#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3byz s PHE 27 N 0.00 3.40 -0.07 4.31 5.36 -1.26 -5.04 117.98 124.67 3byz s PHE 27 Ca 0.00 1.46 0.05 0.00 -0.96 0.00 0.00 56.93 57.48 3byz s PHE 27 Cb 0.00 -3.27 -0.00 0.00 -0.34 0.00 0.00 43.02 39.40 3byz s PHE 27 CO 0.00 -0.62 -0.23 1.03 -1.46 0.00 0.00 175.22 173.94 3byz s ARG 28 N 2.08 2.59 0.31 10.12 0.52 -1.26 -5.06 118.95 128.25 3byz s ARG 28 Ca 0.51 -0.83 0.03 0.00 -0.52 0.00 0.00 55.73 54.93 3byz s ARG 28 Cb -0.21 -2.09 0.78 0.00 0.52 0.00 0.00 34.95 33.96 3byz s ARG 28 CO 0.19 0.26 1.59 -1.35 0.02 0.00 0.00 175.30 176.02 3byz h PRO 29 N 6.40 0.06 0.00 3.54 0.11 -1.99 -1.89 132.00 138.24 3byz h PRO 29 Ca -0.27 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3byz h PRO 29 Cb 1.20 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3byz h PRO 29 CO 0.47 0.04 0.09 0.39 -0.21 0.00 0.00 178.00 178.78 3byz n GLU 30 N -5.39 0.00 0.11 1.05 4.71 -1.26 -1.37 120.64 118.48 3byz n GLU 30 Ca 0.24 0.39 0.11 0.00 -0.01 0.00 0.00 57.16 57.89 3byz n GLU 30 Cb 0.78 -1.59 0.46 0.00 -1.01 0.00 0.00 31.44 30.08 3byz n GLU 30 CO 0.00 0.00 0.00 -1.33 0.09 0.00 0.00 177.13 175.89 3byz n MET 31 N -1.39 0.17 -0.00 3.49 2.81 -0.71 -3.41 117.12 118.08 3byz n MET 31 Ca 0.00 0.39 0.04 0.00 -1.81 0.00 0.00 57.70 56.31 3byz n MET 31 Cb 0.09 -1.81 -0.04 0.00 -0.71 0.00 0.00 33.22 30.74 3byz n MET 31 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3byz n LEU 32 N -2.13 0.30 -4.70 4.03 4.77 -0.47 -4.92 117.00 113.88 3byz n LEU 32 Ca 0.02 -0.43 -0.42 0.00 -0.03 0.00 0.00 56.01 55.16 3byz n LEU 32 Cb 0.23 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.29 3byz n LEU 32 CO 0.19 0.07 1.26 0.00 -1.33 0.00 0.00 177.39 177.59 3byz s GLN 33 N -1.82 4.22 0.00 3.23 -2.07 -1.22 -1.04 119.66 120.96 3byz s GLN 33 Ca 0.02 2.31 0.00 0.00 -1.82 0.00 0.00 55.36 55.87 3byz s GLN 33 Cb 0.05 -3.41 0.00 0.00 -1.09 0.00 0.00 33.01 28.57 3byz s GLN 33 CO 0.30 -0.66 0.00 0.41 -1.32 0.00 0.00 175.29 174.03 3byz n GLY 34 N 3.85 0.87 3.76 2.60 0.00 0.16 -4.88 105.19 111.55 3byz n GLY 34 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 3byz n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3byz s LYS 35 N -0.20 4.72 -0.77 1.61 -0.14 -0.21 -4.63 119.74 120.12 3byz s LYS 35 Ca 0.00 1.56 -0.21 0.00 -1.36 0.00 0.00 55.97 55.96 3byz s LYS 35 Cb 0.00 -3.14 0.09 0.00 -1.68 0.00 0.00 37.83 33.10 3byz s LYS 35 CO 0.00 0.36 1.04 0.15 -0.76 0.00 0.00 175.35 176.14 3byz s LYS 36 N -1.46 3.31 -0.09 1.68 3.01 -1.26 -0.53 119.74 124.41 3byz s LYS 36 Ca 0.44 -1.19 0.03 0.00 -1.01 0.00 0.00 55.97 54.24 3byz s LYS 36 Cb -0.27 -4.53 -0.01 0.00 -1.01 0.00 0.00 37.83 32.01 3byz s LYS 36 CO 0.33 -1.81 -0.19 0.54 0.51 0.00 0.00 175.35 174.73 3byz s VAL 37 N 3.58 2.58 -0.06 3.17 0.11 0.48 0.27 120.40 130.53 3byz s VAL 37 Ca 0.27 -0.86 -0.20 0.00 -2.93 0.00 0.00 61.98 58.26 3byz s VAL 37 Cb -0.12 -2.01 -0.05 0.00 -1.53 0.00 0.00 36.38 32.67 3byz s VAL 37 CO 0.02 0.56 0.55 -0.63 -3.33 0.00 0.00 175.10 172.27 3byz s ILE 38 N -0.02 5.06 -0.13 7.04 1.01 -0.70 -1.72 121.20 131.74 3byz s ILE 38 Ca -0.06 1.13 0.03 0.00 0.00 0.00 0.00 60.65 61.75 3byz s ILE 38 Cb -0.15 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.44 3byz s ILE 38 CO 0.05 0.36 -0.21 -0.69 0.00 0.00 0.00 174.94 174.44 3byz s VAL 39 N 0.27 2.17 0.07 2.92 1.01 -0.57 -1.92 120.40 124.35 3byz s VAL 39 Ca 0.29 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.36 3byz s VAL 39 Cb -0.17 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 3byz s VAL 39 CO 0.14 0.55 -0.00 0.42 0.00 0.00 0.00 175.10 176.21 3byz s THR 40 N 0.65 4.04 -0.14 3.92 -4.23 -0.86 -1.80 115.64 117.23 3byz s THR 40 Ca -0.11 -0.91 -0.00 0.00 -1.18 0.00 0.00 61.69 59.49 3byz s THR 40 Cb -0.16 -2.90 0.00 0.00 1.34 0.00 0.00 72.50 70.78 3byz s THR 40 CO 0.02 0.17 0.12 0.61 -0.54 0.00 0.00 174.62 175.00 3byz n GLY 41 N 0.75 0.57 0.54 3.99 0.00 0.70 -2.91 105.19 108.82 3byz n GLY 41 Ca -0.11 -0.49 0.05 0.00 0.00 0.00 0.00 46.02 45.46 3byz n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3byz n ALA 42 N -2.03 2.26 0.15 4.61 0.00 -0.18 -3.74 120.51 121.59 3byz n ALA 42 Ca -0.02 -0.97 0.05 0.00 0.00 0.00 0.00 53.44 52.50 3byz n ALA 42 Cb 0.51 -0.39 0.49 0.00 0.00 0.00 0.00 19.45 20.06 3byz n ALA 42 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3byz h SER 43 N 1.92 0.18 -5.24 0.00 4.64 -1.93 -3.25 113.55 109.86 3byz h SER 43 Ca 0.00 -0.02 -0.11 0.00 -0.47 0.00 0.00 61.79 61.19 3byz h SER 43 Cb 0.63 -0.04 -0.05 0.00 -0.31 0.00 0.00 62.40 62.63 3byz h SER 43 CO 0.00 0.23 0.02 -1.59 -0.87 0.00 0.00 176.83 174.62 3byz s LYS 44 N -4.97 1.93 2.89 4.77 -2.85 -1.26 -4.80 119.74 115.45 3byz s LYS 44 Ca -0.06 -1.47 0.00 0.00 -1.00 0.00 0.00 55.97 53.45 3byz s LYS 44 Cb 0.16 0.53 0.00 0.00 -2.06 0.00 0.00 37.83 36.46 3byz s LYS 44 CO 0.71 -0.85 0.00 0.41 0.10 0.00 0.00 175.35 175.72 3byz n GLY 45 N -0.50 0.49 0.33 0.59 0.00 -1.26 -1.83 105.19 103.01 3byz n GLY 45 Ca -0.03 -0.91 0.12 0.00 0.00 0.00 0.00 46.02 45.20 3byz n GLY 45 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3byz h ILE 46 N 0.00 0.09 -0.21 -0.61 2.04 -1.89 0.16 117.51 117.09 3byz h ILE 46 Ca 0.00 -0.01 0.04 0.00 1.00 0.00 0.00 64.86 65.89 3byz h ILE 46 Cb 0.00 0.05 -0.07 0.00 -0.74 0.00 0.00 36.82 36.06 3byz h ILE 46 CO 0.00 0.01 -0.53 1.23 0.00 0.00 0.00 178.15 178.86 3byz h GLY 47 N 0.04 -0.99 0.89 5.37 0.00 -1.63 -0.96 103.07 105.79 3byz h GLY 47 Ca 0.55 0.66 0.02 0.00 0.00 0.00 0.00 47.33 48.57 3byz h GLY 47 CO -0.87 -0.18 0.38 -0.09 0.00 0.00 0.00 176.54 175.77 3byz h ARG 48 N -0.52 0.73 -0.77 4.80 2.43 -0.24 -0.98 114.38 119.83 3byz h ARG 48 Ca 0.05 -0.04 0.10 0.00 -0.81 0.00 0.00 59.98 59.28 3byz h ARG 48 Cb 0.65 -0.16 -0.07 0.00 -0.42 0.00 0.00 29.97 29.97 3byz h ARG 48 CO -0.48 0.48 0.41 0.93 -1.51 0.00 0.00 179.97 179.81 3byz h GLU 49 N 0.75 0.67 0.52 0.20 4.39 -0.97 -1.70 114.58 118.44 3byz h GLU 49 Ca 0.24 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.88 3byz h GLU 49 Cb 0.00 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.50 3byz h GLU 49 CO -0.09 0.45 -0.32 0.52 -1.16 0.00 0.00 179.01 178.40 3byz h MET 50 N 0.69 -0.77 -0.96 2.33 2.86 0.05 -0.02 114.93 119.12 3byz h MET 50 Ca 0.38 0.05 0.23 0.00 -2.06 0.00 0.00 59.70 58.30 3byz h MET 50 Cb 0.38 0.18 -0.18 0.00 0.06 0.00 0.00 31.60 32.03 3byz h MET 50 CO -0.26 -0.52 -0.07 0.00 1.06 0.00 0.00 176.91 177.13 3byz h ALA 51 N -0.39 0.95 -0.52 6.32 0.00 -0.90 0.21 119.26 124.93 3byz h ALA 51 Ca -0.06 0.34 -0.11 0.00 0.00 0.00 0.00 54.91 55.09 3byz h ALA 51 Cb 0.66 0.63 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 3byz h ALA 51 CO 0.06 -0.49 -0.09 1.88 0.00 0.00 0.00 179.25 180.60 3byz h TYR 52 N 0.02 1.10 -0.36 0.00 0.05 -0.43 0.17 116.97 117.52 3byz h TYR 52 Ca 0.53 -0.23 -0.12 0.00 0.05 0.00 0.00 58.73 58.97 3byz h TYR 52 Cb 1.00 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 38.45 3byz h TYR 52 CO -0.58 1.03 -0.26 0.45 -1.05 0.00 0.00 178.16 177.75 3byz h HIS 53 N 0.86 0.85 -0.31 4.88 3.86 0.85 -1.67 115.15 124.46 3byz h HIS 53 Ca 0.14 -0.21 -0.08 0.00 -1.16 0.00 0.00 60.37 59.06 3byz h HIS 53 Cb 0.65 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.91 3byz h HIS 53 CO 0.05 0.93 -0.15 -0.07 0.86 0.00 0.00 177.93 179.54 3byz h LEU 54 N 0.64 0.54 -0.17 2.43 3.38 -0.45 -1.25 115.31 120.42 3byz h LEU 54 Ca 0.08 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 3byz h LEU 54 Cb 0.77 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 3byz h LEU 54 CO 0.06 0.72 -0.19 0.00 0.09 0.00 0.00 178.44 179.12 3byz h ALA 55 N 1.34 0.26 0.00 1.53 0.00 -0.29 -0.03 119.26 122.06 3byz h ALA 55 Ca 0.09 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3byz h ALA 55 Cb 0.56 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3byz h ALA 55 CO 0.04 0.18 0.00 0.87 0.00 0.00 0.00 179.25 180.34 3byz h LYS 56 N 0.08 0.00 -0.18 0.00 1.57 -0.77 0.48 116.57 117.75 3byz h LYS 56 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3byz h LYS 56 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.05 3byz h LYS 56 CO 0.05 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 177.60 3byz n MET 57 N -3.08 2.20 -2.17 3.15 2.81 -0.52 -4.92 117.12 114.59 3byz n MET 57 Ca -0.03 -1.79 -0.14 0.00 -1.81 0.00 0.00 57.70 53.94 3byz n MET 57 Cb 0.09 -1.47 -0.01 0.00 -0.71 0.00 0.00 33.22 31.12 3byz n MET 57 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3byz n GLY 58 N 1.35 -0.02 3.81 3.03 0.00 0.16 -3.48 105.19 110.02 3byz n GLY 58 Ca 0.17 -0.32 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 3byz n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3byz s ALA 59 N -2.66 2.81 -0.17 4.61 0.00 -0.05 0.36 121.76 126.65 3byz s ALA 59 Ca 0.00 0.43 -0.27 0.00 0.00 0.00 0.00 51.96 52.12 3byz s ALA 59 Cb 0.00 -3.22 -0.01 0.00 0.00 0.00 0.00 23.12 19.89 3byz s ALA 59 CO 0.00 -0.61 0.90 -1.01 0.00 0.00 0.00 175.76 175.04 3byz s HIS 60 N -2.35 3.42 -0.17 0.00 3.76 0.31 -1.98 115.29 118.28 3byz s HIS 60 Ca 0.64 1.35 -0.00 0.00 -0.15 0.00 0.00 55.06 56.90 3byz s HIS 60 Cb -0.15 -3.09 0.04 0.00 1.11 0.00 0.00 32.58 30.49 3byz s HIS 60 CO 0.32 -0.28 -0.07 0.54 -0.85 0.00 0.00 174.74 174.40 3byz s VAL 61 N 2.32 1.24 -0.31 -0.90 0.11 -0.73 -0.39 120.40 121.74 3byz s VAL 61 Ca 0.41 -0.72 -0.12 0.00 -2.93 0.00 0.00 61.98 58.62 3byz s VAL 61 Cb -0.17 -1.39 -0.03 0.00 -1.53 0.00 0.00 36.38 33.27 3byz s VAL 61 CO 0.12 0.14 0.21 -0.69 -3.33 0.00 0.00 175.10 171.56 3byz s VAL 62 N 1.58 5.22 0.05 2.04 1.01 -0.70 -1.43 120.40 128.17 3byz s VAL 62 Ca 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 61.91 3byz s VAL 62 Cb -0.15 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 3byz s VAL 62 CO -0.08 0.10 0.12 0.68 0.00 0.00 0.00 175.10 175.92 3byz s VAL 63 N 1.73 4.85 0.02 2.92 -7.23 0.20 -1.51 120.40 121.38 3byz s VAL 63 Ca 0.06 -0.56 -0.01 0.00 -1.81 0.00 0.00 61.98 59.66 3byz s VAL 63 Cb -0.17 -3.32 -0.02 0.00 0.56 0.00 0.00 36.38 33.44 3byz s VAL 63 CO 0.10 0.18 0.00 0.28 -0.31 0.00 0.00 175.10 175.36 3byz s THR 64 N -1.38 0.12 -0.00 5.32 -1.32 -0.74 -2.27 115.64 115.36 3byz s THR 64 Ca 0.29 -0.95 -0.02 0.00 -1.21 0.00 0.00 61.69 59.80 3byz s THR 64 Cb -0.12 -0.41 0.01 0.00 -1.51 0.00 0.00 72.50 70.46 3byz s THR 64 CO 0.22 -0.53 0.07 0.00 -2.21 0.00 0.00 174.62 172.17 3byz n ALA 65 N 1.42 -0.20 0.04 11.08 0.00 -1.26 -0.22 120.51 131.37 3byz n ALA 65 Ca -0.23 -0.04 -0.22 0.00 0.00 0.00 0.00 53.44 52.95 3byz n ALA 65 Cb 0.56 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.87 3byz n ALA 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3byz h ARG 66 N 0.00 0.32 -6.41 0.00 3.08 -1.91 0.04 114.38 109.51 3byz h ARG 66 Ca -0.01 -0.55 -0.54 0.00 0.07 0.00 0.00 59.98 58.95 3byz h ARG 66 Cb 0.06 0.20 -0.08 0.00 0.08 0.00 0.00 29.97 30.24 3byz h ARG 66 CO 0.02 1.26 1.04 -1.54 -1.07 0.00 0.00 179.97 179.68 3byz s SER 67 N -7.16 6.22 0.18 7.04 1.04 -1.26 -4.34 113.70 115.41 3byz s SER 67 Ca -0.19 -0.32 -0.02 0.00 0.48 0.00 0.00 55.95 55.90 3byz s SER 67 Cb 0.05 -2.56 0.07 0.00 0.10 0.00 0.00 66.02 63.68 3byz s SER 67 CO 0.81 -1.76 1.45 0.07 0.98 0.00 0.00 173.24 174.78 3byz h LYS 68 N 9.95 0.45 -0.64 4.02 2.10 -1.98 -2.31 116.57 128.17 3byz h LYS 68 Ca -0.27 -0.35 -0.03 0.00 -2.00 0.00 0.00 60.65 58.00 3byz h LYS 68 Cb 1.05 0.07 -0.03 0.00 -0.90 0.00 0.00 32.23 32.42 3byz h LYS 68 CO 1.26 0.98 0.29 0.93 -2.00 0.00 0.00 179.45 180.90 3byz h GLU 69 N 0.32 0.92 0.12 0.07 5.08 -2.00 -1.79 114.58 117.30 3byz h GLU 69 Ca -0.02 -0.13 -0.30 0.00 -1.00 0.00 0.00 59.36 57.91 3byz h GLU 69 Cb 1.25 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 3byz h GLU 69 CO 0.12 0.73 -1.50 0.00 -1.00 0.00 0.00 179.01 177.36 3byz h THR 70 N 0.91 1.19 -0.53 1.13 1.03 -1.92 -2.80 112.91 111.93 3byz h THR 70 Ca 0.22 -2.82 0.07 0.00 -0.01 0.00 0.00 66.41 63.87 3byz h THR 70 Cb 0.12 2.78 -0.06 0.00 -1.07 0.00 0.00 68.15 69.92 3byz h THR 70 CO -0.03 0.82 0.20 -0.07 -0.01 0.00 0.00 175.52 176.44 3byz h LEU 71 N 0.07 0.21 -1.21 0.00 3.38 -1.32 0.10 115.31 116.53 3byz h LEU 71 Ca -0.23 0.06 0.10 0.00 0.09 0.00 0.00 57.88 57.90 3byz h LEU 71 Cb 2.01 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 42.73 3byz h LEU 71 CO 0.17 0.15 0.57 -0.61 0.09 0.00 0.00 178.44 178.80 3byz h GLN 72 N 0.39 0.85 -0.55 1.13 5.75 -1.17 0.90 115.11 122.40 3byz h GLN 72 Ca 0.25 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.67 3byz h GLN 72 Cb 0.27 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 28.60 3byz h GLN 72 CO -0.25 0.56 0.21 0.87 -2.65 0.00 0.00 178.83 177.58 3byz h LYS 73 N 0.88 0.83 -0.49 1.69 6.56 -1.12 0.11 116.57 125.02 3byz h LYS 73 Ca 0.41 -0.15 -0.12 0.00 -1.06 0.00 0.00 60.65 59.73 3byz h LYS 73 Cb 0.40 -0.13 -0.02 0.00 -0.57 0.00 0.00 32.23 31.91 3byz h LYS 73 CO -0.17 0.73 -0.15 0.28 -2.06 0.00 0.00 179.45 178.07 3byz h VAL 74 N 0.76 1.27 -0.56 0.50 2.07 0.22 -1.83 116.25 118.67 3byz h VAL 74 Ca 0.18 -1.30 -0.11 0.00 0.82 0.00 0.00 66.70 66.30 3byz h VAL 74 Cb 0.21 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 3byz h VAL 74 CO -0.01 0.45 -0.07 0.58 0.02 0.00 0.00 177.57 178.53 3byz h VAL 75 N 0.84 1.27 0.20 2.57 2.07 0.77 -0.08 116.25 123.88 3byz h VAL 75 Ca 0.12 -1.23 -0.01 0.00 0.82 0.00 0.00 66.70 66.41 3byz h VAL 75 Cb 0.71 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 3byz h VAL 75 CO 0.05 0.44 -0.10 0.28 0.02 0.00 0.00 177.57 178.27 3byz h SER 76 N 0.93 -0.23 0.02 0.57 0.02 -0.67 -2.12 113.55 112.07 3byz h SER 76 Ca 0.15 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.04 3byz h SER 76 Cb 0.64 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.22 3byz h SER 76 CO 0.04 -0.13 -0.11 -0.74 -1.14 0.00 0.00 176.83 174.75 3byz h HIS 77 N -0.30 0.21 0.08 3.45 6.17 -1.26 -1.64 115.15 121.85 3byz h HIS 77 Ca -0.03 -0.02 -0.00 0.00 0.71 0.00 0.00 60.37 61.03 3byz h HIS 77 Cb 0.23 -0.06 0.00 0.00 2.52 0.00 0.00 27.41 30.10 3byz h HIS 77 CO -0.05 0.31 -0.04 0.00 0.71 0.00 0.00 177.93 178.86 3byz h LEU 79 N -0.46 -0.01 -1.17 0.00 3.38 -1.13 -0.47 115.31 115.47 3byz h LEU 79 Ca -0.01 0.12 0.06 0.00 0.09 0.00 0.00 57.88 58.14 3byz h LEU 79 Cb 0.39 0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.25 3byz h LEU 79 CO 0.02 -0.00 0.58 -0.33 0.09 0.00 0.00 178.44 178.80 3byz h GLU 80 N 0.26 0.99 0.00 1.13 5.08 -1.21 -2.05 114.58 118.77 3byz h GLU 80 Ca 0.33 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.58 3byz h GLU 80 Cb 0.50 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 3byz h GLU 80 CO -0.42 0.65 -0.25 -0.07 -1.00 0.00 0.00 179.01 177.92 3byz h LEU 81 N 1.02 0.00 0.00 1.33 3.38 -0.33 -3.46 115.31 117.25 3byz h LEU 81 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 3byz h LEU 81 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3byz h LEU 81 CO -0.13 0.25 0.00 0.61 0.09 0.00 0.00 178.44 179.26 3byz n GLY 82 N 0.93 1.75 3.44 0.83 0.00 -0.73 -4.33 105.19 107.09 3byz n GLY 82 Ca 0.02 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.57 3byz n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3byz n ALA 83 N 0.00 -2.32 0.28 4.61 0.00 -0.57 -3.66 120.51 118.85 3byz n ALA 83 Ca 0.00 0.43 0.15 0.00 0.00 0.00 0.00 53.44 54.02 3byz n ALA 83 Cb 0.00 -1.70 0.80 0.00 0.00 0.00 0.00 19.45 18.55 3byz n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3byz h ALA 84 N 1.22 1.24 -1.31 0.00 0.00 -1.49 -3.46 119.26 115.47 3byz h ALA 84 Ca -0.31 -0.08 0.14 0.00 0.00 0.00 0.00 54.91 54.67 3byz h ALA 84 Cb 1.42 -0.01 -0.30 0.00 0.00 0.00 0.00 17.79 18.90 3byz h ALA 84 CO 0.58 0.11 0.65 0.45 0.00 0.00 0.00 179.25 181.03 3byz s SER 85 N -6.00 -0.25 -0.17 0.00 0.15 -1.26 -4.97 113.70 101.20 3byz s SER 85 Ca -0.03 0.45 -0.08 0.00 0.70 0.00 0.00 55.95 56.99 3byz s SER 85 Cb 0.13 0.66 0.06 0.00 -1.71 0.00 0.00 66.02 65.16 3byz s SER 85 CO 0.56 -0.08 0.39 0.00 1.20 0.00 0.00 173.24 175.31 3byz s ALA 86 N 0.45 -0.99 0.01 5.45 0.00 -1.26 -1.78 121.76 123.64 3byz s ALA 86 Ca 0.01 1.43 0.00 0.00 0.00 0.00 0.00 51.96 53.40 3byz s ALA 86 Cb -0.04 -0.99 -0.01 0.00 0.00 0.00 0.00 23.12 22.08 3byz s ALA 86 CO -0.12 -0.39 -0.01 -1.01 0.00 0.00 0.00 175.76 174.23 3byz s HIS 87 N 1.73 0.11 0.26 0.00 3.76 -0.51 -4.99 115.29 115.64 3byz s HIS 87 Ca -0.07 -0.15 0.11 0.00 -0.15 0.00 0.00 55.06 54.80 3byz s HIS 87 Cb -0.10 -0.08 -0.05 0.00 1.11 0.00 0.00 32.58 33.47 3byz s HIS 87 CO -0.12 -0.05 -0.13 1.52 -0.85 0.00 0.00 174.74 175.10 3byz s TYR 88 N -0.41 2.44 -0.18 1.40 1.13 -1.26 0.61 117.35 121.09 3byz s TYR 88 Ca -0.04 -0.29 -0.05 0.00 -1.41 0.00 0.00 57.07 55.28 3byz s TYR 88 Cb -0.03 -1.08 0.07 0.00 -1.10 0.00 0.00 41.96 39.82 3byz s TYR 88 CO -0.00 0.66 0.13 0.42 -2.51 0.00 0.00 175.55 174.25 3byz s ILE 89 N -2.34 -0.16 0.24 -3.49 1.01 -0.96 -4.95 121.20 110.55 3byz s ILE 89 Ca 0.29 -0.15 -0.26 0.00 0.00 0.00 0.00 60.65 60.53 3byz s ILE 89 Cb -0.06 -0.60 -0.09 0.00 0.01 0.00 0.00 42.46 41.72 3byz s ILE 89 CO 0.16 -0.26 0.87 0.00 0.00 0.00 0.00 174.94 175.72 3byz s ALA 90 N 2.19 3.34 -0.04 9.38 0.00 -1.26 -4.19 121.76 131.18 3byz s ALA 90 Ca 0.03 0.47 -0.30 0.00 0.00 0.00 0.00 51.96 52.17 3byz s ALA 90 Cb -0.16 -3.09 0.10 0.00 0.00 0.00 0.00 23.12 19.97 3byz s ALA 90 CO -0.10 0.23 1.32 0.20 0.00 0.00 0.00 175.76 177.41 3byz s GLY 91 N -1.36 -0.22 -0.08 0.00 0.00 0.00 -4.99 107.32 100.68 3byz s GLY 91 Ca 0.43 0.24 0.01 0.00 0.00 0.00 0.00 44.72 45.40 3byz s GLY 91 CO 0.27 4.57 -0.10 -1.08 0.00 0.00 0.00 173.10 176.75 3byz s THR 92 N -2.08 1.06 -2.00 0.90 -1.32 -1.26 -3.13 115.64 107.81 3byz s THR 92 Ca 0.26 -0.40 0.08 0.00 -1.21 0.00 0.00 61.69 60.42 3byz s THR 92 Cb 0.01 -1.00 0.24 0.00 -1.51 0.00 0.00 72.50 70.23 3byz s THR 92 CO -0.02 0.35 1.02 0.23 -2.21 0.00 0.00 174.62 173.99 3byz n MET 93 N 4.11 0.63 0.12 7.08 0.00 -1.26 -1.91 117.12 125.89 3byz n MET 93 Ca -0.21 0.00 -0.00 0.00 0.00 0.00 0.00 57.70 57.49 3byz n MET 93 Cb 0.51 -1.21 0.01 0.00 0.00 0.00 0.00 33.22 32.54 3byz n MET 93 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 3byz h GLU 94 N 0.00 0.00 -6.20 0.03 5.08 -1.95 -3.41 114.58 108.13 3byz h GLU 94 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 3byz h GLU 94 Cb 0.00 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.18 3byz h GLU 94 CO 0.00 0.66 1.17 0.34 -1.00 0.00 0.00 179.01 180.18 3byz s ASP 95 N -6.55 5.94 0.46 1.42 -1.08 -0.80 -4.88 116.67 111.17 3byz s ASP 95 Ca 0.02 -0.41 0.16 0.00 -0.52 0.00 0.00 52.55 51.80 3byz s ASP 95 Cb 0.09 -2.55 1.11 0.00 -1.46 0.00 0.00 42.92 40.10 3byz s ASP 95 CO 0.76 -1.97 2.00 0.24 0.52 0.00 0.00 175.17 176.72 3byz h MET 96 N 11.22 0.30 -0.30 4.34 2.86 -1.86 -1.23 114.93 130.27 3byz h MET 96 Ca -0.19 -0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.34 3byz h MET 96 Cb 1.07 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.65 3byz h MET 96 CO 1.28 0.20 -0.18 1.15 1.06 0.00 0.00 176.91 180.42 3byz h THR 97 N 0.31 1.30 -0.52 2.22 2.02 -1.95 -2.63 112.91 113.66 3byz h THR 97 Ca 0.25 -1.31 0.10 0.00 0.77 0.00 0.00 66.41 66.22 3byz h THR 97 Cb 0.57 1.50 -0.09 0.00 -1.74 0.00 0.00 68.15 68.39 3byz h THR 97 CO -0.06 0.42 -0.00 0.15 0.37 0.00 0.00 175.52 176.40 3byz h PHE 98 N 0.40 -0.04 -0.83 3.16 3.04 -1.57 -1.13 116.94 119.97 3byz h PHE 98 Ca 0.06 0.04 0.14 0.00 3.98 0.00 0.00 57.97 62.19 3byz h PHE 98 Cb 0.72 0.10 -0.14 0.00 2.56 0.00 0.00 35.95 39.19 3byz h PHE 98 CO 0.06 -0.13 -0.36 0.00 -2.02 0.00 0.00 178.31 175.87 3byz h ALA 99 N 1.47 0.11 -0.06 2.41 0.00 -1.12 0.22 119.26 122.29 3byz h ALA 99 Ca 0.27 0.24 -0.25 0.00 0.00 0.00 0.00 54.91 55.17 3byz h ALA 99 Cb 0.41 0.90 0.02 0.00 0.00 0.00 0.00 17.79 19.12 3byz h ALA 99 CO -0.44 -0.63 -0.92 1.49 0.00 0.00 0.00 179.25 178.74 3byz h GLU 100 N -0.06 0.73 0.02 0.00 4.81 -1.11 -3.03 114.58 115.94 3byz h GLU 100 Ca 0.31 -0.71 -0.00 0.00 -0.13 0.00 0.00 59.36 58.83 3byz h GLU 100 Cb 0.58 0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.14 3byz h GLU 100 CO -0.87 1.29 -0.01 1.96 -0.73 0.00 0.00 179.01 180.66 3byz h GLN 101 N 0.44 -0.03 -0.92 1.92 1.08 -0.70 -2.92 115.11 113.99 3byz h GLN 101 Ca -0.10 0.00 0.25 0.00 -1.45 0.00 0.00 58.65 57.36 3byz h GLN 101 Cb 1.57 0.01 -0.14 0.00 -0.05 0.00 0.00 27.48 28.87 3byz h GLN 101 CO 0.19 0.07 0.37 0.35 -0.95 0.00 0.00 178.83 178.85 3byz h PHE 102 N -0.12 0.58 -0.31 2.96 3.57 -0.62 0.25 116.94 123.26 3byz h PHE 102 Ca -0.00 0.04 -0.10 0.00 3.53 0.00 0.00 57.97 61.44 3byz h PHE 102 Cb 0.11 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 3byz h PHE 102 CO -0.05 -0.16 -0.21 0.28 -2.23 0.00 0.00 178.31 175.95 3byz h VAL 103 N 0.29 1.30 -0.61 1.41 2.07 -1.47 -0.78 116.25 118.46 3byz h VAL 103 Ca 0.60 -1.35 0.05 0.00 0.82 0.00 0.00 66.70 66.83 3byz h VAL 103 Cb 1.25 1.48 -0.05 0.00 -1.52 0.00 0.00 31.29 32.45 3byz h VAL 103 CO -0.61 0.43 0.32 0.00 0.02 0.00 0.00 177.57 177.74 3byz h ALA 104 N 0.74 0.80 -0.17 1.67 0.00 -1.09 -2.20 119.26 119.01 3byz h ALA 104 Ca 0.06 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 3byz h ALA 104 Cb 0.76 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 3byz h ALA 104 CO 0.06 -0.01 -0.09 1.96 0.00 0.00 0.00 179.25 181.16 3byz h GLN 105 N 0.60 0.37 -0.53 0.00 4.20 -0.84 -2.67 115.11 116.24 3byz h GLN 105 Ca 0.27 -0.17 0.09 0.00 0.06 0.00 0.00 58.65 58.91 3byz h GLN 105 Cb 0.17 -0.01 -0.07 0.00 0.30 0.00 0.00 27.48 27.87 3byz h GLN 105 CO -0.18 0.68 0.11 0.00 -0.67 0.00 0.00 178.83 178.78 3byz h ALA 106 N 0.67 0.61 -0.14 3.87 0.00 -1.10 -1.75 119.26 121.42 3byz h ALA 106 Ca 0.04 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3byz h ALA 106 Cb 0.58 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3byz h ALA 106 CO 0.03 -0.30 0.05 0.78 0.00 0.00 0.00 179.25 179.81 3byz h GLY 107 N 0.25 0.21 0.47 0.00 0.00 -1.28 -2.94 103.07 99.78 3byz h GLY 107 Ca 0.27 -0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.50 3byz h GLY 107 CO -0.34 0.08 -0.03 0.50 0.00 0.00 0.00 176.54 176.75 3byz h LYS 108 N 0.20 0.05 0.00 4.80 1.79 -0.99 0.47 116.57 122.89 3byz h LYS 108 Ca 0.05 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 3byz h LYS 108 Cb 0.05 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.71 3byz h LYS 108 CO -0.01 0.60 0.00 -0.07 -1.08 0.00 0.00 179.45 178.90 3byz h LEU 109 N -0.50 0.00 0.00 2.94 3.38 -1.29 -2.74 115.31 117.11 3byz h LEU 109 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3byz h LEU 109 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3byz h LEU 109 CO 0.01 0.00 -0.58 0.23 0.09 0.00 0.00 178.44 178.19 3byz n MET 110 N -2.94 3.55 -2.84 1.13 2.81 -1.12 -5.03 117.12 112.68 3byz n MET 110 Ca -0.03 -0.02 -0.10 0.00 -1.81 0.00 0.00 57.70 55.75 3byz n MET 110 Cb 0.06 -0.85 0.05 0.00 -0.71 0.00 0.00 33.22 31.77 3byz n MET 110 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3byz n GLY 111 N 1.53 0.04 0.00 3.03 0.00 0.15 -4.87 105.19 105.06 3byz n GLY 111 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.85 3byz n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3byz n GLY 112 N -1.12 1.33 3.34 -0.02 0.00 -0.21 -5.04 105.19 103.48 3byz n GLY 112 Ca -0.12 -2.27 -0.13 0.00 0.00 0.00 0.00 46.02 43.50 3byz n GLY 112 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3byz s LEU 113 N 0.00 0.24 -0.06 0.99 2.96 -1.26 -4.62 118.68 116.92 3byz s LEU 113 Ca 0.00 0.91 0.01 0.00 -0.22 0.00 0.00 54.13 54.83 3byz s LEU 113 Cb 0.00 1.54 -0.05 0.00 0.50 0.00 0.00 46.19 48.18 3byz s LEU 113 CO 0.00 -0.16 -0.05 0.47 -1.32 0.00 0.00 176.35 175.29 3byz n ASP 114 N 2.94 3.52 -3.92 3.68 9.92 0.14 -4.34 116.55 128.49 3byz n ASP 114 Ca -0.14 -0.03 -0.18 0.00 -0.53 0.00 0.00 54.79 53.91 3byz n ASP 114 Cb 0.57 0.02 -0.15 0.00 -0.64 0.00 0.00 41.12 40.91 3byz n ASP 114 CO 0.00 0.00 0.00 -0.32 0.13 0.00 0.00 177.20 177.01 3byz s MET 115 N -2.13 0.60 -0.24 -1.24 0.00 -1.14 0.14 119.30 115.29 3byz s MET 115 Ca -0.08 -0.14 0.01 0.00 0.00 0.00 0.00 55.69 55.48 3byz s MET 115 Cb 0.02 -0.61 0.04 0.00 0.00 0.00 0.00 34.83 34.28 3byz s MET 115 CO 0.16 0.02 -0.11 -1.17 0.00 0.00 0.00 175.02 173.92 3byz s LEU 116 N 0.40 3.06 -0.40 4.11 2.96 0.07 -1.72 118.68 127.17 3byz s LEU 116 Ca -0.05 -1.06 -0.06 0.00 -0.22 0.00 0.00 54.13 52.74 3byz s LEU 116 Cb -0.09 -1.57 0.09 0.00 0.50 0.00 0.00 46.19 45.12 3byz s LEU 116 CO -0.00 -0.13 0.21 -0.63 -1.32 0.00 0.00 176.35 174.48 3byz s ILE 117 N 1.22 3.77 -0.46 6.68 1.01 -0.81 0.37 121.20 132.97 3byz s ILE 117 Ca -0.03 -1.61 -0.19 0.00 0.00 0.00 0.00 60.65 58.82 3byz s ILE 117 Cb -0.17 -3.38 0.04 0.00 0.01 0.00 0.00 42.46 38.96 3byz s ILE 117 CO -0.07 -0.52 0.58 -0.76 0.00 0.00 0.00 174.94 174.18 3byz s LEU 118 N 1.31 4.78 0.00 2.97 1.43 0.11 -2.03 118.68 127.25 3byz s LEU 118 Ca 0.04 -0.66 0.00 0.00 -1.03 0.00 0.00 54.13 52.47 3byz s LEU 118 Cb -0.23 -2.53 0.00 0.00 0.03 0.00 0.00 46.19 43.47 3byz s LEU 118 CO -0.00 -0.78 0.00 -3.20 0.23 0.00 0.00 176.35 172.60 3byz n ASN 119 N 6.06 2.45 -4.75 2.29 5.15 -1.24 -1.96 115.26 123.27 3byz n ASN 119 Ca -0.05 0.00 -0.37 0.00 -0.60 0.00 0.00 54.58 53.56 3byz n ASN 119 Cb 0.47 0.37 0.04 0.00 -0.53 0.00 0.00 39.78 40.13 3byz n ASN 119 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 3byz s HIS 120 N -1.22 2.30 0.03 1.20 -3.43 -1.15 -4.86 115.29 108.16 3byz s HIS 120 Ca 0.00 1.46 -0.06 0.00 -0.80 0.00 0.00 55.06 55.66 3byz s HIS 120 Cb 0.00 -3.64 -0.01 0.00 -1.43 0.00 0.00 32.58 27.51 3byz s HIS 120 CO 0.00 -2.59 0.12 0.96 -2.00 0.00 0.00 174.74 171.23 3byz s ILE 121 N -1.44 0.12 0.21 -5.38 -4.36 -1.26 -4.79 121.20 104.30 3byz s ILE 121 Ca 0.76 -0.95 -0.23 0.00 -0.26 0.00 0.00 60.65 59.97 3byz s ILE 121 Cb -0.35 -0.75 -0.08 0.00 1.25 0.00 0.00 42.46 42.52 3byz s ILE 121 CO 0.40 -0.53 0.78 0.28 0.24 0.00 0.00 174.94 176.11 3byz s THR 122 N -2.24 4.43 -0.45 8.37 -1.32 -1.26 -4.96 115.64 118.20 3byz s THR 122 Ca -0.08 1.55 -0.45 0.00 -1.21 0.00 0.00 61.69 61.50 3byz s THR 122 Cb -0.03 -4.00 -0.19 0.00 -1.51 0.00 0.00 72.50 66.77 3byz s THR 122 CO -0.03 0.34 1.75 0.59 -2.21 0.00 0.00 174.62 175.06 3byz n ASN 123 N 1.08 1.40 -4.47 8.08 5.03 -1.26 -4.98 115.26 120.14 3byz n ASN 123 Ca -0.03 1.04 -0.26 0.00 0.87 0.00 0.00 54.58 56.21 3byz n ASN 123 Cb 0.50 -0.95 -0.10 0.00 -1.02 0.00 0.00 39.78 38.21 3byz n ASN 123 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 3byz s THR 124 N 3.83 1.25 0.21 3.41 -4.23 -1.26 -5.03 115.64 113.83 3byz s THR 124 Ca 1.07 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 59.52 3byz s THR 124 Cb -1.39 -2.66 -0.03 0.00 1.34 0.00 0.00 72.50 69.77 3byz s THR 124 CO 0.75 0.00 0.26 -0.94 -0.54 0.00 0.00 174.62 174.14 3byz s SER 125 N -3.62 0.06 0.07 3.99 1.04 -1.26 -5.01 113.70 108.97 3byz s SER 125 Ca 0.29 -1.21 -0.31 0.00 0.48 0.00 0.00 55.95 55.20 3byz s SER 125 Cb 0.07 0.45 -0.07 0.00 0.10 0.00 0.00 66.02 66.57 3byz s SER 125 CO 0.14 -0.95 1.33 -0.76 0.98 0.00 0.00 173.24 173.99 3byz s LEU 126 N -3.10 4.36 -0.14 2.42 2.01 -1.26 -4.74 118.68 118.21 3byz s LEU 126 Ca 0.32 2.18 -0.30 0.00 0.01 0.00 0.00 54.13 56.34 3byz s LEU 126 Cb 0.04 -3.58 0.13 0.00 0.01 0.00 0.00 46.19 42.79 3byz s LEU 126 CO 0.10 -0.61 1.04 0.20 1.01 0.00 0.00 176.35 178.09 3byz s ASN 127 N 1.27 -0.30 0.49 2.29 0.02 -0.55 -5.05 114.94 113.11 3byz s ASN 127 Ca 0.62 0.23 -0.22 0.00 -1.02 0.00 0.00 52.86 52.47 3byz s ASN 127 Cb -0.33 0.27 -0.07 0.00 0.02 0.00 0.00 41.25 41.14 3byz s ASN 127 CO 0.29 -0.36 1.23 -0.76 0.02 0.00 0.00 177.10 177.52 3byz s LEU 128 N -1.53 3.96 -0.16 0.60 1.43 -1.26 -3.76 118.68 117.96 3byz s LEU 128 Ca 0.02 2.45 -0.29 0.00 -1.03 0.00 0.00 54.13 55.28 3byz s LEU 128 Cb -0.01 -4.25 -0.01 0.00 0.03 0.00 0.00 46.19 41.95 3byz s LEU 128 CO -0.02 -1.13 1.07 0.12 0.23 0.00 0.00 176.35 176.62 3byz s PHE 129 N -1.47 3.33 0.01 0.29 5.36 -1.26 -4.92 117.98 119.33 3byz s PHE 129 Ca 0.66 1.43 -0.05 0.00 -0.96 0.00 0.00 56.93 58.01 3byz s PHE 129 Cb -0.32 -3.28 -0.02 0.00 -0.34 0.00 0.00 43.02 39.05 3byz s PHE 129 CO 0.39 -0.62 -0.10 0.72 -1.46 0.00 0.00 175.22 174.15 3byz n HIS 130 N 5.73 0.00 -2.49 10.12 8.25 -1.26 -5.00 115.22 130.57 3byz n HIS 130 Ca 0.11 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.54 3byz n HIS 130 Cb 0.47 -0.15 0.06 0.00 1.12 0.00 0.00 29.99 31.49 3byz n HIS 130 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 3byz n ASP 131 N -3.75 -0.94 -3.77 0.41 5.68 -1.26 -5.03 116.55 107.88 3byz n ASP 131 Ca -0.05 -2.13 -0.42 0.00 -0.50 0.00 0.00 54.79 51.69 3byz n ASP 131 Cb 0.18 0.43 0.00 0.00 -1.14 0.00 0.00 41.12 40.58 3byz n ASP 131 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 3byz n ASP 132 N -0.94 4.93 0.05 -1.12 2.03 -1.26 -4.74 116.55 115.51 3byz n ASP 132 Ca -0.17 -3.00 0.02 0.00 0.52 0.00 0.00 54.79 52.16 3byz n ASP 132 Cb 0.83 -1.54 0.38 0.00 -0.72 0.00 0.00 41.12 40.08 3byz n ASP 132 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 3byz h ILE 133 N 3.74 1.15 -0.70 5.18 2.04 -1.99 0.18 117.51 127.12 3byz h ILE 133 Ca 0.49 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 3byz h ILE 133 Cb 0.60 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 3byz h ILE 133 CO 1.72 0.20 0.33 -0.74 0.00 0.00 0.00 178.15 179.66 3byz h HIS 134 N 0.41 1.02 -0.21 1.37 2.76 -1.99 -0.32 115.15 118.18 3byz h HIS 134 Ca 0.10 -0.05 -0.07 0.00 -2.20 0.00 0.00 60.37 58.15 3byz h HIS 134 Cb 0.20 -0.31 -0.01 0.00 1.55 0.00 0.00 27.41 28.85 3byz h HIS 134 CO 0.01 0.76 -0.12 1.25 -1.30 0.00 0.00 177.93 178.53 3byz h HIS 135 N 0.98 0.53 -0.85 5.26 -0.00 -1.10 0.17 115.15 120.14 3byz h HIS 135 Ca 0.24 -0.14 0.16 0.00 -0.00 0.00 0.00 60.37 60.63 3byz h HIS 135 Cb 0.13 -0.12 -0.10 0.00 -0.00 0.00 0.00 27.41 27.32 3byz h HIS 135 CO 0.01 0.76 0.42 0.28 -0.00 0.00 0.00 177.93 179.39 3byz h VAL 136 N 0.16 0.68 -0.08 5.26 2.07 -1.04 -0.41 116.25 122.89 3byz h VAL 136 Ca 0.05 -0.20 -0.10 0.00 0.82 0.00 0.00 66.70 67.27 3byz h VAL 136 Cb 0.62 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 3byz h VAL 136 CO 0.03 0.10 -0.34 -0.09 0.02 0.00 0.00 177.57 177.30 3byz h ARG 137 N 0.57 0.37 -0.65 1.57 2.43 -0.23 -2.31 114.38 116.13 3byz h ARG 137 Ca 0.48 -0.29 -0.06 0.00 -0.81 0.00 0.00 59.98 59.30 3byz h ARG 137 Cb 0.72 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.30 3byz h ARG 137 CO -0.39 0.93 0.17 -0.22 -1.51 0.00 0.00 179.97 178.94 3byz h LYS 138 N -0.11 1.03 -0.90 0.20 3.64 -0.56 0.44 116.57 120.30 3byz h LYS 138 Ca -0.02 -0.24 0.10 0.00 -1.27 0.00 0.00 60.65 59.22 3byz h LYS 138 Cb 0.98 -0.14 -0.07 0.00 -0.41 0.00 0.00 32.23 32.60 3byz h LYS 138 CO 0.07 0.92 0.58 0.77 -2.27 0.00 0.00 179.45 179.52 3byz h SER 139 N 0.95 0.81 -0.04 4.20 0.02 -0.96 -0.74 113.55 117.79 3byz h SER 139 Ca 0.20 0.02 -0.23 0.00 -0.84 0.00 0.00 61.79 60.95 3byz h SER 139 Cb 0.34 -0.14 0.01 0.00 0.14 0.00 0.00 62.40 62.75 3byz h SER 139 CO -0.00 0.47 -0.83 0.24 -1.14 0.00 0.00 176.83 175.58 3byz h MET 140 N 0.89 0.71 -0.08 3.45 2.86 -0.57 -0.51 114.93 121.68 3byz h MET 140 Ca 0.42 -0.62 -0.00 0.00 -2.06 0.00 0.00 59.70 57.44 3byz h MET 140 Cb 0.41 0.14 -0.00 0.00 0.06 0.00 0.00 31.60 32.21 3byz h MET 140 CO -0.18 1.22 0.05 1.49 1.06 0.00 0.00 176.91 180.55 3byz h GLU 141 N 0.47 0.12 0.02 1.72 4.57 -0.65 0.63 114.58 121.46 3byz h GLU 141 Ca -0.06 -0.01 -0.18 0.00 -1.18 0.00 0.00 59.36 57.92 3byz h GLU 141 Cb 1.45 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 30.00 3byz h GLU 141 CO 0.16 0.16 -0.96 0.28 -1.18 0.00 0.00 179.01 177.47 3byz h VAL 142 N 0.05 1.16 0.00 0.32 2.07 -1.21 -1.13 116.25 117.51 3byz h VAL 142 Ca 0.03 -2.26 0.00 0.00 0.82 0.00 0.00 66.70 65.29 3byz h VAL 142 Cb 0.07 2.61 0.00 0.00 -1.52 0.00 0.00 31.29 32.45 3byz h VAL 142 CO -0.00 0.46 0.00 0.78 0.02 0.00 0.00 177.57 178.82 3byz h ASN 143 N -0.88 0.00 0.00 0.57 4.21 -1.23 -3.36 115.58 114.89 3byz h ASN 143 Ca -0.25 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.26 3byz h ASN 143 Cb 1.30 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.50 3byz h ASN 143 CO -0.11 0.00 0.00 0.33 -1.29 0.00 0.00 177.43 176.36 3byz n PHE 144 N -2.54 -1.64 -0.17 1.19 7.35 -0.88 -4.77 117.46 116.00 3byz n PHE 144 Ca 0.03 0.29 -0.02 0.00 -0.76 0.00 0.00 57.45 57.00 3byz n PHE 144 Cb 0.35 0.44 0.06 0.00 0.35 0.00 0.00 39.48 40.68 3byz n PHE 144 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 3byz h LEU 145 N 0.00 -0.33 -1.97 -2.13 7.12 0.22 -1.73 115.31 116.48 3byz h LEU 145 Ca 0.00 0.14 -0.02 0.00 0.13 0.00 0.00 57.88 58.13 3byz h LEU 145 Cb 0.00 0.27 -0.00 0.00 -0.53 0.00 0.00 40.66 40.39 3byz h LEU 145 CO 0.00 -0.12 -0.11 0.77 -0.13 0.00 0.00 178.44 178.85 3byz h SER 146 N 0.07 0.00 -0.32 1.25 4.64 -1.35 -0.88 113.55 116.95 3byz h SER 146 Ca 0.27 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.52 3byz h SER 146 Cb 0.41 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 3byz h SER 146 CO -0.49 0.11 -0.05 1.88 -0.87 0.00 0.00 176.83 177.41 3byz h TYR 147 N 0.00 0.67 -0.71 4.77 0.99 -1.54 -0.70 116.97 120.44 3byz h TYR 147 Ca -0.00 -0.13 -0.02 0.00 2.00 0.00 0.00 58.73 60.57 3byz h TYR 147 Cb 0.27 -0.17 -0.03 0.00 1.00 0.00 0.00 36.73 37.80 3byz h TYR 147 CO 0.00 0.76 0.36 0.28 -0.00 0.00 0.00 178.16 179.56 3byz h VAL 148 N 0.39 1.22 -0.04 -2.88 2.07 -1.06 -1.32 116.25 114.63 3byz h VAL 148 Ca 0.09 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 3byz h VAL 148 Cb 0.52 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 3byz h VAL 148 CO 0.03 0.26 -0.02 0.58 0.02 0.00 0.00 177.57 178.43 3byz h VAL 149 N 1.01 1.33 -0.86 2.57 2.07 -0.90 -1.71 116.25 119.75 3byz h VAL 149 Ca 0.25 -1.03 0.17 0.00 0.82 0.00 0.00 66.70 66.91 3byz h VAL 149 Cb 0.07 1.93 -0.10 0.00 -1.52 0.00 0.00 31.29 31.67 3byz h VAL 149 CO -0.04 0.28 0.43 -0.07 0.02 0.00 0.00 177.57 178.19 3byz h LEU 150 N -0.30 0.47 0.49 2.57 -0.00 -1.05 -2.25 115.31 115.24 3byz h LEU 150 Ca 0.01 0.11 -0.02 0.00 -0.00 0.00 0.00 57.88 57.98 3byz h LEU 150 Cb 0.46 0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.17 3byz h LEU 150 CO 0.01 0.15 -0.24 0.74 -0.00 0.00 0.00 178.44 179.11 3byz h THR 151 N 0.56 0.32 -0.92 0.22 2.02 -1.12 -0.65 112.91 113.33 3byz h THR 151 Ca 0.49 -0.48 0.27 0.00 0.77 0.00 0.00 66.41 67.46 3byz h THR 151 Cb 0.78 0.46 -0.15 0.00 -1.74 0.00 0.00 68.15 67.49 3byz h THR 151 CO -0.41 0.05 0.25 0.58 0.37 0.00 0.00 175.52 176.36 3byz h VAL 152 N -1.02 0.22 -0.32 3.16 2.07 -1.03 0.16 116.25 119.49 3byz h VAL 152 Ca -0.07 -0.05 -0.11 0.00 0.82 0.00 0.00 66.70 67.29 3byz h VAL 152 Cb 0.59 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 3byz h VAL 152 CO 0.11 0.03 -0.23 0.00 0.02 0.00 0.00 177.57 177.50 3byz h ALA 153 N 1.85 0.46 0.00 1.67 0.00 -1.15 -2.98 119.26 119.11 3byz h ALA 153 Ca 0.61 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3byz h ALA 153 Cb 1.30 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3byz h ALA 153 CO -0.72 0.43 0.00 0.00 0.00 0.00 0.00 179.25 178.96 3byz h ALA 154 N 0.75 1.00 -0.17 0.00 0.00 0.56 -3.39 119.26 118.01 3byz h ALA 154 Ca 0.06 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 3byz h ALA 154 Cb 0.78 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 3byz h ALA 154 CO 0.06 0.00 -0.18 1.25 0.00 0.00 0.00 179.25 180.38 3byz h LEU 155 N 0.00 0.46 -0.65 0.00 5.85 -0.93 0.27 115.31 120.31 3byz h LEU 155 Ca 0.00 -0.48 0.12 0.00 0.84 0.00 0.00 57.88 58.36 3byz h LEU 155 Cb 0.58 -0.13 -0.12 0.00 0.37 0.00 0.00 40.66 41.35 3byz h LEU 155 CO 0.00 0.85 -0.27 -0.65 -0.34 0.00 0.00 178.44 178.03 3byz h PRO 156 N 0.08 -0.08 -0.24 5.25 0.11 -1.76 0.79 132.00 136.14 3byz h PRO 156 Ca 0.03 0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.08 3byz h PRO 156 Cb 0.72 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.84 3byz h PRO 156 CO 0.04 -0.06 -0.12 0.52 -0.21 0.00 0.00 178.00 178.18 3byz h MET 157 N -0.09 0.40 -0.19 1.05 2.86 -1.77 -2.76 114.93 114.43 3byz h MET 157 Ca 0.28 -0.10 -0.16 0.00 -2.06 0.00 0.00 59.70 57.66 3byz h MET 157 Cb 0.54 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 3byz h MET 157 CO -0.71 0.52 -0.52 -0.07 1.06 0.00 0.00 176.91 177.19 3byz h LEU 158 N 0.37 0.61 -0.55 1.22 3.38 0.22 -2.64 115.31 117.92 3byz h LEU 158 Ca 0.07 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 3byz h LEU 158 Cb 0.44 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3byz h LEU 158 CO 0.02 1.02 0.22 0.11 0.09 0.00 0.00 178.44 179.90 3byz h LYS 159 N 0.43 0.83 -0.16 1.13 1.57 0.60 0.24 116.57 121.21 3byz h LYS 159 Ca 0.01 -0.15 0.05 0.00 -1.87 0.00 0.00 60.65 58.69 3byz h LYS 159 Cb 1.06 -0.13 -0.07 0.00 0.08 0.00 0.00 32.23 33.17 3byz h LYS 159 CO 0.10 0.72 -0.32 1.96 -0.57 0.00 0.00 179.45 181.34 3byz h GLN 160 N 0.76 -0.36 0.00 3.15 4.20 -1.51 -2.08 115.11 119.27 3byz h GLN 160 Ca 0.18 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.92 3byz h GLN 160 Cb 0.20 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.07 3byz h GLN 160 CO -0.01 -0.24 0.00 -1.13 -0.67 0.00 0.00 178.83 176.77 3byz n SER 161 N -5.41 0.00 -4.12 1.46 3.41 -1.00 -4.91 113.62 103.06 3byz n SER 161 Ca -0.03 -1.09 -0.28 0.00 -0.26 0.00 0.00 58.87 57.21 3byz n SER 161 Cb 0.33 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.22 3byz n SER 161 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3byz n ASN 162 N -0.94 0.27 -2.51 4.04 3.02 -0.26 -4.96 115.26 113.93 3byz n ASN 162 Ca 0.20 -1.13 0.00 0.00 -0.03 0.00 0.00 54.58 53.62 3byz n ASN 162 Cb 0.09 -2.40 0.00 0.00 -0.61 0.00 0.00 39.78 36.86 3byz n ASN 162 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3byz n GLY 163 N -2.26 1.04 2.99 7.41 0.00 -0.09 -4.77 105.19 109.52 3byz n GLY 163 Ca -0.32 -1.54 -0.13 0.00 0.00 0.00 0.00 46.02 44.03 3byz n GLY 163 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3byz s SER 164 N -1.00 -0.15 -0.23 1.61 0.01 0.12 -2.10 113.70 111.96 3byz s SER 164 Ca 0.00 0.32 -0.11 0.00 1.31 0.00 0.00 55.95 57.47 3byz s SER 164 Cb 0.00 0.27 -0.05 0.00 0.21 0.00 0.00 66.02 66.46 3byz s SER 164 CO 0.00 -0.10 0.20 -0.63 0.41 0.00 0.00 173.24 173.12 3byz s ILE 165 N 0.56 5.34 -0.20 1.44 1.01 0.43 -0.75 121.20 129.03 3byz s ILE 165 Ca -0.04 0.27 -0.02 0.00 0.00 0.00 0.00 60.65 60.86 3byz s ILE 165 Cb -0.06 -3.53 0.00 0.00 0.01 0.00 0.00 42.46 38.88 3byz s ILE 165 CO -0.03 0.34 -0.10 -0.69 0.00 0.00 0.00 174.94 174.47 3byz s VAL 166 N 0.99 2.89 -0.26 2.92 1.01 0.16 0.90 120.40 129.00 3byz s VAL 166 Ca 0.10 -0.66 0.03 0.00 0.00 0.00 0.00 61.98 61.45 3byz s VAL 166 Cb -0.13 -2.28 0.06 0.00 0.00 0.00 0.00 36.38 34.02 3byz s VAL 166 CO 0.04 0.47 -0.10 -0.69 0.00 0.00 0.00 175.10 174.81 3byz s VAL 167 N 1.40 2.18 -0.25 2.92 1.01 0.49 0.04 120.40 128.19 3byz s VAL 167 Ca 0.05 -1.65 -0.23 0.00 0.00 0.00 0.00 61.98 60.15 3byz s VAL 167 Cb -0.14 -2.30 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 3byz s VAL 167 CO -0.07 -0.05 0.75 -0.69 0.00 0.00 0.00 175.10 175.05 3byz s VAL 168 N 1.10 4.89 0.00 2.92 1.01 -0.83 -1.00 120.40 128.49 3byz s VAL 168 Ca -0.08 1.39 0.00 0.00 0.00 0.00 0.00 61.98 63.28 3byz s VAL 168 Cb -0.20 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.13 3byz s VAL 168 CO -0.05 -0.04 0.00 -0.24 0.00 0.00 0.00 175.10 174.77 3byz n SER 169 N 5.90 1.20 -3.99 3.32 2.88 0.29 -4.86 113.62 118.35 3byz n SER 169 Ca 0.03 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.48 3byz n SER 169 Cb 0.48 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.88 3byz n SER 169 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 3byz s SER 170 N 1.00 -0.05 0.17 -3.46 0.01 -1.23 -2.34 113.70 107.79 3byz s SER 170 Ca 0.00 -0.93 -0.17 0.00 1.31 0.00 0.00 55.95 56.16 3byz s SER 170 Cb 0.00 0.53 0.10 0.00 0.21 0.00 0.00 66.02 66.85 3byz s SER 170 CO 0.00 -1.04 1.68 -0.07 0.41 0.00 0.00 173.24 174.22 3byz h LEU 171 N 2.36 -0.28 -0.74 2.44 3.38 -1.63 -0.42 115.31 120.41 3byz h LEU 171 Ca -0.29 0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.79 3byz h LEU 171 Cb 1.25 0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.21 3byz h LEU 171 CO 0.41 -0.10 0.16 0.00 0.09 0.00 0.00 178.44 179.00 3byz n ALA 172 N -2.64 0.78 0.84 1.53 0.00 -1.25 0.51 120.51 120.28 3byz n ALA 172 Ca 0.02 0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.68 3byz n ALA 172 Cb 0.21 -0.92 0.08 0.00 0.00 0.00 0.00 19.45 18.82 3byz n ALA 172 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3byz n GLY 173 N -1.31 -1.18 0.00 0.00 0.00 -0.18 -4.38 105.19 98.14 3byz n GLY 173 Ca -0.01 -0.43 0.06 0.00 0.00 0.00 0.00 46.02 45.64 3byz n GLY 173 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3byz n LYS 174 N -1.67 0.77 -4.05 1.61 4.76 0.18 -4.18 118.16 115.58 3byz n LYS 174 Ca 0.04 -0.09 -0.10 0.00 -2.87 0.00 0.00 58.31 55.29 3byz n LYS 174 Cb 0.37 -1.24 -0.08 0.00 -1.84 0.00 0.00 35.03 32.25 3byz n LYS 174 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3byz s VAL 175 N -2.69 0.03 0.26 -0.18 -7.23 0.55 -5.11 120.40 106.04 3byz s VAL 175 Ca -0.03 -1.59 -0.12 0.00 -1.81 0.00 0.00 61.98 58.43 3byz s VAL 175 Cb 0.07 -2.13 -0.08 0.00 0.56 0.00 0.00 36.38 34.81 3byz s VAL 175 CO 0.47 -0.15 0.62 0.00 -0.31 0.00 0.00 175.10 175.73 3byz s ALA 176 N -4.04 3.47 -0.18 1.32 0.00 -1.26 -3.87 121.76 117.20 3byz s ALA 176 Ca 0.25 -0.14 -0.10 0.00 0.00 0.00 0.00 51.96 51.97 3byz s ALA 176 Cb 0.03 -2.57 0.06 0.00 0.00 0.00 0.00 23.12 20.64 3byz s ALA 176 CO 0.06 0.44 0.43 0.71 0.00 0.00 0.00 175.76 177.39 3byz s TYR 177 N -1.86 -0.64 0.71 0.00 2.02 -1.26 -5.01 117.35 111.31 3byz s TYR 177 Ca 0.49 1.36 -0.13 0.00 -0.37 0.00 0.00 57.07 58.43 3byz s TYR 177 Cb -0.11 0.29 0.03 0.00 -0.40 0.00 0.00 41.96 41.77 3byz s TYR 177 CO 0.20 -0.36 1.09 -1.25 -1.57 0.00 0.00 175.55 173.66 3byz s PRO 178 N 1.47 2.57 0.00 -1.71 0.04 -1.26 -3.85 135.00 132.26 3byz s PRO 178 Ca -0.09 1.24 0.00 0.00 0.04 0.00 0.00 61.00 62.19 3byz s PRO 178 Cb -0.08 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.53 3byz s PRO 178 CO -0.13 -1.41 0.00 -1.33 0.04 0.00 0.00 177.00 174.17 3byz n MET 179 N -2.98 0.00 -1.31 4.56 2.81 -1.25 -4.83 117.12 114.13 3byz n MET 179 Ca 0.09 0.00 0.03 0.00 -1.81 0.00 0.00 57.70 56.02 3byz n MET 179 Cb 0.53 -1.21 0.09 0.00 -0.71 0.00 0.00 33.22 31.91 3byz n MET 179 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 3byz n VAL 180 N -2.00 0.98 -0.03 2.03 0.24 -1.25 -1.49 118.33 116.81 3byz n VAL 180 Ca 0.00 -2.07 -0.09 0.00 -2.04 0.00 0.00 64.34 60.14 3byz n VAL 180 Cb 0.00 0.49 -0.02 0.00 -1.47 0.00 0.00 33.84 32.84 3byz n VAL 180 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3byz h ALA 181 N 1.17 -0.14 -0.10 2.33 0.00 -1.86 0.31 119.26 120.96 3byz h ALA 181 Ca -0.12 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.89 3byz h ALA 181 Cb 1.53 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 19.76 3byz h ALA 181 CO 0.10 -0.67 -0.07 0.00 0.00 0.00 0.00 179.25 178.61 3byz h ALA 182 N 0.77 0.01 0.40 0.00 0.00 -1.94 -1.26 119.26 117.25 3byz h ALA 182 Ca 0.13 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3byz h ALA 182 Cb 0.45 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3byz h ALA 182 CO -0.36 -0.53 -0.44 -0.92 0.00 0.00 0.00 179.25 177.00 3byz h TYR 183 N -0.08 -1.22 -0.56 0.00 3.20 -1.77 -1.76 116.97 114.78 3byz h TYR 183 Ca 0.07 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.97 3byz h TYR 183 Cb 0.18 0.48 -0.03 0.00 1.54 0.00 0.00 36.73 38.90 3byz h TYR 183 CO -0.19 -0.57 0.37 0.66 -1.64 0.00 0.00 178.16 176.79 3byz h SER 184 N -0.84 0.58 -0.38 -2.11 4.64 -0.42 0.29 113.55 115.30 3byz h SER 184 Ca -0.05 -0.01 0.08 0.00 -0.47 0.00 0.00 61.79 61.34 3byz h SER 184 Cb 0.74 -0.14 -0.09 0.00 -0.31 0.00 0.00 62.40 62.60 3byz h SER 184 CO -0.08 0.40 -0.29 0.00 -0.87 0.00 0.00 176.83 176.00 3byz h ALA 185 N 1.67 -0.11 -0.14 5.18 0.00 -0.87 1.06 119.26 126.05 3byz h ALA 185 Ca 0.22 0.11 -0.08 0.00 0.00 0.00 0.00 54.91 55.16 3byz h ALA 185 Cb 0.04 0.64 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3byz h ALA 185 CO -0.06 -0.68 -0.27 0.66 0.00 0.00 0.00 179.25 178.90 3byz h SER 186 N -0.23 0.25 -0.12 0.00 4.64 -0.28 0.47 113.55 118.29 3byz h SER 186 Ca 0.18 -0.08 -0.04 0.00 -0.47 0.00 0.00 61.79 61.38 3byz h SER 186 Cb 0.51 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.53 3byz h SER 186 CO -0.51 0.52 -0.08 0.11 -0.87 0.00 0.00 176.83 176.00 3byz h LYS 187 N 0.22 0.26 -0.93 4.77 1.79 0.32 -2.81 116.57 120.19 3byz h LYS 187 Ca 0.03 -0.12 0.12 0.00 -2.18 0.00 0.00 60.65 58.50 3byz h LYS 187 Cb 0.60 -0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 31.17 3byz h LYS 187 CO 0.04 0.62 0.59 0.74 -1.08 0.00 0.00 179.45 180.37 3byz h PHE 188 N -0.11 0.97 -0.68 -1.35 -1.00 0.13 -0.12 116.94 114.79 3byz h PHE 188 Ca 0.02 0.03 0.03 0.00 2.81 0.00 0.00 57.97 60.87 3byz h PHE 188 Cb 0.56 -0.31 -0.04 0.00 3.61 0.00 0.00 35.95 39.76 3byz h PHE 188 CO 0.07 0.40 0.42 0.00 -1.61 0.00 0.00 178.31 177.59 3byz h ALA 189 N 1.57 0.89 -0.09 2.45 0.00 -0.72 -0.03 119.26 123.33 3byz h ALA 189 Ca 0.45 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.39 3byz h ALA 189 Cb 0.54 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 3byz h ALA 189 CO -0.22 0.17 -0.22 -0.07 0.00 0.00 0.00 179.25 178.91 3byz h LEU 190 N 0.81 -0.68 -1.15 0.00 3.38 -0.77 0.18 115.31 117.07 3byz h LEU 190 Ca 0.28 0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.38 3byz h LEU 190 Cb 0.05 0.30 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 3byz h LEU 190 CO -0.12 -0.28 0.58 -0.78 0.09 0.00 0.00 178.44 177.93 3byz h ASP 191 N -0.31 0.98 -0.19 -0.43 3.58 -1.15 0.41 116.42 119.31 3byz h ASP 191 Ca 0.09 -0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.49 3byz h ASP 191 Cb 0.43 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.24 3byz h ASP 191 CO -0.27 0.69 0.02 1.23 -2.88 0.00 0.00 179.24 178.03 3byz h GLY 192 N 1.15 0.34 0.43 -0.78 0.00 0.89 -2.14 103.07 102.96 3byz h GLY 192 Ca 0.33 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.41 3byz h GLY 192 CO -0.09 0.22 -0.16 -2.75 0.00 0.00 0.00 176.54 173.76 3byz h PHE 193 N 0.09 -0.42 -0.13 5.60 3.04 -0.21 -3.09 116.94 121.82 3byz h PHE 193 Ca 0.05 -0.01 -0.06 0.00 3.98 0.00 0.00 57.97 61.93 3byz h PHE 193 Cb 0.34 0.14 -0.01 0.00 2.56 0.00 0.00 35.95 38.98 3byz h PHE 193 CO 0.03 -0.14 -0.20 0.74 -2.02 0.00 0.00 178.31 176.72 3byz h PHE 194 N -1.03 0.24 0.00 0.41 0.04 -0.31 -1.09 116.94 115.20 3byz h PHE 194 Ca -0.05 -0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.62 3byz h PHE 194 Cb 0.47 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.55 3byz h PHE 194 CO 0.03 0.42 -0.31 0.77 -0.60 0.00 0.00 178.31 178.62 3byz h SER 195 N 0.21 0.00 0.16 2.17 0.02 -1.49 0.13 113.55 114.74 3byz h SER 195 Ca 0.04 0.00 -0.30 0.00 -0.84 0.00 0.00 61.79 60.69 3byz h SER 195 Cb 0.48 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.02 3byz h SER 195 CO 0.03 0.31 -1.47 -1.28 -1.14 0.00 0.00 176.83 173.28 3byz h SER 196 N 0.00 0.52 0.14 3.07 0.87 -1.34 -3.15 113.55 113.66 3byz h SER 196 Ca -0.00 -0.90 -0.08 0.00 -1.23 0.00 0.00 61.79 59.57 3byz h SER 196 Cb 0.77 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 3byz h SER 196 CO 0.04 1.66 -0.28 0.16 -0.53 0.00 0.00 176.83 177.88 3byz h ILE 197 N -0.13 1.25 -0.83 2.23 3.07 -1.08 -1.89 117.51 120.13 3byz h ILE 197 Ca -0.30 -1.20 0.19 0.00 1.55 0.00 0.00 64.86 65.11 3byz h ILE 197 Cb 1.90 1.47 -0.12 0.00 -0.27 0.00 0.00 36.82 39.81 3byz h ILE 197 CO 0.13 0.36 0.30 -0.09 -1.05 0.00 0.00 178.15 177.81 3byz h ARG 198 N 0.22 0.34 0.00 0.16 2.43 -0.75 0.44 114.38 117.21 3byz h ARG 198 Ca 0.03 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.10 3byz h ARG 198 Cb 0.62 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 3byz h ARG 198 CO 0.04 0.23 -0.41 0.87 -1.51 0.00 0.00 179.97 179.19 3byz h LYS 199 N 0.35 0.00 -0.07 0.20 1.57 -1.31 -0.90 116.57 116.41 3byz h LYS 199 Ca 0.50 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 59.04 3byz h LYS 199 Cb 0.90 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.23 3byz h LYS 199 CO -0.52 0.41 -0.89 0.93 -0.57 0.00 0.00 179.45 178.80 3byz h GLU 200 N 0.00 0.67 -0.90 3.15 5.08 -0.63 -2.47 114.58 119.49 3byz h GLU 200 Ca -0.00 -0.63 0.07 0.00 -1.00 0.00 0.00 59.36 57.79 3byz h GLU 200 Cb 0.92 0.16 -0.06 0.00 0.50 0.00 0.00 28.75 30.27 3byz h GLU 200 CO 0.05 1.23 0.58 1.88 -1.00 0.00 0.00 179.01 181.76 3byz h TYR 201 N 0.42 1.03 0.00 4.33 0.05 0.07 0.38 116.97 123.25 3byz h TYR 201 Ca -0.08 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.72 3byz h TYR 201 Cb 1.53 -0.34 0.00 0.00 1.01 0.00 0.00 36.73 38.93 3byz h TYR 201 CO 0.08 0.54 0.00 0.45 -1.05 0.00 0.00 178.16 178.18 3byz n SER 202 N -4.49 0.00 -0.24 3.88 2.88 -0.37 -0.28 113.62 115.00 3byz n SER 202 Ca 0.14 0.77 0.07 0.00 -1.33 0.00 0.00 58.87 58.52 3byz n SER 202 Cb 0.21 -0.27 0.15 0.00 -0.75 0.00 0.00 64.21 63.55 3byz n SER 202 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 3byz n VAL 203 N -1.31 -0.28 -0.02 2.46 0.31 -0.94 -0.08 118.33 118.47 3byz n VAL 203 Ca 0.00 1.50 0.04 0.00 -0.01 0.00 0.00 64.34 65.87 3byz n VAL 203 Cb 0.00 -2.14 0.23 0.00 -0.91 0.00 0.00 33.84 31.02 3byz n VAL 203 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3byz n SER 204 N -4.98 3.59 -4.26 4.52 7.64 0.13 -4.88 113.62 115.38 3byz n SER 204 Ca 0.13 -2.50 -0.35 0.00 1.01 0.00 0.00 58.87 57.17 3byz n SER 204 Cb 0.43 -0.59 -0.05 0.00 -1.01 0.00 0.00 64.21 62.99 3byz n SER 204 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3byz n ARG 205 N 0.37 -2.25 -3.03 1.43 1.74 0.88 -4.88 116.66 110.93 3byz n ARG 205 Ca 0.15 0.28 -0.43 0.00 -0.77 0.00 0.00 57.85 57.08 3byz n ARG 205 Cb 0.76 -4.62 -0.06 0.00 -1.02 0.00 0.00 32.46 27.53 3byz n ARG 205 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3byz s VAL 206 N -3.62 4.70 -1.22 1.55 1.01 0.61 -4.95 120.40 118.48 3byz s VAL 206 Ca 0.47 0.07 -0.04 0.00 0.00 0.00 0.00 61.98 62.48 3byz s VAL 206 Cb -0.27 -4.33 0.19 0.00 0.00 0.00 0.00 36.38 31.98 3byz s VAL 206 CO 0.96 -0.79 2.14 -3.20 0.00 0.00 0.00 175.10 174.20 3byz n ASN 207 N 6.61 7.57 -3.98 3.32 4.05 -1.26 -4.61 115.26 126.96 3byz n ASN 207 Ca -0.01 -3.32 -0.27 0.00 0.45 0.00 0.00 54.58 51.43 3byz n ASN 207 Cb 0.47 -1.30 -0.17 0.00 1.23 0.00 0.00 39.78 40.01 3byz n ASN 207 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3byz s VAL 208 N -2.12 1.21 0.31 3.44 1.01 -1.26 -4.15 120.40 118.83 3byz s VAL 208 Ca 0.47 -0.45 -0.23 0.00 0.00 0.00 0.00 61.98 61.77 3byz s VAL 208 Cb 0.17 -1.15 -0.10 0.00 0.00 0.00 0.00 36.38 35.31 3byz s VAL 208 CO -0.09 0.39 0.87 -0.94 0.00 0.00 0.00 175.10 175.33 3byz s SER 209 N 1.20 7.17 -0.13 3.32 1.04 -0.89 -4.88 113.70 120.53 3byz s SER 209 Ca -0.04 1.67 0.02 0.00 0.48 0.00 0.00 55.95 58.09 3byz s SER 209 Cb -0.14 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.46 3byz s SER 209 CO -0.03 -0.09 -0.21 -0.63 0.98 0.00 0.00 173.24 173.26 3byz s ILE 210 N -1.69 2.23 -0.12 -1.02 1.01 -1.25 0.16 121.20 120.51 3byz s ILE 210 Ca 0.50 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 60.24 3byz s ILE 210 Cb -0.16 -1.89 -0.00 0.00 0.01 0.00 0.00 42.46 40.42 3byz s ILE 210 CO 0.21 0.55 -0.21 -0.89 0.00 0.00 0.00 174.94 174.60 3byz s THR 211 N 0.64 2.31 -0.21 2.92 2.01 0.26 -4.39 115.64 119.18 3byz s THR 211 Ca -0.11 -0.92 -0.08 0.00 0.31 0.00 0.00 61.69 60.90 3byz s THR 211 Cb -0.16 -1.92 -0.04 0.00 0.01 0.00 0.00 72.50 70.39 3byz s THR 211 CO 0.02 0.55 0.08 -0.22 -0.69 0.00 0.00 174.62 174.36 3byz s LEU 212 N 0.45 3.73 -0.22 4.42 2.96 -0.59 -0.38 118.68 129.05 3byz s LEU 212 Ca -0.15 -0.01 -0.06 0.00 -0.22 0.00 0.00 54.13 53.69 3byz s LEU 212 Cb -0.17 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 3byz s LEU 212 CO 0.06 0.09 0.03 0.00 -1.32 0.00 0.00 176.35 175.21 3byz s VAL 214 N 1.24 5.03 -0.16 0.00 1.01 0.10 0.11 120.40 127.73 3byz s VAL 214 Ca 0.04 -1.31 -0.17 0.00 0.00 0.00 0.00 61.98 60.55 3byz s VAL 214 Cb -0.15 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 3byz s VAL 214 CO 0.02 -0.69 0.42 -0.76 0.00 0.00 0.00 175.10 174.10 3byz s LEU 215 N 1.58 4.23 0.00 3.92 1.02 -0.99 -1.18 118.68 127.26 3byz s LEU 215 Ca 0.04 0.66 0.00 0.00 0.02 0.00 0.00 54.13 54.85 3byz s LEU 215 Cb -0.26 -2.58 0.00 0.00 0.02 0.00 0.00 46.19 43.36 3byz s LEU 215 CO 0.04 -0.02 0.00 0.61 0.02 0.00 0.00 176.35 177.01 3byz n GLY 216 N 3.51 -2.83 3.74 -3.19 0.00 0.20 -1.75 105.19 104.87 3byz n GLY 216 Ca -0.08 -1.33 -0.41 0.00 0.00 0.00 0.00 46.02 44.20 3byz n GLY 216 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3byz s LEU 217 N 0.00 4.49 0.14 0.99 2.96 -1.26 -4.88 118.68 121.12 3byz s LEU 217 Ca 0.00 2.10 0.10 0.00 -0.22 0.00 0.00 54.13 56.11 3byz s LEU 217 Cb 0.00 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.05 3byz s LEU 217 CO 0.00 -0.22 -0.24 -0.63 -1.32 0.00 0.00 176.35 173.95 3byz s ILE 218 N -0.29 2.08 -0.23 6.68 -1.09 -1.26 -0.82 121.20 126.28 3byz s ILE 218 Ca 0.49 -1.77 -0.01 0.00 -2.23 0.00 0.00 60.65 57.13 3byz s ILE 218 Cb -0.29 -1.88 0.13 0.00 -1.58 0.00 0.00 42.46 38.83 3byz s ILE 218 CO 0.35 -0.03 2.12 -0.90 -1.23 0.00 0.00 174.94 175.25 3byz n ASP 219 N 0.78 6.11 -4.74 3.58 5.68 -0.05 -4.59 116.55 123.31 3byz n ASP 219 Ca -0.17 -2.87 -0.31 0.00 -0.50 0.00 0.00 54.79 50.94 3byz n ASP 219 Cb 0.54 -1.10 0.11 0.00 -1.14 0.00 0.00 41.12 39.53 3byz n ASP 219 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 3byz s THR 220 N -1.53 2.97 0.14 2.12 -4.23 -1.26 -4.82 115.64 109.03 3byz s THR 220 Ca 0.25 0.33 -0.17 0.00 -1.18 0.00 0.00 61.69 60.92 3byz s THR 220 Cb 0.19 -2.70 -0.01 0.00 1.34 0.00 0.00 72.50 71.31 3byz s THR 220 CO -0.02 -0.40 1.75 -0.33 -0.54 0.00 0.00 174.62 175.09 3byz h GLU 221 N -1.21 0.49 -0.58 3.99 3.07 -1.98 0.21 114.58 118.55 3byz h GLU 221 Ca -0.44 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.38 3byz h GLU 221 Cb 1.24 -0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 29.03 3byz h GLU 221 CO 0.49 0.38 0.38 1.15 -1.40 0.00 0.00 179.01 180.01 3byz h THR 222 N 0.45 1.16 -0.07 1.13 2.02 -1.96 -0.70 112.91 114.94 3byz h THR 222 Ca 0.13 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 66.98 3byz h THR 222 Cb 0.03 0.31 -0.00 0.00 -1.74 0.00 0.00 68.15 66.75 3byz h THR 222 CO -0.02 0.15 -0.08 0.00 0.37 0.00 0.00 175.52 175.94 3byz h ALA 223 N 1.21 0.11 -0.02 6.16 0.00 -1.82 -2.25 119.26 122.64 3byz h ALA 223 Ca 0.21 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.86 3byz h ALA 223 Cb -0.08 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 3byz h ALA 223 CO -0.04 -0.07 -0.24 0.52 0.00 0.00 0.00 179.25 179.42 3byz h MET 224 N -0.26 -0.35 0.09 0.00 2.07 -0.41 -0.38 114.93 115.68 3byz h MET 224 Ca 0.01 0.02 -0.00 0.00 -2.07 0.00 0.00 59.70 57.66 3byz h MET 224 Cb 0.60 0.08 -0.01 0.00 -1.87 0.00 0.00 31.60 30.40 3byz h MET 224 CO 0.02 -0.23 -0.15 0.87 1.07 0.00 0.00 176.91 178.49 3byz h LYS 225 N -0.36 -0.24 -1.43 1.72 1.57 -1.21 -1.09 116.57 115.53 3byz h LYS 225 Ca 0.07 0.02 0.42 0.00 -1.87 0.00 0.00 60.65 59.28 3byz h LYS 225 Cb 0.45 0.05 -0.08 0.00 0.08 0.00 0.00 32.23 32.74 3byz h LYS 225 CO -0.22 -0.16 1.00 0.00 -0.57 0.00 0.00 179.45 179.50 3byz h ALA 226 N -1.38 3.17 -0.02 3.86 0.00 -1.31 -2.04 119.26 121.55 3byz h ALA 226 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3byz h ALA 226 Cb 0.23 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3byz h ALA 226 CO -0.05 -1.64 -0.19 0.28 0.00 0.00 0.00 179.25 177.64 3byz n VAL 227 N -4.26 0.00 -2.10 0.00 0.31 -0.16 -4.39 118.33 107.73 3byz n VAL 227 Ca 0.33 -0.40 -0.42 0.00 -0.01 0.00 0.00 64.34 63.84 3byz n VAL 227 Cb 1.47 1.30 -0.03 0.00 -0.91 0.00 0.00 33.84 35.68 3byz n VAL 227 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3byz s SER 228 N -1.82 6.74 -0.86 4.52 0.15 -0.43 -2.20 113.70 119.80 3byz s SER 228 Ca 0.18 2.22 -0.01 0.00 0.70 0.00 0.00 55.95 59.05 3byz s SER 228 Cb 0.15 -2.55 -0.01 0.00 -1.71 0.00 0.00 66.02 61.90 3byz s SER 228 CO 0.35 -0.83 0.72 0.61 1.20 0.00 0.00 173.24 175.29 3byz n GLY 229 N 3.88 -0.22 2.18 9.45 0.00 -1.26 -4.85 105.19 114.37 3byz n GLY 229 Ca 0.15 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3byz n GLY 229 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3byz n ILE 230 N -3.20 0.00 -3.47 -0.61 5.41 -1.14 -5.08 119.36 111.26 3byz n ILE 230 Ca -0.19 0.00 -0.43 0.00 1.00 0.00 0.00 62.75 63.14 3byz n ILE 230 Cb 0.62 -0.02 -0.08 0.00 -0.71 0.00 0.00 39.64 39.44 3byz n ILE 230 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3byz s VAL 231 N -1.78 4.84 -1.09 1.39 1.01 -0.93 -4.98 120.40 118.86 3byz s VAL 231 Ca 0.00 -1.20 -0.02 0.00 0.00 0.00 0.00 61.98 60.75 3byz s VAL 231 Cb 0.00 -3.92 0.28 0.00 0.00 0.00 0.00 36.38 32.74 3byz s VAL 231 CO 0.00 -0.56 1.90 1.41 0.00 0.00 0.00 175.10 177.86 3byz n HIS 232 N 5.09 2.69 -3.52 5.22 8.25 -1.26 -4.87 115.22 126.82 3byz n HIS 232 Ca -0.12 -2.61 0.00 0.00 -0.26 0.00 0.00 57.72 54.73 3byz n HIS 232 Cb 0.43 -1.33 0.00 0.00 1.12 0.00 0.00 29.99 30.21 3byz n HIS 232 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3byz n MET 233 N 0.45 2.71 -4.39 -0.41 0.00 -1.26 -5.14 117.12 109.08 3byz n MET 233 Ca 0.48 0.00 -0.33 0.00 0.00 0.00 0.00 57.70 57.85 3byz n MET 233 Cb 0.27 0.00 -0.16 0.00 0.00 0.00 0.00 33.22 33.33 3byz n MET 233 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 175.97 174.83 3byz s GLN 234 N -0.74 3.10 1.24 3.17 0.74 -1.26 -5.12 119.66 120.79 3byz s GLN 234 Ca 0.00 -0.80 -0.16 0.00 0.05 0.00 0.00 55.36 54.45 3byz s GLN 234 Cb 0.00 -2.58 0.31 0.00 1.10 0.00 0.00 33.01 31.83 3byz s GLN 234 CO 0.00 -0.08 1.01 0.00 -0.55 0.00 0.00 175.29 175.66 3byz s ALA 235 N 1.02 -0.43 0.31 1.58 0.00 -1.26 -4.76 121.76 118.22 3byz s ALA 235 Ca -0.02 -0.43 0.09 0.00 0.00 0.00 0.00 51.96 51.60 3byz s ALA 235 Cb -0.15 -3.11 -0.05 0.00 0.00 0.00 0.00 23.12 19.81 3byz s ALA 235 CO -0.05 -4.01 0.01 0.00 0.00 0.00 0.00 175.76 171.71 3byz s ALA 236 N -2.49 3.20 0.29 0.00 0.00 0.00 -4.85 121.76 117.91 3byz s ALA 236 Ca 0.68 -1.84 -0.29 0.00 0.00 0.00 0.00 51.96 50.51 3byz s ALA 236 Cb -0.20 -0.54 -0.09 0.00 0.00 0.00 0.00 23.12 22.29 3byz s ALA 236 CO 0.62 0.14 1.06 -1.25 0.00 0.00 0.00 175.76 176.32 3byz s PRO 237 N -3.71 4.63 0.22 0.00 0.04 -1.26 -0.87 135.00 134.05 3byz s PRO 237 Ca 0.34 1.70 -0.08 0.00 0.04 0.00 0.00 61.00 62.99 3byz s PRO 237 Cb -0.03 -3.13 0.25 0.00 0.04 0.00 0.00 34.50 31.64 3byz s PRO 237 CO 0.20 0.24 1.85 1.57 0.04 0.00 0.00 177.00 180.89 3byz h LYS 238 N 3.72 0.88 -0.39 4.56 2.10 -1.93 -1.85 116.57 123.66 3byz h LYS 238 Ca -0.47 -0.05 -0.02 0.00 -2.00 0.00 0.00 60.65 58.11 3byz h LYS 238 Cb 1.21 -0.20 -0.02 0.00 -0.90 0.00 0.00 32.23 32.32 3byz h LYS 238 CO 0.67 0.58 0.17 1.49 -2.00 0.00 0.00 179.45 180.35 3byz h GLU 239 N 0.91 0.57 0.05 0.07 4.81 -1.97 0.16 114.58 119.18 3byz h GLU 239 Ca 0.32 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 59.45 3byz h GLU 239 Cb 0.08 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.37 3byz h GLU 239 CO -0.14 0.53 -0.03 1.49 -0.73 0.00 0.00 179.01 180.14 3byz h GLU 240 N 0.49 -0.07 -0.81 1.92 4.81 -1.96 -2.81 114.58 116.14 3byz h GLU 240 Ca 0.13 0.00 0.19 0.00 -0.13 0.00 0.00 59.36 59.55 3byz h GLU 240 Cb 0.16 0.02 -0.15 0.00 0.63 0.00 0.00 28.75 29.41 3byz h GLU 240 CO -0.01 0.16 -0.03 0.00 -0.73 0.00 0.00 179.01 178.40 3byz h ALA 242 N 1.78 1.11 -0.02 0.00 0.00 -0.49 -1.87 119.26 119.77 3byz h ALA 242 Ca 0.44 -0.40 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 3byz h ALA 242 Cb 0.79 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3byz h ALA 242 CO -0.75 0.58 -0.78 1.25 0.00 0.00 0.00 179.25 179.55 3byz h LEU 243 N 0.24 0.20 -0.52 0.00 6.46 -1.10 -2.86 115.31 117.73 3byz h LEU 243 Ca 0.02 -0.15 -0.16 0.00 -0.12 0.00 0.00 57.88 57.48 3byz h LEU 243 Cb 0.79 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.65 3byz h LEU 243 CO 0.06 0.90 -0.59 -0.33 -0.62 0.00 0.00 178.44 177.86 3byz h GLU 244 N 0.10 0.48 -0.91 1.25 4.39 -0.60 -0.23 114.58 119.06 3byz h GLU 244 Ca -0.03 -0.32 -0.01 0.00 0.34 0.00 0.00 59.36 59.34 3byz h GLU 244 Cb 1.36 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 30.01 3byz h GLU 244 CO 0.11 0.93 0.51 0.82 -1.16 0.00 0.00 179.01 180.23 3byz h ILE 245 N 0.36 1.26 -0.18 3.13 2.04 -1.34 -1.98 117.51 120.81 3byz h ILE 245 Ca -0.00 -0.62 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 3byz h ILE 245 Cb 1.13 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 3byz h ILE 245 CO 0.11 0.29 -0.02 0.40 0.00 0.00 0.00 178.15 178.93 3byz h ILE 246 N 1.27 1.27 -0.54 -0.67 2.04 -1.21 -1.98 117.51 117.69 3byz h ILE 246 Ca 0.32 -0.92 0.03 0.00 1.00 0.00 0.00 64.86 65.29 3byz h ILE 246 Cb 0.01 1.51 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 3byz h ILE 246 CO -0.05 0.28 0.31 0.11 0.00 0.00 0.00 178.15 178.79 3byz h LYS 247 N 0.07 0.59 -0.82 2.37 1.57 -0.95 0.29 116.57 119.69 3byz h LYS 247 Ca 0.05 -0.04 0.12 0.00 -1.87 0.00 0.00 60.65 58.92 3byz h LYS 247 Cb 0.42 -0.13 -0.08 0.00 0.08 0.00 0.00 32.23 32.52 3byz h LYS 247 CO 0.01 0.39 0.44 0.78 -0.57 0.00 0.00 179.45 180.50 3byz h GLY 248 N 0.61 1.31 1.06 3.86 0.00 -1.03 0.42 103.07 109.30 3byz h GLY 248 Ca 0.22 -0.27 -0.23 0.00 0.00 0.00 0.00 47.33 47.06 3byz h GLY 248 CO -0.11 0.03 -0.88 -1.33 0.00 0.00 0.00 176.54 174.25 3byz h GLY 249 N 0.67 0.68 1.85 4.60 0.00 -0.59 -0.97 103.07 109.32 3byz h GLY 249 Ca 0.43 -1.18 -0.09 0.00 0.00 0.00 0.00 47.33 46.49 3byz h GLY 249 CO -0.32 1.04 -0.36 0.00 0.00 0.00 0.00 176.54 176.91 3byz h ALA 250 N 0.38 1.24 -0.00 3.60 0.00 -0.46 -0.61 119.26 123.41 3byz h ALA 250 Ca -0.11 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3byz h ALA 250 Cb 1.55 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.25 3byz h ALA 250 CO 0.17 0.53 -0.10 1.28 0.00 0.00 0.00 179.25 181.13 3byz n LEU 251 N -4.08 0.22 -3.06 0.00 4.77 0.09 -4.94 117.00 109.99 3byz n LEU 251 Ca -0.01 0.23 -0.23 0.00 -0.03 0.00 0.00 56.01 55.97 3byz n LEU 251 Cb 0.43 -0.32 0.03 0.00 -2.33 0.00 0.00 43.42 41.24 3byz n LEU 251 CO 0.40 0.04 0.00 0.54 -1.33 0.00 0.00 177.39 177.05 3byz n ARG 252 N -1.28 -4.94 -2.29 3.23 1.74 -0.24 -4.99 116.66 107.90 3byz n ARG 252 Ca 0.11 0.89 -0.41 0.00 -0.77 0.00 0.00 57.85 57.67 3byz n ARG 252 Cb 0.30 -5.75 -0.03 0.00 -1.02 0.00 0.00 32.46 25.95 3byz n ARG 252 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3byz s GLN 253 N -5.75 4.47 0.48 5.56 -0.21 -0.40 -4.90 119.66 118.91 3byz s GLN 253 Ca 0.32 1.99 0.26 0.00 0.02 0.00 0.00 55.36 57.95 3byz s GLN 253 Cb -0.14 -3.17 1.20 0.00 1.00 0.00 0.00 33.01 31.89 3byz s GLN 253 CO 0.40 -0.09 1.95 0.93 -2.12 0.00 0.00 175.29 176.36 3byz h GLU 254 N 4.50 0.00 -2.68 2.91 5.08 -1.88 -3.37 114.58 119.15 3byz h GLU 254 Ca -0.46 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 57.79 3byz h GLU 254 Cb 1.22 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.25 3byz h GLU 254 CO 0.71 0.17 -0.15 -1.21 -1.00 0.00 0.00 179.01 177.53 3byz s GLU 255 N -3.93 0.67 -0.02 2.33 2.02 -1.26 -1.54 118.70 116.97 3byz s GLU 255 Ca -0.01 0.27 0.02 0.00 0.02 0.00 0.00 54.97 55.26 3byz s GLU 255 Cb 0.12 0.31 0.01 0.00 0.10 0.00 0.00 34.13 34.67 3byz s GLU 255 CO 0.61 -0.15 -0.06 0.08 0.02 0.00 0.00 175.26 175.76 3byz s VAL 256 N -0.57 0.52 -0.12 2.63 1.01 0.11 -4.90 120.40 119.08 3byz s VAL 256 Ca -0.07 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.72 3byz s VAL 256 Cb -0.03 -0.49 0.01 0.00 0.00 0.00 0.00 36.38 35.87 3byz s VAL 256 CO 0.03 0.18 -0.17 -0.31 0.00 0.00 0.00 175.10 174.83 3byz s TYR 257 N 0.30 2.18 -0.14 5.22 2.02 -1.26 0.00 117.35 125.68 3byz s TYR 257 Ca -0.04 -1.07 -0.04 0.00 -0.37 0.00 0.00 57.07 55.55 3byz s TYR 257 Cb -0.08 -1.55 0.07 0.00 -0.40 0.00 0.00 41.96 40.00 3byz s TYR 257 CO -0.00 -0.53 0.18 -0.47 -1.57 0.00 0.00 175.55 173.15 3byz s TYR 258 N 0.98 -0.17 0.18 2.71 6.14 -0.33 -4.97 117.35 121.89 3byz s TYR 258 Ca -0.06 0.35 -0.21 0.00 0.64 0.00 0.00 57.07 57.79 3byz s TYR 258 Cb -0.15 -0.35 0.05 0.00 0.42 0.00 0.00 41.96 41.94 3byz s TYR 258 CO -0.03 -0.43 0.58 0.34 0.64 0.00 0.00 175.55 176.65 3byz s ASP 259 N 2.29 -0.45 -0.03 4.32 2.15 -1.26 -0.63 116.67 123.06 3byz s ASP 259 Ca 0.04 -0.17 -0.25 0.00 0.43 0.00 0.00 52.55 52.60 3byz s ASP 259 Cb -0.14 0.60 -0.19 0.00 -0.30 0.00 0.00 42.92 42.89 3byz s ASP 259 CO -0.09 -1.01 1.19 0.28 -0.17 0.00 0.00 175.17 175.37 3byz h SER 260 N 2.07 -0.07 -4.05 -0.34 0.02 -1.88 -3.46 113.55 105.84 3byz h SER 260 Ca -0.31 -0.45 -0.50 0.00 -0.84 0.00 0.00 61.79 59.69 3byz h SER 260 Cb 1.29 0.02 0.06 0.00 0.14 0.00 0.00 62.40 63.91 3byz h SER 260 CO 0.37 0.44 0.44 -0.55 -1.14 0.00 0.00 176.83 176.39 3byz s SER 261 N -5.61 5.99 0.09 3.07 0.15 -1.26 -4.93 113.70 111.21 3byz s SER 261 Ca -0.15 2.17 0.23 0.00 0.70 0.00 0.00 55.95 58.90 3byz s SER 261 Cb 0.01 -2.58 0.04 0.00 -1.71 0.00 0.00 66.02 61.78 3byz s SER 261 CO 0.63 -1.03 1.02 -0.11 1.20 0.00 0.00 173.24 174.95 3byz n LEU 262 N -0.95 0.63 0.01 3.45 7.94 -1.26 -3.07 117.00 123.74 3byz n LEU 262 Ca 0.10 0.11 -0.11 0.00 -1.11 0.00 0.00 56.01 54.99 3byz n LEU 262 Cb 0.50 -0.09 -0.06 0.00 0.53 0.00 0.00 43.42 44.30 3byz n LEU 262 CO 0.43 -0.04 0.88 -0.50 -1.11 0.00 0.00 177.39 177.06 3byz h TRP 263 N 0.00 0.09 -0.59 1.96 6.55 -1.98 0.99 115.95 122.97 3byz h TRP 263 Ca 0.00 0.00 0.11 0.00 0.95 0.00 0.00 58.89 59.95 3byz h TRP 263 Cb 0.83 -0.03 -0.08 0.00 -0.86 0.00 0.00 29.16 29.02 3byz h TRP 263 CO 0.00 0.08 0.14 1.15 -1.05 0.00 0.00 178.44 178.76 3byz h THR 264 N 0.07 0.67 -0.08 1.49 2.02 -1.96 -1.78 112.91 113.34 3byz h THR 264 Ca 0.02 -0.10 -0.16 0.00 0.77 0.00 0.00 66.41 66.94 3byz h THR 264 Cb 0.02 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 3byz h THR 264 CO -0.00 0.05 -0.66 0.71 0.37 0.00 0.00 175.52 175.98 3byz h THR 265 N 0.28 1.39 -0.08 3.16 1.35 -1.32 -1.07 112.91 116.62 3byz h THR 265 Ca 0.30 -2.07 0.02 0.00 -0.55 0.00 0.00 66.41 64.12 3byz h THR 265 Cb 0.44 2.05 -0.00 0.00 -1.73 0.00 0.00 68.15 68.91 3byz h THR 265 CO -0.38 0.62 0.11 0.25 -0.25 0.00 0.00 175.52 175.87 3byz h LEU 266 N 0.23 0.00 0.00 3.87 5.85 0.19 -3.35 115.31 122.10 3byz h LEU 266 Ca -0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.70 3byz h LEU 266 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.24 3byz h LEU 266 CO 0.11 0.00 -0.63 0.18 -0.34 0.00 0.00 178.44 177.76 3byz n LEU 267 N -3.61 0.00 0.30 2.25 4.77 -0.95 -4.69 117.00 115.07 3byz n LEU 267 Ca -0.01 0.00 0.19 0.00 -0.03 0.00 0.00 56.01 56.16 3byz n LEU 267 Cb 0.21 0.00 0.95 0.00 -2.33 0.00 0.00 43.42 42.25 3byz n LEU 267 CO 0.25 0.00 1.08 -0.29 -1.33 0.00 0.00 177.39 177.10 3byz h ILE 268 N 0.00 0.15 -3.89 -0.08 6.09 -1.33 -3.43 117.51 115.02 3byz h ILE 268 Ca 0.00 -0.26 -0.47 0.00 -1.37 0.00 0.00 64.86 62.76 3byz h ILE 268 Cb 0.48 1.22 -0.02 0.00 0.47 0.00 0.00 36.82 38.97 3byz h ILE 268 CO 0.00 0.03 0.24 -0.13 -3.07 0.00 0.00 178.15 175.21 3byz s ARG 269 N -4.05 4.18 -0.56 2.19 0.52 -1.26 -5.03 118.95 114.94 3byz s ARG 269 Ca -0.03 0.96 0.04 0.00 -0.52 0.00 0.00 55.73 56.18 3byz s ARG 269 Cb 0.12 -2.38 0.15 0.00 0.52 0.00 0.00 34.95 33.36 3byz s ARG 269 CO 0.49 0.10 0.36 1.21 0.02 0.00 0.00 175.30 177.48 3byz s ASN 270 N -2.12 3.97 0.22 0.23 3.84 -1.26 -4.96 114.94 114.86 3byz s ASN 270 Ca 0.57 -3.28 -0.09 0.00 0.21 0.00 0.00 52.86 50.27 3byz s ASN 270 Cb -0.11 -1.33 0.21 0.00 -0.55 0.00 0.00 41.25 39.47 3byz s ASN 270 CO 0.16 -0.17 1.87 1.55 -2.79 0.00 0.00 177.10 177.72 3byz h PRO 271 N 5.98 0.96 -0.25 0.43 0.13 -1.97 -2.74 132.00 134.53 3byz h PRO 271 Ca 0.08 -0.06 0.06 0.00 -0.87 0.00 0.00 66.00 65.21 3byz h PRO 271 Cb 0.84 -0.22 -0.06 0.00 0.13 0.00 0.00 31.00 31.69 3byz h PRO 271 CO 0.61 0.64 -0.15 0.66 -0.23 0.00 0.00 178.00 179.52 3byz h SER 272 N 0.99 -0.51 -0.44 1.44 4.64 -1.99 0.53 113.55 118.22 3byz h SER 272 Ca 0.31 0.11 0.09 0.00 -0.47 0.00 0.00 61.79 61.83 3byz h SER 272 Cb -0.02 0.27 -0.09 0.00 -0.31 0.00 0.00 62.40 62.24 3byz h SER 272 CO -0.10 -0.19 -0.22 -0.09 -0.87 0.00 0.00 176.83 175.35 3byz h ARG 273 N -0.13 -0.13 -0.58 4.77 2.43 -1.92 0.18 114.38 119.00 3byz h ARG 273 Ca 0.14 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.38 3byz h ARG 273 Cb 0.34 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.87 3byz h ARG 273 CO -0.34 -0.09 0.29 0.87 -1.51 0.00 0.00 179.97 179.19 3byz h LYS 274 N -0.14 0.53 -0.27 0.20 1.79 -1.30 0.12 116.57 117.50 3byz h LYS 274 Ca 0.21 -0.03 0.02 0.00 -2.18 0.00 0.00 60.65 58.67 3byz h LYS 274 Cb 0.46 -0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.97 3byz h LYS 274 CO -0.52 0.35 0.11 0.82 -1.08 0.00 0.00 179.45 179.12 3byz h ILE 275 N 0.55 0.95 -0.30 1.86 2.04 -0.16 -1.94 117.51 120.51 3byz h ILE 275 Ca 0.27 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 66.03 3byz h ILE 275 Cb 0.20 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 3byz h ILE 275 CO -0.19 0.04 0.11 0.25 0.00 0.00 0.00 178.15 178.36 3byz h LEU 276 N 0.24 0.37 0.00 1.44 5.85 0.93 0.57 115.31 124.71 3byz h LEU 276 Ca 0.11 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.80 3byz h LEU 276 Cb 0.07 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.00 3byz h LEU 276 CO -0.10 0.35 0.00 -0.62 -0.34 0.00 0.00 178.44 177.73 3byz n GLU 277 N -4.40 0.00 -0.22 1.25 1.02 0.21 -3.41 120.64 115.09 3byz n GLU 277 Ca 0.01 0.50 -0.06 0.00 -0.02 0.00 0.00 57.16 57.59 3byz n GLU 277 Cb 0.14 -1.22 -0.05 0.00 -0.02 0.00 0.00 31.44 30.28 3byz n GLU 277 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3byz n PHE 278 N -1.99 -0.23 0.00 -0.32 -0.00 -0.76 0.15 117.46 114.31 3byz n PHE 278 Ca 0.00 0.66 0.00 0.00 -0.00 0.00 0.00 57.45 58.11 3byz n PHE 278 Cb 0.00 -0.52 0.00 0.00 -0.00 0.00 0.00 39.48 38.96 3byz n PHE 278 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.76 176.65 3byz n LEU 279 N -4.48 0.00 0.00 -2.13 7.94 0.19 -5.11 117.00 113.41 3byz n LEU 279 Ca 0.01 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.91 3byz n LEU 279 Cb 0.14 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.09 3byz n LEU 279 CO -0.08 0.00 0.16 -1.22 -1.11 0.00 0.00 177.39 175.14