#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gra s GLY 0 N 0.00 0.35 0.00 5.14 0.00 -1.26 -5.01 107.32 106.54 2gra s GLY 0 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 44.72 44.57 2gra s GLY 0 CO 0.00 1.52 0.00 1.15 0.00 0.00 0.00 173.10 175.77 2gra n MET 1 N 5.25 0.00 -3.41 2.90 0.00 -1.26 -5.15 117.12 115.45 2gra n MET 1 Ca -0.06 0.00 -0.12 0.00 0.00 0.00 0.00 57.70 57.52 2gra n MET 1 Cb 0.49 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.68 2gra n MET 1 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 2gra n SER 2 N 0.00 -0.76 -3.81 3.17 2.88 -1.26 -4.86 113.62 108.99 2gra n SER 2 Ca 0.00 -2.43 -0.12 0.00 -1.33 0.00 0.00 58.87 54.98 2gra n SER 2 Cb 0.00 1.52 -0.11 0.00 -0.75 0.00 0.00 64.21 64.87 2gra n SER 2 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2gra s VAL 3 N -2.81 0.02 -1.15 2.46 1.01 -1.26 -3.54 120.40 115.13 2gra s VAL 3 Ca 0.24 -0.15 -0.10 0.00 0.00 0.00 0.00 61.98 61.97 2gra s VAL 3 Cb 0.00 -0.35 0.24 0.00 0.00 0.00 0.00 36.38 36.28 2gra s VAL 3 CO 0.17 -0.08 1.28 0.61 0.00 0.00 0.00 175.10 177.08 2gra n GLY 4 N 2.60 4.07 2.95 4.51 0.00 0.42 -3.71 105.19 116.02 2gra n GLY 4 Ca -0.15 -2.40 -0.42 0.00 0.00 0.00 0.00 46.02 43.05 2gra n GLY 4 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2gra n PHE 5 N 3.50 2.86 0.09 1.61 3.72 -1.20 -0.91 117.46 127.14 2gra n PHE 5 Ca 0.29 -2.42 0.03 0.00 -0.05 0.00 0.00 57.45 55.30 2gra n PHE 5 Cb 0.39 -2.21 0.17 0.00 -0.94 0.00 0.00 39.48 36.90 2gra n PHE 5 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 2gra n ILE 6 N 5.64 1.67 -4.65 4.37 5.41 -1.13 -0.60 119.36 130.06 2gra n ILE 6 Ca 0.51 0.52 -0.34 0.00 1.00 0.00 0.00 62.75 64.44 2gra n ILE 6 Cb 0.40 -1.50 -0.12 0.00 -0.71 0.00 0.00 39.64 37.72 2gra n ILE 6 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2gra s GLY 7 N -3.14 1.67 0.05 7.39 0.00 -1.22 -4.38 107.32 107.70 2gra s GLY 7 Ca 0.00 -0.90 0.03 0.00 0.00 0.00 0.00 44.72 43.86 2gra s GLY 7 CO 0.08 -0.61 -0.09 0.00 0.00 0.00 0.00 173.10 172.48 2gra s ALA 8 N -0.65 0.73 0.00 3.20 0.00 -1.10 -4.57 121.76 119.37 2gra s ALA 8 Ca 0.10 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.24 2gra s ALA 8 Cb -0.11 0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.01 2gra s ALA 8 CO 0.02 0.03 0.00 0.41 0.00 0.00 0.00 175.76 176.22 2gra n GLY 9 N 1.44 1.80 0.00 0.00 0.00 -1.26 -4.87 105.19 102.30 2gra n GLY 9 Ca -0.22 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.00 2gra n GLY 9 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2gra n GLN 10 N 0.00 0.00 0.23 1.61 3.00 -1.26 -2.69 117.38 118.26 2gra n GLN 10 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.04 2gra n GLN 10 Cb 0.00 0.00 0.25 0.00 0.00 0.00 0.00 30.24 30.49 2gra n GLN 10 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 2gra h LEU 11 N 0.00 0.00 0.25 1.08 3.38 -1.93 0.33 115.31 118.42 2gra h LEU 11 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2gra h LEU 11 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2gra h LEU 11 CO 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 178.44 178.41 2gra h ALA 12 N 0.59 -0.34 -0.88 1.53 0.00 -1.81 -2.61 119.26 115.75 2gra h ALA 12 Ca 0.00 -0.18 0.21 0.00 0.00 0.00 0.00 54.91 54.94 2gra h ALA 12 Cb 1.18 0.13 -0.12 0.00 0.00 0.00 0.00 17.79 18.98 2gra h ALA 12 CO 0.00 -0.38 0.38 0.35 0.00 0.00 0.00 179.25 179.60 2gra h PHE 13 N -0.96 0.63 0.00 0.00 -0.00 -0.13 0.63 116.94 117.10 2gra h PHE 13 Ca -0.03 0.04 0.00 0.00 -0.00 0.00 0.00 57.97 57.98 2gra h PHE 13 Cb 0.47 -0.14 0.00 0.00 -0.00 0.00 0.00 35.95 36.28 2gra h PHE 13 CO 0.05 -0.03 0.00 0.00 -0.00 0.00 0.00 178.31 178.33 2gra n ALA 14 N -2.51 -0.08 -0.32 2.41 0.00 -1.03 0.02 120.51 119.01 2gra n ALA 14 Ca 0.21 0.00 0.23 0.00 0.00 0.00 0.00 53.44 53.88 2gra n ALA 14 Cb 0.62 0.05 0.52 0.00 0.00 0.00 0.00 19.45 20.64 2gra n ALA 14 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2gra h LEU 15 N 0.00 0.41 0.00 0.00 4.07 -1.33 1.76 115.31 120.22 2gra h LEU 15 Ca 0.00 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.04 2gra h LEU 15 Cb 0.00 0.01 0.00 0.00 1.08 0.00 0.00 40.66 41.75 2gra h LEU 15 CO 0.00 0.08 0.00 0.00 -1.08 0.00 0.00 178.44 177.44 2gra n ALA 16 N -2.49 0.00 0.13 1.53 0.00 0.22 -0.93 120.51 118.97 2gra n ALA 16 Ca 0.25 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.87 2gra n ALA 16 Cb 0.89 0.10 0.62 0.00 0.00 0.00 0.00 19.45 21.06 2gra n ALA 16 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2gra h LYS 17 N 0.00 0.00 -7.49 0.00 3.64 0.66 -3.38 116.57 110.00 2gra h LYS 17 Ca 0.00 0.00 -0.46 0.00 -1.27 0.00 0.00 60.65 58.92 2gra h LYS 17 Cb 0.00 0.00 0.13 0.00 -0.41 0.00 0.00 32.23 31.95 2gra h LYS 17 CO 0.00 0.00 0.29 0.20 -2.27 0.00 0.00 179.45 177.67 2gra s GLY 18 N -3.66 1.58 -0.12 5.01 0.00 0.59 -3.98 107.32 106.73 2gra s GLY 18 Ca -0.03 -0.53 -0.02 0.00 0.00 0.00 0.00 44.72 44.14 2gra s GLY 18 CO 0.39 0.03 0.04 1.97 0.00 0.00 0.00 173.10 175.53 2gra n PHE 19 N -3.80 -0.16 0.00 1.90 1.16 -1.26 -4.75 117.46 110.55 2gra n PHE 19 Ca 0.07 0.04 0.00 0.00 -1.87 0.00 0.00 57.45 55.69 2gra n PHE 19 Cb 0.59 -0.16 0.00 0.00 -1.61 0.00 0.00 39.48 38.30 2gra n PHE 19 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 2gra n THR 20 N -0.63 0.00 0.36 1.97 -2.24 -1.26 -3.30 114.28 109.18 2gra n THR 20 Ca 0.01 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.87 2gra n THR 20 Cb 0.05 0.00 0.37 0.00 -2.10 0.00 0.00 70.33 68.65 2gra n THR 20 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gra n ALA 21 N -3.00 1.51 0.12 6.98 0.00 -1.26 -2.61 120.51 122.25 2gra n ALA 21 Ca 0.00 0.04 -0.06 0.00 0.00 0.00 0.00 53.44 53.41 2gra n ALA 21 Cb 0.00 -1.27 -0.03 0.00 0.00 0.00 0.00 19.45 18.15 2gra n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gra h ALA 22 N 2.29 -0.41 -3.34 0.00 0.00 -1.89 -3.46 119.26 112.45 2gra h ALA 22 Ca 0.00 -0.09 -0.66 0.00 0.00 0.00 0.00 54.91 54.16 2gra h ALA 22 Cb 0.23 0.15 -0.13 0.00 0.00 0.00 0.00 17.79 18.05 2gra h ALA 22 CO 0.00 -0.38 -0.64 0.20 0.00 0.00 0.00 179.25 178.43 2gra s GLY 23 N -3.02 1.90 0.00 0.00 0.00 -1.07 -4.98 107.32 100.15 2gra s GLY 23 Ca -0.06 -1.00 0.00 0.00 0.00 0.00 0.00 44.72 43.67 2gra s GLY 23 CO 0.17 -0.90 0.00 -0.62 0.00 0.00 0.00 173.10 171.75 2gra n VAL 24 N 1.09 0.00 -1.56 1.40 0.31 -1.26 -4.17 118.33 114.13 2gra n VAL 24 Ca -0.13 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.77 2gra n VAL 24 Cb 0.52 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.45 2gra n VAL 24 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2gra n LEU 25 N -2.11 1.66 -4.60 7.52 4.77 -1.24 -5.01 117.00 118.00 2gra n LEU 25 Ca 0.00 1.05 -0.34 0.00 -0.03 0.00 0.00 56.01 56.69 2gra n LEU 25 Cb 0.00 -1.27 -0.11 0.00 -2.33 0.00 0.00 43.42 39.71 2gra n LEU 25 CO 0.00 -1.81 -0.36 0.00 -1.33 0.00 0.00 177.39 173.88 2gra s ALA 26 N -1.24 3.04 0.19 -1.18 0.00 -1.26 -4.41 121.76 116.90 2gra s ALA 26 Ca 0.62 -0.87 -0.15 0.00 0.00 0.00 0.00 51.96 51.56 2gra s ALA 26 Cb -0.62 -1.30 0.17 0.00 0.00 0.00 0.00 23.12 21.37 2gra s ALA 26 CO 0.58 0.56 1.65 0.00 0.00 0.00 0.00 175.76 178.55 2gra h ALA 27 N 5.31 0.36 0.00 0.00 0.00 -1.91 -2.43 119.26 120.59 2gra h ALA 27 Ca -0.48 0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 2gra h ALA 27 Cb 1.18 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 2gra h ALA 27 CO 0.53 -0.43 -0.71 0.45 0.00 0.00 0.00 179.25 179.09 2gra h HIS 28 N 0.02 0.00 0.00 0.00 3.86 -1.88 -3.35 115.15 113.80 2gra h HIS 28 Ca 0.25 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.46 2gra h HIS 28 Cb 0.38 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.85 2gra h HIS 28 CO -0.42 0.36 0.00 1.63 0.86 0.00 0.00 177.93 180.37 2gra n LYS 29 N -3.05 0.28 -3.69 2.45 5.02 -0.91 -4.58 118.16 113.69 2gra n LYS 29 Ca -0.01 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.16 2gra n LYS 29 Cb 0.70 -1.12 -0.09 0.00 -0.02 0.00 0.00 35.03 34.50 2gra n LYS 29 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2gra s ILE 30 N -1.18 -0.01 0.12 -0.18 1.01 -1.25 -4.18 121.20 115.53 2gra s ILE 30 Ca 0.00 0.02 0.05 0.00 0.00 0.00 0.00 60.65 60.72 2gra s ILE 30 Cb 0.00 -0.74 -0.04 0.00 0.01 0.00 0.00 42.46 41.69 2gra s ILE 30 CO 0.00 0.01 0.01 -0.32 0.00 0.00 0.00 174.94 174.64 2gra s MET 31 N 0.69 2.54 0.29 2.79 -2.45 -1.24 -4.86 119.30 117.05 2gra s MET 31 Ca -0.03 -0.90 0.05 0.00 -1.25 0.00 0.00 55.69 53.56 2gra s MET 31 Cb -0.05 -2.51 -0.06 0.00 1.25 0.00 0.00 34.83 33.47 2gra s MET 31 CO -0.05 0.52 -0.01 0.00 1.05 0.00 0.00 175.02 176.53 2gra s ALA 32 N -1.44 2.28 0.10 4.11 0.00 -1.26 -3.21 121.76 122.34 2gra s ALA 32 Ca 0.26 -1.94 0.06 0.00 0.00 0.00 0.00 51.96 50.34 2gra s ALA 32 Cb -0.11 0.40 -0.03 0.00 0.00 0.00 0.00 23.12 23.37 2gra s ALA 32 CO 0.19 -0.18 -0.14 0.45 0.00 0.00 0.00 175.76 176.07 2gra s SER 33 N -3.44 1.87 -0.23 0.00 0.15 0.23 -3.16 113.70 109.12 2gra s SER 33 Ca 0.32 -0.73 0.00 0.00 0.70 0.00 0.00 55.95 56.24 2gra s SER 33 Cb 0.06 -0.06 0.06 0.00 -1.71 0.00 0.00 66.02 64.37 2gra s SER 33 CO 0.13 -0.11 -0.04 -0.94 1.20 0.00 0.00 173.24 173.47 2gra s SER 34 N -2.14 3.70 0.00 5.45 1.04 0.85 -2.73 113.70 119.87 2gra s SER 34 Ca 0.04 -1.11 -0.02 0.00 0.48 0.00 0.00 55.95 55.34 2gra s SER 34 Cb -0.07 -1.09 -0.08 0.00 0.10 0.00 0.00 66.02 64.87 2gra s SER 34 CO 0.03 -0.24 1.83 -0.81 0.98 0.00 0.00 173.24 175.02 2gra n PRO 35 N 4.73 0.92 0.00 4.02 -0.04 -1.26 -4.31 135.00 139.05 2gra n PRO 35 Ca -0.12 -0.30 0.00 0.00 -0.04 0.00 0.00 63.50 63.04 2gra n PRO 35 Cb 0.45 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 2gra n PRO 35 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2gra n ASP 36 N 2.18 0.00 -1.62 3.54 -0.08 -1.26 -5.05 116.55 114.26 2gra n ASP 36 Ca 0.13 0.00 -0.00 0.00 -1.51 0.00 0.00 54.79 53.41 2gra n ASP 36 Cb 0.44 0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.91 2gra n ASP 36 CO 0.00 0.00 0.00 0.80 0.12 0.00 0.00 177.20 178.12 2gra n MET 37 N 0.00 0.13 -1.40 -0.67 0.00 -1.26 -4.82 117.12 109.09 2gra n MET 37 Ca 0.00 -0.12 -0.38 0.00 -0.00 0.00 0.00 57.70 57.21 2gra n MET 37 Cb 0.00 0.04 0.04 0.00 0.00 0.00 0.00 33.22 33.30 2gra n MET 37 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 2gra n ASP 38 N -0.15 -1.43 -0.26 6.12 4.64 -1.26 -4.80 116.55 119.42 2gra n ASP 38 Ca -0.02 0.69 0.03 0.00 -1.38 0.00 0.00 54.79 54.11 2gra n ASP 38 Cb 0.54 -1.14 0.03 0.00 -1.04 0.00 0.00 41.12 39.50 2gra n ASP 38 CO 0.00 0.00 0.00 -0.11 -0.82 0.00 0.00 177.20 176.27 2gra n LEU 39 N 0.61 1.54 0.04 -2.67 7.94 -1.26 -1.53 117.00 121.68 2gra n LEU 39 Ca 0.11 -1.01 -0.09 0.00 -1.11 0.00 0.00 56.01 53.90 2gra n LEU 39 Cb 0.48 -0.00 -0.13 0.00 0.53 0.00 0.00 43.42 44.30 2gra n LEU 39 CO 0.51 0.32 -0.11 0.00 -1.11 0.00 0.00 177.39 177.00 2gra h ALA 40 N 1.25 0.43 0.00 1.96 0.00 -1.96 -3.43 119.26 117.51 2gra h ALA 40 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 54.91 53.83 2gra h ALA 40 Cb 0.27 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2gra h ALA 40 CO 0.00 1.30 0.00 2.41 0.00 0.00 0.00 179.25 182.96 2gra n THR 41 N -3.30 0.00 0.30 0.00 -1.04 -1.26 -4.83 114.28 104.14 2gra n THR 41 Ca -0.07 0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 61.76 2gra n THR 41 Cb 0.99 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 69.41 2gra n THR 41 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 2gra h VAL 42 N 0.00 0.06 0.00 12.58 2.07 -1.86 0.31 116.25 129.41 2gra h VAL 42 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2gra h VAL 42 Cb 0.00 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 29.83 2gra h VAL 42 CO 0.00 0.00 0.00 -1.20 0.02 0.00 0.00 177.57 176.39 2gra n SER 43 N -5.56 0.00 -0.11 0.57 7.64 -0.58 -0.15 113.62 115.43 2gra n SER 43 Ca -0.12 -0.70 0.04 0.00 1.01 0.00 0.00 58.87 59.10 2gra n SER 43 Cb 0.45 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.63 2gra n SER 43 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2gra n ALA 44 N -0.68 2.93 0.02 -0.43 0.00 0.80 -4.48 120.51 118.68 2gra n ALA 44 Ca 0.04 -0.34 -0.15 0.00 0.00 0.00 0.00 53.44 52.99 2gra n ALA 44 Cb 0.02 -0.32 -0.14 0.00 0.00 0.00 0.00 19.45 19.01 2gra n ALA 44 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2gra h LEU 45 N 0.55 0.25 -0.55 0.00 3.38 0.23 -3.30 115.31 115.87 2gra h LEU 45 Ca 0.00 -0.46 0.09 0.00 0.09 0.00 0.00 57.88 57.60 2gra h LEU 45 Cb 0.26 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 40.85 2gra h LEU 45 CO 0.00 1.40 0.13 0.03 0.09 0.00 0.00 178.44 180.10 2gra h ARG 46 N 0.04 0.27 -1.86 1.13 3.08 -1.62 0.22 114.38 115.64 2gra h ARG 46 Ca -0.30 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.73 2gra h ARG 46 Cb 2.01 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 32.00 2gra h ARG 46 CO 0.11 0.18 0.00 0.36 -1.07 0.00 0.00 179.97 179.55 2gra n LYS 47 N -5.09 0.89 0.00 0.04 2.85 -1.24 -2.59 118.16 113.02 2gra n LYS 47 Ca 0.07 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.33 2gra n LYS 47 Cb 0.27 -1.05 0.00 0.00 -0.65 0.00 0.00 35.03 33.60 2gra n LYS 47 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 177.40 176.02 2gra n MET 48 N 1.40 -0.00 -3.05 -1.58 2.81 0.78 -4.96 117.12 112.52 2gra n MET 48 Ca 0.00 -0.31 -0.13 0.00 -1.81 0.00 0.00 57.70 55.45 2gra n MET 48 Cb 0.45 -0.65 0.05 0.00 -0.71 0.00 0.00 33.22 32.36 2gra n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2gra n GLY 49 N -0.04 -0.05 0.83 3.03 0.00 -1.07 -4.89 105.19 103.01 2gra n GLY 49 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2gra n GLY 49 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2gra n VAL 50 N -3.53 0.00 -4.11 1.61 0.31 -1.20 -3.07 118.33 108.35 2gra n VAL 50 Ca -0.10 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.09 2gra n VAL 50 Cb 0.58 0.00 -0.12 0.00 -0.91 0.00 0.00 33.84 33.39 2gra n VAL 50 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2gra s LEU 52 N -3.25 2.24 -0.72 7.52 2.01 -1.26 -3.69 118.68 121.54 2gra s LEU 52 Ca 0.00 -0.53 -0.26 0.00 0.01 0.00 0.00 54.13 53.35 2gra s LEU 52 Cb 0.00 -0.27 0.04 0.00 0.01 0.00 0.00 46.19 45.97 2gra s LEU 52 CO 0.00 -0.15 1.19 -0.89 1.01 0.00 0.00 176.35 177.51 2gra s THR 53 N -1.26 3.90 -1.04 5.49 2.01 -1.19 -4.86 115.64 118.70 2gra s THR 53 Ca -0.07 0.17 0.14 0.00 0.31 0.00 0.00 61.69 62.24 2gra s THR 53 Cb -0.09 -4.85 0.13 0.00 0.01 0.00 0.00 72.50 67.69 2gra s THR 53 CO 0.01 -1.74 1.45 -0.81 -0.69 0.00 0.00 174.62 172.84 2gra n PRO 54 N 8.87 0.02 -2.86 4.92 -0.04 -1.26 -0.10 135.00 144.55 2gra n PRO 54 Ca 0.01 0.25 -0.43 0.00 -0.04 0.00 0.00 63.50 63.28 2gra n PRO 54 Cb 0.48 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.42 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 -2.96 3.08 0.31 0.54 3.76 -1.26 -4.66 115.29 114.10 2gra s HIS 55 Ca 0.07 -1.44 0.12 0.00 -0.15 0.00 0.00 55.06 53.66 2gra s HIS 55 Cb 0.09 -4.37 0.99 0.00 1.11 0.00 0.00 32.58 30.40 2gra s HIS 55 CO 0.26 -1.55 1.41 0.09 -0.85 0.00 0.00 174.74 174.09 2gra n ASN 56 N 6.82 0.14 0.01 1.40 3.02 -1.26 -1.17 115.26 124.21 2gra n ASN 56 Ca 0.28 1.50 -0.13 0.00 -0.03 0.00 0.00 54.58 56.21 2gra n ASN 56 Cb 0.48 -0.65 -0.09 0.00 -0.61 0.00 0.00 39.78 38.90 2gra n ASN 56 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 2gra h LYS 57 N 0.00 -0.03 0.00 3.52 2.10 -1.90 -3.36 116.57 116.90 2gra h LYS 57 Ca 0.67 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.32 2gra h LYS 57 Cb 1.64 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.97 2gra h LYS 57 CO -0.76 0.39 0.00 0.39 -2.00 0.00 0.00 179.45 177.48 2gra n GLU 58 N -4.90 0.00 -0.19 0.07 1.02 -0.32 -0.35 120.64 115.98 2gra n GLU 58 Ca -0.08 0.51 0.15 0.00 -0.02 0.00 0.00 57.16 57.72 2gra n GLU 58 Cb 0.23 -0.80 0.26 0.00 -0.02 0.00 0.00 31.44 31.10 2gra n GLU 58 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2gra n THR 59 N -2.16 -0.08 -0.04 2.62 -1.04 -1.25 0.99 114.28 113.32 2gra n THR 59 Ca 0.00 0.64 0.05 0.00 -2.04 0.00 0.00 64.05 62.70 2gra n THR 59 Cb 0.00 -1.06 0.41 0.00 -1.82 0.00 0.00 70.33 67.87 2gra n THR 59 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 2gra h VAL 60 N 0.00 1.09 0.00 12.58 2.07 -0.91 -3.37 116.25 127.71 2gra h VAL 60 Ca 0.33 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.64 2gra h VAL 60 Cb 1.09 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 2gra h VAL 60 CO -0.15 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.55 2gra n GLN 61 N -4.47 0.00 -1.54 1.57 6.02 0.28 -2.54 117.38 116.70 2gra n GLN 61 Ca 0.05 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.62 2gra n GLN 61 Cb 0.10 -0.33 -0.02 0.00 1.02 0.00 0.00 30.24 31.01 2gra n GLN 61 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2gra n HIS 62 N 0.00 3.01 -4.07 1.08 8.25 -1.26 -4.85 115.22 117.39 2gra n HIS 62 Ca 0.00 -2.69 -0.08 0.00 -0.26 0.00 0.00 57.72 54.68 2gra n HIS 62 Cb 0.00 -2.34 -0.09 0.00 1.12 0.00 0.00 29.99 28.68 2gra n HIS 62 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2gra s SER 63 N 3.54 0.34 0.00 0.41 0.01 -1.05 -4.45 113.70 112.49 2gra s SER 63 Ca 0.51 -1.02 0.00 0.00 1.31 0.00 0.00 55.95 56.75 2gra s SER 63 Cb 0.14 0.27 0.00 0.00 0.21 0.00 0.00 66.02 66.64 2gra s SER 63 CO -0.04 -0.69 0.04 0.47 0.41 0.00 0.00 173.24 173.44 2gra n ASP 64 N -0.01 0.00 -3.33 2.44 8.00 -1.23 -4.77 116.55 117.64 2gra n ASP 64 Ca -0.11 -1.00 -0.03 0.00 0.71 0.00 0.00 54.79 54.36 2gra n ASP 64 Cb 0.62 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.67 2gra n ASP 64 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2gra s VAL 65 N 0.00 -0.79 0.13 2.53 1.01 -1.23 -3.23 120.40 118.81 2gra s VAL 65 Ca 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 61.98 61.85 2gra s VAL 65 Cb 0.00 -0.88 -0.06 0.00 0.00 0.00 0.00 36.38 35.43 2gra s VAL 65 CO 0.00 -0.04 0.49 -0.76 0.00 0.00 0.00 175.10 174.78 2gra s LEU 66 N 2.70 4.33 -0.30 3.92 1.43 0.22 0.16 118.68 131.14 2gra s LEU 66 Ca 0.13 0.94 0.00 0.00 -1.03 0.00 0.00 54.13 54.17 2gra s LEU 66 Cb -0.15 -3.19 0.09 0.00 0.03 0.00 0.00 46.19 42.98 2gra s LEU 66 CO -0.18 0.12 0.07 -0.36 0.23 0.00 0.00 176.35 176.22 2gra s PHE 67 N -1.47 2.17 -0.94 0.29 2.99 -0.09 -1.25 117.98 119.69 2gra s PHE 67 Ca 0.37 -1.94 -0.14 0.00 0.00 0.00 0.00 56.93 55.22 2gra s PHE 67 Cb -0.14 -1.90 -0.09 0.00 0.00 0.00 0.00 43.02 40.88 2gra s PHE 67 CO 0.19 -0.86 2.08 1.28 -0.00 0.00 0.00 175.22 177.91 2gra n LEU 68 N 4.72 4.93 -1.44 -0.37 4.77 -1.12 -2.85 117.00 125.64 2gra n LEU 68 Ca -0.02 -3.08 -0.01 0.00 -0.03 0.00 0.00 56.01 52.86 2gra n LEU 68 Cb 0.43 -1.18 0.00 0.00 -2.33 0.00 0.00 43.42 40.34 2gra n LEU 68 CO 0.14 0.30 0.93 0.00 -1.33 0.00 0.00 177.39 177.43 2gra n ALA 69 N 5.81 3.81 -2.70 -1.18 0.00 -1.26 -4.56 120.51 120.43 2gra n ALA 69 Ca 0.49 -0.12 -0.22 0.00 0.00 0.00 0.00 53.44 53.60 2gra n ALA 69 Cb 0.28 -1.03 -0.04 0.00 0.00 0.00 0.00 19.45 18.67 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 -0.16 4.13 1.01 0.00 1.01 -1.26 -3.52 120.40 121.62 2gra s VAL 70 Ca 0.02 -1.37 -0.20 0.00 0.00 0.00 0.00 61.98 60.43 2gra s VAL 70 Cb 0.02 -3.34 -0.09 0.00 0.00 0.00 0.00 36.38 32.96 2gra s VAL 70 CO 0.00 -0.28 -0.73 0.29 0.00 0.00 0.00 175.10 174.38 2gra n LYS 71 N -1.27 -0.31 -0.31 2.72 4.01 -1.26 -4.66 118.16 117.08 2gra n LYS 71 Ca -0.05 -0.08 0.34 0.00 -0.51 0.00 0.00 58.31 58.00 2gra n LYS 71 Cb 0.59 -1.25 0.73 0.00 -0.51 0.00 0.00 35.03 34.59 2gra n LYS 71 CO 0.00 0.00 0.00 -1.00 -1.11 0.00 0.00 177.40 175.29 2gra h PRO 72 N -1.26 0.03 -1.31 1.97 0.13 -1.97 -1.55 132.00 128.03 2gra h PRO 72 Ca -0.44 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2gra h PRO 72 Cb 1.34 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2gra h PRO 72 CO 0.27 0.02 0.00 -2.39 -0.23 0.00 0.00 178.00 175.66 2gra n HIS 73 N -4.22 0.00 0.66 1.56 1.44 -1.26 -3.88 115.22 109.52 2gra n HIS 73 Ca 0.25 -0.44 0.05 0.00 -2.01 0.00 0.00 57.72 55.56 2gra n HIS 73 Cb 1.19 -0.25 0.27 0.00 0.12 0.00 0.00 29.99 31.33 2gra n HIS 73 CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 2gra n ILE 74 N 0.73 0.00 -0.06 0.61 -6.64 -0.58 -2.64 119.36 110.79 2gra n ILE 74 Ca 0.00 0.00 -0.02 0.00 -1.77 0.00 0.00 62.75 60.96 2gra n ILE 74 Cb 0.39 -0.77 -0.01 0.00 -1.44 0.00 0.00 39.64 37.81 2gra n ILE 74 CO 0.00 0.00 0.00 0.40 -1.77 0.00 0.00 176.55 175.18 2gra h ILE 75 N 0.00 0.00 0.00 7.28 5.03 -1.86 -3.03 117.51 124.92 2gra h ILE 75 Ca 0.00 -0.91 0.00 0.00 -0.12 0.00 0.00 64.86 63.83 2gra h ILE 75 Cb 0.00 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 33.79 2gra h ILE 75 CO 0.00 0.00 0.00 -2.65 -0.68 0.00 0.00 178.15 174.82 2gra n PRO 76 N -4.48 0.00 -0.01 2.37 -0.02 -1.08 -3.11 135.00 128.67 2gra n PRO 76 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 2gra n PRO 76 Cb 0.12 -0.09 0.00 0.00 -0.02 0.00 0.00 33.50 33.51 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 0.00 0.00 0.04 6.00 3.01 -1.26 -3.14 117.46 122.11 2gra n PHE 77 Ca 0.00 -0.11 0.00 0.00 1.01 0.00 0.00 57.45 58.35 2gra n PHE 77 Cb 0.00 -0.15 0.00 0.00 -0.01 0.00 0.00 39.48 39.32 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 1.07 0.18 0.24 4.37 2.08 -1.26 -4.89 119.36 121.16 2gra n ILE 78 Ca 0.00 0.06 0.11 0.00 0.56 0.00 0.00 62.75 63.48 2gra n ILE 78 Cb 0.09 -0.60 0.60 0.00 -0.75 0.00 0.00 39.64 38.98 2gra n ILE 78 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 2gra h LEU 79 N 0.00 0.00 0.00 1.39 3.38 -1.46 -2.71 115.31 115.91 2gra h LEU 79 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2gra h LEU 79 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2gra h LEU 79 CO 0.00 0.18 0.00 0.47 0.09 0.00 0.00 178.44 179.18 2gra n ASP 80 N -3.54 0.00 0.00 -0.43 8.00 -1.19 -2.50 116.55 116.90 2gra n ASP 80 Ca -0.01 -1.55 0.00 0.00 0.71 0.00 0.00 54.79 53.94 2gra n ASP 80 Cb 0.33 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.43 2gra n ASP 80 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2gra n GLU 81 N -0.58 0.16 -0.08 -1.24 4.71 -1.03 -4.83 120.64 117.76 2gra n GLU 81 Ca 0.03 -0.40 -0.16 0.00 -0.01 0.00 0.00 57.16 56.63 2gra n GLU 81 Cb 0.01 -0.64 -0.07 0.00 -1.01 0.00 0.00 31.44 29.73 2gra n GLU 81 CO 0.00 0.00 0.00 -0.89 0.09 0.00 0.00 177.13 176.33 2gra n ILE 82 N -0.06 0.94 -0.17 -3.67 5.41 -1.04 -4.60 119.36 116.18 2gra n ILE 82 Ca 0.00 -0.29 -0.06 0.00 1.00 0.00 0.00 62.75 63.40 2gra n ILE 82 Cb 0.27 -1.47 0.00 0.00 -0.71 0.00 0.00 39.64 37.74 2gra n ILE 82 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2gra h GLY 83 N 0.14 -0.13 0.92 7.39 0.00 -1.81 0.66 103.07 110.24 2gra h GLY 83 Ca -0.41 0.41 0.08 0.00 0.00 0.00 0.00 47.33 47.41 2gra h GLY 83 CO -0.18 -0.21 0.47 0.00 0.00 0.00 0.00 176.54 176.62 2gra h ALA 84 N 0.94 1.84 -1.96 3.60 0.00 -1.84 -0.52 119.26 121.33 2gra h ALA 84 Ca 0.21 -0.01 -0.64 0.00 0.00 0.00 0.00 54.91 54.47 2gra h ALA 84 Cb 0.54 0.02 -0.38 0.00 0.00 0.00 0.00 17.79 17.96 2gra h ALA 84 CO -0.62 -0.60 -0.25 -0.25 0.00 0.00 0.00 179.25 177.53 2gra n ASP 85 N -3.30 5.21 -3.74 0.00 8.00 0.23 -5.01 116.55 117.94 2gra n ASP 85 Ca 0.04 -3.70 -0.13 0.00 0.71 0.00 0.00 54.79 51.72 2gra n ASP 85 Cb 0.59 -0.69 -0.13 0.00 -0.02 0.00 0.00 41.12 40.87 2gra n ASP 85 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2gra s ILE 86 N -4.57 -0.04 0.00 0.53 1.01 -0.20 -4.92 121.20 113.01 2gra s ILE 86 Ca 0.47 0.13 0.00 0.00 0.00 0.00 0.00 60.65 61.25 2gra s ILE 86 Cb 0.28 -0.33 0.00 0.00 0.01 0.00 0.00 42.46 42.42 2gra s ILE 86 CO -0.15 0.05 0.00 -0.62 0.00 0.00 0.00 174.94 174.22 2gra n GLU 87 N 4.03 1.56 -0.19 2.79 1.02 -1.26 -4.88 120.64 123.72 2gra n GLU 87 Ca -0.24 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 56.96 2gra n GLU 87 Cb 0.53 0.00 0.15 0.00 -0.02 0.00 0.00 31.44 32.10 2gra n GLU 87 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2gra n ASP 88 N 0.00 2.91 -1.48 1.62 10.43 -1.26 -4.51 116.55 124.26 2gra n ASP 88 Ca 0.00 -2.19 0.09 0.00 2.57 0.00 0.00 54.79 55.25 2gra n ASP 88 Cb 0.00 -0.25 0.33 0.00 1.84 0.00 0.00 41.12 43.04 2gra n ASP 88 CO 0.00 0.00 0.00 -2.11 -1.07 0.00 0.00 177.20 174.02 2gra n ARG 89 N 0.14 3.49 -3.64 -1.24 -4.01 -1.26 -4.92 116.66 105.22 2gra n ARG 89 Ca 0.11 -2.61 -0.09 0.00 -1.04 0.00 0.00 57.85 54.22 2gra n ARG 89 Cb 0.48 -1.84 -0.07 0.00 -3.04 0.00 0.00 32.46 27.99 2gra n ARG 89 CO 0.00 0.00 0.00 -3.38 -3.04 0.00 0.00 177.63 171.21 2gra s HIS 90 N -1.81 -0.61 0.04 2.89 -3.43 -1.26 -4.23 115.29 106.89 2gra s HIS 90 Ca 0.47 1.41 0.04 0.00 -0.80 0.00 0.00 55.06 56.18 2gra s HIS 90 Cb 0.30 0.36 -0.04 0.00 -1.43 0.00 0.00 32.58 31.78 2gra s HIS 90 CO 0.23 -0.29 -0.05 0.42 -2.00 0.00 0.00 174.74 173.04 2gra s ILE 91 N 0.53 3.72 -0.18 -5.38 1.01 -1.20 -4.77 121.20 114.93 2gra s ILE 91 Ca -0.00 -0.89 -0.03 0.00 0.00 0.00 0.00 60.65 59.73 2gra s ILE 91 Cb -0.05 -2.67 -0.02 0.00 0.01 0.00 0.00 42.46 39.73 2gra s ILE 91 CO -0.07 0.29 -0.06 -0.69 0.00 0.00 0.00 174.94 174.41 2gra s VAL 92 N -1.10 3.48 -0.47 2.92 1.01 -1.09 0.71 120.40 125.84 2gra s VAL 92 Ca 0.20 -0.48 -0.11 0.00 0.00 0.00 0.00 61.98 61.59 2gra s VAL 92 Cb -0.11 -2.54 0.11 0.00 0.00 0.00 0.00 36.38 33.84 2gra s VAL 92 CO 0.11 0.46 0.36 -0.69 0.00 0.00 0.00 175.10 175.35 2gra s VAL 93 N 0.90 4.47 0.00 2.92 1.01 -0.38 -0.99 120.40 128.34 2gra s VAL 93 Ca -0.01 -1.61 0.00 0.00 0.00 0.00 0.00 61.98 60.36 2gra s VAL 93 Cb -0.15 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.36 2gra s VAL 93 CO 0.01 -0.73 1.41 -1.54 0.00 0.00 0.00 175.10 174.24 2gra n SER 94 N 4.99 3.89 -4.56 3.32 3.41 0.32 -2.80 113.62 122.19 2gra n SER 94 Ca -0.10 -2.06 -0.23 0.00 -0.26 0.00 0.00 58.87 56.22 2gra n SER 94 Cb 0.41 -0.77 -0.05 0.00 -0.26 0.00 0.00 64.21 63.54 2gra n SER 94 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gra s ALA 96 N 13.05 -3.01 0.00 0.00 0.00 -1.25 -4.64 121.76 125.90 2gra s ALA 96 Ca 0.89 1.88 0.00 0.00 0.00 0.00 0.00 51.96 54.72 2gra s ALA 96 Cb -0.13 -2.20 0.00 0.00 0.00 0.00 0.00 23.12 20.79 2gra s ALA 96 CO 0.12 -1.03 0.00 0.00 0.00 0.00 0.00 175.76 174.85 2gra n ALA 97 N 4.90 0.00 -0.36 0.00 0.00 -1.26 -3.33 120.51 120.46 2gra n ALA 97 Ca -0.08 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.28 2gra n ALA 97 Cb 0.54 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.02 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 0.00 3.13 3.57 0.00 0.00 -1.26 -4.85 105.19 105.78 2gra n GLY 98 Ca 0.00 -0.49 -0.43 0.00 0.00 0.00 0.00 46.02 45.10 2gra n GLY 98 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gra s VAL 99 N -1.10 4.18 0.83 1.61 1.01 -1.21 -4.11 120.40 121.60 2gra s VAL 99 Ca 0.16 0.88 -0.11 0.00 0.00 0.00 0.00 61.98 62.90 2gra s VAL 99 Cb 0.13 -4.63 0.09 0.00 0.00 0.00 0.00 36.38 31.97 2gra s VAL 99 CO 0.01 -1.16 1.13 -0.89 0.00 0.00 0.00 175.10 174.19 2gra s THR 100 N 4.53 2.65 0.07 3.92 2.01 -1.26 -4.92 115.64 122.63 2gra s THR 100 Ca 0.42 0.22 -0.16 0.00 0.31 0.00 0.00 61.69 62.48 2gra s THR 100 Cb -0.08 -2.51 -0.15 0.00 0.01 0.00 0.00 72.50 69.76 2gra s THR 100 CO 0.26 -0.26 1.29 0.16 -0.69 0.00 0.00 174.62 175.38 2gra h ILE 101 N -1.33 1.33 0.00 1.82 -0.00 -1.97 -2.59 117.51 114.77 2gra h ILE 101 Ca -0.44 -1.78 -0.02 0.00 -0.00 0.00 0.00 64.86 62.63 2gra h ILE 101 Cb 1.25 2.01 -0.00 0.00 -0.00 0.00 0.00 36.82 40.08 2gra h ILE 101 CO 0.47 0.55 -0.09 0.28 -0.00 0.00 0.00 178.15 179.36 2gra h SER 102 N 0.29 0.00 0.15 2.16 0.02 -1.95 0.68 113.55 114.91 2gra h SER 102 Ca -0.02 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.85 2gra h SER 102 Cb 1.14 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.67 2gra h SER 102 CO 0.11 0.09 -0.28 0.28 -1.14 0.00 0.00 176.83 175.89 2gra h SER 103 N 0.00 0.21 -0.01 3.07 0.02 -1.83 -2.69 113.55 112.32 2gra h SER 103 Ca -0.00 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 2gra h SER 103 Cb 0.29 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.77 2gra h SER 103 CO 0.01 0.50 -0.33 -0.38 -1.14 0.00 0.00 176.83 175.49 2gra n ILE 104 N -4.14 0.00 1.85 3.27 2.08 -0.40 -4.29 119.36 117.73 2gra n ILE 104 Ca -0.01 -0.33 0.10 0.00 0.56 0.00 0.00 62.75 63.07 2gra n ILE 104 Cb 0.38 1.17 0.60 0.00 -0.75 0.00 0.00 39.64 41.04 2gra n ILE 104 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 2gra n GLU 105 N -0.21 0.92 -1.31 0.38 4.07 0.22 -2.92 120.64 121.80 2gra n GLU 105 Ca 0.06 0.00 0.03 0.00 -0.06 0.00 0.00 57.16 57.19 2gra n GLU 105 Cb 0.31 -1.34 0.02 0.00 -0.06 0.00 0.00 31.44 30.36 2gra n GLU 105 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 2gra n LYS 106 N -0.84 0.00 0.06 5.31 5.02 -1.24 -4.52 118.16 121.96 2gra n LYS 106 Ca 0.15 -1.80 0.00 0.00 -2.02 0.00 0.00 58.31 54.64 2gra n LYS 106 Cb 0.07 -0.08 0.00 0.00 -0.02 0.00 0.00 35.03 35.00 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 0.40 0.00 0.00 1.97 4.76 -1.15 -4.73 118.16 119.42 2gra n LYS 107 Ca 0.05 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.62 2gra n LYS 107 Cb 1.06 -0.32 0.42 0.00 -1.84 0.00 0.00 35.03 34.35 2gra n LYS 107 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2gra n LEU 108 N -3.36 1.29 -1.39 -0.35 4.77 -1.20 -2.97 117.00 113.79 2gra n LEU 108 Ca 0.00 -0.39 0.08 0.00 -0.03 0.00 0.00 56.01 55.67 2gra n LEU 108 Cb 0.00 -0.07 0.30 0.00 -2.33 0.00 0.00 43.42 41.33 2gra n LEU 108 CO 0.00 0.23 0.75 -1.20 -1.33 0.00 0.00 177.39 175.84 2gra n SER 109 N -0.26 4.08 -0.01 -1.43 7.64 -1.26 -3.41 113.62 118.97 2gra n SER 109 Ca 0.15 -2.36 -0.01 0.00 1.01 0.00 0.00 58.87 57.66 2gra n SER 109 Cb 0.36 -0.53 -0.01 0.00 -1.01 0.00 0.00 64.21 63.02 2gra n SER 109 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2gra n ALA 110 N 0.96 1.96 -0.01 -0.43 0.00 -1.16 -4.55 120.51 117.28 2gra n ALA 110 Ca 0.22 -0.11 0.04 0.00 0.00 0.00 0.00 53.44 53.59 2gra n ALA 110 Cb 0.76 0.26 0.22 0.00 0.00 0.00 0.00 19.45 20.69 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 -2.15 1.12 0.00 0.00 3.01 -1.21 -4.85 117.46 113.38 2gra n PHE 111 Ca -0.03 -0.39 0.00 0.00 1.01 0.00 0.00 57.45 58.04 2gra n PHE 111 Cb 0.55 -0.31 0.00 0.00 -0.01 0.00 0.00 39.48 39.71 2gra n PHE 111 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 2gra n ARG 112 N 0.36 0.00 0.00 -1.08 3.00 -1.22 -4.32 116.66 113.40 2gra n ARG 112 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.00 2gra n ARG 112 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.21 2gra n ARG 112 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2gra n PRO 113 N -0.24 0.00 -3.53 -0.14 -0.02 -1.26 -4.34 135.00 125.46 2gra n PRO 113 Ca 0.00 0.05 -0.29 0.00 -2.02 0.00 0.00 63.50 61.24 2gra n PRO 113 Cb 0.00 -0.56 -0.14 0.00 -0.02 0.00 0.00 33.50 32.79 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 -2.82 0.91 1.35 3.55 0.00 -1.26 -4.50 121.76 118.97 2gra s ALA 114 Ca 0.00 -1.54 -0.21 0.00 0.00 0.00 0.00 51.96 50.21 2gra s ALA 114 Cb 0.00 -1.52 0.34 0.00 0.00 0.00 0.00 23.12 21.94 2gra s ALA 114 CO 0.00 -1.86 0.99 -1.25 0.00 0.00 0.00 175.76 173.64 2gra s PRO 115 N 1.54 -2.36 -0.74 0.00 0.04 -1.26 -4.98 135.00 127.23 2gra s PRO 115 Ca 0.13 0.08 -0.11 0.00 0.04 0.00 0.00 61.00 61.14 2gra s PRO 115 Cb -0.19 -1.45 0.20 0.00 0.04 0.00 0.00 34.50 33.09 2gra s PRO 115 CO -0.18 -4.49 0.65 1.03 0.04 0.00 0.00 177.00 174.05 2gra s ARG 116 N -5.17 3.27 -0.16 4.56 0.52 -1.26 -4.95 118.95 115.75 2gra s ARG 116 Ca 0.69 -2.40 -0.14 0.00 -0.52 0.00 0.00 55.73 53.37 2gra s ARG 116 Cb -0.12 -4.24 -0.05 0.00 0.52 0.00 0.00 34.95 31.07 2gra s ARG 116 CO 0.57 -1.26 0.31 0.08 0.02 0.00 0.00 175.30 175.02 2gra s VAL 117 N 0.26 5.30 -0.21 3.52 1.01 -1.26 -2.69 120.40 126.33 2gra s VAL 117 Ca 0.16 0.57 -0.03 0.00 0.00 0.00 0.00 61.98 62.68 2gra s VAL 117 Cb -0.15 -3.65 0.07 0.00 0.00 0.00 0.00 36.38 32.65 2gra s VAL 117 CO -0.06 0.37 0.05 -0.63 0.00 0.00 0.00 175.10 174.83 2gra s ILE 118 N 0.55 0.49 0.50 2.22 -1.09 -0.16 -4.27 121.20 119.44 2gra s ILE 118 Ca 0.17 -0.62 -0.06 0.00 -2.23 0.00 0.00 60.65 57.91 2gra s ILE 118 Cb -0.13 -1.06 -0.04 0.00 -1.58 0.00 0.00 42.46 39.65 2gra s ILE 118 CO 0.04 -0.28 0.81 -0.60 -1.23 0.00 0.00 174.94 173.69 2gra s ARG 119 N 1.86 3.56 -0.19 2.79 3.52 -1.23 -0.53 118.95 128.73 2gra s ARG 119 Ca 0.01 0.27 -0.29 0.00 -0.13 0.00 0.00 55.73 55.59 2gra s ARG 119 Cb -0.17 -2.34 0.13 0.00 -1.56 0.00 0.00 34.95 31.01 2gra s ARG 119 CO -0.11 -0.24 1.05 0.00 -0.81 0.00 0.00 175.30 175.18 2gra s MET 121 N -0.86 2.28 0.00 0.00 1.75 0.34 -3.86 119.30 118.95 2gra s MET 121 Ca 0.00 -0.87 0.00 0.00 -1.25 0.00 0.00 55.69 53.57 2gra s MET 121 Cb -0.01 -2.32 0.00 0.00 2.84 0.00 0.00 34.83 35.33 2gra s MET 121 CO -0.01 0.56 0.00 0.25 -0.65 0.00 0.00 175.02 175.18 2gra n THR 122 N 1.52 0.00 -3.34 10.11 -2.24 -1.26 -0.00 114.28 119.07 2gra n THR 122 Ca -0.16 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.60 2gra n THR 122 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 2gra n THR 122 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2gra n ASN 123 N 0.00 -0.55 0.07 3.42 0.23 -1.24 -4.37 115.26 112.82 2gra n ASN 123 Ca 0.00 -1.45 -0.21 0.00 -0.53 0.00 0.00 54.58 52.39 2gra n ASN 123 Cb 0.00 0.93 -0.14 0.00 -2.08 0.00 0.00 39.78 38.49 2gra n ASN 123 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 2gra h THR 124 N 1.27 1.44 0.00 5.53 2.02 -1.95 -3.31 112.91 117.90 2gra h THR 124 Ca -0.09 -2.50 0.00 0.00 0.77 0.00 0.00 66.41 64.59 2gra h THR 124 Cb 0.33 3.05 0.00 0.00 -1.74 0.00 0.00 68.15 69.79 2gra h THR 124 CO 0.11 0.72 0.30 -0.81 0.37 0.00 0.00 175.52 176.21 2gra n PRO 125 N -4.03 0.00 0.21 6.66 -0.04 -1.26 0.61 135.00 137.15 2gra n PRO 125 Ca -0.14 0.18 0.06 0.00 -0.04 0.00 0.00 63.50 63.55 2gra n PRO 125 Cb 0.87 -1.80 0.52 0.00 -0.04 0.00 0.00 33.50 33.05 2gra n PRO 125 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2gra h VAL 126 N 0.00 1.10 -0.05 0.52 2.07 -1.83 0.36 116.25 118.43 2gra h VAL 126 Ca 0.00 -0.46 0.01 0.00 0.82 0.00 0.00 66.70 67.07 2gra h VAL 126 Cb 0.60 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 2gra h VAL 126 CO 0.00 0.14 0.33 0.58 0.02 0.00 0.00 177.57 178.64 2gra h VAL 127 N 0.06 0.05 0.00 2.57 2.07 -0.05 -3.29 116.25 117.66 2gra h VAL 127 Ca 0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.53 2gra h VAL 127 Cb 0.23 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 2gra h VAL 127 CO 0.01 0.00 0.00 0.52 0.02 0.00 0.00 177.57 178.12 2gra n VAL 128 N -3.00 0.00 -0.19 2.57 0.31 0.12 -4.61 118.33 113.53 2gra n VAL 128 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2gra n VAL 128 Cb 0.40 -0.51 0.00 0.00 -0.91 0.00 0.00 33.84 32.81 2gra n VAL 128 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2gra n ARG 129 N -0.23 0.00 0.00 5.55 0.63 -0.96 -4.91 116.66 116.75 2gra n ARG 129 Ca 0.00 0.00 0.06 0.00 -0.92 0.00 0.00 57.85 56.99 2gra n ARG 129 Cb 0.00 0.00 0.03 0.00 0.45 0.00 0.00 32.46 32.94 2gra n ARG 129 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2gra n GLU 130 N 0.00 1.14 -1.16 -0.14 -0.58 -1.11 -2.62 120.64 116.17 2gra n GLU 130 Ca 0.00 -1.04 -0.35 0.00 -0.42 0.00 0.00 57.16 55.35 2gra n GLU 130 Cb 0.04 -1.20 0.09 0.00 -0.57 0.00 0.00 31.44 29.79 2gra n GLU 130 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2gra n GLY 131 N 0.78 -1.39 3.07 0.62 0.00 -0.75 -4.77 105.19 102.75 2gra n GLY 131 Ca 0.06 -0.46 -0.28 0.00 0.00 0.00 0.00 46.02 45.34 2gra n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gra s ALA 132 N -2.02 1.69 0.11 4.61 0.00 -1.26 -3.18 121.76 121.72 2gra s ALA 132 Ca 0.65 -0.72 -0.06 0.00 0.00 0.00 0.00 51.96 51.83 2gra s ALA 132 Cb -0.32 -0.80 -0.02 0.00 0.00 0.00 0.00 23.12 21.99 2gra s ALA 132 CO 0.58 -0.01 0.15 0.95 0.00 0.00 0.00 175.76 177.43 2gra s THR 133 N 0.87 0.13 0.04 0.00 -4.23 -0.64 -3.69 115.64 108.12 2gra s THR 133 Ca -0.09 -1.47 -0.01 0.00 -1.18 0.00 0.00 61.69 58.95 2gra s THR 133 Cb -0.15 -1.61 -0.03 0.00 1.34 0.00 0.00 72.50 72.04 2gra s THR 133 CO 0.00 -0.60 -0.03 -0.69 -0.54 0.00 0.00 174.62 172.76 2gra s VAL 134 N -3.93 0.18 0.16 2.29 1.01 1.00 -3.87 120.40 117.24 2gra s VAL 134 Ca 0.11 -1.43 0.05 0.00 0.00 0.00 0.00 61.98 60.71 2gra s VAL 134 Cb 0.05 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 2gra s VAL 134 CO -0.06 -0.79 -0.11 -0.72 0.00 0.00 0.00 175.10 173.42 2gra s TYR 135 N -2.89 1.37 0.04 5.22 -0.85 -1.18 -0.51 117.35 118.56 2gra s TYR 135 Ca -0.03 -0.71 0.03 0.00 -0.52 0.00 0.00 57.07 55.85 2gra s TYR 135 Cb 0.00 -0.68 -0.02 0.00 0.38 0.00 0.00 41.96 41.64 2gra s TYR 135 CO -0.06 0.15 -0.10 0.00 -1.52 0.00 0.00 175.55 174.01 2gra s ALA 136 N -3.23 0.84 0.00 9.51 0.00 -0.29 -3.69 121.76 124.90 2gra s ALA 136 Ca 0.18 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.37 2gra s ALA 136 Cb 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.07 2gra s ALA 136 CO 0.02 0.10 0.00 2.41 0.00 0.00 0.00 175.76 178.29 2gra n THR 137 N 1.71 0.00 0.00 0.00 -1.04 -1.26 -3.52 114.28 110.17 2gra n THR 137 Ca -0.20 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.81 2gra n THR 137 Cb 0.55 -0.16 0.00 0.00 -1.82 0.00 0.00 70.33 68.90 2gra n THR 137 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2gra n GLY 138 N 0.00 1.33 2.30 3.41 0.00 -1.26 -4.26 105.19 106.71 2gra n GLY 138 Ca 0.00 -0.93 -0.14 0.00 0.00 0.00 0.00 46.02 44.95 2gra n GLY 138 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2gra n THR 139 N 1.62 -0.41 -1.11 2.61 -1.04 -1.26 -4.23 114.28 110.47 2gra n THR 139 Ca 0.00 0.00 0.12 0.00 -2.04 0.00 0.00 64.05 62.13 2gra n THR 139 Cb 0.00 -1.75 -0.04 0.00 -1.82 0.00 0.00 70.33 66.71 2gra n THR 139 CO 0.00 0.00 0.00 1.57 -0.64 0.00 0.00 175.07 176.00 2gra n HIS 140 N -2.91 -2.47 0.00 -1.42 -0.00 -1.26 -4.94 115.22 102.22 2gra n HIS 140 Ca -0.16 1.29 0.00 0.00 0.46 0.00 0.00 57.72 59.31 2gra n HIS 140 Cb 0.56 -2.24 0.00 0.00 -0.12 0.00 0.00 29.99 28.19 2gra n HIS 140 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2gra n ALA 141 N -2.69 0.00 -0.27 1.57 0.00 -1.26 -4.73 120.51 113.13 2gra n ALA 141 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2gra n ALA 141 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 2gra n ALA 141 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2gra n GLN 142 N 0.00 0.00 0.00 0.00 7.27 -1.26 -4.27 117.38 119.12 2gra n GLN 142 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2gra n GLN 142 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 2gra n GLN 142 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 2gra n VAL 143 N 0.00 0.00 -1.09 1.69 0.31 -1.26 -0.30 118.33 117.67 2gra n VAL 143 Ca 0.00 0.00 -0.24 0.00 -0.01 0.00 0.00 64.34 64.09 2gra n VAL 143 Cb 0.00 0.00 0.15 0.00 -0.91 0.00 0.00 33.84 33.08 2gra n VAL 143 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2gra n GLU 144 N 13.29 2.23 -0.07 5.55 -0.58 -1.26 -4.03 120.64 135.76 2gra n GLU 144 Ca 0.00 -2.82 -0.10 0.00 -0.42 0.00 0.00 57.16 53.82 2gra n GLU 144 Cb 0.00 -2.11 -0.15 0.00 -0.57 0.00 0.00 31.44 28.61 2gra n GLU 144 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2gra n ASP 145 N -0.96 0.44 -0.03 1.62 2.03 0.59 -3.95 116.55 116.29 2gra n ASP 145 Ca 0.56 0.13 -0.14 0.00 0.52 0.00 0.00 54.79 55.86 2gra n ASP 145 Cb 1.41 0.53 -0.10 0.00 -0.72 0.00 0.00 41.12 42.24 2gra n ASP 145 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 2gra h GLY 146 N 3.66 0.19 0.86 0.27 0.00 -1.68 -3.20 103.07 103.17 2gra h GLY 146 Ca -0.46 -0.29 0.15 0.00 0.00 0.00 0.00 47.33 46.73 2gra h GLY 146 CO 0.04 0.25 0.42 -0.09 0.00 0.00 0.00 176.54 177.17 2gra h ARG 147 N -0.42 0.15 -0.66 4.80 9.65 -1.80 -0.03 114.38 126.06 2gra h ARG 147 Ca -0.01 -0.01 0.04 0.00 -1.10 0.00 0.00 59.98 58.89 2gra h ARG 147 Cb 0.86 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 29.37 2gra h ARG 147 CO 0.04 0.10 0.44 1.25 2.80 0.00 0.00 179.97 184.59 2gra h LEU 148 N 0.15 0.67 0.73 3.80 5.85 -1.67 -2.48 115.31 122.36 2gra h LEU 148 Ca 0.29 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.97 2gra h LEU 148 Cb 0.94 -0.15 0.01 0.00 0.37 0.00 0.00 40.66 41.83 2gra h LEU 148 CO -0.04 0.46 -0.35 0.24 -0.34 0.00 0.00 178.44 178.41 2gra h MET 149 N 0.78 -0.94 -0.11 1.25 2.86 -1.09 -1.08 114.93 116.59 2gra h MET 149 Ca 0.27 0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.97 2gra h MET 149 Cb 0.10 0.21 0.00 0.00 0.06 0.00 0.00 31.60 31.97 2gra h MET 149 CO -0.08 -0.62 0.00 -1.91 1.06 0.00 0.00 176.91 175.36 2gra n GLU 150 N -5.50 0.19 -0.02 1.72 2.13 -0.95 -1.77 120.64 116.45 2gra n GLU 150 Ca -0.14 0.00 -0.06 0.00 0.66 0.00 0.00 57.16 57.62 2gra n GLU 150 Cb 0.40 -1.06 -0.02 0.00 0.27 0.00 0.00 31.44 31.03 2gra n GLU 150 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 2gra n GLN 151 N 0.02 0.19 0.26 5.31 6.02 -0.49 -3.62 117.38 125.08 2gra n GLN 151 Ca 0.00 0.08 0.11 0.00 -0.01 0.00 0.00 57.00 57.18 2gra n GLN 151 Cb 0.03 -0.83 0.73 0.00 1.02 0.00 0.00 30.24 31.18 2gra n GLN 151 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 2gra h LEU 152 N -0.35 0.00 0.00 1.08 5.85 -0.51 -3.20 115.31 118.18 2gra h LEU 152 Ca -0.09 0.00 -0.32 0.00 0.84 0.00 0.00 57.88 58.30 2gra h LEU 152 Cb 0.68 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.65 2gra h LEU 152 CO -0.06 0.09 -2.15 0.18 -0.34 0.00 0.00 178.44 176.16 2gra n LEU 153 N -3.95 2.32 0.00 2.25 4.77 -0.73 -4.31 117.00 117.35 2gra n LEU 153 Ca -0.02 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2gra n LEU 153 Cb 0.18 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 2gra n LEU 153 CO 0.31 0.66 0.10 -0.24 -1.33 0.00 0.00 177.39 176.90 2gra n SER 154 N -3.46 0.00 -0.08 -1.43 2.88 -1.24 0.18 113.62 110.47 2gra n SER 154 Ca -0.38 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.23 2gra n SER 154 Cb 0.84 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.24 2gra n SER 154 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2gra n SER 155 N -0.71 0.88 -2.65 -3.46 3.41 -1.21 -4.56 113.62 105.32 2gra n SER 155 Ca 0.00 -0.94 -0.08 0.00 -0.26 0.00 0.00 58.87 57.59 2gra n SER 155 Cb 0.00 0.87 0.04 0.00 -0.26 0.00 0.00 64.21 64.85 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 -1.04 1.43 0.00 -3.33 0.31 0.48 -4.83 118.33 111.35 2gra n VAL 156 Ca 0.03 -3.30 0.00 0.00 -0.01 0.00 0.00 64.34 61.07 2gra n VAL 156 Cb 0.24 0.58 0.00 0.00 -0.91 0.00 0.00 33.84 33.75 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 -0.43 0.21 0.00 2.92 0.00 -1.08 -4.09 105.19 102.72 2gra n GLY 157 Ca 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 0.00 0.00 -4.16 1.61 7.35 -1.19 -4.73 117.46 116.33 2gra n PHE 158 Ca 0.00 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.56 2gra n PHE 158 Cb 0.00 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 39.78 2gra n PHE 158 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2gra n THR 160 N -0.43 0.00 -4.28 0.00 -1.04 -1.26 -5.03 114.28 102.25 2gra n THR 160 Ca 0.05 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.86 2gra n THR 160 Cb 0.41 0.00 -0.13 0.00 -1.82 0.00 0.00 70.33 68.80 2gra n THR 160 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 2gra s GLU 161 N -2.00 0.92 0.04 -2.82 1.03 -1.26 -3.08 118.70 111.53 2gra s GLU 161 Ca 0.00 -0.90 -0.26 0.00 0.03 0.00 0.00 54.97 53.84 2gra s GLU 161 Cb 0.00 -0.96 0.06 0.00 -0.80 0.00 0.00 34.13 32.43 2gra s GLU 161 CO 0.00 0.23 0.61 0.08 -1.33 0.00 0.00 175.26 174.85 2gra s VAL 162 N -1.07 0.01 0.00 1.83 1.01 -1.24 -5.03 120.40 115.91 2gra s VAL 162 Ca 0.01 -0.07 -0.23 0.00 0.00 0.00 0.00 61.98 61.69 2gra s VAL 162 Cb -0.09 -0.99 -0.12 0.00 0.00 0.00 0.00 36.38 35.18 2gra s VAL 162 CO 0.02 -0.04 0.61 -1.84 0.00 0.00 0.00 175.10 173.86 2gra n GLU 163 N 0.38 0.00 -0.34 2.72 0.00 -1.26 -4.70 120.64 117.44 2gra n GLU 163 Ca -0.18 0.00 0.19 0.00 0.00 0.00 0.00 57.16 57.17 2gra n GLU 163 Cb 0.60 -0.86 0.42 0.00 0.00 0.00 0.00 31.44 31.60 2gra n GLU 163 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 2gra h GLU 164 N 1.71 0.50 -1.03 3.44 4.81 -1.96 -1.35 114.58 120.71 2gra h GLU 164 Ca -0.29 -0.03 0.30 0.00 -0.13 0.00 0.00 59.36 59.20 2gra h GLU 164 Cb 0.83 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 30.06 2gra h GLU 164 CO 0.38 0.33 1.16 0.38 -0.73 0.00 0.00 179.01 180.53 2gra h ASP 165 N 0.52 0.00 0.50 1.04 3.04 -2.03 1.11 116.42 120.60 2gra h ASP 165 Ca 0.66 0.00 -0.25 0.00 -3.24 0.00 0.00 57.03 54.19 2gra h ASP 165 Cb 1.35 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.64 2gra h ASP 165 CO -0.47 0.00 -1.12 -0.07 -2.04 0.00 0.00 179.24 175.54 2gra h LEU 166 N 0.00 0.48 -0.90 0.15 3.38 -1.55 -3.34 115.31 113.53 2gra h LEU 166 Ca 0.49 -0.45 0.26 0.00 0.09 0.00 0.00 57.88 58.26 2gra h LEU 166 Cb 2.80 -0.15 -0.17 0.00 0.09 0.00 0.00 40.66 43.23 2gra h LEU 166 CO -0.01 1.30 0.06 -0.38 0.09 0.00 0.00 178.44 179.51 2gra n ILE 167 N -3.63 -0.38 -0.20 1.22 5.41 0.38 0.18 119.36 122.34 2gra n ILE 167 Ca -0.08 1.96 0.01 0.00 1.00 0.00 0.00 62.75 65.64 2gra n ILE 167 Cb 0.94 -2.89 0.10 0.00 -0.71 0.00 0.00 39.64 37.09 2gra n ILE 167 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 2gra h ASP 168 N 0.00 -0.19 0.31 4.38 3.32 -1.72 0.22 116.42 122.74 2gra h ASP 168 Ca 0.56 0.14 -0.02 0.00 0.02 0.00 0.00 57.03 57.74 2gra h ASP 168 Cb 1.20 0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.99 2gra h ASP 168 CO -0.83 -0.08 -0.15 0.00 -1.72 0.00 0.00 179.24 176.46 2gra h ALA 169 N 1.53 -1.06 -1.00 3.45 0.00 0.16 -2.24 119.26 120.11 2gra h ALA 169 Ca 0.32 -0.09 0.39 0.00 0.00 0.00 0.00 54.91 55.53 2gra h ALA 169 Cb 0.51 0.16 -0.18 0.00 0.00 0.00 0.00 17.79 18.28 2gra h ALA 169 CO -0.49 -1.03 0.44 0.28 0.00 0.00 0.00 179.25 178.45 2gra h VAL 170 N -0.43 0.02 0.65 0.00 2.07 -0.83 0.69 116.25 118.42 2gra h VAL 170 Ca -0.04 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.44 2gra h VAL 170 Cb 0.32 -0.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.09 2gra h VAL 170 CO 0.07 0.00 -0.32 0.74 0.02 0.00 0.00 177.57 178.08 2gra h THR 171 N 0.02 0.34 -0.68 2.57 2.02 -0.47 0.91 112.91 117.61 2gra h THR 171 Ca 0.79 0.00 0.13 0.00 0.77 0.00 0.00 66.41 68.11 2gra h THR 171 Cb 2.02 0.34 -0.13 0.00 -1.74 0.00 0.00 68.15 68.64 2gra h THR 171 CO -0.79 0.00 -0.19 1.23 0.37 0.00 0.00 175.52 176.14 2gra h GLY 172 N -0.89 0.43 0.00 2.16 0.00 0.89 0.64 103.07 106.31 2gra h GLY 172 Ca -0.09 0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2gra h GLY 172 CO 0.14 -0.26 0.00 -0.10 0.00 0.00 0.00 176.54 176.32 2gra n LEU 173 N -5.46 0.00 -0.27 3.11 7.94 0.14 -3.22 117.00 119.23 2gra n LEU 173 Ca 0.08 0.00 0.05 0.00 -1.11 0.00 0.00 56.01 55.04 2gra n LEU 173 Cb 0.35 0.00 0.16 0.00 0.53 0.00 0.00 43.42 44.46 2gra n LEU 173 CO 0.02 0.00 0.79 0.77 -1.11 0.00 0.00 177.39 177.86 2gra h SER 174 N 0.00 -0.48 -0.27 1.96 4.64 0.57 0.80 113.55 120.77 2gra h SER 174 Ca 0.00 0.22 0.05 0.00 -0.47 0.00 0.00 61.79 61.59 2gra h SER 174 Cb 0.00 0.40 -0.08 0.00 -0.31 0.00 0.00 62.40 62.42 2gra h SER 174 CO 0.00 -0.22 -0.45 1.23 -0.87 0.00 0.00 176.83 176.52 2gra h GLY 175 N 0.06 -0.71 0.95 -0.77 0.00 0.19 -3.13 103.07 99.66 2gra h GLY 175 Ca 0.43 0.57 -0.12 0.00 0.00 0.00 0.00 47.33 48.20 2gra h GLY 175 CO -0.74 -0.19 -1.32 1.44 0.00 0.00 0.00 176.54 175.72 2gra n SER 176 N -5.42 0.83 -0.15 0.19 7.64 0.20 -4.59 113.62 112.31 2gra n SER 176 Ca -0.03 0.35 -0.04 0.00 1.01 0.00 0.00 58.87 60.16 2gra n SER 176 Cb 0.36 0.29 -0.04 0.00 -1.01 0.00 0.00 64.21 63.81 2gra n SER 176 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2gra n GLY 177 N 1.34 -0.95 0.31 0.23 0.00 0.27 0.03 105.19 106.42 2gra n GLY 177 Ca -0.07 0.44 0.12 0.00 0.00 0.00 0.00 46.02 46.50 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 0.10 -0.21 1.61 0.11 -1.81 0.91 132.00 132.71 2gra h PRO 178 Ca 0.06 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.22 2gra h PRO 178 Cb 0.15 -0.02 -0.07 0.00 0.11 0.00 0.00 31.00 31.17 2gra h PRO 178 CO -0.35 0.07 -0.35 0.00 -0.21 0.00 0.00 178.00 177.16 2gra h ALA 179 N 1.84 -0.38 -0.01 -0.75 0.00 -0.73 0.16 119.26 119.39 2gra h ALA 179 Ca 0.54 0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.50 2gra h ALA 179 Cb 1.08 0.69 -0.05 0.00 0.00 0.00 0.00 17.79 19.51 2gra h ALA 179 CO -0.76 -0.81 -0.48 1.88 0.00 0.00 0.00 179.25 179.08 2gra h TYR 180 N -0.38 -1.42 -0.68 0.00 0.99 -0.89 -0.43 116.97 114.16 2gra h TYR 180 Ca 0.11 0.05 0.10 0.00 2.00 0.00 0.00 58.73 60.98 2gra h TYR 180 Cb 0.57 0.62 -0.12 0.00 1.00 0.00 0.00 36.73 38.80 2gra h TYR 180 CO -0.47 -0.51 -0.44 0.00 -0.00 0.00 0.00 178.16 176.74 2gra h ALA 181 N -0.53 -0.27 -0.94 3.88 0.00 -0.60 1.09 119.26 121.89 2gra h ALA 181 Ca 0.01 0.14 0.15 0.00 0.00 0.00 0.00 54.91 55.21 2gra h ALA 181 Cb 0.64 1.00 -0.08 0.00 0.00 0.00 0.00 17.79 19.36 2gra h ALA 181 CO -0.33 -0.81 0.60 0.74 0.00 0.00 0.00 179.25 179.45 2gra h PHE 182 N -0.17 0.92 0.36 0.00 0.05 -0.16 0.51 116.94 118.46 2gra h PHE 182 Ca 0.20 0.03 -0.02 0.00 3.82 0.00 0.00 57.97 62.00 2gra h PHE 182 Cb 0.55 -0.29 0.00 0.00 2.00 0.00 0.00 35.95 38.22 2gra h PHE 182 CO -0.76 0.32 -0.17 1.15 -0.18 0.00 0.00 178.31 178.66 2gra h THR 183 N 0.76 0.57 -0.71 -1.55 2.02 0.16 -1.86 112.91 112.30 2gra h THR 183 Ca 0.48 -0.58 0.14 0.00 0.77 0.00 0.00 66.41 67.22 2gra h THR 183 Cb 0.72 0.82 -0.13 0.00 -1.74 0.00 0.00 68.15 67.82 2gra h THR 183 CO -0.24 0.10 -0.21 0.00 0.37 0.00 0.00 175.52 175.53 2gra h ALA 184 N -0.41 0.38 -0.15 6.16 0.00 0.23 -0.55 119.26 124.92 2gra h ALA 184 Ca -0.05 0.26 0.01 0.00 0.00 0.00 0.00 54.91 55.14 2gra h ALA 184 Cb 0.53 0.61 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2gra h ALA 184 CO 0.08 -0.46 0.05 -0.07 0.00 0.00 0.00 179.25 178.85 2gra h LEU 185 N -0.03 0.07 -1.56 0.00 3.38 0.05 -0.06 115.31 117.15 2gra h LEU 185 Ca 0.33 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.32 2gra h LEU 185 Cb 0.54 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2gra h LEU 185 CO -0.75 0.06 0.31 -0.78 0.09 0.00 0.00 178.44 177.37 2gra h ASP 186 N 0.13 0.51 0.00 -0.43 -0.00 -0.47 0.56 116.42 116.72 2gra h ASP 186 Ca 0.06 -0.01 0.00 0.00 -0.00 0.00 0.00 57.03 57.08 2gra h ASP 186 Cb 0.03 -0.13 0.00 0.00 -0.00 0.00 0.00 39.33 39.24 2gra h ASP 186 CO -0.06 0.37 0.00 0.00 -0.00 0.00 0.00 179.24 179.55 2gra n ALA 187 N -2.47 -0.46 -0.33 -0.78 0.00 -0.30 -1.80 120.51 114.38 2gra n ALA 187 Ca 0.04 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.59 2gra n ALA 187 Cb 0.07 0.00 0.23 0.00 0.00 0.00 0.00 19.45 19.76 2gra n ALA 187 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2gra h LEU 188 N 0.00 -0.55 -0.27 0.00 3.38 -0.74 0.53 115.31 117.66 2gra h LEU 188 Ca 0.00 0.27 0.03 0.00 0.09 0.00 0.00 57.88 58.27 2gra h LEU 188 Cb 0.00 0.49 -0.05 0.00 0.09 0.00 0.00 40.66 41.19 2gra h LEU 188 CO 0.00 -0.32 -0.29 0.00 0.09 0.00 0.00 178.44 177.93 2gra h ALA 189 N 1.93 -0.49 -0.99 1.53 0.00 0.31 0.43 119.26 121.98 2gra h ALA 189 Ca 0.54 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.53 2gra h ALA 189 Cb 1.03 0.98 -0.07 0.00 0.00 0.00 0.00 17.79 19.73 2gra h ALA 189 CO -0.89 -0.64 0.64 -0.44 0.00 0.00 0.00 179.25 177.91 2gra h ASP 190 N -0.16 1.00 -0.02 0.00 3.32 -0.25 -1.31 116.42 119.01 2gra h ASP 190 Ca 0.05 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2gra h ASP 190 Cb 0.28 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 2gra h ASP 190 CO -0.34 0.63 -0.03 1.23 -1.72 0.00 0.00 179.24 179.01 2gra h GLY 191 N 1.13 -1.82 0.50 2.75 0.00 0.38 0.26 103.07 106.28 2gra h GLY 191 Ca 0.44 0.79 0.04 0.00 0.00 0.00 0.00 47.33 48.61 2gra h GLY 191 CO -0.19 -0.68 -0.11 -1.33 0.00 0.00 0.00 176.54 174.23 2gra h GLY 192 N -0.02 0.03 -0.37 4.60 0.00 -0.12 -1.44 103.07 105.75 2gra h GLY 192 Ca 0.00 0.13 0.33 0.00 0.00 0.00 0.00 47.33 47.79 2gra h GLY 192 CO -0.03 -0.12 0.80 -2.08 0.00 0.00 0.00 176.54 175.12 2gra h VAL 193 N -0.10 0.42 -0.54 4.60 2.07 -0.93 1.21 116.25 122.97 2gra h VAL 193 Ca 0.10 -0.04 -0.05 0.00 0.82 0.00 0.00 66.70 67.53 2gra h VAL 193 Cb 0.25 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 2gra h VAL 193 CO -0.24 0.02 0.14 0.50 0.02 0.00 0.00 177.57 178.02 2gra h LYS 194 N 0.13 0.87 0.00 1.57 3.64 0.18 -0.88 116.57 122.07 2gra h LYS 194 Ca 0.59 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 2gra h LYS 194 Cb 2.07 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.77 2gra h LYS 194 CO -0.12 0.81 0.00 -1.33 -2.27 0.00 0.00 179.45 176.54 2gra n MET 195 N -4.42 0.48 0.00 1.90 2.81 0.41 -4.85 117.12 113.44 2gra n MET 195 Ca 0.02 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 2gra n MET 195 Cb 0.22 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.23 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 0.20 1.51 3.39 3.03 0.00 -0.34 -5.10 105.19 107.88 2gra n GLY 196 Ca 0.12 -0.34 -0.37 0.00 0.00 0.00 0.00 46.02 45.44 2gra n GLY 196 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gra n LEU 197 N 0.00 -0.57 -4.87 0.99 4.77 -1.16 -4.88 117.00 111.29 2gra n LEU 197 Ca 0.00 0.60 -0.31 0.00 -0.03 0.00 0.00 56.01 56.28 2gra n LEU 197 Cb 0.00 -1.10 0.03 0.00 -2.33 0.00 0.00 43.42 40.02 2gra n LEU 197 CO 0.00 -3.65 0.73 -2.16 -1.33 0.00 0.00 177.39 170.98 2gra s PRO 198 N -2.22 3.24 0.00 3.23 0.04 -1.26 -4.17 135.00 133.87 2gra s PRO 198 Ca 0.63 0.66 0.00 0.00 0.04 0.00 0.00 61.00 62.33 2gra s PRO 198 Cb -0.39 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.11 2gra s PRO 198 CO 0.61 -0.81 0.92 -2.13 0.04 0.00 0.00 177.00 175.63 2gra n ARG 199 N -2.89 0.00 0.05 4.56 3.00 -1.26 -2.49 116.66 117.62 2gra n ARG 199 Ca 0.06 0.62 -0.04 0.00 -0.00 0.00 0.00 57.85 58.49 2gra n ARG 199 Cb 0.55 -1.42 -0.03 0.00 0.00 0.00 0.00 32.46 31.57 2gra n ARG 199 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 2gra h ARG 200 N 0.00 -0.21 -0.67 -0.14 2.43 -1.98 -2.25 114.38 111.55 2gra h ARG 200 Ca 0.00 0.01 0.23 0.00 -0.81 0.00 0.00 59.98 59.42 2gra h ARG 200 Cb 0.00 0.05 -0.12 0.00 -0.42 0.00 0.00 29.97 29.48 2gra h ARG 200 CO 0.00 -0.14 0.18 -0.11 -1.51 0.00 0.00 179.97 178.39 2gra n LEU 201 N -3.18 0.07 0.00 3.80 7.94 -1.25 -1.64 117.00 122.73 2gra n LEU 201 Ca -0.03 1.13 0.00 0.00 -1.11 0.00 0.00 56.01 56.01 2gra n LEU 201 Cb 0.11 -0.48 0.00 0.00 0.53 0.00 0.00 43.42 43.58 2gra n LEU 201 CO 0.05 -1.21 0.48 0.00 -1.11 0.00 0.00 177.39 175.61 2gra n ALA 202 N -2.93 -0.42 -0.32 1.96 0.00 -0.86 -1.51 120.51 116.43 2gra n ALA 202 Ca 0.21 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.74 2gra n ALA 202 Cb 0.69 0.05 0.19 0.00 0.00 0.00 0.00 19.45 20.38 2gra n ALA 202 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2gra n VAL 203 N -2.00 -0.38 -0.03 0.00 0.31 -0.65 -0.86 118.33 114.71 2gra n VAL 203 Ca 0.00 2.04 -0.09 0.00 -0.01 0.00 0.00 64.34 66.28 2gra n VAL 203 Cb 0.00 -2.90 -0.03 0.00 -0.91 0.00 0.00 33.84 30.00 2gra n VAL 203 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2gra h ARG 204 N 0.00 -0.31 0.09 5.55 2.47 -1.34 0.57 114.38 121.41 2gra h ARG 204 Ca 0.49 0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 59.23 2gra h ARG 204 Cb 0.89 0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.28 2gra h ARG 204 CO -0.90 -0.21 -0.04 -0.07 0.56 0.00 0.00 179.97 179.31 2gra h LEU 205 N -0.32 -0.10 -0.53 3.04 3.38 0.10 -1.29 115.31 119.59 2gra h LEU 205 Ca 0.12 -0.21 0.10 0.00 0.09 0.00 0.00 57.88 57.97 2gra h LEU 205 Cb 0.51 0.03 -0.08 0.00 0.09 0.00 0.00 40.66 41.21 2gra h LEU 205 CO -0.38 0.16 0.08 1.23 0.09 0.00 0.00 178.44 179.61 2gra h GLY 206 N -0.36 0.63 -0.01 0.83 0.00 -1.12 0.54 103.07 103.57 2gra h GLY 206 Ca -0.01 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.34 2gra h GLY 206 CO 0.02 -0.10 -0.50 0.00 0.00 0.00 0.00 176.54 175.95 2gra h ALA 207 N 1.43 -0.92 -0.80 3.60 0.00 0.29 -0.22 119.26 122.64 2gra h ALA 207 Ca 0.27 -0.08 0.17 0.00 0.00 0.00 0.00 54.91 55.27 2gra h ALA 207 Cb 0.39 0.93 -0.11 0.00 0.00 0.00 0.00 17.79 19.00 2gra h ALA 207 CO -0.38 -1.07 0.31 0.37 0.00 0.00 0.00 179.25 178.48 2gra h GLN 208 N -0.62 0.39 -0.50 0.00 5.75 0.05 0.57 115.11 120.74 2gra h GLN 208 Ca 0.01 -0.02 0.10 0.00 -0.15 0.00 0.00 58.65 58.59 2gra h GLN 208 Cb 0.67 -0.09 -0.09 0.00 1.07 0.00 0.00 27.48 29.04 2gra h GLN 208 CO -0.34 0.26 -0.10 0.00 -2.65 0.00 0.00 178.83 175.99 2gra h ALA 209 N 1.62 0.35 -0.16 3.38 0.00 0.18 0.67 119.26 125.30 2gra h ALA 209 Ca 0.46 0.19 -0.04 0.00 0.00 0.00 0.00 54.91 55.52 2gra h ALA 209 Cb 0.78 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 2gra h ALA 209 CO -0.47 -0.43 -0.06 -0.07 0.00 0.00 0.00 179.25 178.21 2gra h LEU 210 N 0.02 0.33 -0.61 0.00 3.38 -0.23 -1.03 115.31 117.18 2gra h LEU 210 Ca 0.24 -0.40 0.12 0.00 0.09 0.00 0.00 57.88 57.94 2gra h LEU 210 Cb 0.37 -0.09 -0.12 0.00 0.09 0.00 0.00 40.66 40.91 2gra h LEU 210 CO -0.50 0.65 -0.19 0.25 0.09 0.00 0.00 178.44 178.74 2gra h LEU 211 N 0.01 -0.70 0.00 1.67 7.12 0.16 -1.56 115.31 122.01 2gra h LEU 211 Ca 0.04 0.19 0.00 0.00 0.13 0.00 0.00 57.88 58.24 2gra h LEU 211 Cb 0.52 0.42 0.00 0.00 -0.53 0.00 0.00 40.66 41.07 2gra h LEU 211 CO 0.02 -0.23 0.00 0.61 -0.13 0.00 0.00 178.44 178.71 2gra n GLY 212 N -1.43 -2.55 0.23 3.75 0.00 0.22 -2.91 105.19 102.50 2gra n GLY 212 Ca 0.07 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.03 2gra n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gra n ALA 213 N -1.26 -0.33 -0.47 4.61 0.00 -0.41 -0.83 120.51 121.82 2gra n ALA 213 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.91 2gra n ALA 213 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.36 2gra n ALA 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gra n ALA 214 N -3.60 -0.05 -0.34 0.00 0.00 -0.60 0.10 120.51 116.02 2gra n ALA 214 Ca 0.01 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.47 2gra n ALA 214 Cb 0.15 0.30 0.07 0.00 0.00 0.00 0.00 19.45 19.97 2gra n ALA 214 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2gra n LYS 215 N -1.91 -0.17 0.08 0.00 4.81 -0.50 0.85 118.16 121.32 2gra n LYS 215 Ca 0.00 1.41 -0.14 0.00 -0.87 0.00 0.00 58.31 58.71 2gra n LYS 215 Cb 0.00 -2.09 -0.07 0.00 0.02 0.00 0.00 35.03 32.89 2gra n LYS 215 CO 0.00 0.00 0.00 1.98 1.17 0.00 0.00 177.40 180.55 2gra h MET 216 N 0.00 -0.60 -0.65 1.64 4.05 0.64 -0.49 114.93 119.52 2gra h MET 216 Ca 0.36 0.04 0.10 0.00 -0.28 0.00 0.00 59.70 59.91 2gra h MET 216 Cb 0.58 0.14 -0.07 0.00 -0.80 0.00 0.00 31.60 31.44 2gra h MET 216 CO -0.91 -0.40 0.27 1.25 0.23 0.00 0.00 176.91 177.35 2gra h LEU 217 N -0.62 0.30 0.14 3.39 5.85 0.72 -1.02 115.31 124.07 2gra h LEU 217 Ca 0.03 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 2gra h LEU 217 Cb 0.67 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 2gra h LEU 217 CO -0.29 0.17 -0.24 -0.07 -0.34 0.00 0.00 178.44 177.67 2gra h LEU 218 N 0.47 -0.68 0.54 2.25 3.38 0.13 -2.24 115.31 119.15 2gra h LEU 218 Ca 0.33 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.34 2gra h LEU 218 Cb 0.40 0.24 0.01 0.00 0.09 0.00 0.00 40.66 41.39 2gra h LEU 218 CO -0.30 -0.28 -0.26 0.45 0.09 0.00 0.00 178.44 178.14 2gra h HIS 219 N -0.40 -0.67 0.00 1.13 3.86 -1.09 -3.38 115.15 114.59 2gra h HIS 219 Ca -0.02 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 2gra h HIS 219 Cb 0.37 0.22 0.00 0.00 1.06 0.00 0.00 27.41 29.07 2gra h HIS 219 CO -0.26 -0.42 0.00 0.43 0.86 0.00 0.00 177.93 178.54 2gra n SER 220 N -3.95 0.00 0.00 2.45 7.64 -0.39 -4.94 113.62 114.42 2gra n SER 220 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.79 2gra n SER 220 Cb 0.29 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 2gra n SER 220 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 2gra n GLU 221 N 0.00 0.00 0.00 1.43 0.28 -0.84 -5.04 120.64 116.47 2gra n GLU 221 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2gra n GLU 221 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 2gra n GLU 221 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 2gra n GLN 222 N 0.00 0.00 0.00 3.44 1.13 -1.26 -4.43 117.38 116.26 2gra n GLN 222 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2gra n GLN 222 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 2gra n GLN 222 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 2gra n HIS 223 N 0.00 0.00 -0.42 1.08 -0.00 -1.26 -4.88 115.22 109.74 2gra n HIS 223 Ca 0.00 0.00 0.34 0.00 -0.00 0.00 0.00 57.72 58.06 2gra n HIS 223 Cb 0.00 0.00 0.62 0.00 -0.00 0.00 0.00 29.99 30.61 2gra n HIS 223 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2gra h PRO 224 N 0.00 0.12 0.76 1.57 0.11 -1.97 0.32 132.00 132.91 2gra h PRO 224 Ca 0.00 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.07 2gra h PRO 224 Cb 0.00 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 31.09 2gra h PRO 224 CO 0.00 0.08 -0.37 0.78 -0.21 0.00 0.00 178.00 178.28 2gra h GLY 225 N 0.12 -1.07 -0.31 -0.55 0.00 -1.96 -1.02 103.07 98.28 2gra h GLY 225 Ca 0.80 0.40 0.06 0.00 0.00 0.00 0.00 47.33 48.59 2gra h GLY 225 CO -0.46 -0.39 -0.47 -1.61 0.00 0.00 0.00 176.54 173.61 2gra h GLN 226 N -1.23 -0.36 -0.88 4.80 5.75 -0.80 0.18 115.11 122.58 2gra h GLN 226 Ca -0.10 0.02 0.20 0.00 -0.15 0.00 0.00 58.65 58.62 2gra h GLN 226 Cb 0.80 0.08 -0.12 0.00 1.07 0.00 0.00 27.48 29.31 2gra h GLN 226 CO 0.17 -0.24 0.40 -0.07 -2.65 0.00 0.00 178.83 176.44 2gra h LEU 227 N -0.37 0.37 -0.34 -2.39 3.38 -1.02 0.14 115.31 115.07 2gra h LEU 227 Ca 0.11 0.14 0.05 0.00 0.09 0.00 0.00 57.88 58.27 2gra h LEU 227 Cb 0.60 0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.41 2gra h LEU 227 CO -0.57 0.05 0.05 0.50 0.09 0.00 0.00 178.44 178.56 2gra h LYS 228 N 0.45 0.16 -0.60 1.13 3.64 0.71 -1.73 116.57 120.31 2gra h LYS 228 Ca 0.53 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.98 2gra h LYS 228 Cb 0.96 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.68 2gra h LYS 228 CO -0.49 0.11 0.27 -0.44 -2.27 0.00 0.00 179.45 176.63 2gra h ASP 229 N 0.17 0.34 0.03 4.20 5.19 0.40 -0.70 116.42 126.05 2gra h ASP 229 Ca 0.16 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.63 2gra h ASP 229 Cb 0.19 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.70 2gra h ASP 229 CO -0.23 0.21 0.00 0.59 -3.12 0.00 0.00 179.24 176.70 2gra n ASN 230 N -4.92 0.00 0.00 6.45 4.13 -0.64 -1.78 115.26 118.50 2gra n ASN 230 Ca 0.08 -0.03 0.00 0.00 1.68 0.00 0.00 54.58 56.31 2gra n ASN 230 Cb 0.22 -0.10 0.00 0.00 -1.54 0.00 0.00 39.78 38.37 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 -1.10 0.61 -3.94 2.41 0.31 -0.28 -4.96 118.33 111.38 2gra n VAL 231 Ca 0.03 -0.62 -0.33 0.00 -0.01 0.00 0.00 64.34 63.41 2gra n VAL 231 Cb 0.02 0.70 -0.14 0.00 -0.91 0.00 0.00 33.84 33.52 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 -0.61 4.87 0.18 4.52 0.01 -0.73 -4.80 113.70 117.13 2gra s SER 232 Ca 0.00 -1.85 -0.30 0.00 1.31 0.00 0.00 55.95 55.11 2gra s SER 232 Cb 0.00 -1.69 -0.08 0.00 0.21 0.00 0.00 66.02 64.47 2gra s SER 232 CO 0.00 -0.37 1.09 -0.94 0.41 0.00 0.00 173.24 173.43 2gra s SER 233 N 1.24 7.28 0.51 2.44 1.04 -1.26 -4.88 113.70 120.07 2gra s SER 233 Ca 0.04 2.08 0.41 0.00 0.48 0.00 0.00 55.95 58.97 2gra s SER 233 Cb -0.20 -2.60 1.60 0.00 0.10 0.00 0.00 66.02 64.91 2gra s SER 233 CO -0.05 -0.21 1.62 -0.65 0.98 0.00 0.00 173.24 174.93 2gra h PRO 234 N 5.06 0.03 0.00 4.02 0.11 -1.98 -1.90 132.00 137.33 2gra h PRO 234 Ca -0.44 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2gra h PRO 234 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2gra h PRO 234 CO 0.72 0.02 0.00 0.41 -0.21 0.00 0.00 178.00 178.94 2gra n GLY 235 N -1.75 -3.00 0.00 -0.55 0.00 -1.26 -5.02 105.19 93.61 2gra n GLY 235 Ca 0.39 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.71 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 -0.61 -0.54 5.00 -0.02 0.00 -0.72 -4.91 105.19 103.39 2gra n GLY 236 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 0.00 0.00 -0.22 4.61 0.00 -1.26 -3.67 120.51 119.97 2gra n ALA 237 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2gra n ALA 237 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2gra n ALA 237 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2gra n THR 238 N 0.00 0.00 -0.62 0.00 -1.04 -1.26 -2.83 114.28 108.53 2gra n THR 238 Ca 0.00 0.39 0.49 0.00 -2.04 0.00 0.00 64.05 62.89 2gra n THR 238 Cb 0.00 -1.25 0.78 0.00 -1.82 0.00 0.00 70.33 68.04 2gra n THR 238 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 2gra h ILE 239 N 0.00 0.04 0.06 12.58 6.09 -1.85 0.42 117.51 134.85 2gra h ILE 239 Ca 0.00 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2gra h ILE 239 Cb 0.00 0.05 0.00 0.00 0.47 0.00 0.00 36.82 37.34 2gra h ILE 239 CO 0.00 0.00 -0.03 0.45 -3.07 0.00 0.00 178.15 175.50 2gra h HIS 240 N 0.00 -0.07 -0.91 2.19 3.86 -1.80 -2.60 115.15 115.82 2gra h HIS 240 Ca 0.86 -0.00 0.31 0.00 -1.16 0.00 0.00 60.37 60.38 2gra h HIS 240 Cb 3.56 0.02 -0.17 0.00 1.06 0.00 0.00 27.41 31.88 2gra h HIS 240 CO 0.00 -0.04 0.23 0.00 0.86 0.00 0.00 177.93 178.97 2gra n ALA 241 N -2.09 0.67 0.18 2.45 0.00 0.13 0.22 120.51 122.07 2gra n ALA 241 Ca -0.01 0.95 -0.11 0.00 0.00 0.00 0.00 53.44 54.28 2gra n ALA 241 Cb 0.03 -0.81 -0.06 0.00 0.00 0.00 0.00 19.45 18.62 2gra n ALA 241 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2gra h LEU 242 N 0.00 -0.79 -0.88 0.00 3.38 -1.01 -0.62 115.31 115.39 2gra h LEU 242 Ca 0.65 0.06 0.37 0.00 0.09 0.00 0.00 57.88 59.05 2gra h LEU 242 Cb 1.54 0.26 -0.16 0.00 0.09 0.00 0.00 40.66 42.38 2gra h LEU 242 CO -0.79 -0.39 0.48 1.57 0.09 0.00 0.00 178.44 179.40 2gra n HIS 243 N -4.12 1.01 -0.18 1.13 -0.00 0.13 0.19 115.22 113.39 2gra n HIS 243 Ca -0.07 1.02 -0.08 0.00 0.46 0.00 0.00 57.72 59.06 2gra n HIS 243 Cb 0.27 -1.44 0.02 0.00 -0.12 0.00 0.00 29.99 28.72 2gra n HIS 243 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 2gra h VAL 244 N 0.00 1.19 0.37 3.57 2.07 -0.27 0.38 116.25 123.56 2gra h VAL 244 Ca 0.74 -0.52 -0.02 0.00 0.82 0.00 0.00 66.70 67.72 2gra h VAL 244 Cb 1.97 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 32.32 2gra h VAL 244 CO -0.67 0.21 -0.18 -0.07 0.02 0.00 0.00 177.57 176.88 2gra h LEU 245 N 0.70 -0.42 -1.05 2.57 3.38 0.29 -2.97 115.31 117.80 2gra h LEU 245 Ca 0.18 0.01 0.18 0.00 0.09 0.00 0.00 57.88 58.35 2gra h LEU 245 Cb 0.09 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2gra h LEU 245 CO -0.03 -0.10 0.98 -0.33 0.09 0.00 0.00 178.44 179.05 2gra h GLU 246 N -0.90 0.00 -0.01 1.13 4.39 -0.20 2.84 114.58 121.83 2gra h GLU 246 Ca -0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.65 2gra h GLU 246 Cb 0.38 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.03 2gra h GLU 246 CO 0.08 0.00 -0.15 0.45 -1.16 0.00 0.00 179.01 178.23 2gra n SER 247 N -3.13 1.46 -0.22 1.42 2.88 0.13 -3.70 113.62 112.47 2gra n SER 247 Ca 0.14 -1.28 0.09 0.00 -1.33 0.00 0.00 58.87 56.49 2gra n SER 247 Cb 1.18 0.10 0.16 0.00 -0.75 0.00 0.00 64.21 64.90 2gra n SER 247 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2gra n GLY 248 N 1.28 4.79 2.54 0.46 0.00 0.95 -4.95 105.19 110.26 2gra n GLY 248 Ca 0.15 -1.14 -0.17 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.29 1.63 0.20 -0.02 0.00 -1.10 -4.82 105.19 99.79 2gra n GLY 249 Ca 0.17 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.34 2gra n GLY 249 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2gra n PHE 250 N -2.23 0.56 0.05 1.61 7.35 -1.18 -0.00 117.46 123.62 2gra n PHE 250 Ca -0.17 0.71 -0.02 0.00 -0.76 0.00 0.00 57.45 57.21 2gra n PHE 250 Cb 0.62 -1.06 -0.01 0.00 0.35 0.00 0.00 39.48 39.38 2gra n PHE 250 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2gra h ARG 251 N 0.00 -0.12 -0.13 -4.13 3.08 -1.87 -3.23 114.38 107.98 2gra h ARG 251 Ca 0.45 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.52 2gra h ARG 251 Cb 1.09 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.15 2gra h ARG 251 CO -0.50 -0.08 -0.06 0.43 -1.07 0.00 0.00 179.97 178.69 2gra n SER 252 N -2.42 -0.11 -0.30 7.04 7.64 1.00 0.31 113.62 126.78 2gra n SER 252 Ca -0.01 0.23 0.10 0.00 1.01 0.00 0.00 58.87 60.19 2gra n SER 252 Cb 0.05 -0.04 0.26 0.00 -1.01 0.00 0.00 64.21 63.47 2gra n SER 252 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2gra h LEU 253 N 0.00 0.43 -0.33 -3.43 3.38 -1.50 0.67 115.31 114.52 2gra h LEU 253 Ca 0.04 0.12 -0.06 0.00 0.09 0.00 0.00 57.88 58.07 2gra h LEU 253 Cb 0.07 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2gra h LEU 253 CO -0.13 0.11 -0.01 -0.07 0.09 0.00 0.00 178.44 178.44 2gra h LEU 254 N 0.51 0.59 -0.35 1.67 3.38 0.47 -0.80 115.31 120.78 2gra h LEU 254 Ca 0.51 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2gra h LEU 254 Cb 0.85 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 2gra h LEU 254 CO -0.44 0.76 0.22 0.40 0.09 0.00 0.00 178.44 179.47 2gra h ILE 255 N 0.40 1.10 -0.90 1.22 1.08 -1.17 0.84 117.51 120.08 2gra h ILE 255 Ca 0.09 -0.22 0.18 0.00 -0.39 0.00 0.00 64.86 64.53 2gra h ILE 255 Cb 0.47 0.62 -0.11 0.00 -3.07 0.00 0.00 36.82 34.73 2gra h ILE 255 CO 0.02 0.10 0.47 0.78 -0.69 0.00 0.00 178.15 178.83 2gra h ASN 256 N 0.46 0.54 -0.01 1.72 4.21 -0.64 0.48 115.58 122.34 2gra h ASN 256 Ca 0.13 0.11 -0.26 0.00 1.21 0.00 0.00 56.30 57.48 2gra h ASN 256 Cb -0.03 0.03 0.02 0.00 -1.12 0.00 0.00 38.32 37.22 2gra h ASN 256 CO -0.03 0.17 -1.02 0.00 -1.29 0.00 0.00 177.43 175.27 2gra h ALA 257 N 1.62 0.14 -0.04 -0.83 0.00 -0.07 0.16 119.26 120.25 2gra h ALA 257 Ca 0.52 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2gra h ALA 257 Cb 0.83 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 2gra h ALA 257 CO -0.41 0.68 0.01 -0.24 0.00 0.00 0.00 179.25 179.29 2gra h VAL 258 N 0.41 0.99 0.00 0.00 3.04 -0.10 0.80 116.25 121.39 2gra h VAL 258 Ca -0.12 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.56 2gra h VAL 258 Cb 1.67 0.96 0.00 0.00 -2.01 0.00 0.00 31.29 31.90 2gra h VAL 258 CO 0.20 0.01 0.00 1.21 -1.01 0.00 0.00 177.57 177.98 2gra n GLU 259 N -5.09 0.00 -0.55 4.17 2.13 0.09 -0.52 120.64 120.87 2gra n GLU 259 Ca -0.06 0.47 0.44 0.00 0.66 0.00 0.00 57.16 58.67 2gra n GLU 259 Cb 0.04 -1.41 0.72 0.00 0.27 0.00 0.00 31.44 31.06 2gra n GLU 259 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2gra n ALA 260 N -1.84 1.53 0.09 4.31 0.00 0.55 0.21 120.51 125.36 2gra n ALA 260 Ca 0.00 0.81 -0.08 0.00 0.00 0.00 0.00 53.44 54.16 2gra n ALA 260 Cb 0.00 -1.09 -0.05 0.00 0.00 0.00 0.00 19.45 18.31 2gra n ALA 260 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2gra h SER 261 N 0.00 -0.26 -0.42 0.00 0.87 -0.47 -2.80 113.55 110.46 2gra h SER 261 Ca 0.90 -0.18 0.08 0.00 -1.23 0.00 0.00 61.79 61.36 2gra h SER 261 Cb 3.13 0.07 -0.09 0.00 -0.44 0.00 0.00 62.40 65.06 2gra h SER 261 CO -0.33 0.25 -0.39 0.00 -0.53 0.00 0.00 176.83 175.83 2gra h ILE 263 N -0.29 0.13 -0.83 0.00 2.04 -0.86 0.68 117.51 118.38 2gra h ILE 263 Ca 0.16 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.22 2gra h ILE 263 Cb 0.57 0.13 -0.13 0.00 -0.74 0.00 0.00 36.82 36.65 2gra h ILE 263 CO -0.57 0.00 0.18 -0.09 0.00 0.00 0.00 178.15 177.67 2gra h ARG 264 N -0.47 0.20 -0.13 2.37 9.65 -1.08 0.33 114.38 125.25 2gra h ARG 264 Ca 0.08 -0.01 0.05 0.00 -1.10 0.00 0.00 59.98 59.00 2gra h ARG 264 Cb 0.62 -0.05 -0.06 0.00 -1.39 0.00 0.00 29.97 29.09 2gra h ARG 264 CO -0.43 0.13 -0.28 1.15 2.80 0.00 0.00 179.97 183.34 2gra h THR 265 N 0.21 0.34 -0.24 0.20 2.02 0.37 -0.66 112.91 115.16 2gra h THR 265 Ca 0.50 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.73 2gra h THR 265 Cb 0.95 0.34 -0.06 0.00 -1.74 0.00 0.00 68.15 67.64 2gra h THR 265 CO -0.63 0.00 -0.16 0.03 0.37 0.00 0.00 175.52 175.13 2gra h ARG 266 N -0.35 -0.14 -0.84 6.66 3.08 0.69 0.09 114.38 123.56 2gra h ARG 266 Ca 0.10 0.01 0.21 0.00 0.07 0.00 0.00 59.98 60.37 2gra h ARG 266 Cb 0.51 0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.54 2gra h ARG 266 CO -0.34 -0.10 0.58 0.93 -1.07 0.00 0.00 179.97 179.98 2gra h GLU 267 N -0.15 0.21 -0.21 0.04 5.08 -0.15 -0.83 114.58 118.56 2gra h GLU 267 Ca 0.13 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.40 2gra h GLU 267 Cb 0.35 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 2gra h GLU 267 CO -0.33 0.14 -0.18 -0.07 -1.00 0.00 0.00 179.01 177.57 2gra h LEU 268 N 0.22 0.53 -1.61 1.33 3.38 0.49 -2.79 115.31 116.85 2gra h LEU 268 Ca 0.42 -0.46 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 2gra h LEU 268 Cb 1.30 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 2gra h LEU 268 CO -0.09 0.88 -0.21 0.06 0.09 0.00 0.00 178.44 179.16 2gra h GLN 269 N 0.18 0.00 0.00 1.13 3.07 -0.64 -0.70 115.11 118.16 2gra h GLN 269 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.78 2gra h GLN 269 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.28 2gra h GLN 269 CO 0.05 0.21 0.00 0.43 0.09 0.00 0.00 178.83 179.61 2gra n SER 270 N -4.08 0.00 -0.06 0.06 7.64 -0.72 0.11 113.62 116.57 2gra n SER 270 Ca -0.02 -0.76 -0.09 0.00 1.01 0.00 0.00 58.87 59.02 2gra n SER 270 Cb 0.28 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.42 2gra n SER 270 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2gra n MET 271 N -0.80 0.41 -0.00 1.43 2.81 -0.31 -4.13 117.12 116.52 2gra n MET 271 Ca 0.08 0.07 0.15 0.00 -1.81 0.00 0.00 57.70 56.18 2gra n MET 271 Cb 0.04 -1.25 0.76 0.00 -0.71 0.00 0.00 33.22 32.05 2gra n MET 271 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2gra n ALA 272 N -2.85 2.64 0.13 3.04 0.00 -0.46 -2.42 120.51 120.59 2gra n ALA 272 Ca -0.22 -0.28 0.02 0.00 0.00 0.00 0.00 53.44 52.96 2gra n ALA 272 Cb 0.74 -1.37 0.03 0.00 0.00 0.00 0.00 19.45 18.85 2gra n ALA 272 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2gra n ASP 273 N -0.56 1.57 0.00 0.00 9.92 0.30 -4.71 116.55 123.07 2gra n ASP 273 Ca 0.21 -1.35 0.00 0.00 -0.53 0.00 0.00 54.79 53.12 2gra n ASP 273 Cb 0.19 -0.02 0.00 0.00 -0.64 0.00 0.00 41.12 40.65 2gra n ASP 273 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00 2gra n GLN 274 N 0.17 0.86 0.00 -1.24 7.27 -1.18 -5.01 117.38 118.26 2gra n GLN 274 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.10 2gra n GLN 274 Cb 0.15 -0.98 0.00 0.00 2.41 0.00 0.00 30.24 31.82 2gra n GLN 274 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52