#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bza h VAL 29 N 0.00 1.25 -0.74 -3.33 2.07 -1.99 -1.20 116.25 112.31 1bza h VAL 29 Ca 0.00 -0.97 -0.02 0.00 0.82 0.00 0.00 66.70 66.53 1bza h VAL 29 Cb 0.00 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1bza h VAL 29 CO 0.00 0.34 0.36 1.56 0.02 0.00 0.00 177.57 179.85 1bza h GLN 30 N 0.65 1.04 -0.41 1.57 1.08 -1.99 -1.02 115.11 116.02 1bza h GLN 30 Ca 0.14 -0.14 -0.12 0.00 -1.45 0.00 0.00 58.65 57.08 1bza h GLN 30 Cb 0.43 -0.20 -0.01 0.00 -0.05 0.00 0.00 27.48 27.65 1bza h GLN 30 CO 0.01 0.79 -0.24 1.96 -0.95 0.00 0.00 178.83 180.41 1bza h GLN 31 N 1.04 0.84 -0.67 1.46 4.20 -1.93 -1.28 115.11 118.78 1bza h GLN 31 Ca 0.26 -0.36 -0.08 0.00 0.06 0.00 0.00 58.65 58.53 1bza h GLN 31 Cb 0.09 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 1bza h GLN 31 CO -0.04 0.99 0.11 1.96 -0.67 0.00 0.00 178.83 181.18 1bza h GLN 32 N 0.73 1.11 -0.12 1.46 4.20 -0.42 -1.25 115.11 120.82 1bza h GLN 32 Ca 0.10 -0.30 -0.15 0.00 0.06 0.00 0.00 58.65 58.36 1bza h GLN 32 Cb 0.77 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 1bza h GLN 32 CO 0.06 1.02 -0.55 -0.07 -0.67 0.00 0.00 178.83 178.62 1bza h LEU 33 N 1.03 0.41 -0.43 1.46 3.38 -1.16 -0.95 115.31 119.04 1bza h LEU 33 Ca 0.20 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1bza h LEU 33 Cb 0.44 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1bza h LEU 33 CO 0.01 0.88 0.08 -0.08 0.09 0.00 0.00 178.44 179.42 1bza h GLU 34 N 0.28 0.71 -0.35 1.13 4.81 -0.84 -0.63 114.58 119.70 1bza h GLU 34 Ca 0.00 -0.19 -0.06 0.00 -0.13 0.00 0.00 59.36 58.99 1bza h GLU 34 Cb 1.06 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 1bza h GLU 34 CO 0.09 0.74 -0.01 0.00 -0.73 0.00 0.00 179.01 179.10 1bza h ALA 35 N 0.95 0.47 -0.51 2.92 0.00 -1.08 -0.93 119.26 121.08 1bza h ALA 35 Ca 0.13 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1bza h ALA 35 Cb 0.36 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1bza h ALA 35 CO 0.01 0.24 0.32 1.25 0.00 0.00 0.00 179.25 181.07 1bza h LEU 36 N 0.43 0.60 -0.47 0.00 5.85 -1.06 -0.88 115.31 119.79 1bza h LEU 36 Ca 0.10 -0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 1bza h LEU 36 Cb 0.47 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1bza h LEU 36 CO 0.02 0.46 0.29 -0.08 -0.34 0.00 0.00 178.44 178.80 1bza h GLU 37 N 0.68 0.63 0.06 1.25 4.81 -0.95 -1.78 114.58 119.29 1bza h GLU 37 Ca 0.18 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1bza h GLU 37 Cb -0.03 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.21 1bza h GLU 37 CO -0.04 0.45 -0.03 -0.22 -0.73 0.00 0.00 179.01 178.45 1bza h LYS 38 N 0.63 -0.08 0.00 1.92 3.64 -0.78 -2.83 116.57 119.07 1bza h LYS 38 Ca 0.17 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.49 1bza h LYS 38 Cb -0.03 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 1bza h LYS 38 CO -0.03 0.02 -0.30 0.66 -2.27 0.00 0.00 179.45 177.53 1bza h SER 39 N -0.16 0.00 0.84 4.20 4.64 -1.16 -2.91 113.55 119.00 1bza h SER 39 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1bza h SER 39 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1bza h SER 39 CO 0.01 0.30 0.00 0.77 -0.87 0.00 0.00 176.83 177.04 1bza h SER 40 N 0.00 0.00 0.00 4.97 4.64 -1.08 -3.47 113.55 118.61 1bza h SER 40 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1bza h SER 40 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1bza h SER 40 CO 0.04 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.61 1bza n GLY 41 N -0.15 0.45 0.00 -0.77 0.00 -1.10 -5.01 105.19 98.61 1bza n GLY 41 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1bza n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bza n GLY 42 N -2.25 7.18 3.19 -0.02 0.00 -1.23 -4.50 105.19 107.56 1bza n GLY 42 Ca 0.00 -1.88 -0.34 0.00 0.00 0.00 0.00 46.02 43.80 1bza n GLY 42 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bza s ARG 43 N 1.05 3.11 -0.17 1.61 3.52 0.23 -4.78 118.95 123.52 1bza s ARG 43 Ca 0.00 -0.77 -0.05 0.00 -0.13 0.00 0.00 55.73 54.78 1bza s ARG 43 Cb 0.00 -2.76 -0.03 0.00 -1.56 0.00 0.00 34.95 30.60 1bza s ARG 43 CO 0.00 -0.22 -0.01 -1.17 -0.81 0.00 0.00 175.30 173.08 1bza s LEU 44 N 1.36 3.31 -0.12 -0.88 2.96 -1.26 -1.10 118.68 122.94 1bza s LEU 44 Ca 0.05 -0.14 0.03 0.00 -0.22 0.00 0.00 54.13 53.85 1bza s LEU 44 Cb -0.14 -1.82 0.00 0.00 0.50 0.00 0.00 46.19 44.74 1bza s LEU 44 CO -0.09 0.13 -0.22 -0.83 -1.32 0.00 0.00 176.35 174.02 1bza s GLY 45 N 0.60 1.36 -0.02 7.98 0.00 0.49 -4.47 107.32 113.27 1bza s GLY 45 Ca -0.01 -1.03 0.01 0.00 0.00 0.00 0.00 44.72 43.69 1bza s GLY 45 CO 0.02 -0.16 -0.04 0.14 0.00 0.00 0.00 173.10 173.06 1bza s VAL 46 N 0.59 0.43 -0.15 1.40 1.01 0.53 -0.80 120.40 123.40 1bza s VAL 46 Ca -0.12 -0.15 -0.04 0.00 0.00 0.00 0.00 61.98 61.67 1bza s VAL 46 Cb -0.17 -0.42 0.06 0.00 0.00 0.00 0.00 36.38 35.86 1bza s VAL 46 CO 0.03 0.16 0.13 0.00 0.00 0.00 0.00 175.10 175.43 1bza s ALA 47 N 0.42 0.13 -0.16 5.51 0.00 -0.63 -0.79 121.76 126.24 1bza s ALA 47 Ca -0.05 0.02 -0.04 0.00 0.00 0.00 0.00 51.96 51.90 1bza s ALA 47 Cb -0.08 -1.04 -0.03 0.00 0.00 0.00 0.00 23.12 21.97 1bza s ALA 47 CO -0.00 -1.03 -0.04 -1.17 0.00 0.00 0.00 175.76 173.52 1bza s LEU 48 N 2.22 3.22 -0.22 0.00 0.20 0.05 -1.14 118.68 123.02 1bza s LEU 48 Ca 0.04 -0.15 -0.03 0.00 0.69 0.00 0.00 54.13 54.68 1bza s LEU 48 Cb -0.15 -1.78 0.00 0.00 -0.43 0.00 0.00 46.19 43.83 1bza s LEU 48 CO -0.09 0.16 -0.07 -0.63 -0.29 0.00 0.00 176.35 175.43 1bza s ILE 49 N 0.43 3.10 -0.50 6.68 1.01 0.40 -1.00 121.20 131.32 1bza s ILE 49 Ca -0.04 -0.62 -0.23 0.00 0.00 0.00 0.00 60.65 59.76 1bza s ILE 49 Cb -0.14 -2.42 0.04 0.00 0.01 0.00 0.00 42.46 39.95 1bza s ILE 49 CO 0.03 0.42 0.81 0.21 0.00 0.00 0.00 174.94 176.40 1bza s ASN 50 N 1.43 6.34 0.00 3.58 3.84 0.13 -1.18 114.94 129.08 1bza s ASN 50 Ca 0.05 -0.38 0.19 0.00 0.21 0.00 0.00 52.86 52.93 1bza s ASN 50 Cb -0.14 -2.38 1.00 0.00 -0.55 0.00 0.00 41.25 39.18 1bza s ASN 50 CO -0.05 -1.03 1.58 0.35 -2.79 0.00 0.00 177.10 175.17 1bza n THR 51 N 6.04 0.35 -0.04 -5.21 -2.24 -0.63 0.02 114.28 112.57 1bza n THR 51 Ca 0.00 0.09 -0.02 0.00 -2.27 0.00 0.00 64.05 61.84 1bza n THR 51 Cb 0.47 -0.77 0.22 0.00 -2.10 0.00 0.00 70.33 68.15 1bza n THR 51 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bza h ALA 52 N 2.96 1.21 0.00 6.98 0.00 -1.87 -3.36 119.26 125.18 1bza h ALA 52 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1bza h ALA 52 Cb 0.15 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1bza h ALA 52 CO 0.00 0.51 0.00 -0.40 0.00 0.00 0.00 179.25 179.36 1bza n ASP 53 N -4.23 0.04 -1.96 0.00 5.68 -1.13 -5.01 116.55 109.95 1bza n ASP 53 Ca 0.02 -1.00 -0.20 0.00 -0.50 0.00 0.00 54.79 53.11 1bza n ASP 53 Cb 0.30 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.24 1bza n ASP 53 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1bza n ASN 54 N -0.00 -5.54 -4.84 -1.12 3.02 0.10 -4.99 115.26 101.88 1bza n ASN 54 Ca 0.00 0.18 -0.32 0.00 -0.03 0.00 0.00 54.58 54.41 1bza n ASN 54 Cb 0.26 -4.66 -0.03 0.00 -0.61 0.00 0.00 39.78 34.75 1bza n ASN 54 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1bza s SER 55 N -2.38 6.55 0.12 6.41 1.04 -1.19 -4.81 113.70 119.44 1bza s SER 55 Ca 0.00 1.56 0.06 0.00 0.48 0.00 0.00 55.95 58.05 1bza s SER 55 Cb 0.00 -2.50 -0.04 0.00 0.10 0.00 0.00 66.02 63.58 1bza s SER 55 CO 0.00 -0.64 -0.15 -1.10 0.98 0.00 0.00 173.24 172.33 1bza s GLN 56 N -4.22 1.01 -0.16 4.02 -0.21 -1.26 -0.69 119.66 118.15 1bza s GLN 56 Ca 0.59 -1.21 0.01 0.00 0.02 0.00 0.00 55.36 54.77 1bza s GLN 56 Cb -0.10 -0.93 0.02 0.00 1.00 0.00 0.00 33.01 32.99 1bza s GLN 56 CO 0.34 0.18 -0.20 0.42 -2.12 0.00 0.00 175.29 173.92 1bza s ILE 57 N -1.98 1.98 -0.01 1.08 1.01 -0.17 -4.98 121.20 118.13 1bza s ILE 57 Ca 0.08 -0.90 0.05 0.00 0.00 0.00 0.00 60.65 59.87 1bza s ILE 57 Cb -0.06 -1.79 -0.01 0.00 0.01 0.00 0.00 42.46 40.61 1bza s ILE 57 CO 0.03 0.53 -0.16 -0.76 0.00 0.00 0.00 174.94 174.58 1bza s LEU 59 N 1.18 2.02 -0.18 2.97 1.43 -1.26 -0.77 118.68 124.08 1bza s LEU 59 Ca 0.01 -0.28 -0.04 0.00 -1.03 0.00 0.00 54.13 52.79 1bza s LEU 59 Cb -0.14 -0.81 0.09 0.00 0.03 0.00 0.00 46.19 45.36 1bza s LEU 59 CO -0.09 0.19 0.25 -0.47 0.23 0.00 0.00 176.35 176.45 1bza s TYR 60 N -0.35 -0.38 -1.38 0.29 5.04 0.03 -4.82 117.35 115.78 1bza s TYR 60 Ca 0.06 0.55 -0.12 0.00 -2.44 0.00 0.00 57.07 55.12 1bza s TYR 60 Cb -0.06 -0.21 0.10 0.00 0.35 0.00 0.00 41.96 42.14 1bza s TYR 60 CO -0.01 -0.52 0.57 0.54 -1.34 0.00 0.00 175.55 174.80 1bza n ARG 61 N 5.33 -3.32 0.13 4.97 1.74 -1.26 -0.35 116.66 123.91 1bza n ARG 61 Ca -0.05 0.42 0.12 0.00 -0.77 0.00 0.00 57.85 57.57 1bza n ARG 61 Cb 0.50 -5.13 0.47 0.00 -1.02 0.00 0.00 32.46 27.27 1bza n ARG 61 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1bza n ALA 62 N -3.77 1.87 0.21 7.54 0.00 -1.26 -2.04 120.51 123.06 1bza n ALA 62 Ca 0.02 0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.61 1bza n ALA 62 Cb 0.52 -1.42 0.18 0.00 0.00 0.00 0.00 19.45 18.73 1bza n ALA 62 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1bza n ASP 63 N -2.28 3.18 -4.84 0.00 8.00 -1.26 -0.98 116.55 118.37 1bza n ASP 63 Ca 0.03 -1.92 -0.35 0.00 0.71 0.00 0.00 54.79 53.26 1bza n ASP 63 Cb 0.30 -0.22 -0.06 0.00 -0.02 0.00 0.00 41.12 41.12 1bza n ASP 63 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1bza s GLU 64 N -1.30 4.03 0.27 -1.24 2.02 -0.86 -4.95 118.70 116.68 1bza s GLU 64 Ca 0.33 0.58 -0.29 0.00 0.02 0.00 0.00 54.97 55.61 1bza s GLU 64 Cb 0.19 -2.85 -0.09 0.00 0.10 0.00 0.00 34.13 31.47 1bza s GLU 64 CO 0.26 0.42 0.96 1.03 0.02 0.00 0.00 175.26 177.95 1bza s ARG 65 N -2.12 4.74 0.04 1.61 0.52 -1.26 -4.17 118.95 118.32 1bza s ARG 65 Ca 0.41 1.48 0.05 0.00 -0.52 0.00 0.00 55.73 57.15 1bza s ARG 65 Cb -0.15 -3.12 -0.02 0.00 0.52 0.00 0.00 34.95 32.18 1bza s ARG 65 CO 0.20 0.41 -0.14 -0.06 0.02 0.00 0.00 175.30 175.72 1bza s PHE 66 N -1.31 1.25 0.10 -0.53 0.40 0.01 -4.97 117.98 112.93 1bza s PHE 66 Ca 0.44 -0.37 -0.31 0.00 -0.60 0.00 0.00 56.93 56.10 1bza s PHE 66 Cb -0.25 -0.74 -0.09 0.00 0.51 0.00 0.00 43.02 42.46 1bza s PHE 66 CO 0.31 0.04 1.76 0.00 0.70 0.00 0.00 175.22 178.03 1bza s ALA 67 N -0.90 3.72 0.26 5.36 0.00 -1.26 -2.30 121.76 126.64 1bza s ALA 67 Ca 0.01 1.34 0.03 0.00 0.00 0.00 0.00 51.96 53.35 1bza s ALA 67 Cb -0.08 -3.74 0.35 0.00 0.00 0.00 0.00 23.12 19.65 1bza s ALA 67 CO 0.01 -1.19 1.65 0.52 0.00 0.00 0.00 175.76 176.75 1bza h MET 68 N 8.57 0.36 0.00 0.00 0.00 -1.50 -3.48 114.93 118.88 1bza h MET 68 Ca -0.45 -0.18 0.00 0.00 0.00 0.00 0.00 59.70 59.07 1bza h MET 68 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.81 1bza h MET 68 CO 0.94 0.72 0.00 0.00 0.00 0.00 0.00 176.91 178.57 1bza n SER 70 N 2.35 0.00 0.15 0.00 7.64 -1.26 -2.59 113.62 119.91 1bza n SER 70 Ca 0.00 -0.55 0.13 0.00 1.01 0.00 0.00 58.87 59.45 1bza n SER 70 Cb 0.00 -0.09 0.51 0.00 -1.01 0.00 0.00 64.21 63.62 1bza n SER 70 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1bza h THR 71 N 0.00 0.00 0.00 0.44 1.35 -1.38 -1.95 112.91 111.37 1bza h THR 71 Ca 0.00 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 1bza h THR 71 Cb 0.07 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 1bza h THR 71 CO 0.00 0.00 0.00 0.77 -0.25 0.00 0.00 175.52 176.04 1bza h SER 72 N 0.00 0.00 -0.02 5.36 4.64 -1.68 -2.95 113.55 118.90 1bza h SER 72 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1bza h SER 72 Cb 0.41 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1bza h SER 72 CO 0.00 0.00 0.01 0.11 -0.87 0.00 0.00 176.83 176.08 1bza h LYS 73 N 0.00 0.00 -0.91 4.77 1.57 -1.59 -1.67 116.57 118.74 1bza h LYS 73 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1bza h LYS 73 Cb 0.40 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.66 1bza h LYS 73 CO 0.00 0.00 0.54 0.28 -0.57 0.00 0.00 179.45 179.70 1bza h VAL 74 N 0.00 1.25 -0.06 0.50 2.07 -1.74 -1.23 116.25 117.04 1bza h VAL 74 Ca 0.01 -0.56 -0.18 0.00 0.82 0.00 0.00 66.70 66.79 1bza h VAL 74 Cb 0.04 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 29.77 1bza h VAL 74 CO -0.00 0.27 -0.72 -0.03 0.02 0.00 0.00 177.57 177.11 1bza h MET 75 N 1.26 0.33 -0.38 1.57 1.85 -1.52 -0.56 114.93 117.49 1bza h MET 75 Ca 0.33 -0.27 -0.05 0.00 -0.61 0.00 0.00 59.70 59.09 1bza h MET 75 Cb -0.05 0.06 -0.01 0.00 0.43 0.00 0.00 31.60 32.03 1bza h MET 75 CO -0.06 0.91 0.03 0.00 -0.40 0.00 0.00 176.91 177.39 1bza h ALA 76 N 1.01 0.51 -0.51 0.39 0.00 -1.40 -1.22 119.26 118.04 1bza h ALA 76 Ca -0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1bza h ALA 76 Cb 1.28 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1bza h ALA 76 CO 0.12 0.25 0.23 0.00 0.00 0.00 0.00 179.25 179.85 1bza h ALA 77 N 0.89 0.66 -0.09 0.00 0.00 -1.10 -2.82 119.26 116.80 1bza h ALA 77 Ca 0.11 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1bza h ALA 77 Cb 0.42 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1bza h ALA 77 CO 0.01 0.24 -0.32 0.00 0.00 0.00 0.00 179.25 179.18 1bza h ALA 78 N 1.07 1.29 -0.52 0.00 0.00 -1.06 -1.72 119.26 118.31 1bza h ALA 78 Ca 0.17 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 1bza h ALA 78 Cb 0.15 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1bza h ALA 78 CO -0.02 0.49 -0.02 0.00 0.00 0.00 0.00 179.25 179.70 1bza h ALA 79 N 1.52 0.98 -0.13 0.00 0.00 -0.97 -0.19 119.26 120.46 1bza h ALA 79 Ca 0.02 -0.29 -0.19 0.00 0.00 0.00 0.00 54.91 54.44 1bza h ALA 79 Cb 0.66 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1bza h ALA 79 CO 0.05 0.62 -0.71 0.28 0.00 0.00 0.00 179.25 179.49 1bza h VAL 80 N 0.83 1.33 -0.65 0.00 2.07 -1.30 -2.20 116.25 116.33 1bza h VAL 80 Ca 0.15 -2.01 -0.04 0.00 0.82 0.00 0.00 66.70 65.62 1bza h VAL 80 Cb 0.52 1.99 -0.03 0.00 -1.52 0.00 0.00 31.29 32.25 1bza h VAL 80 CO 0.03 0.62 0.24 -0.07 0.02 0.00 0.00 177.57 178.41 1bza h LEU 81 N 0.41 0.89 -0.66 2.57 3.38 -1.05 -1.26 115.31 119.60 1bza h LEU 81 Ca -0.03 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 1bza h LEU 81 Cb 1.30 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.79 1bza h LEU 81 CO 0.13 0.81 0.34 0.50 0.09 0.00 0.00 178.44 180.31 1bza h LYS 82 N 0.95 0.93 -0.73 1.13 1.63 -0.77 -1.70 116.57 118.01 1bza h LYS 82 Ca 0.22 -0.12 -0.03 0.00 -0.85 0.00 0.00 60.65 59.87 1bza h LYS 82 Cb 0.21 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 31.64 1bza h LYS 82 CO -0.02 0.72 0.35 1.96 -3.45 0.00 0.00 179.45 179.02 1bza h GLN 83 N 0.90 1.04 0.00 1.90 4.20 -0.75 -1.76 115.11 120.63 1bza h GLN 83 Ca 0.23 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1bza h GLN 83 Cb 0.08 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.67 1bza h GLN 83 CO -0.03 0.80 0.00 -1.13 -0.67 0.00 0.00 178.83 177.80 1bza n SER 84 N -4.33 0.48 0.25 1.46 3.41 -0.54 -1.43 113.62 112.91 1bza n SER 84 Ca 0.07 0.69 0.11 0.00 -0.26 0.00 0.00 58.87 59.48 1bza n SER 84 Cb 0.13 -0.76 0.65 0.00 -0.26 0.00 0.00 64.21 63.97 1bza n SER 84 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1bza h GLU 85 N 0.00 0.00 0.00 4.33 5.08 -1.08 -3.08 114.58 119.83 1bza h GLU 85 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1bza h GLU 85 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1bza h GLU 85 CO 0.00 0.16 -0.89 -1.13 -1.00 0.00 0.00 179.01 176.15 1bza n SER 86 N -3.68 1.36 -3.74 1.42 3.41 -0.52 -4.88 113.62 106.98 1bza n SER 86 Ca -0.02 -0.44 -0.29 0.00 -0.26 0.00 0.00 58.87 57.87 1bza n SER 86 Cb 0.28 1.20 -0.16 0.00 -0.26 0.00 0.00 64.21 65.27 1bza n SER 86 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1bza s ASP 87 N -2.46 3.65 0.46 4.04 -1.08 -0.99 -5.00 116.67 115.28 1bza s ASP 87 Ca 0.01 -1.33 0.14 0.00 -0.52 0.00 0.00 52.55 50.85 1bza s ASP 87 Cb 0.07 -0.79 1.08 0.00 -1.46 0.00 0.00 42.92 41.83 1bza s ASP 87 CO 0.42 -0.37 2.04 0.07 0.52 0.00 0.00 175.17 177.85 1bza h LYS 88 N 8.14 0.30 0.00 4.34 2.10 -1.90 -2.55 116.57 126.99 1bza h LYS 88 Ca -0.15 -0.02 -0.13 0.00 -2.00 0.00 0.00 60.65 58.35 1bza h LYS 88 Cb 1.05 -0.07 -0.02 0.00 -0.90 0.00 0.00 32.23 32.30 1bza h LYS 88 CO 0.42 0.20 -0.62 0.45 -2.00 0.00 0.00 179.45 177.90 1bza h HIS 89 N 0.31 0.00 -0.98 0.07 3.86 -1.94 -3.42 115.15 113.05 1bza h HIS 89 Ca 0.18 0.00 0.09 0.00 -1.16 0.00 0.00 60.37 59.49 1bza h HIS 89 Cb 0.33 0.00 -0.12 0.00 1.06 0.00 0.00 27.41 28.69 1bza h HIS 89 CO -0.00 0.62 -0.57 -0.11 0.86 0.00 0.00 177.93 178.73 1bza n LEU 90 N -3.27 -1.02 0.30 2.43 7.94 -0.96 -2.19 117.00 120.23 1bza n LEU 90 Ca 0.01 1.75 0.17 0.00 -1.11 0.00 0.00 56.01 56.83 1bza n LEU 90 Cb 0.78 -0.23 0.92 0.00 0.53 0.00 0.00 43.42 45.42 1bza n LEU 90 CO 0.42 -1.43 1.08 -0.07 -1.11 0.00 0.00 177.39 176.29 1bza h LEU 91 N 0.00 0.00 0.00 -1.96 3.38 -1.81 -1.43 115.31 113.49 1bza h LEU 91 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1bza h LEU 91 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1bza h LEU 91 CO -0.93 0.04 -0.29 0.59 0.09 0.00 0.00 178.44 177.95 1bza n ASN 92 N -3.50 0.52 -4.68 -0.43 3.02 -0.93 -1.27 115.26 107.98 1bza n ASN 92 Ca -0.02 0.26 -0.45 0.00 -0.03 0.00 0.00 54.58 54.33 1bza n ASN 92 Cb 0.15 -0.23 -0.04 0.00 -0.61 0.00 0.00 39.78 39.05 1bza n ASN 92 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1bza n GLN 93 N -1.88 2.37 -3.27 3.52 7.27 -0.54 -4.72 117.38 120.13 1bza n GLN 93 Ca 0.05 0.86 -0.37 0.00 0.07 0.00 0.00 57.00 57.62 1bza n GLN 93 Cb 0.39 -2.69 -0.06 0.00 2.41 0.00 0.00 30.24 30.29 1bza n GLN 93 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1bza s ARG 94 N 2.39 4.12 -0.09 3.69 0.52 -1.26 -1.07 118.95 127.24 1bza s ARG 94 Ca 0.84 0.66 0.04 0.00 -0.52 0.00 0.00 55.73 56.74 1bza s ARG 94 Cb -0.62 -3.03 0.00 0.00 0.52 0.00 0.00 34.95 31.82 1bza s ARG 94 CO 0.42 0.52 -0.20 0.08 0.02 0.00 0.00 175.30 176.13 1bza s VAL 95 N -1.35 1.75 0.19 3.52 1.01 0.89 -4.92 120.40 121.49 1bza s VAL 95 Ca 0.36 -0.84 -0.30 0.00 0.00 0.00 0.00 61.98 61.20 1bza s VAL 95 Cb -0.17 -1.53 -0.08 0.00 0.00 0.00 0.00 36.38 34.61 1bza s VAL 95 CO 0.20 0.49 1.14 -1.61 0.00 0.00 0.00 175.10 175.32 1bza s GLU 96 N 0.41 4.55 -0.35 2.72 2.02 -1.26 -0.79 118.70 126.00 1bza s GLU 96 Ca -0.16 1.79 -0.07 0.00 0.02 0.00 0.00 54.97 56.55 1bza s GLU 96 Cb -0.17 -3.25 0.05 0.00 0.10 0.00 0.00 34.13 30.85 1bza s GLU 96 CO 0.07 0.02 0.12 0.42 0.02 0.00 0.00 175.26 175.91 1bza s ILE 97 N -0.26 3.81 0.29 -1.63 -1.09 -0.58 -4.94 121.20 116.80 1bza s ILE 97 Ca 0.50 -1.20 -0.07 0.00 -2.23 0.00 0.00 60.65 57.66 1bza s ILE 97 Cb -0.31 -3.19 -0.06 0.00 -1.58 0.00 0.00 42.46 37.32 1bza s ILE 97 CO 0.36 -0.23 0.59 -0.54 -1.23 0.00 0.00 174.94 173.89 1bza s LYS 98 N 1.39 3.70 0.51 2.79 -0.14 -1.26 -0.07 119.74 126.66 1bza s LYS 98 Ca -0.01 0.14 0.22 0.00 -1.36 0.00 0.00 55.97 54.96 1bza s LYS 98 Cb -0.20 -2.60 1.31 0.00 -1.68 0.00 0.00 37.83 34.65 1bza s LYS 98 CO 0.02 0.20 2.01 -0.22 -0.76 0.00 0.00 175.35 176.61 1bza h LYS 99 N 1.81 0.08 0.00 1.68 3.64 -1.96 0.12 116.57 121.93 1bza h LYS 99 Ca -0.47 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 58.89 1bza h LYS 99 Cb 1.18 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1bza h LYS 99 CO 0.66 0.05 -0.06 0.66 -2.27 0.00 0.00 179.45 178.50 1bza h SER 100 N 0.08 0.00 0.79 4.20 4.64 -2.03 -2.54 113.55 118.69 1bza h SER 100 Ca 0.22 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.45 1bza h SER 100 Cb 0.78 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.86 1bza h SER 100 CO -0.02 0.06 -0.45 0.44 -0.87 0.00 0.00 176.83 175.99 1bza h ASP 101 N 0.00 0.00 -3.58 4.97 3.32 -1.14 -3.46 116.42 116.53 1bza h ASP 101 Ca -0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 1bza h ASP 101 Cb 0.40 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.97 1bza h ASP 101 CO 0.01 0.45 0.54 -0.76 -1.72 0.00 0.00 179.24 177.75 1bza s LEU 102 N -7.22 4.47 0.00 1.55 1.43 -0.96 -4.82 118.68 113.14 1bza s LEU 102 Ca -0.00 2.25 0.00 0.00 -1.03 0.00 0.00 54.13 55.35 1bza s LEU 102 Cb 0.11 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.72 1bza s LEU 102 CO 0.71 -0.32 0.00 1.33 0.23 0.00 0.00 176.35 178.30 1bza n VAL 103 N 2.13 0.00 -0.07 -1.59 0.24 -1.26 -5.08 118.33 112.69 1bza n VAL 103 Ca 0.03 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.21 1bza n VAL 103 Cb 0.45 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.73 1bza n VAL 103 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1bza h ASN 104 N 0.00 0.00 -3.98 -1.34 -1.07 -1.96 -3.43 115.58 103.80 1bza h ASN 104 Ca 0.00 -0.57 -0.71 0.00 0.07 0.00 0.00 56.30 55.09 1bza h ASN 104 Cb 0.00 0.00 -0.34 0.00 -2.07 0.00 0.00 38.32 35.91 1bza h ASN 104 CO 0.00 0.99 -0.34 -0.47 0.07 0.00 0.00 177.43 177.69 1bza s TYR 105 N -2.12 3.47 -0.46 4.14 5.04 -1.26 -4.94 117.35 121.22 1bza s TYR 105 Ca -0.17 -2.55 0.09 0.00 -2.44 0.00 0.00 57.07 51.99 1bza s TYR 105 Cb 0.00 -3.29 0.32 0.00 0.35 0.00 0.00 41.96 39.34 1bza s TYR 105 CO 0.48 -0.88 0.75 0.09 -1.34 0.00 0.00 175.55 174.65 1bza n ASN 106 N 3.75 2.02 -0.05 4.32 3.02 -1.26 -0.73 115.26 126.32 1bza n ASN 106 Ca 0.06 -3.18 0.11 0.00 -0.03 0.00 0.00 54.58 51.54 1bza n ASN 106 Cb 0.39 -0.61 0.51 0.00 -0.61 0.00 0.00 39.78 39.46 1bza n ASN 106 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1bza h PRO 107 N 3.31 0.38 0.00 3.52 0.13 -1.92 -1.32 132.00 136.10 1bza h PRO 107 Ca 0.11 -0.02 -0.42 0.00 -0.87 0.00 0.00 66.00 64.80 1bza h PRO 107 Cb 0.79 -0.08 -0.07 0.00 0.13 0.00 0.00 31.00 31.77 1bza h PRO 107 CO 0.62 0.25 -2.47 -0.89 -0.23 0.00 0.00 178.00 175.28 1bza n ILE 108 N -4.47 1.52 0.23 -3.56 2.08 -1.26 -4.25 119.36 109.66 1bza n ILE 108 Ca 0.08 -0.48 0.07 0.00 0.56 0.00 0.00 62.75 62.98 1bza n ILE 108 Cb 0.33 -1.66 0.56 0.00 -0.75 0.00 0.00 39.64 38.12 1bza n ILE 108 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1bza h ALA 109 N -0.46 1.69 -0.12 -1.39 0.00 -1.96 -2.16 119.26 114.85 1bza h ALA 109 Ca -0.63 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.12 1bza h ALA 109 Cb 1.76 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.52 1bza h ALA 109 CO -0.24 0.19 -0.05 1.05 0.00 0.00 0.00 179.25 180.19 1bza h GLU 110 N 0.00 0.18 0.00 0.00 4.11 -1.43 -1.24 114.58 116.19 1bza h GLU 110 Ca -0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.40 1bza h GLU 110 Cb 0.27 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1bza h GLU 110 CO 0.02 0.25 0.00 1.63 0.07 0.00 0.00 179.01 180.98 1bza n LYS 111 N -4.37 0.44 -0.07 1.06 5.02 -0.81 -3.71 118.16 115.71 1bza n LYS 111 Ca -0.01 0.04 0.02 0.00 -2.02 0.00 0.00 58.31 56.34 1bza n LYS 111 Cb 0.19 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 33.72 1bza n LYS 111 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1bza n HIS 112 N -1.09 0.00 -1.74 2.13 8.25 -0.47 -5.02 115.22 117.29 1bza n HIS 112 Ca 0.11 -0.36 -0.42 0.00 -0.26 0.00 0.00 57.72 56.79 1bza n HIS 112 Cb 0.08 -0.05 -0.02 0.00 1.12 0.00 0.00 29.99 31.12 1bza n HIS 112 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1bza n VAL 113 N -0.43 0.87 -0.60 1.59 0.31 -1.20 -1.27 118.33 117.59 1bza n VAL 113 Ca 0.02 -0.22 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 1bza n VAL 113 Cb 0.44 -1.93 0.00 0.00 -0.91 0.00 0.00 33.84 31.44 1bza n VAL 113 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1bza n ASN 114 N 2.41 0.00 0.00 4.52 3.02 0.90 -4.96 115.26 121.15 1bza n ASN 114 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 1bza n ASN 114 Cb 0.36 -0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 1bza n ASN 114 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bza n GLY 115 N -2.00 6.43 3.31 7.41 0.00 -0.40 -4.97 105.19 114.98 1bza n GLY 115 Ca 0.00 -2.00 -0.16 0.00 0.00 0.00 0.00 46.02 43.85 1bza n GLY 115 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bza s THR 116 N 1.33 0.62 -0.01 2.61 -4.23 -1.26 -1.53 115.64 113.17 1bza s THR 116 Ca 0.00 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.50 1bza s THR 116 Cb 0.00 -2.57 0.01 0.00 1.34 0.00 0.00 72.50 71.28 1bza s THR 116 CO 0.00 -0.07 0.03 -0.04 -0.54 0.00 0.00 174.62 174.00 1bza s MET 117 N -4.01 0.03 0.76 3.99 -1.94 0.03 -4.91 119.30 113.25 1bza s MET 117 Ca 0.36 0.07 -0.11 0.00 -1.71 0.00 0.00 55.69 54.29 1bza s MET 117 Cb 0.08 -0.02 0.05 0.00 2.01 0.00 0.00 34.83 36.94 1bza s MET 117 CO 0.12 -0.03 1.09 0.95 -0.01 0.00 0.00 175.02 177.15 1bza s THR 118 N 0.18 3.28 0.35 2.05 -4.23 -1.26 -0.07 115.64 115.94 1bza s THR 118 Ca -0.01 0.41 0.03 0.00 -1.18 0.00 0.00 61.69 60.94 1bza s THR 118 Cb -0.02 -3.24 0.27 0.00 1.34 0.00 0.00 72.50 70.85 1bza s THR 118 CO -0.01 -0.54 2.01 -0.07 -0.54 0.00 0.00 174.62 175.47 1bza h LEU 119 N -0.92 0.71 -1.09 4.79 3.38 -0.90 -0.68 115.31 120.59 1bza h LEU 119 Ca -0.46 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.52 1bza h LEU 119 Cb 1.26 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.78 1bza h LEU 119 CO 0.60 0.51 0.62 0.00 0.09 0.00 0.00 178.44 180.26 1bza h ALA 120 N 1.61 1.37 -0.08 1.53 0.00 -1.49 -0.32 119.26 121.88 1bza h ALA 120 Ca 0.24 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 1bza h ALA 120 Cb -0.07 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.36 1bza h ALA 120 CO -0.05 0.56 -0.55 0.93 0.00 0.00 0.00 179.25 180.13 1bza h GLU 121 N 1.22 0.24 -0.38 0.00 5.08 -1.58 -1.43 114.58 117.73 1bza h GLU 121 Ca 0.36 -0.15 -0.12 0.00 -1.00 0.00 0.00 59.36 58.45 1bza h GLU 121 Cb -0.06 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1bza h GLU 121 CO -0.09 0.73 -0.21 -0.07 -1.00 0.00 0.00 179.01 178.37 1bza h LEU 122 N 0.19 0.85 0.17 1.33 3.38 -0.51 -1.01 115.31 119.71 1bza h LEU 122 Ca 0.00 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.55 1bza h LEU 122 Cb 1.03 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1bza h LEU 122 CO 0.09 1.08 -0.13 1.23 0.09 0.00 0.00 178.44 180.79 1bza h GLY 123 N 0.62 -0.30 0.65 0.83 0.00 -0.86 0.41 103.07 104.42 1bza h GLY 123 Ca 0.08 0.15 0.05 0.00 0.00 0.00 0.00 47.33 47.60 1bza h GLY 123 CO 0.06 -0.13 0.12 0.00 0.00 0.00 0.00 176.54 176.58 1bza h ALA 124 N 0.50 0.42 -0.35 3.60 0.00 -1.23 -1.29 119.26 120.93 1bza h ALA 124 Ca -0.01 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1bza h ALA 124 Cb 0.28 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1bza h ALA 124 CO -0.01 -0.28 -0.21 0.00 0.00 0.00 0.00 179.25 178.76 1bza h ALA 125 N 1.25 0.99 -0.54 0.00 0.00 -0.91 0.22 119.26 120.26 1bza h ALA 125 Ca 0.17 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 1bza h ALA 125 Cb 0.16 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1bza h ALA 125 CO -0.18 0.60 0.06 0.00 0.00 0.00 0.00 179.25 179.72 1bza h ALA 126 N 1.19 1.08 0.10 0.00 0.00 -0.56 -2.35 119.26 118.72 1bza h ALA 126 Ca 0.09 -0.25 -0.31 0.00 0.00 0.00 0.00 54.91 54.44 1bza h ALA 126 Cb 0.67 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1bza h ALA 126 CO 0.05 0.59 -1.66 -0.07 0.00 0.00 0.00 179.25 178.16 1bza h LEU 127 N 0.82 0.31 0.00 0.00 3.38 -0.82 -2.75 115.31 116.26 1bza h LEU 127 Ca 0.17 -0.82 -0.04 0.00 0.09 0.00 0.00 57.88 57.28 1bza h LEU 127 Cb 0.41 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1bza h LEU 127 CO 0.01 1.71 -0.34 1.56 0.09 0.00 0.00 178.44 181.48 1bza h GLN 128 N -0.29 0.00 0.00 1.13 4.20 -0.66 -3.33 115.11 116.16 1bza h GLN 128 Ca -0.37 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.34 1bza h GLN 128 Cb 1.79 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.57 1bza h GLN 128 CO 0.01 0.16 0.00 0.66 -0.67 0.00 0.00 178.83 178.99 1bza n TYR 129 N -3.07 0.00 -3.03 2.96 4.02 -0.94 -1.51 117.16 115.58 1bza n TYR 129 Ca 0.02 -0.11 -0.21 0.00 -0.01 0.00 0.00 57.90 57.59 1bza n TYR 129 Cb 0.61 -0.01 0.01 0.00 -0.02 0.00 0.00 39.34 39.93 1bza n TYR 129 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1bza n SER 130 N -0.11 -4.92 -4.69 7.72 2.88 -1.04 -4.86 113.62 108.61 1bza n SER 130 Ca 0.00 -0.24 -0.42 0.00 -1.33 0.00 0.00 58.87 56.88 1bza n SER 130 Cb 0.17 -4.03 -0.03 0.00 -0.75 0.00 0.00 64.21 59.56 1bza n SER 130 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1bza s ASP 131 N -2.58 6.56 0.14 -3.46 -1.08 -0.93 -4.91 116.67 110.42 1bza s ASP 131 Ca 0.28 2.55 0.01 0.00 -0.52 0.00 0.00 52.55 54.86 1bza s ASP 131 Cb -0.14 -2.56 -0.08 0.00 -1.46 0.00 0.00 42.92 38.68 1bza s ASP 131 CO 0.34 -0.92 1.32 0.78 0.52 0.00 0.00 175.17 177.22 1bza h ASN 132 N 8.42 0.30 -0.70 -0.34 2.35 -1.27 -2.61 115.58 121.72 1bza h ASN 132 Ca -0.43 -0.26 -0.06 0.00 -0.55 0.00 0.00 56.30 54.99 1bza h ASN 132 Cb 1.20 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 39.45 1bza h ASN 132 CO 0.93 1.10 0.19 0.74 -1.65 0.00 0.00 177.43 178.74 1bza h THR 133 N 0.11 1.26 -0.61 2.81 2.02 -1.88 -1.04 112.91 115.59 1bza h THR 133 Ca -0.06 -0.93 0.03 0.00 0.77 0.00 0.00 66.41 66.22 1bza h THR 133 Cb 1.61 0.53 -0.04 0.00 -1.74 0.00 0.00 68.15 68.51 1bza h THR 133 CO 0.15 0.36 0.36 0.00 0.37 0.00 0.00 175.52 176.76 1bza h ALA 134 N 1.09 0.79 -0.12 6.16 0.00 -1.86 -0.83 119.26 124.49 1bza h ALA 134 Ca 0.22 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1bza h ALA 134 Cb 0.34 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1bza h ALA 134 CO -0.00 0.08 0.03 1.98 0.00 0.00 0.00 179.25 181.34 1bza h MET 135 N 0.70 0.09 -0.48 0.00 -1.53 -1.24 -1.68 114.93 110.78 1bza h MET 135 Ca 0.25 -0.01 -0.03 0.00 -3.44 0.00 0.00 59.70 56.48 1bza h MET 135 Cb 0.06 -0.02 -0.02 0.00 -0.55 0.00 0.00 31.60 31.07 1bza h MET 135 CO -0.12 0.06 0.19 -0.91 0.14 0.00 0.00 176.91 176.26 1bza h ASN 136 N 0.09 0.62 -0.26 1.39 2.35 -0.81 -0.60 115.58 118.35 1bza h ASN 136 Ca 0.05 -0.07 -0.11 0.00 -0.55 0.00 0.00 56.30 55.63 1bza h ASN 136 Cb 0.04 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 1bza h ASN 136 CO -0.06 0.56 -0.20 0.11 -1.65 0.00 0.00 177.43 176.19 1bza h LYS 137 N 0.68 0.72 -0.30 0.81 1.79 -0.89 0.21 116.57 119.59 1bza h LYS 137 Ca 0.16 -0.27 -0.14 0.00 -2.18 0.00 0.00 60.65 58.22 1bza h LYS 137 Cb 0.14 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.74 1bza h LYS 137 CO -0.02 0.87 -0.39 -0.07 -1.08 0.00 0.00 179.45 178.76 1bza h LEU 138 N 0.64 0.76 -0.41 2.94 3.38 -0.53 -0.20 115.31 121.90 1bza h LEU 138 Ca 0.10 -0.34 -0.14 0.00 0.09 0.00 0.00 57.88 57.58 1bza h LEU 138 Cb 0.68 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1bza h LEU 138 CO 0.05 1.06 -0.29 0.40 0.09 0.00 0.00 178.44 179.75 1bza h ILE 139 N 0.59 1.27 -0.51 1.22 2.04 -0.81 -1.15 117.51 120.16 1bza h ILE 139 Ca 0.05 -1.46 0.04 0.00 1.00 0.00 0.00 64.86 64.49 1bza h ILE 139 Cb 0.93 1.30 -0.04 0.00 -0.74 0.00 0.00 36.82 38.27 1bza h ILE 139 CO 0.08 0.49 0.26 0.00 0.00 0.00 0.00 178.15 178.98 1bza h ALA 140 N 0.80 0.65 0.00 1.87 0.00 -0.83 -0.21 119.26 121.54 1bza h ALA 140 Ca 0.08 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1bza h ALA 140 Cb 0.88 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1bza h ALA 140 CO 0.08 -0.09 -0.06 1.25 0.00 0.00 0.00 179.25 180.43 1bza h HIS 141 N 0.50 -0.15 0.00 0.00 -0.00 -0.83 -2.67 115.15 112.01 1bza h HIS 141 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.60 1bza h HIS 141 Cb 0.13 0.07 0.00 0.00 -0.00 0.00 0.00 27.41 27.61 1bza h HIS 141 CO -0.10 -0.09 0.00 -0.07 -0.00 0.00 0.00 177.93 177.67 1bza h LEU 142 N -0.11 0.00 0.00 0.26 3.38 -0.79 -3.46 115.31 114.59 1bza h LEU 142 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1bza h LEU 142 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1bza h LEU 142 CO -0.06 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.08 1bza n GLY 143 N -0.51 1.00 0.00 0.83 0.00 -0.66 -4.80 105.19 101.05 1bza n GLY 143 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1bza n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bza n GLY 144 N -2.00 2.49 0.40 -0.02 0.00 -0.18 -4.64 105.19 101.24 1bza n GLY 144 Ca 0.00 -1.98 0.20 0.00 0.00 0.00 0.00 46.02 44.23 1bza n GLY 144 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1bza h PRO 145 N 0.00 0.43 -0.21 1.61 0.11 -1.85 -0.52 132.00 131.58 1bza h PRO 145 Ca 0.00 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.05 1bza h PRO 145 Cb 0.00 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.00 1bza h PRO 145 CO 0.00 0.29 -0.03 0.38 -0.21 0.00 0.00 178.00 178.43 1bza h ASP 146 N 0.45 0.28 -0.19 -2.05 2.03 -1.88 -1.97 116.42 113.09 1bza h ASP 146 Ca 0.53 -0.04 -0.09 0.00 -0.73 0.00 0.00 57.03 56.70 1bza h ASP 146 Cb 1.27 -0.07 -0.02 0.00 -0.83 0.00 0.00 39.33 39.68 1bza h ASP 146 CO -0.24 0.36 -0.17 0.11 -1.03 0.00 0.00 179.24 178.27 1bza h LYS 147 N 0.30 0.61 -0.70 4.15 1.79 -1.35 -0.53 116.57 120.84 1bza h LYS 147 Ca 0.07 -0.21 -0.05 0.00 -2.18 0.00 0.00 60.65 58.28 1bza h LYS 147 Cb 0.25 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 30.82 1bza h LYS 147 CO 0.01 0.75 0.25 0.28 -1.08 0.00 0.00 179.45 179.66 1bza h VAL 148 N 0.55 1.25 -0.43 0.50 2.07 -1.40 -0.19 116.25 118.61 1bza h VAL 148 Ca 0.09 -0.84 -0.04 0.00 0.82 0.00 0.00 66.70 66.74 1bza h VAL 148 Cb 0.60 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1bza h VAL 148 CO 0.04 0.33 0.13 0.74 0.02 0.00 0.00 177.57 178.83 1bza h THR 149 N 1.02 1.22 -0.76 2.57 2.02 -1.22 -0.92 112.91 116.85 1bza h THR 149 Ca 0.23 -0.74 -0.01 0.00 0.77 0.00 0.00 66.41 66.66 1bza h THR 149 Cb 0.26 0.89 -0.04 0.00 -1.74 0.00 0.00 68.15 67.53 1bza h THR 149 CO -0.01 0.26 0.42 0.00 0.37 0.00 0.00 175.52 176.56 1bza h ALA 150 N 0.98 1.31 -0.83 6.16 0.00 -0.84 -0.98 119.26 125.07 1bza h ALA 150 Ca 0.14 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1bza h ALA 150 Cb 0.27 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1bza h ALA 150 CO -0.00 0.57 0.53 0.35 0.00 0.00 0.00 179.25 180.69 1bza h PHE 151 N 1.06 1.06 -0.89 0.00 3.57 -0.55 -1.70 116.94 119.50 1bza h PHE 151 Ca 0.27 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 1bza h PHE 151 Cb 0.02 -0.36 -0.04 0.00 2.79 0.00 0.00 35.95 38.36 1bza h PHE 151 CO 0.01 0.69 0.53 0.00 -2.23 0.00 0.00 178.31 177.30 1bza h ALA 152 N 1.29 1.26 -0.16 2.41 0.00 -0.25 -1.66 119.26 122.16 1bza h ALA 152 Ca 0.30 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 1bza h ALA 152 Cb -0.09 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.33 1bza h ALA 152 CO -0.06 0.63 -0.35 0.00 0.00 0.00 0.00 179.25 179.46 1bza h ARG 153 N 1.22 0.33 0.00 0.00 2.47 -0.80 -0.97 114.38 116.63 1bza h ARG 153 Ca 0.32 -0.14 -0.07 0.00 -1.26 0.00 0.00 59.98 58.83 1bza h ARG 153 Cb -0.04 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.26 1bza h ARG 153 CO -0.06 0.64 -0.31 0.66 0.56 0.00 0.00 179.97 181.46 1bza h SER 154 N 0.28 0.00 0.09 7.04 4.64 -0.40 0.50 113.55 125.70 1bza h SER 154 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1bza h SER 154 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 1bza h SER 154 CO 0.06 0.31 0.00 0.18 -0.87 0.00 0.00 176.83 176.51 1bza n LEU 155 N -3.75 0.00 0.00 5.97 4.77 -0.72 -4.88 117.00 118.39 1bza n LEU 155 Ca -0.01 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 1bza n LEU 155 Cb 0.41 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 1bza n LEU 155 CO 0.36 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1bza n GLY 156 N 0.81 0.71 3.54 -0.72 0.00 0.17 -5.02 105.19 104.68 1bza n GLY 156 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 1bza n GLY 156 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bza s ASP 157 N -2.18 6.41 0.00 1.61 -1.08 -0.45 -4.87 116.67 116.11 1bza s ASP 157 Ca 0.00 -0.12 0.26 0.00 -0.52 0.00 0.00 52.55 52.18 1bza s ASP 157 Cb 0.00 -2.39 0.69 0.00 -1.46 0.00 0.00 42.92 39.76 1bza s ASP 157 CO 0.00 -0.95 1.53 -0.62 0.52 0.00 0.00 175.17 175.65 1bza n GLU 158 N 6.81 1.37 -0.13 4.34 -0.58 -1.26 -3.56 120.64 127.61 1bza n GLU 158 Ca 0.03 -0.90 -0.25 0.00 -0.42 0.00 0.00 57.16 55.62 1bza n GLU 158 Cb 0.48 -1.48 -0.11 0.00 -0.57 0.00 0.00 31.44 29.76 1bza n GLU 158 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1bza n THR 159 N -0.03 1.51 -1.62 2.62 -1.04 -1.26 -5.00 114.28 109.47 1bza n THR 159 Ca 0.14 -0.47 -0.46 0.00 -2.04 0.00 0.00 64.05 61.23 1bza n THR 159 Cb 0.40 -1.68 -0.02 0.00 -1.82 0.00 0.00 70.33 67.21 1bza n THR 159 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 1bza n PHE 160 N -3.81 1.58 -3.73 -1.42 -0.00 -1.26 -4.65 117.46 104.17 1bza n PHE 160 Ca -0.51 0.62 -0.13 0.00 -0.00 0.00 0.00 57.45 57.43 1bza n PHE 160 Cb 0.93 -2.32 -0.14 0.00 -0.00 0.00 0.00 39.48 37.95 1bza n PHE 160 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.76 175.78 1bza s ARG 161 N -1.02 0.13 -0.19 -4.13 1.70 -0.91 -4.92 118.95 109.60 1bza s ARG 161 Ca 0.64 0.45 -0.03 0.00 -0.47 0.00 0.00 55.73 56.33 1bza s ARG 161 Cb -0.72 -0.16 -0.01 0.00 -0.57 0.00 0.00 34.95 33.49 1bza s ARG 161 CO 0.56 -0.18 -0.08 -1.17 -1.08 0.00 0.00 175.30 173.36 1bza s LEU 162 N 1.30 2.80 -0.06 -1.89 2.96 -1.26 -3.10 118.68 119.43 1bza s LEU 162 Ca -0.08 -0.39 0.04 0.00 -0.22 0.00 0.00 54.13 53.48 1bza s LEU 162 Cb -0.11 -1.69 -0.06 0.00 0.50 0.00 0.00 46.19 44.83 1bza s LEU 162 CO -0.07 0.03 -0.00 0.47 -1.32 0.00 0.00 176.35 175.46 1bza n ASP 163 N 4.43 3.60 -4.55 3.68 8.00 -1.26 -4.06 116.55 126.39 1bza n ASP 163 Ca -0.18 -0.01 -0.25 0.00 0.71 0.00 0.00 54.79 55.05 1bza n ASP 163 Cb 0.51 0.44 -0.11 0.00 -0.02 0.00 0.00 41.12 41.94 1bza n ASP 163 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1bza s ARG 164 N -2.13 1.84 0.69 -1.24 0.52 -1.26 -4.86 118.95 112.50 1bza s ARG 164 Ca -0.04 -2.03 0.03 0.00 -0.52 0.00 0.00 55.73 53.16 1bza s ARG 164 Cb 0.02 -1.31 0.12 0.00 0.52 0.00 0.00 34.95 34.30 1bza s ARG 164 CO 0.21 -0.11 0.95 0.95 0.02 0.00 0.00 175.30 177.31 1bza s THR 165 N -2.96 2.06 0.27 0.02 -4.23 -1.26 -4.71 115.64 104.83 1bza s THR 165 Ca 0.35 -0.74 -0.24 0.00 -1.18 0.00 0.00 61.69 59.88 1bza s THR 165 Cb 0.09 -2.33 -0.09 0.00 1.34 0.00 0.00 72.50 71.52 1bza s THR 165 CO 0.17 0.00 0.85 0.00 -0.54 0.00 0.00 174.62 175.10 1bza s ALA 166 N -3.01 3.31 -2.45 3.99 0.00 -1.26 -2.04 121.76 120.30 1bza s ALA 166 Ca 0.66 0.38 0.23 0.00 0.00 0.00 0.00 51.96 53.23 1bza s ALA 166 Cb -0.05 -3.03 0.48 0.00 0.00 0.00 0.00 23.12 20.52 1bza s ALA 166 CO 0.43 0.24 1.43 -0.35 0.00 0.00 0.00 175.76 177.51 1bza n PRO 167 N 0.76 2.37 0.16 0.00 -0.04 -1.26 -4.92 135.00 132.07 1bza n PRO 167 Ca -0.00 -2.06 0.13 0.00 -0.04 0.00 0.00 63.50 61.52 1bza n PRO 167 Cb 0.50 -1.49 0.55 0.00 -0.04 0.00 0.00 33.50 33.02 1bza n PRO 167 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1bza h THR 168 N 4.05 0.00 0.00 0.52 1.35 -1.88 -1.43 112.91 115.52 1bza h THR 168 Ca 0.00 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 1bza h THR 168 Cb 0.89 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 68.33 1bza h THR 168 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1bza n LEU 169 N -2.40 0.00 -1.13 3.87 -0.00 -0.87 -2.07 117.00 114.41 1bza n LEU 169 Ca 0.01 0.34 0.09 0.00 -0.00 0.00 0.00 56.01 56.45 1bza n LEU 169 Cb 0.22 -0.34 0.26 0.00 -0.00 0.00 0.00 43.42 43.57 1bza n LEU 169 CO 0.20 -0.28 0.72 0.59 -0.00 0.00 0.00 177.39 178.62 1bza n ASN 170 N -1.34 3.29 0.22 1.45 5.03 -0.54 -4.30 115.26 119.07 1bza n ASN 170 Ca 0.02 -2.11 0.05 0.00 0.87 0.00 0.00 54.58 53.42 1bza n ASN 170 Cb 0.05 -0.42 0.49 0.00 -1.02 0.00 0.00 39.78 38.88 1bza n ASN 170 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 1bza h THR 171 N 3.30 1.09 -6.70 3.41 1.35 -1.63 -1.46 112.91 112.27 1bza h THR 171 Ca 0.00 -0.79 -0.54 0.00 -0.55 0.00 0.00 66.41 64.53 1bza h THR 171 Cb 0.89 1.43 -0.19 0.00 -1.73 0.00 0.00 68.15 68.56 1bza h THR 171 CO 0.06 0.22 -0.84 0.00 -0.25 0.00 0.00 175.52 174.71 1bza n ALA 172 N -2.47 -1.33 -2.11 6.62 0.00 -1.26 -4.26 120.51 115.70 1bza n ALA 172 Ca -0.02 -0.02 -0.42 0.00 0.00 0.00 0.00 53.44 52.98 1bza n ALA 172 Cb 0.29 -3.36 -0.03 0.00 0.00 0.00 0.00 19.45 16.35 1bza n ALA 172 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bza s ILE 173 N -3.36 3.23 -0.09 0.00 1.01 -1.26 -4.71 121.20 116.02 1bza s ILE 173 Ca 0.67 0.82 -0.38 0.00 0.00 0.00 0.00 60.65 61.76 1bza s ILE 173 Cb -0.36 -3.53 -0.16 0.00 0.01 0.00 0.00 42.46 38.42 1bza s ILE 173 CO 0.92 0.04 1.55 -2.65 0.00 0.00 0.00 174.94 174.80 1bza n PRO 174 N 4.44 1.20 -0.27 2.79 -0.02 -1.26 -1.52 135.00 140.35 1bza n PRO 174 Ca 0.13 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1bza n PRO 174 Cb 0.42 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1bza n PRO 174 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bza n GLY 175 N 3.37 2.21 3.70 -1.23 0.00 -1.26 -5.01 105.19 106.97 1bza n GLY 175 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1bza n GLY 175 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bza s ASP 176 N -3.58 7.15 0.23 1.61 -1.08 -0.58 -4.93 116.67 115.50 1bza s ASP 176 Ca 0.00 1.79 0.26 0.00 -0.52 0.00 0.00 52.55 54.08 1bza s ASP 176 Cb 0.00 -2.57 0.82 0.00 -1.46 0.00 0.00 42.92 39.71 1bza s ASP 176 CO 0.00 -0.47 1.76 1.55 0.52 0.00 0.00 175.17 178.53 1bza h PRO 177 N 7.11 0.00 -6.85 4.34 0.13 -1.95 -3.47 132.00 131.32 1bza h PRO 177 Ca -0.37 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.23 1bza h PRO 177 Cb 1.18 0.00 0.08 0.00 0.13 0.00 0.00 31.00 32.39 1bza h PRO 177 CO 0.83 0.00 0.75 1.03 -0.23 0.00 0.00 178.00 180.38 1bza s ARG 178 N -3.15 4.23 -1.44 0.86 0.52 -1.26 -3.28 118.95 115.43 1bza s ARG 178 Ca 0.09 2.39 -0.09 0.00 -0.52 0.00 0.00 55.73 57.60 1bza s ARG 178 Cb 0.11 -3.05 0.05 0.00 0.52 0.00 0.00 34.95 32.59 1bza s ARG 178 CO 0.57 -0.42 0.93 -0.25 0.02 0.00 0.00 175.30 176.15 1bza n ASP 179 N 1.36 -3.90 -4.45 0.23 8.00 -1.18 -4.89 116.55 111.72 1bza n ASP 179 Ca 0.03 -0.76 -0.22 0.00 0.71 0.00 0.00 54.79 54.55 1bza n ASP 179 Cb 0.40 -4.09 -0.10 0.00 -0.02 0.00 0.00 41.12 37.30 1bza n ASP 179 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1bza s THR 180 N -3.41 1.79 0.39 -3.53 -4.23 -1.18 -1.25 115.64 104.23 1bza s THR 180 Ca 0.45 -2.15 -0.13 0.00 -1.18 0.00 0.00 61.69 58.68 1bza s THR 180 Cb -0.22 -2.47 0.05 0.00 1.34 0.00 0.00 72.50 71.20 1bza s THR 180 CO 0.81 -0.29 0.75 0.28 -0.54 0.00 0.00 174.62 175.63 1bza s THR 181 N -2.91 0.00 0.20 3.99 -1.32 -0.97 -2.15 115.64 112.47 1bza s THR 181 Ca 0.30 -1.09 0.06 0.00 -1.21 0.00 0.00 61.69 59.75 1bza s THR 181 Cb 0.03 -2.94 -0.04 0.00 -1.51 0.00 0.00 72.50 68.05 1bza s THR 181 CO 0.13 0.00 0.12 0.42 -2.21 0.00 0.00 174.62 173.07 1bza s THR 182 N -2.24 4.26 0.28 5.08 -4.23 -1.26 -0.81 115.64 116.71 1bza s THR 182 Ca 0.18 -1.30 0.02 0.00 -1.18 0.00 0.00 61.69 59.41 1bza s THR 182 Cb -0.04 -3.21 0.28 0.00 1.34 0.00 0.00 72.50 70.87 1bza s THR 182 CO 0.13 -0.19 1.82 -0.65 -0.54 0.00 0.00 174.62 175.19 1bza h PRO 183 N 2.17 0.90 -0.22 3.99 0.11 -1.70 -1.83 132.00 135.42 1bza h PRO 183 Ca -0.47 -0.05 -0.21 0.00 0.11 0.00 0.00 66.00 65.37 1bza h PRO 183 Cb 1.21 -0.20 0.01 0.00 0.11 0.00 0.00 31.00 32.13 1bza h PRO 183 CO 0.61 0.59 -0.67 1.25 -0.21 0.00 0.00 178.00 179.58 1bza h LEU 184 N 0.92 0.96 -0.52 2.35 5.85 -1.38 -0.79 115.31 122.70 1bza h LEU 184 Ca 0.51 -0.58 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 1bza h LEU 184 Cb 0.58 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1bza h LEU 184 CO -0.29 1.38 0.23 0.00 -0.34 0.00 0.00 178.44 179.42 1bza h ALA 185 N 0.62 0.67 -0.18 1.25 0.00 -1.73 -1.06 119.26 118.83 1bza h ALA 185 Ca -0.02 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.61 1bza h ALA 185 Cb 1.29 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1bza h ALA 185 CO 0.14 0.25 -0.52 1.98 0.00 0.00 0.00 179.25 181.10 1bza h MET 186 N 0.69 0.50 -0.57 0.00 1.85 -1.28 -1.57 114.93 114.55 1bza h MET 186 Ca 0.18 -0.30 -0.05 0.00 -0.61 0.00 0.00 59.70 58.91 1bza h MET 186 Cb 0.14 0.03 -0.02 0.00 0.43 0.00 0.00 31.60 32.18 1bza h MET 186 CO -0.02 0.90 0.15 0.00 -0.40 0.00 0.00 176.91 177.54 1bza h ALA 187 N 1.05 0.74 -0.21 0.39 0.00 -0.82 0.83 119.26 121.24 1bza h ALA 187 Ca 0.01 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1bza h ALA 187 Cb 1.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1bza h ALA 187 CO 0.09 0.44 0.10 1.96 0.00 0.00 0.00 179.25 181.84 1bza h GLN 188 N 0.80 0.30 -0.62 0.00 4.20 -1.10 -1.26 115.11 117.44 1bza h GLN 188 Ca 0.18 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.75 1bza h GLN 188 Cb 0.33 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 1bza h GLN 188 CO -0.00 0.32 0.01 1.15 -0.67 0.00 0.00 178.83 179.64 1bza h THR 189 N 0.22 1.27 -0.45 -0.54 2.02 -1.23 -0.90 112.91 113.29 1bza h THR 189 Ca 0.07 -1.15 -0.06 0.00 0.77 0.00 0.00 66.41 66.05 1bza h THR 189 Cb 0.11 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 1bza h THR 189 CO -0.01 0.42 0.05 0.25 0.37 0.00 0.00 175.52 176.60 1bza h LEU 190 N 0.99 0.66 -0.23 2.58 5.85 -0.67 -0.85 115.31 123.63 1bza h LEU 190 Ca 0.18 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 1bza h LEU 190 Cb 0.55 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 1bza h LEU 190 CO 0.03 0.70 0.07 0.50 -0.34 0.00 0.00 178.44 179.40 1bza h LYS 191 N 0.67 0.36 -0.50 1.25 3.11 -0.93 -0.88 116.57 119.64 1bza h LYS 191 Ca 0.14 -0.08 -0.05 0.00 -2.81 0.00 0.00 60.65 57.85 1bza h LYS 191 Cb 0.35 -0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 31.50 1bza h LYS 191 CO 0.01 0.46 0.11 -0.91 -2.81 0.00 0.00 179.45 176.31 1bza h ASN 192 N 0.20 0.71 -0.34 4.20 2.35 -0.87 0.15 115.58 121.99 1bza h ASN 192 Ca 0.07 -0.12 -0.17 0.00 -0.55 0.00 0.00 56.30 55.53 1bza h ASN 192 Cb 0.25 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 1bza h ASN 192 CO -0.00 0.71 -0.44 -0.07 -1.65 0.00 0.00 177.43 175.98 1bza h LEU 193 N 0.74 0.99 0.00 1.61 3.38 -0.96 -2.32 115.31 118.75 1bza h LEU 193 Ca 0.16 -0.48 -0.22 0.00 0.09 0.00 0.00 57.88 57.44 1bza h LEU 193 Cb 0.29 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1bza h LEU 193 CO -0.00 1.28 -2.22 0.35 0.09 0.00 0.00 178.44 177.94 1bza n THR 194 N -4.04 0.82 -0.17 0.22 -2.24 -0.35 -4.60 114.28 103.92 1bza n THR 194 Ca -0.03 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 1bza n THR 194 Cb 0.57 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 1bza n THR 194 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1bza n LEU 195 N -2.55 0.21 0.00 3.22 4.77 0.46 -4.91 117.00 118.19 1bza n LEU 195 Ca -0.21 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.39 1bza n LEU 195 Cb 0.92 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.01 1bza n LEU 195 CO 0.44 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1bza n GLY 196 N 0.35 5.22 0.03 -0.72 0.00 -0.70 -4.95 105.19 104.42 1bza n GLY 196 Ca 0.00 -1.57 0.14 0.00 0.00 0.00 0.00 46.02 44.59 1bza n GLY 196 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bza n LYS 197 N 0.00 0.08 -0.20 1.61 5.02 -1.15 -4.47 118.16 119.05 1bza n LYS 197 Ca 0.00 0.06 -0.07 0.00 -2.02 0.00 0.00 58.31 56.28 1bza n LYS 197 Cb 0.00 -1.59 0.03 0.00 -0.02 0.00 0.00 35.03 33.45 1bza n LYS 197 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bza h ALA 198 N 2.86 0.74 -3.96 7.82 0.00 -1.75 -3.44 119.26 121.53 1bza h ALA 198 Ca 0.00 -0.11 -0.68 0.00 0.00 0.00 0.00 54.91 54.12 1bza h ALA 198 Cb 0.57 -0.23 -0.23 0.00 0.00 0.00 0.00 17.79 17.91 1bza h ALA 198 CO 0.00 0.27 -0.87 -0.51 0.00 0.00 0.00 179.25 178.14 1bza s LEU 199 N -9.93 2.29 0.84 0.00 1.43 -1.26 -5.03 118.68 107.02 1bza s LEU 199 Ca -0.13 -0.72 -0.10 0.00 -1.03 0.00 0.00 54.13 52.15 1bza s LEU 199 Cb 0.13 -1.20 0.10 0.00 0.03 0.00 0.00 46.19 45.24 1bza s LEU 199 CO 0.77 0.18 1.12 0.00 0.23 0.00 0.00 176.35 178.66 1bza s ALA 200 N -1.02 1.87 0.18 4.21 0.00 -1.26 -4.51 121.76 121.22 1bza s ALA 200 Ca 0.13 0.45 -0.13 0.00 0.00 0.00 0.00 51.96 52.41 1bza s ALA 200 Cb -0.10 -3.37 0.15 0.00 0.00 0.00 0.00 23.12 19.80 1bza s ALA 200 CO 0.05 -2.26 1.76 1.49 0.00 0.00 0.00 175.76 176.81 1bza h GLU 201 N -1.46 0.39 -0.81 0.00 4.57 -1.98 0.28 114.58 115.57 1bza h GLU 201 Ca -0.43 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 57.73 1bza h GLU 201 Cb 1.25 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 29.71 1bza h GLU 201 CO 0.46 0.26 0.53 1.15 -1.18 0.00 0.00 179.01 180.24 1bza h THR 202 N 0.41 1.20 -0.24 0.32 2.02 -1.99 -0.00 112.91 114.63 1bza h THR 202 Ca 0.23 -0.37 -0.07 0.00 0.77 0.00 0.00 66.41 66.96 1bza h THR 202 Cb 0.20 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.62 1bza h THR 202 CO -0.20 0.20 -0.13 1.56 0.37 0.00 0.00 175.52 177.32 1bza h GLN 203 N 1.09 0.51 -0.22 6.66 7.50 -1.69 -1.47 115.11 127.49 1bza h GLN 203 Ca 0.30 -0.23 0.04 0.00 0.50 0.00 0.00 58.65 59.26 1bza h GLN 203 Cb -0.12 -0.01 -0.03 0.00 0.05 0.00 0.00 27.48 27.36 1bza h GLN 203 CO -0.07 0.78 -0.01 -0.09 -1.50 0.00 0.00 178.83 177.95 1bza h ARG 204 N 0.23 0.06 -0.82 1.46 2.43 -0.79 -0.95 114.38 116.01 1bza h ARG 204 Ca 0.05 -0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.28 1bza h ARG 204 Cb 0.63 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.11 1bza h ARG 204 CO 0.04 0.04 0.49 0.00 -1.51 0.00 0.00 179.97 179.03 1bza h ALA 205 N 1.19 1.12 -0.25 2.80 0.00 -0.98 -1.74 119.26 121.40 1bza h ALA 205 Ca 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1bza h ALA 205 Cb 0.13 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1bza h ALA 205 CO -0.18 0.21 0.08 0.37 0.00 0.00 0.00 179.25 179.73 1bza h GLN 206 N 0.89 0.38 -0.64 0.00 5.75 -0.77 -1.25 115.11 119.47 1bza h GLN 206 Ca 0.36 -0.08 0.06 0.00 -0.15 0.00 0.00 58.65 58.85 1bza h GLN 206 Cb 0.20 -0.06 -0.06 0.00 1.07 0.00 0.00 27.48 28.64 1bza h GLN 206 CO -0.18 0.45 0.33 1.25 -2.65 0.00 0.00 178.83 178.03 1bza h LEU 207 N 0.23 0.48 -0.87 -2.39 5.85 -0.98 -1.20 115.31 116.43 1bza h LEU 207 Ca 0.08 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 1bza h LEU 207 Cb 0.23 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 1bza h LEU 207 CO -0.00 0.30 0.27 0.58 -0.34 0.00 0.00 178.44 179.25 1bza h VAL 208 N 0.61 1.25 -0.45 1.05 2.07 -1.11 -0.79 116.25 118.89 1bza h VAL 208 Ca 0.29 -0.82 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 1bza h VAL 208 Cb 0.22 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1bza h VAL 208 CO -0.20 0.33 0.20 0.74 0.02 0.00 0.00 177.57 178.66 1bza h THR 209 N 1.06 1.19 -0.58 2.57 2.02 -0.76 -0.80 112.91 117.61 1bza h THR 209 Ca 0.24 -0.58 -0.01 0.00 0.77 0.00 0.00 66.41 66.83 1bza h THR 209 Cb 0.24 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 1bza h THR 209 CO -0.02 0.22 0.32 -0.50 0.37 0.00 0.00 175.52 175.91 1bza h TRP 210 N 0.58 0.80 -0.61 3.16 6.55 -0.84 -1.93 115.95 123.66 1bza h TRP 210 Ca 0.15 -0.02 -0.08 0.00 0.95 0.00 0.00 58.89 59.89 1bza h TRP 210 Cb 0.16 -0.26 -0.02 0.00 -0.86 0.00 0.00 29.16 28.18 1bza h TRP 210 CO -0.00 0.58 0.07 -0.07 -1.05 0.00 0.00 178.44 177.97 1bza h LEU 211 N 0.78 0.99 -1.91 -4.49 3.38 -0.85 -2.10 115.31 111.12 1bza h LEU 211 Ca 0.20 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1bza h LEU 211 Cb 0.05 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 1bza h LEU 211 CO -0.03 1.02 -0.12 0.11 0.09 0.00 0.00 178.44 179.51 1bza h LYS 212 N 0.93 0.00 -0.17 1.13 1.57 -1.03 -2.23 116.57 116.76 1bza h LYS 212 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1bza h LYS 212 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1bza h LYS 212 CO 0.02 0.12 0.00 0.41 -0.57 0.00 0.00 179.45 179.43 1bza n GLY 213 N -0.74 0.06 3.62 3.86 0.00 -0.74 -4.87 105.19 106.38 1bza n GLY 213 Ca -0.02 -0.32 -0.47 0.00 0.00 0.00 0.00 46.02 45.21 1bza n GLY 213 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1bza n ASN 214 N 0.12 1.98 -0.00 1.61 5.15 -0.88 -4.85 115.26 118.39 1bza n ASN 214 Ca 0.13 1.14 0.07 0.00 -0.60 0.00 0.00 54.58 55.33 1bza n ASN 214 Cb 0.25 -1.31 -0.09 0.00 -0.53 0.00 0.00 39.78 38.10 1bza n ASN 214 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1bza n THR 215 N 1.67 0.00 1.11 -0.44 -2.24 -0.57 -4.58 114.28 109.23 1bza n THR 215 Ca 0.13 -0.16 0.12 0.00 -2.27 0.00 0.00 64.05 61.87 1bza n THR 215 Cb 0.28 0.97 0.17 0.00 -2.10 0.00 0.00 70.33 69.64 1bza n THR 215 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1bza n THR 216 N -1.38 0.00 -0.55 4.28 -2.24 -1.26 -4.56 114.28 108.58 1bza n THR 216 Ca 0.03 -0.20 0.10 0.00 -2.27 0.00 0.00 64.05 61.71 1bza n THR 216 Cb 0.24 0.86 0.35 0.00 -2.10 0.00 0.00 70.33 69.67 1bza n THR 216 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bza n GLY 217 N 1.38 2.69 0.31 3.38 0.00 -1.26 -4.69 105.19 106.99 1bza n GLY 217 Ca 0.11 -0.84 0.01 0.00 0.00 0.00 0.00 46.02 45.30 1bza n GLY 217 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1bza h SER 218 N 4.15 0.63 0.24 1.61 0.02 -1.92 -2.43 113.55 115.85 1bza h SER 218 Ca 0.00 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1bza h SER 218 Cb 1.31 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.69 1bza h SER 218 CO 0.16 0.56 -0.22 0.00 -1.14 0.00 0.00 176.83 176.19 1bza n ALA 219 N -2.46 3.00 -1.84 3.77 0.00 -1.26 -3.17 120.51 118.55 1bza n ALA 219 Ca 0.04 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1bza n ALA 219 Cb 0.14 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1bza n ALA 219 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1bza n SER 220 N -0.64 0.00 -0.27 0.00 7.64 -0.91 -4.14 113.62 115.30 1bza n SER 220 Ca 0.13 0.00 0.08 0.00 1.01 0.00 0.00 58.87 60.09 1bza n SER 220 Cb 0.34 0.00 0.22 0.00 -1.01 0.00 0.00 64.21 63.75 1bza n SER 220 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1bza h ILE 221 N 0.00 0.51 -0.96 0.44 2.04 -1.78 -1.11 117.51 116.65 1bza h ILE 221 Ca 0.00 -0.11 0.22 0.00 1.00 0.00 0.00 64.86 65.97 1bza h ILE 221 Cb 0.00 0.16 -0.08 0.00 -0.74 0.00 0.00 36.82 36.16 1bza h ILE 221 CO 0.00 0.06 0.62 0.03 0.00 0.00 0.00 178.15 178.86 1bza h ARG 222 N 0.32 0.44 0.00 2.37 3.08 -1.81 -0.88 114.38 117.90 1bza h ARG 222 Ca 0.46 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.48 1bza h ARG 222 Cb 0.80 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.75 1bza h ARG 222 CO -0.51 0.29 0.00 0.00 -1.07 0.00 0.00 179.97 178.68 1bza h ALA 223 N 1.61 1.00 -0.16 0.04 0.00 -1.15 -2.55 119.26 118.06 1bza h ALA 223 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1bza h ALA 223 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1bza h ALA 223 CO -0.23 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.43 1bza n GLY 224 N 0.24 0.99 3.76 0.00 0.00 -0.34 -4.99 105.19 104.85 1bza n GLY 224 Ca 0.02 -0.63 -0.23 0.00 0.00 0.00 0.00 46.02 45.17 1bza n GLY 224 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bza s LEU 225 N -1.78 3.60 0.22 0.99 1.43 -0.96 -3.54 118.68 118.64 1bza s LEU 225 Ca 0.34 -0.36 -0.32 0.00 -1.03 0.00 0.00 54.13 52.76 1bza s LEU 225 Cb 0.21 -2.14 -0.14 0.00 0.03 0.00 0.00 46.19 44.14 1bza s LEU 225 CO 0.31 -0.01 1.32 -2.65 0.23 0.00 0.00 176.35 175.55 1bza n PRO 226 N -0.93 1.74 0.27 1.29 -0.02 -1.26 -4.87 135.00 131.22 1bza n PRO 226 Ca -0.08 0.62 0.12 0.00 -2.02 0.00 0.00 63.50 62.14 1bza n PRO 226 Cb 0.58 -2.22 0.78 0.00 -0.02 0.00 0.00 33.50 32.61 1bza n PRO 226 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1bza h LYS 227 N 3.88 0.00 0.00 -0.52 1.57 -1.99 -2.11 116.57 117.41 1bza h LYS 227 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1bza h LYS 227 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1bza h LYS 227 CO 0.73 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 180.27 1bza h SER 228 N 0.00 0.00 -3.88 0.86 4.64 -2.01 -3.45 113.55 109.71 1bza h SER 228 Ca 0.01 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.83 1bza h SER 228 Cb 0.03 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.14 1bza h SER 228 CO -0.00 0.00 0.46 0.26 -0.87 0.00 0.00 176.83 176.68 1bza s TRP 229 N -3.44 3.40 -0.09 4.77 0.52 -0.79 -4.78 118.94 118.53 1bza s TRP 229 Ca 0.04 1.66 -0.18 0.00 0.02 0.00 0.00 56.10 57.65 1bza s TRP 229 Cb 0.09 -3.24 -0.05 0.00 -1.15 0.00 0.00 33.47 29.12 1bza s TRP 229 CO 0.54 -0.67 0.46 0.08 0.02 0.00 0.00 176.95 177.38 1bza s VAL 230 N -1.37 5.15 -0.04 4.03 1.01 -1.11 -4.94 120.40 123.12 1bza s VAL 230 Ca 0.51 0.93 0.03 0.00 0.00 0.00 0.00 61.98 63.45 1bza s VAL 230 Cb -0.28 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.30 1bza s VAL 230 CO 0.36 0.38 -0.13 -0.69 0.00 0.00 0.00 175.10 175.01 1bza s VAL 231 N 0.28 1.15 -0.13 2.92 1.01 -1.26 -0.23 120.40 124.13 1bza s VAL 231 Ca 0.25 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.67 1bza s VAL 231 Cb -0.15 -1.01 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 1bza s VAL 231 CO 0.11 0.34 -0.10 -0.83 0.00 0.00 0.00 175.10 174.62 1bza s GLY 232 N 0.19 1.60 0.16 4.51 0.00 -0.20 -4.34 107.32 109.24 1bza s GLY 232 Ca -0.05 -0.87 -0.08 0.00 0.00 0.00 0.00 44.72 43.71 1bza s GLY 232 CO 0.02 -0.22 0.26 0.51 0.00 0.00 0.00 173.10 173.66 1bza s ASP 233 N 0.20 0.07 -0.11 1.64 -4.77 -0.94 -0.91 116.67 111.85 1bza s ASP 233 Ca -0.06 -0.89 -0.01 0.00 -3.30 0.00 0.00 52.55 48.29 1bza s ASP 233 Cb -0.15 0.42 0.03 0.00 -1.09 0.00 0.00 42.92 42.14 1bza s ASP 233 CO 0.04 -0.87 -0.01 -0.75 0.70 0.00 0.00 175.17 174.28 1bza s LYS 234 N -3.97 0.85 0.61 2.11 2.47 0.17 -4.70 119.74 117.28 1bza s LYS 234 Ca 0.17 -0.11 -0.09 0.00 -1.56 0.00 0.00 55.97 54.38 1bza s LYS 234 Cb 0.04 -1.38 -0.02 0.00 -1.46 0.00 0.00 37.83 35.01 1bza s LYS 234 CO -0.00 -0.37 0.99 0.95 0.16 0.00 0.00 175.35 177.07 1bza s THR 235 N 1.88 4.26 -0.05 3.43 -4.23 -1.26 -1.43 115.64 118.24 1bza s THR 235 Ca 0.04 0.52 -0.12 0.00 -1.18 0.00 0.00 61.69 60.94 1bza s THR 235 Cb -0.13 -3.70 0.02 0.00 1.34 0.00 0.00 72.50 70.03 1bza s THR 235 CO -0.06 -0.85 0.28 -0.83 -0.54 0.00 0.00 174.62 172.61 1bza s GLY 236 N -4.23 -0.15 0.07 3.99 0.00 -0.28 -3.28 107.32 103.42 1bza s GLY 236 Ca 0.54 0.45 -0.11 0.00 0.00 0.00 0.00 44.72 45.60 1bza s GLY 236 CO 0.50 0.28 0.24 -1.35 0.00 0.00 0.00 173.10 172.77 1bza s SER 237 N -0.81 0.00 0.00 1.64 1.04 -1.26 -0.66 113.70 113.65 1bza s SER 237 Ca -0.09 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 55.92 1bza s SER 237 Cb -0.04 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.41 1bza s SER 237 CO 0.03 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.20 1bza n GLY 238 N 0.31 2.26 3.62 7.32 0.00 -0.42 -4.52 105.19 113.75 1bza n GLY 238 Ca -0.17 -0.80 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 1bza n GLY 238 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bza s ASP 240 N 1.05 1.96 -1.55 1.61 1.01 -0.55 -2.87 116.67 117.32 1bza s ASP 240 Ca 0.00 1.19 -0.04 0.00 0.71 0.00 0.00 52.55 54.41 1bza s ASP 240 Cb 0.00 -1.86 0.01 0.00 1.01 0.00 0.00 42.92 42.08 1bza s ASP 240 CO 0.00 -3.55 0.44 -1.22 0.21 0.00 0.00 175.17 171.06 1bza n TYR 241 N -4.45 -1.73 -3.23 4.23 4.01 -0.24 -1.87 117.16 113.88 1bza n TYR 241 Ca 0.05 0.38 -0.22 0.00 -0.16 0.00 0.00 57.90 57.96 1bza n TYR 241 Cb 0.57 -4.15 -0.00 0.00 -0.31 0.00 0.00 39.34 35.45 1bza n TYR 241 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1bza n GLY 242 N -1.35 -0.49 3.67 2.72 0.00 -1.21 -0.41 105.19 108.13 1bza n GLY 242 Ca -0.13 0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 1bza n GLY 242 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bza s THR 243 N -2.90 3.81 -0.20 2.61 2.01 -0.78 -4.40 115.64 115.78 1bza s THR 243 Ca 0.34 1.07 -0.02 0.00 0.31 0.00 0.00 61.69 63.40 1bza s THR 243 Cb -0.18 -3.69 0.06 0.00 0.01 0.00 0.00 72.50 68.70 1bza s THR 243 CO 0.42 -0.06 0.00 -0.89 -0.69 0.00 0.00 174.62 173.40 1bza s THR 244 N 3.28 0.88 0.19 -0.82 2.01 0.50 -1.30 115.64 120.38 1bza s THR 244 Ca 0.65 -0.76 0.09 0.00 0.31 0.00 0.00 61.69 61.97 1bza s THR 244 Cb -0.30 -1.28 -0.04 0.00 0.01 0.00 0.00 72.50 70.89 1bza s THR 244 CO 0.24 -0.15 -0.18 0.20 -0.69 0.00 0.00 174.62 174.05 1bza s ASN 245 N 1.70 2.76 -0.28 3.53 0.01 0.17 -1.87 114.94 120.97 1bza s ASN 245 Ca -0.02 -0.92 -0.21 0.00 -0.71 0.00 0.00 52.86 51.00 1bza s ASN 245 Cb -0.17 -0.17 0.08 0.00 0.41 0.00 0.00 41.25 41.40 1bza s ASN 245 CO -0.07 -0.06 0.75 -0.62 -1.51 0.00 0.00 177.10 175.59 1bza s ASP 246 N -2.93 -0.79 -0.06 -1.22 2.15 -0.06 -1.13 116.67 112.63 1bza s ASP 246 Ca 0.19 1.39 0.05 0.00 0.43 0.00 0.00 52.55 54.61 1bza s ASP 246 Cb -0.04 1.37 -0.01 0.00 -0.30 0.00 0.00 42.92 43.94 1bza s ASP 246 CO 0.08 -0.23 -0.22 0.27 -0.17 0.00 0.00 175.17 174.89 1bza s ILE 247 N 0.97 1.85 -0.00 4.11 -4.36 -0.51 -1.13 121.20 122.12 1bza s ILE 247 Ca -0.05 -0.94 -0.02 0.00 -0.26 0.00 0.00 60.65 59.38 1bza s ILE 247 Cb -0.05 -1.57 -0.00 0.00 1.25 0.00 0.00 42.46 42.09 1bza s ILE 247 CO -0.10 0.52 0.04 0.00 0.24 0.00 0.00 174.94 175.64 1bza s ALA 248 N -0.03 -0.07 -0.16 2.27 0.00 0.55 -0.66 121.76 123.66 1bza s ALA 248 Ca -0.06 -0.13 -0.05 0.00 0.00 0.00 0.00 51.96 51.73 1bza s ALA 248 Cb -0.14 0.02 -0.03 0.00 0.00 0.00 0.00 23.12 22.97 1bza s ALA 248 CO 0.04 -0.09 -0.00 0.08 0.00 0.00 0.00 175.76 175.78 1bza s VAL 249 N -0.63 4.20 -0.12 0.00 1.01 -0.09 -1.09 120.40 123.68 1bza s VAL 249 Ca -0.07 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 61.69 1bza s VAL 249 Cb -0.04 -2.85 0.01 0.00 0.00 0.00 0.00 36.38 33.49 1bza s VAL 249 CO -0.00 0.49 -0.21 -0.63 0.00 0.00 0.00 175.10 174.75 1bza s ILE 250 N 0.28 1.92 -0.76 2.22 1.01 0.10 -1.03 121.20 124.94 1bza s ILE 250 Ca -0.01 -0.91 -0.05 0.00 0.00 0.00 0.00 60.65 59.68 1bza s ILE 250 Cb -0.13 -1.70 0.19 0.00 0.01 0.00 0.00 42.46 40.83 1bza s ILE 250 CO 0.02 0.52 0.63 0.26 0.00 0.00 0.00 174.94 176.37 1bza s TRP 251 N 0.72 3.65 0.98 3.97 0.51 0.67 -1.04 118.94 128.40 1bza s TRP 251 Ca -0.10 -2.69 -0.11 0.00 -2.12 0.00 0.00 56.10 51.08 1bza s TRP 251 Cb -0.16 -3.35 0.15 0.00 -0.81 0.00 0.00 33.47 29.31 1bza s TRP 251 CO 0.01 -0.84 0.96 -2.30 -0.51 0.00 0.00 176.95 174.27 1bza n PRO 252 N 3.18 -0.83 0.19 4.98 -0.02 -1.26 -2.77 135.00 138.47 1bza n PRO 252 Ca 0.14 -0.19 0.04 0.00 -2.02 0.00 0.00 63.50 61.46 1bza n PRO 252 Cb 0.39 -2.23 0.39 0.00 -0.02 0.00 0.00 33.50 32.03 1bza n PRO 252 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1bza h GLU 254 N -2.00 0.00 0.00 -0.52 4.57 -1.98 -3.34 114.58 111.31 1bza h GLU 254 Ca -0.47 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 57.62 1bza h GLU 254 Cb 1.29 0.00 -0.21 0.00 -0.16 0.00 0.00 28.75 29.66 1bza h GLU 254 CO 0.41 0.35 -0.76 0.09 -1.18 0.00 0.00 179.01 177.92 1bza n ASN 255 N -4.01 0.92 -3.99 1.04 3.02 -1.26 -5.09 115.26 105.89 1bza n ASN 255 Ca -0.02 -2.32 -0.09 0.00 -0.03 0.00 0.00 54.58 52.12 1bza n ASN 255 Cb 0.40 -0.31 -0.08 0.00 -0.61 0.00 0.00 39.78 39.18 1bza n ASN 255 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1bza s HIS 256 N -0.61 0.46 0.77 3.10 3.76 -1.26 -5.16 115.29 116.36 1bza s HIS 256 Ca 0.25 -0.84 -0.13 0.00 -0.15 0.00 0.00 55.06 54.20 1bza s HIS 256 Cb 0.28 -0.14 0.06 0.00 1.11 0.00 0.00 32.58 33.88 1bza s HIS 256 CO -0.10 -0.66 1.14 0.00 -0.85 0.00 0.00 174.74 174.27 1bza s ALA 257 N -3.97 2.09 0.70 -1.40 0.00 -1.26 -4.28 121.76 113.63 1bza s ALA 257 Ca 0.17 0.56 -0.16 0.00 0.00 0.00 0.00 51.96 52.52 1bza s ALA 257 Cb 0.04 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.81 1bza s ALA 257 CO -0.01 -1.91 1.23 -2.14 0.00 0.00 0.00 175.76 172.93 1bza s PRO 258 N -4.42 2.32 0.02 0.00 0.02 -1.26 -4.56 135.00 127.12 1bza s PRO 258 Ca 0.67 1.84 0.07 0.00 0.02 0.00 0.00 61.00 63.60 1bza s PRO 258 Cb -0.22 -1.85 -0.03 0.00 0.02 0.00 0.00 34.50 32.42 1bza s PRO 258 CO 0.50 -1.71 -0.21 -0.51 -0.33 0.00 0.00 177.00 174.74 1bza s LEU 259 N -4.85 2.43 -0.17 -5.54 1.43 -0.20 -1.61 118.68 110.17 1bza s LEU 259 Ca 0.77 -0.44 -0.02 0.00 -1.03 0.00 0.00 54.13 53.40 1bza s LEU 259 Cb -0.31 -1.44 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 1bza s LEU 259 CO 0.43 0.28 -0.08 -0.69 0.23 0.00 0.00 176.35 176.51 1bza s VAL 260 N -0.82 3.33 -0.07 -1.59 1.01 -0.33 -0.72 120.40 121.21 1bza s VAL 260 Ca 0.13 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.58 1bza s VAL 260 Cb -0.10 -2.45 0.02 0.00 0.00 0.00 0.00 36.38 33.84 1bza s VAL 260 CO 0.03 0.48 -0.10 -0.22 0.00 0.00 0.00 175.10 175.29 1bza s LEU 261 N 0.78 1.51 -0.16 3.92 2.96 -0.25 -0.46 118.68 126.99 1bza s LEU 261 Ca -0.03 -0.27 0.00 0.00 -0.22 0.00 0.00 54.13 53.61 1bza s LEU 261 Cb -0.15 -0.76 0.00 0.00 0.50 0.00 0.00 46.19 45.78 1bza s LEU 261 CO 0.01 -0.01 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.19 1bza s VAL 262 N 0.88 2.60 -0.24 1.68 1.01 -0.29 -0.33 120.40 125.72 1bza s VAL 262 Ca -0.11 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.10 1bza s VAL 262 Cb -0.15 -2.09 0.06 0.00 0.00 0.00 0.00 36.38 34.19 1bza s VAL 262 CO 0.01 0.52 -0.08 0.42 0.00 0.00 0.00 175.10 175.96 1bza s THR 263 N 0.85 1.78 -0.05 3.92 -4.23 -0.28 -1.60 115.64 116.03 1bza s THR 263 Ca -0.05 -1.32 0.03 0.00 -1.18 0.00 0.00 61.69 59.17 1bza s THR 263 Cb -0.15 -1.95 -0.03 0.00 1.34 0.00 0.00 72.50 71.71 1bza s THR 263 CO -0.01 -0.02 -0.13 -0.31 -0.54 0.00 0.00 174.62 173.62 1bza s TYR 264 N 1.29 2.75 -0.12 3.99 2.02 0.02 -0.88 117.35 126.42 1bza s TYR 264 Ca -0.06 -0.12 -0.08 0.00 -0.37 0.00 0.00 57.07 56.44 1bza s TYR 264 Cb -0.19 -1.64 0.04 0.00 -0.40 0.00 0.00 41.96 39.77 1bza s TYR 264 CO -0.06 0.22 0.29 0.12 -1.57 0.00 0.00 175.55 174.55 1bza s PHE 265 N -0.75 -0.37 0.05 2.71 5.36 -0.78 -0.38 117.98 123.82 1bza s PHE 265 Ca 0.12 0.87 -0.06 0.00 -0.96 0.00 0.00 56.93 56.89 1bza s PHE 265 Cb -0.11 0.11 -0.01 0.00 -0.34 0.00 0.00 43.02 42.67 1bza s PHE 265 CO 0.01 -0.22 0.11 -0.08 -1.46 0.00 0.00 175.22 173.58 1bza s THR 266 N 0.85 0.14 0.19 0.12 -1.32 -0.26 -0.37 115.64 114.99 1bza s THR 266 Ca -0.06 -1.15 0.09 0.00 -1.21 0.00 0.00 61.69 59.36 1bza s THR 266 Cb -0.07 -1.02 -0.04 0.00 -1.51 0.00 0.00 72.50 69.86 1bza s THR 266 CO -0.06 -0.64 -0.18 -1.10 -2.21 0.00 0.00 174.62 170.43 1bza s GLN 267 N -2.92 1.36 0.58 7.08 -0.21 0.45 -0.60 119.66 125.41 1bza s GLN 267 Ca -0.02 -1.49 0.36 0.00 0.02 0.00 0.00 55.36 54.23 1bza s GLN 267 Cb 0.01 -1.40 1.72 0.00 1.00 0.00 0.00 33.01 34.33 1bza s GLN 267 CO -0.06 0.28 2.12 -1.00 -2.12 0.00 0.00 175.29 174.50 1bza h PRO 268 N 3.01 0.00 -6.23 2.91 0.13 -1.82 -3.44 132.00 126.55 1bza h PRO 268 Ca -0.42 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.03 1bza h PRO 268 Cb 1.22 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.10 1bza h PRO 268 CO 0.54 0.02 -0.78 -1.83 -0.23 0.00 0.00 178.00 175.71 1bza s GLU 269 N -3.88 2.56 0.27 0.86 1.03 -1.26 -5.03 118.70 113.25 1bza s GLU 269 Ca -0.01 -0.72 -0.01 0.00 0.03 0.00 0.00 54.97 54.26 1bza s GLU 269 Cb 0.11 -2.37 0.49 0.00 -0.80 0.00 0.00 34.13 31.56 1bza s GLU 269 CO 0.51 0.57 1.83 0.37 -1.33 0.00 0.00 175.26 177.21 1bza h GLN 270 N 5.52 0.94 -0.68 -4.83 4.15 -1.91 -1.96 115.11 116.33 1bza h GLN 270 Ca -0.43 -0.06 -0.19 0.00 0.77 0.00 0.00 58.65 58.74 1bza h GLN 270 Cb 1.16 -0.21 -0.11 0.00 0.21 0.00 0.00 27.48 28.52 1bza h GLN 270 CO 0.50 0.62 0.22 1.63 -1.93 0.00 0.00 178.83 179.88 1bza n LYS 271 N -4.64 3.69 -1.81 1.69 4.01 -1.26 -1.08 118.16 118.77 1bza n LYS 271 Ca 0.17 -3.09 -0.38 0.00 -0.51 0.00 0.00 58.31 54.50 1bza n LYS 271 Cb 0.31 -2.18 0.04 0.00 -0.51 0.00 0.00 35.03 32.69 1bza n LYS 271 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1bza s ALA 272 N -2.99 2.73 0.56 7.82 0.00 -0.74 -4.91 121.76 124.25 1bza s ALA 272 Ca 0.54 1.28 -0.19 0.00 0.00 0.00 0.00 51.96 53.60 1bza s ALA 272 Cb 0.43 -3.55 -0.05 0.00 0.00 0.00 0.00 23.12 19.95 1bza s ALA 272 CO 0.13 -1.38 1.12 -1.83 0.00 0.00 0.00 175.76 173.80 1bza s GLU 273 N -3.00 3.27 0.63 0.00 -1.05 -1.26 -3.30 118.70 113.99 1bza s GLU 273 Ca 0.74 1.56 -0.17 0.00 -0.15 0.00 0.00 54.97 56.95 1bza s GLU 273 Cb -0.39 -2.00 -0.01 0.00 -0.44 0.00 0.00 34.13 31.29 1bza s GLU 273 CO 0.45 -0.90 1.14 1.03 0.95 0.00 0.00 175.26 177.93 1bza s ARG 274 N -3.43 2.87 -0.49 -4.83 3.00 -1.26 -4.55 118.95 110.24 1bza s ARG 274 Ca 0.71 1.55 0.07 0.00 0.00 0.00 0.00 55.73 58.07 1bza s ARG 274 Cb -0.23 -1.95 0.26 0.00 0.00 0.00 0.00 34.95 33.03 1bza s ARG 274 CO 0.29 -1.23 0.63 0.54 0.00 0.00 0.00 175.30 175.54 1bza n ARG 275 N -2.08 1.52 0.07 3.54 5.12 -1.26 -4.91 116.66 118.65 1bza n ARG 275 Ca 0.11 -3.86 0.04 0.00 -1.93 0.00 0.00 57.85 52.22 1bza n ARG 275 Cb 0.51 -1.68 0.44 0.00 -1.16 0.00 0.00 32.46 30.58 1bza n ARG 275 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1bza h ARG 276 N 4.00 0.39 0.00 5.56 3.08 -1.94 -1.61 114.38 123.86 1bza h ARG 276 Ca 0.12 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.12 1bza h ARG 276 Cb 0.78 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.75 1bza h ARG 276 CO 0.62 0.32 -0.08 0.38 -1.07 0.00 0.00 179.97 180.14 1bza h ASP 277 N 0.40 0.00 -0.51 7.04 2.03 -1.91 -1.89 116.42 121.57 1bza h ASP 277 Ca 0.10 0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 56.28 1bza h ASP 277 Cb 0.07 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.55 1bza h ASP 277 CO -0.01 0.08 -0.14 0.40 -1.03 0.00 0.00 179.24 178.54 1bza h ILE 278 N 0.00 1.27 -0.74 4.15 1.08 -1.65 -0.22 117.51 121.40 1bza h ILE 278 Ca -0.00 -1.29 -0.07 0.00 -0.39 0.00 0.00 64.86 63.11 1bza h ILE 278 Cb 0.16 1.01 -0.03 0.00 -3.07 0.00 0.00 36.82 34.89 1bza h ILE 278 CO 0.01 0.45 0.21 -0.07 -0.69 0.00 0.00 178.15 178.06 1bza h LEU 279 N 0.88 1.09 -0.43 1.44 3.38 -1.40 -0.15 115.31 120.13 1bza h LEU 279 Ca 0.13 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 1bza h LEU 279 Cb 0.70 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1bza h LEU 279 CO 0.05 1.03 0.04 0.00 0.09 0.00 0.00 178.44 179.65 1bza h ALA 280 N 1.11 0.57 -0.68 1.53 0.00 -1.25 -0.86 119.26 119.68 1bza h ALA 280 Ca 0.23 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1bza h ALA 280 Cb 0.34 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1bza h ALA 280 CO -0.00 0.32 0.45 0.00 0.00 0.00 0.00 179.25 180.01 1bza h ALA 281 N 0.92 0.86 -0.61 0.00 0.00 -0.78 -0.98 119.26 118.67 1bza h ALA 281 Ca 0.13 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1bza h ALA 281 Cb 0.42 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1bza h ALA 281 CO 0.01 0.29 0.08 0.00 0.00 0.00 0.00 179.25 179.62 1bza h ALA 282 N 1.25 0.81 -0.72 0.00 0.00 -0.92 -1.43 119.26 118.24 1bza h ALA 282 Ca 0.25 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1bza h ALA 282 Cb -0.11 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 1bza h ALA 282 CO -0.05 0.59 0.19 0.00 0.00 0.00 0.00 179.25 179.98 1bza h ALA 283 N 1.01 0.95 -0.48 0.00 0.00 -0.82 -1.69 119.26 118.23 1bza h ALA 283 Ca 0.18 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1bza h ALA 283 Cb 0.46 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1bza h ALA 283 CO 0.02 0.66 0.29 -0.22 0.00 0.00 0.00 179.25 180.00 1bza h LYS 284 N 1.09 0.58 0.30 0.00 3.64 -0.87 -2.43 116.57 118.87 1bza h LYS 284 Ca 0.23 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.56 1bza h LYS 284 Cb 0.35 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1bza h LYS 284 CO -0.00 0.38 -0.14 0.82 -2.27 0.00 0.00 179.45 178.24 1bza h ILE 285 N 0.59 0.71 0.00 2.00 2.04 -0.90 -3.20 117.51 118.75 1bza h ILE 285 Ca 0.19 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 66.03 1bza h ILE 285 Cb -0.01 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 1bza h ILE 285 CO -0.07 0.00 0.00 -0.37 0.00 0.00 0.00 178.15 177.71 1bza h VAL 286 N -0.41 0.00 -0.03 1.67 -1.51 -1.26 -3.48 116.25 111.23 1bza h VAL 286 Ca -0.04 -0.45 0.00 0.00 -1.23 0.00 0.00 66.70 64.98 1bza h VAL 286 Cb 0.31 1.38 0.00 0.00 -2.13 0.00 0.00 31.29 30.85 1bza h VAL 286 CO 0.07 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 176.76