#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2byd s TYR 19 N 0.00 2.46 -1.10 -1.77 1.51 -1.26 -5.06 117.35 112.13 2byd s TYR 19 Ca 0.00 -0.29 -0.19 0.00 -1.01 0.00 0.00 57.07 55.58 2byd s TYR 19 Cb 0.00 -1.11 0.09 0.00 -0.11 0.00 0.00 41.96 40.83 2byd s TYR 19 CO 0.00 0.63 1.45 0.12 -1.11 0.00 0.00 175.55 176.64 2byd s PHE 20 N -2.22 2.87 -0.28 2.71 5.36 -1.26 -4.85 117.98 120.32 2byd s PHE 20 Ca 0.28 -1.36 -0.22 0.00 -0.96 0.00 0.00 56.93 54.67 2byd s PHE 20 Cb -0.06 -4.57 0.11 0.00 -0.34 0.00 0.00 43.02 38.16 2byd s PHE 20 CO 0.16 -1.72 0.88 -1.14 -1.46 0.00 0.00 175.22 171.94 2byd s GLN 21 N 3.77 0.61 0.71 10.12 0.74 -1.26 -5.17 119.66 129.17 2byd s GLN 21 Ca 0.45 0.82 -0.11 0.00 0.05 0.00 0.00 55.36 56.56 2byd s GLN 21 Cb -0.00 0.25 0.01 0.00 1.10 0.00 0.00 33.01 34.37 2byd s GLN 21 CO -0.04 -0.09 1.08 0.20 -0.55 0.00 0.00 175.29 175.89 2byd s GLY 22 N 0.67 1.64 -0.07 2.59 0.00 -1.26 -5.06 107.32 105.83 2byd s GLY 22 Ca -0.02 -0.18 0.05 0.00 0.00 0.00 0.00 44.72 44.57 2byd s GLY 22 CO -0.08 0.17 -0.24 -2.38 0.00 0.00 0.00 173.10 170.57 2byd s HIS 23 N -3.22 2.43 0.26 1.90 -3.43 -1.26 -5.11 115.29 106.86 2byd s HIS 23 Ca 0.58 -0.84 -0.30 0.00 -0.80 0.00 0.00 55.06 53.70 2byd s HIS 23 Cb -0.12 -1.61 -0.10 0.00 -1.43 0.00 0.00 32.58 29.31 2byd s HIS 23 CO 0.53 -0.30 1.48 1.41 -2.00 0.00 0.00 174.74 175.87 2byd s MET 24 N 0.07 4.23 0.40 -0.38 1.75 -1.26 -5.03 119.30 119.07 2byd s MET 24 Ca -0.10 2.38 0.01 0.00 -1.25 0.00 0.00 55.69 56.73 2byd s MET 24 Cb -0.15 -3.09 0.01 0.00 2.84 0.00 0.00 34.83 34.44 2byd s MET 24 CO 0.06 -0.47 0.10 0.39 -0.65 0.00 0.00 175.02 174.44 2byd n GLU 25 N 2.26 1.00 -1.73 4.11 1.02 -1.26 -4.73 120.64 121.32 2byd n GLU 25 Ca 0.07 -2.75 -0.39 0.00 -0.02 0.00 0.00 57.16 54.06 2byd n GLU 25 Cb 0.39 0.60 0.03 0.00 -0.02 0.00 0.00 31.44 32.45 2byd n GLU 25 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2byd n GLY 26 N 0.25 0.68 3.25 0.62 0.00 -1.26 -4.57 105.19 104.16 2byd n GLY 26 Ca -0.11 0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 2byd n GLY 26 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2byd s VAL 27 N -1.26 1.92 -0.29 1.61 1.01 -0.10 -4.97 120.40 118.31 2byd s VAL 27 Ca 0.67 -1.01 -0.03 0.00 0.00 0.00 0.00 61.98 61.61 2byd s VAL 27 Cb -0.45 -1.62 0.10 0.00 0.00 0.00 0.00 36.38 34.41 2byd s VAL 27 CO 0.53 0.54 0.13 -0.13 0.00 0.00 0.00 175.10 176.16 2byd s ARG 28 N -0.26 0.28 0.06 2.72 1.81 -1.26 -1.81 118.95 120.49 2byd s ARG 28 Ca 0.00 -0.63 0.09 0.00 -1.72 0.00 0.00 55.73 53.47 2byd s ARG 28 Cb -0.12 -1.30 -0.03 0.00 -0.45 0.00 0.00 34.95 33.04 2byd s ARG 28 CO 0.02 -1.02 -0.23 -1.58 -0.68 0.00 0.00 175.30 171.82 2byd s TRP 29 N 2.01 2.43 0.06 -0.53 0.51 -0.28 -1.45 118.94 121.69 2byd s TRP 29 Ca 0.09 -0.34 0.04 0.00 -2.12 0.00 0.00 56.10 53.77 2byd s TRP 29 Cb -0.16 -1.40 -0.03 0.00 -0.81 0.00 0.00 33.47 31.07 2byd s TRP 29 CO -0.35 0.22 -0.11 0.00 -0.51 0.00 0.00 176.95 176.21 2byd s ALA 30 N -0.91 0.88 -0.06 0.98 0.00 0.06 -0.46 121.76 122.26 2byd s ALA 30 Ca 0.14 -0.91 -0.02 0.00 0.00 0.00 0.00 51.96 51.17 2byd s ALA 30 Cb -0.10 -0.02 0.04 0.00 0.00 0.00 0.00 23.12 23.04 2byd s ALA 30 CO 0.04 0.06 0.12 0.12 0.00 0.00 0.00 175.76 176.11 2byd s PHE 31 N -1.44 -0.12 -1.20 0.00 5.36 0.12 -0.03 117.98 120.67 2byd s PHE 31 Ca -0.05 0.43 -0.17 0.00 -0.96 0.00 0.00 56.93 56.18 2byd s PHE 31 Cb -0.09 -0.15 0.10 0.00 -0.34 0.00 0.00 43.02 42.54 2byd s PHE 31 CO 0.01 -0.17 1.55 0.45 -1.46 0.00 0.00 175.22 175.60 2byd s SER 32 N 1.34 6.85 0.45 6.13 0.15 -1.26 -0.87 113.70 126.50 2byd s SER 32 Ca -0.07 -2.46 0.18 0.00 0.70 0.00 0.00 55.95 54.29 2byd s SER 32 Cb -0.12 -2.51 1.07 0.00 -1.71 0.00 0.00 66.02 62.76 2byd s SER 32 CO -0.05 -1.07 1.98 0.00 1.20 0.00 0.00 173.24 175.30 2byd h GLY 34 N 0.74 0.00 -1.34 0.00 0.00 -1.29 -2.40 103.07 98.79 2byd h GLY 34 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2byd h GLY 34 CO 0.03 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.27 2byd n THR 35 N -4.47 0.54 -2.76 4.70 -2.24 -1.05 -4.97 114.28 104.04 2byd n THR 35 Ca -0.03 -0.77 -0.42 0.00 -2.27 0.00 0.00 64.05 60.56 2byd n THR 35 Cb 0.12 0.86 -0.03 0.00 -2.10 0.00 0.00 70.33 69.17 2byd n THR 35 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2byd s TRP 36 N -1.06 3.47 -0.58 4.78 -0.00 -0.90 -4.98 118.94 119.67 2byd s TRP 36 Ca 0.23 1.46 0.05 0.00 -0.00 0.00 0.00 56.10 57.84 2byd s TRP 36 Cb 0.13 -3.13 0.18 0.00 -0.00 0.00 0.00 33.47 30.66 2byd s TRP 36 CO 0.18 -0.24 0.47 1.28 -0.00 0.00 0.00 176.95 178.64 2byd n LEU 37 N 5.15 1.74 -4.77 5.86 4.77 -1.26 -4.99 117.00 123.51 2byd n LEU 37 Ca 0.07 -4.92 -0.37 0.00 -0.03 0.00 0.00 56.01 50.76 2byd n LEU 37 Cb 0.49 -0.23 -0.01 0.00 -2.33 0.00 0.00 43.42 41.34 2byd n LEU 37 CO 0.51 1.84 0.84 -2.16 -1.33 0.00 0.00 177.39 177.08 2byd s PRO 38 N -1.04 3.75 1.05 3.23 0.04 -1.26 -5.02 135.00 135.75 2byd s PRO 38 Ca 0.30 1.81 -0.11 0.00 0.04 0.00 0.00 61.00 63.03 2byd s PRO 38 Cb 0.02 -2.42 0.22 0.00 0.04 0.00 0.00 34.50 32.36 2byd s PRO 38 CO -0.16 -0.57 1.09 -1.54 0.04 0.00 0.00 177.00 175.85 2byd s SER 39 N -1.32 1.83 0.18 6.66 1.04 -1.26 -4.77 113.70 116.06 2byd s SER 39 Ca 0.63 1.88 -0.15 0.00 0.48 0.00 0.00 55.95 58.80 2byd s SER 39 Cb -0.29 -2.46 0.15 0.00 0.10 0.00 0.00 66.02 63.52 2byd s SER 39 CO 0.36 -3.73 1.69 -0.09 0.98 0.00 0.00 173.24 172.45 2byd h ARG 40 N -2.30 0.12 -0.75 4.02 2.43 -1.99 -1.53 114.38 114.37 2byd h ARG 40 Ca -0.53 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 58.66 2byd h ARG 40 Cb 1.30 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.78 2byd h ARG 40 CO 0.45 0.08 0.50 0.00 -1.51 0.00 0.00 179.97 179.49 2byd h ALA 41 N 1.39 1.51 -0.21 2.80 0.00 -1.98 -0.60 119.26 122.16 2byd h ALA 41 Ca 0.23 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.91 2byd h ALA 41 Cb 0.33 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2byd h ALA 41 CO -0.36 0.43 -0.60 0.93 0.00 0.00 0.00 179.25 179.65 2byd h GLU 42 N 0.97 0.70 -0.18 0.00 5.08 -1.77 -0.86 114.58 118.52 2byd h GLU 42 Ca 0.29 -0.47 -0.04 0.00 -1.00 0.00 0.00 59.36 58.14 2byd h GLU 42 Cb -0.03 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2byd h GLU 42 CO -0.07 1.09 -0.06 2.35 -1.00 0.00 0.00 179.01 181.32 2byd h TRP 43 N 0.52 0.40 0.00 4.33 2.91 -0.96 -1.80 115.95 121.35 2byd h TRP 43 Ca -0.00 -0.09 -0.05 0.00 1.13 0.00 0.00 58.89 59.88 2byd h TRP 43 Cb 1.18 -0.09 -0.01 0.00 -0.51 0.00 0.00 29.16 29.73 2byd h TRP 43 CO 0.06 0.63 -0.25 -0.07 -1.03 0.00 0.00 178.44 177.78 2byd h LEU 44 N 0.05 0.00 -0.12 0.65 3.38 -1.07 -1.78 115.31 116.42 2byd h LEU 44 Ca 0.04 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.86 2byd h LEU 44 Cb 0.51 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.27 2byd h LEU 44 CO 0.02 0.25 -0.53 0.25 0.09 0.00 0.00 178.44 178.52 2byd h LEU 45 N 0.00 0.67 -1.11 1.67 5.85 -1.04 -2.26 115.31 119.09 2byd h LEU 45 Ca -0.00 -0.63 0.08 0.00 0.84 0.00 0.00 57.88 58.17 2byd h LEU 45 Cb 0.65 -0.20 -0.07 0.00 0.37 0.00 0.00 40.66 41.42 2byd h LEU 45 CO 0.03 1.20 0.61 0.00 -0.34 0.00 0.00 178.44 179.94 2byd h ALA 46 N 0.49 1.52 -0.62 1.25 0.00 -0.98 -2.05 119.26 118.87 2byd h ALA 46 Ca -0.03 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 2byd h ALA 46 Cb 1.17 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 2byd h ALA 46 CO 0.11 0.31 0.04 0.28 0.00 0.00 0.00 179.25 179.99 2byd h VAL 47 N 1.02 1.26 0.00 0.00 2.07 -1.28 -2.41 116.25 116.92 2byd h VAL 47 Ca 0.42 -1.10 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 2byd h VAL 47 Cb 0.29 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 2byd h VAL 47 CO -0.18 0.41 -0.10 0.03 0.02 0.00 0.00 177.57 177.75 2byd h ARG 48 N 0.98 0.00 -0.02 1.57 3.08 -0.78 -3.28 114.38 115.93 2byd h ARG 48 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 2byd h ARG 48 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 2byd h ARG 48 CO 0.02 0.10 -0.04 0.43 -1.07 0.00 0.00 179.97 179.42 2byd n SER 49 N -3.44 1.76 -4.81 7.04 7.64 -0.84 0.76 113.62 121.72 2byd n SER 49 Ca -0.01 -1.54 -0.25 0.00 1.01 0.00 0.00 58.87 58.08 2byd n SER 49 Cb 0.26 0.03 -0.05 0.00 -1.01 0.00 0.00 64.21 63.43 2byd n SER 49 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2byd s ILE 50 N -2.06 2.14 0.49 0.44 -4.36 -1.22 -4.79 121.20 111.84 2byd s ILE 50 Ca 0.34 -1.60 -0.21 0.00 -0.26 0.00 0.00 60.65 58.92 2byd s ILE 50 Cb 0.21 -2.74 -0.08 0.00 1.25 0.00 0.00 42.46 41.10 2byd s ILE 50 CO 0.35 0.00 1.09 -1.10 0.24 0.00 0.00 174.94 175.52 2byd s GLN 51 N -4.04 3.71 0.21 0.37 -0.21 -1.26 -4.73 119.66 113.72 2byd s GLN 51 Ca 0.38 1.52 -0.09 0.00 0.02 0.00 0.00 55.36 57.19 2byd s GLN 51 Cb 0.01 -2.18 0.23 0.00 1.00 0.00 0.00 33.01 32.07 2byd s GLN 51 CO 0.22 -0.54 1.82 -1.35 -2.12 0.00 0.00 175.29 173.32 2byd h PRO 52 N 1.66 0.70 0.00 2.91 0.11 -1.96 -0.71 132.00 134.71 2byd h PRO 52 Ca -0.49 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.55 2byd h PRO 52 Cb 1.24 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 2byd h PRO 52 CO 0.59 0.47 -0.09 1.05 -0.21 0.00 0.00 178.00 179.80 2byd h GLU 53 N 0.72 0.00 0.23 1.05 9.09 -1.99 -1.18 114.58 122.51 2byd h GLU 53 Ca 0.29 0.00 -0.31 0.00 0.05 0.00 0.00 59.36 59.39 2byd h GLU 53 Cb 0.15 0.00 0.03 0.00 -1.65 0.00 0.00 28.75 27.28 2byd h GLU 53 CO -0.16 0.09 -1.39 0.93 0.05 0.00 0.00 179.01 178.54 2byd h GLU 54 N 0.00 0.49 -0.85 1.06 4.39 -1.62 -2.56 114.58 115.50 2byd h GLU 54 Ca -0.00 -0.84 0.10 0.00 0.34 0.00 0.00 59.36 58.95 2byd h GLU 54 Cb 0.53 0.31 -0.07 0.00 -0.10 0.00 0.00 28.75 29.42 2byd h GLU 54 CO 0.01 1.40 0.49 -0.22 -1.16 0.00 0.00 179.01 179.54 2byd h LYS 55 N 0.05 0.80 -0.65 2.33 3.64 -0.94 -1.69 116.57 120.11 2byd h LYS 55 Ca -0.25 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.10 2byd h LYS 55 Cb 2.07 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 33.68 2byd h LYS 55 CO 0.25 0.53 0.42 1.49 -2.27 0.00 0.00 179.45 179.87 2byd h GLU 56 N 0.83 0.82 -0.62 1.90 4.81 -1.19 -0.67 114.58 120.46 2byd h GLU 56 Ca 0.41 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.59 2byd h GLU 56 Cb 0.36 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 2byd h GLU 56 CO -0.24 0.55 0.38 0.00 -0.73 0.00 0.00 179.01 178.96 2byd h ARG 57 N 0.85 0.83 -0.49 1.92 3.08 -1.00 -2.59 114.38 116.98 2byd h ARG 57 Ca 0.25 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 60.18 2byd h ARG 57 Cb -0.05 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.80 2byd h ARG 57 CO -0.07 0.59 0.11 0.82 -1.07 0.00 0.00 179.97 180.35 2byd h ILE 58 N 0.84 1.21 0.00 2.04 2.04 -0.72 -0.70 117.51 122.23 2byd h ILE 58 Ca 0.22 -0.78 0.00 0.00 1.00 0.00 0.00 64.86 65.30 2byd h ILE 58 Cb -0.03 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 2byd h ILE 58 CO -0.04 0.29 0.00 1.23 0.00 0.00 0.00 178.15 179.62 2byd h GLY 59 N 0.93 0.00 2.00 5.37 0.00 -0.74 -2.83 103.07 107.80 2byd h GLY 59 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.42 2byd h GLY 59 CO -0.00 0.00 -0.36 1.46 0.00 0.00 0.00 176.54 177.64 2byd h GLN 60 N 0.00 0.00 -7.04 4.80 4.20 -0.99 -3.46 115.11 112.61 2byd h GLN 60 Ca 0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 2byd h GLN 60 Cb 0.17 0.00 0.11 0.00 0.30 0.00 0.00 27.48 28.06 2byd h GLN 60 CO 0.00 0.36 0.55 -0.06 -0.67 0.00 0.00 178.83 179.00 2byd s PHE 61 N -3.07 2.48 -0.13 2.96 0.08 -1.07 -4.97 117.98 114.26 2byd s PHE 61 Ca 0.04 1.45 -0.17 0.00 0.12 0.00 0.00 56.93 58.37 2byd s PHE 61 Cb 0.07 -3.62 -0.25 0.00 -0.57 0.00 0.00 43.02 38.65 2byd s PHE 61 CO 0.72 -2.36 0.49 0.28 -0.10 0.00 0.00 175.22 174.24 2byd h VAL 62 N 1.49 1.02 -2.95 -0.44 2.07 -1.90 -3.47 116.25 112.06 2byd h VAL 62 Ca -0.50 -2.35 -0.65 0.00 0.82 0.00 0.00 66.70 64.02 2byd h VAL 62 Cb 1.28 2.64 -0.08 0.00 -1.52 0.00 0.00 31.29 33.62 2byd h VAL 62 CO 0.58 0.64 -0.54 -0.36 0.02 0.00 0.00 177.57 177.91 2byd s PHE 63 N -2.45 3.41 0.36 1.57 0.08 -1.26 -0.05 117.98 119.64 2byd s PHE 63 Ca -0.22 0.29 0.04 0.00 0.12 0.00 0.00 56.93 57.17 2byd s PHE 63 Cb 0.04 -1.79 0.70 0.00 -0.57 0.00 0.00 43.02 41.40 2byd s PHE 63 CO 0.73 0.60 1.98 0.00 -0.10 0.00 0.00 175.22 178.43 2byd h ALA 64 N 4.07 1.64 0.00 5.36 0.00 -1.04 -2.03 119.26 127.26 2byd h ALA 64 Ca -0.49 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.33 2byd h ALA 64 Cb 1.19 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2byd h ALA 64 CO 0.65 0.28 -0.28 0.07 0.00 0.00 0.00 179.25 179.96 2byd h ARG 65 N 0.80 0.00 0.17 0.00 0.11 -1.94 0.99 114.38 114.50 2byd h ARG 65 Ca 0.28 0.00 -0.32 0.00 0.10 0.00 0.00 59.98 60.05 2byd h ARG 65 Cb 0.11 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.20 2byd h ARG 65 CO -0.08 0.28 -1.51 -0.44 0.10 0.00 0.00 179.97 178.32 2byd h ASP 66 N 0.00 0.55 -0.11 0.08 3.32 -1.78 -2.62 116.42 115.86 2byd h ASP 66 Ca -0.00 -0.69 -0.00 0.00 0.02 0.00 0.00 57.03 56.36 2byd h ASP 66 Cb 0.66 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 2byd h ASP 66 CO 0.04 1.56 0.06 0.00 -1.72 0.00 0.00 179.24 179.18 2byd h ALA 67 N 0.36 0.15 -0.82 3.45 0.00 -1.22 -1.61 119.26 119.56 2byd h ALA 67 Ca -0.25 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 54.68 2byd h ALA 67 Cb 2.06 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 19.74 2byd h ALA 67 CO 0.20 -0.32 0.49 0.87 0.00 0.00 0.00 179.25 180.49 2byd h LYS 68 N 0.09 0.84 -0.35 0.00 1.57 -0.88 0.46 116.57 118.30 2byd h LYS 68 Ca 0.04 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 2byd h LYS 68 Cb 0.08 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 2byd h LYS 68 CO -0.01 0.56 -0.09 0.00 -0.57 0.00 0.00 179.45 179.34 2byd h ALA 69 N 1.41 0.48 -0.43 3.86 0.00 -1.37 -1.42 119.26 121.79 2byd h ALA 69 Ca 0.37 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2byd h ALA 69 Cb 0.23 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2byd h ALA 69 CO -0.20 0.33 0.20 0.00 0.00 0.00 0.00 179.25 179.58 2byd h ALA 70 N 0.81 0.56 -0.51 0.00 0.00 -1.04 -2.43 119.26 116.65 2byd h ALA 70 Ca 0.09 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.94 2byd h ALA 70 Cb 0.59 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 2byd h ALA 70 CO 0.04 0.13 0.20 1.98 0.00 0.00 0.00 179.25 181.59 2byd h MET 71 N 0.55 0.38 -0.40 0.00 -1.53 -0.85 -2.31 114.93 110.77 2byd h MET 71 Ca 0.15 -0.02 0.03 0.00 -3.44 0.00 0.00 59.70 56.42 2byd h MET 71 Cb 0.13 -0.09 -0.04 0.00 -0.55 0.00 0.00 31.60 31.06 2byd h MET 71 CO -0.02 0.25 0.19 0.00 0.14 0.00 0.00 176.91 177.48 2byd h ALA 72 N 1.33 0.50 -0.78 0.39 0.00 -0.98 -1.32 119.26 118.39 2byd h ALA 72 Ca 0.24 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.17 2byd h ALA 72 Cb 0.24 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 2byd h ALA 72 CO -0.23 -0.17 0.50 0.78 0.00 0.00 0.00 179.25 180.14 2byd h GLY 73 N 0.40 1.10 0.88 0.00 0.00 -1.26 -0.79 103.07 103.40 2byd h GLY 73 Ca 0.17 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 2byd h GLY 73 CO -0.13 0.41 0.04 3.21 0.00 0.00 0.00 176.54 180.07 2byd h ARG 74 N 1.05 0.14 -0.68 4.80 2.47 -0.81 -2.25 114.38 119.11 2byd h ARG 74 Ca 0.28 -0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 58.95 2byd h ARG 74 Cb -0.10 -0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.16 2byd h ARG 74 CO -0.06 0.24 0.30 -0.07 0.56 0.00 0.00 179.97 180.94 2byd h LEU 75 N 0.02 0.89 -0.87 3.04 3.38 -1.06 -1.88 115.31 118.82 2byd h LEU 75 Ca 0.03 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 2byd h LEU 75 Cb 0.15 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2byd h LEU 75 CO -0.00 0.77 -0.17 0.24 0.09 0.00 0.00 178.44 179.37 2byd h MET 76 N 0.96 0.65 -0.10 1.13 2.86 -1.01 -0.01 114.93 119.42 2byd h MET 76 Ca 0.23 -0.23 -0.04 0.00 -2.06 0.00 0.00 59.70 57.61 2byd h MET 76 Cb 0.14 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.75 2byd h MET 76 CO -0.03 0.79 -0.08 0.82 1.06 0.00 0.00 176.91 179.47 2byd h ILE 77 N 0.59 1.35 -0.82 -1.22 2.04 -0.98 -0.14 117.51 118.33 2byd h ILE 77 Ca 0.09 -1.19 -0.03 0.00 1.00 0.00 0.00 64.86 64.73 2byd h ILE 77 Cb 0.62 1.93 -0.04 0.00 -0.74 0.00 0.00 36.82 38.59 2byd h ILE 77 CO 0.04 0.34 0.38 0.03 0.00 0.00 0.00 178.15 178.94 2byd h ARG 78 N -0.17 1.18 -0.30 2.37 3.08 -1.28 -0.68 114.38 118.58 2byd h ARG 78 Ca 0.02 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.89 2byd h ARG 78 Cb 0.57 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 2byd h ARG 78 CO 0.02 0.92 0.19 -0.22 -1.07 0.00 0.00 179.97 179.82 2byd h LYS 79 N 1.16 0.39 -0.28 0.04 3.64 -0.94 -0.01 116.57 120.57 2byd h LYS 79 Ca 0.28 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.69 2byd h LYS 79 Cb 0.14 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 31.81 2byd h LYS 79 CO -0.03 0.27 -0.10 1.25 -2.27 0.00 0.00 179.45 178.57 2byd h LEU 80 N 0.40 -0.34 -0.25 5.20 5.85 -0.53 -0.24 115.31 125.40 2byd h LEU 80 Ca 0.11 0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.84 2byd h LEU 80 Cb -0.04 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 2byd h LEU 80 CO -0.02 -0.13 -0.17 0.58 -0.34 0.00 0.00 178.44 178.36 2byd h VAL 81 N -0.04 1.31 -0.07 1.05 2.07 -0.96 -0.25 116.25 119.36 2byd h VAL 81 Ca 0.14 -1.29 -0.00 0.00 0.82 0.00 0.00 66.70 66.37 2byd h VAL 81 Cb 0.25 1.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.61 2byd h VAL 81 CO -0.31 0.40 0.04 0.00 0.02 0.00 0.00 177.57 177.72 2byd h ALA 82 N 0.71 0.10 0.00 1.67 0.00 -0.88 0.75 119.26 121.60 2byd h ALA 82 Ca 0.05 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 2byd h ALA 82 Cb 0.70 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2byd h ALA 82 CO 0.05 -0.38 -1.06 0.93 0.00 0.00 0.00 179.25 178.79 2byd h GLU 83 N 0.04 0.00 0.00 0.00 5.08 -1.03 -1.10 114.58 117.57 2byd h GLU 83 Ca 0.03 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.15 2byd h GLU 83 Cb 0.06 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.26 2byd h GLU 83 CO -0.00 0.24 -2.03 1.63 -1.00 0.00 0.00 179.01 177.85 2byd n LYS 84 N -2.91 1.27 0.00 2.33 4.76 -0.11 -4.51 118.16 118.99 2byd n LYS 84 Ca -0.04 -0.03 0.08 0.00 -2.87 0.00 0.00 58.31 55.44 2byd n LYS 84 Cb 0.73 -1.40 -0.01 0.00 -1.84 0.00 0.00 35.03 32.51 2byd n LYS 84 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2byd n LEU 85 N -2.50 1.54 -3.25 -0.35 4.77 0.23 -4.72 117.00 112.72 2byd n LEU 85 Ca -0.22 -0.75 -0.22 0.00 -0.03 0.00 0.00 56.01 54.79 2byd n LEU 85 Cb 0.91 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 42.07 2byd n LEU 85 CO 0.34 0.30 0.17 -3.20 -1.33 0.00 0.00 177.39 173.67 2byd n ASN 86 N -0.21 -6.05 -4.69 -1.43 5.15 -0.42 -4.90 115.26 102.72 2byd n ASN 86 Ca 0.06 -0.45 -0.37 0.00 -0.60 0.00 0.00 54.58 53.23 2byd n ASN 86 Cb 0.32 -4.72 -0.08 0.00 -0.53 0.00 0.00 39.78 34.78 2byd n ASN 86 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2byd s ILE 87 N -3.26 5.28 0.44 -1.44 1.01 -1.23 -5.03 121.20 116.98 2byd s ILE 87 Ca 0.48 0.50 -0.24 0.00 0.00 0.00 0.00 60.65 61.39 2byd s ILE 87 Cb -0.21 -3.63 -0.09 0.00 0.01 0.00 0.00 42.46 38.54 2byd s ILE 87 CO 0.60 0.33 1.14 -2.65 0.00 0.00 0.00 174.94 174.35 2byd n PRO 88 N 4.11 1.58 -0.24 2.79 -0.02 -1.26 -4.16 135.00 137.79 2byd n PRO 88 Ca -0.11 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 2byd n PRO 88 Cb 0.52 -2.23 0.12 0.00 -0.02 0.00 0.00 33.50 31.89 2byd n PRO 88 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 2byd h TRP 89 N 1.67 0.67 0.00 6.00 2.91 -1.93 0.06 115.95 125.32 2byd h TRP 89 Ca -0.47 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.58 2byd h TRP 89 Cb 1.32 -0.20 0.00 0.00 -0.51 0.00 0.00 29.16 29.77 2byd h TRP 89 CO 0.45 0.28 0.00 0.27 -1.03 0.00 0.00 178.44 178.41 2byd n ASN 90 N -4.82 0.12 -0.12 2.65 6.94 -1.26 -2.36 115.26 116.40 2byd n ASN 90 Ca 0.10 0.52 0.09 0.00 -0.02 0.00 0.00 54.58 55.27 2byd n ASN 90 Cb 0.23 -0.55 -0.08 0.00 -2.36 0.00 0.00 39.78 37.02 2byd n ASN 90 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 2byd n HIS 91 N -1.62 0.00 -1.91 -2.53 8.25 -0.08 -4.97 115.22 112.36 2byd n HIS 91 Ca 0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.08 2byd n HIS 91 Cb 0.22 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.31 2byd n HIS 91 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2byd s ILE 92 N -2.61 2.97 -0.38 1.59 1.01 -0.70 -4.94 121.20 118.14 2byd s ILE 92 Ca 0.09 0.44 0.04 0.00 0.00 0.00 0.00 60.65 61.22 2byd s ILE 92 Cb 0.15 -3.28 0.11 0.00 0.01 0.00 0.00 42.46 39.44 2byd s ILE 92 CO 0.69 0.00 0.11 -0.13 0.00 0.00 0.00 174.94 175.61 2byd s ARG 93 N 2.58 1.62 0.25 2.79 0.52 -1.26 -5.05 118.95 120.40 2byd s ARG 93 Ca 0.74 -2.05 -0.04 0.00 -0.52 0.00 0.00 55.73 53.87 2byd s ARG 93 Cb -0.41 -3.26 -0.05 0.00 0.52 0.00 0.00 34.95 31.76 2byd s ARG 93 CO 0.33 -0.98 0.49 -0.51 0.02 0.00 0.00 175.30 174.64 2byd s LEU 94 N 0.64 4.14 0.29 2.53 1.43 -1.26 -1.97 118.68 124.48 2byd s LEU 94 Ca 0.12 0.61 0.03 0.00 -1.03 0.00 0.00 54.13 53.86 2byd s LEU 94 Cb -0.21 -3.40 -0.03 0.00 0.03 0.00 0.00 46.19 42.58 2byd s LEU 94 CO -0.06 -0.12 0.27 -1.10 0.23 0.00 0.00 176.35 175.57 2byd s GLN 95 N -3.36 1.60 -0.01 1.70 -0.21 0.15 -4.89 119.66 114.64 2byd s GLN 95 Ca 0.42 -1.83 0.06 0.00 0.02 0.00 0.00 55.36 54.03 2byd s GLN 95 Cb -0.11 0.33 -0.02 0.00 1.00 0.00 0.00 33.01 34.21 2byd s GLN 95 CO 0.29 -0.59 -0.20 1.03 -2.12 0.00 0.00 175.29 173.70 2byd s ARG 96 N -3.64 1.57 1.00 2.91 0.52 -1.26 -0.42 118.95 119.64 2byd s ARG 96 Ca 0.38 -0.73 -0.11 0.00 -0.52 0.00 0.00 55.73 54.75 2byd s ARG 96 Cb 0.03 -1.54 0.19 0.00 0.52 0.00 0.00 34.95 34.16 2byd s ARG 96 CO 0.21 0.42 1.09 0.25 0.02 0.00 0.00 175.30 177.29 2byd n THR 97 N 2.50 0.00 0.30 0.02 -2.24 0.29 -4.79 114.28 110.35 2byd n THR 97 Ca -0.15 -0.15 0.15 0.00 -2.27 0.00 0.00 64.05 61.63 2byd n THR 97 Cb 0.53 -0.99 0.91 0.00 -2.10 0.00 0.00 70.33 68.68 2byd n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2byd h ALA 98 N -2.16 1.47 0.00 6.98 0.00 -2.01 0.38 119.26 123.93 2byd h ALA 98 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2byd h ALA 98 Cb 1.29 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2byd h ALA 98 CO 0.43 0.02 0.00 1.63 0.00 0.00 0.00 179.25 181.33 2byd n LYS 99 N -3.79 0.27 0.00 0.00 4.01 -1.26 -4.93 118.16 112.45 2byd n LYS 99 Ca -0.03 0.02 0.00 0.00 -0.51 0.00 0.00 58.31 57.79 2byd n LYS 99 Cb 0.10 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.12 2byd n LYS 99 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2byd n GLY 100 N 1.19 0.26 3.69 0.72 0.00 0.13 -5.07 105.19 106.12 2byd n GLY 100 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2byd n GLY 100 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2byd s LYS 101 N -0.92 4.33 0.23 1.61 2.20 -1.26 -4.56 119.74 121.37 2byd s LYS 101 Ca 0.00 1.85 -0.31 0.00 -0.36 0.00 0.00 55.97 57.15 2byd s LYS 101 Cb 0.00 -3.51 -0.10 0.00 -1.51 0.00 0.00 37.83 32.71 2byd s LYS 101 CO 0.00 -0.47 1.53 -2.14 -0.36 0.00 0.00 175.35 173.91 2byd s PRO 102 N 2.03 4.21 0.06 4.03 0.02 -1.26 -0.55 135.00 143.54 2byd s PRO 102 Ca 0.61 2.39 -0.01 0.00 0.02 0.00 0.00 61.00 64.01 2byd s PRO 102 Cb -0.29 -3.11 -0.04 0.00 0.02 0.00 0.00 34.50 31.08 2byd s PRO 102 CO 0.26 -0.54 -0.03 0.14 -0.33 0.00 0.00 177.00 176.49 2byd s VAL 103 N 0.45 0.27 0.05 3.83 -7.23 0.44 -4.93 120.40 113.29 2byd s VAL 103 Ca 0.65 -1.83 -0.24 0.00 -1.81 0.00 0.00 61.98 58.75 2byd s VAL 103 Cb -0.44 -1.56 -0.06 0.00 0.56 0.00 0.00 36.38 34.88 2byd s VAL 103 CO 0.39 -0.96 0.72 -0.22 -0.31 0.00 0.00 175.10 174.72 2byd s LEU 104 N -2.94 4.47 0.31 1.32 0.20 -1.26 -0.67 118.68 120.10 2byd s LEU 104 Ca 0.08 1.41 -0.28 0.00 0.69 0.00 0.00 54.13 56.03 2byd s LEU 104 Cb 0.08 -3.16 -0.13 0.00 -0.43 0.00 0.00 46.19 42.55 2byd s LEU 104 CO -0.09 0.08 1.15 0.00 -0.29 0.00 0.00 176.35 177.20 2byd n ALA 105 N 2.54 0.49 -0.18 5.97 0.00 -0.83 -4.89 120.51 123.60 2byd n ALA 105 Ca -0.04 0.38 -0.10 0.00 0.00 0.00 0.00 53.44 53.68 2byd n ALA 105 Cb 0.50 -2.13 0.01 0.00 0.00 0.00 0.00 19.45 17.82 2byd n ALA 105 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2byd h LYS 106 N 2.38 0.97 -5.48 0.00 1.79 -1.96 -3.40 116.57 110.87 2byd h LYS 106 Ca -0.43 -0.35 -0.50 0.00 -2.18 0.00 0.00 60.65 57.20 2byd h LYS 106 Cb 1.31 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.87 2byd h LYS 106 CO 0.62 1.02 1.65 -0.25 -1.08 0.00 0.00 179.45 181.41 2byd n ASP 107 N -4.22 1.76 0.00 0.86 9.92 -1.26 -4.78 116.55 118.83 2byd n ASP 107 Ca 0.01 -0.21 0.00 0.00 -0.53 0.00 0.00 54.79 54.06 2byd n ASP 107 Cb 0.38 -1.37 0.00 0.00 -0.64 0.00 0.00 41.12 39.49 2byd n ASP 107 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2byd n SER 108 N 13.71 0.00 -3.39 -2.24 7.64 -1.26 -4.95 113.62 123.14 2byd n SER 108 Ca 0.45 0.02 -0.23 0.00 1.01 0.00 0.00 58.87 60.12 2byd n SER 108 Cb 0.37 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.63 2byd n SER 108 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2byd n SER 109 N -0.32 -6.33 -3.49 6.43 2.88 -1.26 -5.02 113.62 106.51 2byd n SER 109 Ca 0.00 -0.45 -0.20 0.00 -1.33 0.00 0.00 58.87 56.89 2byd n SER 109 Cb 0.00 -5.02 -0.13 0.00 -0.75 0.00 0.00 64.21 58.31 2byd n SER 109 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2byd s ASN 110 N -3.09 1.81 0.00 -3.46 2.47 -1.26 -4.82 114.94 106.59 2byd s ASN 110 Ca 0.48 -0.51 0.30 0.00 0.42 0.00 0.00 52.86 53.55 2byd s ASN 110 Cb -0.21 0.25 1.43 0.00 -1.45 0.00 0.00 41.25 41.27 2byd s ASN 110 CO 0.60 -0.36 1.98 -0.81 -3.72 0.00 0.00 177.10 174.79 2byd n PRO 111 N 5.30 0.71 -3.57 0.43 -0.04 -1.26 -4.52 135.00 132.06 2byd n PRO 111 Ca -0.05 -0.16 -0.41 0.00 -0.04 0.00 0.00 63.50 62.85 2byd n PRO 111 Cb 0.48 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.36 2byd n PRO 111 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2byd s TYR 112 N -2.39 3.45 0.23 0.54 2.02 -1.26 -4.95 117.35 114.98 2byd s TYR 112 Ca 0.33 -1.96 -0.08 0.00 -0.37 0.00 0.00 57.07 54.98 2byd s TYR 112 Cb 0.20 -3.48 0.22 0.00 -0.40 0.00 0.00 41.96 38.51 2byd s TYR 112 CO 0.45 -0.99 1.89 -1.35 -1.57 0.00 0.00 175.55 173.98 2byd h PRO 113 N 8.33 1.07 -0.59 -1.71 0.11 -1.85 -2.95 132.00 134.41 2byd h PRO 113 Ca -0.18 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2byd h PRO 113 Cb 1.06 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.93 2byd h PRO 113 CO 0.84 0.71 0.00 0.09 -0.21 0.00 0.00 178.00 179.43 2byd n ASN 114 N -4.53 3.15 -4.69 -2.05 4.13 -1.26 -4.93 115.26 105.09 2byd n ASN 114 Ca 0.10 -2.26 -0.44 0.00 1.68 0.00 0.00 54.58 53.65 2byd n ASN 114 Cb 0.05 -0.45 -0.03 0.00 -1.54 0.00 0.00 39.78 37.81 2byd n ASN 114 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 2byd n PHE 115 N 0.65 2.47 -3.56 3.10 7.35 -0.83 -3.89 117.46 122.74 2byd n PHE 115 Ca 0.16 0.25 -0.12 0.00 -0.76 0.00 0.00 57.45 56.98 2byd n PHE 115 Cb 0.59 -2.56 -0.04 0.00 0.35 0.00 0.00 39.48 37.82 2byd n PHE 115 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2byd s ASN 116 N 0.75 -0.39 0.12 -2.13 6.03 -0.75 -5.02 114.94 113.56 2byd s ASN 116 Ca 0.73 -0.05 -0.03 0.00 -1.03 0.00 0.00 52.86 52.47 2byd s ASN 116 Cb -0.60 0.51 -0.03 0.00 -3.03 0.00 0.00 41.25 38.10 2byd s ASN 116 CO 0.41 -0.82 0.09 0.72 -2.03 0.00 0.00 177.10 175.47 2byd s PHE 117 N -3.25 0.64 0.04 1.54 -0.12 -1.26 -1.24 117.98 114.32 2byd s PHE 117 Ca -0.01 -1.05 -0.12 0.00 -0.05 0.00 0.00 56.93 55.70 2byd s PHE 117 Cb 0.00 -0.34 0.01 0.00 -0.63 0.00 0.00 43.02 42.06 2byd s PHE 117 CO -0.08 -0.53 0.25 1.21 -0.05 0.00 0.00 175.22 176.02 2byd s ASN 118 N -2.99 -0.06 0.09 1.98 3.04 0.03 -4.97 114.94 112.06 2byd s ASN 118 Ca 0.17 -0.25 0.01 0.00 0.04 0.00 0.00 52.86 52.84 2byd s ASN 118 Cb 0.07 0.32 -0.04 0.00 -1.54 0.00 0.00 41.25 40.05 2byd s ASN 118 CO -0.02 -0.57 -0.04 0.27 -3.04 0.00 0.00 177.10 173.70 2byd s ILE 119 N -2.43 0.52 0.18 -5.21 -4.36 -1.26 -1.61 121.20 107.04 2byd s ILE 119 Ca -0.06 -1.90 -0.19 0.00 -0.26 0.00 0.00 60.65 58.24 2byd s ILE 119 Cb -0.01 -1.70 0.04 0.00 1.25 0.00 0.00 42.46 42.03 2byd s ILE 119 CO -0.03 -0.85 0.54 -0.55 0.24 0.00 0.00 174.94 174.29 2byd s SER 120 N -3.02 -0.34 -0.10 4.36 0.15 -0.78 -4.84 113.70 109.13 2byd s SER 120 Ca 0.12 -0.34 -0.24 0.00 0.70 0.00 0.00 55.95 56.19 2byd s SER 120 Cb 0.06 0.58 0.06 0.00 -1.71 0.00 0.00 66.02 65.01 2byd s SER 120 CO -0.05 -1.02 0.58 -1.38 1.20 0.00 0.00 173.24 172.57 2byd s HIS 121 N -3.83 -0.57 -0.22 3.44 -3.43 -1.26 -0.76 115.29 108.66 2byd s HIS 121 Ca 0.06 1.14 -0.29 0.00 -0.80 0.00 0.00 55.06 55.16 2byd s HIS 121 Cb -0.01 0.29 0.15 0.00 -1.43 0.00 0.00 32.58 31.58 2byd s HIS 121 CO -0.06 -0.47 1.15 -1.14 -2.00 0.00 0.00 174.74 172.23 2byd s GLN 122 N -0.70 0.36 7.88 -0.38 0.74 -0.69 -4.85 119.66 122.03 2byd s GLN 122 Ca -0.08 0.10 0.00 0.00 0.05 0.00 0.00 55.36 55.44 2byd s GLN 122 Cb -0.02 0.17 0.00 0.00 1.10 0.00 0.00 33.01 34.26 2byd s GLN 122 CO 0.06 -0.11 0.00 0.41 -0.55 0.00 0.00 175.29 175.10 2byd n GLY 123 N 0.71 3.66 0.36 2.59 0.00 -1.26 -2.31 105.19 108.95 2byd n GLY 123 Ca -0.06 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.03 2byd n GLY 123 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2byd n ASP 124 N 6.68 1.38 -4.22 1.61 8.00 -1.26 -4.69 116.55 124.05 2byd n ASP 124 Ca 0.00 -1.16 -0.27 0.00 0.71 0.00 0.00 54.79 54.07 2byd n ASP 124 Cb 0.00 0.17 -0.15 0.00 -0.02 0.00 0.00 41.12 41.12 2byd n ASP 124 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2byd s TYR 125 N -2.39 1.84 -0.03 1.24 2.02 -0.98 -0.88 117.35 118.16 2byd s TYR 125 Ca 0.26 -0.35 0.01 0.00 -0.37 0.00 0.00 57.07 56.62 2byd s TYR 125 Cb 0.19 -1.17 -0.03 0.00 -0.40 0.00 0.00 41.96 40.55 2byd s TYR 125 CO 0.49 -0.02 -0.05 0.00 -1.57 0.00 0.00 175.55 174.41 2byd s ALA 126 N -0.51 3.09 0.05 3.71 0.00 -0.05 -1.71 121.76 126.34 2byd s ALA 126 Ca 0.08 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 51.13 2byd s ALA 126 Cb -0.08 -1.25 -0.03 0.00 0.00 0.00 0.00 23.12 21.76 2byd s ALA 126 CO -0.01 0.60 -0.08 0.14 0.00 0.00 0.00 175.76 176.41 2byd s VAL 127 N -0.94 0.63 -0.02 0.00 -7.23 0.06 -0.70 120.40 112.21 2byd s VAL 127 Ca 0.15 -1.23 0.02 0.00 -1.81 0.00 0.00 61.98 59.11 2byd s VAL 127 Cb -0.11 -0.82 0.01 0.00 0.56 0.00 0.00 36.38 36.02 2byd s VAL 127 CO 0.05 -0.44 -0.06 -0.22 -0.31 0.00 0.00 175.10 174.13 2byd s LEU 128 N -1.82 1.69 -0.04 1.32 0.20 0.40 -1.86 118.68 118.57 2byd s LEU 128 Ca -0.06 -0.12 0.07 0.00 0.69 0.00 0.00 54.13 54.71 2byd s LEU 128 Cb -0.08 -0.39 -0.02 0.00 -0.43 0.00 0.00 46.19 45.27 2byd s LEU 128 CO -0.00 0.02 -0.25 0.00 -0.29 0.00 0.00 176.35 175.83 2byd s ALA 129 N 0.34 2.18 0.04 5.97 0.00 -0.63 -1.13 121.76 128.53 2byd s ALA 129 Ca -0.04 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 50.84 2byd s ALA 129 Cb -0.08 -0.63 -0.03 0.00 0.00 0.00 0.00 23.12 22.38 2byd s ALA 129 CO -0.00 0.47 -0.05 0.00 0.00 0.00 0.00 175.76 176.18 2byd s ALA 130 N -0.38 0.41 -0.02 0.00 0.00 -0.75 -0.79 121.76 120.23 2byd s ALA 130 Ca 0.03 -0.84 -0.03 0.00 0.00 0.00 0.00 51.96 51.12 2byd s ALA 130 Cb -0.12 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.15 2byd s ALA 130 CO 0.01 -0.17 0.07 -1.21 0.00 0.00 0.00 175.76 174.47 2byd s GLU 131 N -2.24 0.15 0.29 0.00 0.41 -0.37 -0.93 118.70 116.01 2byd s GLU 131 Ca -0.07 -0.00 0.04 0.00 -0.41 0.00 0.00 54.97 54.53 2byd s GLU 131 Cb -0.05 0.06 0.43 0.00 -1.78 0.00 0.00 34.13 32.80 2byd s GLU 131 CO -0.03 -0.02 1.71 -1.00 -0.49 0.00 0.00 175.26 175.43 2byd h PRO 132 N 5.75 0.37 0.00 0.39 0.13 -1.84 -1.98 132.00 134.81 2byd h PRO 132 Ca -0.26 -0.15 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2byd h PRO 132 Cb 1.20 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2byd h PRO 132 CO 0.45 0.66 -0.41 -0.85 -0.23 0.00 0.00 178.00 177.61 2byd n GLU 133 N -4.08 0.52 -2.54 0.86 0.00 -1.25 -1.97 120.64 112.19 2byd n GLU 133 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 57.16 56.75 2byd n GLU 133 Cb 0.44 -0.71 -0.05 0.00 0.00 0.00 0.00 31.44 31.13 2byd n GLU 133 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2byd s LEU 134 N -3.33 4.55 0.16 -1.84 1.43 -1.26 -4.84 118.68 113.55 2byd s LEU 134 Ca 0.00 2.19 -0.31 0.00 -1.03 0.00 0.00 54.13 54.98 2byd s LEU 134 Cb 0.00 -3.65 -0.09 0.00 0.03 0.00 0.00 46.19 42.48 2byd s LEU 134 CO 0.00 -0.10 1.44 -1.58 0.23 0.00 0.00 176.35 176.35 2byd s GLN 135 N -1.45 4.29 -0.01 1.70 0.74 -0.73 -4.61 119.66 119.59 2byd s GLN 135 Ca 0.44 2.20 0.03 0.00 0.05 0.00 0.00 55.36 58.08 2byd s GLN 135 Cb -0.30 -3.19 -0.01 0.00 1.10 0.00 0.00 33.01 30.61 2byd s GLN 135 CO 0.38 -0.46 -0.10 0.54 -0.55 0.00 0.00 175.29 175.10 2byd s VAL 136 N 0.79 0.80 0.07 1.34 0.11 -1.26 -1.03 120.40 121.21 2byd s VAL 136 Ca 0.64 -0.43 0.05 0.00 -2.93 0.00 0.00 61.98 59.32 2byd s VAL 136 Cb -0.40 -0.67 -0.03 0.00 -1.53 0.00 0.00 36.38 33.75 2byd s VAL 136 CO 0.34 0.23 -0.15 -0.83 -3.33 0.00 0.00 175.10 171.36 2byd s GLY 137 N -0.22 0.89 0.00 6.54 0.00 0.12 -4.46 107.32 110.20 2byd s GLY 137 Ca 0.04 -1.00 0.01 0.00 0.00 0.00 0.00 44.72 43.76 2byd s GLY 137 CO -0.00 -1.02 -0.02 -1.50 0.00 0.00 0.00 173.10 170.55 2byd s ILE 138 N -1.23 0.17 -0.07 0.90 2.07 -1.26 -0.10 121.20 121.69 2byd s ILE 138 Ca -0.01 -0.25 -0.09 0.00 -1.41 0.00 0.00 60.65 58.89 2byd s ILE 138 Cb -0.10 -0.18 0.02 0.00 0.13 0.00 0.00 42.46 42.33 2byd s ILE 138 CO 0.02 -0.05 0.23 -0.62 -1.91 0.00 0.00 174.94 172.61 2byd s ASP 139 N -0.32 -0.20 -0.00 4.50 2.15 -0.42 -4.59 116.67 117.80 2byd s ASP 139 Ca -0.02 0.35 0.08 0.00 0.43 0.00 0.00 52.55 53.39 2byd s ASP 139 Cb -0.02 0.43 -0.02 0.00 -0.30 0.00 0.00 42.92 43.00 2byd s ASP 139 CO -0.00 -0.15 -0.25 -0.51 -0.17 0.00 0.00 175.17 174.08 2byd s ILE 140 N -0.21 2.02 0.01 4.11 2.07 -1.26 -0.97 121.20 126.98 2byd s ILE 140 Ca -0.03 -1.17 0.01 0.00 -1.41 0.00 0.00 60.65 58.05 2byd s ILE 140 Cb -0.03 -1.70 -0.01 0.00 0.13 0.00 0.00 42.46 40.86 2byd s ILE 140 CO 0.01 0.50 -0.03 -0.04 -1.91 0.00 0.00 174.94 173.47 2byd s MET 141 N -0.79 0.26 -0.23 3.50 -1.94 0.03 -4.53 119.30 115.60 2byd s MET 141 Ca 0.10 -0.24 -0.16 0.00 -1.71 0.00 0.00 55.69 53.68 2byd s MET 141 Cb -0.10 -0.17 -0.04 0.00 2.01 0.00 0.00 34.83 36.54 2byd s MET 141 CO -0.00 0.04 0.42 0.21 -0.01 0.00 0.00 175.02 175.68 2byd s LYS 142 N -0.44 4.12 -0.09 2.03 2.20 -1.26 -0.74 119.74 125.56 2byd s LYS 142 Ca -0.03 0.20 -0.30 0.00 -0.36 0.00 0.00 55.97 55.49 2byd s LYS 142 Cb -0.03 -3.59 -0.04 0.00 -1.51 0.00 0.00 37.83 32.66 2byd s LYS 142 CO -0.00 -0.16 1.46 0.99 -0.36 0.00 0.00 175.35 177.27 2byd s THR 143 N 1.70 3.89 0.02 3.43 2.01 -0.10 -5.01 115.64 121.59 2byd s THR 143 Ca 0.19 1.11 -0.14 0.00 0.31 0.00 0.00 61.69 63.16 2byd s THR 143 Cb -0.15 -3.71 0.02 0.00 0.01 0.00 0.00 72.50 68.66 2byd s THR 143 CO 0.09 -0.08 0.29 -0.94 -0.69 0.00 0.00 174.62 173.29 2byd s SER 144 N 2.56 -0.13 0.32 3.53 1.04 -1.26 -4.94 113.70 114.82 2byd s SER 144 Ca 0.64 -0.11 -0.29 0.00 0.48 0.00 0.00 55.95 56.67 2byd s SER 144 Cb -0.28 0.33 -0.10 0.00 0.10 0.00 0.00 66.02 66.07 2byd s SER 144 CO 0.23 -0.55 1.35 0.12 0.98 0.00 0.00 173.24 175.38 2byd s PHE 145 N -2.10 2.99 0.32 5.02 5.36 -1.26 -4.93 117.98 123.38 2byd s PHE 145 Ca -0.08 1.31 -0.25 0.00 -0.96 0.00 0.00 56.93 56.94 2byd s PHE 145 Cb -0.03 -3.75 -0.15 0.00 -0.34 0.00 0.00 43.02 38.76 2byd s PHE 145 CO -0.01 -2.15 0.57 -2.30 -1.46 0.00 0.00 175.22 169.87 2byd n PRO 146 N 1.09 0.48 0.16 10.12 -0.02 -1.26 -4.90 135.00 140.67 2byd n PRO 146 Ca 0.02 0.17 0.02 0.00 -2.02 0.00 0.00 63.50 61.68 2byd n PRO 146 Cb 0.41 -1.35 0.26 0.00 -0.02 0.00 0.00 33.50 32.80 2byd n PRO 146 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2byd h GLY 147 N 1.04 0.00 -4.89 -1.23 0.00 -1.80 -3.44 103.07 92.74 2byd h GLY 147 Ca -0.36 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 46.81 2byd h GLY 147 CO 0.54 0.00 -0.63 -1.60 0.00 0.00 0.00 176.54 174.85 2byd s ARG 148 N -3.71 0.37 0.84 4.80 3.00 -1.22 -3.83 118.95 119.20 2byd s ARG 148 Ca -0.01 -0.55 0.00 0.00 -1.00 0.00 0.00 55.73 54.17 2byd s ARG 148 Cb 0.12 0.14 0.00 0.00 0.00 0.00 0.00 34.95 35.22 2byd s ARG 148 CO 0.73 -0.07 0.00 0.41 0.00 0.00 0.00 175.30 176.37 2byd n GLY 149 N 1.54 -1.75 3.99 8.12 0.00 -1.26 -4.91 105.19 110.91 2byd n GLY 149 Ca -0.24 -1.24 -0.23 0.00 0.00 0.00 0.00 46.02 44.31 2byd n GLY 149 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2byd s SER 150 N -4.60 4.46 0.00 1.61 1.04 -1.26 -4.78 113.70 110.16 2byd s SER 150 Ca 0.00 -0.31 -0.23 0.00 0.48 0.00 0.00 55.95 55.89 2byd s SER 150 Cb 0.00 -0.13 -0.18 0.00 0.10 0.00 0.00 66.02 65.81 2byd s SER 150 CO 0.00 -1.78 1.23 0.40 0.98 0.00 0.00 173.24 174.07 2byd h ILE 151 N -0.46 1.41 -0.90 -1.02 2.04 -1.98 -1.46 117.51 115.14 2byd h ILE 151 Ca -0.37 -1.48 0.09 0.00 1.00 0.00 0.00 64.86 64.10 2byd h ILE 151 Cb 1.27 2.21 -0.07 0.00 -0.74 0.00 0.00 36.82 39.50 2byd h ILE 151 CO 0.42 0.42 0.58 -0.65 0.00 0.00 0.00 178.15 178.92 2byd h PRO 152 N -0.25 0.90 -0.40 2.37 0.11 -1.98 0.86 132.00 133.61 2byd h PRO 152 Ca 0.00 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.00 2byd h PRO 152 Cb 0.75 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.64 2byd h PRO 152 CO 0.04 0.59 -0.00 0.93 -0.21 0.00 0.00 178.00 179.35 2byd h GLU 153 N 0.92 0.64 -0.33 1.05 5.08 -1.93 -1.56 114.58 118.46 2byd h GLU 153 Ca 0.42 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.56 2byd h GLU 153 Cb 0.38 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 2byd h GLU 153 CO -0.18 0.66 -0.07 0.35 -1.00 0.00 0.00 179.01 178.77 2byd h PHE 154 N 0.60 0.70 -0.25 4.33 3.57 -0.12 -1.82 116.94 123.95 2byd h PHE 154 Ca 0.12 -0.15 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 2byd h PHE 154 Cb 0.38 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 2byd h PHE 154 CO 0.02 0.79 0.12 0.74 -2.23 0.00 0.00 178.31 177.75 2byd h PHE 155 N 0.41 0.33 -0.08 0.41 0.04 -0.61 -1.55 116.94 115.88 2byd h PHE 155 Ca 0.08 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.81 2byd h PHE 155 Cb 0.55 -0.11 -0.00 0.00 2.20 0.00 0.00 35.95 38.60 2byd h PHE 155 CO 0.05 0.24 -0.12 1.25 -0.60 0.00 0.00 178.31 179.13 2byd h HIS 156 N 0.34 0.28 -0.98 -0.55 2.76 -1.05 0.78 115.15 116.73 2byd h HIS 156 Ca 0.09 -0.09 0.19 0.00 -2.20 0.00 0.00 60.37 58.36 2byd h HIS 156 Cb 0.03 -0.06 -0.10 0.00 1.55 0.00 0.00 27.41 28.84 2byd h HIS 156 CO 0.00 0.70 0.61 0.82 -1.30 0.00 0.00 177.93 178.76 2byd h ILE 157 N -0.22 0.71 -0.13 6.26 5.03 -1.06 -2.18 117.51 125.92 2byd h ILE 157 Ca 0.01 -0.24 0.00 0.00 -0.12 0.00 0.00 64.86 64.51 2byd h ILE 157 Cb 0.67 -0.04 0.00 0.00 -3.03 0.00 0.00 36.82 34.42 2byd h ILE 157 CO 0.03 0.13 0.00 0.23 -0.68 0.00 0.00 178.15 177.85 2byd n MET 158 N -4.69 2.04 -0.33 2.37 2.81 -0.61 -4.56 117.12 114.16 2byd n MET 158 Ca 0.22 -1.54 0.11 0.00 -1.81 0.00 0.00 57.70 54.68 2byd n MET 158 Cb 0.60 -1.46 0.29 0.00 -0.71 0.00 0.00 33.22 31.93 2byd n MET 158 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 2byd h LYS 159 N 3.42 0.64 0.00 0.03 3.64 -0.16 -2.18 116.57 121.96 2byd h LYS 159 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2byd h LYS 159 Cb 0.74 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 2byd h LYS 159 CO 0.00 0.42 0.00 0.54 -2.27 0.00 0.00 179.45 178.14 2byd n ARG 160 N -4.85 0.14 0.00 1.90 1.74 -1.26 -3.04 116.66 111.30 2byd n ARG 160 Ca 0.21 0.36 0.12 0.00 -0.77 0.00 0.00 57.85 57.77 2byd n ARG 160 Cb 0.54 -1.76 0.24 0.00 -1.02 0.00 0.00 32.46 30.45 2byd n ARG 160 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2byd n LYS 161 N -2.03 0.12 -4.19 5.56 5.02 -0.82 -4.13 118.16 117.69 2byd n LYS 161 Ca 0.03 -0.07 -0.19 0.00 -2.02 0.00 0.00 58.31 56.05 2byd n LYS 161 Cb 0.22 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.62 2byd n LYS 161 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2byd s PHE 162 N -2.93 1.29 0.84 2.13 0.08 -1.17 -4.00 117.98 114.22 2byd s PHE 162 Ca 0.13 -0.47 -0.10 0.00 0.12 0.00 0.00 56.93 56.60 2byd s PHE 162 Cb 0.18 -0.72 0.14 0.00 -0.57 0.00 0.00 43.02 42.05 2byd s PHE 162 CO 0.69 0.08 1.17 0.95 -0.10 0.00 0.00 175.22 178.01 2byd s THR 163 N -1.39 2.09 0.09 0.64 -4.23 -1.26 -4.83 115.64 106.75 2byd s THR 163 Ca 0.00 -0.18 -0.23 0.00 -1.18 0.00 0.00 61.69 60.10 2byd s THR 163 Cb -0.09 -2.90 -0.14 0.00 1.34 0.00 0.00 72.50 70.70 2byd s THR 163 CO 0.02 0.00 1.74 -1.13 -0.54 0.00 0.00 174.62 174.72 2byd h ASN 164 N -1.12 0.00 -0.80 3.99 -1.24 -1.98 -1.49 115.58 112.93 2byd h ASN 164 Ca -0.43 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 56.56 2byd h ASN 164 Cb 1.27 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 40.28 2byd h ASN 164 CO 0.46 0.00 0.40 0.11 -1.29 0.00 0.00 177.43 177.12 2byd h LYS 165 N 0.01 1.15 -0.27 6.67 1.57 -1.99 -1.20 116.57 122.50 2byd h LYS 165 Ca 0.00 -0.16 0.01 0.00 -1.87 0.00 0.00 60.65 58.63 2byd h LYS 165 Cb 0.00 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 2byd h LYS 165 CO -0.01 0.88 0.16 0.93 -0.57 0.00 0.00 179.45 180.84 2byd h GLU 166 N 1.13 0.32 -0.71 3.15 5.08 -1.83 -1.92 114.58 119.80 2byd h GLU 166 Ca 0.28 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.58 2byd h GLU 166 Cb 0.10 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 2byd h GLU 166 CO -0.04 0.21 0.28 -1.49 -1.00 0.00 0.00 179.01 176.98 2byd h TRP 167 N 0.33 1.10 -0.68 4.33 -0.00 -1.01 0.15 115.95 120.18 2byd h TRP 167 Ca 0.10 -0.09 0.01 0.00 -0.00 0.00 0.00 58.89 58.92 2byd h TRP 167 Cb -0.01 -0.33 -0.03 0.00 -0.00 0.00 0.00 29.16 28.79 2byd h TRP 167 CO -0.07 0.85 0.44 0.93 -0.00 0.00 0.00 178.44 180.59 2byd h GLU 168 N 1.03 0.88 -0.35 0.49 5.08 -1.08 0.36 114.58 120.99 2byd h GLU 168 Ca 0.24 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.49 2byd h GLU 168 Cb 0.22 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 2byd h GLU 168 CO -0.02 0.58 0.02 1.15 -1.00 0.00 0.00 179.01 179.74 2byd h THR 169 N 0.90 1.25 -0.03 1.13 2.02 -1.00 -0.78 112.91 116.40 2byd h THR 169 Ca 0.25 -0.93 0.02 0.00 0.77 0.00 0.00 66.41 66.52 2byd h THR 169 Cb -0.09 1.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.47 2byd h THR 169 CO -0.06 0.31 -0.11 0.40 0.37 0.00 0.00 175.52 176.43 2byd h ILE 170 N 0.42 0.71 0.00 3.11 2.04 -0.22 -2.83 117.51 120.75 2byd h ILE 170 Ca 0.10 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.96 2byd h ILE 170 Cb 0.42 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 37.21 2byd h ILE 170 CO 0.01 0.00 0.00 0.54 0.00 0.00 0.00 178.15 178.70 2byd n ARG 171 N -5.24 0.69 0.28 2.37 1.74 0.12 -3.89 116.66 112.73 2byd n ARG 171 Ca -0.05 0.01 0.19 0.00 -0.77 0.00 0.00 57.85 57.23 2byd n ARG 171 Cb 0.17 -1.50 0.86 0.00 -1.02 0.00 0.00 32.46 30.97 2byd n ARG 171 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2byd h SER 172 N 0.00 0.00 -3.83 0.55 4.64 -0.87 -3.44 113.55 110.61 2byd h SER 172 Ca 0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 2byd h SER 172 Cb 0.11 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.22 2byd h SER 172 CO 0.00 0.00 0.19 -0.36 -0.87 0.00 0.00 176.83 175.79 2byd s PHE 173 N -3.81 3.51 -0.05 4.77 0.08 -1.25 -5.02 117.98 116.21 2byd s PHE 173 Ca -0.01 1.09 -0.16 0.00 0.12 0.00 0.00 56.93 57.97 2byd s PHE 173 Cb 0.10 -2.50 -0.31 0.00 -0.57 0.00 0.00 43.02 39.75 2byd s PHE 173 CO 0.47 -0.26 0.74 1.57 -0.10 0.00 0.00 175.22 177.64 2byd h LYS 174 N 0.78 0.36 -6.25 0.44 -0.00 -1.95 -3.45 116.57 106.51 2byd h LYS 174 Ca -0.47 -0.62 -0.57 0.00 -0.00 0.00 0.00 60.65 58.99 2byd h LYS 174 Cb 1.19 0.23 -0.04 0.00 -0.00 0.00 0.00 32.23 33.61 2byd h LYS 174 CO 0.63 1.30 -0.08 0.16 -0.00 0.00 0.00 179.45 181.46 2byd s ASP 175 N -7.21 6.93 0.54 7.07 1.47 -1.26 -4.99 116.67 119.22 2byd s ASP 175 Ca -0.15 1.15 0.33 0.00 1.18 0.00 0.00 52.55 55.05 2byd s ASP 175 Cb 0.04 -2.32 1.39 0.00 -0.34 0.00 0.00 42.92 41.70 2byd s ASP 175 CO 0.84 0.21 2.00 -0.33 0.68 0.00 0.00 175.17 178.57 2byd h GLU 176 N 4.13 0.00 -0.30 2.11 5.08 -1.99 -2.66 114.58 120.94 2byd h GLU 176 Ca -0.49 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.79 2byd h GLU 176 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2byd h GLU 176 CO 0.64 0.05 -0.12 2.35 -1.00 0.00 0.00 179.01 180.93 2byd h TRP 177 N 0.00 0.69 -0.55 4.33 2.91 -1.99 0.12 115.95 121.46 2byd h TRP 177 Ca -0.00 -0.16 -0.08 0.00 1.13 0.00 0.00 58.89 59.77 2byd h TRP 177 Cb 0.49 -0.16 -0.02 0.00 -0.51 0.00 0.00 29.16 28.96 2byd h TRP 177 CO 0.00 0.82 0.02 1.15 -1.03 0.00 0.00 178.44 179.41 2byd h THR 178 N 0.36 1.25 -0.13 2.65 2.02 -1.90 0.12 112.91 117.29 2byd h THR 178 Ca 0.07 -1.05 0.02 0.00 0.77 0.00 0.00 66.41 66.22 2byd h THR 178 Cb 0.63 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.82 2byd h THR 178 CO 0.04 0.38 -0.01 1.56 0.37 0.00 0.00 175.52 177.86 2byd h GLN 179 N 0.87 0.03 -0.94 6.66 4.20 -1.45 -0.02 115.11 124.46 2byd h GLN 179 Ca 0.17 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.87 2byd h GLN 179 Cb 0.48 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.21 2byd h GLN 179 CO 0.02 0.02 0.57 1.25 -0.67 0.00 0.00 178.83 180.02 2byd h LEU 180 N 0.03 1.13 -0.14 1.46 5.85 -0.35 0.34 115.31 123.62 2byd h LEU 180 Ca 0.06 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2byd h LEU 180 Cb 0.07 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 2byd h LEU 180 CO -0.11 0.86 0.08 -0.78 -0.34 0.00 0.00 178.44 178.15 2byd h ASP 181 N 1.29 0.14 -0.33 1.25 3.58 -0.49 -1.54 116.42 120.31 2byd h ASP 181 Ca 0.34 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.74 2byd h ASP 181 Cb -0.07 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 40.94 2byd h ASP 181 CO -0.06 0.10 0.07 -0.03 -2.88 0.00 0.00 179.24 176.43 2byd h MET 182 N 0.17 0.63 0.34 0.28 4.05 -0.66 -2.16 114.93 117.58 2byd h MET 182 Ca 0.05 -0.12 -0.02 0.00 -0.28 0.00 0.00 59.70 59.33 2byd h MET 182 Cb -0.01 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 30.70 2byd h MET 182 CO -0.02 0.60 -0.16 0.35 0.23 0.00 0.00 176.91 177.91 2byd h PHE 183 N 0.61 -0.42 -0.76 1.39 3.57 -0.71 -1.51 116.94 119.11 2byd h PHE 183 Ca 0.14 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.72 2byd h PHE 183 Cb 0.28 0.14 -0.05 0.00 2.79 0.00 0.00 35.95 39.11 2byd h PHE 183 CO 0.01 -0.21 0.50 1.88 -2.23 0.00 0.00 178.31 178.26 2byd h TYR 184 N -0.52 0.71 0.28 0.41 -1.99 -1.15 0.14 116.97 114.85 2byd h TYR 184 Ca -0.05 0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.69 2byd h TYR 184 Cb 0.39 -0.23 0.00 0.00 2.00 0.00 0.00 36.73 38.90 2byd h TYR 184 CO -0.03 0.33 -0.13 -0.09 -0.00 0.00 0.00 178.16 178.23 2byd h ARG 185 N 0.66 -0.36 -1.01 4.88 2.43 -1.27 0.13 114.38 119.84 2byd h ARG 185 Ca 0.35 0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.62 2byd h ARG 185 Cb 0.47 0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 30.03 2byd h ARG 185 CO -0.13 -0.19 0.65 -0.97 -1.51 0.00 0.00 179.97 177.82 2byd h ASN 186 N -0.44 1.02 -0.32 -3.80 -0.00 -0.81 -0.48 115.58 110.74 2byd h ASN 186 Ca -0.04 0.02 -0.15 0.00 -0.00 0.00 0.00 56.30 56.13 2byd h ASN 186 Cb 0.33 -0.19 -0.00 0.00 -0.00 0.00 0.00 38.32 38.46 2byd h ASN 186 CO 0.06 0.62 -0.40 -0.25 -0.00 0.00 0.00 177.43 177.46 2byd h TRP 187 N 1.13 1.02 -0.77 0.67 7.01 -0.78 -2.69 115.95 121.54 2byd h TRP 187 Ca 0.45 -0.33 -0.02 0.00 2.11 0.00 0.00 58.89 61.11 2byd h TRP 187 Cb 0.26 -0.21 -0.04 0.00 -2.10 0.00 0.00 29.16 27.07 2byd h TRP 187 CO -0.00 1.13 0.41 0.00 -2.79 0.00 0.00 178.44 177.19 2byd h ALA 188 N 0.72 0.99 -0.58 2.65 0.00 -0.48 -1.80 119.26 120.75 2byd h ALA 188 Ca 0.04 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 54.91 2byd h ALA 188 Cb 0.99 -0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.40 2byd h ALA 188 CO 0.09 0.52 0.20 -0.07 0.00 0.00 0.00 179.25 180.00 2byd h LEU 189 N 1.08 0.17 -0.35 0.00 3.38 -0.97 -0.81 115.31 117.81 2byd h LEU 189 Ca 0.27 0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.25 2byd h LEU 189 Cb 0.06 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2byd h LEU 189 CO -0.04 0.11 -0.06 0.11 0.09 0.00 0.00 178.44 178.65 2byd h LYS 190 N 0.37 0.65 -0.35 1.13 1.57 -1.12 -2.61 116.57 116.21 2byd h LYS 190 Ca 0.30 -0.24 -0.06 0.00 -1.87 0.00 0.00 60.65 58.78 2byd h LYS 190 Cb 0.37 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 2byd h LYS 190 CO -0.31 0.81 -0.02 0.93 -0.57 0.00 0.00 179.45 180.29 2byd h GLU 191 N 0.44 0.55 -0.62 3.15 4.39 -1.20 -1.18 114.58 120.13 2byd h GLU 191 Ca 0.09 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2byd h GLU 191 Cb 0.55 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.09 2byd h GLU 191 CO 0.03 0.59 0.40 0.66 -1.16 0.00 0.00 179.01 179.53 2byd h SER 192 N 0.53 0.72 -0.25 1.42 4.64 -0.82 0.11 113.55 119.90 2byd h SER 192 Ca 0.11 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.36 2byd h SER 192 Cb 0.37 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 2byd h SER 192 CO 0.01 0.54 0.02 0.15 -0.87 0.00 0.00 176.83 176.68 2byd h PHE 193 N 0.84 0.45 -0.69 4.77 3.57 -1.12 -0.94 116.94 123.83 2byd h PHE 193 Ca 0.23 -0.07 -0.00 0.00 3.53 0.00 0.00 57.97 61.65 2byd h PHE 193 Cb -0.07 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.51 2byd h PHE 193 CO -0.03 0.57 0.42 0.82 -2.23 0.00 0.00 178.31 177.86 2byd h ILE 194 N 0.21 1.19 -0.13 1.41 2.04 -0.99 -1.25 117.51 119.99 2byd h ILE 194 Ca 0.07 -0.41 -0.12 0.00 1.00 0.00 0.00 64.86 65.40 2byd h ILE 194 Cb 0.37 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 2byd h ILE 194 CO 0.01 0.20 -0.45 0.11 0.00 0.00 0.00 178.15 178.02 2byd h LYS 195 N 0.94 0.32 -0.63 2.37 1.57 -0.74 -1.82 116.57 118.59 2byd h LYS 195 Ca 0.25 -0.17 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 2byd h LYS 195 Cb -0.05 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 2byd h LYS 195 CO -0.05 0.71 0.23 0.00 -0.57 0.00 0.00 179.45 179.77 2byd h ALA 196 N 1.26 0.82 -0.00 3.86 0.00 -0.11 -3.25 119.26 121.84 2byd h ALA 196 Ca 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2byd h ALA 196 Cb 0.90 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2byd h ALA 196 CO 0.07 0.46 -0.57 0.44 0.00 0.00 0.00 179.25 179.65 2byd n ILE 197 N -4.41 0.00 -1.03 0.00 -5.35 -0.58 -4.74 119.36 103.26 2byd n ILE 197 Ca 0.04 -0.05 -0.01 0.00 -0.27 0.00 0.00 62.75 62.46 2byd n ILE 197 Cb 0.19 0.54 -0.00 0.00 -1.74 0.00 0.00 39.64 38.62 2byd n ILE 197 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2byd n GLY 198 N 1.46 0.46 0.12 3.28 0.00 -0.69 -4.96 105.19 104.85 2byd n GLY 198 Ca 0.07 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2byd n GLY 198 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2byd h VAL 199 N 0.00 0.94 0.00 1.61 -1.51 -1.87 -3.49 116.25 111.92 2byd h VAL 199 Ca -0.02 -2.39 0.00 0.00 -1.23 0.00 0.00 66.70 63.06 2byd h VAL 199 Cb 0.07 2.42 0.00 0.00 -2.13 0.00 0.00 31.29 31.65 2byd h VAL 199 CO 0.03 0.54 0.00 0.61 -1.23 0.00 0.00 177.57 177.52 2byd n GLY 200 N 1.28 1.94 0.11 5.19 0.00 -1.26 -4.39 105.19 108.05 2byd n GLY 200 Ca -0.01 -0.45 -0.15 0.00 0.00 0.00 0.00 46.02 45.41 2byd n GLY 200 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2byd h LEU 201 N 0.00 0.30 -0.35 0.99 3.38 -1.98 -3.31 115.31 114.34 2byd h LEU 201 Ca 0.00 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2byd h LEU 201 Cb 0.00 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.65 2byd h LEU 201 CO 0.00 1.39 0.00 0.61 0.09 0.00 0.00 178.44 180.53 2byd n GLY 202 N 1.66 -0.62 3.71 0.83 0.00 -1.26 -4.88 105.19 104.63 2byd n GLY 202 Ca -0.17 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 2byd n GLY 202 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2byd s PHE 203 N -1.97 3.41 -0.47 1.61 2.19 -1.25 -4.98 117.98 116.52 2byd s PHE 203 Ca 0.39 1.26 -0.29 0.00 0.33 0.00 0.00 56.93 58.62 2byd s PHE 203 Cb 0.19 -3.46 0.03 0.00 -1.31 0.00 0.00 43.02 38.47 2byd s PHE 203 CO 0.31 -1.43 1.11 -2.00 1.83 0.00 0.00 175.22 175.05 2byd s GLU 204 N 1.05 3.71 0.53 10.12 2.56 -1.26 -4.89 118.70 130.51 2byd s GLU 204 Ca 0.59 0.53 0.24 0.00 0.00 0.00 0.00 54.97 56.34 2byd s GLU 204 Cb -0.30 -3.90 1.45 0.00 2.00 0.00 0.00 34.13 33.37 2byd s GLU 204 CO 0.29 -1.35 2.12 -0.07 -0.56 0.00 0.00 175.26 175.70 2byd h LEU 205 N 11.11 0.00 -2.04 2.70 4.07 -1.88 -1.83 115.31 127.44 2byd h LEU 205 Ca -0.23 0.00 0.11 0.00 0.08 0.00 0.00 57.88 57.84 2byd h LEU 205 Cb 1.06 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.79 2byd h LEU 205 CO 1.11 0.08 0.31 -0.61 -1.08 0.00 0.00 178.44 178.26 2byd h GLN 206 N 0.00 0.00 0.00 1.13 5.75 -1.72 0.22 115.11 120.49 2byd h GLN 206 Ca -0.00 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 2byd h GLN 206 Cb 0.18 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.73 2byd h GLN 206 CO 0.01 0.00 -0.03 0.00 -2.65 0.00 0.00 178.83 176.16 2byd h ARG 207 N 0.00 0.00 -5.18 1.69 3.08 -1.69 -3.42 114.38 108.86 2byd h ARG 207 Ca 0.19 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.62 2byd h ARG 207 Cb 0.80 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 30.72 2byd h ARG 207 CO -0.00 0.03 -0.46 -0.51 -1.07 0.00 0.00 179.97 177.95 2byd s LEU 208 N -6.37 4.15 -0.19 3.04 1.43 0.06 -1.27 118.68 119.54 2byd s LEU 208 Ca -0.02 0.20 0.01 0.00 -1.03 0.00 0.00 54.13 53.29 2byd s LEU 208 Cb 0.11 -2.16 0.04 0.00 0.03 0.00 0.00 46.19 44.21 2byd s LEU 208 CO 0.51 0.08 -0.11 -0.70 0.23 0.00 0.00 176.35 176.35 2byd s GLU 209 N 0.89 2.09 -0.14 1.70 2.12 -0.46 -4.68 118.70 120.22 2byd s GLU 209 Ca 0.09 -0.78 -0.11 0.00 0.36 0.00 0.00 54.97 54.53 2byd s GLU 209 Cb -0.13 -2.35 -0.05 0.00 0.26 0.00 0.00 34.13 31.86 2byd s GLU 209 CO 0.03 -0.39 0.22 -0.06 -0.54 0.00 0.00 175.26 174.53 2byd s PHE 210 N 1.42 3.52 -0.65 5.30 0.40 -1.26 -0.23 117.98 126.48 2byd s PHE 210 Ca 0.00 0.56 -0.17 0.00 -0.60 0.00 0.00 56.93 56.72 2byd s PHE 210 Cb -0.15 -2.17 0.14 0.00 0.51 0.00 0.00 43.02 41.34 2byd s PHE 210 CO -0.09 0.45 0.67 0.34 0.70 0.00 0.00 175.22 177.29 2byd s ASP 211 N -0.18 6.35 -0.10 1.36 -1.08 0.24 -4.78 116.67 118.46 2byd s ASP 211 Ca 0.15 -1.89 -0.29 0.00 -0.52 0.00 0.00 52.55 49.99 2byd s ASP 211 Cb -0.13 -2.25 -0.04 0.00 -1.46 0.00 0.00 42.92 39.04 2byd s ASP 211 CO 0.04 -0.89 1.57 -0.76 0.52 0.00 0.00 175.17 175.64 2byd s LEU 212 N 1.70 4.22 -0.04 -1.34 1.02 -1.26 -2.34 118.68 120.64 2byd s LEU 212 Ca 0.11 2.02 -0.02 0.00 0.02 0.00 0.00 54.13 56.26 2byd s LEU 212 Cb -0.22 -3.53 0.03 0.00 0.02 0.00 0.00 46.19 42.48 2byd s LEU 212 CO 0.01 -0.95 0.10 -0.55 0.02 0.00 0.00 176.35 174.98 2byd s SER 213 N 3.20 -0.05 0.60 2.29 0.15 -1.26 -4.44 113.70 114.19 2byd s SER 213 Ca 0.69 0.19 -0.07 0.00 0.70 0.00 0.00 55.95 57.46 2byd s SER 213 Cb -0.29 0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.12 2byd s SER 213 CO 0.26 -0.11 0.93 -2.16 1.20 0.00 0.00 173.24 173.36 2byd s PRO 214 N 0.87 3.00 0.52 5.44 0.04 -1.26 -3.03 135.00 140.57 2byd s PRO 214 Ca -0.07 0.13 0.27 0.00 0.04 0.00 0.00 61.00 61.38 2byd s PRO 214 Cb -0.09 -2.23 1.43 0.00 0.04 0.00 0.00 34.50 33.65 2byd s PRO 214 CO -0.04 -0.71 2.06 -0.07 0.04 0.00 0.00 177.00 178.29 2byd h LEU 215 N -0.23 0.00 -8.10 -3.56 4.07 -2.02 -3.41 115.31 102.06 2byd h LEU 215 Ca -0.45 0.00 -0.55 0.00 0.08 0.00 0.00 57.88 56.95 2byd h LEU 215 Cb 1.25 0.00 -0.33 0.00 1.08 0.00 0.00 40.66 42.66 2byd h LEU 215 CO 0.61 0.12 -0.83 0.21 -1.08 0.00 0.00 178.44 177.47 2byd s ASN 216 N -6.17 2.09 -0.08 -0.43 3.84 -1.26 -5.07 114.94 107.86 2byd s ASN 216 Ca -0.03 -0.36 0.00 0.00 0.21 0.00 0.00 52.86 52.69 2byd s ASN 216 Cb 0.13 -0.89 -0.03 0.00 -0.55 0.00 0.00 41.25 39.91 2byd s ASN 216 CO 0.59 0.08 -0.07 -0.76 -2.79 0.00 0.00 177.10 174.15 2byd s LEU 217 N 0.48 3.13 0.20 3.21 1.43 -1.26 -5.12 118.68 120.75 2byd s LEU 217 Ca -0.13 -0.06 -0.24 0.00 -1.03 0.00 0.00 54.13 52.67 2byd s LEU 217 Cb -0.15 -1.69 -0.08 0.00 0.03 0.00 0.00 46.19 44.29 2byd s LEU 217 CO 0.04 0.33 0.78 -1.81 0.23 0.00 0.00 176.35 175.92 2byd s ASP 218 N -0.59 7.30 0.28 2.29 1.01 -1.26 -4.99 116.67 120.71 2byd s ASP 218 Ca 0.09 1.61 -0.30 0.00 0.71 0.00 0.00 52.55 54.66 2byd s ASP 218 Cb -0.12 -2.49 -0.11 0.00 1.01 0.00 0.00 42.92 41.21 2byd s ASP 218 CO 0.02 0.13 1.55 -0.63 0.21 0.00 0.00 175.17 176.45 2byd s ILE 219 N -1.30 2.23 0.00 0.77 1.01 -1.26 -2.93 121.20 119.71 2byd s ILE 219 Ca 0.39 0.19 0.00 0.00 0.00 0.00 0.00 60.65 61.24 2byd s ILE 219 Cb -0.21 -3.12 0.00 0.00 0.01 0.00 0.00 42.46 39.14 2byd s ILE 219 CO 0.25 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.83 2byd n GLY 220 N 2.14 2.41 3.80 6.18 0.00 0.67 -5.00 105.19 115.39 2byd n GLY 220 Ca 0.08 -0.44 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 2byd n GLY 220 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2byd s GLN 221 N 0.00 3.03 -0.11 1.61 -0.21 -1.15 -4.74 119.66 118.09 2byd s GLN 221 Ca 0.00 1.17 0.00 0.00 0.02 0.00 0.00 55.36 56.55 2byd s GLN 221 Cb 0.00 -1.99 -0.02 0.00 1.00 0.00 0.00 33.01 31.99 2byd s GLN 221 CO 0.00 -1.04 -0.11 0.08 -2.12 0.00 0.00 175.29 172.10 2byd s VAL 222 N -2.63 3.27 0.06 1.09 1.01 -1.26 -4.26 120.40 117.68 2byd s VAL 222 Ca 0.62 -0.60 0.09 0.00 0.00 0.00 0.00 61.98 62.09 2byd s VAL 222 Cb -0.16 -2.36 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 2byd s VAL 222 CO 0.44 0.54 -0.23 -0.31 0.00 0.00 0.00 175.10 175.54 2byd s TYR 223 N 0.02 2.42 -0.27 5.22 2.02 0.09 -4.92 117.35 121.92 2byd s TYR 223 Ca -0.03 -0.34 0.22 0.00 -0.37 0.00 0.00 57.07 56.55 2byd s TYR 223 Cb -0.14 -1.40 0.50 0.00 -0.40 0.00 0.00 41.96 40.52 2byd s TYR 223 CO 0.04 0.21 1.09 1.63 -1.57 0.00 0.00 175.55 176.95 2byd n LYS 224 N 1.55 1.64 -0.00 -0.62 4.76 -1.26 0.01 118.16 124.24 2byd n LYS 224 Ca -0.17 -3.44 0.04 0.00 -2.87 0.00 0.00 58.31 51.87 2byd n LYS 224 Cb 0.52 -1.53 -0.06 0.00 -1.84 0.00 0.00 35.03 32.13 2byd n LYS 224 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2byd n GLU 225 N -0.53 2.71 -2.21 1.97 1.02 -1.25 -4.83 120.64 117.51 2byd n GLU 225 Ca 0.07 -0.03 -0.41 0.00 -0.02 0.00 0.00 57.16 56.77 2byd n GLU 225 Cb 0.80 -1.02 -0.03 0.00 -0.02 0.00 0.00 31.44 31.18 2byd n GLU 225 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2byd s THR 226 N -2.11 3.08 0.14 2.62 2.01 -1.17 -4.56 115.64 115.65 2byd s THR 226 Ca 0.01 0.96 0.09 0.00 0.31 0.00 0.00 61.69 63.05 2byd s THR 226 Cb 0.06 -3.61 -0.04 0.00 0.01 0.00 0.00 72.50 68.92 2byd s THR 226 CO 0.36 0.18 -0.14 -0.13 -0.69 0.00 0.00 174.62 174.20 2byd s ARG 227 N -0.73 1.94 -0.11 4.92 0.52 -0.99 -4.30 118.95 120.21 2byd s ARG 227 Ca 0.53 -1.20 -0.01 0.00 -0.52 0.00 0.00 55.73 54.54 2byd s ARG 227 Cb -0.37 -2.16 -0.03 0.00 0.52 0.00 0.00 34.95 32.92 2byd s ARG 227 CO 0.43 0.46 -0.07 -1.17 0.02 0.00 0.00 175.30 174.97 2byd s LEU 228 N -2.44 3.10 -0.21 2.53 2.96 -1.26 -0.60 118.68 122.76 2byd s LEU 228 Ca 0.21 -0.12 -0.03 0.00 -0.22 0.00 0.00 54.13 53.97 2byd s LEU 228 Cb -0.10 -1.70 -0.01 0.00 0.50 0.00 0.00 46.19 44.88 2byd s LEU 228 CO 0.13 0.26 -0.06 -0.36 -1.32 0.00 0.00 176.35 175.00 2byd s PHE 229 N -0.22 2.94 -0.19 5.38 0.08 0.68 -1.22 117.98 125.43 2byd s PHE 229 Ca 0.03 -0.95 -0.06 0.00 0.12 0.00 0.00 56.93 56.07 2byd s PHE 229 Cb -0.13 -2.08 -0.03 0.00 -0.57 0.00 0.00 43.02 40.21 2byd s PHE 229 CO 0.03 -0.53 0.04 -1.17 -0.10 0.00 0.00 175.22 173.48 2byd s LEU 230 N 1.38 3.55 -1.32 -0.37 2.96 0.25 -1.35 118.68 123.78 2byd s LEU 230 Ca 0.05 -0.06 -0.12 0.00 -0.22 0.00 0.00 54.13 53.78 2byd s LEU 230 Cb -0.14 -1.90 0.10 0.00 0.50 0.00 0.00 46.19 44.74 2byd s LEU 230 CO -0.03 0.12 0.52 0.47 -1.32 0.00 0.00 176.35 176.10 2byd n ASP 231 N 3.91 -3.26 0.00 3.68 8.00 -0.40 -1.47 116.55 127.01 2byd n ASP 231 Ca -0.17 -0.51 0.00 0.00 0.71 0.00 0.00 54.79 54.82 2byd n ASP 231 Cb 0.52 -2.72 0.00 0.00 -0.02 0.00 0.00 41.12 38.91 2byd n ASP 231 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2byd n GLY 232 N -1.15 0.77 3.19 0.44 0.00 -1.26 -5.04 105.19 102.14 2byd n GLY 232 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 2byd n GLY 232 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2byd s GLU 233 N -0.28 2.41 0.05 1.61 2.12 -0.55 -5.07 118.70 119.00 2byd s GLU 233 Ca 0.00 -0.76 -0.33 0.00 0.36 0.00 0.00 54.97 54.23 2byd s GLU 233 Cb 0.00 -1.96 -0.12 0.00 0.26 0.00 0.00 34.13 32.31 2byd s GLU 233 CO 0.00 0.24 1.77 -1.91 -0.54 0.00 0.00 175.26 174.82 2byd n GLU 234 N 3.28 2.34 -2.79 4.30 2.13 -1.26 -0.59 120.64 128.05 2byd n GLU 234 Ca -0.19 0.85 -0.43 0.00 0.66 0.00 0.00 57.16 58.05 2byd n GLU 234 Cb 0.52 -2.69 -0.01 0.00 0.27 0.00 0.00 31.44 29.54 2byd n GLU 234 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2byd s GLU 235 N 2.68 3.86 0.34 5.31 0.41 -0.35 -4.86 118.70 126.08 2byd s GLU 235 Ca 0.85 -1.99 0.26 0.00 -0.41 0.00 0.00 54.97 53.68 2byd s GLU 235 Cb -0.63 -5.19 1.07 0.00 -1.78 0.00 0.00 34.13 27.60 2byd s GLU 235 CO 0.43 -1.96 1.79 0.87 -0.49 0.00 0.00 175.26 175.90 2byd h LYS 236 N 8.12 0.00 -0.00 1.61 1.57 -1.91 -2.53 116.57 123.42 2byd h LYS 236 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 2byd h LYS 236 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.24 2byd h LYS 236 CO 1.29 0.00 -0.09 0.39 -0.57 0.00 0.00 179.45 180.48 2byd n GLU 237 N -2.49 0.59 -4.45 3.15 4.71 -1.26 -4.78 120.64 116.11 2byd n GLU 237 Ca 0.02 -0.16 -0.34 0.00 -0.01 0.00 0.00 57.16 56.68 2byd n GLU 237 Cb 0.27 -1.50 -0.12 0.00 -1.01 0.00 0.00 31.44 29.08 2byd n GLU 237 CO 0.00 0.00 0.00 -1.58 0.09 0.00 0.00 177.13 175.64 2byd s TRP 238 N -2.52 3.02 0.26 -0.32 0.52 -0.95 -3.03 118.94 115.92 2byd s TRP 238 Ca 0.28 -0.17 0.11 0.00 0.02 0.00 0.00 56.10 56.34 2byd s TRP 238 Cb 0.20 -1.88 -0.05 0.00 -1.15 0.00 0.00 33.47 30.59 2byd s TRP 238 CO 0.48 0.11 -0.13 0.00 0.02 0.00 0.00 176.95 177.42 2byd s ALA 239 N -0.06 2.89 -0.06 0.98 0.00 -0.52 -4.80 121.76 120.19 2byd s ALA 239 Ca 0.01 -1.75 -0.00 0.00 0.00 0.00 0.00 51.96 50.22 2byd s ALA 239 Cb -0.13 -0.48 0.02 0.00 0.00 0.00 0.00 23.12 22.54 2byd s ALA 239 CO 0.03 0.30 -0.03 -0.06 0.00 0.00 0.00 175.76 176.00 2byd s PHE 240 N -2.32 0.75 -0.23 0.00 0.08 -1.26 -1.13 117.98 113.86 2byd s PHE 240 Ca 0.29 -0.22 -0.09 0.00 0.12 0.00 0.00 56.93 57.04 2byd s PHE 240 Cb -0.06 -0.75 -0.04 0.00 -0.57 0.00 0.00 43.02 41.60 2byd s PHE 240 CO 0.16 -0.27 0.11 -1.21 -0.10 0.00 0.00 175.22 173.91 2byd s GLU 241 N 1.42 3.90 -0.12 0.44 2.02 -0.21 -4.16 118.70 121.98 2byd s GLU 241 Ca -0.03 -0.36 0.02 0.00 0.02 0.00 0.00 54.97 54.61 2byd s GLU 241 Cb -0.13 -3.39 -0.01 0.00 0.10 0.00 0.00 34.13 30.70 2byd s GLU 241 CO -0.03 0.02 -0.18 -1.21 0.02 0.00 0.00 175.26 173.89 2byd s GLU 242 N 1.10 3.23 -0.02 1.61 2.02 0.10 -0.94 118.70 125.80 2byd s GLU 242 Ca 0.05 -0.77 0.00 0.00 0.02 0.00 0.00 54.97 54.27 2byd s GLU 242 Cb -0.14 -2.50 0.02 0.00 0.10 0.00 0.00 34.13 31.61 2byd s GLU 242 CO 0.04 0.17 0.02 -1.12 0.02 0.00 0.00 175.26 174.40 2byd s SER 243 N 0.41 0.06 -0.38 -0.19 0.01 -0.26 -0.74 113.70 112.61 2byd s SER 243 Ca -0.13 0.03 -0.23 0.00 1.31 0.00 0.00 55.95 56.92 2byd s SER 243 Cb -0.17 -0.06 0.01 0.00 0.21 0.00 0.00 66.02 66.02 2byd s SER 243 CO 0.06 -0.10 0.80 -0.54 0.41 0.00 0.00 173.24 173.87 2byd s LYS 244 N 0.85 3.69 0.06 12.44 1.02 -1.26 0.09 119.74 136.63 2byd s LYS 244 Ca -0.07 0.25 0.07 0.00 0.02 0.00 0.00 55.97 56.24 2byd s LYS 244 Cb -0.10 -3.83 -0.23 0.00 -0.52 0.00 0.00 37.83 33.15 2byd s LYS 244 CO -0.02 -0.91 1.05 -0.84 -0.92 0.00 0.00 175.35 173.70 2byd h ILE 245 N 5.81 1.39 -1.51 2.17 3.07 -1.56 0.19 117.51 127.07 2byd h ILE 245 Ca -0.25 -3.13 0.00 0.00 1.55 0.00 0.00 64.86 63.03 2byd h ILE 245 Cb 1.09 2.72 0.00 0.00 -0.27 0.00 0.00 36.82 40.36 2byd h ILE 245 CO 0.93 0.81 0.00 -0.90 -1.05 0.00 0.00 178.15 177.94 2byd n ASP 246 N -3.28 0.00 0.24 2.16 5.68 -1.24 -4.54 116.55 115.57 2byd n ASP 246 Ca -0.07 -0.51 0.16 0.00 -0.50 0.00 0.00 54.79 53.86 2byd n ASP 246 Cb 0.99 0.00 0.60 0.00 -1.14 0.00 0.00 41.12 41.57 2byd n ASP 246 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 2byd h GLU 247 N 0.00 0.00 -0.00 0.11 -0.00 -2.01 -3.26 114.58 109.41 2byd h GLU 247 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 2byd h GLU 247 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 2byd h GLU 247 CO 0.00 0.00 -0.04 0.72 -0.00 0.00 0.00 179.01 179.69 2byd n HIS 248 N -2.91 0.00 -5.05 2.06 8.25 -1.26 -4.98 115.22 111.32 2byd n HIS 248 Ca 0.01 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.16 2byd n HIS 248 Cb 0.32 0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.26 2byd n HIS 248 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2byd s HIS 249 N -0.72 2.52 -0.06 4.41 3.76 -1.23 -0.92 115.29 123.05 2byd s HIS 249 Ca 0.01 -1.09 0.05 0.00 -0.15 0.00 0.00 55.06 53.88 2byd s HIS 249 Cb 0.01 -1.70 -0.02 0.00 1.11 0.00 0.00 32.58 31.99 2byd s HIS 249 CO 0.04 -0.46 -0.20 0.12 -0.85 0.00 0.00 174.74 173.40 2byd s PHE 250 N 0.47 2.56 -0.04 1.40 2.19 0.09 -1.28 117.98 123.37 2byd s PHE 250 Ca -0.16 -0.48 0.06 0.00 0.33 0.00 0.00 56.93 56.68 2byd s PHE 250 Cb -0.17 -1.63 -0.01 0.00 -1.31 0.00 0.00 43.02 39.90 2byd s PHE 250 CO 0.06 -0.06 -0.23 0.08 1.83 0.00 0.00 175.22 176.90 2byd s VAL 251 N -0.34 1.87 -0.07 3.12 1.01 0.11 -0.79 120.40 125.31 2byd s VAL 251 Ca 0.02 -0.98 0.05 0.00 0.00 0.00 0.00 61.98 61.06 2byd s VAL 251 Cb -0.12 -1.58 -0.00 0.00 0.00 0.00 0.00 36.38 34.68 2byd s VAL 251 CO 0.02 0.53 -0.22 0.00 0.00 0.00 0.00 175.10 175.43 2byd s ALA 252 N -0.28 1.94 -0.11 5.51 0.00 -0.14 -1.11 121.76 127.58 2byd s ALA 252 Ca 0.01 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 51.13 2byd s ALA 252 Cb -0.12 -0.67 0.00 0.00 0.00 0.00 0.00 23.12 22.33 2byd s ALA 252 CO 0.02 0.31 -0.22 0.08 0.00 0.00 0.00 175.76 175.95 2byd s VAL 253 N 0.14 1.96 -0.12 0.00 1.01 -0.12 -1.29 120.40 121.97 2byd s VAL 253 Ca -0.10 -0.95 -0.05 0.00 0.00 0.00 0.00 61.98 60.88 2byd s VAL 253 Cb -0.15 -1.71 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 2byd s VAL 253 CO 0.05 0.54 0.05 0.00 0.00 0.00 0.00 175.10 175.73 2byd s ALA 254 N 0.50 3.43 -0.06 5.51 0.00 0.86 -1.05 121.76 130.96 2byd s ALA 254 Ca -0.15 -0.75 -0.01 0.00 0.00 0.00 0.00 51.96 51.04 2byd s ALA 254 Cb -0.17 -1.71 0.03 0.00 0.00 0.00 0.00 23.12 21.26 2byd s ALA 254 CO 0.06 0.46 0.00 -0.51 0.00 0.00 0.00 175.76 175.77 2byd s LEU 255 N -0.49 0.70 -0.04 0.00 1.43 -0.29 -0.70 118.68 119.30 2byd s LEU 255 Ca 0.10 -0.07 0.03 0.00 -1.03 0.00 0.00 54.13 53.16 2byd s LEU 255 Cb -0.12 -0.39 -0.03 0.00 0.03 0.00 0.00 46.19 45.68 2byd s LEU 255 CO 0.02 -0.17 -0.10 -0.60 0.23 0.00 0.00 176.35 175.73 2byd s ARG 256 N 1.75 2.59 -0.15 1.70 3.52 -0.20 -1.44 118.95 126.71 2byd s ARG 256 Ca 0.01 -0.66 -0.23 0.00 -0.13 0.00 0.00 55.73 54.73 2byd s ARG 256 Cb -0.13 -2.48 -0.03 0.00 -1.56 0.00 0.00 34.95 30.76 2byd s ARG 256 CO -0.04 0.63 0.70 0.15 -0.81 0.00 0.00 175.30 175.93 2byd s LYS 257 N -0.95 4.30 0.00 5.12 3.01 -1.17 -1.77 119.74 128.28 2byd s LYS 257 Ca 0.13 0.79 0.00 0.00 -1.01 0.00 0.00 55.97 55.89 2byd s LYS 257 Cb -0.11 -3.54 0.00 0.00 -1.01 0.00 0.00 37.83 33.17 2byd s LYS 257 CO 0.03 -0.18 0.00 0.94 0.51 0.00 0.00 175.35 176.65 2byd n GLN 276 N 4.74 0.00 -0.06 1.68 -0.06 -1.26 -4.69 117.38 117.74 2byd n GLN 276 Ca 0.00 0.00 0.03 0.00 -2.00 0.00 0.00 57.00 55.03 2byd n GLN 276 Cb 0.50 0.00 0.06 0.00 -4.06 0.00 0.00 30.24 26.74 2byd n GLN 276 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2byd n ARG 277 N 0.00 1.62 -2.28 3.69 5.12 -1.26 -4.92 116.66 118.63 2byd n ARG 277 Ca 0.00 -1.41 -0.39 0.00 -1.93 0.00 0.00 57.85 54.11 2byd n ARG 277 Cb 0.00 -1.14 -0.02 0.00 -1.16 0.00 0.00 32.46 30.13 2byd n ARG 277 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2byd s GLN 278 N -0.80 4.26 0.37 5.56 -0.21 -1.26 -4.92 119.66 122.66 2byd s GLN 278 Ca 0.11 1.94 -0.27 0.00 0.02 0.00 0.00 55.36 57.16 2byd s GLN 278 Cb 0.06 -2.89 -0.09 0.00 1.00 0.00 0.00 33.01 31.09 2byd s GLN 278 CO 0.09 -0.17 1.21 -0.06 -2.12 0.00 0.00 175.29 174.24 2byd s PHE 279 N -1.28 3.10 -0.18 0.91 0.08 -1.26 -4.74 117.98 114.60 2byd s PHE 279 Ca 0.52 1.52 -0.05 0.00 0.12 0.00 0.00 56.93 59.05 2byd s PHE 279 Cb -0.33 -3.49 -0.03 0.00 -0.57 0.00 0.00 43.02 38.60 2byd s PHE 279 CO 0.43 -1.46 -0.01 0.99 -0.10 0.00 0.00 175.22 175.07 2byd s THR 280 N -1.29 3.98 -0.23 0.64 2.01 -0.53 -4.95 115.64 115.28 2byd s THR 280 Ca 0.53 -0.32 -0.19 0.00 0.31 0.00 0.00 61.69 62.03 2byd s THR 280 Cb -0.34 -2.77 -0.03 0.00 0.01 0.00 0.00 72.50 69.37 2byd s THR 280 CO 0.44 0.46 0.56 -0.63 -0.69 0.00 0.00 174.62 174.76 2byd s ILE 281 N 0.67 5.06 0.22 1.82 -1.09 -1.26 -0.76 121.20 125.86 2byd s ILE 281 Ca -0.01 1.01 0.02 0.00 -2.23 0.00 0.00 60.65 59.44 2byd s ILE 281 Cb -0.14 -3.87 -0.04 0.00 -1.58 0.00 0.00 42.46 36.83 2byd s ILE 281 CO 0.02 0.11 0.37 -0.76 -1.23 0.00 0.00 174.94 173.46 2byd s LEU 282 N 2.04 4.26 0.00 2.97 1.43 0.95 -4.95 118.68 125.39 2byd s LEU 282 Ca 0.24 0.24 0.04 0.00 -1.03 0.00 0.00 54.13 53.63 2byd s LEU 282 Cb -0.16 -3.02 0.04 0.00 0.03 0.00 0.00 46.19 43.09 2byd s LEU 282 CO 0.09 -0.06 0.37 -0.46 0.23 0.00 0.00 176.35 176.52 2byd n ASN 283 N -1.02 2.72 -0.05 2.29 0.23 -1.26 -4.40 115.26 113.76 2byd n ASN 283 Ca -0.07 -2.82 0.00 0.00 -0.53 0.00 0.00 54.58 51.16 2byd n ASN 283 Cb 0.55 -0.02 0.30 0.00 -2.08 0.00 0.00 39.78 38.53 2byd n ASN 283 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 2byd h PHE 284 N 0.69 0.65 -0.71 -2.53 3.57 -1.99 -1.91 116.94 114.71 2byd h PHE 284 Ca -0.34 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.11 2byd h PHE 284 Cb 1.22 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.72 2byd h PHE 284 CO 0.00 0.53 0.38 -0.91 -2.23 0.00 0.00 178.31 176.08 2byd h ASN 285 N 0.64 0.89 -0.41 0.41 4.21 -1.96 -0.39 115.58 118.97 2byd h ASN 285 Ca 0.15 -0.10 0.01 0.00 1.21 0.00 0.00 56.30 57.57 2byd h ASN 285 Cb 0.17 -0.23 -0.02 0.00 -1.12 0.00 0.00 38.32 37.12 2byd h ASN 285 CO -0.01 0.74 0.26 0.44 -1.29 0.00 0.00 177.43 177.57 2byd h ASP 286 N 0.98 0.43 -0.80 5.81 3.32 -1.80 -1.76 116.42 122.60 2byd h ASP 286 Ca 0.25 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 2byd h ASP 286 Cb 0.05 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 2byd h ASP 286 CO -0.04 0.31 0.48 -0.07 -1.72 0.00 0.00 179.24 178.20 2byd h LEU 287 N 0.52 0.97 -0.51 1.55 3.38 -0.98 -2.45 115.31 117.80 2byd h LEU 287 Ca 0.16 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2byd h LEU 287 Cb -0.03 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.48 2byd h LEU 287 CO -0.05 0.75 0.00 0.23 0.09 0.00 0.00 178.44 179.46 2byd n MET 288 N -4.37 1.33 -0.25 1.13 2.81 -0.19 -4.50 117.12 113.08 2byd n MET 288 Ca 0.09 -0.50 -0.02 0.00 -1.81 0.00 0.00 57.70 55.45 2byd n MET 288 Cb 0.07 -1.21 0.10 0.00 -0.71 0.00 0.00 33.22 31.46 2byd n MET 288 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2byd h SER 289 N 0.90 0.64 -0.44 7.83 4.64 -0.83 -2.18 113.55 124.11 2byd h SER 289 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2byd h SER 289 Cb 0.20 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2byd h SER 289 CO 0.00 0.42 0.00 -1.20 -0.87 0.00 0.00 176.83 175.18 2byd n SER 290 N -4.73 3.28 -4.77 4.97 7.64 -1.26 -5.03 113.62 113.72 2byd n SER 290 Ca 0.09 -1.94 -0.35 0.00 1.01 0.00 0.00 58.87 57.67 2byd n SER 290 Cb 0.14 -0.29 0.01 0.00 -1.01 0.00 0.00 64.21 63.07 2byd n SER 290 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2byd s ALA 291 N -1.11 2.64 -0.09 -0.43 0.00 -0.82 -4.63 121.76 117.31 2byd s ALA 291 Ca 0.34 0.89 -0.11 0.00 0.00 0.00 0.00 51.96 53.08 2byd s ALA 291 Cb 0.18 -3.39 0.03 0.00 0.00 0.00 0.00 23.12 19.94 2byd s ALA 291 CO 0.25 -0.92 0.30 0.54 0.00 0.00 0.00 175.76 175.93 2byd s VAL 292 N -1.70 0.02 0.46 0.00 0.11 -1.26 -5.09 120.40 112.93 2byd s VAL 292 Ca 0.75 -0.13 -0.24 0.00 -2.93 0.00 0.00 61.98 59.43 2byd s VAL 292 Cb -0.26 -0.47 -0.07 0.00 -1.53 0.00 0.00 36.38 34.05 2byd s VAL 292 CO 0.29 -0.07 1.23 -2.16 -3.33 0.00 0.00 175.10 171.06 2byd s PRO 293 N -0.21 3.71 -0.00 1.54 0.04 -1.26 -4.43 135.00 134.40 2byd s PRO 293 Ca -0.03 1.95 0.00 0.00 0.04 0.00 0.00 61.00 62.96 2byd s PRO 293 Cb -0.03 -2.48 -0.00 0.00 0.04 0.00 0.00 34.50 32.03 2byd s PRO 293 CO 0.01 -0.64 0.00 -1.33 0.04 0.00 0.00 177.00 175.09 2byd n MET 294 N -0.40 0.90 -4.24 4.56 2.81 0.23 -4.93 117.12 116.05 2byd n MET 294 Ca 0.07 -0.00 -0.20 0.00 -1.81 0.00 0.00 57.70 55.75 2byd n MET 294 Cb 0.46 -1.00 -0.12 0.00 -0.71 0.00 0.00 33.22 31.85 2byd n MET 294 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2byd s THR 295 N -2.01 1.41 0.88 2.03 -4.23 -0.81 -5.05 115.64 107.86 2byd s THR 295 Ca -0.00 -1.53 -0.12 0.00 -1.18 0.00 0.00 61.69 58.85 2byd s THR 295 Cb 0.00 -1.40 0.08 0.00 1.34 0.00 0.00 72.50 72.52 2byd s THR 295 CO 0.01 -0.23 0.90 -2.65 -0.54 0.00 0.00 174.62 172.11 2byd n PRO 296 N 0.95 -0.18 -1.82 3.99 -0.02 -1.26 -4.69 135.00 131.96 2byd n PRO 296 Ca -0.19 0.01 -0.41 0.00 -2.02 0.00 0.00 63.50 60.89 2byd n PRO 296 Cb 0.55 -2.20 -0.01 0.00 -0.02 0.00 0.00 33.50 31.82 2byd n PRO 296 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2byd s GLU 297 N -4.06 4.13 -0.40 -0.52 2.12 -1.26 -4.83 118.70 113.88 2byd s GLU 297 Ca 0.66 2.55 0.02 0.00 0.36 0.00 0.00 54.97 58.56 2byd s GLU 297 Cb -0.25 -3.00 0.12 0.00 0.26 0.00 0.00 34.13 31.26 2byd s GLU 297 CO 0.59 -0.55 0.17 0.34 -0.54 0.00 0.00 175.26 175.26 2byd s ASP 298 N 0.11 4.14 0.19 -1.70 -1.08 -1.26 -5.00 116.67 112.08 2byd s ASP 298 Ca 0.57 -2.38 0.19 0.00 -0.52 0.00 0.00 52.55 50.40 2byd s ASP 298 Cb -0.46 -1.27 0.85 0.00 -1.46 0.00 0.00 42.92 40.57 2byd s ASP 298 CO 0.56 -0.32 1.58 -0.81 0.52 0.00 0.00 175.17 176.70 2byd n PRO 299 N 3.90 0.12 0.00 4.34 -0.04 -1.26 -1.44 135.00 140.63 2byd n PRO 299 Ca 0.04 0.45 0.08 0.00 -0.04 0.00 0.00 63.50 64.03 2byd n PRO 299 Cb 0.37 -1.78 0.44 0.00 -0.04 0.00 0.00 33.50 32.49 2byd n PRO 299 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2byd n SER 300 N -2.02 0.00 -1.32 3.54 3.41 -1.26 -1.99 113.62 113.99 2byd n SER 300 Ca 0.01 0.01 0.06 0.00 -0.26 0.00 0.00 58.87 58.69 2byd n SER 300 Cb 0.15 -0.27 0.27 0.00 -0.26 0.00 0.00 64.21 64.10 2byd n SER 300 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2byd n PHE 301 N -1.27 1.22 -4.67 7.33 3.01 -0.52 -4.69 117.46 117.88 2byd n PHE 301 Ca 0.08 -0.46 -0.30 0.00 1.01 0.00 0.00 57.45 57.78 2byd n PHE 301 Cb 0.13 -0.26 -0.13 0.00 -0.01 0.00 0.00 39.48 39.22 2byd n PHE 301 CO 0.00 0.00 0.00 -0.46 1.01 0.00 0.00 176.76 177.31 2byd s TRP 302 N -1.92 2.51 -1.81 1.38 -0.11 -0.84 -4.73 118.94 113.43 2byd s TRP 302 Ca 0.38 -0.29 0.00 0.00 1.22 0.00 0.00 56.10 57.41 2byd s TRP 302 Cb 0.26 -1.44 0.00 0.00 -1.50 0.00 0.00 33.47 30.79 2byd s TRP 302 CO 0.16 0.24 0.00 -0.25 -4.62 0.00 0.00 176.95 172.48 2byd n ASP 303 N 1.52 -5.44 -0.30 5.86 9.92 -1.26 -4.87 116.55 121.97 2byd n ASP 303 Ca -0.16 0.18 0.03 0.00 -0.53 0.00 0.00 54.79 54.31 2byd n ASP 303 Cb 0.52 -4.55 0.05 0.00 -0.64 0.00 0.00 41.12 36.51 2byd n ASP 303 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2byd s PHE 305 N -0.70 2.52 0.65 0.00 0.08 -1.26 -4.96 117.98 114.30 2byd s PHE 305 Ca 0.10 -0.28 -0.11 0.00 0.12 0.00 0.00 56.93 56.76 2byd s PHE 305 Cb 0.06 -1.39 -0.02 0.00 -0.57 0.00 0.00 43.02 41.10 2byd s PHE 305 CO 0.09 0.31 1.04 0.00 -0.10 0.00 0.00 175.22 176.55 2byd s PHE 307 N -3.10 1.72 -0.36 0.00 0.08 -1.26 -0.43 117.98 114.62 2byd s PHE 307 Ca 0.56 -0.35 0.25 0.00 0.12 0.00 0.00 56.93 57.51 2byd s PHE 307 Cb -0.12 -1.11 1.07 0.00 -0.57 0.00 0.00 43.02 42.29 2byd s PHE 307 CO 0.54 -0.05 1.74 1.79 -0.10 0.00 0.00 175.22 179.14 2byd h THR 308 N 4.73 0.00 0.00 0.64 1.35 -1.98 -2.34 112.91 115.31 2byd h THR 308 Ca -0.37 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.27 2byd h THR 308 Cb 1.15 0.94 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 2byd h THR 308 CO 0.48 0.00 0.00 -0.33 -0.25 0.00 0.00 175.52 175.42 2byd h GLU 309 N 0.00 0.00 -0.03 4.72 3.07 -2.01 -2.86 114.58 117.46 2byd h GLU 309 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2byd h GLU 309 Cb 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 2byd h GLU 309 CO 0.00 0.00 0.00 -0.85 -1.40 0.00 0.00 179.01 176.76 2byd n GLU 310 N -3.02 1.74 -4.24 2.33 0.28 -0.88 -4.91 120.64 111.94 2byd n GLU 310 Ca 0.00 -1.08 -0.16 0.00 -0.16 0.00 0.00 57.16 55.76 2byd n GLU 310 Cb 0.26 -1.47 -0.11 0.00 1.43 0.00 0.00 31.44 31.55 2byd n GLU 310 CO 0.00 0.00 0.00 0.96 -0.16 0.00 0.00 177.13 177.93 2byd s ILE 311 N -1.98 1.23 0.13 3.84 -4.36 -1.08 -5.10 121.20 113.88 2byd s ILE 311 Ca 0.37 -1.86 -0.29 0.00 -0.26 0.00 0.00 60.65 58.61 2byd s ILE 311 Cb 0.21 -1.64 -0.06 0.00 1.25 0.00 0.00 42.46 42.21 2byd s ILE 311 CO 0.32 -0.57 0.92 -2.16 0.24 0.00 0.00 174.94 173.69 2byd s PRO 312 N -3.14 4.69 -0.39 0.37 0.04 -1.26 -4.96 135.00 130.35 2byd s PRO 312 Ca 0.12 1.38 -0.29 0.00 0.04 0.00 0.00 61.00 62.25 2byd s PRO 312 Cb -0.02 -3.35 0.02 0.00 0.04 0.00 0.00 34.50 31.20 2byd s PRO 312 CO 0.02 0.31 1.09 0.42 0.04 0.00 0.00 177.00 178.87 2byd s ILE 313 N -0.31 4.39 0.28 0.56 1.01 -1.26 -4.83 121.20 121.04 2byd s ILE 313 Ca 0.44 1.49 -0.01 0.00 0.00 0.00 0.00 60.65 62.57 2byd s ILE 313 Cb -0.23 -4.49 -0.02 0.00 0.01 0.00 0.00 42.46 37.73 2byd s ILE 313 CO 0.29 -0.70 0.32 -0.13 0.00 0.00 0.00 174.94 174.72 2byd s ARG 314 N 3.96 1.60 0.00 2.79 0.52 -1.26 -4.90 118.95 121.66 2byd s ARG 314 Ca 0.46 -1.70 0.00 0.00 -0.52 0.00 0.00 55.73 53.97 2byd s ARG 314 Cb -0.10 0.37 0.00 0.00 0.52 0.00 0.00 34.95 35.74 2byd s ARG 314 CO 0.22 -0.61 0.00 0.09 0.02 0.00 0.00 175.30 175.02 2byd n ASN 315 N -0.94 0.00 0.00 0.23 4.13 -1.25 -2.25 115.26 115.18 2byd n ASN 315 Ca 0.02 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.28 2byd n ASN 315 Cb 0.63 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.87 2byd n ASN 315 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2byd n GLY 316 N 0.00 1.74 0.58 7.41 0.00 -1.26 -3.46 105.19 110.21 2byd n GLY 316 Ca 0.00 -0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.03 2byd n GLY 316 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2byd n THR 317 N 0.00 2.20 -1.63 2.61 -1.04 -1.24 -4.55 114.28 110.63 2byd n THR 317 Ca 0.00 -3.05 0.00 0.00 -2.04 0.00 0.00 64.05 58.96 2byd n THR 317 Cb 0.00 -0.25 0.00 0.00 -1.82 0.00 0.00 70.33 68.26 2byd n THR 317 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72