 1.23 0.37 0.00 0.00 175.52 177.24 2gra h GLY 172 N -0.70 0.10 0.00 2.16 0.00 0.42 0.37 103.07 105.43 2gra h GLY 172 Ca -0.02 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.43 2gra h GLY 172 CO 0.03 -0.12 0.00 -0.10 0.00 0.00 0.00 176.54 176.35 2gra n LEU 173 N -5.26 1.02 0.26 3.11 0.00 -0.53 -3.38 117.00 112.23 2gra n LEU 173 Ca -0.01 0.42 0.15 0.00 0.00 0.00 0.00 56.01 56.57 2gra n LEU 173 Cb 0.18 -0.21 0.60 0.00 0.00 0.00 0.00 43.42 43.99 2gra n LEU 173 CO 0.21 -0.21 0.94 -1.28 0.00 0.00 0.00 177.39 177.05 2gra h SER 174 N 0.00 0.00 0.07 1.96 0.87 -1.23 -2.27 113.55 112.95 2gra h SER 174 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2gra h SER 174 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2gra h SER 174 CO 0.00 0.04 -0.03 1.23 -0.53 0.00 0.00 176.83 177.54 2gra h GLY 175 N 2.20 -0.09 1.15 5.77 0.00 0.53 -3.40 103.07 109.22 2gra h GLY 175 Ca -0.00 0.03 -0.29 0.00 0.00 0.00 0.00 47.33 47.07 2gra h GLY 175 CO 0.01 -0.03 -1.26 1.76 0.00 0.00 0.00 176.54 177.01 2gra h SER 176 N -1.01 0.80 0.00 0.19 0.02 -1.35 -3.41 113.55 108.80 2gra h SER 176 Ca -0.01 -0.88 0.00 0.00 -0.84 0.00 0.00 61.79 60.06 2gra h SER 176 Cb 0.25 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2gra h SER 176 CO 0.01 1.61 0.00 0.61 -1.14 0.00 0.00 176.83 177.93 2gra n GLY 177 N 1.55 0.00 0.54 -3.77 0.00 -0.85 0.12 105.19 102.78 2gra n GLY 177 Ca -0.15 0.00 0.39 0.00 0.00 0.00 0.00 46.02 46.26 2gra n GLY 177 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2gra h PRO 178 N 0.00 0.07 -0.24 1.61 0.11 -1.84 1.26 132.00 132.98 2gra h PRO 178 Ca 0.00 -0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.94 2gra h PRO 178 Cb 0.00 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.09 2gra h PRO 178 CO 0.00 0.05 -0.53 0.00 -0.21 0.00 0.00 178.00 177.31 2gra h ALA 179 N 1.39 0.62 -0.25 -0.75 0.00 0.62 -0.49 119.26 120.39 2gra h ALA 179 Ca 0.76 -0.51 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 2gra h ALA 179 Cb 2.70 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 20.39 2gra h ALA 179 CO -0.19 0.68 0.05 1.88 0.00 0.00 0.00 179.25 181.67 2gra h TYR 180 N 0.54 0.44 0.69 0.00 0.99 0.14 0.24 116.97 120.01 2gra h TYR 180 Ca 0.02 -0.06 -0.03 0.00 2.00 0.00 0.00 58.73 60.66 2gra h TYR 180 Cb 1.10 -0.12 -0.01 0.00 1.00 0.00 0.00 36.73 38.69 2gra h TYR 180 CO 0.06 0.52 -0.50 0.00 -0.00 0.00 0.00 178.16 178.23 2gra h ALA 181 N 0.87 -1.24 -0.97 3.88 0.00 -0.88 0.54 119.26 121.46 2gra h ALA 181 Ca 0.08 -0.23 0.26 0.00 0.00 0.00 0.00 54.91 55.01 2gra h ALA 181 Cb 0.31 0.66 -0.13 0.00 0.00 0.00 0.00 17.79 18.63 2gra h ALA 181 CO 0.00 -1.22 0.53 0.74 0.00 0.00 0.00 179.25 179.30 2gra h PHE 182 N -1.14 0.89 -0.13 0.00 0.05 -1.00 1.54 116.94 117.15 2gra h PHE 182 Ca -0.09 0.04 -0.13 0.00 3.82 0.00 0.00 57.97 61.61 2gra h PHE 182 Cb 0.94 -0.24 -0.01 0.00 2.00 0.00 0.00 35.95 38.64 2gra h PHE 182 CO -0.16 -0.03 -0.47 1.15 -0.18 0.00 0.00 178.31 178.62 2gra h THR 183 N 0.47 1.33 0.08 -1.55 2.02 -0.18 -1.72 112.91 113.36 2gra h THR 183 Ca 0.64 -1.67 -0.29 0.00 0.77 0.00 0.00 66.41 65.86 2gra h THR 183 Cb 1.29 1.75 0.02 0.00 -1.74 0.00 0.00 68.15 69.47 2gra h THR 183 CO -0.53 0.50 -1.18 0.00 0.37 0.00 0.00 175.52 174.69 2gra h ALA 184 N 1.25 0.06 -0.10 6.16 0.00 0.67 -2.73 119.26 124.57 2gra h ALA 184 Ca 0.02 -0.75 -0.06 0.00 0.00 0.00 0.00 54.91 54.11 2gra h ALA 184 Cb 0.93 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2gra h ALA 184 CO 0.08 0.71 -0.21 -0.07 0.00 0.00 0.00 179.25 179.76 2gra h LEU 185 N 0.30 0.16 0.01 0.00 3.38 0.17 -2.11 115.31 117.21 2gra h LEU 185 Ca -0.17 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.77 2gra h LEU 185 Cb 1.84 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.55 2gra h LEU 185 CO 0.22 0.38 -0.00 -0.78 0.09 0.00 0.00 178.44 178.35 2gra h ASP 186 N 0.15 -0.01 -0.70 -0.43 3.58 -1.34 -2.46 116.42 115.21 2gra h ASP 186 Ca 0.03 -0.60 0.11 0.00 0.42 0.00 0.00 57.03 56.98 2gra h ASP 186 Cb 0.46 0.00 -0.08 0.00 1.72 0.00 0.00 39.33 41.43 2gra h ASP 186 CO 0.03 0.60 0.31 0.00 -2.88 0.00 0.00 179.24 177.31 2gra h ALA 187 N 0.36 0.96 0.01 -0.78 0.00 -1.29 -1.23 119.26 117.29 2gra h ALA 187 Ca -0.00 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2gra h ALA 187 Cb 0.61 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2gra h ALA 187 CO 0.00 -0.12 -0.00 -0.07 0.00 0.00 0.00 179.25 179.06 2gra h LEU 188 N 0.52 -0.01 -0.89 0.00 3.38 -1.42 -0.07 115.31 116.82 2gra h LEU 188 Ca 0.36 -0.12 0.24 0.00 0.09 0.00 0.00 57.88 58.44 2gra h LEU 188 Cb 0.44 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.06 2gra h LEU 188 CO -0.31 0.11 0.32 0.00 0.09 0.00 0.00 178.44 178.65 2gra h ALA 189 N 0.86 1.38 -0.24 1.53 0.00 -0.84 1.94 119.26 123.90 2gra h ALA 189 Ca -0.00 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2gra h ALA 189 Cb 0.13 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2gra h ALA 189 CO 0.00 -0.43 0.12 -0.44 0.00 0.00 0.00 179.25 178.50 2gra h ASP 190 N 0.28 0.30 0.15 0.00 5.19 -0.56 -0.93 116.42 120.86 2gra h ASP 190 Ca 0.57 -0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.86 2gra h ASP 190 Cb 1.13 -0.08 -0.02 0.00 0.18 0.00 0.00 39.33 40.55 2gra h ASP 190 CO -0.60 0.33 -0.26 1.23 -3.12 0.00 0.00 179.24 176.82 2gra h GLY 191 N 0.26 -1.10 -0.44 2.75 0.00 0.43 0.58 103.07 105.55 2gra h GLY 191 Ca 0.08 0.53 0.04 0.00 0.00 0.00 0.00 47.33 47.98 2gra h GLY 191 CO -0.01 -0.35 -0.26 0.61 0.00 0.00 0.00 176.54 176.53 2gra n GLY 192 N -1.26 -2.49 0.40 4.60 0.00 0.44 -1.36 105.19 105.52 2gra n GLY 192 Ca -0.05 0.78 -0.12 0.00 0.00 0.00 0.00 46.02 46.63 2gra n GLY 192 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2gra h VAL 193 N 0.00 0.00 -1.28 1.61 2.07 -0.84 0.27 116.25 118.08 2gra h VAL 193 Ca 0.07 0.00 0.37 0.00 0.82 0.00 0.00 66.70 67.96 2gra h VAL 193 Cb 0.18 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.90 2gra h VAL 193 CO -0.41 0.00 1.08 0.50 0.02 0.00 0.00 177.57 178.75 2gra h LYS 194 N -0.31 0.00 -1.22 1.57 3.64 0.39 2.34 116.57 122.98 2gra h LYS 194 Ca 0.07 0.00 -0.49 0.00 -1.27 0.00 0.00 60.65 58.96 2gra h LYS 194 Cb 0.51 0.00 -0.22 0.00 -0.41 0.00 0.00 32.23 32.11 2gra h LYS 194 CO -0.56 0.00 0.63 -1.33 -2.27 0.00 0.00 179.45 175.92 2gra n MET 195 N -3.78 2.22 -1.05 1.90 2.81 0.91 -4.84 117.12 115.29 2gra n MET 195 Ca 0.28 -2.43 -0.02 0.00 -1.81 0.00 0.00 57.70 53.72 2gra n MET 195 Cb 1.48 -1.95 -0.01 0.00 -0.71 0.00 0.00 33.22 32.03 2gra n MET 195 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2gra n GLY 196 N -0.37 0.29 3.76 3.03 0.00 0.78 -4.98 105.19 107.70 2gra n GLY 196 Ca 0.47 -0.03 -0.39 0.00 0.00 0.00 0.00 46.02 46.06 2gra n GLY 196 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gra s LEU 197 N -0.41 4.46 0.29 0.99 1.43 -0.91 -4.94 118.68 119.59 2gra s LEU 197 Ca 0.00 1.38 -0.29 0.00 -1.03 0.00 0.00 54.13 54.19 2gra s LEU 197 Cb 0.00 -3.13 -0.10 0.00 0.03 0.00 0.00 46.19 42.98 2gra s LEU 197 CO 0.00 0.07 1.36 -2.16 0.23 0.00 0.00 176.35 175.85 2gra s PRO 198 N -0.25 4.32 0.00 1.29 0.04 -1.26 -3.25 135.00 135.89 2gra s PRO 198 Ca 0.36 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.64 2gra s PRO 198 Cb -0.20 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.25 2gra s PRO 198 CO 0.21 -0.29 0.64 -2.13 0.04 0.00 0.00 177.00 175.48 2gra n ARG 199 N 1.49 0.00 -0.34 4.56 3.00 -1.26 0.40 116.66 124.50 2gra n ARG 199 Ca 0.03 0.46 0.32 0.00 -0.00 0.00 0.00 57.85 58.66 2gra n ARG 199 Cb 0.41 -1.14 0.48 0.00 0.00 0.00 0.00 32.46 32.22 2gra n ARG 199 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2gra n ARG 200 N -1.34 0.01 -0.06 -0.14 5.12 -1.26 -0.05 116.66 118.94 2gra n ARG 200 Ca 0.00 0.86 -0.03 0.00 -1.93 0.00 0.00 57.85 56.75 2gra n ARG 200 Cb 0.00 -2.09 -0.01 0.00 -1.16 0.00 0.00 32.46 29.20 2gra n ARG 200 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 2gra h LEU 201 N 0.00 0.00 -0.05 0.55 5.85 -1.59 -3.38 115.31 116.69 2gra h LEU 201 Ca 0.55 0.00 0.02 0.00 0.84 0.00 0.00 57.88 59.30 2gra h LEU 201 Cb 2.71 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 43.69 2gra h LEU 201 CO -0.01 0.69 -0.46 0.00 -0.34 0.00 0.00 178.44 178.32 2gra h ALA 202 N -1.01 -0.86 0.00 1.25 0.00 0.36 0.20 119.26 119.21 2gra h ALA 202 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2gra h ALA 202 Cb 0.38 0.91 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2gra h ALA 202 CO 0.00 -1.01 0.00 1.55 0.00 0.00 0.00 179.25 179.79 2gra n VAL 203 N -4.99 0.07 -1.14 0.00 3.14 -0.09 -1.29 118.33 114.03 2gra n VAL 203 Ca -0.06 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.32 2gra n VAL 203 Cb 0.33 -0.32 0.00 0.00 -1.06 0.00 0.00 33.84 32.79 2gra n VAL 203 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2gra n ARG 204 N 0.67 0.00 -0.08 1.45 5.12 0.04 -4.69 116.66 119.17 2gra n ARG 204 Ca 0.00 -0.01 -0.11 0.00 -1.93 0.00 0.00 57.85 55.80 2gra n ARG 204 Cb 0.05 -0.43 -0.07 0.00 -1.16 0.00 0.00 32.46 30.86 2gra n ARG 204 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2gra n LEU 205 N 0.00 2.90 0.14 0.55 4.77 -0.41 -3.93 117.00 121.03 2gra n LEU 205 Ca 0.00 -0.07 0.05 0.00 -0.03 0.00 0.00 56.01 55.96 2gra n LEU 205 Cb 0.25 -0.53 0.50 0.00 -2.33 0.00 0.00 43.42 41.32 2gra n LEU 205 CO 0.00 0.74 1.05 1.23 -1.33 0.00 0.00 177.39 179.07 2gra h GLY 206 N 1.08 0.25 0.53 -0.72 0.00 -1.84 1.15 103.07 103.51 2gra h GLY 206 Ca -0.34 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 46.86 2gra h GLY 206 CO -0.06 0.10 -0.25 0.00 0.00 0.00 0.00 176.54 176.33 2gra h ALA 207 N 1.82 -0.83 -1.08 3.60 0.00 -1.84 -1.04 119.26 119.89 2gra h ALA 207 Ca 0.06 -0.16 0.29 0.00 0.00 0.00 0.00 54.91 55.10 2gra h ALA 207 Cb 0.09 0.28 -0.09 0.00 0.00 0.00 0.00 17.79 18.06 2gra h ALA 207 CO -0.00 -0.78 0.70 0.37 0.00 0.00 0.00 179.25 179.54 2gra h GLN 208 N -1.01 0.32 0.52 0.00 5.75 -1.52 0.14 115.11 119.30 2gra h GLN 208 Ca -0.07 -0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.38 2gra h GLN 208 Cb 0.55 -0.07 0.01 0.00 1.07 0.00 0.00 27.48 29.03 2gra h GLN 208 CO 0.12 0.21 -0.25 0.00 -2.65 0.00 0.00 178.83 176.26 2gra h ALA 209 N 1.60 -0.69 0.58 3.38 0.00 0.15 -1.76 119.26 122.53 2gra h ALA 209 Ca 0.62 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.33 2gra h ALA 209 Cb 1.68 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 19.72 2gra h ALA 209 CO -0.29 -0.82 -0.51 -0.07 0.00 0.00 0.00 179.25 177.56 2gra h LEU 210 N -0.83 -1.37 -0.96 0.00 3.38 0.56 0.37 115.31 116.47 2gra h LEU 210 Ca -0.07 0.10 0.29 0.00 0.09 0.00 0.00 57.88 58.29 2gra h LEU 210 Cb 0.59 0.44 -0.15 0.00 0.09 0.00 0.00 40.66 41.63 2gra h LEU 210 CO 0.12 -0.70 0.45 0.25 0.09 0.00 0.00 178.44 178.65 2gra h LEU 211 N -1.07 0.33 0.14 1.67 5.85 -1.23 0.65 115.31 121.65 2gra h LEU 211 Ca -0.08 0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 2gra h LEU 211 Cb 0.91 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.13 2gra h LEU 211 CO -0.02 -0.15 -0.07 1.23 -0.34 0.00 0.00 178.44 179.09 2gra h GLY 212 N 0.28 -0.20 -0.17 3.75 0.00 -0.60 -0.26 103.07 105.88 2gra h GLY 212 Ca 0.68 0.07 0.11 0.00 0.00 0.00 0.00 47.33 48.19 2gra h GLY 212 CO -0.63 -0.07 -0.17 0.00 0.00 0.00 0.00 176.54 175.67 2gra h ALA 213 N 0.13 0.32 0.05 3.60 0.00 0.27 0.10 119.26 123.73 2gra h ALA 213 Ca -0.02 0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2gra h ALA 213 Cb 0.47 0.47 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 2gra h ALA 213 CO 0.03 -0.46 -0.03 0.00 0.00 0.00 0.00 179.25 178.79 2gra h ALA 214 N 1.49 -0.92 -1.52 0.00 0.00 0.18 -2.52 119.26 115.97 2gra h ALA 214 Ca 0.27 -0.01 0.48 0.00 0.00 0.00 0.00 54.91 55.65 2gra h ALA 214 Cb 0.44 0.13 -0.11 0.00 0.00 0.00 0.00 17.79 18.24 2gra h ALA 214 CO -0.59 -0.92 1.03 -0.22 0.00 0.00 0.00 179.25 178.55 2gra h LYS 215 N -0.07 0.04 0.12 0.00 3.64 -0.78 0.98 116.57 120.50 2gra h LYS 215 Ca -0.01 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2gra h LYS 215 Cb 0.05 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2gra h LYS 215 CO 0.01 0.02 -0.06 1.98 -2.27 0.00 0.00 179.45 179.13 2gra h MET 216 N 0.04 -0.16 0.00 1.90 4.05 -0.39 -2.48 114.93 117.89 2gra h MET 216 Ca 0.86 0.01 -0.06 0.00 -0.28 0.00 0.00 59.70 60.23 2gra h MET 216 Cb 2.98 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 33.80 2gra h MET 216 CO -0.29 0.12 -0.28 1.25 0.23 0.00 0.00 176.91 177.94 2gra h LEU 217 N -0.42 0.00 -0.16 3.39 5.85 -0.49 -3.12 115.31 120.35 2gra h LEU 217 Ca -0.02 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 2gra h LEU 217 Cb 0.34 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 2gra h LEU 217 CO 0.03 0.28 -0.11 -0.07 -0.34 0.00 0.00 178.44 178.23 2gra h LEU 218 N 0.00 0.38 -3.60 2.25 3.38 -1.25 -2.94 115.31 113.52 2gra h LEU 218 Ca -0.00 -0.44 -0.27 0.00 0.09 0.00 0.00 57.88 57.26 2gra h LEU 218 Cb 0.70 -0.11 -0.11 0.00 0.09 0.00 0.00 40.66 41.23 2gra h LEU 218 CO 0.04 0.74 0.24 1.41 0.09 0.00 0.00 178.44 180.96 2gra n HIS 219 N -4.58 1.07 -3.15 1.13 8.25 -0.94 -4.65 115.22 112.34 2gra n HIS 219 Ca -0.06 -1.71 0.06 0.00 -0.26 0.00 0.00 57.72 55.75 2gra n HIS 219 Cb 0.33 -0.99 -0.01 0.00 1.12 0.00 0.00 29.99 30.44 2gra n HIS 219 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2gra s SER 220 N 0.78 -0.12 0.00 0.41 1.04 -1.11 -4.99 113.70 109.71 2gra s SER 220 Ca 0.32 0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.79 2gra s SER 220 Cb 0.22 1.09 0.00 0.00 0.10 0.00 0.00 66.02 67.43 2gra s SER 220 CO -0.04 -0.02 0.65 -1.84 0.98 0.00 0.00 173.24 172.96 2gra n GLU 221 N 5.22 0.34 -0.09 4.02 0.28 -1.26 -4.07 120.64 125.08 2gra n GLU 221 Ca 0.03 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.89 2gra n GLU 221 Cb 0.57 -1.33 -0.04 0.00 1.43 0.00 0.00 31.44 32.07 2gra n GLU 221 CO 0.00 0.00 0.00 1.96 -0.16 0.00 0.00 177.13 178.93 2gra h GLN 222 N 2.77 0.69 0.00 3.44 1.08 -1.94 -3.50 115.11 117.65 2gra h GLN 222 Ca 0.00 -0.37 0.00 0.00 -1.45 0.00 0.00 58.65 56.83 2gra h GLN 222 Cb 0.34 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 2gra h GLN 222 CO 0.00 0.98 0.00 1.58 -0.95 0.00 0.00 178.83 180.44 2gra n HIS 223 N -4.27 0.00 0.00 2.96 -0.00 -1.26 -4.67 115.22 107.98 2gra n HIS 223 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.68 2gra n HIS 223 Cb 0.47 -0.30 0.00 0.00 -0.00 0.00 0.00 29.99 30.17 2gra n HIS 223 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 2gra n PRO 224 N 1.62 0.00 -0.19 1.57 -0.02 -1.26 -2.06 135.00 134.66 2gra n PRO 224 Ca 0.00 0.57 0.16 0.00 -2.02 0.00 0.00 63.50 62.21 2gra n PRO 224 Cb 0.00 -1.18 0.30 0.00 -0.02 0.00 0.00 33.50 32.60 2gra n PRO 224 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gra n GLY 225 N -0.93 -0.51 0.00 -1.23 0.00 -1.26 -0.73 105.19 100.53 2gra n GLY 225 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.50 2gra n GLY 225 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2gra n GLN 226 N -4.39 0.00 -0.21 1.61 -0.06 -0.87 -1.83 117.38 111.63 2gra n GLN 226 Ca 0.20 0.03 0.30 0.00 -2.00 0.00 0.00 57.00 55.52 2gra n GLN 226 Cb 0.67 -1.00 0.59 0.00 -4.06 0.00 0.00 30.24 26.43 2gra n GLN 226 CO 0.00 0.00 0.00 -0.07 -0.20 0.00 0.00 177.06 176.79 2gra h LEU 227 N 0.00 0.00 0.58 1.69 3.38 -0.90 0.66 115.31 120.73 2gra h LEU 227 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2gra h LEU 227 Cb 0.00 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.76 2gra h LEU 227 CO 0.00 0.00 -0.28 0.50 0.09 0.00 0.00 178.44 178.75 2gra h LYS 228 N 0.00 -0.75 -0.35 1.13 3.64 -0.81 -3.09 116.57 116.35 2gra h LYS 228 Ca 0.48 0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.98 2gra h LYS 228 Cb 2.53 0.17 -0.09 0.00 -0.41 0.00 0.00 32.23 34.43 2gra h LYS 228 CO -0.01 -0.44 -0.33 -0.44 -2.27 0.00 0.00 179.45 175.97 2gra h ASP 229 N -0.99 -1.07 0.00 4.20 5.19 0.11 0.78 116.42 124.63 2gra h ASP 229 Ca -0.08 0.18 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 2gra h ASP 229 Cb 0.66 0.49 0.00 0.00 0.18 0.00 0.00 39.33 40.66 2gra h ASP 229 CO 0.13 -0.33 0.30 0.59 -3.12 0.00 0.00 179.24 176.82 2gra n ASN 230 N -5.41 0.04 -1.30 6.45 4.13 -0.69 0.17 115.26 118.65 2gra n ASN 230 Ca 0.00 0.26 -0.09 0.00 1.68 0.00 0.00 54.58 56.44 2gra n ASN 230 Cb 0.33 -0.25 0.13 0.00 -1.54 0.00 0.00 39.78 38.45 2gra n ASN 230 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 2gra n VAL 231 N -1.35 2.42 -3.55 2.41 0.31 0.27 -4.94 118.33 113.90 2gra n VAL 231 Ca -0.00 -3.60 -0.29 0.00 -0.01 0.00 0.00 64.34 60.44 2gra n VAL 231 Cb 0.31 -0.65 -0.13 0.00 -0.91 0.00 0.00 33.84 32.46 2gra n VAL 231 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2gra s SER 232 N -3.28 3.33 0.27 4.52 0.01 0.13 -4.82 113.70 113.85 2gra s SER 232 Ca 0.45 -1.97 -0.30 0.00 1.31 0.00 0.00 55.95 55.44 2gra s SER 232 Cb 0.39 -0.53 -0.10 0.00 0.21 0.00 0.00 66.02 65.99 2gra s SER 232 CO -0.02 -0.35 1.40 -0.94 0.41 0.00 0.00 173.24 173.75 2gra s SER 233 N 1.28 6.69 0.60 2.44 1.04 -1.26 -4.85 113.70 119.63 2gra s SER 233 Ca 0.15 2.67 0.28 0.00 0.48 0.00 0.00 55.95 59.53 2gra s SER 233 Cb -0.21 -2.63 1.46 0.00 0.10 0.00 0.00 66.02 64.74 2gra s SER 233 CO -0.11 -0.66 1.87 -0.65 0.98 0.00 0.00 173.24 174.67 2gra h PRO 234 N 4.59 0.00 0.00 4.02 0.11 -1.99 -3.16 132.00 135.57 2gra h PRO 234 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2gra h PRO 234 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2gra h PRO 234 CO 0.74 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.94 2gra n GLY 235 N -1.47 -2.92 0.00 -0.55 0.00 -1.26 -5.04 105.19 93.95 2gra n GLY 235 Ca 0.07 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2gra n GLY 235 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gra n GLY 236 N -0.70 1.11 7.00 -0.02 0.00 -1.20 -4.95 105.19 106.43 2gra n GLY 236 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.60 2gra n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gra n ALA 237 N -3.00 0.00 -0.35 4.61 0.00 -1.26 -3.95 120.51 116.56 2gra n ALA 237 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 2gra n ALA 237 Cb 0.00 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.54 2gra n ALA 237 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2gra h THR 238 N 0.00 0.03 -0.81 0.00 2.02 -1.92 1.79 112.91 114.02 2gra h THR 238 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 2gra h THR 238 Cb 0.00 0.03 -0.04 0.00 -1.74 0.00 0.00 68.15 66.40 2gra h THR 238 CO 0.00 0.00 0.43 0.40 0.37 0.00 0.00 175.52 176.72 2gra h ILE 239 N -0.01 1.24 -0.55 3.11 1.08 -1.85 0.52 117.51 121.05 2gra h ILE 239 Ca 0.40 -0.61 -0.06 0.00 -0.39 0.00 0.00 64.86 64.20 2gra h ILE 239 Cb 0.65 0.15 -0.02 0.00 -3.07 0.00 0.00 36.82 34.53 2gra h ILE 239 CO -0.97 0.27 0.11 0.45 -0.69 0.00 0.00 178.15 177.32 2gra h HIS 240 N 1.14 0.96 0.17 1.37 3.86 0.21 0.29 115.15 123.16 2gra h HIS 240 Ca 0.29 -0.13 -0.01 0.00 -1.16 0.00 0.00 60.37 59.36 2gra h HIS 240 Cb 0.04 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.25 2gra h HIS 240 CO 0.01 0.84 -0.08 0.00 0.86 0.00 0.00 177.93 179.55 2gra h ALA 241 N 1.00 -0.23 -0.55 2.45 0.00 0.85 -2.40 119.26 120.38 2gra h ALA 241 Ca 0.17 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.07 2gra h ALA 241 Cb 0.38 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 18.17 2gra h ALA 241 CO 0.01 -0.61 -0.55 -0.07 0.00 0.00 0.00 179.25 178.02 2gra h LEU 242 N -0.28 -1.90 -1.97 0.00 3.38 -0.53 0.68 115.31 114.70 2gra h LEU 242 Ca -0.02 0.26 0.25 0.00 0.09 0.00 0.00 57.88 58.46 2gra h LEU 242 Cb 0.22 0.80 -0.03 0.00 0.09 0.00 0.00 40.66 41.73 2gra h LEU 242 CO 0.04 -0.36 0.66 -0.74 0.09 0.00 0.00 178.44 178.12 2gra h HIS 243 N -0.30 0.00 0.34 1.13 2.76 -0.70 0.32 115.15 118.70 2gra h HIS 243 Ca 0.10 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.26 2gra h HIS 243 Cb 0.55 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.52 2gra h HIS 243 CO -0.79 0.00 -0.16 0.28 -1.30 0.00 0.00 177.93 175.96 2gra h VAL 244 N 0.00 0.35 -0.49 5.26 2.07 0.82 -1.27 116.25 122.99 2gra h VAL 244 Ca 0.41 -0.75 0.09 0.00 0.82 0.00 0.00 66.70 67.27 2gra h VAL 244 Cb 1.72 0.57 -0.07 0.00 -1.52 0.00 0.00 31.29 31.98 2gra h VAL 244 CO -0.00 0.08 0.06 -0.07 0.02 0.00 0.00 177.57 177.66 2gra h LEU 245 N -1.02 -0.08 -0.90 2.57 3.38 0.11 0.16 115.31 119.54 2gra h LEU 245 Ca -0.05 0.10 0.18 0.00 0.09 0.00 0.00 57.88 58.20 2gra h LEU 245 Cb 0.48 0.15 -0.11 0.00 0.09 0.00 0.00 40.66 41.28 2gra h LEU 245 CO 0.08 -0.01 0.46 -0.08 0.09 0.00 0.00 178.44 178.98 2gra h GLU 246 N 0.19 0.57 0.00 1.13 4.57 -0.44 0.18 114.58 120.77 2gra h GLU 246 Ca 0.25 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.39 2gra h GLU 246 Cb 0.35 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 2gra h GLU 246 CO -0.35 0.37 0.00 0.43 -1.18 0.00 0.00 179.01 178.28 2gra n SER 247 N -4.90 0.00 -1.12 1.04 7.64 0.56 -2.38 113.62 114.46 2gra n SER 247 Ca 0.20 0.45 -0.02 0.00 1.01 0.00 0.00 58.87 60.51 2gra n SER 247 Cb 0.54 -0.47 0.21 0.00 -1.01 0.00 0.00 64.21 63.48 2gra n SER 247 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gra n GLY 248 N -0.21 4.68 2.54 0.23 0.00 0.61 -4.93 105.19 108.12 2gra n GLY 248 Ca 0.03 -1.18 -0.10 0.00 0.00 0.00 0.00 46.02 44.78 2gra n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gra n GLY 249 N -0.99 -0.50 0.31 -0.02 0.00 -1.00 -4.78 105.19 98.21 2gra n GLY 249 Ca 0.31 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.46 2gra n GLY 249 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2gra h PHE 250 N -0.08 0.14 0.55 1.61 3.57 -1.72 0.34 116.94 121.35 2gra h PHE 250 Ca -0.21 0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.33 2gra h PHE 250 Cb 1.16 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.97 2gra h PHE 250 CO 0.76 -0.30 -0.40 0.00 -2.23 0.00 0.00 178.31 176.14 2gra h ARG 251 N 0.11 -0.89 -0.88 1.11 3.08 -1.86 -2.76 114.38 112.29 2gra h ARG 251 Ca 0.54 0.06 0.11 0.00 0.07 0.00 0.00 59.98 60.77 2gra h ARG 251 Cb 1.10 0.20 -0.13 0.00 0.08 0.00 0.00 29.97 31.22 2gra h ARG 251 CO -0.75 -0.59 -0.48 1.03 -1.07 0.00 0.00 179.97 178.11 2gra h SER 252 N -0.92 -1.75 -0.66 7.04 0.87 -0.74 0.37 113.55 117.77 2gra h SER 252 Ca -0.06 0.30 0.13 0.00 -1.23 0.00 0.00 61.79 60.93 2gra h SER 252 Cb 0.77 0.82 -0.04 0.00 -0.44 0.00 0.00 62.40 63.51 2gra h SER 252 CO 0.02 -0.28 0.45 -0.07 -0.53 0.00 0.00 176.83 176.42 2gra h LEU 253 N -0.07 0.30 -0.59 2.23 3.38 -1.11 0.34 115.31 119.80 2gra h LEU 253 Ca 0.23 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.15 2gra h LEU 253 Cb 0.52 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2gra h LEU 253 CO -0.89 0.16 -0.30 -0.07 0.09 0.00 0.00 178.44 177.44 2gra h LEU 254 N 0.33 0.00 0.08 1.67 3.38 0.00 -1.37 115.31 119.40 2gra h LEU 254 Ca 0.32 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.28 2gra h LEU 254 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2gra h LEU 254 CO -0.08 0.30 -0.04 0.40 0.09 0.00 0.00 178.44 179.11 2gra h ILE 255 N 0.00 0.78 -0.96 1.22 1.08 0.17 -3.04 117.51 116.77 2gra h ILE 255 Ca -0.00 -1.38 0.30 0.00 -0.39 0.00 0.00 64.86 63.38 2gra h ILE 255 Cb 1.01 1.41 -0.16 0.00 -3.07 0.00 0.00 36.82 36.00 2gra h ILE 255 CO 0.04 0.24 0.30 0.78 -0.69 0.00 0.00 178.15 178.82 2gra h ASN 256 N -0.96 0.02 0.20 1.72 4.21 -0.51 0.97 115.58 121.24 2gra h ASN 256 Ca -0.01 0.23 -0.00 0.00 1.21 0.00 0.00 56.30 57.73 2gra h ASN 256 Cb 0.48 0.31 -0.02 0.00 -1.12 0.00 0.00 38.32 37.96 2gra h ASN 256 CO 0.02 -0.27 -0.32 0.00 -1.29 0.00 0.00 177.43 175.56 2gra h ALA 257 N 1.90 -0.93 0.07 -0.83 0.00 -1.27 0.39 119.26 118.59 2gra h ALA 257 Ca 0.66 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.48 2gra h ALA 257 Cb 1.49 0.64 -0.02 0.00 0.00 0.00 0.00 17.79 19.90 2gra h ALA 257 CO -0.75 -0.97 -0.21 0.28 0.00 0.00 0.00 179.25 177.60 2gra h VAL 258 N -0.56 0.00 -0.76 0.00 2.07 -0.77 -0.39 116.25 115.85 2gra h VAL 258 Ca -0.02 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.56 2gra h VAL 258 Cb 0.51 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.19 2gra h VAL 258 CO -0.10 0.00 -0.45 1.21 0.02 0.00 0.00 177.57 178.25 2gra n GLU 259 N -3.65 -0.33 -0.26 1.57 2.13 -0.20 -0.64 120.64 119.26 2gra n GLU 259 Ca -0.04 1.34 0.06 0.00 0.66 0.00 0.00 57.16 59.19 2gra n GLU 259 Cb 0.17 -1.98 0.18 0.00 0.27 0.00 0.00 31.44 30.08 2gra n GLU 259 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2gra h ALA 260 N 0.18 0.91 -0.15 4.31 0.00 -0.60 0.12 119.26 124.02 2gra h ALA 260 Ca 0.12 0.21 -0.14 0.00 0.00 0.00 0.00 54.91 55.10 2gra h ALA 260 Cb 0.31 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2gra h ALA 260 CO -0.71 -0.39 -0.51 1.03 0.00 0.00 0.00 179.25 178.67 2gra h SER 261 N 0.19 0.45 0.04 0.00 0.87 0.77 -2.52 113.55 113.34 2gra h SER 261 Ca 0.43 -0.23 -0.00 0.00 -1.23 0.00 0.00 61.79 60.76 2gra h SER 261 Cb 0.76 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.59 2gra h SER 261 CO -0.59 0.88 -0.02 0.00 -0.53 0.00 0.00 176.83 176.57 2gra h ILE 263 N -0.41 0.83 -0.10 0.00 1.08 -0.87 -1.34 117.51 116.70 2gra h ILE 263 Ca -0.00 -0.29 -0.01 0.00 -0.39 0.00 0.00 64.86 64.16 2gra h ILE 263 Cb 0.38 -0.08 -0.00 0.00 -3.07 0.00 0.00 36.82 34.05 2gra h ILE 263 CO 0.01 0.15 0.02 -0.09 -0.69 0.00 0.00 178.15 177.55 2gra h ARG 264 N 0.84 0.17 -0.29 2.37 9.65 -1.33 -1.69 114.38 124.10 2gra h ARG 264 Ca 0.51 -0.05 0.08 0.00 -1.10 0.00 0.00 59.98 59.42 2gra h ARG 264 Cb 0.68 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.23 2gra h ARG 264 CO -0.28 0.38 0.21 1.15 2.80 0.00 0.00 179.97 184.23 2gra h THR 265 N -0.07 0.83 0.27 0.20 2.02 -0.73 0.23 112.91 115.66 2gra h THR 265 Ca 0.03 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 2gra h THR 265 Cb 0.29 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 67.56 2gra h THR 265 CO 0.00 0.00 -0.13 0.03 0.37 0.00 0.00 175.52 175.79 2gra h ARG 266 N 0.00 -0.34 -1.03 6.66 3.08 -1.00 -3.08 114.38 118.67 2gra h ARG 266 Ca 0.14 0.02 0.27 0.00 0.07 0.00 0.00 59.98 60.48 2gra h ARG 266 Cb 0.56 0.08 -0.07 0.00 0.08 0.00 0.00 29.97 30.61 2gra h ARG 266 CO -0.00 -0.23 0.69 0.93 -1.07 0.00 0.00 179.97 180.29 2gra h GLU 267 N -1.00 0.27 0.01 0.04 5.08 -0.97 1.41 114.58 119.43 2gra h GLU 267 Ca -0.04 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2gra h GLU 267 Cb 0.27 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2gra h GLU 267 CO 0.06 0.18 -0.09 1.25 -1.00 0.00 0.00 179.01 179.41 2gra h LEU 268 N 0.28 -0.29 -0.71 1.33 5.85 -0.58 -2.61 115.31 118.58 2gra h LEU 268 Ca 0.55 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 59.25 2gra h LEU 268 Cb 1.61 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.72 2gra h LEU 268 CO -0.19 -0.10 0.26 -0.61 -0.34 0.00 0.00 178.44 177.46 2gra h GLN 269 N -0.13 1.08 0.00 1.25 5.75 -1.05 -3.02 115.11 119.00 2gra h GLN 269 Ca 0.00 -0.21 0.00 0.00 -0.15 0.00 0.00 58.65 58.29 2gra h GLN 269 Cb 0.13 -0.17 0.00 0.00 1.07 0.00 0.00 27.48 28.51 2gra h GLN 269 CO -0.06 0.91 0.00 0.43 -2.65 0.00 0.00 178.83 177.46 2gra n SER 270 N -4.33 0.00 -0.19 -0.69 7.64 0.47 0.16 113.62 116.69 2gra n SER 270 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.94 2gra n SER 270 Cb 0.20 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 2gra n SER 270 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 2gra n MET 271 N -0.64 0.00 -0.04 1.43 -0.00 -1.15 -4.71 117.12 112.02 2gra n MET 271 Ca 0.00 -0.26 -0.16 0.00 -0.00 0.00 0.00 57.70 57.29 2gra n MET 271 Cb 0.00 -0.19 -0.14 0.00 -0.00 0.00 0.00 33.22 32.90 2gra n MET 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2gra n ALA 272 N 0.00 1.23 0.08 3.17 0.00 0.43 -3.54 120.51 121.87 2gra n ALA 272 Ca 0.00 -0.82 0.05 0.00 0.00 0.00 0.00 53.44 52.67 2gra n ALA 272 Cb 0.53 -0.56 -0.03 0.00 0.00 0.00 0.00 19.45 19.38 2gra n ALA 272 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2gra h ASP 273 N 0.03 0.00 0.00 0.00 3.04 -1.83 -3.41 116.42 114.26 2gra h ASP 273 Ca -0.43 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.36 2gra h ASP 273 Cb 2.03 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 40.32 2gra h ASP 273 CO 0.05 0.31 0.00 0.00 -2.04 0.00 0.00 179.24 177.56 2gra n GLN 274 N -2.84 0.00 0.00 4.15 6.02 -1.26 -5.17 117.38 118.29 2gra n GLN 274 Ca -0.04 0.01 0.15 0.00 -0.01 0.00 0.00 57.00 57.11 2gra n GLN 274 Cb 0.70 -0.59 0.83 0.00 1.02 0.00 0.00 30.24 32.20 2gra n GLN 274 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44