#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 -1.80 3.59 -0.13 0.00 -1.26 -5.01 105.19 100.57 2gra n GLY 0 Ca 0.00 -0.58 -0.10 0.00 0.00 0.00 0.00 46.02 45.35 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 -3.21 0.54 0.11 1.61 0.00 -1.26 -5.16 119.30 111.93 2gra s MET 1 Ca 0.61 0.16 0.08 0.00 0.00 0.00 0.00 55.69 56.54 2gra s MET 1 Cb -0.28 0.25 -0.04 0.00 0.00 0.00 0.00 34.83 34.77 2gra s MET 1 CO 0.63 -0.16 -0.12 -1.12 0.00 0.00 0.00 175.02 174.25 2gra s SER 2 N -1.00 4.25 0.02 1.11 0.01 -1.26 -4.99 113.70 111.84 2gra s SER 2 Ca -0.00 -0.44 -0.05 0.00 1.31 0.00 0.00 55.95 56.77 2gra s SER 2 Cb -0.01 -0.75 -0.01 0.00 0.21 0.00 0.00 66.02 65.46 2gra s SER 2 CO 0.00 0.17 0.07 -0.69 0.41 0.00 0.00 173.24 173.21 2gra s VAL 3 N -1.22 0.11 0.06 3.43 1.01 -1.22 -1.86 120.40 120.71 2gra s VAL 3 Ca 0.21 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.30 2gra s VAL 3 Cb -0.11 -0.56 -0.03 0.00 0.00 0.00 0.00 36.38 35.69 2gra s VAL 3 CO 0.13 -0.50 -0.08 -0.83 0.00 0.00 0.00 175.10 173.82 2gra s GLY 4 N -1.68 0.58 -0.30 4.51 0.00 -0.40 -3.51 107.32 106.52 2gra s GLY 4 Ca -0.11 -0.90 0.01 0.00 0.00 0.00 0.00 44.72 43.71 2gra s GLY 4 CO -0.01 -0.96 0.05 -1.36 0.00 0.00 0.00 173.10 170.81 2gra s PHE 5 N -1.86 2.46 -0.26 1.90 0.40 -1.13 -1.03 117.98 118.46 2gra s PHE 5 Ca -0.05 -2.10 0.21 0.00 -0.60 0.00 0.00 56.93 54.39 2gra s PHE 5 Cb -0.07 -2.03 0.07 0.00 0.51 0.00 0.00 43.02 41.51 2gra s PHE 5 CO -0.01 -0.87 1.21 0.82 0.70 0.00 0.00 175.22 177.08 2gra h ILE 6 N 6.57 0.21 -2.61 0.64 1.08 -1.72 -1.60 117.51 120.08 2gra h ILE 6 Ca -0.12 -1.35 -0.74 0.00 -0.39 0.00 0.00 64.86 62.27 2gra h ILE 6 Cb 1.03 1.86 -0.33 0.00 -3.07 0.00 0.00 36.82 36.31 2gra h ILE 6 CO 0.47 0.12 0.35 0.61 -0.69 0.00 0.00 178.15 179.01 2gra n GLY 7 N 1.20 5.19 3.67 5.37 0.00 -1.25 -4.59 105.19 114.79 2gra n GLY 7 Ca -0.00 -2.70 -0.42 0.00 0.00 0.00 0.00 46.02 42.89 2gra n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gra s ALA 8 N -2.89 3.52 0.00 4.61 0.00 -1.17 -4.42 121.76 121.41 2gra s ALA 8 Ca 0.35 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.55 2gra s ALA 8 Cb 0.10 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.80 2gra s ALA 8 CO 0.04 -0.75 0.00 0.41 0.00 0.00 0.00 175.76 175.46 2gra n GLY 9 N 3.25 3.36 7.00 0.00 0.00 -1.26 -4.74 105.19 112.80 2gra n GLY 9 Ca 0.09 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.32 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 -1.69 0.00 0.00 1.61 1.13 -1.26 0.34 117.38 117.51 2gra n GLN 10 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2gra n GLN 10 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 2gra n GLN 10 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 2gra n LEU 11 N 0.00 0.00 -0.01 1.08 7.94 -1.26 -0.12 117.00 124.63 2gra n LEU 11 Ca 0.00 0.00 -0.19 0.00 -1.11 0.00 0.00 56.01 54.71 2gra n LEU 11 Cb 0.00 0.00 -0.14 0.00 0.53 0.00 0.00 43.42 43.81 2gra n LEU 11 CO 0.00 0.00 -0.11 0.00 -1.11 0.00 0.00 177.39 176.17 2gra h ALA 12 N 1.51 0.07 -0.79 1.96 0.00 -0.37 -2.98 119.26 118.65 2gra h ALA 12 Ca 0.00 -0.85 0.06 0.00 0.00 0.00 0.00 54.91 54.12 2gra h ALA 12 Cb 0.00 0.29 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 2gra h ALA 12 CO 0.00 0.48 0.48 0.35 0.00 0.00 0.00 179.25 180.56 2gra h PHE 13 N -0.59 0.88 0.64 0.00 3.57 -0.62 -1.57 116.94 119.25 2gra h PHE 13 Ca -0.19 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.31 2gra h PHE 13 Cb 1.48 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.94 2gra h PHE 13 CO 0.18 0.43 -0.45 0.00 -2.23 0.00 0.00 178.31 176.24 2gra h ALA 14 N 1.39 -1.20 -0.45 2.41 0.00 -1.63 -2.06 119.26 117.72 2gra h ALA 14 Ca 0.35 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 55.10 2gra h ALA 14 Cb 0.20 0.60 -0.07 0.00 0.00 0.00 0.00 17.79 18.52 2gra h ALA 14 CO -0.18 -1.18 -0.40 -0.07 0.00 0.00 0.00 179.25 177.41 2gra h LEU 15 N -1.04 -1.41 0.00 0.00 3.38 -1.32 -0.22 115.31 114.71 2gra h LEU 15 Ca -0.08 0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2gra h LEU 15 Cb 0.85 0.59 0.00 0.00 0.09 0.00 0.00 40.66 42.19 2gra h LEU 15 CO 0.05 -0.24 0.00 0.00 0.09 0.00 0.00 178.44 178.34 2gra n ALA 16 N -3.05 0.00 -0.60 1.53 0.00 -0.62 0.44 120.51 118.22 2gra n ALA 16 Ca -0.01 0.00 0.47 0.00 0.00 0.00 0.00 53.44 53.90 2gra n ALA 16 Cb 0.22 0.38 0.76 0.00 0.00 0.00 0.00 19.45 20.82 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 0.01 0.11 0.00 3.64 -0.90 -1.60 116.57 117.83 2gra h LYS 17 Ca 0.00 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2gra h LYS 17 Cb 0.00 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2gra h LYS 17 CO 0.00 0.01 -0.05 0.78 -2.27 0.00 0.00 179.45 177.92 2gra h GLY 18 N 0.01 -0.15 -0.13 5.01 0.00 0.18 -1.23 103.07 106.78 2gra h GLY 18 Ca 0.89 0.06 0.28 0.00 0.00 0.00 0.00 47.33 48.55 2gra h GLY 18 CO -0.17 -0.05 0.70 0.74 0.00 0.00 0.00 176.54 177.75 2gra h PHE 19 N -0.16 0.44 0.00 5.60 -1.00 -0.88 0.79 116.94 121.73 2gra h PHE 19 Ca -0.01 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2gra h PHE 19 Cb 0.11 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 39.54 2gra h PHE 19 CO 0.17 0.05 0.00 2.41 -1.61 0.00 0.00 178.31 179.33 2gra n THR 20 N -4.48 0.00 0.10 -1.55 -1.04 -0.78 -2.19 114.28 104.33 2gra n THR 20 Ca 0.24 0.94 0.20 0.00 -2.04 0.00 0.00 64.05 63.39 2gra n THR 20 Cb 0.96 -1.81 0.72 0.00 -1.82 0.00 0.00 70.33 68.38 2gra n THR 20 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2gra h ALA 21 N -2.03 2.07 0.00 2.41 0.00 -0.70 1.21 119.26 122.23 2gra h ALA 21 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2gra h ALA 21 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2gra h ALA 21 CO 0.00 -0.71 0.03 0.00 0.00 0.00 0.00 179.25 178.57 2gra h ALA 22 N 1.37 1.02 -4.99 0.00 0.00 0.10 -3.44 119.26 113.31 2gra h ALA 22 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.77 2gra h ALA 22 Cb 1.19 0.00 0.12 0.00 0.00 0.00 0.00 17.79 19.10 2gra h ALA 22 CO -0.00 -0.02 -0.56 0.41 0.00 0.00 0.00 179.25 179.08 2gra n GLY 23 N -1.28 -0.28 1.04 0.00 0.00 0.42 -4.91 105.19 100.18 2gra n GLY 23 Ca -0.02 0.09 0.01 0.00 0.00 0.00 0.00 46.02 46.10 2gra n GLY 23 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2gra n VAL 24 N -4.52 0.00 -3.57 1.61 0.31 -0.93 -5.08 118.33 106.15 2gra n VAL 24 Ca -0.01 -0.49 -0.07 0.00 -0.01 0.00 0.00 64.34 63.77 2gra n VAL 24 Cb 0.55 0.71 -0.03 0.00 -0.91 0.00 0.00 33.84 34.16 2gra n VAL 24 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 2gra s LEU 25 N 0.00 -0.24 -0.18 7.52 2.96 -1.22 -4.95 118.68 122.57 2gra s LEU 25 Ca 0.17 0.11 -0.03 0.00 -0.22 0.00 0.00 54.13 54.15 2gra s LEU 25 Cb 0.19 1.63 -0.02 0.00 0.50 0.00 0.00 46.19 48.49 2gra s LEU 25 CO -0.08 -0.33 -0.04 0.00 -1.32 0.00 0.00 176.35 174.57 2gra s ALA 26 N -2.09 2.90 -0.37 5.97 0.00 -1.26 -4.59 121.76 122.31 2gra s ALA 26 Ca 0.05 -0.96 0.04 0.00 0.00 0.00 0.00 51.96 51.10 2gra s ALA 26 Cb -0.01 -1.59 0.24 0.00 0.00 0.00 0.00 23.12 21.76 2gra s ALA 26 CO -0.05 -0.03 0.96 0.00 0.00 0.00 0.00 175.76 176.65 2gra n ALA 27 N 4.02 0.59 -0.03 0.00 0.00 -1.26 -0.26 120.51 123.57 2gra n ALA 27 Ca -0.18 0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.35 2gra n ALA 27 Cb 0.52 -0.65 -0.12 0.00 0.00 0.00 0.00 19.45 19.20 2gra n ALA 27 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2gra n HIS 28 N -1.55 0.00 0.37 0.00 8.25 -1.25 -3.91 115.22 117.12 2gra n HIS 28 Ca -0.00 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.49 2gra n HIS 28 Cb 0.25 -0.47 0.19 0.00 1.12 0.00 0.00 29.99 31.08 2gra n HIS 28 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2gra n LYS 29 N -2.20 0.12 -4.09 -0.41 4.76 0.64 -4.57 118.16 112.42 2gra n LYS 29 Ca -0.09 0.20 -0.14 0.00 -2.87 0.00 0.00 58.31 55.41 2gra n LYS 29 Cb 0.58 -1.50 -0.12 0.00 -1.84 0.00 0.00 35.03 32.14 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 -2.52 0.51 0.26 -0.18 1.09 -1.24 -3.45 121.20 115.66 2gra s ILE 30 Ca 0.07 -0.86 0.07 0.00 -1.10 0.00 0.00 60.65 58.84 2gra s ILE 30 Cb 0.05 -0.54 -0.04 0.00 -1.06 0.00 0.00 42.46 40.87 2gra s ILE 30 CO 0.11 -0.25 0.18 -0.32 -0.10 0.00 0.00 174.94 174.56 2gra s MET 31 N -1.20 2.84 -0.63 2.79 1.75 -1.23 -4.31 119.30 119.31 2gra s MET 31 Ca -0.07 -1.12 0.06 0.00 -1.25 0.00 0.00 55.69 53.31 2gra s MET 31 Cb -0.08 -2.51 0.21 0.00 2.84 0.00 0.00 34.83 35.29 2gra s MET 31 CO 0.00 0.38 0.58 0.00 -0.65 0.00 0.00 175.02 175.33 2gra n ALA 32 N -1.16 3.54 -2.55 4.11 0.00 0.37 -2.86 120.51 121.97 2gra n ALA 32 Ca -0.07 -4.41 -0.43 0.00 0.00 0.00 0.00 53.44 48.53 2gra n ALA 32 Cb 0.58 -0.94 -0.02 0.00 0.00 0.00 0.00 19.45 19.07 2gra n ALA 32 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2gra s SER 33 N -1.70 6.99 -0.07 0.00 0.15 -0.60 -2.39 113.70 116.08 2gra s SER 33 Ca 0.32 1.46 -0.01 0.00 0.70 0.00 0.00 55.95 58.42 2gra s SER 33 Cb 0.06 -2.54 0.03 0.00 -1.71 0.00 0.00 66.02 61.85 2gra s SER 33 CO -0.11 -0.75 -0.01 -0.55 1.20 0.00 0.00 173.24 173.02 2gra s SER 34 N 1.65 1.60 -0.52 5.45 0.15 -1.11 -3.04 113.70 117.88 2gra s SER 34 Ca 0.49 -0.11 -0.26 0.00 0.70 0.00 0.00 55.95 56.77 2gra s SER 34 Cb -0.17 -0.48 -0.05 0.00 -1.71 0.00 0.00 66.02 63.61 2gra s SER 34 CO 0.11 -0.18 2.15 -2.16 1.20 0.00 0.00 173.24 174.36 2gra s PRO 35 N 1.89 2.41 1.45 5.44 0.04 -1.26 -4.65 135.00 140.31 2gra s PRO 35 Ca 0.04 1.10 0.00 0.00 0.04 0.00 0.00 61.00 62.18 2gra s PRO 35 Cb -0.12 -4.48 0.00 0.00 0.04 0.00 0.00 34.50 29.94 2gra s PRO 35 CO -0.05 -2.95 0.00 -0.25 0.04 0.00 0.00 177.00 173.79 2gra n ASP 36 N 14.21 0.00 -3.75 6.66 10.43 -1.26 -5.04 116.55 137.80 2gra n ASP 36 Ca 0.29 0.00 -0.09 0.00 2.57 0.00 0.00 54.79 57.56 2gra n ASP 36 Cb 0.53 0.00 -0.03 0.00 1.84 0.00 0.00 41.12 43.46 2gra n ASP 36 CO 0.00 0.00 0.00 -0.04 -1.07 0.00 0.00 177.20 176.09 2gra s MET 37 N 0.00 1.45 -0.30 -1.24 -1.94 -1.26 -5.07 119.30 110.94 2gra s MET 37 Ca 0.00 -0.88 -0.10 0.00 -1.71 0.00 0.00 55.69 53.00 2gra s MET 37 Cb 0.00 0.54 0.14 0.00 2.01 0.00 0.00 34.83 37.52 2gra s MET 37 CO 0.00 -0.63 0.70 0.34 -0.01 0.00 0.00 175.02 175.42 2gra s ASP 38 N -2.88 -1.08 0.56 3.03 3.68 -1.26 -5.01 116.67 113.71 2gra s ASP 38 Ca 0.10 1.39 0.38 0.00 2.13 0.00 0.00 52.55 56.55 2gra s ASP 38 Cb -0.02 2.19 1.52 0.00 -1.45 0.00 0.00 42.92 45.17 2gra s ASP 38 CO -0.01 -0.21 1.70 -0.07 0.13 0.00 0.00 175.17 176.71 2gra h LEU 39 N 7.93 0.00 0.00 -1.34 3.38 -1.97 -1.09 115.31 122.21 2gra h LEU 39 Ca -0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2gra h LEU 39 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2gra h LEU 39 CO 0.11 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.64 2gra n ALA 40 N -2.71 0.00 -0.00 1.53 0.00 -1.26 -3.56 120.51 114.51 2gra n ALA 40 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.73 2gra n ALA 40 Cb 1.42 0.18 -0.01 0.00 0.00 0.00 0.00 19.45 21.05 2gra n ALA 40 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2gra n THR 41 N -0.82 0.02 0.52 0.00 -2.24 -1.12 -4.23 114.28 106.42 2gra n THR 41 Ca 0.00 -0.03 0.10 0.00 -2.27 0.00 0.00 64.05 61.85 2gra n THR 41 Cb 0.00 -0.14 0.42 0.00 -2.10 0.00 0.00 70.33 68.52 2gra n THR 41 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2gra n VAL 42 N -1.74 0.79 -0.09 2.28 0.31 -0.48 -2.30 118.33 117.10 2gra n VAL 42 Ca -0.01 0.16 -0.16 0.00 -0.01 0.00 0.00 64.34 64.33 2gra n VAL 42 Cb 0.24 -0.97 -0.05 0.00 -0.91 0.00 0.00 33.84 32.14 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 -1.86 1.67 0.03 4.52 2.88 -0.77 -4.29 113.62 115.80 2gra n SER 43 Ca 0.04 0.28 0.21 0.00 -1.33 0.00 0.00 58.87 58.07 2gra n SER 43 Cb 0.24 -0.66 0.73 0.00 -0.75 0.00 0.00 64.21 63.77 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 -0.80 2.31 -0.33 -1.46 0.00 -1.65 1.17 119.26 118.51 2gra h ALA 44 Ca -0.29 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 2gra h ALA 44 Cb 1.15 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 2gra h ALA 44 CO -0.17 -0.69 0.10 1.25 0.00 0.00 0.00 179.25 179.73 2gra h LEU 45 N 0.00 0.42 0.11 0.00 6.46 -1.67 -2.63 115.31 118.00 2gra h LEU 45 Ca 0.24 -0.05 -0.00 0.00 -0.12 0.00 0.00 57.88 57.95 2gra h LEU 45 Cb 1.11 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.92 2gra h LEU 45 CO -0.00 0.41 -0.18 0.03 -0.62 0.00 0.00 178.44 178.08 2gra h ARG 46 N 0.46 -0.29 -1.45 1.25 2.47 0.12 -1.56 114.38 115.38 2gra h ARG 46 Ca 0.11 0.02 0.44 0.00 -1.26 0.00 0.00 59.98 59.30 2gra h ARG 46 Cb 0.15 0.07 -0.10 0.00 -1.65 0.00 0.00 29.97 28.44 2gra h ARG 46 CO -0.01 -0.19 0.99 -0.22 0.56 0.00 0.00 179.97 181.10 2gra h LYS 47 N -0.30 0.07 -0.92 0.04 3.64 -1.49 0.34 116.57 117.94 2gra h LYS 47 Ca -0.01 -0.00 0.24 0.00 -1.27 0.00 0.00 60.65 59.60 2gra h LYS 47 Cb 0.28 -0.02 -0.13 0.00 -0.41 0.00 0.00 32.23 31.95 2gra h LYS 47 CO -0.06 0.05 0.43 1.98 -2.27 0.00 0.00 179.45 179.57 2gra h MET 48 N 0.07 0.39 0.00 1.90 4.05 -0.94 -3.45 114.93 116.96 2gra h MET 48 Ca 0.79 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 60.19 2gra h MET 48 Cb 2.77 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 33.48 2gra h MET 48 CO -0.23 0.26 0.00 0.41 0.23 0.00 0.00 176.91 177.57 2gra n GLY 49 N -1.33 0.97 2.91 1.39 0.00 0.12 -4.97 105.19 104.28 2gra n GLY 49 Ca 0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 2gra n GLY 49 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gra s VAL 50 N -1.92 1.28 0.25 1.61 1.01 -1.24 -3.96 120.40 117.44 2gra s VAL 50 Ca 0.00 -0.86 -0.29 0.00 0.00 0.00 0.00 61.98 60.83 2gra s VAL 50 Cb 0.00 -1.49 -0.15 0.00 0.00 0.00 0.00 36.38 34.74 2gra s VAL 50 CO 0.00 0.05 0.95 0.29 0.00 0.00 0.00 175.10 176.39 2gra n LYS 51 N 4.80 1.08 -3.73 2.72 4.01 -1.26 -4.67 118.16 121.11 2gra n LYS 51 Ca -0.12 0.38 -0.38 0.00 -0.51 0.00 0.00 58.31 57.68 2gra n LYS 51 Cb 0.46 -1.70 -0.12 0.00 -0.51 0.00 0.00 35.03 33.16 2gra n LYS 51 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 2gra s LEU 52 N 0.92 4.74 -0.13 -0.35 0.20 -1.26 0.14 118.68 122.94 2gra s LEU 52 Ca 0.62 -1.48 -0.27 0.00 0.69 0.00 0.00 54.13 53.69 2gra s LEU 52 Cb -0.77 -1.87 -0.02 0.00 -0.43 0.00 0.00 46.19 43.10 2gra s LEU 52 CO 0.58 -0.44 0.88 -0.89 -0.29 0.00 0.00 176.35 176.20 2gra s THR 53 N 1.33 4.87 -1.36 3.68 2.01 -1.00 -4.90 115.64 120.26 2gra s THR 53 Ca 0.02 1.76 0.15 0.00 0.31 0.00 0.00 61.69 63.93 2gra s THR 53 Cb -0.21 -4.19 0.25 0.00 0.01 0.00 0.00 72.50 68.35 2gra s THR 53 CO 0.00 0.05 1.45 -0.81 -0.69 0.00 0.00 174.62 174.62 2gra n PRO 54 N 4.97 0.18 -4.89 4.92 -0.04 -1.26 -2.76 135.00 136.12 2gra n PRO 54 Ca 0.05 0.16 -0.28 0.00 -0.04 0.00 0.00 63.50 63.39 2gra n PRO 54 Cb 0.49 -1.50 -0.17 0.00 -0.04 0.00 0.00 33.50 32.28 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 -2.64 1.96 0.00 0.54 3.76 -1.26 -4.81 115.29 112.84 2gra s HIS 55 Ca 0.13 -0.74 -0.02 0.00 -0.15 0.00 0.00 55.06 54.28 2gra s HIS 55 Cb 0.10 -1.35 -0.10 0.00 1.11 0.00 0.00 32.58 32.34 2gra s HIS 55 CO 0.24 -0.32 1.73 0.09 -0.85 0.00 0.00 174.74 175.64 2gra n ASN 56 N 3.58 2.39 0.02 1.40 3.02 -1.26 -3.39 115.26 121.01 2gra n ASN 56 Ca -0.21 -1.89 0.00 0.00 -0.03 0.00 0.00 54.58 52.46 2gra n ASN 56 Cb 0.52 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 39.07 2gra n ASN 56 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2gra n LYS 57 N 2.59 0.00 -0.67 3.52 5.02 -1.26 -4.77 118.16 122.59 2gra n LYS 57 Ca 0.16 0.00 0.51 0.00 -2.02 0.00 0.00 58.31 56.96 2gra n LYS 57 Cb 0.38 -0.01 0.81 0.00 -0.02 0.00 0.00 35.03 36.19 2gra n LYS 57 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2gra h GLU 58 N 0.00 0.00 -0.27 1.97 5.08 -1.96 3.58 114.58 122.99 2gra h GLU 58 Ca 0.00 -0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.20 2gra h GLU 58 Cb 0.00 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2gra h GLU 58 CO 0.00 0.00 -0.46 1.15 -1.00 0.00 0.00 179.01 178.70 2gra h THR 59 N 0.00 1.29 0.00 1.13 2.02 -1.90 -3.01 112.91 112.45 2gra h THR 59 Ca 0.91 -1.66 0.00 0.00 0.77 0.00 0.00 66.41 66.43 2gra h THR 59 Cb 3.61 1.58 0.00 0.00 -1.74 0.00 0.00 68.15 71.61 2gra h THR 59 CO -0.04 0.53 0.00 0.52 0.37 0.00 0.00 175.52 176.90 2gra n VAL 60 N -4.01 0.00 -0.04 3.16 0.31 1.19 -3.73 118.33 115.21 2gra n VAL 60 Ca -0.03 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.26 2gra n VAL 60 Cb 0.57 -0.43 -0.01 0.00 -0.91 0.00 0.00 33.84 33.05 2gra n VAL 60 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2gra n GLN 61 N -0.60 0.26 0.00 5.55 3.00 -1.14 -4.50 117.38 119.96 2gra n GLN 61 Ca 0.02 0.10 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 2gra n GLN 61 Cb 0.01 -0.92 0.00 0.00 0.00 0.00 0.00 30.24 29.32 2gra n GLN 61 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.06 174.67 2gra n HIS 62 N -3.63 0.00 -2.50 1.08 1.44 -1.24 -4.77 115.22 105.60 2gra n HIS 62 Ca -0.07 0.00 -0.23 0.00 -2.01 0.00 0.00 57.72 55.41 2gra n HIS 62 Cb 0.26 -0.01 0.05 0.00 0.12 0.00 0.00 29.99 30.41 2gra n HIS 62 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 2gra s SER 63 N -1.42 5.15 0.00 4.39 0.01 -1.25 -4.31 113.70 116.28 2gra s SER 63 Ca 0.00 0.19 0.00 0.00 1.31 0.00 0.00 55.95 57.45 2gra s SER 63 Cb 0.00 -1.01 0.00 0.00 0.21 0.00 0.00 66.02 65.22 2gra s SER 63 CO 0.00 -1.28 0.00 -0.67 0.41 0.00 0.00 173.24 171.70 2gra n ASP 64 N -2.54 0.00 -3.65 2.44 4.64 -0.78 -4.79 116.55 111.87 2gra n ASP 64 Ca 0.08 -0.75 0.01 0.00 -1.38 0.00 0.00 54.79 52.74 2gra n ASP 64 Cb 0.60 0.00 -0.06 0.00 -1.04 0.00 0.00 41.12 40.61 2gra n ASP 64 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 2gra s VAL 65 N 0.00 0.00 -0.07 5.18 0.11 -0.99 -3.80 120.40 120.83 2gra s VAL 65 Ca 0.00 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.07 2gra s VAL 65 Cb 0.00 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.86 2gra s VAL 65 CO 0.00 0.00 -0.13 -0.22 -3.33 0.00 0.00 175.10 171.42 2gra s LEU 66 N 0.78 1.66 -0.82 2.54 0.20 -0.93 -1.27 118.68 120.84 2gra s LEU 66 Ca -0.04 -0.32 -0.19 0.00 0.69 0.00 0.00 54.13 54.27 2gra s LEU 66 Cb -0.03 -0.86 0.12 0.00 -0.43 0.00 0.00 46.19 44.99 2gra s LEU 66 CO -0.12 0.04 1.00 -0.36 -0.29 0.00 0.00 176.35 176.63 2gra s PHE 67 N 0.68 3.05 -1.00 5.38 0.40 -0.20 -2.32 117.98 123.98 2gra s PHE 67 Ca -0.14 -1.19 -0.24 0.00 -0.60 0.00 0.00 56.93 54.75 2gra s PHE 67 Cb -0.16 -4.21 -0.07 0.00 0.51 0.00 0.00 43.02 39.09 2gra s PHE 67 CO 0.04 -1.46 1.98 -1.17 0.70 0.00 0.00 175.22 175.31 2gra s LEU 68 N 2.79 3.08 -0.85 -0.37 2.96 -1.26 -4.03 118.68 120.99 2gra s LEU 68 Ca 0.26 -0.97 -0.06 0.00 -0.22 0.00 0.00 54.13 53.14 2gra s LEU 68 Cb -0.11 -2.57 0.22 0.00 0.50 0.00 0.00 46.19 44.23 2gra s LEU 68 CO -0.03 -3.01 0.75 0.00 -1.32 0.00 0.00 176.35 172.74 2gra s ALA 69 N 10.97 4.14 0.06 5.97 0.00 -1.26 -3.87 121.76 137.77 2gra s ALA 69 Ca 0.71 -3.59 0.01 0.00 0.00 0.00 0.00 51.96 49.09 2gra s ALA 69 Cb -0.05 -3.07 -0.03 0.00 0.00 0.00 0.00 23.12 19.96 2gra s ALA 69 CO 0.05 -2.18 -0.05 0.08 0.00 0.00 0.00 175.76 173.66 2gra s VAL 70 N -0.69 0.45 0.23 0.00 1.01 -1.26 -3.83 120.40 116.30 2gra s VAL 70 Ca 0.23 -1.53 -0.30 0.00 0.00 0.00 0.00 61.98 60.38 2gra s VAL 70 Cb -0.12 -1.15 -0.15 0.00 0.00 0.00 0.00 36.38 34.97 2gra s VAL 70 CO -0.09 -0.72 1.12 0.29 0.00 0.00 0.00 175.10 175.70 2gra n LYS 71 N 0.64 1.33 -0.33 2.72 4.01 -1.26 -4.50 118.16 120.76 2gra n LYS 71 Ca -0.17 0.47 0.25 0.00 -0.51 0.00 0.00 58.31 58.35 2gra n LYS 71 Cb 0.58 -1.92 0.49 0.00 -0.51 0.00 0.00 35.03 33.67 2gra n LYS 71 CO 0.00 0.00 0.00 -1.35 -1.11 0.00 0.00 177.40 174.94 2gra h PRO 72 N 2.83 0.20 0.00 1.97 0.11 -1.90 0.73 132.00 135.95 2gra h PRO 72 Ca -0.42 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2gra h PRO 72 Cb 1.34 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2gra h PRO 72 CO 0.66 0.14 0.00 -2.39 -0.21 0.00 0.00 178.00 176.20 2gra n HIS 73 N -5.14 0.00 0.00 0.65 1.44 -1.26 -2.83 115.22 108.07 2gra n HIS 73 Ca 0.33 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 56.04 2gra n HIS 73 Cb 1.04 0.00 0.00 0.00 0.12 0.00 0.00 29.99 31.15 2gra n HIS 73 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 2gra n ILE 74 N -0.63 0.00 -0.38 0.61 2.08 0.25 -4.74 119.36 116.55 2gra n ILE 74 Ca 0.04 0.00 0.31 0.00 0.56 0.00 0.00 62.75 63.65 2gra n ILE 74 Cb 0.02 -0.12 0.60 0.00 -0.75 0.00 0.00 39.64 39.39 2gra n ILE 74 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 2gra h ILE 75 N 0.00 0.33 0.44 1.39 1.08 -1.23 -2.16 117.51 117.36 2gra h ILE 75 Ca 0.00 -0.07 -0.02 0.00 -0.39 0.00 0.00 64.86 64.37 2gra h ILE 75 Cb 0.28 0.09 0.00 0.00 -3.07 0.00 0.00 36.82 34.13 2gra h ILE 75 CO 0.00 0.04 -0.21 -0.65 -0.69 0.00 0.00 178.15 176.64 2gra h PRO 76 N 0.22 -0.57 -0.82 2.37 0.11 -1.85 -1.66 132.00 129.79 2gra h PRO 76 Ca 0.70 0.04 0.17 0.00 0.11 0.00 0.00 66.00 67.01 2gra h PRO 76 Cb 2.08 0.13 -0.16 0.00 0.11 0.00 0.00 31.00 33.16 2gra h PRO 76 CO -0.32 -0.38 -0.20 1.19 -0.21 0.00 0.00 178.00 178.08 2gra n PHE 77 N -3.85 0.30 0.24 0.65 3.01 -0.83 -0.82 117.46 116.16 2gra n PHE 77 Ca -0.07 1.00 -0.15 0.00 1.01 0.00 0.00 57.45 59.24 2gra n PHE 77 Cb 0.23 -0.98 -0.08 0.00 -0.01 0.00 0.00 39.48 38.64 2gra n PHE 77 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 2gra h ILE 78 N 0.00 0.56 -1.10 4.37 1.08 -1.52 -2.79 117.51 118.10 2gra h ILE 78 Ca 0.40 -0.26 0.32 0.00 -0.39 0.00 0.00 64.86 64.92 2gra h ILE 78 Cb 0.61 0.68 -0.05 0.00 -3.07 0.00 0.00 36.82 34.99 2gra h ILE 78 CO -0.84 0.05 0.79 -0.07 -0.69 0.00 0.00 178.15 177.38 2gra h LEU 79 N -0.74 0.03 -0.11 1.44 3.38 0.02 0.70 115.31 120.03 2gra h LEU 79 Ca -0.06 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 2gra h LEU 79 Cb 0.53 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 2gra h LEU 79 CO 0.10 0.01 -0.15 0.44 0.09 0.00 0.00 178.44 178.93 2gra h ASP 80 N 0.03 0.33 -0.67 -0.43 3.45 -1.22 0.25 116.42 118.16 2gra h ASP 80 Ca 0.53 -0.51 0.02 0.00 0.43 0.00 0.00 57.03 57.50 2gra h ASP 80 Cb 2.07 -0.09 -0.04 0.00 -0.56 0.00 0.00 39.33 40.71 2gra h ASP 80 CO -0.03 0.77 0.43 -0.08 -1.57 0.00 0.00 179.24 178.77 2gra h GLU 81 N -0.11 0.83 -0.27 3.56 4.81 0.59 -2.83 114.58 121.16 2gra h GLU 81 Ca 0.01 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2gra h GLU 81 Cb 0.70 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.89 2gra h GLU 81 CO 0.04 0.55 0.00 -0.89 -0.73 0.00 0.00 179.01 177.98 2gra n ILE 82 N -4.66 0.34 -0.03 2.32 2.08 -0.16 -4.35 119.36 114.91 2gra n ILE 82 Ca 0.06 -0.66 -0.08 0.00 0.56 0.00 0.00 62.75 62.63 2gra n ILE 82 Cb 0.06 1.12 -0.02 0.00 -0.75 0.00 0.00 39.64 40.05 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 4.61 -0.05 1.54 7.39 0.00 -0.22 0.12 103.07 116.45 2gra h GLY 83 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.54 2gra h GLY 83 CO 0.00 -0.17 -0.27 0.00 0.00 0.00 0.00 176.54 176.10 2gra n ALA 84 N -2.67 2.80 -0.43 3.60 0.00 -1.26 -3.62 120.51 118.94 2gra n ALA 84 Ca -0.01 -0.19 -0.14 0.00 0.00 0.00 0.00 53.44 53.10 2gra n ALA 84 Cb 0.24 -1.31 0.07 0.00 0.00 0.00 0.00 19.45 18.45 2gra n ALA 84 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2gra n ASP 85 N -1.75 4.70 -4.87 0.00 10.43 0.01 -4.90 116.55 120.16 2gra n ASP 85 Ca 0.06 -2.90 -0.22 0.00 2.57 0.00 0.00 54.79 54.30 2gra n ASP 85 Cb 0.37 -0.83 -0.04 0.00 1.84 0.00 0.00 41.12 42.47 2gra n ASP 85 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 2gra s ILE 86 N -1.90 4.74 0.07 0.53 1.01 -1.07 -4.92 121.20 119.66 2gra s ILE 86 Ca 0.29 -1.24 -0.01 0.00 0.00 0.00 0.00 60.65 59.69 2gra s ILE 86 Cb 0.24 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 39.15 2gra s ILE 86 CO 0.03 -0.33 0.10 -0.62 0.00 0.00 0.00 174.94 174.12 2gra n GLU 87 N -1.22 0.15 -0.04 2.79 1.02 -1.26 -5.01 120.64 117.07 2gra n GLU 87 Ca -0.08 -0.50 -0.04 0.00 -0.02 0.00 0.00 57.16 56.52 2gra n GLU 87 Cb 0.57 0.51 -0.14 0.00 -0.02 0.00 0.00 31.44 32.36 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 -1.83 0.32 0.05 1.62 10.43 -1.26 -4.40 116.55 121.49 2gra n ASP 88 Ca -0.00 0.15 -0.03 0.00 2.57 0.00 0.00 54.79 57.47 2gra n ASP 88 Cb 0.11 0.82 0.21 0.00 1.84 0.00 0.00 41.12 44.10 2gra n ASP 88 CO 0.00 0.00 0.00 0.08 -1.07 0.00 0.00 177.20 176.21 2gra h ARG 89 N 0.00 0.37 -6.08 -1.24 -0.00 -1.97 -3.45 114.38 102.01 2gra h ARG 89 Ca -0.33 -0.16 -0.62 0.00 -0.00 0.00 0.00 59.98 58.87 2gra h ARG 89 Cb 1.86 -0.01 -0.07 0.00 -0.00 0.00 0.00 29.97 31.75 2gra h ARG 89 CO 0.04 0.67 -0.56 -3.38 -0.00 0.00 0.00 179.97 176.74 2gra s HIS 90 N -4.33 3.32 -0.03 4.08 -3.43 -1.26 -4.64 115.29 109.00 2gra s HIS 90 Ca -0.06 0.13 0.05 0.00 -0.80 0.00 0.00 55.06 54.39 2gra s HIS 90 Cb 0.13 -1.67 -0.01 0.00 -1.43 0.00 0.00 32.58 29.61 2gra s HIS 90 CO 0.78 0.55 -0.19 0.42 -2.00 0.00 0.00 174.74 174.29 2gra s ILE 91 N -1.47 1.58 -0.43 -5.38 1.01 -1.25 -4.74 121.20 110.52 2gra s ILE 91 Ca 0.32 -0.82 -0.23 0.00 0.00 0.00 0.00 60.65 59.91 2gra s ILE 91 Cb -0.12 -1.33 0.02 0.00 0.01 0.00 0.00 42.46 41.04 2gra s ILE 91 CO 0.25 0.45 0.79 -0.69 0.00 0.00 0.00 174.94 175.73 2gra s VAL 92 N -0.20 4.66 -0.88 2.92 1.01 -0.83 -2.19 120.40 124.89 2gra s VAL 92 Ca 0.01 0.55 0.01 0.00 0.00 0.00 0.00 61.98 62.55 2gra s VAL 92 Cb -0.10 -4.30 0.32 0.00 0.00 0.00 0.00 36.38 32.30 2gra s VAL 92 CO 0.01 -0.66 1.45 1.33 0.00 0.00 0.00 175.10 177.23 2gra n VAL 93 N 6.07 4.87 -2.42 2.92 0.24 -0.98 -2.22 118.33 126.82 2gra n VAL 93 Ca 0.03 -5.81 -0.42 0.00 -2.04 0.00 0.00 64.34 56.09 2gra n VAL 93 Cb 0.48 -1.62 -0.03 0.00 -1.47 0.00 0.00 33.84 31.20 2gra n VAL 93 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2gra s SER 94 N -2.10 7.01 -0.41 -1.34 0.15 -1.25 -4.22 113.70 111.54 2gra s SER 94 Ca 0.41 1.84 0.04 0.00 0.70 0.00 0.00 55.95 58.94 2gra s SER 94 Cb 0.19 -2.56 0.11 0.00 -1.71 0.00 0.00 66.02 62.06 2gra s SER 94 CO -0.09 -0.63 0.14 0.00 1.20 0.00 0.00 173.24 173.86 2gra s ALA 96 N 0.46 -1.48 1.01 0.00 0.00 -1.25 -4.77 121.76 115.72 2gra s ALA 96 Ca 0.14 0.38 -0.16 0.00 0.00 0.00 0.00 51.96 52.32 2gra s ALA 96 Cb -0.22 -2.20 0.00 0.00 0.00 0.00 0.00 23.12 20.70 2gra s ALA 96 CO -0.06 -1.79 -0.07 0.00 0.00 0.00 0.00 175.76 173.84 2gra n ALA 97 N 5.34 -3.78 -1.06 0.00 0.00 -1.26 -2.85 120.51 116.90 2gra n ALA 97 Ca 0.02 -0.86 -0.02 0.00 0.00 0.00 0.00 53.44 52.58 2gra n ALA 97 Cb 0.50 -1.53 -0.01 0.00 0.00 0.00 0.00 19.45 18.42 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 2.15 0.42 2.74 0.00 0.00 -1.26 -4.64 105.19 104.59 2gra n GLY 98 Ca 0.03 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.64 1.09 1.20 1.61 1.01 -1.13 -3.05 120.40 119.49 2gra s VAL 99 Ca 0.00 -1.76 -0.16 0.00 0.00 0.00 0.00 61.98 60.06 2gra s VAL 99 Cb 0.00 -1.81 0.25 0.00 0.00 0.00 0.00 36.38 34.82 2gra s VAL 99 CO 0.00 -0.73 0.69 0.41 0.00 0.00 0.00 175.10 175.47 2gra n THR 100 N 4.46 0.00 -0.03 3.92 -1.04 -1.26 -4.89 114.28 115.45 2gra n THR 100 Ca 0.01 -0.40 -0.21 0.00 -2.04 0.00 0.00 64.05 61.41 2gra n THR 100 Cb 0.40 -0.87 -0.13 0.00 -1.82 0.00 0.00 70.33 67.91 2gra n THR 100 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 2gra h ILE 101 N -2.65 0.89 -0.20 12.58 6.09 -2.00 -3.33 117.51 128.90 2gra h ILE 101 Ca -0.59 -2.32 -0.00 0.00 -1.37 0.00 0.00 64.86 60.59 2gra h ILE 101 Cb 1.33 2.52 -0.01 0.00 0.47 0.00 0.00 36.82 41.13 2gra h ILE 101 CO 0.44 0.65 0.12 0.28 -3.07 0.00 0.00 178.15 176.56 2gra h SER 102 N -0.41 0.23 -0.46 2.19 0.02 -1.96 0.20 113.55 113.36 2gra h SER 102 Ca -0.35 -0.01 0.06 0.00 -0.84 0.00 0.00 61.79 60.65 2gra h SER 102 Cb 1.70 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 64.13 2gra h SER 102 CO -0.01 0.18 0.18 -1.28 -1.14 0.00 0.00 176.83 174.76 2gra h SER 103 N 0.27 0.20 0.00 3.07 0.87 -1.92 0.12 113.55 116.17 2gra h SER 103 Ca 0.07 0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.68 2gra h SER 103 Cb -0.00 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 2gra h SER 103 CO -0.01 0.15 -0.00 0.40 -0.53 0.00 0.00 176.83 176.83 2gra h ILE 104 N 0.36 1.66 -0.03 2.23 2.04 -1.31 -3.27 117.51 119.19 2gra h ILE 104 Ca 0.22 -1.97 0.01 0.00 1.00 0.00 0.00 64.86 64.11 2gra h ILE 104 Cb 0.20 2.99 -0.00 0.00 -0.74 0.00 0.00 36.82 39.27 2gra h ILE 104 CO -0.21 0.51 0.10 -0.33 0.00 0.00 0.00 178.15 178.23 2gra h GLU 105 N -0.85 0.00 -1.83 2.37 5.08 -0.57 -0.74 114.58 118.04 2gra h GLU 105 Ca -0.00 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.68 2gra h GLU 105 Cb 0.84 0.00 -0.35 0.00 0.50 0.00 0.00 28.75 29.74 2gra h GLU 105 CO 0.00 0.00 0.17 1.63 -1.00 0.00 0.00 179.01 179.81 2gra n LYS 106 N -3.23 3.28 0.00 2.33 5.02 0.41 -3.51 118.16 122.45 2gra n LYS 106 Ca -0.02 -4.13 0.00 0.00 -2.02 0.00 0.00 58.31 52.14 2gra n LYS 106 Cb 0.18 -2.27 0.00 0.00 -0.02 0.00 0.00 35.03 32.92 2gra n LYS 106 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2gra n LYS 107 N -0.46 0.00 0.11 1.97 4.81 -0.71 -4.91 118.16 118.97 2gra n LYS 107 Ca 0.45 0.00 -0.21 0.00 -0.87 0.00 0.00 58.31 57.69 2gra n LYS 107 Cb 0.43 0.00 -0.15 0.00 0.02 0.00 0.00 35.03 35.33 2gra n LYS 107 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 2gra h LEU 108 N 0.00 0.61 -0.71 3.14 3.38 -1.38 -3.05 115.31 117.30 2gra h LEU 108 Ca 0.00 -0.73 0.00 0.00 0.09 0.00 0.00 57.88 57.24 2gra h LEU 108 Cb 0.00 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.55 2gra h LEU 108 CO 0.00 1.59 0.00 -1.20 0.09 0.00 0.00 178.44 178.92 2gra n SER 109 N -3.59 0.38 0.00 -0.43 7.64 -1.23 -0.07 113.62 116.32 2gra n SER 109 Ca -0.16 0.64 0.08 0.00 1.01 0.00 0.00 58.87 60.43 2gra n SER 109 Cb 1.07 -0.70 0.37 0.00 -1.01 0.00 0.00 64.21 63.94 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 -1.67 1.81 -1.59 -0.43 0.00 -1.15 -4.20 120.51 113.27 2gra n ALA 110 Ca 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2gra n ALA 110 Cb 0.10 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.29 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 -1.38 0.00 -0.90 0.00 3.01 0.90 -5.08 117.46 114.01 2gra n PHE 111 Ca 0.06 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.21 2gra n PHE 111 Cb 0.15 0.00 0.14 0.00 -0.01 0.00 0.00 39.48 39.76 2gra n PHE 111 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 2gra s ARG 112 N 0.00 1.46 0.00 -1.08 6.06 -1.07 -5.00 118.95 119.33 2gra s ARG 112 Ca 0.00 1.42 0.00 0.00 -2.50 0.00 0.00 55.73 54.65 2gra s ARG 112 Cb 0.00 -1.79 0.00 0.00 0.06 0.00 0.00 34.95 33.22 2gra s ARG 112 CO 0.00 -2.28 0.48 -2.30 -2.50 0.00 0.00 175.30 168.70 2gra n PRO 113 N -3.96 0.00 -3.57 5.12 -0.02 -1.26 -4.46 135.00 126.84 2gra n PRO 113 Ca 0.11 0.17 -0.28 0.00 -2.02 0.00 0.00 63.50 61.48 2gra n PRO 113 Cb 0.52 -0.98 -0.11 0.00 -0.02 0.00 0.00 33.50 32.91 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 -2.35 1.88 0.26 3.55 0.00 -1.26 -4.84 121.76 119.00 2gra s ALA 114 Ca 0.00 -2.60 -0.30 0.00 0.00 0.00 0.00 51.96 49.06 2gra s ALA 114 Cb 0.00 -1.76 -0.10 0.00 0.00 0.00 0.00 23.12 21.26 2gra s ALA 114 CO 0.00 -2.04 1.48 -1.25 0.00 0.00 0.00 175.76 173.95 2gra s PRO 115 N 0.08 4.23 -0.44 0.00 0.04 -1.26 -4.93 135.00 132.72 2gra s PRO 115 Ca 0.25 2.37 -0.27 0.00 0.04 0.00 0.00 61.00 63.39 2gra s PRO 115 Cb -0.10 -3.09 0.03 0.00 0.04 0.00 0.00 34.50 31.38 2gra s PRO 115 CO -0.10 -0.48 1.03 1.03 0.04 0.00 0.00 177.00 178.52 2gra s ARG 116 N -0.38 3.71 -0.03 4.56 0.52 -1.26 -4.55 118.95 121.52 2gra s ARG 116 Ca 0.60 0.48 0.03 0.00 -0.52 0.00 0.00 55.73 56.32 2gra s ARG 116 Cb -0.43 -3.88 0.00 0.00 0.52 0.00 0.00 34.95 31.16 2gra s ARG 116 CO 0.44 -1.22 -0.11 0.08 0.02 0.00 0.00 175.30 174.52 2gra s VAL 117 N 3.99 0.95 -0.17 3.52 1.01 -1.23 -1.96 120.40 126.51 2gra s VAL 117 Ca 0.42 -0.45 -0.04 0.00 0.00 0.00 0.00 61.98 61.91 2gra s VAL 117 Cb -0.09 -0.84 0.06 0.00 0.00 0.00 0.00 36.38 35.51 2gra s VAL 117 CO 0.26 0.29 0.07 0.27 0.00 0.00 0.00 175.10 176.00 2gra s ILE 118 N 0.18 0.09 1.16 2.22 -4.36 -0.94 -2.21 121.20 117.34 2gra s ILE 118 Ca -0.04 -0.25 -0.13 0.00 -0.26 0.00 0.00 60.65 59.98 2gra s ILE 118 Cb -0.10 -0.69 0.28 0.00 1.25 0.00 0.00 42.46 43.21 2gra s ILE 118 CO 0.01 -0.23 1.03 -0.60 0.24 0.00 0.00 174.94 175.39 2gra s ARG 119 N 2.06 -0.86 -0.18 0.37 3.52 -1.14 -3.79 118.95 118.93 2gra s ARG 119 Ca 0.01 0.86 -0.30 0.00 -0.13 0.00 0.00 55.73 56.18 2gra s ARG 119 Cb -0.16 -1.56 0.13 0.00 -1.56 0.00 0.00 34.95 31.80 2gra s ARG 119 CO -0.08 -3.69 1.03 0.00 -0.81 0.00 0.00 175.30 171.74 2gra s MET 121 N -1.01 1.27 0.23 0.00 1.75 0.31 -3.92 119.30 117.92 2gra s MET 121 Ca -0.01 -0.41 -0.12 0.00 -1.25 0.00 0.00 55.69 53.90 2gra s MET 121 Cb -0.01 -1.14 -0.00 0.00 2.84 0.00 0.00 34.83 36.52 2gra s MET 121 CO 0.00 0.15 0.45 0.95 -0.65 0.00 0.00 175.02 175.92 2gra s THR 122 N 0.18 0.01 0.48 10.11 -4.23 -1.26 -0.46 115.64 120.47 2gra s THR 122 Ca -0.04 -1.37 0.05 0.00 -1.18 0.00 0.00 61.69 59.15 2gra s THR 122 Cb -0.10 -2.12 -0.02 0.00 1.34 0.00 0.00 72.50 71.60 2gra s THR 122 CO 0.01 -0.04 0.18 0.54 -0.54 0.00 0.00 174.62 174.77 2gra s ASN 123 N -3.00 4.36 0.05 3.99 2.20 -1.21 -4.91 114.94 116.42 2gra s ASN 123 Ca 0.21 -1.31 -0.23 0.00 -0.94 0.00 0.00 52.86 50.59 2gra s ASN 123 Cb -0.00 0.06 -0.16 0.00 -2.00 0.00 0.00 41.25 39.15 2gra s ASN 123 CO 0.07 -0.78 1.54 0.74 -2.94 0.00 0.00 177.10 175.73 2gra h THR 124 N 1.24 1.18 0.00 0.54 2.02 -1.93 -3.07 112.91 112.89 2gra h THR 124 Ca -0.42 -0.55 0.00 0.00 0.77 0.00 0.00 66.41 66.22 2gra h THR 124 Cb 1.28 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 69.16 2gra h THR 124 CO 0.68 0.15 0.37 -0.81 0.37 0.00 0.00 175.52 176.28 2gra n PRO 125 N -4.94 0.00 0.00 6.66 -0.04 -1.26 -0.07 135.00 135.35 2gra n PRO 125 Ca -0.07 0.09 0.01 0.00 -0.04 0.00 0.00 63.50 63.49 2gra n PRO 125 Cb 0.14 -1.87 0.04 0.00 -0.04 0.00 0.00 33.50 31.77 2gra n PRO 125 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2gra n VAL 126 N -1.05 1.59 0.69 0.52 0.24 -1.12 0.74 118.33 119.95 2gra n VAL 126 Ca 0.00 0.40 0.06 0.00 -2.04 0.00 0.00 64.34 62.76 2gra n VAL 126 Cb 0.37 -1.37 0.34 0.00 -1.47 0.00 0.00 33.84 31.70 2gra n VAL 126 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 2gra n VAL 127 N -1.42 0.19 -4.14 3.34 0.31 0.90 -4.50 118.33 113.01 2gra n VAL 127 Ca 0.01 0.05 -0.09 0.00 -0.01 0.00 0.00 64.34 64.29 2gra n VAL 127 Cb 0.02 -0.86 -0.10 0.00 -0.91 0.00 0.00 33.84 31.99 2gra n VAL 127 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2gra s VAL 128 N -2.15 0.26 -1.97 2.52 1.01 0.23 -4.75 120.40 115.55 2gra s VAL 128 Ca 0.16 -1.88 0.00 0.00 0.00 0.00 0.00 61.98 60.26 2gra s VAL 128 Cb 0.08 -1.82 0.00 0.00 0.00 0.00 0.00 36.38 34.64 2gra s VAL 128 CO 0.15 -0.71 0.02 -2.11 0.00 0.00 0.00 175.10 172.46 2gra n ARG 129 N -0.03 0.00 -3.80 2.72 1.85 -1.26 -4.09 116.66 112.05 2gra n ARG 129 Ca -0.09 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.40 2gra n ARG 129 Cb 0.62 -1.02 -0.12 0.00 -1.05 0.00 0.00 32.46 30.89 2gra n ARG 129 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 2gra s GLU 130 N -1.97 1.94 -0.28 2.89 0.41 -1.25 -1.29 118.70 119.15 2gra s GLU 130 Ca 0.00 -1.83 -0.21 0.00 -0.41 0.00 0.00 54.97 52.52 2gra s GLU 130 Cb 0.00 -3.54 0.08 0.00 -1.78 0.00 0.00 34.13 28.89 2gra s GLU 130 CO 0.00 -1.06 0.73 0.20 -0.49 0.00 0.00 175.26 174.65 2gra s GLY 131 N 1.72 -0.54 -0.24 -1.39 0.00 -0.97 -2.78 107.32 103.12 2gra s GLY 131 Ca 0.09 2.28 -0.21 0.00 0.00 0.00 0.00 44.72 46.87 2gra s GLY 131 CO -0.05 2.07 0.66 0.00 0.00 0.00 0.00 173.10 175.78 2gra s ALA 132 N 0.94 3.61 -0.07 3.20 0.00 -1.26 -0.91 121.76 127.27 2gra s ALA 132 Ca -0.04 -0.37 0.02 0.00 0.00 0.00 0.00 51.96 51.57 2gra s ALA 132 Cb -0.05 -3.06 0.01 0.00 0.00 0.00 0.00 23.12 20.02 2gra s ALA 132 CO -0.09 -0.79 -0.14 0.95 0.00 0.00 0.00 175.76 175.69 2gra s THR 133 N 2.47 1.27 0.01 0.00 -4.23 0.12 -3.33 115.64 111.95 2gra s THR 133 Ca 0.28 -0.55 0.04 0.00 -1.18 0.00 0.00 61.69 60.28 2gra s THR 133 Cb -0.15 -1.15 -0.01 0.00 1.34 0.00 0.00 72.50 72.52 2gra s THR 133 CO 0.09 0.39 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.74 2gra s VAL 134 N 0.66 0.97 0.15 2.29 1.01 0.40 -2.95 120.40 122.92 2gra s VAL 134 Ca -0.14 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.15 2gra s VAL 134 Cb -0.16 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 2gra s VAL 134 CO 0.04 0.14 0.00 -0.72 0.00 0.00 0.00 175.10 174.56 2gra s TYR 135 N -0.52 1.08 -0.04 5.22 -0.85 -1.13 -0.53 117.35 120.57 2gra s TYR 135 Ca 0.03 -1.05 -0.02 0.00 -0.52 0.00 0.00 57.07 55.52 2gra s TYR 135 Cb -0.06 -0.62 0.03 0.00 0.38 0.00 0.00 41.96 41.69 2gra s TYR 135 CO 0.00 -0.26 0.08 0.00 -1.52 0.00 0.00 175.55 173.85 2gra s ALA 136 N -3.73 -0.11 -0.31 9.51 0.00 -1.05 -2.22 121.76 123.84 2gra s ALA 136 Ca 0.22 0.44 -0.19 0.00 0.00 0.00 0.00 51.96 52.42 2gra s ALA 136 Cb 0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.87 2gra s ALA 136 CO 0.02 -0.11 0.58 0.95 0.00 0.00 0.00 175.76 177.19 2gra s THR 137 N 0.91 4.97 -0.18 0.00 -4.23 -1.26 -2.87 115.64 112.99 2gra s THR 137 Ca -0.07 0.70 -0.08 0.00 -1.18 0.00 0.00 61.69 61.06 2gra s THR 137 Cb -0.10 -3.97 -0.04 0.00 1.34 0.00 0.00 72.50 69.73 2gra s THR 137 CO -0.04 -0.14 0.08 -0.83 -0.54 0.00 0.00 174.62 173.15 2gra s GLY 138 N 1.68 1.95 0.00 3.99 0.00 -0.94 -4.98 107.32 109.02 2gra s GLY 138 Ca 0.23 -0.73 0.00 0.00 0.00 0.00 0.00 44.72 44.22 2gra s GLY 138 CO 0.12 0.02 0.00 -1.30 0.00 0.00 0.00 173.10 171.94 2gra n THR 139 N 3.37 0.00 -0.98 0.90 -2.24 -1.26 -3.74 114.28 110.33 2gra n THR 139 Ca -0.17 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.19 2gra n THR 139 Cb 0.52 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.67 2gra n THR 139 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2gra n HIS 140 N 0.00 1.19 -3.66 4.78 8.25 -1.26 -4.76 115.22 119.76 2gra n HIS 140 Ca 0.00 -1.23 -0.05 0.00 -0.26 0.00 0.00 57.72 56.18 2gra n HIS 140 Cb 0.00 -1.45 -0.07 0.00 1.12 0.00 0.00 29.99 29.59 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 6.65 -1.64 0.71 -1.41 0.00 -1.25 -3.51 121.76 121.32 2gra s ALA 141 Ca 0.63 2.02 -0.04 0.00 0.00 0.00 0.00 51.96 54.57 2gra s ALA 141 Cb 0.13 -1.48 0.10 0.00 0.00 0.00 0.00 23.12 21.86 2gra s ALA 141 CO 0.21 -0.70 1.00 -0.65 0.00 0.00 0.00 175.76 175.61 2gra s GLN 142 N 2.42 1.86 0.00 0.00 -0.21 -1.26 -4.92 119.66 117.55 2gra s GLN 142 Ca -0.06 -0.73 0.05 0.00 0.02 0.00 0.00 55.36 54.64 2gra s GLN 142 Cb -0.10 -2.26 0.32 0.00 1.00 0.00 0.00 33.01 31.97 2gra s GLN 142 CO -0.17 -1.36 0.75 0.28 -2.12 0.00 0.00 175.29 172.67 2gra n VAL 143 N -2.87 0.00 -0.00 1.09 0.31 -1.26 -1.02 118.33 114.58 2gra n VAL 143 Ca 0.12 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.48 2gra n VAL 143 Cb 0.60 -0.84 -0.05 0.00 -0.91 0.00 0.00 33.84 32.64 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 -0.94 0.23 0.22 5.55 1.02 -1.26 -4.24 120.64 121.23 2gra n GLU 144 Ca 0.04 -0.06 0.15 0.00 -0.02 0.00 0.00 57.16 57.28 2gra n GLU 144 Cb 0.02 -1.15 0.68 0.00 -0.02 0.00 0.00 31.44 30.96 2gra n GLU 144 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2gra h ASP 145 N 0.00 0.00 0.02 1.62 3.45 -1.43 -2.96 116.42 117.12 2gra h ASP 145 Ca 0.00 0.00 -0.31 0.00 0.43 0.00 0.00 57.03 57.15 2gra h ASP 145 Cb 0.29 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.02 2gra h ASP 145 CO 0.00 0.00 -1.69 0.61 -1.57 0.00 0.00 179.24 176.59 2gra n GLY 146 N -0.25 -0.70 0.26 2.75 0.00 -1.24 -4.39 105.19 101.63 2gra n GLY 146 Ca 0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 2gra n GLY 146 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2gra h ARG 147 N -0.78 -0.11 -0.93 1.61 2.43 -1.70 -1.65 114.38 113.25 2gra h ARG 147 Ca -0.44 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 58.92 2gra h ARG 147 Cb 1.51 0.03 -0.18 0.00 -0.42 0.00 0.00 29.97 30.91 2gra h ARG 147 CO -0.20 -0.08 -0.24 1.25 -1.51 0.00 0.00 179.97 179.19 2gra h LEU 148 N -0.12 -0.90 0.15 3.80 5.85 -1.78 -2.31 115.31 120.00 2gra h LEU 148 Ca 0.07 0.28 0.00 0.00 0.84 0.00 0.00 57.88 59.07 2gra h LEU 148 Cb 0.30 0.59 -0.02 0.00 0.37 0.00 0.00 40.66 41.90 2gra h LEU 148 CO -0.47 -0.31 -0.28 0.24 -0.34 0.00 0.00 178.44 177.28 2gra h MET 149 N -0.00 -0.45 -1.89 1.25 2.86 -1.51 0.40 114.93 115.59 2gra h MET 149 Ca 0.44 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 58.11 2gra h MET 149 Cb 0.67 0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.43 2gra h MET 149 CO -0.96 -0.30 0.00 0.39 1.06 0.00 0.00 176.91 177.11 2gra n GLU 150 N -4.05 0.15 0.00 1.72 1.02 -0.87 0.80 120.64 119.42 2gra n GLU 150 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 2gra n GLU 150 Cb 0.23 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.23 2gra n GLU 150 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2gra n GLN 151 N 1.21 0.00 0.35 3.49 6.02 -1.10 -4.51 117.38 122.84 2gra n GLN 151 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.82 2gra n GLN 151 Cb 0.08 -0.19 -0.09 0.00 1.02 0.00 0.00 30.24 31.06 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 0.00 -0.74 0.00 1.08 5.85 0.49 -3.22 115.31 118.77 2gra h LEU 152 Ca 0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 2gra h LEU 152 Cb 0.00 0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.22 2gra h LEU 152 CO 0.00 -0.46 -1.49 0.18 -0.34 0.00 0.00 178.44 176.34 2gra n LEU 153 N -5.43 0.41 0.00 2.25 4.77 0.26 -3.89 117.00 115.37 2gra n LEU 153 Ca -0.13 -0.04 0.03 0.00 -0.03 0.00 0.00 56.01 55.84 2gra n LEU 153 Cb 0.37 -0.03 0.16 0.00 -2.33 0.00 0.00 43.42 41.59 2gra n LEU 153 CO 0.35 0.02 0.35 -0.24 -1.33 0.00 0.00 177.39 176.55 2gra n SER 154 N -2.13 0.00 -0.96 -1.43 2.88 -1.22 -0.67 113.62 110.09 2gra n SER 154 Ca -0.01 -0.51 0.08 0.00 -1.33 0.00 0.00 58.87 57.09 2gra n SER 154 Cb 0.50 0.00 0.23 0.00 -0.75 0.00 0.00 64.21 64.19 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 -0.75 3.54 -2.75 -3.46 3.41 -1.22 -4.46 113.62 107.95 2gra n SER 155 Ca 0.04 -2.21 -0.04 0.00 -0.26 0.00 0.00 58.87 56.40 2gra n SER 155 Cb 0.02 -0.38 0.05 0.00 -0.26 0.00 0.00 64.21 63.64 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 0.67 0.99 0.00 -3.33 0.31 0.15 -4.84 118.33 112.28 2gra n VAL 156 Ca 0.18 -2.75 0.00 0.00 -0.01 0.00 0.00 64.34 61.76 2gra n VAL 156 Cb 0.60 1.02 0.00 0.00 -0.91 0.00 0.00 33.84 34.55 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 -0.46 -0.03 3.75 2.92 0.00 -0.41 -2.29 105.19 108.67 2gra n GLY 157 Ca 0.05 -2.28 -0.34 0.00 0.00 0.00 0.00 46.02 43.45 2gra n GLY 157 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2gra s PHE 158 N -0.26 2.36 -0.28 1.61 5.36 -0.09 -4.56 117.98 122.12 2gra s PHE 158 Ca 0.00 1.56 -0.20 0.00 -0.96 0.00 0.00 56.93 57.34 2gra s PHE 158 Cb 0.00 -3.35 0.10 0.00 -0.34 0.00 0.00 43.02 39.43 2gra s PHE 158 CO 0.00 -2.12 0.81 0.00 -1.46 0.00 0.00 175.22 172.45 2gra s THR 160 N 1.04 0.00 0.02 0.00 2.01 -1.15 -4.98 115.64 112.58 2gra s THR 160 Ca -0.05 -0.70 -0.01 0.00 0.31 0.00 0.00 61.69 61.24 2gra s THR 160 Cb -0.05 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.67 2gra s THR 160 CO -0.11 0.00 0.15 -1.83 -0.69 0.00 0.00 174.62 172.14 2gra s GLU 161 N -3.75 3.28 0.16 4.92 -1.05 -1.26 -2.86 118.70 118.15 2gra s GLU 161 Ca 0.09 -0.44 -0.23 0.00 -0.15 0.00 0.00 54.97 54.24 2gra s GLU 161 Cb -0.04 -2.98 0.07 0.00 -0.44 0.00 0.00 34.13 30.74 2gra s GLU 161 CO 0.02 0.64 0.60 0.14 0.95 0.00 0.00 175.26 177.60 2gra s VAL 162 N -1.35 0.00 0.52 1.83 -7.23 -0.94 -4.97 120.40 108.26 2gra s VAL 162 Ca 0.29 -0.04 -0.21 0.00 -1.81 0.00 0.00 61.98 60.21 2gra s VAL 162 Cb -0.13 -1.03 -0.06 0.00 0.56 0.00 0.00 36.38 35.72 2gra s VAL 162 CO 0.20 -0.01 1.16 -1.61 -0.31 0.00 0.00 175.10 174.54 2gra s GLU 163 N -3.76 3.44 0.00 4.82 2.02 -1.26 -4.19 118.70 119.78 2gra s GLU 163 Ca 0.01 1.71 0.05 0.00 0.02 0.00 0.00 54.97 56.77 2gra s GLU 163 Cb -0.01 -2.14 0.24 0.00 0.10 0.00 0.00 34.13 32.32 2gra s GLU 163 CO -0.12 -0.80 1.13 -1.91 0.02 0.00 0.00 175.26 173.58 2gra n GLU 164 N -1.05 0.02 0.06 1.61 2.13 -1.26 -0.89 120.64 121.26 2gra n GLU 164 Ca 0.10 0.36 0.13 0.00 0.66 0.00 0.00 57.16 58.41 2gra n GLU 164 Cb 0.50 -1.50 0.48 0.00 0.27 0.00 0.00 31.44 31.19 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 -1.44 0.42 -0.05 4.31 3.85 -1.26 -3.16 116.55 119.23 2gra n ASP 165 Ca 0.02 0.55 -0.00 0.00 -0.71 0.00 0.00 54.79 54.65 2gra n ASP 165 Cb 0.06 -0.66 -0.13 0.00 -1.35 0.00 0.00 41.12 39.04 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 -1.91 0.00 -0.20 -2.12 4.77 -0.07 -4.43 117.00 113.03 2gra n LEU 166 Ca 0.05 0.00 0.25 0.00 -0.03 0.00 0.00 56.01 56.28 2gra n LEU 166 Cb 0.34 0.21 0.64 0.00 -2.33 0.00 0.00 43.42 42.28 2gra n LEU 166 CO 0.26 0.21 1.24 0.40 -1.33 0.00 0.00 177.39 178.17 2gra h ILE 167 N 0.00 0.60 -0.14 -0.08 2.04 -1.49 0.87 117.51 119.31 2gra h ILE 167 Ca -0.23 -0.05 -0.12 0.00 1.00 0.00 0.00 64.86 65.46 2gra h ILE 167 Cb 1.42 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 2gra h ILE 167 CO 0.01 0.03 -0.43 0.44 0.00 0.00 0.00 178.15 178.20 2gra h ASP 168 N 0.15 0.33 0.34 1.72 3.32 -1.78 -2.43 116.42 118.08 2gra h ASP 168 Ca 0.44 -0.15 -0.02 0.00 0.02 0.00 0.00 57.03 57.33 2gra h ASP 168 Cb 1.50 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.96 2gra h ASP 168 CO -0.08 0.72 -0.16 0.00 -1.72 0.00 0.00 179.24 178.00 2gra h ALA 169 N 1.29 -0.46 -0.82 3.45 0.00 0.39 -3.23 119.26 119.88 2gra h ALA 169 Ca 0.02 -0.10 0.26 0.00 0.00 0.00 0.00 54.91 55.09 2gra h ALA 169 Cb 0.86 0.18 -0.15 0.00 0.00 0.00 0.00 17.79 18.68 2gra h ALA 169 CO 0.07 -0.43 0.15 0.28 0.00 0.00 0.00 179.25 179.32 2gra n VAL 170 N -5.08 -0.34 0.01 0.00 0.31 0.10 0.14 118.33 113.48 2gra n VAL 170 Ca -0.06 1.76 -0.10 0.00 -0.01 0.00 0.00 64.34 65.93 2gra n VAL 170 Cb 0.18 -2.66 -0.04 0.00 -0.91 0.00 0.00 33.84 30.42 2gra n VAL 170 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 2gra h THR 171 N 0.00 0.34 -0.89 2.52 2.02 -1.47 -0.21 112.91 115.22 2gra h THR 171 Ca 0.56 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.86 2gra h THR 171 Cb 1.27 0.34 -0.07 0.00 -1.74 0.00 0.00 68.15 67.95 2gra h THR 171 CO -0.73 0.00 0.57 1.23 0.37 0.00 0.00 175.52 176.97 2gra h GLY 172 N -0.38 1.26 0.00 2.16 0.00 0.12 0.49 103.07 106.73 2gra h GLY 172 Ca 0.09 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2gra h GLY 172 CO -0.32 0.14 0.00 -0.10 0.00 0.00 0.00 176.54 176.26 2gra n LEU 173 N -4.55 0.00 0.20 3.11 7.94 -0.25 -4.01 117.00 119.44 2gra n LEU 173 Ca 0.16 0.00 0.07 0.00 -1.11 0.00 0.00 56.01 55.13 2gra n LEU 173 Cb 0.39 0.00 0.57 0.00 0.53 0.00 0.00 43.42 44.91 2gra n LEU 173 CO 0.30 0.00 1.06 0.77 -1.11 0.00 0.00 177.39 178.41 2gra h SER 174 N 0.00 0.10 0.05 1.96 4.64 -1.28 0.33 113.55 119.35 2gra h SER 174 Ca 0.00 -0.01 0.03 0.00 -0.47 0.00 0.00 61.79 61.34 2gra h SER 174 Cb 0.00 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.02 2gra h SER 174 CO 0.00 0.10 -0.27 1.23 -0.87 0.00 0.00 176.83 177.02 2gra h GLY 175 N 0.21 -0.46 0.08 -0.77 0.00 0.28 -3.16 103.07 99.25 2gra h GLY 175 Ca 0.03 0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.69 2gra h GLY 175 CO -0.00 -0.22 -1.35 1.44 0.00 0.00 0.00 176.54 176.41 2gra n SER 176 N -5.39 0.60 -0.15 0.19 7.64 0.15 -4.70 113.62 111.97 2gra n SER 176 Ca -0.06 -0.55 -0.04 0.00 1.01 0.00 0.00 58.87 59.24 2gra n SER 176 Cb 0.30 1.32 -0.04 0.00 -1.01 0.00 0.00 64.21 64.78 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 1.40 -1.74 0.32 0.23 0.00 0.12 -1.07 105.19 104.45 2gra n GLY 177 Ca 0.01 0.57 0.08 0.00 0.00 0.00 0.00 46.02 46.68 2gra n GLY 177 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2gra n PRO 178 N -3.84 -0.08 0.03 1.61 -0.02 -1.26 0.13 135.00 131.56 2gra n PRO 178 Ca 0.01 1.38 0.08 0.00 -2.02 0.00 0.00 63.50 62.95 2gra n PRO 178 Cb 0.09 -2.11 0.50 0.00 -0.02 0.00 0.00 33.50 31.97 2gra n PRO 178 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gra h ALA 179 N 1.80 1.90 0.37 3.55 0.00 -1.45 0.27 119.26 125.69 2gra h ALA 179 Ca 0.47 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.34 2gra h ALA 179 Cb 0.81 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2gra h ALA 179 CO -0.90 0.05 -0.18 1.88 0.00 0.00 0.00 179.25 180.10 2gra h TYR 180 N 0.38 -0.46 -0.44 0.00 0.99 0.11 -2.24 116.97 115.30 2gra h TYR 180 Ca 0.16 -0.01 0.09 0.00 2.00 0.00 0.00 58.73 60.97 2gra h TYR 180 Cb 0.18 0.15 -0.09 0.00 1.00 0.00 0.00 36.73 37.98 2gra h TYR 180 CO -0.00 -0.14 -0.19 0.00 -0.00 0.00 0.00 178.16 177.83 2gra h ALA 181 N -0.31 0.14 -0.88 3.88 0.00 -0.56 0.93 119.26 122.47 2gra h ALA 181 Ca -0.05 0.16 0.14 0.00 0.00 0.00 0.00 54.91 55.15 2gra h ALA 181 Cb 0.53 0.48 -0.07 0.00 0.00 0.00 0.00 17.79 18.73 2gra h ALA 181 CO 0.08 -0.54 0.57 0.74 0.00 0.00 0.00 179.25 180.10 2gra h PHE 182 N -0.10 0.81 0.40 0.00 0.05 -0.50 0.53 116.94 118.13 2gra h PHE 182 Ca 0.21 0.02 -0.02 0.00 3.82 0.00 0.00 57.97 62.01 2gra h PHE 182 Cb 0.43 -0.26 0.00 0.00 2.00 0.00 0.00 35.95 38.13 2gra h PHE 182 CO -0.45 0.31 -0.19 1.15 -0.18 0.00 0.00 178.31 178.95 2gra h THR 183 N 0.70 0.00 -1.25 -1.55 2.02 0.26 -1.01 112.91 112.08 2gra h THR 183 Ca 0.43 -0.37 0.39 0.00 0.77 0.00 0.00 66.41 67.64 2gra h THR 183 Cb 0.67 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.96 2gra h THR 183 CO -0.19 0.00 0.81 0.00 0.37 0.00 0.00 175.52 176.50 2gra h ALA 184 N -1.38 2.62 0.26 6.16 0.00 0.14 -1.44 119.26 125.60 2gra h ALA 184 Ca -0.06 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2gra h ALA 184 Cb 0.41 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2gra h ALA 184 CO 0.09 -1.20 -0.12 -0.07 0.00 0.00 0.00 179.25 177.95 2gra h LEU 185 N 0.15 -0.29 -1.95 0.00 3.38 0.17 -1.57 115.31 115.20 2gra h LEU 185 Ca 0.77 -0.19 0.16 0.00 0.09 0.00 0.00 57.88 58.70 2gra h LEU 185 Cb 2.32 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 43.13 2gra h LEU 185 CO -0.39 0.21 0.51 -0.78 0.09 0.00 0.00 178.44 178.08 2gra h ASP 186 N -0.97 0.00 0.25 -0.43 3.58 -0.45 -0.71 116.42 117.70 2gra h ASP 186 Ca -0.04 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.40 2gra h ASP 186 Cb 0.47 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.52 2gra h ASP 186 CO 0.06 0.00 -0.12 0.00 -2.88 0.00 0.00 179.24 176.30 2gra h ALA 187 N 1.49 -0.58 -0.37 -0.78 0.00 -1.19 -3.32 119.26 114.50 2gra h ALA 187 Ca 0.26 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.14 2gra h ALA 187 Cb 1.27 0.13 -0.08 0.00 0.00 0.00 0.00 17.79 19.11 2gra h ALA 187 CO -0.00 -0.55 -0.55 -0.07 0.00 0.00 0.00 179.25 178.08 2gra h LEU 188 N -0.60 -1.82 -5.99 0.00 3.38 -0.59 -1.96 115.31 107.72 2gra h LEU 188 Ca -0.03 0.24 -0.59 0.00 0.09 0.00 0.00 57.88 57.58 2gra h LEU 188 Cb 0.26 0.74 0.02 0.00 0.09 0.00 0.00 40.66 41.78 2gra h LEU 188 CO 0.06 -0.41 2.66 0.00 0.09 0.00 0.00 178.44 180.84 2gra n ALA 189 N -3.07 4.43 0.00 1.53 0.00 -0.34 0.76 120.51 123.82 2gra n ALA 189 Ca -0.04 -3.08 0.00 0.00 0.00 0.00 0.00 53.44 50.32 2gra n ALA 189 Cb 0.35 -3.43 0.00 0.00 0.00 0.00 0.00 19.45 16.37 2gra n ALA 189 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2gra n ASP 190 N 6.04 0.00 0.03 0.00 10.43 -0.78 -4.74 116.55 127.53 2gra n ASP 190 Ca 0.51 0.00 -0.04 0.00 2.57 0.00 0.00 54.79 57.83 2gra n ASP 190 Cb 0.31 0.00 -0.02 0.00 1.84 0.00 0.00 41.12 43.25 2gra n ASP 190 CO 0.00 0.00 0.00 1.23 -1.07 0.00 0.00 177.20 177.36 2gra h GLY 191 N 0.00 -0.19 -0.14 0.44 0.00 0.79 -0.65 103.07 103.32 2gra h GLY 191 Ca 0.00 0.07 0.26 0.00 0.00 0.00 0.00 47.33 47.66 2gra h GLY 191 CO 0.00 -0.07 0.66 -1.33 0.00 0.00 0.00 176.54 175.80 2gra h GLY 192 N -1.04 1.35 0.83 4.60 0.00 -1.34 2.27 103.07 109.73 2gra h GLY 192 Ca -0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 2gra h GLY 192 CO 0.03 -0.16 0.03 -2.08 0.00 0.00 0.00 176.54 174.37 2gra h VAL 193 N 0.43 1.21 -0.32 4.60 2.07 -1.74 -1.46 116.25 121.04 2gra h VAL 193 Ca 0.61 -0.66 0.09 0.00 0.82 0.00 0.00 66.70 67.56 2gra h VAL 193 Cb 1.46 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 32.57 2gra h VAL 193 CO -0.33 0.20 0.51 0.50 0.02 0.00 0.00 177.57 178.47 2gra h LYS 194 N 0.05 0.00 -0.79 1.57 3.64 0.53 0.55 116.57 122.12 2gra h LYS 194 Ca 0.05 0.00 -0.49 0.00 -1.27 0.00 0.00 60.65 58.94 2gra h LYS 194 Cb 0.27 0.00 -0.27 0.00 -0.41 0.00 0.00 32.23 31.83 2gra h LYS 194 CO 0.00 0.00 0.31 -1.33 -2.27 0.00 0.00 179.45 176.16 2gra n MET 195 N -3.34 2.48 0.00 1.90 0.00 -0.17 -5.01 117.12 112.97 2gra n MET 195 Ca 0.05 -3.32 0.00 0.00 0.00 0.00 0.00 57.70 54.43 2gra n MET 195 Cb 0.65 -2.13 0.00 0.00 0.00 0.00 0.00 33.22 31.74 2gra n MET 195 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2gra n GLY 196 N -1.01 0.94 0.58 3.03 0.00 0.19 -5.02 105.19 103.92 2gra n GLY 196 Ca 0.52 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 0.00 -4.74 0.99 4.77 -1.24 -4.32 117.00 112.46 2gra n LEU 197 Ca 0.00 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.57 2gra n LEU 197 Cb 0.00 -0.87 -0.05 0.00 -2.33 0.00 0.00 43.42 40.17 2gra n LEU 197 CO 0.00 0.00 0.66 -2.16 -1.33 0.00 0.00 177.39 174.56 2gra s PRO 198 N -1.76 4.75 0.18 3.23 0.04 -1.26 -4.60 135.00 135.59 2gra s PRO 198 Ca 0.00 1.47 -0.23 0.00 0.04 0.00 0.00 61.00 62.28 2gra s PRO 198 Cb 0.00 -3.34 0.07 0.00 0.04 0.00 0.00 34.50 31.27 2gra s PRO 198 CO 0.00 0.31 1.46 -2.13 0.04 0.00 0.00 177.00 176.68 2gra n ARG 199 N 2.34 -0.32 0.00 4.56 3.00 -1.26 -1.60 116.66 123.37 2gra n ARG 199 Ca 0.01 1.44 0.00 0.00 -0.00 0.00 0.00 57.85 59.30 2gra n ARG 199 Cb 0.48 -2.12 0.00 0.00 0.00 0.00 0.00 32.46 30.82 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 -5.28 0.00 -0.23 -0.14 1.74 -1.26 -2.02 116.66 109.47 2gra n ARG 200 Ca 0.06 0.32 0.21 0.00 -0.77 0.00 0.00 57.85 57.67 2gra n ARG 200 Cb 0.31 -1.14 0.40 0.00 -1.02 0.00 0.00 32.46 31.01 2gra n ARG 200 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2gra n LEU 201 N -1.14 0.21 0.49 0.55 7.94 -1.09 -0.33 117.00 123.63 2gra n LEU 201 Ca 0.00 1.18 -0.19 0.00 -1.11 0.00 0.00 56.01 55.89 2gra n LEU 201 Cb 0.00 -0.56 -0.09 0.00 0.53 0.00 0.00 43.42 43.30 2gra n LEU 201 CO 0.00 -1.31 0.54 0.00 -1.11 0.00 0.00 177.39 175.50 2gra h ALA 202 N 1.42 -1.33 -0.66 1.96 0.00 -1.02 0.37 119.26 120.00 2gra h ALA 202 Ca 0.58 -0.27 0.12 0.00 0.00 0.00 0.00 54.91 55.34 2gra h ALA 202 Cb 1.52 0.49 -0.12 0.00 0.00 0.00 0.00 17.79 19.68 2gra h ALA 202 CO -0.56 -1.25 -0.29 0.28 0.00 0.00 0.00 179.25 177.43 2gra h VAL 203 N -1.25 0.19 -0.49 0.00 2.07 -0.05 -1.81 116.25 114.91 2gra h VAL 203 Ca -0.13 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.48 2gra h VAL 203 Cb 0.96 0.19 -0.07 0.00 -1.52 0.00 0.00 31.29 30.85 2gra h VAL 203 CO 0.20 0.00 0.08 0.03 0.02 0.00 0.00 177.57 177.90 2gra h ARG 204 N -0.10 0.20 -0.07 1.57 2.47 -1.24 -1.46 114.38 115.75 2gra h ARG 204 Ca 0.28 -0.01 -0.02 0.00 -1.26 0.00 0.00 59.98 58.96 2gra h ARG 204 Cb 0.55 -0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 28.82 2gra h ARG 204 CO -0.72 0.13 -0.04 -0.07 0.56 0.00 0.00 179.97 179.83 2gra h LEU 205 N 0.21 0.16 -0.33 3.04 3.38 -0.30 -1.89 115.31 119.57 2gra h LEU 205 Ca 0.25 -0.43 0.07 0.00 0.09 0.00 0.00 57.88 57.85 2gra h LEU 205 Cb 0.34 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 40.96 2gra h LEU 205 CO -0.34 0.56 -0.32 1.23 0.09 0.00 0.00 178.44 179.66 2gra h GLY 206 N -0.24 -0.29 -0.12 0.83 0.00 -1.19 -0.25 103.07 101.81 2gra h GLY 206 Ca 0.01 0.40 0.05 0.00 0.00 0.00 0.00 47.33 47.80 2gra h GLY 206 CO 0.01 -0.21 -0.44 0.00 0.00 0.00 0.00 176.54 175.90 2gra h ALA 207 N 0.68 -0.59 -1.04 3.60 0.00 -1.23 -0.63 119.26 120.07 2gra h ALA 207 Ca 0.15 0.01 0.26 0.00 0.00 0.00 0.00 54.91 55.33 2gra h ALA 207 Cb 0.53 0.86 -0.10 0.00 0.00 0.00 0.00 17.79 19.08 2gra h ALA 207 CO -0.49 -0.93 0.65 0.37 0.00 0.00 0.00 179.25 178.85 2gra h GLN 208 N -0.45 0.44 0.57 0.00 5.75 -0.30 0.15 115.11 121.27 2gra h GLN 208 Ca 0.09 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.54 2gra h GLN 208 Cb 0.62 -0.10 0.01 0.00 1.07 0.00 0.00 27.48 29.08 2gra h GLN 208 CO -0.47 0.29 -0.27 0.00 -2.65 0.00 0.00 178.83 175.73 2gra h ALA 209 N 1.66 -0.76 -0.51 3.38 0.00 0.45 0.22 119.26 123.70 2gra h ALA 209 Ca 0.62 -0.20 0.10 0.00 0.00 0.00 0.00 54.91 55.43 2gra h ALA 209 Cb 1.43 0.30 -0.09 0.00 0.00 0.00 0.00 17.79 19.43 2gra h ALA 209 CO -0.36 -0.78 -0.02 -0.07 0.00 0.00 0.00 179.25 178.02 2gra h LEU 210 N -1.06 -0.26 -0.07 0.00 3.38 -0.71 1.98 115.31 118.58 2gra h LEU 210 Ca -0.08 0.13 0.03 0.00 0.09 0.00 0.00 57.88 58.05 2gra h LEU 210 Cb 0.65 0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.57 2gra h LEU 210 CO 0.13 -0.09 -0.51 0.25 0.09 0.00 0.00 178.44 178.31 2gra h LEU 211 N 0.10 -1.58 0.50 1.67 7.12 -0.71 0.17 115.31 122.57 2gra h LEU 211 Ca 0.26 0.19 -0.02 0.00 0.13 0.00 0.00 57.88 58.44 2gra h LEU 211 Cb 0.39 0.61 -0.01 0.00 -0.53 0.00 0.00 40.66 41.13 2gra h LEU 211 CO -0.44 -0.49 -0.35 1.23 -0.13 0.00 0.00 178.44 178.26 2gra h GLY 212 N -0.60 -0.90 -0.26 3.75 0.00 0.25 -1.98 103.07 103.32 2gra h GLY 212 Ca 0.04 0.39 0.13 0.00 0.00 0.00 0.00 47.33 47.89 2gra h GLY 212 CO -0.39 -0.32 -0.12 0.00 0.00 0.00 0.00 176.54 175.71 2gra h ALA 213 N -0.43 0.48 0.25 3.60 0.00 0.32 0.57 119.26 124.06 2gra h ALA 213 Ca -0.05 0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2gra h ALA 213 Cb 0.69 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2gra h ALA 213 CO 0.03 -0.42 -0.20 0.00 0.00 0.00 0.00 179.25 178.65 2gra h ALA 214 N 1.64 -0.97 -0.91 0.00 0.00 -0.50 0.38 119.26 118.91 2gra h ALA 214 Ca 0.32 -0.09 0.23 0.00 0.00 0.00 0.00 54.91 55.37 2gra h ALA 214 Cb 0.50 0.39 -0.13 0.00 0.00 0.00 0.00 17.79 18.56 2gra h ALA 214 CO -0.64 -0.97 0.41 -0.22 0.00 0.00 0.00 179.25 177.83 2gra h LYS 215 N -0.44 0.39 -0.17 0.00 3.64 -0.98 0.72 116.57 119.73 2gra h LYS 215 Ca -0.03 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.38 2gra h LYS 215 Cb 0.37 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 32.03 2gra h LYS 215 CO 0.00 0.26 -0.26 0.52 -2.27 0.00 0.00 179.45 177.70 2gra h MET 216 N 0.40 -0.29 -0.09 1.90 2.86 0.66 -1.03 114.93 119.35 2gra h MET 216 Ca 0.57 0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 58.23 2gra h MET 216 Cb 1.10 0.07 -0.00 0.00 0.06 0.00 0.00 31.60 32.82 2gra h MET 216 CO -0.53 -0.19 0.04 1.25 1.06 0.00 0.00 176.91 178.54 2gra h LEU 217 N -0.30 0.11 0.32 1.22 5.85 0.46 -2.81 115.31 120.15 2gra h LEU 217 Ca 0.11 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2gra h LEU 217 Cb 0.47 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 2gra h LEU 217 CO -0.34 0.19 -0.40 -0.07 -0.34 0.00 0.00 178.44 177.47 2gra h LEU 218 N 0.02 -1.13 -1.21 2.25 3.38 0.02 -2.16 115.31 116.49 2gra h LEU 218 Ca 0.03 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2gra h LEU 218 Cb 0.11 0.39 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2gra h LEU 218 CO -0.00 -0.53 0.00 0.45 0.09 0.00 0.00 178.44 178.44 2gra h HIS 219 N -0.77 0.00 -4.33 1.13 3.86 -1.27 -3.44 115.15 110.32 2gra h HIS 219 Ca -0.02 0.00 -0.48 0.00 -1.16 0.00 0.00 60.37 58.71 2gra h HIS 219 Cb 0.71 0.00 0.08 0.00 1.06 0.00 0.00 27.41 29.26 2gra h HIS 219 CO -0.26 0.00 0.36 0.45 0.86 0.00 0.00 177.93 179.34 2gra s SER 220 N -4.43 5.17 0.00 2.45 0.15 -0.81 -4.96 113.70 111.26 2gra s SER 220 Ca 0.01 0.92 0.07 0.00 0.70 0.00 0.00 55.95 57.65 2gra s SER 220 Cb 0.09 -1.65 -0.01 0.00 -1.71 0.00 0.00 66.02 62.73 2gra s SER 220 CO 0.35 -1.47 0.48 -1.84 1.20 0.00 0.00 173.24 171.96 2gra n GLU 221 N -3.02 2.60 -1.26 5.44 0.28 -1.26 -5.00 120.64 118.43 2gra n GLU 221 Ca 0.07 -0.43 -0.31 0.00 -0.16 0.00 0.00 57.16 56.33 2gra n GLU 221 Cb 0.59 -0.96 0.09 0.00 1.43 0.00 0.00 31.44 32.59 2gra n GLU 221 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 2gra s GLN 222 N -1.12 2.21 -0.12 3.44 -1.52 -1.26 -5.03 119.66 116.25 2gra s GLN 222 Ca 0.05 1.15 -0.14 0.00 -1.95 0.00 0.00 55.36 54.47 2gra s GLN 222 Cb 0.05 -1.89 -0.05 0.00 -0.22 0.00 0.00 33.01 30.90 2gra s GLN 222 CO 0.18 -1.67 0.33 -1.58 -0.25 0.00 0.00 175.29 172.29 2gra s HIS 223 N -2.91 3.52 0.47 0.91 5.65 -1.26 -4.95 115.29 116.72 2gra s HIS 223 Ca 0.61 0.70 0.39 0.00 0.25 0.00 0.00 55.06 57.01 2gra s HIS 223 Cb -0.17 -2.34 1.53 0.00 -1.18 0.00 0.00 32.58 30.42 2gra s HIS 223 CO 0.56 0.33 1.49 -2.30 -0.65 0.00 0.00 174.74 174.17 2gra n PRO 224 N 3.19 -0.02 -0.01 2.88 -0.02 -1.26 1.00 135.00 140.76 2gra n PRO 224 Ca -0.12 1.13 -0.13 0.00 -2.02 0.00 0.00 63.50 62.36 2gra n PRO 224 Cb 0.52 -2.37 -0.10 0.00 -0.02 0.00 0.00 33.50 31.53 2gra n PRO 224 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2gra h GLY 225 N 0.00 -0.02 1.94 -1.23 0.00 -1.98 0.44 103.07 102.22 2gra h GLY 225 Ca 0.87 0.01 0.00 0.00 0.00 0.00 0.00 47.33 48.21 2gra h GLY 225 CO -0.26 -0.01 0.02 -1.61 0.00 0.00 0.00 176.54 174.69 2gra h GLN 226 N -0.49 0.00 0.13 4.80 5.75 0.25 0.33 115.11 125.88 2gra h GLN 226 Ca -0.00 0.00 -0.32 0.00 -0.15 0.00 0.00 58.65 58.18 2gra h GLN 226 Cb 0.48 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.02 2gra h GLN 226 CO 0.00 0.00 -1.62 -0.07 -2.65 0.00 0.00 178.83 174.49 2gra h LEU 227 N 0.00 0.44 0.15 -2.39 3.38 -1.17 -2.13 115.31 113.58 2gra h LEU 227 Ca 0.01 -0.64 -0.01 0.00 0.09 0.00 0.00 57.88 57.33 2gra h LEU 227 Cb 0.06 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2gra h LEU 227 CO -0.00 1.54 -0.07 0.50 0.09 0.00 0.00 178.44 180.50 2gra h LYS 228 N 0.08 -0.19 0.00 1.13 3.64 0.14 -1.41 116.57 119.96 2gra h LYS 228 Ca -0.28 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 2gra h LYS 228 Cb 2.04 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.90 2gra h LYS 228 CO 0.16 -0.09 0.00 -0.25 -2.27 0.00 0.00 179.45 177.00 2gra n ASP 229 N -5.16 0.00 -0.16 4.20 9.92 0.92 -2.25 116.55 124.03 2gra n ASP 229 Ca -0.08 0.74 0.03 0.00 -0.53 0.00 0.00 54.79 54.94 2gra n ASP 229 Cb 0.12 -0.24 0.06 0.00 -0.64 0.00 0.00 41.12 40.42 2gra n ASP 229 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2gra n ASN 230 N -1.65 -0.16 -1.32 -2.24 4.13 -0.80 0.00 115.26 113.22 2gra n ASN 230 Ca 0.00 0.74 -0.06 0.00 1.68 0.00 0.00 54.58 56.95 2gra n ASN 230 Cb 0.00 -0.22 0.09 0.00 -1.54 0.00 0.00 39.78 38.10 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 -4.70 1.58 -4.59 2.41 0.31 -0.54 -4.85 118.33 107.95 2gra n VAL 231 Ca 0.07 -0.64 -0.23 0.00 -0.01 0.00 0.00 64.34 63.53 2gra n VAL 231 Cb 0.21 -0.70 -0.16 0.00 -0.91 0.00 0.00 33.84 32.29 2gra n VAL 231 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2gra s SER 232 N 0.05 1.60 -0.25 4.52 0.15 0.10 -4.90 113.70 114.97 2gra s SER 232 Ca 0.20 -0.25 -0.08 0.00 0.70 0.00 0.00 55.95 56.52 2gra s SER 232 Cb 0.17 -0.36 -0.03 0.00 -1.71 0.00 0.00 66.02 64.08 2gra s SER 232 CO 0.04 0.12 0.10 -0.44 1.20 0.00 0.00 173.24 174.27 2gra s SER 233 N -0.00 5.39 0.22 5.45 0.01 -1.26 -4.98 113.70 118.52 2gra s SER 233 Ca -0.01 -0.14 0.04 0.00 1.31 0.00 0.00 55.95 57.15 2gra s SER 233 Cb -0.08 -1.98 0.60 0.00 0.21 0.00 0.00 66.02 64.77 2gra s SER 233 CO 0.01 -0.03 1.07 -2.65 0.41 0.00 0.00 173.24 172.05 2gra n PRO 234 N 4.88 -0.05 0.00 12.44 -0.02 -1.26 -1.75 135.00 149.23 2gra n PRO 234 Ca -0.16 1.01 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 2gra n PRO 234 Cb 0.52 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 2gra n PRO 234 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gra n GLY 235 N -1.31 -1.81 0.00 -1.23 0.00 -1.26 -5.00 105.19 94.58 2gra n GLY 235 Ca 0.18 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.39 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 -0.30 2.49 6.04 -0.02 0.00 -0.72 -4.89 105.19 107.80 2gra n GLY 236 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.14 4.61 0.00 -1.26 -3.79 120.51 117.21 2gra n ALA 237 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 2gra n ALA 237 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 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 0.00 -1.33 0.00 2.02 -1.90 -2.62 112.91 109.08 2gra h THR 238 Ca 0.00 -0.20 0.43 0.00 0.77 0.00 0.00 66.41 67.41 2gra h THR 238 Cb 0.00 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.29 2gra h THR 238 CO 0.00 0.00 0.87 -0.29 0.37 0.00 0.00 175.52 176.47 2gra h ILE 239 N -0.59 0.15 -0.05 3.11 6.09 -1.83 0.90 117.51 125.29 2gra h ILE 239 Ca -0.04 -0.03 -0.02 0.00 -1.37 0.00 0.00 64.86 63.39 2gra h ILE 239 Cb 0.30 0.04 -0.00 0.00 0.47 0.00 0.00 36.82 37.63 2gra h ILE 239 CO 0.07 0.02 -0.07 0.45 -3.07 0.00 0.00 178.15 175.55 2gra h HIS 240 N 0.10 0.16 -0.07 2.19 3.86 -1.79 -2.87 115.15 116.72 2gra h HIS 240 Ca 0.80 -0.05 0.04 0.00 -1.16 0.00 0.00 60.37 60.00 2gra h HIS 240 Cb 2.55 -0.03 -0.05 0.00 1.06 0.00 0.00 27.41 30.94 2gra h HIS 240 CO -0.00 0.63 -0.23 0.00 0.86 0.00 0.00 177.93 179.19 2gra h ALA 241 N 0.50 -0.24 -0.38 2.45 0.00 0.11 -2.55 119.26 119.16 2gra h ALA 241 Ca 0.01 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.01 2gra h ALA 241 Cb 0.61 0.42 -0.09 0.00 0.00 0.00 0.00 17.79 18.73 2gra h ALA 241 CO 0.02 -0.70 -0.36 -0.07 0.00 0.00 0.00 179.25 178.14 2gra h LEU 242 N -0.32 -1.18 -1.17 0.00 3.38 -0.96 0.14 115.31 115.20 2gra h LEU 242 Ca 0.08 0.20 0.38 0.00 0.09 0.00 0.00 57.88 58.63 2gra h LEU 242 Cb 0.43 0.54 -0.15 0.00 0.09 0.00 0.00 40.66 41.57 2gra h LEU 242 CO -0.26 -0.34 0.67 -0.74 0.09 0.00 0.00 178.44 177.87 2gra h HIS 243 N -0.29 0.74 -0.38 1.13 2.76 -1.22 1.10 115.15 118.99 2gra h HIS 243 Ca 0.16 0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.27 2gra h HIS 243 Cb 0.56 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 29.31 2gra h HIS 243 CO -0.55 -0.24 -0.12 -0.24 -1.30 0.00 0.00 177.93 175.47 2gra h VAL 244 N 0.17 1.25 0.31 5.26 3.04 -0.55 -0.77 116.25 124.96 2gra h VAL 244 Ca 0.78 -1.13 -0.02 0.00 -1.01 0.00 0.00 66.70 65.33 2gra h VAL 244 Cb 2.13 1.09 0.00 0.00 -2.01 0.00 0.00 31.29 32.51 2gra h VAL 244 CO -0.56 0.38 -0.15 -0.07 -1.01 0.00 0.00 177.57 176.17 2gra h LEU 245 N 0.61 -0.35 -1.75 3.16 3.38 0.14 -3.09 115.31 117.42 2gra h LEU 245 Ca 0.11 -0.14 0.39 0.00 0.09 0.00 0.00 57.88 58.33 2gra h LEU 245 Cb 0.56 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.33 2gra h LEU 245 CO 0.04 0.12 0.92 -0.33 0.09 0.00 0.00 178.44 179.28 2gra h GLU 246 N -1.01 0.09 -0.03 1.13 4.39 -0.85 3.09 114.58 121.40 2gra h GLU 246 Ca -0.04 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.65 2gra h GLU 246 Cb 0.47 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 2gra h GLU 246 CO 0.07 0.06 0.00 0.43 -1.16 0.00 0.00 179.01 178.41 2gra n SER 247 N -4.33 0.25 -0.08 1.42 7.64 -0.30 -2.81 113.62 115.42 2gra n SER 247 Ca 0.31 -1.56 0.01 0.00 1.01 0.00 0.00 58.87 58.65 2gra n SER 247 Cb 1.36 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 64.54 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 0.79 -0.68 2.26 0.23 0.00 1.03 -4.97 105.19 103.84 2gra n GLY 248 Ca 0.12 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 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 0.39 -0.08 0.34 -0.02 0.00 -0.97 -4.86 105.19 99.99 2gra n GLY 249 Ca 0.01 -0.34 0.06 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 1.02 -0.44 1.61 3.57 -1.80 0.90 116.94 121.80 2gra h PHE 250 Ca -0.31 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.31 2gra h PHE 250 Cb 1.21 -0.32 -0.07 0.00 2.79 0.00 0.00 35.95 39.56 2gra h PHE 250 CO 0.35 0.39 -0.01 0.00 -2.23 0.00 0.00 178.31 176.82 2gra h ARG 251 N 0.89 0.10 0.00 1.11 2.47 -1.89 -3.32 114.38 113.74 2gra h ARG 251 Ca 0.46 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 59.18 2gra h ARG 251 Cb 0.47 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.76 2gra h ARG 251 CO -0.27 0.07 0.00 0.43 0.56 0.00 0.00 179.97 180.76 2gra n SER 252 N -5.22 0.00 0.00 7.04 7.64 0.30 -3.66 113.62 119.72 2gra n SER 252 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.92 2gra n SER 252 Cb 0.23 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 2gra n SER 252 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2gra n LEU 253 N 0.00 0.00 -0.19 -3.43 4.32 -1.15 -0.05 117.00 116.51 2gra n LEU 253 Ca 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 56.01 55.95 2gra n LEU 253 Cb 0.00 0.00 0.02 0.00 -1.62 0.00 0.00 43.42 41.82 2gra n LEU 253 CO 0.00 0.00 0.68 -0.07 -1.22 0.00 0.00 177.39 176.78 2gra h LEU 254 N 0.00 -0.90 0.30 2.23 3.38 -1.69 0.77 115.31 119.41 2gra h LEU 254 Ca 0.00 0.20 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 2gra h LEU 254 Cb 0.00 0.48 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 2gra h LEU 254 CO 0.00 -0.27 -0.44 0.40 0.09 0.00 0.00 178.44 178.22 2gra h ILE 255 N -0.12 0.00 -0.96 1.22 1.08 -0.54 0.22 117.51 118.41 2gra h ILE 255 Ca 0.25 0.00 0.23 0.00 -0.39 0.00 0.00 64.86 64.94 2gra h ILE 255 Cb 0.51 0.00 -0.18 0.00 -3.07 0.00 0.00 36.82 34.08 2gra h ILE 255 CO -0.63 0.00 -0.12 0.59 -0.69 0.00 0.00 178.15 177.30 2gra n ASN 256 N -5.04 -0.23 0.37 1.72 4.13 -0.19 -0.30 115.26 115.72 2gra n ASN 256 Ca -0.09 1.64 -0.18 0.00 1.68 0.00 0.00 54.58 57.63 2gra n ASN 256 Cb 0.38 -0.54 -0.09 0.00 -1.54 0.00 0.00 39.78 37.99 2gra n ASN 256 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2gra h ALA 257 N 1.91 -0.90 0.00 5.41 0.00 0.25 -0.28 119.26 125.65 2gra h ALA 257 Ca 0.52 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2gra h ALA 257 Cb 0.93 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2gra h ALA 257 CO -0.95 -1.01 0.00 0.28 0.00 0.00 0.00 179.25 177.58 2gra n VAL 258 N -5.48 0.38 0.50 0.00 0.31 0.57 -1.08 118.33 113.52 2gra n VAL 258 Ca -0.14 0.09 0.06 0.00 -0.01 0.00 0.00 64.34 64.35 2gra n VAL 258 Cb 0.37 -0.94 -0.08 0.00 -0.91 0.00 0.00 33.84 32.28 2gra n VAL 258 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2gra n GLU 259 N -1.14 2.16 -0.06 5.55 2.13 0.59 -4.19 120.64 125.68 2gra n GLU 259 Ca 0.06 -0.03 -0.02 0.00 0.66 0.00 0.00 57.16 57.83 2gra n GLU 259 Cb 0.06 -1.17 -0.13 0.00 0.27 0.00 0.00 31.44 30.47 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 -1.45 1.95 0.29 4.31 0.00 -0.21 -2.96 120.51 122.44 2gra n ALA 260 Ca 0.01 -0.85 -0.16 0.00 0.00 0.00 0.00 53.44 52.44 2gra n ALA 260 Cb 0.24 -0.26 -0.08 0.00 0.00 0.00 0.00 19.45 19.35 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 -0.58 0.65 0.00 0.87 -1.32 -1.47 113.55 111.70 2gra h SER 261 Ca -0.29 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.24 2gra h SER 261 Cb 1.60 0.15 0.01 0.00 -0.44 0.00 0.00 62.40 63.71 2gra h SER 261 CO 0.02 -0.40 -0.31 0.00 -0.53 0.00 0.00 176.83 175.61 2gra h ILE 263 N -1.03 0.25 -0.13 0.00 1.08 -1.56 1.03 117.51 117.15 2gra h ILE 263 Ca -0.09 -0.08 -0.15 0.00 -0.39 0.00 0.00 64.86 64.15 2gra h ILE 263 Cb 0.71 -0.01 -0.01 0.00 -3.07 0.00 0.00 36.82 34.44 2gra h ILE 263 CO 0.15 0.04 -0.56 -0.09 -0.69 0.00 0.00 178.15 177.00 2gra h ARG 264 N 0.24 0.40 -0.69 2.37 9.65 -1.07 -2.40 114.38 122.87 2gra h ARG 264 Ca 0.70 -0.26 -0.01 0.00 -1.10 0.00 0.00 59.98 59.31 2gra h ARG 264 Cb 1.58 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 30.16 2gra h ARG 264 CO -0.66 0.85 0.40 1.15 2.80 0.00 0.00 179.97 184.52 2gra h THR 265 N 0.30 1.20 0.22 0.20 2.02 0.28 -2.17 112.91 114.97 2gra h THR 265 Ca 0.00 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.71 2gra h THR 265 Cb 1.08 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.74 2gra h THR 265 CO 0.10 0.22 -0.22 0.03 0.37 0.00 0.00 175.52 176.01 2gra h ARG 266 N 0.94 -0.46 -0.04 6.66 3.08 -0.68 -1.28 114.38 122.60 2gra h ARG 266 Ca 0.25 0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.34 2gra h ARG 266 Cb -0.00 0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 2gra h ARG 266 CO -0.04 -0.31 0.29 0.93 -1.07 0.00 0.00 179.97 179.76 2gra h GLU 267 N -0.48 0.00 0.00 0.04 5.08 -1.05 -1.79 114.58 116.39 2gra h GLU 267 Ca -0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 2gra h GLU 267 Cb 0.45 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 2gra h GLU 267 CO -0.05 0.00 -0.15 -0.07 -1.00 0.00 0.00 179.01 177.74 2gra h LEU 268 N 0.00 0.00 -0.04 1.33 3.38 -0.61 -3.30 115.31 116.06 2gra h LEU 268 Ca 0.02 -0.83 -0.01 0.00 0.09 0.00 0.00 57.88 57.14 2gra h LEU 268 Cb 0.59 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 2gra h LEU 268 CO -0.00 1.00 -0.02 0.06 0.09 0.00 0.00 178.44 179.58 2gra h GLN 269 N -1.00 0.09 -1.72 1.13 3.07 -1.19 -2.03 115.11 113.46 2gra h GLN 269 Ca -0.04 -0.04 0.00 0.00 0.09 0.00 0.00 58.65 58.66 2gra h GLN 269 Cb 0.93 -0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.49 2gra h GLN 269 CO -0.02 0.45 0.00 -1.13 0.09 0.00 0.00 178.83 178.22 2gra n SER 270 N -4.83 2.81 0.00 0.06 3.41 -0.70 -0.10 113.62 114.26 2gra n SER 270 Ca -0.07 -1.65 0.00 0.00 -0.26 0.00 0.00 58.87 56.89 2gra n SER 270 Cb 0.23 -0.55 0.00 0.00 -0.26 0.00 0.00 64.21 63.62 2gra n SER 270 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 2gra n MET 271 N 1.24 4.72 -0.09 4.33 0.00 -0.93 -4.38 117.12 122.01 2gra n MET 271 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.70 57.57 2gra n MET 271 Cb 0.32 -0.42 -0.04 0.00 0.00 0.00 0.00 33.22 33.08 2gra n MET 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2gra h ALA 272 N 0.00 0.43 0.00 -5.12 0.00 0.20 -3.11 119.26 111.66 2gra h ALA 272 Ca 0.00 -0.42 -0.33 0.00 0.00 0.00 0.00 54.91 54.16 2gra h ALA 272 Cb 0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 2gra h ALA 272 CO 0.00 0.47 -2.15 -0.40 0.00 0.00 0.00 179.25 177.17 2gra n ASP 273 N -4.23 0.28 0.26 0.00 5.68 -1.21 -4.05 116.55 113.27 2gra n ASP 273 Ca -0.04 0.13 0.14 0.00 -0.50 0.00 0.00 54.79 54.53 2gra n ASP 273 Cb 0.49 0.70 0.77 0.00 -1.14 0.00 0.00 41.12 41.94 2gra n ASP 273 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 2gra h GLN 274 N 0.00 0.00 0.00 0.11 4.15 -1.76 -3.52 115.11 114.09 2gra h GLN 274 Ca -0.45 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.97 2gra h GLN 274 Cb 2.13 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.82 2gra h GLN 274 CO 0.04 0.00 0.00 -1.91 -1.93 0.00 0.00 178.83 175.03