#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3byz s GLU 26 N 0.00 2.47 -0.24 3.44 2.56 -1.26 -5.10 118.70 120.57 3byz s GLU 26 Ca 0.00 -1.46 -0.23 0.00 0.00 0.00 0.00 54.97 53.28 3byz s GLU 26 Cb 0.00 -2.26 -0.01 0.00 2.00 0.00 0.00 34.13 33.86 3byz s GLU 26 CO 0.00 0.15 0.76 0.12 -0.56 0.00 0.00 175.26 175.73 3byz s PHE 27 N -2.37 3.32 -0.12 5.30 5.36 -1.26 -5.05 117.98 123.15 3byz s PHE 27 Ca 0.37 1.04 0.01 0.00 -0.96 0.00 0.00 56.93 57.39 3byz s PHE 27 Cb -0.04 -2.97 0.02 0.00 -0.34 0.00 0.00 43.02 39.69 3byz s PHE 27 CO 0.23 -0.35 -0.13 1.03 -1.46 0.00 0.00 175.22 174.54 3byz s ARG 28 N 2.62 2.10 0.64 10.12 0.52 -1.26 -4.98 118.95 128.70 3byz s ARG 28 Ca 0.32 -0.50 0.23 0.00 -0.52 0.00 0.00 55.73 55.27 3byz s ARG 28 Cb -0.15 -1.90 1.16 0.00 0.52 0.00 0.00 34.95 34.58 3byz s ARG 28 CO 0.08 -0.17 1.64 -1.35 0.02 0.00 0.00 175.30 175.53 3byz h PRO 29 N 7.80 0.00 -0.10 3.54 0.11 -1.99 1.23 132.00 142.59 3byz h PRO 29 Ca -0.34 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.80 3byz h PRO 29 Cb 1.15 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 3byz h PRO 29 CO 0.49 0.00 0.09 0.93 -0.21 0.00 0.00 178.00 179.30 3byz h GLU 30 N 0.00 0.00 0.00 1.05 3.07 -1.94 -3.12 114.58 113.64 3byz h GLU 30 Ca 0.12 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.97 3byz h GLU 30 Cb 1.38 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.29 3byz h GLU 30 CO -0.00 0.00 -0.06 0.52 -1.40 0.00 0.00 179.01 178.07 3byz h MET 31 N 0.00 0.00 -2.22 2.33 2.86 0.12 -3.33 114.93 114.70 3byz h MET 31 Ca 0.05 0.00 -0.68 0.00 -2.06 0.00 0.00 59.70 57.00 3byz h MET 31 Cb 0.23 0.00 -0.36 0.00 0.06 0.00 0.00 31.60 31.53 3byz h MET 31 CO -0.00 0.06 0.08 1.28 1.06 0.00 0.00 176.91 179.39 3byz n LEU 32 N -4.33 5.76 -0.01 1.22 4.32 -1.18 -4.77 117.00 118.00 3byz n LEU 32 Ca -0.03 -5.51 -0.04 0.00 -0.02 0.00 0.00 56.01 50.41 3byz n LEU 32 Cb 0.14 -0.81 -0.01 0.00 -1.62 0.00 0.00 43.42 41.11 3byz n LEU 32 CO 0.33 2.21 -0.53 1.67 -1.22 0.00 0.00 177.39 179.86 3byz n GLN 33 N -0.20 0.10 0.08 3.23 7.27 -1.25 -3.76 117.38 122.85 3byz n GLN 33 Ca 0.39 0.04 0.08 0.00 0.07 0.00 0.00 57.00 57.58 3byz n GLN 33 Cb 0.35 -0.67 0.37 0.00 2.41 0.00 0.00 30.24 32.69 3byz n GLN 33 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3byz n GLY 34 N 2.81 -0.91 3.68 1.69 0.00 -1.26 -4.10 105.19 107.09 3byz n GLY 34 Ca -0.08 0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -3.25 4.35 -0.52 1.61 -0.14 -1.26 -4.75 119.74 115.78 3byz s LYS 35 Ca 0.02 1.11 -0.25 0.00 -1.36 0.00 0.00 55.97 55.49 3byz s LYS 35 Cb 0.06 -3.55 0.04 0.00 -1.68 0.00 0.00 37.83 32.69 3byz s LYS 35 CO 0.22 -0.28 0.94 0.15 -0.76 0.00 0.00 175.35 175.61 3byz s LYS 36 N 1.97 3.41 -0.27 1.68 1.02 -1.26 -3.15 119.74 123.14 3byz s LYS 36 Ca 0.41 -0.10 -0.01 0.00 0.02 0.00 0.00 55.97 56.29 3byz s LYS 36 Cb -0.17 -4.00 0.04 0.00 -0.52 0.00 0.00 37.83 33.17 3byz s LYS 36 CO 0.15 -1.39 -0.05 0.54 -0.92 0.00 0.00 175.35 173.68 3byz s VAL 37 N 3.90 2.84 0.13 3.17 0.11 -0.68 -1.05 120.40 128.81 3byz s VAL 37 Ca 0.33 -1.21 -0.31 0.00 -2.93 0.00 0.00 61.98 57.86 3byz s VAL 37 Cb -0.11 -2.53 -0.08 0.00 -1.53 0.00 0.00 36.38 32.13 3byz s VAL 37 CO 0.22 0.07 1.33 -0.63 -3.33 0.00 0.00 175.10 172.76 3byz s ILE 38 N 1.28 3.42 -0.07 7.04 1.01 -0.88 -2.46 121.20 130.53 3byz s ILE 38 Ca -0.03 1.06 0.05 0.00 0.00 0.00 0.00 60.65 61.73 3byz s ILE 38 Cb -0.18 -3.68 -0.01 0.00 0.01 0.00 0.00 42.46 38.60 3byz s ILE 38 CO -0.03 0.10 -0.22 -0.69 0.00 0.00 0.00 174.94 174.10 3byz s VAL 39 N 0.81 2.27 0.22 2.92 1.01 -0.48 -1.45 120.40 125.69 3byz s VAL 39 Ca 0.61 -0.98 0.07 0.00 0.00 0.00 0.00 61.98 61.69 3byz s VAL 39 Cb -0.35 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 3byz s VAL 39 CO 0.32 0.56 0.08 0.42 0.00 0.00 0.00 175.10 176.49 3byz s THR 40 N -0.05 4.01 -1.35 3.92 -4.23 -0.74 -2.52 115.64 114.69 3byz s THR 40 Ca -0.06 -1.47 -0.07 0.00 -1.18 0.00 0.00 61.69 58.91 3byz s THR 40 Cb -0.15 -3.10 0.02 0.00 1.34 0.00 0.00 72.50 70.61 3byz s THR 40 CO 0.05 -0.24 1.08 0.61 -0.54 0.00 0.00 174.62 175.58 3byz n GLY 41 N -0.66 -0.48 0.59 3.99 0.00 -1.11 -3.94 105.19 103.59 3byz n GLY 41 Ca -0.08 0.20 0.12 0.00 0.00 0.00 0.00 46.02 46.26 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 -4.71 3.10 1.63 4.61 0.00 -1.03 -3.93 120.51 120.17 3byz n ALA 42 Ca -0.08 -0.61 0.08 0.00 0.00 0.00 0.00 53.44 52.84 3byz n ALA 42 Cb 0.59 -0.88 0.49 0.00 0.00 0.00 0.00 19.45 19.65 3byz n ALA 42 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3byz n SER 43 N 0.30 0.00 -2.84 0.00 3.41 -1.26 -2.32 113.62 110.90 3byz n SER 43 Ca 0.12 -1.11 -0.01 0.00 -0.26 0.00 0.00 58.87 57.61 3byz n SER 43 Cb 0.48 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.44 3byz n SER 43 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3byz n LYS 44 N -0.82 0.36 0.00 4.33 2.85 -1.26 -4.84 118.16 118.78 3byz n LYS 44 Ca 0.12 -0.92 0.00 0.00 -1.05 0.00 0.00 58.31 56.47 3byz n LYS 44 Cb 0.06 1.30 0.00 0.00 -0.65 0.00 0.00 35.03 35.74 3byz n LYS 44 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3byz n GLY 45 N -0.59 1.46 0.26 2.58 0.00 -1.26 -1.31 105.19 106.32 3byz n GLY 45 Ca 0.00 -0.43 0.04 0.00 0.00 0.00 0.00 46.02 45.62 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 0.57 -0.61 -0.61 1.08 -1.91 -2.94 117.51 113.10 3byz h ILE 46 Ca 0.00 -0.10 0.06 0.00 -0.39 0.00 0.00 64.86 64.44 3byz h ILE 46 Cb 0.00 0.27 -0.06 0.00 -3.07 0.00 0.00 36.82 33.96 3byz h ILE 46 CO 0.00 0.05 0.31 1.23 -0.69 0.00 0.00 178.15 179.05 3byz h GLY 47 N 0.28 0.87 0.71 5.37 0.00 -1.62 0.01 103.07 108.68 3byz h GLY 47 Ca 0.38 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 3byz h GLY 47 CO -0.47 0.11 -0.40 -0.09 0.00 0.00 0.00 176.54 175.69 3byz h ARG 48 N 0.57 -0.86 -0.73 4.80 2.43 -0.79 -2.33 114.38 117.47 3byz h ARG 48 Ca 0.28 0.06 0.09 0.00 -0.81 0.00 0.00 59.98 59.60 3byz h ARG 48 Cb 0.21 0.19 -0.07 0.00 -0.42 0.00 0.00 29.97 29.89 3byz h ARG 48 CO -0.20 -0.57 0.38 0.93 -1.51 0.00 0.00 179.97 179.00 3byz h GLU 49 N -0.89 0.63 -0.75 0.20 3.07 -1.24 0.68 114.58 116.28 3byz h GLU 49 Ca -0.06 -0.04 0.17 0.00 -0.50 0.00 0.00 59.36 58.94 3byz h GLU 49 Cb 0.76 -0.14 -0.12 0.00 -0.84 0.00 0.00 28.75 28.40 3byz h GLU 49 CO 0.00 0.42 0.12 1.98 -1.40 0.00 0.00 179.01 180.13 3byz h MET 50 N 0.65 0.19 0.00 2.33 4.05 -0.93 0.18 114.93 121.39 3byz h MET 50 Ca 0.35 -0.01 -0.14 0.00 -0.28 0.00 0.00 59.70 59.62 3byz h MET 50 Cb 0.35 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.09 3byz h MET 50 CO -0.26 0.13 -0.66 0.00 0.23 0.00 0.00 176.91 176.35 3byz h ALA 51 N 1.66 0.86 0.64 0.39 0.00 -0.39 -1.22 119.26 121.21 3byz h ALA 51 Ca 0.42 -0.60 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 3byz h ALA 51 Cb 0.75 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.44 3byz h ALA 51 CO -0.58 0.83 -0.31 1.88 0.00 0.00 0.00 179.25 181.07 3byz h TYR 52 N 0.00 -0.80 -0.82 0.00 0.05 0.19 -2.42 116.97 113.16 3byz h TYR 52 Ca -0.01 -0.02 0.20 0.00 0.05 0.00 0.00 58.73 58.95 3byz h TYR 52 Cb 1.20 0.27 -0.12 0.00 1.01 0.00 0.00 36.73 39.08 3byz h TYR 52 CO 0.00 -0.50 0.26 0.45 -1.05 0.00 0.00 178.16 177.32 3byz h HIS 53 N -0.96 0.41 -0.54 4.88 3.86 -0.64 -1.04 115.15 121.12 3byz h HIS 53 Ca -0.09 0.04 0.03 0.00 -1.16 0.00 0.00 60.37 59.20 3byz h HIS 53 Cb 0.66 -0.05 -0.04 0.00 1.06 0.00 0.00 27.41 29.04 3byz h HIS 53 CO 0.06 -0.10 0.31 -0.07 0.86 0.00 0.00 177.93 178.98 3byz h LEU 54 N 0.30 0.49 -0.50 2.43 3.38 -1.20 -2.11 115.31 118.09 3byz h LEU 54 Ca 0.49 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.44 3byz h LEU 54 Cb 0.91 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 3byz h LEU 54 CO -0.55 0.34 0.17 0.00 0.09 0.00 0.00 178.44 178.49 3byz h ALA 55 N 1.26 0.65 0.00 1.53 0.00 -0.70 -1.20 119.26 120.80 3byz h ALA 55 Ca 0.23 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3byz h ALA 55 Cb 0.07 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3byz h ALA 55 CO -0.12 0.29 0.10 1.63 0.00 0.00 0.00 179.25 181.15 3byz n LYS 56 N -4.52 0.02 0.00 0.00 5.02 -0.67 -0.75 118.16 117.26 3byz n LYS 56 Ca 0.02 0.45 0.05 0.00 -2.02 0.00 0.00 58.31 56.81 3byz n LYS 56 Cb 0.18 -1.68 0.01 0.00 -0.02 0.00 0.00 35.03 33.52 3byz n LYS 56 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3byz n MET 57 N -1.57 1.80 -1.57 1.97 2.81 -0.50 -4.95 117.12 115.12 3byz n MET 57 Ca -0.00 -0.69 0.00 0.00 -1.81 0.00 0.00 57.70 55.20 3byz n MET 57 Cb 0.10 -1.10 0.00 0.00 -0.71 0.00 0.00 33.22 31.52 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 0.83 0.51 3.68 3.03 0.00 0.07 -4.20 105.19 109.11 3byz n GLY 58 Ca 0.04 -0.39 -0.30 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.65 3.27 0.29 4.61 0.00 -1.11 -4.34 121.76 121.83 3byz s ALA 59 Ca 0.00 -1.13 -0.30 0.00 0.00 0.00 0.00 51.96 50.54 3byz s ALA 59 Cb 0.00 -1.17 -0.11 0.00 0.00 0.00 0.00 23.12 21.84 3byz s ALA 59 CO 0.00 0.70 1.48 -1.01 0.00 0.00 0.00 175.76 176.93 3byz s HIS 60 N -1.31 2.88 -0.05 0.00 3.76 -1.19 -3.07 115.29 116.31 3byz s HIS 60 Ca 0.26 1.00 -0.02 0.00 -0.15 0.00 0.00 55.06 56.14 3byz s HIS 60 Cb -0.12 -3.92 0.04 0.00 1.11 0.00 0.00 32.58 29.69 3byz s HIS 60 CO 0.18 -2.94 0.09 0.08 -0.85 0.00 0.00 174.74 171.30 3byz s VAL 61 N -0.25 -0.11 -0.09 -0.90 1.01 0.66 -1.69 120.40 119.03 3byz s VAL 61 Ca 0.59 0.28 -0.01 0.00 0.00 0.00 0.00 61.98 62.84 3byz s VAL 61 Cb -0.44 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.73 3byz s VAL 61 CO 0.48 0.12 -0.05 -0.69 0.00 0.00 0.00 175.10 174.96 3byz s VAL 62 N 1.57 3.86 0.06 2.92 1.01 -1.03 -2.20 120.40 126.59 3byz s VAL 62 Ca -0.04 -0.41 0.08 0.00 0.00 0.00 0.00 61.98 61.61 3byz s VAL 62 Cb -0.12 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 3byz s VAL 62 CO -0.04 0.58 -0.21 0.68 0.00 0.00 0.00 175.10 176.11 3byz s VAL 63 N -0.60 1.71 0.40 2.92 -7.23 -1.10 -1.38 120.40 115.12 3byz s VAL 63 Ca 0.09 -1.31 0.05 0.00 -1.81 0.00 0.00 61.98 59.01 3byz s VAL 63 Cb -0.12 -1.50 -0.07 0.00 0.56 0.00 0.00 36.38 35.26 3byz s VAL 63 CO 0.02 0.14 0.02 0.28 -0.31 0.00 0.00 175.10 175.25 3byz s THR 64 N -0.90 1.66 0.00 5.32 -1.32 -1.05 -0.37 115.64 118.98 3byz s THR 64 Ca 0.07 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.55 3byz s THR 64 Cb -0.09 -2.82 0.00 0.00 -1.51 0.00 0.00 72.50 68.08 3byz s THR 64 CO 0.03 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.44 3byz n ALA 65 N -0.94 0.00 0.14 11.08 0.00 -1.24 -2.46 120.51 127.08 3byz n ALA 65 Ca -0.06 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.31 3byz n ALA 65 Cb 0.67 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.08 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 -0.41 -6.88 0.00 3.08 -1.88 -3.03 114.38 105.26 3byz h ARG 66 Ca 0.00 0.03 -0.53 0.00 0.07 0.00 0.00 59.98 59.55 3byz h ARG 66 Cb 0.00 0.09 0.08 0.00 0.08 0.00 0.00 29.97 30.22 3byz h ARG 66 CO 0.00 -0.27 0.69 -1.54 -1.07 0.00 0.00 179.97 177.78 3byz s SER 67 N -2.92 6.64 -0.22 7.04 1.04 -1.26 -3.94 113.70 120.08 3byz s SER 67 Ca -0.07 2.79 -0.20 0.00 0.48 0.00 0.00 55.95 58.95 3byz s SER 67 Cb 0.01 -2.65 -0.18 0.00 0.10 0.00 0.00 66.02 63.30 3byz s SER 67 CO 0.22 -0.65 0.12 1.17 0.98 0.00 0.00 173.24 175.08 3byz n LYS 68 N 0.87 0.57 0.12 4.02 4.81 -1.26 -3.75 118.16 123.54 3byz n LYS 68 Ca 0.01 0.52 -0.00 0.00 -0.87 0.00 0.00 58.31 57.97 3byz n LYS 68 Cb 0.41 -1.70 0.04 0.00 0.02 0.00 0.00 35.03 33.79 3byz n LYS 68 CO 0.00 0.00 0.00 1.05 1.17 0.00 0.00 177.40 179.62 3byz h GLU 69 N -0.98 0.00 -0.93 1.64 -0.00 -1.99 -2.21 114.58 110.11 3byz h GLU 69 Ca -0.41 0.00 0.03 0.00 -0.00 0.00 0.00 59.36 58.97 3byz h GLU 69 Cb 1.37 0.00 -0.05 0.00 -0.00 0.00 0.00 28.75 30.07 3byz h GLU 69 CO -0.24 0.64 0.61 1.79 -0.00 0.00 0.00 179.01 181.81 3byz h THR 70 N 0.00 1.19 -0.21 -1.06 1.35 -1.95 0.15 112.91 112.38 3byz h THR 70 Ca -0.01 -0.42 -0.09 0.00 -0.55 0.00 0.00 66.41 65.35 3byz h THR 70 Cb 1.41 -0.13 -0.01 0.00 -1.73 0.00 0.00 68.15 67.69 3byz h THR 70 CO 0.08 0.22 -0.27 -0.07 -0.25 0.00 0.00 175.52 175.23 3byz h LEU 71 N 1.21 0.40 -0.47 3.87 3.38 -1.61 -2.74 115.31 119.36 3byz h LEU 71 Ca 0.36 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.15 3byz h LEU 71 Cb -0.05 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3byz h LEU 71 CO -0.10 0.67 0.10 -0.61 0.09 0.00 0.00 178.44 178.59 3byz h GLN 72 N 0.35 0.76 0.00 1.13 5.75 -0.75 -0.89 115.11 121.47 3byz h GLN 72 Ca 0.05 -0.19 0.00 0.00 -0.15 0.00 0.00 58.65 58.36 3byz h GLN 72 Cb 0.67 -0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.12 3byz h GLN 72 CO 0.05 0.76 0.00 1.17 -2.65 0.00 0.00 178.83 178.16 3byz n LYS 73 N -4.47 0.25 -0.09 1.69 4.81 -0.02 -1.36 118.16 118.96 3byz n LYS 73 Ca 0.01 0.12 -0.17 0.00 -0.87 0.00 0.00 58.31 57.39 3byz n LYS 73 Cb 0.23 -1.50 -0.07 0.00 0.02 0.00 0.00 35.03 33.71 3byz n LYS 73 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 3byz n VAL 74 N -1.21 1.02 -0.26 3.15 0.31 -0.69 -3.68 118.33 116.97 3byz n VAL 74 Ca 0.07 -0.31 0.07 0.00 -0.01 0.00 0.00 64.34 64.16 3byz n VAL 74 Cb 0.09 -1.52 0.20 0.00 -0.91 0.00 0.00 33.84 31.70 3byz n VAL 74 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3byz h VAL 75 N -0.42 0.57 0.11 2.52 2.07 -1.03 -0.13 116.25 119.94 3byz h VAL 75 Ca -0.45 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 66.95 3byz h VAL 75 Cb 1.49 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 3byz h VAL 75 CO -0.20 0.07 -0.05 -1.28 0.02 0.00 0.00 177.57 176.12 3byz h SER 76 N 0.36 -0.13 -0.39 0.57 0.87 -1.43 -2.39 113.55 111.01 3byz h SER 76 Ca 0.44 -0.39 0.11 0.00 -1.23 0.00 0.00 61.79 60.71 3byz h SER 76 Cb 0.73 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.71 3byz h SER 76 CO -0.47 0.37 0.36 -0.74 -0.53 0.00 0.00 176.83 175.81 3byz h HIS 77 N -0.67 0.00 0.00 2.24 6.17 -1.60 -2.61 115.15 118.67 3byz h HIS 77 Ca -0.02 0.00 -0.08 0.00 0.71 0.00 0.00 60.37 60.98 3byz h HIS 77 Cb 0.52 0.00 -0.01 0.00 2.52 0.00 0.00 27.41 30.43 3byz h HIS 77 CO 0.08 0.00 -0.39 0.00 0.71 0.00 0.00 177.93 178.33 3byz h LEU 79 N 0.00 0.26 -0.56 0.00 3.38 -1.40 -3.06 115.31 113.92 3byz h LEU 79 Ca -0.00 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 57.31 3byz h LEU 79 Cb 0.73 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3byz h LEU 79 CO 0.05 0.87 0.74 -0.33 0.09 0.00 0.00 178.44 179.87 3byz h GLU 80 N -0.34 0.00 0.00 1.13 5.08 -1.59 0.48 114.58 119.34 3byz h GLU 80 Ca -0.01 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 3byz h GLU 80 Cb 0.86 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.10 3byz h GLU 80 CO 0.04 0.00 -1.75 1.28 -1.00 0.00 0.00 179.01 177.59 3byz n LEU 81 N -2.45 0.00 0.00 1.33 4.77 -1.23 -5.02 117.00 114.39 3byz n LEU 81 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 3byz n LEU 81 Cb 0.76 0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.92 3byz n LEU 81 CO 0.04 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.79 3byz n GLY 82 N 1.76 0.66 0.00 -0.72 0.00 0.17 -4.23 105.19 102.83 3byz n GLY 82 Ca -0.07 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 0.00 0.00 4.61 0.00 -1.13 -3.40 120.51 120.59 3byz n ALA 83 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3byz n ALA 83 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3byz n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3byz n ALA 84 N -3.00 0.56 -3.57 0.00 0.00 -1.18 -4.35 120.51 108.97 3byz n ALA 84 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 3byz n ALA 84 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 3byz n ALA 84 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3byz s SER 85 N -1.38 -0.61 -0.05 0.00 0.15 -1.26 -4.87 113.70 105.68 3byz s SER 85 Ca 0.00 0.92 -0.00 0.00 0.70 0.00 0.00 55.95 57.57 3byz s SER 85 Cb 0.00 1.43 0.03 0.00 -1.71 0.00 0.00 66.02 65.76 3byz s SER 85 CO 0.00 -0.14 -0.01 0.00 1.20 0.00 0.00 173.24 174.29 3byz s ALA 86 N 1.79 0.57 0.16 5.45 0.00 -1.26 -0.25 121.76 128.23 3byz s ALA 86 Ca -0.07 -0.01 0.02 0.00 0.00 0.00 0.00 51.96 51.89 3byz s ALA 86 Cb -0.05 -0.53 -0.01 0.00 0.00 0.00 0.00 23.12 22.54 3byz s ALA 86 CO -0.16 -0.22 0.07 0.72 0.00 0.00 0.00 175.76 176.16 3byz n HIS 87 N 4.54 -0.01 -3.69 0.00 8.25 -0.93 -5.00 115.22 118.37 3byz n HIS 87 Ca -0.18 -1.05 -0.11 0.00 -0.26 0.00 0.00 57.72 56.13 3byz n HIS 87 Cb 0.50 0.02 -0.06 0.00 1.12 0.00 0.00 29.99 31.57 3byz n HIS 87 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 3byz s TYR 88 N -2.21 -0.15 -0.12 4.41 1.13 -1.26 -2.70 117.35 116.45 3byz s TYR 88 Ca 0.09 -0.09 -0.04 0.00 -1.41 0.00 0.00 57.07 55.63 3byz s TYR 88 Cb 0.00 0.18 0.05 0.00 -1.10 0.00 0.00 41.96 41.09 3byz s TYR 88 CO 0.07 -0.61 0.10 0.42 -2.51 0.00 0.00 175.55 173.01 3byz s ILE 89 N -3.29 -0.13 0.17 -3.49 1.01 0.50 -4.90 121.20 111.08 3byz s ILE 89 Ca -0.00 0.08 -0.25 0.00 0.00 0.00 0.00 60.65 60.48 3byz s ILE 89 Cb 0.01 -0.42 -0.08 0.00 0.01 0.00 0.00 42.46 41.99 3byz s ILE 89 CO -0.08 -0.09 0.76 0.00 0.00 0.00 0.00 174.94 175.53 3byz s ALA 90 N 2.18 3.45 0.00 9.38 0.00 -1.26 -3.68 121.76 131.83 3byz s ALA 90 Ca 0.03 0.33 0.00 0.00 0.00 0.00 0.00 51.96 52.33 3byz s ALA 90 Cb -0.14 -2.93 0.00 0.00 0.00 0.00 0.00 23.12 20.05 3byz s ALA 90 CO -0.07 0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.40 3byz n GLY 91 N 1.54 1.94 3.59 0.00 0.00 -1.14 -4.99 105.19 106.13 3byz n GLY 91 Ca -0.06 -0.73 -0.38 0.00 0.00 0.00 0.00 46.02 44.85 3byz n GLY 91 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3byz s THR 92 N -2.00 5.30 -1.82 2.61 -1.32 -1.26 -2.99 115.64 114.17 3byz s THR 92 Ca 0.00 0.19 0.00 0.00 -1.21 0.00 0.00 61.69 60.67 3byz s THR 92 Cb 0.00 -3.54 0.00 0.00 -1.51 0.00 0.00 72.50 67.45 3byz s THR 92 CO 0.00 0.25 0.19 0.23 -2.21 0.00 0.00 174.62 173.08 3byz n MET 93 N 5.04 0.00 0.22 7.08 0.00 -1.26 -0.75 117.12 127.45 3byz n MET 93 Ca -0.14 0.00 0.07 0.00 0.00 0.00 0.00 57.70 57.63 3byz n MET 93 Cb 0.52 -1.21 0.51 0.00 0.00 0.00 0.00 33.22 33.04 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 -4.52 0.03 5.08 -1.92 -3.41 114.58 109.85 3byz h GLU 94 Ca 0.00 0.00 -0.72 0.00 -1.00 0.00 0.00 59.36 57.64 3byz h GLU 94 Cb 0.00 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.04 3byz h GLU 94 CO 0.00 0.25 -0.28 0.34 -1.00 0.00 0.00 179.01 178.31 3byz s ASP 95 N -6.63 6.16 0.31 1.42 2.15 0.07 -4.92 116.67 115.23 3byz s ASP 95 Ca -0.03 -1.08 0.09 0.00 0.43 0.00 0.00 52.55 51.96 3byz s ASP 95 Cb 0.14 -2.20 0.87 0.00 -0.30 0.00 0.00 42.92 41.43 3byz s ASP 95 CO 0.67 -0.63 1.71 0.24 -0.17 0.00 0.00 175.17 176.99 3byz h MET 96 N 8.76 0.47 0.49 4.34 2.86 -1.86 -1.90 114.93 128.09 3byz h MET 96 Ca -0.28 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.32 3byz h MET 96 Cb 1.11 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.66 3byz h MET 96 CO 0.84 0.31 -0.32 1.15 1.06 0.00 0.00 176.91 179.96 3byz h THR 97 N 0.48 0.34 -0.71 2.22 2.02 -1.95 0.36 112.91 115.67 3byz h THR 97 Ca 0.64 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.95 3byz h THR 97 Cb 1.25 0.34 -0.14 0.00 -1.74 0.00 0.00 68.15 67.87 3byz h THR 97 CO -0.52 0.00 -0.22 0.15 0.37 0.00 0.00 175.52 175.31 3byz h PHE 98 N -0.78 -0.51 0.26 3.16 3.04 -1.73 0.26 116.94 120.64 3byz h PHE 98 Ca -0.05 0.07 0.01 0.00 3.98 0.00 0.00 57.97 61.97 3byz h PHE 98 Cb 0.64 0.34 -0.03 0.00 2.56 0.00 0.00 35.95 39.46 3byz h PHE 98 CO -0.11 -0.33 -0.36 0.00 -2.02 0.00 0.00 178.31 175.48 3byz h ALA 99 N 1.58 -0.72 -0.87 2.41 0.00 -0.91 2.03 119.26 122.78 3byz h ALA 99 Ca 0.33 -0.10 0.11 0.00 0.00 0.00 0.00 54.91 55.25 3byz h ALA 99 Cb 0.54 0.56 -0.13 0.00 0.00 0.00 0.00 17.79 18.76 3byz h ALA 99 CO -0.75 -0.95 -0.47 0.93 0.00 0.00 0.00 179.25 178.01 3byz h GLU 100 N -0.69 -0.07 -0.00 0.00 4.39 0.10 -3.05 114.58 115.26 3byz h GLU 100 Ca -0.00 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.51 3byz h GLU 100 Cb 0.66 0.02 0.02 0.00 -0.10 0.00 0.00 28.75 29.34 3byz h GLU 100 CO -0.13 -0.05 -0.73 1.96 -1.16 0.00 0.00 179.01 178.90 3byz h GLN 101 N -0.07 0.50 -0.81 2.33 4.20 -0.17 -3.08 115.11 118.00 3byz h GLN 101 Ca 0.23 -0.54 0.19 0.00 0.06 0.00 0.00 58.65 58.60 3byz h GLN 101 Cb 0.53 0.15 -0.12 0.00 0.30 0.00 0.00 27.48 28.34 3byz h GLN 101 CO -0.88 1.17 0.26 0.35 -0.67 0.00 0.00 178.83 179.07 3byz h PHE 102 N 0.04 0.43 -0.12 2.96 3.57 0.34 0.87 116.94 125.03 3byz h PHE 102 Ca -0.09 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.43 3byz h PHE 102 Cb 1.43 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 40.10 3byz h PHE 102 CO 0.13 -0.08 0.00 0.28 -2.23 0.00 0.00 178.31 176.42 3byz h VAL 103 N 0.32 1.24 -0.07 1.41 2.07 -1.54 -3.00 116.25 116.69 3byz h VAL 103 Ca 0.48 -0.79 0.04 0.00 0.82 0.00 0.00 66.70 67.26 3byz h VAL 103 Cb 0.87 1.54 -0.06 0.00 -1.52 0.00 0.00 31.29 32.12 3byz h VAL 103 CO -0.53 0.23 -0.30 0.00 0.02 0.00 0.00 177.57 176.99 3byz h ALA 104 N 0.76 -0.38 -0.44 1.67 0.00 -0.84 -2.16 119.26 117.87 3byz h ALA 104 Ca 0.03 0.01 -0.52 0.00 0.00 0.00 0.00 54.91 54.43 3byz h ALA 104 Cb 0.35 0.55 -0.13 0.00 0.00 0.00 0.00 17.79 18.55 3byz h ALA 104 CO 0.01 -0.79 0.95 0.00 0.00 0.00 0.00 179.25 179.42 3byz n GLN 105 N -5.40 2.94 0.00 0.00 10.64 0.28 -2.40 117.38 123.44 3byz n GLN 105 Ca -0.04 -2.39 0.00 0.00 -1.83 0.00 0.00 57.00 52.75 3byz n GLN 105 Cb 0.32 -2.28 0.00 0.00 -0.86 0.00 0.00 30.24 27.42 3byz n GLN 105 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3byz n ALA 106 N 1.50 0.00 0.06 2.61 0.00 -1.06 -4.69 120.51 118.94 3byz n ALA 106 Ca 0.53 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.76 3byz n ALA 106 Cb 0.52 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.82 3byz n ALA 106 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3byz h GLY 107 N 0.00 0.40 0.61 0.00 0.00 -1.27 -3.07 103.07 99.75 3byz h GLY 107 Ca 0.00 -1.02 0.15 0.00 0.00 0.00 0.00 47.33 46.46 3byz h GLY 107 CO 0.00 0.89 0.55 1.70 0.00 0.00 0.00 176.54 179.68 3byz h LYS 108 N 0.10 0.00 0.00 4.80 3.64 -1.73 1.10 116.57 124.48 3byz h LYS 108 Ca -0.33 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 58.94 3byz h LYS 108 Cb 2.08 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.88 3byz h LYS 108 CO 0.16 0.00 -1.29 1.28 -2.27 0.00 0.00 179.45 177.33 3byz n LEU 109 N -3.66 0.82 -0.00 5.20 4.32 -1.19 -4.32 117.00 118.17 3byz n LEU 109 Ca 0.10 0.35 0.04 0.00 -0.02 0.00 0.00 56.01 56.48 3byz n LEU 109 Cb 0.75 0.03 -0.06 0.00 -1.62 0.00 0.00 43.42 42.52 3byz n LEU 109 CO 0.27 0.02 -0.20 0.23 -1.22 0.00 0.00 177.39 176.50 3byz n MET 110 N -2.79 2.94 0.00 3.23 2.81 -0.82 -5.04 117.12 117.45 3byz n MET 110 Ca -0.06 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.80 3byz n MET 110 Cb 0.73 -1.01 0.00 0.00 -0.71 0.00 0.00 33.22 32.23 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 1.44 2.95 1.53 3.03 0.00 0.37 -4.97 105.19 109.54 3byz n GLY 111 Ca 0.01 -0.78 -0.11 0.00 0.00 0.00 0.00 46.02 45.14 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 0.00 3.63 3.57 -0.02 0.00 -1.21 -4.72 105.19 106.44 3byz n GLY 112 Ca 0.00 -1.91 -0.34 0.00 0.00 0.00 0.00 46.02 43.77 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 3.18 -0.03 0.99 2.96 -1.26 -4.62 118.68 119.91 3byz s LEU 113 Ca 0.13 -0.04 -0.00 0.00 -0.22 0.00 0.00 54.13 54.00 3byz s LEU 113 Cb 0.01 -1.70 -0.02 0.00 0.50 0.00 0.00 46.19 44.98 3byz s LEU 113 CO 0.09 0.33 -0.03 -0.67 -1.32 0.00 0.00 176.35 174.76 3byz n ASP 114 N 2.42 2.46 -4.06 3.68 -0.08 -0.22 -4.26 116.55 116.49 3byz n ASP 114 Ca -0.18 0.00 -0.21 0.00 -1.51 0.00 0.00 54.79 52.90 3byz n ASP 114 Cb 0.53 -0.06 -0.15 0.00 2.34 0.00 0.00 41.12 43.78 3byz n ASP 114 CO 0.00 0.00 0.00 -0.32 0.12 0.00 0.00 177.20 177.00 3byz s MET 115 N -2.05 0.98 -0.26 -0.67 0.00 -0.62 -2.52 119.30 114.16 3byz s MET 115 Ca -0.04 -0.41 -0.03 0.00 0.00 0.00 0.00 55.69 55.21 3byz s MET 115 Cb 0.01 -0.94 0.02 0.00 0.00 0.00 0.00 34.83 33.92 3byz s MET 115 CO 0.06 0.23 -0.02 -1.17 0.00 0.00 0.00 175.02 174.12 3byz s LEU 116 N -0.19 3.34 -0.33 4.11 2.96 -1.06 -2.08 118.68 125.43 3byz s LEU 116 Ca 0.03 -0.78 -0.11 0.00 -0.22 0.00 0.00 54.13 53.06 3byz s LEU 116 Cb -0.05 -1.73 -0.00 0.00 0.50 0.00 0.00 46.19 44.90 3byz s LEU 116 CO -0.00 -0.13 0.18 -0.63 -1.32 0.00 0.00 176.35 174.45 3byz s ILE 117 N 1.39 4.75 -0.37 6.68 1.01 -0.53 -1.17 121.20 132.97 3byz s ILE 117 Ca 0.01 -0.47 -0.09 0.00 0.00 0.00 0.00 60.65 60.10 3byz s ILE 117 Cb -0.17 -3.48 0.04 0.00 0.01 0.00 0.00 42.46 38.87 3byz s ILE 117 CO -0.02 -0.02 0.18 -0.76 0.00 0.00 0.00 174.94 174.32 3byz s LEU 118 N 1.63 4.69 0.00 2.97 1.43 -0.74 -1.79 118.68 126.86 3byz s LEU 118 Ca 0.04 -1.17 0.00 0.00 -1.03 0.00 0.00 54.13 51.97 3byz s LEU 118 Cb -0.18 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.08 3byz s LEU 118 CO 0.07 -0.40 0.32 -0.46 0.23 0.00 0.00 176.35 176.11 3byz n ASN 119 N 4.91 0.00 -4.78 2.29 0.23 -1.26 -2.08 115.26 114.58 3byz n ASN 119 Ca -0.12 -1.02 -0.35 0.00 -0.53 0.00 0.00 54.58 52.57 3byz n ASN 119 Cb 0.45 -0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 38.14 3byz n ASN 119 CO 0.00 0.00 0.00 -1.38 -0.93 0.00 0.00 177.26 174.95 3byz s HIS 120 N 0.00 2.78 0.03 -2.53 -3.43 -1.25 -4.86 115.29 106.03 3byz s HIS 120 Ca 0.00 1.55 -0.02 0.00 -0.80 0.00 0.00 55.06 55.79 3byz s HIS 120 Cb 0.00 -3.27 -0.02 0.00 -1.43 0.00 0.00 32.58 27.86 3byz s HIS 120 CO 0.00 -1.41 0.01 0.96 -2.00 0.00 0.00 174.74 172.30 3byz s ILE 121 N -1.75 0.13 0.35 -5.38 -4.36 -1.26 -4.77 121.20 104.16 3byz s ILE 121 Ca 0.70 -1.05 -0.25 0.00 -0.26 0.00 0.00 60.65 59.78 3byz s ILE 121 Cb -0.24 -0.57 -0.10 0.00 1.25 0.00 0.00 42.46 42.80 3byz s ILE 121 CO 0.27 -0.58 0.99 0.28 0.24 0.00 0.00 174.94 176.15 3byz s THR 122 N -2.01 3.99 -0.01 8.37 -1.32 -1.26 -4.88 115.64 118.52 3byz s THR 122 Ca -0.11 1.61 -0.35 0.00 -1.21 0.00 0.00 61.69 61.64 3byz s THR 122 Cb -0.06 -3.88 -0.13 0.00 -1.51 0.00 0.00 72.50 66.93 3byz s THR 122 CO -0.03 0.10 1.73 0.59 -2.21 0.00 0.00 174.62 174.80 3byz n ASN 123 N 0.35 3.12 -4.15 8.08 3.02 -1.26 -4.95 115.26 119.46 3byz n ASN 123 Ca 0.03 1.03 -0.31 0.00 -0.03 0.00 0.00 54.58 55.30 3byz n ASN 123 Cb 0.50 -1.36 -0.17 0.00 -0.61 0.00 0.00 39.78 38.14 3byz n ASN 123 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3byz s THR 124 N 2.74 1.87 0.00 3.41 -4.23 -1.26 -5.04 115.64 113.12 3byz s THR 124 Ca 0.88 -0.88 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 3byz s THR 124 Cb -0.74 -1.65 0.00 0.00 1.34 0.00 0.00 72.50 71.45 3byz s THR 124 CO 0.48 0.51 0.00 -1.54 -0.54 0.00 0.00 174.62 173.53 3byz n SER 125 N 3.90 0.00 -3.64 3.99 3.41 -1.26 -5.02 113.62 115.00 3byz n SER 125 Ca -0.20 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.12 3byz n SER 125 Cb 0.52 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.32 3byz n SER 125 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3byz s LEU 126 N 0.00 1.18 0.09 1.04 2.96 -1.26 -4.89 118.68 117.79 3byz s LEU 126 Ca 0.00 -1.29 -0.05 0.00 -0.22 0.00 0.00 54.13 52.56 3byz s LEU 126 Cb 0.00 -0.55 -0.02 0.00 0.50 0.00 0.00 46.19 46.13 3byz s LEU 126 CO 0.00 -0.41 0.11 0.20 -1.32 0.00 0.00 176.35 174.94 3byz s ASN 127 N 1.91 0.25 0.57 3.68 0.01 -1.12 -5.04 114.94 115.21 3byz s ASN 127 Ca 0.07 -0.84 -0.20 0.00 -0.71 0.00 0.00 52.86 51.19 3byz s ASN 127 Cb -0.17 0.30 -0.04 0.00 0.41 0.00 0.00 41.25 41.75 3byz s ASN 127 CO -0.27 -0.70 1.22 -0.76 -1.51 0.00 0.00 177.10 175.07 3byz s LEU 128 N -2.91 3.72 -0.12 0.60 1.43 -1.26 -4.37 118.68 115.78 3byz s LEU 128 Ca 0.08 2.41 -0.27 0.00 -1.03 0.00 0.00 54.13 55.33 3byz s LEU 128 Cb 0.06 -4.53 -0.02 0.00 0.03 0.00 0.00 46.19 41.73 3byz s LEU 128 CO -0.09 -1.51 0.89 0.12 0.23 0.00 0.00 176.35 176.00 3byz s PHE 129 N -1.56 3.50 0.00 0.29 5.36 -1.26 -4.97 117.98 119.34 3byz s PHE 129 Ca 0.75 1.42 0.00 0.00 -0.96 0.00 0.00 56.93 58.14 3byz s PHE 129 Cb -0.31 -3.06 0.00 0.00 -0.34 0.00 0.00 43.02 39.31 3byz s PHE 129 CO 0.34 -0.17 0.00 0.72 -1.46 0.00 0.00 175.22 174.66 3byz n HIS 130 N 4.82 0.00 -2.11 10.12 8.25 -1.26 -4.99 115.22 130.05 3byz n HIS 130 Ca 0.05 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.54 3byz n HIS 130 Cb 0.49 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.63 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 -1.02 0.54 -3.29 0.41 5.68 -1.26 -4.96 116.55 112.65 3byz n ASP 131 Ca 0.00 -2.13 -0.34 0.00 -0.50 0.00 0.00 54.79 51.82 3byz n ASP 131 Cb 0.00 -0.26 -0.03 0.00 -1.14 0.00 0.00 41.12 39.70 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 0.06 7.39 -0.23 -1.12 -0.08 -1.26 -4.65 116.55 116.66 3byz n ASP 132 Ca 0.04 -2.51 0.16 0.00 -1.51 0.00 0.00 54.79 50.97 3byz n ASP 132 Cb 0.85 -1.42 0.46 0.00 2.34 0.00 0.00 41.12 43.36 3byz n ASP 132 CO 0.00 0.00 0.00 0.16 0.12 0.00 0.00 177.20 177.48 3byz h ILE 133 N 3.18 0.76 -0.47 5.18 3.07 -1.99 -0.71 117.51 126.53 3byz h ILE 133 Ca 0.75 -0.17 0.09 0.00 1.55 0.00 0.00 64.86 67.08 3byz h ILE 133 Cb 0.26 0.21 -0.10 0.00 -0.27 0.00 0.00 36.82 36.92 3byz h ILE 133 CO 1.69 0.09 -0.26 0.45 -1.05 0.00 0.00 178.15 179.08 3byz h HIS 134 N 0.51 -0.68 -0.43 0.16 3.86 -2.00 0.34 115.15 116.91 3byz h HIS 134 Ca 0.44 0.06 -0.04 0.00 -1.16 0.00 0.00 60.37 59.67 3byz h HIS 134 Cb 0.93 0.37 -0.02 0.00 1.06 0.00 0.00 27.41 29.75 3byz h HIS 134 CO -0.00 -0.33 0.12 1.25 0.86 0.00 0.00 177.93 179.83 3byz h HIS 135 N -0.15 0.69 0.18 2.45 -0.00 -1.54 -0.13 115.15 116.64 3byz h HIS 135 Ca 0.22 -0.07 0.01 0.00 -0.00 0.00 0.00 60.37 60.52 3byz h HIS 135 Cb 0.50 -0.20 -0.04 0.00 -0.00 0.00 0.00 27.41 27.66 3byz h HIS 135 CO -0.52 0.64 -0.51 0.28 -0.00 0.00 0.00 177.93 177.82 3byz h VAL 136 N 0.55 0.03 -0.23 5.26 2.07 -0.46 0.90 116.25 124.37 3byz h VAL 136 Ca 0.14 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.71 3byz h VAL 136 Cb 0.28 0.03 -0.06 0.00 -1.52 0.00 0.00 31.29 30.01 3byz h VAL 136 CO -0.00 0.00 -0.18 -0.09 0.02 0.00 0.00 177.57 177.32 3byz h ARG 137 N -0.78 -0.17 -0.44 1.57 2.43 -0.19 0.11 114.38 116.91 3byz h ARG 137 Ca -0.01 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.23 3byz h ARG 137 Cb 0.77 0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 30.31 3byz h ARG 137 CO -0.25 -0.11 0.15 -0.22 -1.51 0.00 0.00 179.97 178.03 3byz h LYS 138 N -0.17 0.31 -0.29 0.20 3.64 -0.89 0.53 116.57 119.89 3byz h LYS 138 Ca 0.13 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.56 3byz h LYS 138 Cb 0.38 -0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 32.06 3byz h LYS 138 CO -0.34 0.21 -0.16 0.77 -2.27 0.00 0.00 179.45 177.65 3byz h SER 139 N 0.32 -0.55 -0.69 4.20 0.02 -0.10 0.33 113.55 117.09 3byz h SER 139 Ca 0.21 0.12 -0.07 0.00 -0.84 0.00 0.00 61.79 61.21 3byz h SER 139 Cb 0.20 0.29 -0.03 0.00 0.14 0.00 0.00 62.40 63.00 3byz h SER 139 CO -0.21 -0.20 0.16 0.24 -1.14 0.00 0.00 176.83 175.68 3byz h MET 140 N -0.13 1.11 0.43 3.45 2.86 0.87 0.26 114.93 123.78 3byz h MET 140 Ca 0.15 -0.27 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 3byz h MET 140 Cb 0.36 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.88 3byz h MET 140 CO -0.37 0.98 -0.21 1.49 1.06 0.00 0.00 176.91 179.86 3byz h GLU 141 N 1.04 -0.56 -0.05 1.72 4.57 0.46 0.31 114.58 122.07 3byz h GLU 141 Ca 0.22 0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.43 3byz h GLU 141 Cb 0.38 0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 29.09 3byz h GLU 141 CO 0.00 -0.37 0.02 0.28 -1.18 0.00 0.00 179.01 177.76 3byz h VAL 142 N -0.74 1.13 0.00 0.32 2.07 -0.46 -0.88 116.25 117.69 3byz h VAL 142 Ca -0.06 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.08 3byz h VAL 142 Cb 0.45 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 3byz h VAL 142 CO 0.10 0.11 -0.02 0.78 0.02 0.00 0.00 177.57 178.56 3byz h ASN 143 N -0.07 0.00 0.00 0.57 4.21 -0.58 -3.36 115.58 116.35 3byz h ASN 143 Ca 0.02 -0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.53 3byz h ASN 143 Cb 0.15 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.35 3byz h ASN 143 CO -0.00 0.00 -0.20 0.33 -1.29 0.00 0.00 177.43 176.27 3byz n PHE 144 N -2.95 -0.51 -0.30 1.19 7.35 -0.72 -4.76 117.46 116.76 3byz n PHE 144 Ca 0.04 0.09 0.04 0.00 -0.76 0.00 0.00 57.45 56.86 3byz n PHE 144 Cb 0.51 0.15 0.18 0.00 0.35 0.00 0.00 39.48 40.67 3byz n PHE 144 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 3byz h LEU 145 N 0.00 0.67 -1.03 -2.13 3.38 -0.68 -0.42 115.31 115.09 3byz h LEU 145 Ca 0.00 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 3byz h LEU 145 Cb 0.20 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 3byz h LEU 145 CO 0.00 0.37 0.32 0.77 0.09 0.00 0.00 178.44 179.99 3byz h SER 146 N 0.78 0.92 -0.57 -0.43 4.64 -1.31 0.12 113.55 117.70 3byz h SER 146 Ca 0.41 -0.11 -0.04 0.00 -0.47 0.00 0.00 61.79 61.58 3byz h SER 146 Cb 0.40 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.23 3byz h SER 146 CO -0.26 0.79 0.21 1.88 -0.87 0.00 0.00 176.83 178.58 3byz h TYR 147 N 1.00 0.92 -0.09 4.77 0.99 -1.34 0.34 116.97 123.56 3byz h TYR 147 Ca 0.24 -0.07 -0.02 0.00 2.00 0.00 0.00 58.73 60.89 3byz h TYR 147 Cb 0.13 -0.28 -0.00 0.00 1.00 0.00 0.00 36.73 37.58 3byz h TYR 147 CO 0.01 0.73 -0.02 0.28 -0.00 0.00 0.00 178.16 179.16 3byz h VAL 148 N 0.88 1.29 -0.44 -2.88 2.07 -0.61 -0.58 116.25 115.99 3byz h VAL 148 Ca 0.20 -0.94 0.04 0.00 0.82 0.00 0.00 66.70 66.82 3byz h VAL 148 Cb 0.22 1.75 -0.04 0.00 -1.52 0.00 0.00 31.29 31.70 3byz h VAL 148 CO -0.01 0.26 0.22 0.58 0.02 0.00 0.00 177.57 178.64 3byz h VAL 149 N -0.16 0.97 -0.15 2.57 2.07 0.44 -0.51 116.25 121.48 3byz h VAL 149 Ca 0.02 -0.15 -0.10 0.00 0.82 0.00 0.00 66.70 67.29 3byz h VAL 149 Cb 0.43 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 3byz h VAL 149 CO 0.01 0.08 -0.35 -0.07 0.02 0.00 0.00 177.57 177.26 3byz h LEU 150 N 0.44 0.33 -0.86 2.57 3.38 -0.41 -0.34 115.31 120.42 3byz h LEU 150 Ca 0.19 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 3byz h LEU 150 Cb 0.09 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 3byz h LEU 150 CO -0.13 0.66 0.33 0.74 0.09 0.00 0.00 178.44 180.13 3byz h THR 151 N 0.27 1.26 0.37 0.22 2.02 0.34 0.17 112.91 117.57 3byz h THR 151 Ca 0.03 -0.78 -0.02 0.00 0.77 0.00 0.00 66.41 66.41 3byz h THR 151 Cb 0.75 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.45 3byz h THR 151 CO 0.06 0.32 -0.18 0.58 0.37 0.00 0.00 175.52 176.67 3byz h VAL 152 N 1.14 0.44 -0.99 3.16 2.07 -0.43 -1.65 116.25 120.00 3byz h VAL 152 Ca 0.27 -0.66 0.29 0.00 0.82 0.00 0.00 66.70 67.41 3byz h VAL 152 Cb 0.18 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 3byz h VAL 152 CO -0.03 0.09 0.71 0.00 0.02 0.00 0.00 177.57 178.37 3byz h ALA 153 N -0.64 2.94 -0.00 1.67 0.00 -1.06 -1.62 119.26 120.54 3byz h ALA 153 Ca -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3byz h ALA 153 Cb 0.53 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3byz h ALA 153 CO 0.08 -1.22 -0.56 0.00 0.00 0.00 0.00 179.25 177.55 3byz n ALA 154 N -2.73 3.72 0.16 0.00 0.00 0.61 -4.63 120.51 117.63 3byz n ALA 154 Ca 0.21 -0.43 -0.08 0.00 0.00 0.00 0.00 53.44 53.13 3byz n ALA 154 Cb 1.05 -1.03 -0.04 0.00 0.00 0.00 0.00 19.45 19.44 3byz n ALA 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3byz h LEU 155 N 0.39 -0.42 -0.84 0.00 5.85 -0.49 -1.84 115.31 117.96 3byz h LEU 155 Ca 0.00 -0.02 0.23 0.00 0.84 0.00 0.00 57.88 58.94 3byz h LEU 155 Cb 0.52 0.11 -0.16 0.00 0.37 0.00 0.00 40.66 41.50 3byz h LEU 155 CO 0.00 0.03 0.02 -2.65 -0.34 0.00 0.00 178.44 175.50 3byz n PRO 156 N -5.10 -0.07 0.09 5.25 -0.02 -1.26 0.21 135.00 134.10 3byz n PRO 156 Ca -0.07 1.25 -0.04 0.00 -2.02 0.00 0.00 63.50 62.63 3byz n PRO 156 Cb 0.21 -1.99 0.16 0.00 -0.02 0.00 0.00 33.50 31.86 3byz n PRO 156 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 3byz h MET 157 N 0.00 0.22 0.21 -0.52 2.86 -1.82 -2.97 114.93 112.91 3byz h MET 157 Ca 0.51 -0.13 -0.33 0.00 -2.06 0.00 0.00 59.70 57.68 3byz h MET 157 Cb 1.05 0.01 0.02 0.00 0.06 0.00 0.00 31.60 32.75 3byz h MET 157 CO -0.79 0.70 -1.57 -0.07 1.06 0.00 0.00 176.91 176.25 3byz h LEU 158 N 0.17 0.68 -1.13 1.22 3.38 0.34 -1.14 115.31 118.83 3byz h LEU 158 Ca 0.00 -0.93 0.20 0.00 0.09 0.00 0.00 57.88 57.25 3byz h LEU 158 Cb 1.00 -0.22 -0.10 0.00 0.09 0.00 0.00 40.66 41.43 3byz h LEU 158 CO 0.08 1.73 0.62 0.50 0.09 0.00 0.00 178.44 181.46 3byz h LYS 159 N 0.06 0.64 0.01 1.13 3.64 0.53 0.32 116.57 122.90 3byz h LYS 159 Ca -0.30 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 58.96 3byz h LYS 159 Cb 2.07 -0.14 0.01 0.00 -0.41 0.00 0.00 32.23 33.76 3byz h LYS 159 CO 0.20 0.42 -0.32 0.37 -2.27 0.00 0.00 179.45 177.85 3byz h GLN 160 N 0.66 0.19 0.00 1.90 4.15 -1.45 -3.18 115.11 117.39 3byz h GLN 160 Ca 0.57 -0.23 0.00 0.00 0.77 0.00 0.00 58.65 59.76 3byz h GLN 160 Cb 1.03 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.79 3byz h GLN 160 CO -0.34 0.98 0.00 1.03 -1.93 0.00 0.00 178.83 178.57 3byz h SER 161 N -0.50 0.00 -5.74 -0.69 0.87 -0.14 -3.46 113.55 103.89 3byz h SER 161 Ca -0.04 0.00 -0.36 0.00 -1.23 0.00 0.00 61.79 60.16 3byz h SER 161 Cb 1.11 0.00 0.15 0.00 -0.44 0.00 0.00 62.40 63.22 3byz h SER 161 CO 0.06 0.00 -0.75 0.59 -0.53 0.00 0.00 176.83 176.20 3byz n ASN 162 N -2.45 -3.01 -3.13 6.23 5.03 0.92 -5.00 115.26 113.84 3byz n ASN 162 Ca -0.01 -0.62 -0.18 0.00 0.87 0.00 0.00 54.58 54.64 3byz n ASN 162 Cb 0.10 -5.00 0.14 0.00 -1.02 0.00 0.00 39.78 34.00 3byz n ASN 162 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3byz n GLY 163 N -1.37 -2.34 2.67 7.41 0.00 0.04 -4.68 105.19 106.92 3byz n GLY 163 Ca -0.22 -1.53 -0.29 0.00 0.00 0.00 0.00 46.02 43.99 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 -3.42 3.48 0.34 1.61 0.01 -1.05 -1.30 113.70 113.37 3byz s SER 164 Ca 0.43 -1.25 -0.27 0.00 1.31 0.00 0.00 55.95 56.17 3byz s SER 164 Cb -0.03 -0.61 -0.09 0.00 0.21 0.00 0.00 66.02 65.50 3byz s SER 164 CO 0.32 -0.39 1.11 -0.63 0.41 0.00 0.00 173.24 174.06 3byz s ILE 165 N 1.85 3.44 -0.24 1.44 1.01 0.19 -2.55 121.20 126.34 3byz s ILE 165 Ca 0.06 1.31 -0.03 0.00 0.00 0.00 0.00 60.65 61.99 3byz s ILE 165 Cb -0.17 -3.78 0.08 0.00 0.01 0.00 0.00 42.46 38.61 3byz s ILE 165 CO -0.23 0.20 0.08 -0.69 0.00 0.00 0.00 174.94 174.31 3byz s VAL 166 N -1.34 0.32 -0.33 2.92 1.01 -0.31 -1.22 120.40 121.45 3byz s VAL 166 Ca 0.51 -0.71 -0.16 0.00 0.00 0.00 0.00 61.98 61.61 3byz s VAL 166 Cb -0.29 -1.06 -0.01 0.00 0.00 0.00 0.00 36.38 35.01 3byz s VAL 166 CO 0.38 -0.46 0.43 0.68 0.00 0.00 0.00 175.10 176.12 3byz s VAL 167 N 1.93 5.10 -0.26 2.92 -7.23 0.87 -1.79 120.40 121.94 3byz s VAL 167 Ca 0.05 0.29 -0.29 0.00 -1.81 0.00 0.00 61.98 60.21 3byz s VAL 167 Cb -0.17 -3.86 0.01 0.00 0.56 0.00 0.00 36.38 32.92 3byz s VAL 167 CO -0.20 -0.09 1.16 -0.69 -0.31 0.00 0.00 175.10 174.97 3byz s VAL 168 N 2.19 4.42 0.00 1.32 1.01 -0.88 -1.11 120.40 127.35 3byz s VAL 168 Ca 0.15 1.67 0.00 0.00 0.00 0.00 0.00 61.98 63.80 3byz s VAL 168 Cb -0.16 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 31.97 3byz s VAL 168 CO 0.12 -0.34 0.00 -0.24 0.00 0.00 0.00 175.10 174.64 3byz n SER 169 N 6.85 0.00 -3.58 3.32 2.88 0.85 -4.86 113.62 119.09 3byz n SER 169 Ca 0.13 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.62 3byz n SER 169 Cb 0.46 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.90 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 -0.19 0.13 -3.46 0.01 -1.22 -3.33 113.70 106.63 3byz s SER 170 Ca 0.00 -0.03 -0.22 0.00 1.31 0.00 0.00 55.95 57.02 3byz s SER 170 Cb 0.00 0.22 -0.03 0.00 0.21 0.00 0.00 66.02 66.42 3byz s SER 170 CO 0.00 -0.36 1.68 -0.07 0.41 0.00 0.00 173.24 174.90 3byz h LEU 171 N 2.00 -0.39 -0.09 2.44 3.38 -1.70 0.41 115.31 121.37 3byz h LEU 171 Ca -0.15 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3byz h LEU 171 Cb 1.19 0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.13 3byz h LEU 171 CO 0.25 -0.16 0.25 0.00 0.09 0.00 0.00 178.44 178.87 3byz n ALA 172 N -2.50 0.52 1.03 1.53 0.00 -1.26 -0.03 120.51 119.81 3byz n ALA 172 Ca -0.03 0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.53 3byz n ALA 172 Cb 0.19 -0.54 0.11 0.00 0.00 0.00 0.00 19.45 19.20 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 -1.26 -0.93 0.00 0.00 0.00 0.14 -4.20 105.19 98.95 3byz n GLY 173 Ca -0.00 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.22 2.12 -4.02 1.61 4.76 0.95 -3.83 118.16 118.54 3byz n LYS 174 Ca 0.06 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.41 3byz n LYS 174 Cb 0.35 -0.92 -0.11 0.00 -1.84 0.00 0.00 35.03 32.51 3byz n LYS 174 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3byz s VAL 175 N -1.76 0.18 0.26 -0.18 1.01 0.23 -5.13 120.40 115.02 3byz s VAL 175 Ca 0.00 -1.16 -0.29 0.00 0.00 0.00 0.00 61.98 60.53 3byz s VAL 175 Cb 0.00 -0.62 -0.09 0.00 0.00 0.00 0.00 36.38 35.67 3byz s VAL 175 CO 0.00 -0.62 1.00 0.00 0.00 0.00 0.00 175.10 175.48 3byz s ALA 176 N -2.09 3.35 -0.01 5.51 0.00 -1.26 -4.06 121.76 123.19 3byz s ALA 176 Ca -0.09 0.71 0.00 0.00 0.00 0.00 0.00 51.96 52.58 3byz s ALA 176 Cb -0.05 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 19.83 3byz s ALA 176 CO -0.03 0.07 0.00 0.71 0.00 0.00 0.00 175.76 176.51 3byz s TYR 177 N -1.22 0.14 0.76 0.00 2.02 -1.26 -4.97 117.35 112.82 3byz s TYR 177 Ca 0.43 0.02 -0.11 0.00 -0.37 0.00 0.00 57.07 57.05 3byz s TYR 177 Cb -0.27 -0.19 0.05 0.00 -0.40 0.00 0.00 41.96 41.15 3byz s TYR 177 CO 0.35 -0.05 1.09 -1.25 -1.57 0.00 0.00 175.55 174.11 3byz s PRO 178 N 0.48 2.35 0.00 -1.71 0.04 -1.26 -3.73 135.00 131.16 3byz s PRO 178 Ca -0.04 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.14 3byz s PRO 178 Cb -0.07 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.57 3byz s PRO 178 CO -0.01 -1.57 0.00 -1.33 0.04 0.00 0.00 177.00 174.13 3byz n MET 179 N -3.46 0.00 -0.63 4.56 2.81 -1.26 -4.80 117.12 114.35 3byz n MET 179 Ca 0.09 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 56.04 3byz n MET 179 Cb 0.53 -0.22 0.14 0.00 -0.71 0.00 0.00 33.22 32.96 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 -0.99 1.54 -0.26 2.03 0.24 -1.24 -2.80 118.33 116.85 3byz n VAL 180 Ca 0.00 -2.32 -0.04 0.00 -2.04 0.00 0.00 64.34 59.94 3byz n VAL 180 Cb 0.00 0.05 0.02 0.00 -1.47 0.00 0.00 33.84 32.44 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 0.67 0.03 -0.29 2.33 0.00 -1.87 1.12 119.26 121.26 3byz h ALA 181 Ca -0.04 0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 3byz h ALA 181 Cb 1.20 0.85 -0.00 0.00 0.00 0.00 0.00 17.79 19.83 3byz h ALA 181 CO 0.02 -0.65 -0.27 0.00 0.00 0.00 0.00 179.25 178.34 3byz h ALA 182 N 1.14 0.43 0.27 0.00 0.00 -1.96 -0.98 119.26 118.16 3byz h ALA 182 Ca 0.27 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3byz h ALA 182 Cb 0.57 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3byz h ALA 182 CO -0.78 0.43 -0.29 -0.92 0.00 0.00 0.00 179.25 177.69 3byz h TYR 183 N 0.44 -0.77 -0.84 0.00 3.20 -1.78 -2.57 116.97 114.64 3byz h TYR 183 Ca 0.05 0.01 0.16 0.00 3.14 0.00 0.00 58.73 62.08 3byz h TYR 183 Cb 0.84 0.30 -0.10 0.00 1.54 0.00 0.00 36.73 39.31 3byz h TYR 183 CO 0.07 -0.41 0.41 1.03 -1.64 0.00 0.00 178.16 177.62 3byz h SER 184 N -0.60 0.46 -0.67 -2.11 0.87 0.13 -1.29 113.55 110.35 3byz h SER 184 Ca -0.01 0.10 -0.02 0.00 -1.23 0.00 0.00 61.79 60.64 3byz h SER 184 Cb 0.56 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.52 3byz h SER 184 CO -0.07 0.17 0.35 0.00 -0.53 0.00 0.00 176.83 176.75 3byz h ALA 185 N 1.58 1.33 -0.23 6.23 0.00 -1.02 0.31 119.26 127.46 3byz h ALA 185 Ca 0.47 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 55.14 3byz h ALA 185 Cb 0.71 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 3byz h ALA 185 CO -0.39 0.53 -0.30 0.66 0.00 0.00 0.00 179.25 179.75 3byz h SER 186 N 0.96 0.67 -0.70 0.00 4.64 -0.88 -1.47 113.55 116.77 3byz h SER 186 Ca 0.24 -0.50 -0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3byz h SER 186 Cb 0.06 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 61.93 3byz h SER 186 CO -0.04 1.04 0.43 0.11 -0.87 0.00 0.00 176.83 177.50 3byz h LYS 187 N 0.31 0.95 -0.58 4.77 1.79 -1.07 -2.24 116.57 120.50 3byz h LYS 187 Ca 0.03 -0.08 -0.02 0.00 -2.18 0.00 0.00 60.65 58.40 3byz h LYS 187 Cb 0.87 -0.20 -0.03 0.00 -1.58 0.00 0.00 32.23 31.30 3byz h LYS 187 CO 0.07 0.67 0.30 0.74 -1.08 0.00 0.00 179.45 180.15 3byz h PHE 188 N 0.95 0.83 -0.75 -1.35 -1.00 -0.87 -1.44 116.94 113.32 3byz h PHE 188 Ca 0.25 -0.03 0.12 0.00 2.81 0.00 0.00 57.97 61.12 3byz h PHE 188 Cb -0.04 -0.26 -0.08 0.00 3.61 0.00 0.00 35.95 39.18 3byz h PHE 188 CO -0.01 0.62 0.34 0.00 -1.61 0.00 0.00 178.31 177.65 3byz h ALA 189 N 1.13 1.06 -0.68 2.45 0.00 -1.21 -2.26 119.26 119.74 3byz h ALA 189 Ca 0.20 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 3byz h ALA 189 Cb 0.09 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3byz h ALA 189 CO -0.03 -0.12 0.41 -0.07 0.00 0.00 0.00 179.25 179.44 3byz h LEU 190 N 0.54 0.82 0.70 0.00 3.38 -0.64 -1.28 115.31 118.82 3byz h LEU 190 Ca 0.39 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.27 3byz h LEU 190 Cb 0.52 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3byz h LEU 190 CO -0.34 0.64 -0.49 -0.78 0.09 0.00 0.00 178.44 177.56 3byz h ASP 191 N 0.92 -1.27 -0.24 -0.43 1.82 -1.34 0.43 116.42 116.32 3byz h ASP 191 Ca 0.24 0.08 0.07 0.00 -0.39 0.00 0.00 57.03 57.03 3byz h ASP 191 Cb -0.03 0.38 -0.01 0.00 0.68 0.00 0.00 39.33 40.36 3byz h ASP 191 CO -0.05 -0.72 0.22 1.23 -1.61 0.00 0.00 179.24 178.32 3byz h GLY 192 N -1.13 0.00 0.37 -0.78 0.00 -1.27 0.09 103.07 100.36 3byz h GLY 192 Ca -0.09 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.02 3byz h GLY 192 CO 0.06 0.00 -1.09 -2.75 0.00 0.00 0.00 176.54 172.75 3byz h PHE 193 N 0.00 0.29 0.00 5.60 3.04 -1.18 -3.29 116.94 121.40 3byz h PHE 193 Ca 0.12 -0.21 -0.07 0.00 3.98 0.00 0.00 57.97 61.78 3byz h PHE 193 Cb 0.56 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.05 3byz h PHE 193 CO 0.00 1.43 -0.34 0.74 -2.02 0.00 0.00 178.31 178.11 3byz h PHE 194 N -0.56 0.00 0.00 0.41 0.04 -0.61 -2.37 116.94 113.85 3byz h PHE 194 Ca -0.25 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.42 3byz h PHE 194 Cb 1.54 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.67 3byz h PHE 194 CO 0.15 0.34 -0.51 0.77 -0.60 0.00 0.00 178.31 178.46 3byz h SER 195 N 0.00 0.00 -0.19 2.17 0.02 -1.16 -1.22 113.55 113.17 3byz h SER 195 Ca -0.00 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.86 3byz h SER 195 Cb 1.21 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.74 3byz h SER 195 CO 0.04 0.51 -0.20 0.28 -1.14 0.00 0.00 176.83 176.33 3byz h SER 196 N 0.00 0.51 -0.00 3.07 0.02 -1.51 -2.43 113.55 113.21 3byz h SER 196 Ca -0.01 -0.48 -0.00 0.00 -0.84 0.00 0.00 61.79 60.46 3byz h SER 196 Cb 1.02 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 63.42 3byz h SER 196 CO 0.07 0.89 0.00 0.40 -1.14 0.00 0.00 176.83 177.05 3byz h ILE 197 N 0.15 1.08 -0.80 3.27 1.08 -1.48 0.23 117.51 121.04 3byz h ILE 197 Ca 0.03 -0.25 0.19 0.00 -0.39 0.00 0.00 64.86 64.44 3byz h ILE 197 Cb 0.75 1.25 -0.14 0.00 -3.07 0.00 0.00 36.82 35.61 3byz h ILE 197 CO 0.05 0.06 0.00 -0.09 -0.69 0.00 0.00 178.15 177.49 3byz h ARG 198 N -0.10 0.09 -0.08 2.37 2.43 -1.15 0.35 114.38 118.28 3byz h ARG 198 Ca 0.00 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 3byz h ARG 198 Cb 0.11 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.63 3byz h ARG 198 CO -0.00 0.06 -0.01 0.87 -1.51 0.00 0.00 179.97 179.38 3byz h LYS 199 N 0.09 0.15 -0.02 0.20 1.79 -0.36 0.98 116.57 119.40 3byz h LYS 199 Ca 0.44 -0.05 0.03 0.00 -2.18 0.00 0.00 60.65 58.89 3byz h LYS 199 Cb 0.79 -0.01 -0.05 0.00 -1.58 0.00 0.00 32.23 31.38 3byz h LYS 199 CO -0.71 0.44 -0.30 0.93 -1.08 0.00 0.00 179.45 178.73 3byz h GLU 200 N -0.15 -0.42 -0.78 3.15 5.08 0.18 -1.89 114.58 119.77 3byz h GLU 200 Ca 0.02 0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.52 3byz h GLU 200 Cb 0.38 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.64 3byz h GLU 200 CO 0.01 -0.28 0.40 1.88 -1.00 0.00 0.00 179.01 180.01 3byz h TYR 201 N -0.43 0.71 -0.14 4.33 -1.99 -0.01 0.39 116.97 119.82 3byz h TYR 201 Ca 0.07 0.03 0.04 0.00 2.00 0.00 0.00 58.73 60.86 3byz h TYR 201 Cb 0.53 -0.20 -0.04 0.00 2.00 0.00 0.00 36.73 39.02 3byz h TYR 201 CO -0.33 0.23 -0.08 1.03 -0.00 0.00 0.00 178.16 179.00 3byz h SER 202 N 0.64 -0.27 0.54 3.88 0.87 -0.32 -1.17 113.55 117.72 3byz h SER 202 Ca 0.39 0.06 -0.09 0.00 -1.23 0.00 0.00 61.79 60.92 3byz h SER 202 Cb 0.46 0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.55 3byz h SER 202 CO -0.30 -0.11 -0.45 0.58 -0.53 0.00 0.00 176.83 176.02 3byz h VAL 203 N -0.08 1.22 0.00 2.23 2.07 -0.35 -2.72 116.25 118.62 3byz h VAL 203 Ca 0.08 -1.58 0.00 0.00 0.82 0.00 0.00 66.70 66.02 3byz h VAL 203 Cb 0.20 1.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 3byz h VAL 203 CO -0.19 0.44 0.00 -1.20 0.02 0.00 0.00 177.57 176.64 3byz n SER 204 N -3.86 0.18 -3.23 0.57 7.64 0.12 -4.85 113.62 110.19 3byz n SER 204 Ca -0.01 -1.99 -0.24 0.00 1.01 0.00 0.00 58.87 57.64 3byz n SER 204 Cb 0.49 -0.09 -0.04 0.00 -1.01 0.00 0.00 64.21 63.55 3byz n SER 204 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 3byz n ARG 205 N -0.41 -1.04 -2.36 1.43 1.85 -0.95 -4.87 116.66 110.32 3byz n ARG 205 Ca 0.00 0.08 -0.43 0.00 -1.00 0.00 0.00 57.85 56.50 3byz n ARG 205 Cb 0.05 -3.05 -0.02 0.00 -1.05 0.00 0.00 32.46 28.38 3byz n ARG 205 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3byz s VAL 206 N -2.29 3.92 -0.73 8.89 1.01 -0.52 -4.94 120.40 125.74 3byz s VAL 206 Ca 0.46 0.94 -0.06 0.00 0.00 0.00 0.00 61.98 63.32 3byz s VAL 206 Cb -0.27 -4.22 -0.06 0.00 0.00 0.00 0.00 36.38 31.83 3byz s VAL 206 CO 0.57 -0.76 3.01 -3.20 0.00 0.00 0.00 175.10 174.72 3byz n ASN 207 N 8.77 6.88 -4.51 3.32 4.05 -1.26 -4.61 115.26 127.90 3byz n ASN 207 Ca 0.16 -2.83 -0.34 0.00 0.45 0.00 0.00 54.58 52.02 3byz n ASN 207 Cb 0.48 -1.39 -0.12 0.00 1.23 0.00 0.00 39.78 39.99 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 -0.08 4.14 0.58 3.44 1.01 -1.26 -4.16 120.40 124.07 3byz s VAL 208 Ca 0.63 -0.26 -0.09 0.00 0.00 0.00 0.00 61.98 62.26 3byz s VAL 208 Cb 0.28 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 3byz s VAL 208 CO -0.09 0.46 0.95 -0.94 0.00 0.00 0.00 175.10 175.48 3byz s SER 209 N 0.59 6.22 -0.10 3.32 1.04 -0.42 -4.93 113.70 119.43 3byz s SER 209 Ca -0.00 1.25 -0.03 0.00 0.48 0.00 0.00 55.95 57.64 3byz s SER 209 Cb -0.14 -2.38 0.04 0.00 0.10 0.00 0.00 66.02 63.64 3byz s SER 209 CO 0.02 -0.78 0.07 -0.63 0.98 0.00 0.00 173.24 172.90 3byz s ILE 210 N -3.04 -0.06 -0.20 -1.02 1.01 -1.25 -0.64 121.20 116.00 3byz s ILE 210 Ca 0.53 0.15 -0.01 0.00 0.00 0.00 0.00 60.65 61.31 3byz s ILE 210 Cb -0.11 -0.37 0.01 0.00 0.01 0.00 0.00 42.46 42.00 3byz s ILE 210 CO 0.51 -0.01 -0.12 -0.89 0.00 0.00 0.00 174.94 174.43 3byz s THR 211 N 2.14 2.73 -0.26 2.92 2.01 -0.36 -4.37 115.64 120.46 3byz s THR 211 Ca 0.04 -0.74 -0.09 0.00 0.31 0.00 0.00 61.69 61.21 3byz s THR 211 Cb -0.14 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.11 3byz s THR 211 CO -0.06 0.46 0.12 -0.22 -0.69 0.00 0.00 174.62 174.23 3byz s LEU 212 N 1.38 3.70 -0.27 4.42 2.96 -0.32 -0.09 118.68 130.45 3byz s LEU 212 Ca 0.05 -0.11 -0.06 0.00 -0.22 0.00 0.00 54.13 53.79 3byz s LEU 212 Cb -0.14 -2.00 -0.00 0.00 0.50 0.00 0.00 46.19 44.55 3byz s LEU 212 CO -0.08 -0.02 0.06 0.00 -1.32 0.00 0.00 176.35 174.99 3byz s VAL 214 N 1.52 4.76 -0.15 0.00 1.01 0.54 -0.10 120.40 127.98 3byz s VAL 214 Ca 0.04 -0.97 -0.08 0.00 0.00 0.00 0.00 61.98 60.97 3byz s VAL 214 Cb -0.16 -4.54 -0.04 0.00 0.00 0.00 0.00 36.38 31.64 3byz s VAL 214 CO 0.02 -1.20 0.13 -0.76 0.00 0.00 0.00 175.10 173.29 3byz s LEU 215 N 2.83 4.26 0.00 3.92 1.43 -1.21 -2.30 118.68 127.62 3byz s LEU 215 Ca 0.14 0.34 0.00 0.00 -1.03 0.00 0.00 54.13 53.58 3byz s LEU 215 Cb -0.22 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 43.94 3byz s LEU 215 CO 0.06 0.30 0.00 0.61 0.23 0.00 0.00 176.35 177.55 3byz n GLY 216 N 2.69 0.14 3.65 -3.19 0.00 0.26 -2.05 105.19 106.70 3byz n GLY 216 Ca -0.18 -1.61 -0.43 0.00 0.00 0.00 0.00 46.02 43.80 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 4.18 0.02 0.99 2.96 -1.26 -4.91 118.68 120.65 3byz s LEU 217 Ca 0.00 1.92 0.07 0.00 -0.22 0.00 0.00 54.13 55.90 3byz s LEU 217 Cb 0.00 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 43.13 3byz s LEU 217 CO 0.00 -0.95 -0.21 -0.63 -1.32 0.00 0.00 176.35 173.24 3byz s ILE 218 N 4.12 2.55 -0.01 6.68 -1.09 -1.26 -1.37 121.20 130.82 3byz s ILE 218 Ca 0.67 -1.15 0.00 0.00 -2.23 0.00 0.00 60.65 57.94 3byz s ILE 218 Cb -0.28 -2.01 0.01 0.00 -1.58 0.00 0.00 42.46 38.60 3byz s ILE 218 CO 0.25 0.42 1.64 -0.90 -1.23 0.00 0.00 174.94 175.12 3byz n ASP 219 N 1.87 4.51 -4.77 3.58 5.68 -0.51 -4.58 116.55 122.34 3byz n ASP 219 Ca -0.16 -2.28 -0.32 0.00 -0.50 0.00 0.00 54.79 51.52 3byz n ASP 219 Cb 0.52 -0.90 0.06 0.00 -1.14 0.00 0.00 41.12 39.66 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 -0.05 3.23 0.21 2.12 -4.23 -1.26 -4.75 115.64 110.90 3byz s THR 220 Ca 0.01 0.51 -0.10 0.00 -1.18 0.00 0.00 61.69 60.93 3byz s THR 220 Cb 0.01 -3.01 0.14 0.00 1.34 0.00 0.00 72.50 70.97 3byz s THR 220 CO 0.00 -0.41 1.75 -0.08 -0.54 0.00 0.00 174.62 175.34 3byz h GLU 221 N -0.39 0.43 0.07 3.99 4.57 -1.98 0.38 114.58 121.64 3byz h GLU 221 Ca -0.46 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 57.69 3byz h GLU 221 Cb 1.24 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.74 3byz h GLU 221 CO 0.53 0.28 -0.03 1.15 -1.18 0.00 0.00 179.01 179.76 3byz h THR 222 N 0.44 1.01 -0.67 0.32 2.02 -1.94 -2.13 112.91 111.96 3byz h THR 222 Ca 0.30 -0.26 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 3byz h THR 222 Cb 0.35 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 67.91 3byz h THR 222 CO -0.29 0.06 0.28 0.00 0.37 0.00 0.00 175.52 175.95 3byz h ALA 223 N 0.72 0.86 -0.33 6.16 0.00 -1.77 0.23 119.26 125.14 3byz h ALA 223 Ca -0.01 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.79 3byz h ALA 223 Cb 0.17 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 3byz h ALA 223 CO 0.01 0.47 0.01 1.98 0.00 0.00 0.00 179.25 181.72 3byz h MET 224 N 0.94 0.11 0.00 0.00 -1.53 0.00 -2.32 114.93 112.13 3byz h MET 224 Ca 0.22 -0.01 -0.23 0.00 -3.44 0.00 0.00 59.70 56.25 3byz h MET 224 Cb 0.18 -0.02 -0.04 0.00 -0.55 0.00 0.00 31.60 31.17 3byz h MET 224 CO -0.02 0.07 -1.46 0.87 0.14 0.00 0.00 176.91 176.51 3byz h LYS 225 N 0.11 0.00 0.00 0.39 1.57 -1.29 -1.59 116.57 115.77 3byz h LYS 225 Ca 0.16 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 3byz h LYS 225 Cb 0.21 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 3byz h LYS 225 CO -0.25 0.48 -0.08 0.00 -0.57 0.00 0.00 179.45 179.03 3byz h ALA 226 N 1.17 1.31 0.00 3.86 0.00 -0.19 -3.27 119.26 122.14 3byz h ALA 226 Ca -0.20 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3byz h ALA 226 Cb 1.80 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.58 3byz h ALA 226 CO 0.07 0.10 0.00 0.28 0.00 0.00 0.00 179.25 179.70 3byz n VAL 227 N -3.62 0.00 -1.66 0.00 0.31 -0.90 -4.48 118.33 107.98 3byz n VAL 227 Ca -0.02 -0.27 -0.55 0.00 -0.01 0.00 0.00 64.34 63.49 3byz n VAL 227 Cb 0.19 1.10 -0.07 0.00 -0.91 0.00 0.00 33.84 34.16 3byz n VAL 227 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3byz n SER 228 N -0.42 2.51 -0.84 4.52 7.64 -0.60 -1.88 113.62 124.55 3byz n SER 228 Ca 0.00 0.95 -0.06 0.00 1.01 0.00 0.00 58.87 60.77 3byz n SER 228 Cb 0.03 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.04 3byz n SER 228 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3byz n GLY 229 N 4.69 0.26 2.14 0.23 0.00 -1.26 -4.90 105.19 106.35 3byz n GLY 229 Ca 0.29 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.76 0.00 -3.35 -0.61 5.41 -0.93 -5.07 119.36 111.04 3byz n ILE 230 Ca -0.05 0.00 -0.44 0.00 1.00 0.00 0.00 62.75 63.26 3byz n ILE 230 Cb 0.54 -0.19 -0.07 0.00 -0.71 0.00 0.00 39.64 39.20 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 -1.94 5.17 -1.20 1.39 1.01 -0.79 -5.01 120.40 119.03 3byz s VAL 231 Ca 0.00 -0.93 -0.04 0.00 0.00 0.00 0.00 61.98 61.00 3byz s VAL 231 Cb 0.00 -4.15 0.21 0.00 0.00 0.00 0.00 36.38 32.44 3byz s VAL 231 CO 0.00 -0.60 2.09 1.41 0.00 0.00 0.00 175.10 178.00 3byz n HIS 232 N 5.37 2.66 -4.54 5.22 8.25 -1.26 -4.87 115.22 126.05 3byz n HIS 232 Ca -0.11 -2.71 -0.25 0.00 -0.26 0.00 0.00 57.72 54.38 3byz n HIS 232 Cb 0.44 -1.58 -0.10 0.00 1.12 0.00 0.00 29.99 29.87 3byz n HIS 232 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3byz s MET 233 N -2.25 1.84 1.09 -0.41 0.23 -1.26 -5.13 119.30 113.40 3byz s MET 233 Ca 0.46 -2.06 -0.12 0.00 -1.03 0.00 0.00 55.69 52.95 3byz s MET 233 Cb 0.17 -1.13 0.24 0.00 -1.53 0.00 0.00 34.83 32.58 3byz s MET 233 CO -0.09 -0.20 1.07 -0.65 -2.03 0.00 0.00 175.02 173.12 3byz s GLN 234 N -3.82 -0.35 -0.56 3.16 -1.52 -1.26 -4.99 119.66 110.32 3byz s GLN 234 Ca 0.31 1.14 0.07 0.00 -1.95 0.00 0.00 55.36 54.92 3byz s GLN 234 Cb 0.08 -1.60 0.25 0.00 -0.22 0.00 0.00 33.01 31.52 3byz s GLN 234 CO 0.15 -3.43 0.68 0.00 -0.25 0.00 0.00 175.29 172.43 3byz n ALA 235 N -4.75 3.54 -0.12 6.09 0.00 -1.26 -4.66 120.51 119.35 3byz n ALA 235 Ca 0.06 -4.32 -0.05 0.00 0.00 0.00 0.00 53.44 49.13 3byz n ALA 235 Cb 0.53 -0.87 -0.01 0.00 0.00 0.00 0.00 19.45 19.11 3byz n ALA 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3byz n ALA 236 N 1.00 -0.80 -1.92 0.00 0.00 -0.47 -3.66 120.51 114.66 3byz n ALA 236 Ca 0.27 0.05 -0.42 0.00 0.00 0.00 0.00 53.44 53.34 3byz n ALA 236 Cb 0.45 -0.14 -0.03 0.00 0.00 0.00 0.00 19.45 19.73 3byz n ALA 236 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3byz s PRO 237 N -0.01 4.25 0.09 0.00 0.04 -1.26 -1.42 135.00 136.69 3byz s PRO 237 Ca 0.07 2.30 -0.28 0.00 0.04 0.00 0.00 61.00 63.14 3byz s PRO 237 Cb -0.10 -3.13 -0.14 0.00 0.04 0.00 0.00 34.50 31.17 3byz s PRO 237 CO 0.05 -0.48 1.67 1.57 0.04 0.00 0.00 177.00 179.85 3byz h LYS 238 N 5.67 -0.46 -0.21 4.56 2.10 -1.85 -2.10 116.57 124.28 3byz h LYS 238 Ca -0.45 0.03 0.06 0.00 -2.00 0.00 0.00 60.65 58.29 3byz h LYS 238 Cb 1.21 0.11 -0.01 0.00 -0.90 0.00 0.00 32.23 32.64 3byz h LYS 238 CO 0.82 -0.31 0.21 1.05 -2.00 0.00 0.00 179.45 179.22 3byz h GLU 239 N -0.48 0.00 0.11 0.07 -0.00 -1.94 -1.64 114.58 110.70 3byz h GLU 239 Ca -0.02 0.00 -0.15 0.00 -0.00 0.00 0.00 59.36 59.19 3byz h GLU 239 Cb 0.41 0.00 0.02 0.00 -0.00 0.00 0.00 28.75 29.18 3byz h GLU 239 CO 0.01 0.00 -0.66 1.49 -0.00 0.00 0.00 179.01 179.85 3byz h GLU 240 N 0.00 0.25 -0.82 1.06 4.81 -1.85 -3.34 114.58 114.68 3byz h GLU 240 Ca 0.10 -0.42 0.19 0.00 -0.13 0.00 0.00 59.36 59.10 3byz h GLU 240 Cb 0.51 0.15 -0.15 0.00 0.63 0.00 0.00 28.75 29.90 3byz h GLU 240 CO -0.00 1.20 -0.05 0.00 -0.73 0.00 0.00 179.01 179.42 3byz h ALA 242 N 1.79 0.89 -0.60 0.00 0.00 -1.60 -1.59 119.26 118.16 3byz h ALA 242 Ca 0.44 -0.47 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3byz h ALA 242 Cb 0.78 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3byz h ALA 242 CO -0.77 0.66 0.07 1.25 0.00 0.00 0.00 179.25 180.46 3byz h LEU 243 N 0.31 0.95 -1.05 0.00 5.85 -1.59 -2.01 115.31 117.77 3byz h LEU 243 Ca 0.02 -0.23 -0.05 0.00 0.84 0.00 0.00 57.88 58.46 3byz h LEU 243 Cb 0.97 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 3byz h LEU 243 CO 0.08 0.97 0.11 -0.08 -0.34 0.00 0.00 178.44 179.18 3byz h GLU 244 N 0.93 0.79 -0.65 1.25 4.57 -0.96 0.34 114.58 120.84 3byz h GLU 244 Ca 0.18 -0.16 -0.04 0.00 -1.18 0.00 0.00 59.36 58.16 3byz h GLU 244 Cb 0.44 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 3byz h GLU 244 CO 0.01 0.72 0.25 0.82 -1.18 0.00 0.00 179.01 179.64 3byz h ILE 245 N 0.76 1.23 0.01 2.32 2.04 -1.19 -1.68 117.51 121.00 3byz h ILE 245 Ca 0.17 -0.73 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 3byz h ILE 245 Cb 0.30 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 3byz h ILE 245 CO 0.00 0.29 -0.00 0.40 0.00 0.00 0.00 178.15 178.84 3byz h ILE 246 N 0.94 1.60 -0.95 -0.67 2.04 -0.39 -2.32 117.51 117.75 3byz h ILE 246 Ca 0.22 -2.00 0.28 0.00 1.00 0.00 0.00 64.86 64.36 3byz h ILE 246 Cb 0.19 2.92 -0.15 0.00 -0.74 0.00 0.00 36.82 39.04 3byz h ILE 246 CO -0.02 0.50 0.42 0.07 0.00 0.00 0.00 178.15 179.12 3byz h LYS 247 N -0.89 0.27 0.81 2.37 5.09 -0.38 0.25 116.57 124.08 3byz h LYS 247 Ca -0.00 -0.02 -0.04 0.00 0.09 0.00 0.00 60.65 60.68 3byz h LYS 247 Cb 0.83 -0.06 0.01 0.00 0.10 0.00 0.00 32.23 33.11 3byz h LYS 247 CO 0.00 0.18 -0.39 0.78 -2.09 0.00 0.00 179.45 177.93 3byz h GLY 248 N 0.28 -1.13 2.00 0.07 0.00 -1.09 0.90 103.07 104.10 3byz h GLY 248 Ca 0.65 0.42 -0.02 0.00 0.00 0.00 0.00 47.33 48.38 3byz h GLY 248 CO -0.63 -0.41 -0.09 -1.33 0.00 0.00 0.00 176.54 174.08 3byz h GLY 249 N -1.08 0.00 0.93 4.60 0.00 -0.79 -2.30 103.07 104.43 3byz h GLY 249 Ca -0.11 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.11 3byz h GLY 249 CO 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 176.54 176.46 3byz h ALA 250 N 1.91 0.39 -0.05 3.60 0.00 -0.07 -3.00 119.26 122.03 3byz h ALA 250 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3byz h ALA 250 Cb 0.23 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3byz h ALA 250 CO 0.01 0.38 0.00 1.28 0.00 0.00 0.00 179.25 180.92 3byz n LEU 251 N -4.31 0.67 -1.64 0.00 4.77 0.27 -4.93 117.00 111.82 3byz n LEU 251 Ca -0.04 -0.27 -0.17 0.00 -0.03 0.00 0.00 56.01 55.50 3byz n LEU 251 Cb 0.45 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.47 3byz n LEU 251 CO 0.44 0.13 -0.19 0.54 -1.33 0.00 0.00 177.39 176.98 3byz n ARG 252 N -0.37 -1.29 -2.09 3.23 1.74 -0.89 -4.96 116.66 112.02 3byz n ARG 252 Ca 0.16 0.98 -0.36 0.00 -0.77 0.00 0.00 57.85 57.86 3byz n ARG 252 Cb 0.18 -5.32 0.02 0.00 -1.02 0.00 0.00 32.46 26.32 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 -4.15 3.18 0.18 5.56 -0.21 -1.10 -4.84 119.66 118.27 3byz s GLN 253 Ca 0.00 1.80 -0.08 0.00 0.02 0.00 0.00 55.36 57.10 3byz s GLN 253 Cb 0.00 -2.03 0.06 0.00 1.00 0.00 0.00 33.01 32.04 3byz s GLN 253 CO 0.00 -1.04 1.56 0.93 -2.12 0.00 0.00 175.29 174.62 3byz h GLU 254 N 1.15 0.89 -3.56 2.91 5.08 -1.92 -3.35 114.58 115.77 3byz h GLU 254 Ca -0.50 -0.40 -0.10 0.00 -1.00 0.00 0.00 59.36 57.36 3byz h GLU 254 Cb 1.28 -0.02 -0.16 0.00 0.50 0.00 0.00 28.75 30.35 3byz h GLU 254 CO 0.56 1.05 -0.34 -1.21 -1.00 0.00 0.00 179.01 178.07 3byz s GLU 255 N -4.54 0.78 -0.02 2.33 2.02 -1.26 -1.17 118.70 116.84 3byz s GLU 255 Ca -0.10 -0.70 0.05 0.00 0.02 0.00 0.00 54.97 54.24 3byz s GLU 255 Cb 0.12 0.32 -0.01 0.00 0.10 0.00 0.00 34.13 34.67 3byz s GLU 255 CO 0.86 -0.24 -0.15 0.14 0.02 0.00 0.00 175.26 175.89 3byz s VAL 256 N -2.97 1.22 -0.35 2.63 -7.23 -0.80 -4.89 120.40 108.01 3byz s VAL 256 Ca -0.02 -0.65 -0.01 0.00 -1.81 0.00 0.00 61.98 59.49 3byz s VAL 256 Cb 0.01 -1.02 0.09 0.00 0.56 0.00 0.00 36.38 36.02 3byz s VAL 256 CO -0.06 0.35 0.09 -0.31 -0.31 0.00 0.00 175.10 174.85 3byz s TYR 257 N -0.30 3.51 -0.35 2.82 2.02 -1.26 -0.34 117.35 123.46 3byz s TYR 257 Ca 0.05 -2.38 -0.02 0.00 -0.37 0.00 0.00 57.07 54.35 3byz s TYR 257 Cb -0.07 -2.74 0.08 0.00 -0.40 0.00 0.00 41.96 38.84 3byz s TYR 257 CO -0.00 -0.91 0.08 -0.47 -1.57 0.00 0.00 175.55 172.68 3byz s TYR 258 N 1.12 3.45 0.18 2.71 6.14 -0.97 -5.00 117.35 124.98 3byz s TYR 258 Ca 0.04 -2.21 -0.06 0.00 0.64 0.00 0.00 57.07 55.48 3byz s TYR 258 Cb -0.21 -2.63 -0.02 0.00 0.42 0.00 0.00 41.96 39.52 3byz s TYR 258 CO -0.04 -0.89 0.24 0.34 0.64 0.00 0.00 175.55 175.84 3byz s ASP 259 N 1.44 0.09 -0.03 4.32 2.15 -1.26 -0.58 116.67 122.80 3byz s ASP 259 Ca 0.02 -1.09 0.16 0.00 0.43 0.00 0.00 52.55 52.07 3byz s ASP 259 Cb -0.21 0.43 0.50 0.00 -0.30 0.00 0.00 42.92 43.34 3byz s ASP 259 CO -0.03 -0.90 1.42 -1.54 -0.17 0.00 0.00 175.17 173.95 3byz n SER 260 N -0.24 3.65 -4.40 -0.34 3.41 -1.26 -4.89 113.62 109.54 3byz n SER 260 Ca -0.03 -2.16 -0.33 0.00 -0.26 0.00 0.00 58.87 56.09 3byz n SER 260 Cb 0.64 -0.40 -0.14 0.00 -0.26 0.00 0.00 64.21 64.05 3byz n SER 260 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3byz s SER 261 N -1.06 3.95 0.16 4.04 0.15 -1.26 -4.96 113.70 114.71 3byz s SER 261 Ca 0.38 -0.29 -0.13 0.00 0.70 0.00 0.00 55.95 56.61 3byz s SER 261 Cb 0.22 -1.27 0.05 0.00 -1.71 0.00 0.00 66.02 63.30 3byz s SER 261 CO 0.22 0.24 1.69 0.25 1.20 0.00 0.00 173.24 176.85 3byz h LEU 262 N 6.14 0.77 -0.27 3.45 5.85 -2.01 -3.04 115.31 126.19 3byz h LEU 262 Ca -0.34 -0.20 0.03 0.00 0.84 0.00 0.00 57.88 58.22 3byz h LEU 262 Cb 1.19 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.96 3byz h LEU 262 CO 0.53 0.76 -0.42 -0.50 -0.34 0.00 0.00 178.44 178.47 3byz h TRP 263 N 0.74 -1.28 0.00 1.25 -0.00 -1.99 -2.24 115.95 112.44 3byz h TRP 263 Ca 0.17 0.06 0.00 0.00 -0.00 0.00 0.00 58.89 59.12 3byz h TRP 263 Cb 0.26 0.59 0.00 0.00 -0.00 0.00 0.00 29.16 30.01 3byz h TRP 263 CO 0.01 -0.38 0.00 2.41 -0.00 0.00 0.00 178.44 180.49 3byz n THR 264 N -4.71 0.00 -0.36 1.49 -1.04 -1.16 -0.19 114.28 108.31 3byz n THR 264 Ca -0.03 0.97 -0.02 0.00 -2.04 0.00 0.00 64.05 62.93 3byz n THR 264 Cb 0.26 -1.38 0.03 0.00 -1.82 0.00 0.00 70.33 67.42 3byz n THR 264 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 3byz h THR 265 N 0.00 0.03 -0.96 12.58 1.35 -1.55 0.94 112.91 125.29 3byz h THR 265 Ca 0.00 0.00 0.05 0.00 -0.55 0.00 0.00 66.41 65.91 3byz h THR 265 Cb 0.00 0.03 -0.06 0.00 -1.73 0.00 0.00 68.15 66.39 3byz h THR 265 CO 0.00 0.00 0.62 -0.07 -0.25 0.00 0.00 175.52 175.82 3byz h LEU 266 N -0.03 1.02 0.14 3.87 4.07 -0.63 -3.23 115.31 120.52 3byz h LEU 266 Ca 0.33 0.00 -0.36 0.00 0.08 0.00 0.00 57.88 57.93 3byz h LEU 266 Cb 0.59 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 42.10 3byz h LEU 266 CO -0.94 0.67 -1.89 -0.07 -1.08 0.00 0.00 178.44 175.13 3byz h LEU 267 N 1.17 0.46 -0.16 1.67 3.38 0.47 -3.40 115.31 118.89 3byz h LEU 267 Ca 0.40 -0.88 0.00 0.00 0.09 0.00 0.00 57.88 57.49 3byz h LEU 267 Cb 0.08 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3byz h LEU 267 CO -0.15 1.78 0.01 0.00 0.09 0.00 0.00 178.44 180.17 3byz n ILE 268 N -3.49 1.86 -3.08 1.22 0.13 0.23 -4.66 119.36 111.56 3byz n ILE 268 Ca -0.28 0.53 -0.37 0.00 -1.10 0.00 0.00 62.75 61.52 3byz n ILE 268 Cb 1.06 -1.53 -0.06 0.00 -0.84 0.00 0.00 39.64 38.27 3byz n ILE 268 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3byz s ARG 269 N -3.05 4.33 -0.58 9.51 3.03 -1.26 -5.01 118.95 125.93 3byz s ARG 269 Ca -0.00 0.94 0.04 0.00 2.03 0.00 0.00 55.73 58.74 3byz s ARG 269 Cb 0.01 -3.00 0.15 0.00 -1.03 0.00 0.00 34.95 31.07 3byz s ARG 269 CO 0.02 0.46 0.36 1.21 -1.13 0.00 0.00 175.30 176.22 3byz s ASN 270 N -1.48 4.23 0.37 -2.89 3.04 -1.26 -4.94 114.94 112.02 3byz s ASN 270 Ca 0.40 -3.33 0.11 0.00 0.04 0.00 0.00 52.86 50.08 3byz s ASN 270 Cb -0.19 -1.46 0.74 0.00 -1.54 0.00 0.00 41.25 38.80 3byz s ASN 270 CO 0.22 -0.17 1.86 -0.65 -3.04 0.00 0.00 177.10 175.32 3byz h PRO 271 N 5.99 0.12 -0.62 0.43 0.11 -1.96 -1.31 132.00 134.76 3byz h PRO 271 Ca 0.05 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 3byz h PRO 271 Cb 0.84 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.91 3byz h PRO 271 CO 0.65 0.39 0.35 0.77 -0.21 0.00 0.00 178.00 179.95 3byz h SER 272 N 0.11 0.76 -0.42 -2.05 0.02 -1.99 -1.60 113.55 108.38 3byz h SER 272 Ca 0.02 -0.08 0.02 0.00 -0.84 0.00 0.00 61.79 60.90 3byz h SER 272 Cb 0.55 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.86 3byz h SER 272 CO 0.04 0.62 0.25 -0.09 -1.14 0.00 0.00 176.83 176.51 3byz h ARG 273 N 0.84 0.49 -0.42 3.45 2.43 -1.67 0.82 114.38 120.31 3byz h ARG 273 Ca 0.22 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.29 3byz h ARG 273 Cb 0.02 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 3byz h ARG 273 CO -0.04 0.32 -0.03 0.87 -1.51 0.00 0.00 179.97 179.59 3byz h LYS 274 N 0.51 0.70 0.02 0.20 1.57 -1.06 0.11 116.57 118.63 3byz h LYS 274 Ca 0.17 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3byz h LYS 274 Cb 0.00 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.23 3byz h LYS 274 CO -0.07 0.74 -0.01 0.82 -0.57 0.00 0.00 179.45 180.35 3byz h ILE 275 N 0.66 1.32 -0.71 1.86 2.04 -1.00 0.37 117.51 122.05 3byz h ILE 275 Ca 0.13 -1.09 0.13 0.00 1.00 0.00 0.00 64.86 65.03 3byz h ILE 275 Cb 0.45 2.04 -0.09 0.00 -0.74 0.00 0.00 36.82 38.48 3byz h ILE 275 CO 0.02 0.28 0.24 0.25 0.00 0.00 0.00 178.15 178.94 3byz h LEU 276 N -0.51 0.19 -1.00 1.44 5.85 -0.59 0.19 115.31 120.89 3byz h LEU 276 Ca -0.00 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 3byz h LEU 276 Cb 0.48 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.58 3byz h LEU 276 CO 0.01 0.07 0.50 -0.33 -0.34 0.00 0.00 178.44 178.34 3byz h GLU 277 N 0.38 1.19 0.42 1.25 5.08 -0.65 -2.76 114.58 119.50 3byz h GLU 277 Ca 0.38 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 3byz h GLU 277 Cb 0.58 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3byz h GLU 277 CO -0.41 0.85 -0.20 0.35 -1.00 0.00 0.00 179.01 178.61 3byz h PHE 278 N 1.20 -0.52 -0.88 4.33 3.57 0.14 -2.07 116.94 122.72 3byz h PHE 278 Ca 0.31 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.90 3byz h PHE 278 Cb -0.01 0.17 -0.12 0.00 2.79 0.00 0.00 35.95 38.78 3byz h PHE 278 CO 0.01 -0.32 -0.43 1.28 -2.23 0.00 0.00 178.31 176.62 3byz n LEU 279 N -3.56 -0.74 0.16 0.59 4.77 0.44 0.23 117.00 118.88 3byz n LEU 279 Ca -0.07 1.55 0.11 0.00 -0.03 0.00 0.00 56.01 57.57 3byz n LEU 279 Cb 0.22 -0.28 0.56 0.00 -2.33 0.00 0.00 43.42 41.60 3byz n LEU 279 CO 0.17 -1.33 0.83 -1.22 -1.33 0.00 0.00 177.39 174.51 3byz n TYR 280 N -5.20 0.74 1.29 -1.77 4.01 -1.04 -3.03 117.16 112.16 3byz n TYR 280 Ca 0.06 0.37 0.02 0.00 -0.16 0.00 0.00 57.90 58.19 3byz n TYR 280 Cb 0.29 -1.09 0.14 0.00 -0.31 0.00 0.00 39.34 38.38 3byz n TYR 280 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3byz n SER 281 N -2.24 0.00 0.00 7.72 2.88 0.63 -5.09 113.62 117.52 3byz n SER 281 Ca -0.01 -1.14 0.00 0.00 -1.33 0.00 0.00 58.87 56.39 3byz n SER 281 Cb 0.07 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.53 3byz n SER 281 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16