#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bzh h MET 3 N 0.00 0.18 -0.27 5.31 1.85 -1.88 -2.57 114.93 117.55 1bzh h MET 3 Ca 0.00 -0.13 -0.01 0.00 -0.61 0.00 0.00 59.70 58.95 1bzh h MET 3 Cb 0.00 0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.04 1bzh h MET 3 CO 0.00 0.73 0.11 0.93 -0.40 0.00 0.00 176.91 178.28 1bzh h GLU 4 N 0.14 0.40 -0.10 0.39 4.39 -1.99 -2.20 114.58 115.62 1bzh h GLU 4 Ca -0.01 -0.07 0.03 0.00 0.34 0.00 0.00 59.36 59.65 1bzh h GLU 4 Cb 1.10 -0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 29.62 1bzh h GLU 4 CO 0.09 0.42 -0.54 -0.22 -1.16 0.00 0.00 179.01 177.60 1bzh h LYS 5 N 0.29 -0.58 -0.49 2.33 3.11 -1.99 -1.96 116.57 117.29 1bzh h LYS 5 Ca 0.09 0.04 0.08 0.00 -2.81 0.00 0.00 60.65 58.05 1bzh h LYS 5 Cb 0.17 0.13 -0.07 0.00 -1.00 0.00 0.00 32.23 31.46 1bzh h LYS 5 CO -0.01 -0.39 0.10 1.49 -2.81 0.00 0.00 179.45 177.84 1bzh h GLU 6 N -0.60 0.23 0.39 1.90 4.81 -1.31 0.51 114.58 120.51 1bzh h GLU 6 Ca 0.03 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1bzh h GLU 6 Cb 0.69 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.98 1bzh h GLU 6 CO -0.41 0.15 -0.48 0.35 -0.73 0.00 0.00 179.01 177.89 1bzh h PHE 7 N 0.24 -1.35 0.16 0.92 3.57 -1.08 0.27 116.94 119.67 1bzh h PHE 7 Ca 0.24 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.77 1bzh h PHE 7 Cb 0.32 0.54 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 1bzh h PHE 7 CO -0.22 -0.63 -0.27 1.49 -2.23 0.00 0.00 178.31 176.45 1bzh h GLU 8 N -0.91 -0.49 -0.91 1.11 4.57 -0.90 -0.48 114.58 116.57 1bzh h GLU 8 Ca -0.04 0.03 0.20 0.00 -1.18 0.00 0.00 59.36 58.37 1bzh h GLU 8 Cb 0.82 0.11 -0.11 0.00 -0.16 0.00 0.00 28.75 29.41 1bzh h GLU 8 CO -0.12 -0.33 0.46 0.37 -1.18 0.00 0.00 179.01 178.22 1bzh h GLN 9 N -0.51 0.52 -0.00 1.92 4.15 0.25 -0.13 115.11 121.31 1bzh h GLN 9 Ca 0.02 -0.03 -0.25 0.00 0.77 0.00 0.00 58.65 59.16 1bzh h GLN 9 Cb 0.52 -0.12 0.02 0.00 0.21 0.00 0.00 27.48 28.11 1bzh h GLN 9 CO -0.13 0.35 -0.96 0.82 -1.93 0.00 0.00 178.83 176.98 1bzh h ILE 10 N 0.54 1.31 -0.13 2.39 2.04 -0.01 -3.06 117.51 120.58 1bzh h ILE 10 Ca 0.54 -2.21 -0.02 0.00 1.00 0.00 0.00 64.86 64.18 1bzh h ILE 10 Cb 0.94 2.42 -0.00 0.00 -0.74 0.00 0.00 36.82 39.43 1bzh h ILE 10 CO -0.45 0.68 0.01 0.44 0.00 0.00 0.00 178.15 178.83 1bzh h ASP 11 N 0.30 0.21 -0.33 1.72 3.32 -0.47 0.35 116.42 121.52 1bzh h ASP 11 Ca -0.12 -0.28 0.05 0.00 0.02 0.00 0.00 57.03 56.70 1bzh h ASP 11 Cb 1.62 -0.06 -0.05 0.00 0.22 0.00 0.00 39.33 41.07 1bzh h ASP 11 CO 0.19 0.44 0.05 0.50 -1.72 0.00 0.00 179.24 178.70 1bzh h LYS 12 N -0.02 0.16 0.00 3.56 1.63 -1.17 -1.48 116.57 119.25 1bzh h LYS 12 Ca 0.04 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 1bzh h LYS 12 Cb 0.32 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.92 1bzh h LYS 12 CO 0.00 0.10 0.00 0.45 -3.45 0.00 0.00 179.45 176.56 1bzh n SER 13 N -5.11 0.69 -3.61 4.20 2.88 -1.16 -4.94 113.62 106.58 1bzh n SER 13 Ca 0.01 0.60 -0.20 0.00 -1.33 0.00 0.00 58.87 57.95 1bzh n SER 13 Cb 0.15 -0.77 0.05 0.00 -0.75 0.00 0.00 64.21 62.89 1bzh n SER 13 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1bzh n GLY 14 N 0.81 -0.40 1.50 0.46 0.00 0.11 -4.92 105.19 102.76 1bzh n GLY 14 Ca 0.04 0.16 -0.11 0.00 0.00 0.00 0.00 46.02 46.12 1bzh n GLY 14 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1bzh n SER 15 N -3.07 3.01 -0.10 1.61 3.41 -0.65 -4.74 113.62 113.09 1bzh n SER 15 Ca -0.27 -3.75 -0.11 0.00 -0.26 0.00 0.00 58.87 54.47 1bzh n SER 15 Cb 0.67 -0.69 -0.04 0.00 -0.26 0.00 0.00 64.21 63.89 1bzh n SER 15 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1bzh h TRP 16 N 1.07 0.59 -0.01 7.33 4.06 -1.92 0.28 115.95 127.35 1bzh h TRP 16 Ca 0.35 -0.12 0.00 0.00 2.06 0.00 0.00 58.89 61.18 1bzh h TRP 16 Cb 1.94 -0.15 -0.00 0.00 -1.00 0.00 0.00 29.16 29.95 1bzh h TRP 16 CO 1.20 0.71 -0.00 0.00 -3.56 0.00 0.00 178.44 176.79 1bzh h ALA 17 N 0.79 0.01 -0.47 1.49 0.00 -1.91 0.22 119.26 119.40 1bzh h ALA 17 Ca 0.07 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1bzh h ALA 17 Cb 0.51 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1bzh h ALA 17 CO 0.02 -0.50 0.30 0.00 0.00 0.00 0.00 179.25 179.08 1bzh h ALA 18 N 1.01 0.60 -0.50 0.00 0.00 -1.88 0.80 119.26 119.29 1bzh h ALA 18 Ca 0.01 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1bzh h ALA 18 Cb 0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1bzh h ALA 18 CO -0.02 0.02 0.15 0.97 0.00 0.00 0.00 179.25 180.38 1bzh h ILE 19 N 0.62 1.23 0.45 0.00 6.09 -0.26 -1.46 117.51 124.18 1bzh h ILE 19 Ca 0.18 -0.79 -0.02 0.00 -1.37 0.00 0.00 64.86 62.86 1bzh h ILE 19 Cb -0.05 0.80 0.00 0.00 0.47 0.00 0.00 36.82 38.05 1bzh h ILE 19 CO -0.05 0.29 -0.22 0.22 -3.07 0.00 0.00 178.15 175.32 1bzh h TYR 20 N 0.67 -0.56 -0.70 2.19 3.20 -0.55 -2.49 116.97 118.73 1bzh h TYR 20 Ca 0.16 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.08 1bzh h TYR 20 Cb 0.29 0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.70 1bzh h TYR 20 CO 0.02 -0.33 0.46 1.96 -1.64 0.00 0.00 178.16 178.63 1bzh h GLN 21 N -0.65 0.70 -0.46 1.82 1.08 0.67 0.36 115.11 118.63 1bzh h GLN 21 Ca -0.06 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.05 1bzh h GLN 21 Cb 0.49 -0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 27.74 1bzh h GLN 21 CO 0.10 0.47 0.10 0.22 -0.95 0.00 0.00 178.83 178.77 1bzh h ASP 22 N 0.72 0.64 -0.35 1.46 3.58 -1.07 0.95 116.42 122.35 1bzh h ASP 22 Ca 0.30 -0.11 -0.16 0.00 0.42 0.00 0.00 57.03 57.48 1bzh h ASP 22 Cb 0.25 -0.17 -0.00 0.00 1.72 0.00 0.00 39.33 41.13 1bzh h ASP 22 CO -0.10 0.64 -0.41 0.40 -2.88 0.00 0.00 179.24 176.89 1bzh h ILE 23 N 0.67 1.27 -0.26 2.25 2.04 0.05 -1.88 117.51 121.66 1bzh h ILE 23 Ca 0.15 -1.59 0.04 0.00 1.00 0.00 0.00 64.86 64.46 1bzh h ILE 23 Cb 0.27 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 37.77 1bzh h ILE 23 CO -0.00 0.53 0.03 0.03 0.00 0.00 0.00 178.15 178.74 1bzh h ARG 24 N 0.71 0.12 -0.95 2.37 3.08 -0.06 -1.12 114.38 118.53 1bzh h ARG 24 Ca 0.05 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.11 1bzh h ARG 24 Cb 1.01 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.99 1bzh h ARG 24 CO 0.10 0.08 0.62 1.25 -1.07 0.00 0.00 179.97 180.95 1bzh h HIS 25 N 0.12 1.18 0.00 3.04 2.76 -0.66 -2.29 115.15 119.30 1bzh h HIS 25 Ca 0.12 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 1bzh h HIS 25 Cb 0.14 -0.40 0.00 0.00 1.55 0.00 0.00 27.41 28.70 1bzh h HIS 25 CO -0.18 0.72 -0.22 0.93 -1.30 0.00 0.00 177.93 177.89 1bzh h GLU 26 N 1.26 0.00 -6.24 5.26 4.39 -1.09 -3.47 114.58 114.69 1bzh h GLU 26 Ca 0.35 0.00 -0.65 0.00 0.34 0.00 0.00 59.36 59.40 1bzh h GLU 26 Cb -0.11 0.00 0.10 0.00 -0.10 0.00 0.00 28.75 28.64 1bzh h GLU 26 CO -0.09 0.00 -0.07 0.00 -1.16 0.00 0.00 179.01 177.70 1bzh n ALA 27 N -1.82 -1.54 -0.63 3.43 0.00 -0.45 -4.93 120.51 114.57 1bzh n ALA 27 Ca 0.05 0.44 -0.30 0.00 0.00 0.00 0.00 53.44 53.62 1bzh n ALA 27 Cb 0.44 -1.86 0.19 0.00 0.00 0.00 0.00 19.45 18.22 1bzh n ALA 27 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1bzh n SER 28 N 1.71 -0.40 -3.62 0.00 7.64 -1.26 -5.05 113.62 112.63 1bzh n SER 28 Ca 0.15 0.25 -0.11 0.00 1.01 0.00 0.00 58.87 60.17 1bzh n SER 28 Cb 0.26 -1.40 -0.11 0.00 -1.01 0.00 0.00 64.21 61.95 1bzh n SER 28 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1bzh s ASP 29 N -2.52 0.07 0.18 6.43 2.15 -1.26 -4.93 116.67 116.79 1bzh s ASP 29 Ca 0.67 0.73 0.08 0.00 0.43 0.00 0.00 52.55 54.46 1bzh s ASP 29 Cb -0.23 1.06 -0.04 0.00 -0.30 0.00 0.00 42.92 43.41 1bzh s ASP 29 CO 0.61 -0.24 -0.16 -0.36 -0.17 0.00 0.00 175.17 174.85 1bzh s PHE 30 N 2.53 1.71 0.52 -5.34 0.08 -1.26 -5.11 117.98 111.10 1bzh s PHE 30 Ca 0.01 -0.54 -0.22 0.00 0.12 0.00 0.00 56.93 56.30 1bzh s PHE 30 Cb -0.12 -0.82 -0.06 0.00 -0.57 0.00 0.00 43.02 41.44 1bzh s PHE 30 CO -0.12 0.32 1.30 -1.25 -0.10 0.00 0.00 175.22 175.38 1bzh s PRO 31 N -3.24 3.35 -0.43 0.24 0.04 -1.26 -4.87 135.00 128.83 1bzh s PRO 31 Ca 0.19 2.09 0.06 0.00 0.04 0.00 0.00 61.00 63.37 1bzh s PRO 31 Cb -0.03 -2.32 0.42 0.00 0.04 0.00 0.00 34.50 32.62 1bzh s PRO 31 CO 0.06 -0.97 1.10 0.00 0.04 0.00 0.00 177.00 177.23 1bzh h ARG 33 N 2.61 -0.76 -0.43 0.00 2.43 -1.92 -2.78 114.38 113.53 1bzh h ARG 33 Ca 0.27 0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.53 1bzh h ARG 33 Cb 0.94 0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.63 1bzh h ARG 33 CO 0.83 -0.51 0.23 0.28 -1.51 0.00 0.00 179.97 179.28 1bzh h VAL 34 N -0.79 0.99 -0.98 0.20 2.07 -1.91 -2.21 116.25 113.63 1bzh h VAL 34 Ca -0.02 -0.16 0.16 0.00 0.82 0.00 0.00 66.70 67.51 1bzh h VAL 34 Cb 0.74 0.50 -0.09 0.00 -1.52 0.00 0.00 31.29 30.92 1bzh h VAL 34 CO -0.14 0.08 0.61 0.00 0.02 0.00 0.00 177.57 178.15 1bzh h ALA 35 N 1.22 1.72 -0.01 1.67 0.00 -1.82 -1.05 119.26 121.00 1bzh h ALA 35 Ca 0.18 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1bzh h ALA 35 Cb 0.07 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1bzh h ALA 35 CO -0.12 -0.03 -0.10 1.63 0.00 0.00 0.00 179.25 180.64 1bzh n LYS 36 N -4.66 0.88 -1.73 0.00 4.76 -0.85 -4.60 118.16 111.96 1bzh n LYS 36 Ca 0.21 -0.35 -0.42 0.00 -2.87 0.00 0.00 58.31 54.88 1bzh n LYS 36 Cb 0.51 -1.49 -0.02 0.00 -1.84 0.00 0.00 35.03 32.19 1bzh n LYS 36 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1bzh n LEU 37 N -0.76 4.20 -0.31 -0.35 4.77 -0.40 -4.88 117.00 119.28 1bzh n LEU 37 Ca 0.16 1.12 0.17 0.00 -0.03 0.00 0.00 56.01 57.43 1bzh n LEU 37 Cb 0.28 -1.58 0.42 0.00 -2.33 0.00 0.00 43.42 40.21 1bzh n LEU 37 CO 0.22 0.14 1.21 -0.65 -1.33 0.00 0.00 177.39 176.98 1bzh h PRO 38 N 5.41 0.55 0.00 3.23 0.11 -1.90 0.17 132.00 139.57 1bzh h PRO 38 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1bzh h PRO 38 Cb 1.22 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1bzh h PRO 38 CO 0.84 0.37 0.00 0.36 -0.21 0.00 0.00 178.00 179.36 1bzh n LYS 39 N -4.65 0.04 -0.10 1.05 2.85 -1.26 -2.33 118.16 113.76 1bzh n LYS 39 Ca 0.22 0.26 0.05 0.00 -1.05 0.00 0.00 58.31 57.79 1bzh n LYS 39 Cb 0.68 -1.50 0.11 0.00 -0.65 0.00 0.00 35.03 33.66 1bzh n LYS 39 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1bzh n ASN 40 N -1.45 2.50 -0.34 -5.58 3.02 0.58 -4.61 115.26 109.38 1bzh n ASN 40 Ca 0.04 -1.80 0.04 0.00 -0.03 0.00 0.00 54.58 52.83 1bzh n ASN 40 Cb 0.14 -0.14 0.19 0.00 -0.61 0.00 0.00 39.78 39.36 1bzh n ASN 40 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1bzh h LYS 41 N 1.90 0.93 0.00 3.52 3.64 -1.37 -0.44 116.57 124.74 1bzh h LYS 41 Ca 0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1bzh h LYS 41 Cb 0.61 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1bzh h LYS 41 CO 0.00 0.62 0.00 0.27 -2.27 0.00 0.00 179.45 178.07 1bzh n ASN 42 N -4.64 0.00 -0.61 4.20 2.04 -1.26 -2.53 115.26 112.45 1bzh n ASN 42 Ca 0.16 -0.20 0.12 0.00 -0.44 0.00 0.00 54.58 54.21 1bzh n ASN 42 Cb 0.28 -0.24 0.12 0.00 -2.53 0.00 0.00 39.78 37.41 1bzh n ASN 42 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1bzh n ARG 43 N -1.24 1.55 -3.81 -3.83 1.74 -0.18 -4.83 116.66 106.05 1bzh n ARG 43 Ca 0.13 -1.23 -0.36 0.00 -0.77 0.00 0.00 57.85 55.63 1bzh n ARG 43 Cb 0.18 -1.47 -0.13 0.00 -1.02 0.00 0.00 32.46 30.02 1bzh n ARG 43 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1bzh s ASN 44 N -2.29 4.84 0.25 0.55 0.01 -1.05 -4.25 114.94 112.99 1bzh s ASN 44 Ca 0.24 -0.54 0.00 0.00 -0.71 0.00 0.00 52.86 51.86 1bzh s ASN 44 Cb 0.19 -1.83 0.29 0.00 0.41 0.00 0.00 41.25 40.31 1bzh s ASN 44 CO 0.46 -0.11 1.64 -0.09 -1.51 0.00 0.00 177.10 177.49 1bzh h ARG 45 N 8.18 0.51 -4.84 -0.60 2.43 -1.88 -3.43 114.38 114.76 1bzh h ARG 45 Ca -0.36 -0.24 -0.54 0.00 -0.81 0.00 0.00 59.98 58.03 1bzh h ARG 45 Cb 1.14 -0.01 -0.33 0.00 -0.42 0.00 0.00 29.97 30.36 1bzh h ARG 45 CO 0.60 0.80 -0.83 0.71 -1.51 0.00 0.00 179.97 179.74 1bzh s TYR 46 N -4.31 1.64 0.20 2.20 2.02 -1.26 -5.03 117.35 112.82 1bzh s TYR 46 Ca -0.07 -0.58 0.17 0.00 -0.37 0.00 0.00 57.07 56.22 1bzh s TYR 46 Cb 0.13 -1.16 0.63 0.00 -0.40 0.00 0.00 41.96 41.16 1bzh s TYR 46 CO 0.81 -0.26 1.72 0.07 -1.57 0.00 0.00 175.55 176.32 1bzh h ARG 47 N 6.73 0.00 -0.65 -0.62 0.11 -1.95 -2.46 114.38 115.54 1bzh h ARG 47 Ca -0.30 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.78 1bzh h ARG 47 Cb 1.19 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.27 1bzh h ARG 47 CO 0.48 0.42 0.00 -0.40 0.10 0.00 0.00 179.97 180.56 1bzh n ASP 48 N -3.61 4.45 -3.69 0.08 5.75 -1.26 -4.74 116.55 113.53 1bzh n ASP 48 Ca -0.01 -2.31 -0.30 0.00 -0.01 0.00 0.00 54.79 52.16 1bzh n ASP 48 Cb 0.52 -0.54 -0.15 0.00 -1.03 0.00 0.00 41.12 39.92 1bzh n ASP 48 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1bzh s VAL 49 N -1.59 0.68 0.07 2.12 1.01 -0.93 -5.11 120.40 116.65 1bzh s VAL 49 Ca 0.49 -1.30 0.07 0.00 0.00 0.00 0.00 61.98 61.24 1bzh s VAL 49 Cb 0.30 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.13 1bzh s VAL 49 CO 0.26 -0.70 -0.18 -0.44 0.00 0.00 0.00 175.10 174.04 1bzh s SER 50 N 1.68 2.18 0.24 3.32 0.01 -1.26 -4.63 113.70 115.24 1bzh s SER 50 Ca 0.10 -0.58 -0.30 0.00 1.31 0.00 0.00 55.95 56.48 1bzh s SER 50 Cb -0.17 -0.13 -0.09 0.00 0.21 0.00 0.00 66.02 65.84 1bzh s SER 50 CO -0.27 0.06 1.09 -2.16 0.41 0.00 0.00 173.24 172.37 1bzh s PRO 51 N -1.52 4.64 0.79 12.44 0.04 -1.26 -4.55 135.00 145.58 1bzh s PRO 51 Ca 0.04 1.75 -0.13 0.00 0.04 0.00 0.00 61.00 62.70 1bzh s PRO 51 Cb -0.09 -3.23 0.07 0.00 0.04 0.00 0.00 34.50 31.29 1bzh s PRO 51 CO 0.03 0.18 1.19 -0.06 0.04 0.00 0.00 177.00 178.37 1bzh s PHE 52 N -0.81 1.92 0.24 0.56 0.08 -1.26 -4.64 117.98 114.07 1bzh s PHE 52 Ca 0.46 1.66 -0.02 0.00 0.12 0.00 0.00 56.93 59.15 1bzh s PHE 52 Cb -0.31 -3.43 0.27 0.00 -0.57 0.00 0.00 43.02 38.98 1bzh s PHE 52 CO 0.38 -2.67 1.65 -0.44 -0.10 0.00 0.00 175.22 174.04 1bzh h ASP 53 N -0.83 0.65 0.32 1.36 3.32 -1.58 -2.29 116.42 117.37 1bzh h ASP 53 Ca -0.46 -0.24 -0.08 0.00 0.02 0.00 0.00 57.03 56.27 1bzh h ASP 53 Cb 1.29 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.65 1bzh h ASP 53 CO 0.47 0.89 -0.35 1.12 -1.72 0.00 0.00 179.24 179.65 1bzh h HIS 54 N 0.55 0.05 -0.02 4.55 2.07 -1.91 -3.22 115.15 117.23 1bzh h HIS 54 Ca 0.07 -0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.58 1bzh h HIS 54 Cb 0.74 -0.01 0.00 0.00 2.57 0.00 0.00 27.41 30.71 1bzh h HIS 54 CO 0.03 0.39 0.00 -1.13 -3.07 0.00 0.00 177.93 174.16 1bzh n SER 55 N -4.11 1.63 -4.75 3.10 3.41 -1.22 -5.03 113.62 106.65 1bzh n SER 55 Ca -0.02 -1.57 -0.36 0.00 -0.26 0.00 0.00 58.87 56.66 1bzh n SER 55 Cb 0.40 -0.01 0.04 0.00 -0.26 0.00 0.00 64.21 64.38 1bzh n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bzh s ARG 56 N -0.59 2.84 -0.17 4.33 1.70 -0.86 0.16 118.95 126.35 1bzh s ARG 56 Ca 0.01 1.83 -0.26 0.00 -0.47 0.00 0.00 55.73 56.84 1bzh s ARG 56 Cb 0.01 -1.91 -0.01 0.00 -0.57 0.00 0.00 34.95 32.46 1bzh s ARG 56 CO 0.01 -1.31 0.86 0.42 -1.08 0.00 0.00 175.30 174.20 1bzh s ILE 57 N -1.64 4.85 -0.25 4.99 -1.09 -0.49 -4.70 121.20 122.86 1bzh s ILE 57 Ca 0.77 1.69 -0.18 0.00 -2.23 0.00 0.00 60.65 60.70 1bzh s ILE 57 Cb -0.31 -4.16 -0.03 0.00 -1.58 0.00 0.00 42.46 36.38 1bzh s ILE 57 CO 0.35 0.00 0.53 -0.54 -1.23 0.00 0.00 174.94 174.05 1bzh s LYS 58 N 2.25 4.09 0.43 2.79 1.02 -1.26 -4.15 119.74 124.90 1bzh s LYS 58 Ca 0.39 0.36 -0.24 0.00 0.02 0.00 0.00 55.97 56.50 1bzh s LYS 58 Cb -0.17 -3.64 -0.08 0.00 -0.52 0.00 0.00 37.83 33.42 1bzh s LYS 58 CO 0.12 -0.34 1.20 -0.51 -0.92 0.00 0.00 175.35 174.90 1bzh s LEU 59 N 2.26 4.12 -0.08 3.17 1.43 0.16 -4.90 118.68 124.84 1bzh s LEU 59 Ca 0.22 2.40 0.00 0.00 -1.03 0.00 0.00 54.13 55.73 1bzh s LEU 59 Cb -0.16 -4.09 0.09 0.00 0.03 0.00 0.00 46.19 42.07 1bzh s LEU 59 CO 0.09 -0.83 1.47 1.41 0.23 0.00 0.00 176.35 178.72 1bzh n HIS 60 N -0.16 0.48 -4.13 0.29 8.25 -1.26 -4.52 115.22 114.17 1bzh n HIS 60 Ca 0.05 -0.93 -0.34 0.00 -0.26 0.00 0.00 57.72 56.24 1bzh n HIS 60 Cb 0.46 -0.47 -0.10 0.00 1.12 0.00 0.00 29.99 31.01 1bzh n HIS 60 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 1bzh s GLN 61 N -0.53 3.74 0.23 -0.41 -2.07 -1.26 -4.99 119.66 114.37 1bzh s GLN 61 Ca 0.09 -0.37 0.23 0.00 -1.82 0.00 0.00 55.36 53.49 1bzh s GLN 61 Cb 0.07 -3.09 0.94 0.00 -1.09 0.00 0.00 33.01 29.85 1bzh s GLN 61 CO 0.01 0.36 1.71 0.39 -1.32 0.00 0.00 175.29 176.44 1bzh n GLU 62 N 3.23 0.19 0.00 9.60 4.71 -1.26 -3.93 120.64 133.18 1bzh n GLU 62 Ca -0.17 0.38 0.00 0.00 -0.01 0.00 0.00 57.16 57.36 1bzh n GLU 62 Cb 0.53 -1.84 0.00 0.00 -1.01 0.00 0.00 31.44 29.12 1bzh n GLU 62 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1bzh n ASP 63 N -2.19 0.00 -3.39 1.62 9.92 -1.26 -4.82 116.55 116.43 1bzh n ASP 63 Ca 0.03 0.33 -0.12 0.00 -0.53 0.00 0.00 54.79 54.50 1bzh n ASP 63 Cb 0.25 0.00 -0.09 0.00 -0.64 0.00 0.00 41.12 40.64 1bzh n ASP 63 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 1bzh s ASN 64 N -2.36 0.62 0.00 -2.24 3.84 -1.25 -5.04 114.94 108.50 1bzh s ASN 64 Ca 0.00 0.03 0.09 0.00 0.21 0.00 0.00 52.86 53.19 1bzh s ASN 64 Cb 0.00 0.89 0.33 0.00 -0.55 0.00 0.00 41.25 41.93 1bzh s ASN 64 CO 0.00 -0.31 1.25 -0.90 -2.79 0.00 0.00 177.10 174.34 1bzh n ASP 65 N 5.35 0.99 -4.73 -4.21 5.68 -1.26 -4.79 116.55 113.58 1bzh n ASP 65 Ca -0.04 -1.91 -0.40 0.00 -0.50 0.00 0.00 54.79 51.95 1bzh n ASP 65 Cb 0.50 -0.11 -0.05 0.00 -1.14 0.00 0.00 41.12 40.32 1bzh n ASP 65 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 1bzh s TYR 66 N -1.78 3.64 -0.08 2.11 5.04 -1.26 0.40 117.35 125.43 1bzh s TYR 66 Ca 0.17 1.31 -0.07 0.00 -2.44 0.00 0.00 57.07 56.04 1bzh s TYR 66 Cb 0.09 -2.77 0.02 0.00 0.35 0.00 0.00 41.96 39.64 1bzh s TYR 66 CO 0.12 0.19 0.20 -1.50 -1.34 0.00 0.00 175.55 173.22 1bzh s ILE 67 N 0.36 -0.00 -1.08 3.14 2.07 -1.26 -4.91 121.20 119.52 1bzh s ILE 67 Ca 0.37 0.01 -0.22 0.00 -1.41 0.00 0.00 60.65 59.40 1bzh s ILE 67 Cb -0.19 -0.29 -0.00 0.00 0.13 0.00 0.00 42.46 42.11 1bzh s ILE 67 CO 0.19 0.01 1.75 0.21 -1.91 0.00 0.00 174.94 175.19 1bzh s ASN 68 N 0.20 5.88 -0.14 4.50 3.84 -1.26 -4.65 114.94 123.30 1bzh s ASN 68 Ca -0.01 -1.49 -0.16 0.00 0.21 0.00 0.00 52.86 51.42 1bzh s ASN 68 Cb -0.02 -2.57 0.04 0.00 -0.55 0.00 0.00 41.25 38.15 1bzh s ASN 68 CO -0.00 -2.12 0.43 0.00 -2.79 0.00 0.00 177.10 172.62 1bzh s ALA 69 N 7.53 -1.06 0.02 1.71 0.00 -1.26 -2.93 121.76 125.76 1bzh s ALA 69 Ca 0.59 1.13 0.06 0.00 0.00 0.00 0.00 51.96 53.74 1bzh s ALA 69 Cb -0.01 -0.60 -0.02 0.00 0.00 0.00 0.00 23.12 22.49 1bzh s ALA 69 CO 0.01 -0.22 -0.17 -1.12 0.00 0.00 0.00 175.76 174.26 1bzh s SER 70 N 0.02 2.04 -0.38 0.00 0.01 0.04 -1.40 113.70 114.03 1bzh s SER 70 Ca -0.02 -0.41 -0.19 0.00 1.31 0.00 0.00 55.95 56.65 1bzh s SER 70 Cb -0.03 -0.19 0.01 0.00 0.21 0.00 0.00 66.02 66.02 1bzh s SER 70 CO 0.01 0.15 0.54 -0.22 0.41 0.00 0.00 173.24 174.13 1bzh s LEU 71 N -0.82 4.43 -0.43 2.44 2.96 0.42 -1.04 118.68 126.65 1bzh s LEU 71 Ca 0.06 -0.15 -0.18 0.00 -0.22 0.00 0.00 54.13 53.63 1bzh s LEU 71 Cb -0.07 -2.61 0.02 0.00 0.50 0.00 0.00 46.19 44.03 1bzh s LEU 71 CO 0.01 -0.56 0.51 -0.63 -1.32 0.00 0.00 176.35 174.35 1bzh s ILE 72 N 2.48 5.00 -0.45 6.68 1.09 0.17 -4.85 121.20 131.32 1bzh s ILE 72 Ca 0.19 -0.19 -0.11 0.00 -1.10 0.00 0.00 60.65 59.44 1bzh s ILE 72 Cb -0.15 -4.09 0.09 0.00 -1.06 0.00 0.00 42.46 37.25 1bzh s ILE 72 CO 0.15 -0.48 0.33 -0.75 -0.10 0.00 0.00 174.94 174.09 1bzh s LYS 73 N 2.36 2.69 -0.80 2.79 2.20 -1.26 -0.39 119.74 127.32 1bzh s LYS 73 Ca 0.16 -1.52 -0.20 0.00 -0.36 0.00 0.00 55.97 54.04 1bzh s LYS 73 Cb -0.16 -3.93 0.11 0.00 -1.51 0.00 0.00 37.83 32.34 1bzh s LYS 73 CO 0.15 -1.05 1.02 -1.64 -0.36 0.00 0.00 175.35 173.47 1bzh s MET 74 N 1.47 3.38 0.08 4.03 -1.94 0.14 -4.93 119.30 121.54 1bzh s MET 74 Ca 0.04 -1.44 -0.24 0.00 -1.71 0.00 0.00 55.69 52.33 1bzh s MET 74 Cb -0.25 -4.61 -0.09 0.00 2.01 0.00 0.00 34.83 31.89 1bzh s MET 74 CO 0.02 -1.75 1.40 1.49 -0.01 0.00 0.00 175.02 176.18 1bzh h GLU 75 N 9.08 -0.40 -0.59 2.03 4.81 -1.96 0.53 114.58 128.07 1bzh h GLU 75 Ca -0.04 0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 1bzh h GLU 75 Cb 1.05 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 1bzh h GLU 75 CO 1.12 -0.27 0.13 1.49 -0.73 0.00 0.00 179.01 180.76 1bzh h GLU 76 N -0.42 0.95 0.00 1.92 4.81 -1.96 -2.24 114.58 117.64 1bzh h GLU 76 Ca 0.02 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 59.02 1bzh h GLU 76 Cb 0.49 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.75 1bzh h GLU 76 CO -0.32 0.88 0.00 0.00 -0.73 0.00 0.00 179.01 178.84 1bzh h ALA 77 N 1.03 1.00 -4.42 2.92 0.00 -1.87 -3.47 119.26 114.45 1bzh h ALA 77 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.85 1bzh h ALA 77 Cb 0.37 0.00 0.11 0.00 0.00 0.00 0.00 17.79 18.26 1bzh h ALA 77 CO 0.00 0.00 -0.50 1.04 0.00 0.00 0.00 179.25 179.79 1bzh n GLN 78 N -2.89 -4.96 -3.71 0.00 1.13 0.18 -4.89 117.38 102.24 1bzh n GLN 78 Ca 0.01 0.58 -0.14 0.00 -1.94 0.00 0.00 57.00 55.51 1bzh n GLN 78 Cb 0.29 -4.81 -0.09 0.00 0.11 0.00 0.00 30.24 25.74 1bzh n GLN 78 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1bzh s ARG 79 N -5.36 0.65 0.03 -1.09 6.06 -0.91 -4.90 118.95 113.43 1bzh s ARG 79 Ca 0.18 0.26 0.08 0.00 -2.50 0.00 0.00 55.73 53.75 1bzh s ARG 79 Cb -0.08 0.30 -0.02 0.00 0.06 0.00 0.00 34.95 35.21 1bzh s ARG 79 CO 0.50 -0.14 -0.22 -1.12 -2.50 0.00 0.00 175.30 171.81 1bzh s SER 80 N -0.55 2.67 0.07 -2.12 0.01 -1.26 0.25 113.70 112.77 1bzh s SER 80 Ca -0.07 -0.51 0.02 0.00 1.31 0.00 0.00 55.95 56.70 1bzh s SER 80 Cb -0.03 -0.24 -0.03 0.00 0.21 0.00 0.00 66.02 65.92 1bzh s SER 80 CO 0.03 0.21 -0.08 -0.31 0.41 0.00 0.00 173.24 173.51 1bzh s TYR 81 N -0.74 0.81 -0.25 2.43 1.51 0.47 -3.98 117.35 117.61 1bzh s TYR 81 Ca 0.09 -0.68 -0.05 0.00 -1.01 0.00 0.00 57.07 55.42 1bzh s TYR 81 Cb -0.09 -0.47 -0.00 0.00 -0.11 0.00 0.00 41.96 41.28 1bzh s TYR 81 CO 0.01 -0.10 0.01 0.42 -1.11 0.00 0.00 175.55 174.78 1bzh s ILE 82 N -2.38 3.65 -0.15 2.71 1.01 0.04 0.42 121.20 126.51 1bzh s ILE 82 Ca 0.00 -0.53 -0.05 0.00 0.00 0.00 0.00 60.65 60.08 1bzh s ILE 82 Cb -0.03 -2.74 -0.03 0.00 0.01 0.00 0.00 42.46 39.66 1bzh s ILE 82 CO -0.02 0.30 0.01 -0.76 0.00 0.00 0.00 174.94 174.48 1bzh s LEU 83 N 1.50 3.55 0.09 2.97 1.43 -0.20 0.19 118.68 128.21 1bzh s LEU 83 Ca 0.05 0.02 -0.07 0.00 -1.03 0.00 0.00 54.13 53.09 1bzh s LEU 83 Cb -0.15 -1.86 -0.01 0.00 0.03 0.00 0.00 46.19 44.19 1bzh s LEU 83 CO -0.01 0.22 0.16 0.28 0.23 0.00 0.00 176.35 177.24 1bzh s THR 84 N 0.06 0.14 0.79 5.49 -1.32 -0.47 -0.78 115.64 119.55 1bzh s THR 84 Ca 0.03 -1.32 -0.11 0.00 -1.21 0.00 0.00 61.69 59.07 1bzh s THR 84 Cb -0.13 -1.45 0.07 0.00 -1.51 0.00 0.00 72.50 69.48 1bzh s THR 84 CO 0.02 -0.65 1.09 0.00 -2.21 0.00 0.00 174.62 172.87 1bzh s GLN 85 N -3.89 2.14 0.16 7.08 -2.07 -1.15 -3.72 119.66 118.21 1bzh s GLN 85 Ca 0.07 0.71 -0.31 0.00 -1.82 0.00 0.00 55.36 54.01 1bzh s GLN 85 Cb 0.05 -1.92 -0.10 0.00 -1.09 0.00 0.00 33.01 29.96 1bzh s GLN 85 CO -0.09 -1.60 1.52 0.20 -1.32 0.00 0.00 175.29 174.00 1bzh s GLY 86 N -3.84 1.70 0.28 2.60 0.00 -0.44 -4.83 107.32 102.79 1bzh s GLY 86 Ca 0.61 1.31 -0.28 0.00 0.00 0.00 0.00 44.72 46.36 1bzh s GLY 86 CO 0.55 2.55 0.86 -1.05 0.00 0.00 0.00 173.10 176.00 1bzh n PRO 87 N 3.89 0.98 -2.40 2.90 -0.02 -1.26 -4.62 135.00 134.46 1bzh n PRO 87 Ca 0.13 0.34 -0.24 0.00 -2.02 0.00 0.00 63.50 61.72 1bzh n PRO 87 Cb 0.39 -1.62 0.05 0.00 -0.02 0.00 0.00 33.50 32.30 1bzh n PRO 87 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1bzh s LEU 88 N 1.12 3.03 0.43 2.45 1.43 -1.26 -0.35 118.68 125.52 1bzh s LEU 88 Ca 0.60 0.26 0.10 0.00 -1.03 0.00 0.00 54.13 54.06 1bzh s LEU 88 Cb -0.75 -3.02 0.95 0.00 0.03 0.00 0.00 46.19 43.41 1bzh s LEU 88 CO 0.59 -1.38 2.06 1.55 0.23 0.00 0.00 176.35 179.39 1bzh h PRO 89 N -0.30 0.44 -0.22 1.29 0.13 -1.96 -0.74 132.00 130.64 1bzh h PRO 89 Ca -0.43 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1bzh h PRO 89 Cb 1.31 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1bzh h PRO 89 CO 0.57 0.29 0.00 0.27 -0.23 0.00 0.00 178.00 178.90 1bzh n ASN 90 N -4.48 2.19 -0.04 1.44 6.94 -1.26 -4.16 115.26 115.89 1bzh n ASN 90 Ca 0.04 -1.79 0.05 0.00 -0.02 0.00 0.00 54.58 52.85 1bzh n ASN 90 Cb 0.12 -0.14 0.07 0.00 -2.36 0.00 0.00 39.78 37.48 1bzh n ASN 90 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1bzh n THR 91 N 0.67 1.44 -0.08 5.53 -2.24 -0.30 -4.72 114.28 114.58 1bzh n THR 91 Ca 0.17 -1.64 -0.12 0.00 -2.27 0.00 0.00 64.05 60.19 1bzh n THR 91 Cb 0.41 0.12 -0.00 0.00 -2.10 0.00 0.00 70.33 68.77 1bzh n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bzh h GLY 93 N 0.82 0.68 0.73 0.00 0.00 -1.89 -2.26 103.07 101.16 1bzh h GLY 93 Ca 0.04 -0.46 0.05 0.00 0.00 0.00 0.00 47.33 46.95 1bzh h GLY 93 CO 0.10 0.43 0.31 0.45 0.00 0.00 0.00 176.54 177.83 1bzh h HIS 94 N 0.46 0.57 0.12 5.60 3.86 -1.82 0.18 115.15 124.12 1bzh h HIS 94 Ca 0.11 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.36 1bzh h HIS 94 Cb 0.39 -0.17 -0.03 0.00 1.06 0.00 0.00 27.41 28.66 1bzh h HIS 94 CO 0.03 0.28 -0.27 0.35 0.86 0.00 0.00 177.93 179.18 1bzh h PHE 95 N 0.59 -0.74 -0.01 2.45 3.04 -0.73 0.47 116.94 122.01 1bzh h PHE 95 Ca 0.25 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 62.18 1bzh h PHE 95 Cb 0.13 0.31 -0.01 0.00 2.56 0.00 0.00 35.95 38.95 1bzh h PHE 95 CO -0.09 -0.38 -0.17 -1.49 -2.02 0.00 0.00 178.31 174.16 1bzh h TRP 96 N -0.49 0.02 -0.51 0.41 4.06 -0.89 0.93 115.95 119.48 1bzh h TRP 96 Ca 0.03 -0.00 -0.12 0.00 2.06 0.00 0.00 58.89 60.86 1bzh h TRP 96 Cb 0.52 -0.01 -0.02 0.00 -1.00 0.00 0.00 29.16 28.65 1bzh h TRP 96 CO -0.25 0.19 -0.15 1.49 -3.56 0.00 0.00 178.44 176.17 1bzh h GLU 97 N 0.02 0.99 -0.00 0.49 4.81 0.21 0.70 114.58 121.80 1bzh h GLU 97 Ca 0.00 -0.38 -0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1bzh h GLU 97 Cb 0.32 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 1bzh h GLU 97 CO 0.02 1.06 0.00 1.98 -0.73 0.00 0.00 179.01 181.35 1bzh h MET 98 N 0.87 0.00 -0.45 1.92 4.05 0.14 0.89 114.93 122.36 1bzh h MET 98 Ca 0.13 -0.00 0.09 0.00 -0.28 0.00 0.00 59.70 59.64 1bzh h MET 98 Cb 0.71 -0.00 -0.09 0.00 -0.80 0.00 0.00 31.60 31.42 1bzh h MET 98 CO 0.05 0.08 -0.13 0.28 0.23 0.00 0.00 176.91 177.43 1bzh h VAL 99 N -0.08 0.51 0.48 -5.77 2.07 -0.60 0.16 116.25 113.03 1bzh h VAL 99 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1bzh h VAL 99 Cb 0.08 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1bzh h VAL 99 CO -0.00 0.00 -0.23 -0.25 0.02 0.00 0.00 177.57 177.11 1bzh h TRP 100 N -0.03 -0.60 0.00 1.57 2.91 -0.52 -1.99 115.95 117.29 1bzh h TRP 100 Ca 0.22 -0.01 -0.05 0.00 1.13 0.00 0.00 58.89 60.17 1bzh h TRP 100 Cb 0.36 0.20 -0.01 0.00 -0.51 0.00 0.00 29.16 29.20 1bzh h TRP 100 CO -0.41 -0.36 -0.24 0.93 -1.03 0.00 0.00 178.44 177.33 1bzh h GLU 101 N -0.68 0.00 -0.01 2.65 5.08 -0.42 -2.81 114.58 118.39 1bzh h GLU 101 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1bzh h GLU 101 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1bzh h GLU 101 CO 0.11 0.24 -0.04 1.04 -1.00 0.00 0.00 179.01 179.36 1bzh n GLN 102 N -3.61 1.52 -2.17 2.33 1.13 0.53 -4.91 117.38 112.20 1bzh n GLN 102 Ca -0.01 -0.87 -0.18 0.00 -1.94 0.00 0.00 57.00 54.00 1bzh n GLN 102 Cb 0.37 -1.48 -0.02 0.00 0.11 0.00 0.00 30.24 29.22 1bzh n GLN 102 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1bzh n LYS 103 N 0.02 -1.43 -2.16 -1.09 5.02 -1.06 -3.59 118.16 113.85 1bzh n LYS 103 Ca 0.18 0.95 -0.41 0.00 -2.02 0.00 0.00 58.31 57.02 1bzh n LYS 103 Cb 0.35 -5.43 -0.02 0.00 -0.02 0.00 0.00 35.03 29.91 1bzh n LYS 103 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1bzh s SER 104 N -2.31 6.84 -0.17 4.39 0.01 -0.77 -0.65 113.70 121.04 1bzh s SER 104 Ca 0.00 2.59 0.11 0.00 1.31 0.00 0.00 55.95 59.96 1bzh s SER 104 Cb 0.00 -2.64 -0.23 0.00 0.21 0.00 0.00 66.02 63.36 1bzh s SER 104 CO 0.00 -0.50 0.17 -1.14 0.41 0.00 0.00 173.24 172.18 1bzh n ARG 105 N 1.29 0.68 -4.30 12.44 3.00 -1.26 -4.85 116.66 123.66 1bzh n ARG 105 Ca 0.01 0.12 -0.24 0.00 -0.00 0.00 0.00 57.85 57.75 1bzh n ARG 105 Cb 0.42 -1.60 -0.12 0.00 0.00 0.00 0.00 32.46 31.16 1bzh n ARG 105 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1bzh s GLY 106 N -5.64 1.27 -0.08 5.14 0.00 -1.26 -0.56 107.32 106.20 1bzh s GLY 106 Ca -0.16 -1.28 0.01 0.00 0.00 0.00 0.00 44.72 43.29 1bzh s GLY 106 CO 0.77 -1.29 -0.10 0.14 0.00 0.00 0.00 173.10 172.62 1bzh s VAL 107 N -1.26 1.07 -0.22 1.40 1.01 -0.55 -1.85 120.40 120.00 1bzh s VAL 107 Ca 0.08 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.65 1bzh s VAL 107 Cb -0.10 -1.01 0.02 0.00 0.00 0.00 0.00 36.38 35.29 1bzh s VAL 107 CO 0.05 0.35 -0.10 -0.69 0.00 0.00 0.00 175.10 174.71 1bzh s VAL 108 N 0.98 2.69 -0.21 2.92 1.01 0.14 0.03 120.40 127.95 1bzh s VAL 108 Ca -0.09 -0.94 -0.05 0.00 0.00 0.00 0.00 61.98 60.90 1bzh s VAL 108 Cb -0.15 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.92 1bzh s VAL 108 CO 0.00 0.32 -0.01 -0.32 0.00 0.00 0.00 175.10 175.10 1bzh s MET 109 N 1.33 3.54 0.00 2.72 0.00 0.19 -0.47 119.30 126.61 1bzh s MET 109 Ca 0.02 -0.55 0.18 0.00 0.00 0.00 0.00 55.69 55.34 1bzh s MET 109 Cb -0.15 -3.09 0.44 0.00 0.00 0.00 0.00 34.83 32.03 1bzh s MET 109 CO -0.07 -0.09 1.36 1.28 0.00 0.00 0.00 175.02 177.51 1bzh n LEU 110 N 4.53 3.37 0.00 4.11 4.77 0.42 -0.90 117.00 133.31 1bzh n LEU 110 Ca -0.17 -1.78 -0.19 0.00 -0.03 0.00 0.00 56.01 53.84 1bzh n LEU 110 Cb 0.51 -0.31 -0.05 0.00 -2.33 0.00 0.00 43.42 41.24 1bzh n LEU 110 CO 0.30 0.80 -0.12 -0.46 -1.33 0.00 0.00 177.39 176.58 1bzh n ASN 111 N 1.20 1.34 -4.47 -1.43 0.23 -1.26 -4.76 115.26 106.11 1bzh n ASN 111 Ca 0.18 -2.58 -0.30 0.00 -0.53 0.00 0.00 54.58 51.35 1bzh n ASN 111 Cb 0.54 0.70 -0.12 0.00 -2.08 0.00 0.00 39.78 38.82 1bzh n ASN 111 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1bzh s ARG 112 N -3.15 1.82 0.45 -3.83 0.52 -1.26 -4.81 118.95 108.68 1bzh s ARG 112 Ca 0.14 -1.15 0.22 0.00 -0.52 0.00 0.00 55.73 54.42 1bzh s ARG 112 Cb 0.01 -2.11 1.21 0.00 0.52 0.00 0.00 34.95 34.58 1bzh s ARG 112 CO 0.10 0.49 1.84 0.28 0.02 0.00 0.00 175.30 178.03 1bzh h VAL 113 N 3.68 0.60 -3.37 3.52 2.07 -1.92 -3.38 116.25 117.45 1bzh h VAL 113 Ca -0.49 -0.10 -0.67 0.00 0.82 0.00 0.00 66.70 66.26 1bzh h VAL 113 Cb 1.16 0.29 -0.31 0.00 -1.52 0.00 0.00 31.29 30.92 1bzh h VAL 113 CO 0.46 0.05 -0.84 -0.04 0.02 0.00 0.00 177.57 177.22 1bzh s MET 114 N -5.31 3.14 -0.14 1.57 1.00 -1.26 -0.82 119.30 117.49 1bzh s MET 114 Ca -0.07 -0.81 -0.12 0.00 0.00 0.00 0.00 55.69 54.69 1bzh s MET 114 Cb 0.23 -2.41 0.04 0.00 0.00 0.00 0.00 34.83 32.69 1bzh s MET 114 CO 0.78 0.21 0.37 -1.21 0.00 0.00 0.00 175.02 175.17 1bzh s GLU 115 N 0.31 0.41 -1.74 2.03 2.02 0.10 -4.90 118.70 116.94 1bzh s GLU 115 Ca -0.15 0.55 0.00 0.00 0.02 0.00 0.00 54.97 55.39 1bzh s GLU 115 Cb -0.17 0.16 0.00 0.00 0.10 0.00 0.00 34.13 34.22 1bzh s GLU 115 CO 0.08 -0.07 0.00 1.63 0.02 0.00 0.00 175.26 176.91 1bzh n LYS 116 N 3.14 -1.72 -0.95 1.61 5.02 -1.26 -1.16 118.16 122.84 1bzh n LYS 116 Ca -0.15 0.98 0.00 0.00 -2.02 0.00 0.00 58.31 57.12 1bzh n LYS 116 Cb 0.57 -5.60 0.00 0.00 -0.02 0.00 0.00 35.03 29.98 1bzh n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bzh n GLY 117 N -0.89 0.90 3.30 0.72 0.00 -1.26 -5.01 105.19 102.94 1bzh n GLY 117 Ca -0.23 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.60 1bzh n GLY 117 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1bzh s SER 118 N -2.83 2.36 -0.16 1.61 0.15 -0.31 -5.11 113.70 109.40 1bzh s SER 118 Ca 0.00 -0.91 -0.29 0.00 0.70 0.00 0.00 55.95 55.45 1bzh s SER 118 Cb 0.00 -0.11 -0.01 0.00 -1.71 0.00 0.00 66.02 64.19 1bzh s SER 118 CO 0.00 -0.14 1.20 -0.76 1.20 0.00 0.00 173.24 174.75 1bzh s LEU 119 N -2.85 4.18 0.00 3.45 1.43 -1.26 0.00 118.68 123.62 1bzh s LEU 119 Ca 0.16 1.64 0.17 0.00 -1.03 0.00 0.00 54.13 55.07 1bzh s LEU 119 Cb -0.03 -3.54 0.16 0.00 0.03 0.00 0.00 46.19 42.81 1bzh s LEU 119 CO 0.05 -0.71 1.07 0.29 0.23 0.00 0.00 176.35 177.27 1bzh n LYS 120 N 6.35 1.48 0.00 1.70 4.76 -0.00 -4.93 118.16 127.52 1bzh n LYS 120 Ca 0.13 -1.58 0.00 0.00 -2.87 0.00 0.00 58.31 53.99 1bzh n LYS 120 Cb 0.45 -1.34 0.00 0.00 -1.84 0.00 0.00 35.03 32.31 1bzh n LYS 120 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1bzh s ALA 122 N -1.57 2.65 -1.22 0.00 0.00 0.52 -4.63 121.76 117.52 1bzh s ALA 122 Ca 0.00 -0.50 -0.18 0.00 0.00 0.00 0.00 51.96 51.28 1bzh s ALA 122 Cb 0.00 -3.00 0.09 0.00 0.00 0.00 0.00 23.12 20.21 1bzh s ALA 122 CO 0.00 -1.53 1.60 -1.14 0.00 0.00 0.00 175.76 174.69 1bzh s GLN 123 N -5.45 3.93 0.00 0.00 2.00 -1.26 -4.77 119.66 114.11 1bzh s GLN 123 Ca 0.61 -1.98 0.28 0.00 -2.00 0.00 0.00 55.36 52.27 1bzh s GLN 123 Cb -0.11 -5.38 1.11 0.00 0.80 0.00 0.00 33.01 29.43 1bzh s GLN 123 CO 0.51 -2.12 1.78 2.48 -0.50 0.00 0.00 175.29 177.44 1bzh n TYR 124 N 7.79 0.00 -4.23 1.67 0.18 -1.26 -4.83 117.16 116.47 1bzh n TYR 124 Ca 0.43 0.00 -0.19 0.00 1.88 0.00 0.00 57.90 60.02 1bzh n TYR 124 Cb 0.46 -0.02 -0.11 0.00 -0.38 0.00 0.00 39.34 39.28 1bzh n TYR 124 CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 1bzh s TRP 125 N -2.09 1.41 -0.07 -3.48 -2.14 -1.26 -5.04 118.94 106.27 1bzh s TRP 125 Ca 0.37 -0.53 -0.30 0.00 2.66 0.00 0.00 56.10 58.30 1bzh s TRP 125 Cb 0.21 -0.74 -0.03 0.00 -3.10 0.00 0.00 33.47 29.80 1bzh s TRP 125 CO 0.37 0.14 1.23 -1.25 -2.66 0.00 0.00 176.95 174.78 1bzh s PRO 126 N -2.47 4.32 0.31 3.25 0.04 -1.26 -4.92 135.00 134.27 1bzh s PRO 126 Ca 0.07 1.70 0.25 0.00 0.04 0.00 0.00 61.00 63.07 1bzh s PRO 126 Cb -0.06 -3.60 0.74 0.00 0.04 0.00 0.00 34.50 31.62 1bzh s PRO 126 CO 0.03 -0.51 1.74 1.96 0.04 0.00 0.00 177.00 180.26 1bzh h GLN 127 N 7.63 0.00 -5.04 4.56 4.20 -1.97 -3.41 115.11 121.08 1bzh h GLN 127 Ca -0.33 0.00 -0.47 0.00 0.06 0.00 0.00 58.65 57.90 1bzh h GLN 127 Cb 1.15 0.00 -0.30 0.00 0.30 0.00 0.00 27.48 28.63 1bzh h GLN 127 CO 0.90 0.00 -0.81 0.15 -0.67 0.00 0.00 178.83 178.40 1bzh s LYS 128 N -3.20 1.17 0.24 1.46 1.02 -1.26 -5.03 119.74 114.14 1bzh s LYS 128 Ca 0.08 -0.45 -0.04 0.00 0.02 0.00 0.00 55.97 55.58 1bzh s LYS 128 Cb 0.10 -1.09 0.41 0.00 -0.52 0.00 0.00 37.83 36.73 1bzh s LYS 128 CO 0.59 0.23 1.78 0.93 -0.92 0.00 0.00 175.35 177.96 1bzh h GLU 129 N 6.06 0.65 0.00 1.68 3.07 -1.87 -1.27 114.58 122.90 1bzh h GLU 129 Ca -0.33 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 58.48 1bzh h GLU 129 Cb 1.17 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 28.93 1bzh h GLU 129 CO 0.49 0.43 -0.03 0.93 -1.40 0.00 0.00 179.01 179.43 1bzh h GLU 130 N 0.67 0.00 -3.31 2.33 3.07 -1.96 -3.38 114.58 112.01 1bzh h GLU 130 Ca 0.40 0.00 -0.71 0.00 -0.50 0.00 0.00 59.36 58.55 1bzh h GLU 130 Cb 0.45 0.00 -0.35 0.00 -0.84 0.00 0.00 28.75 28.01 1bzh h GLU 130 CO -0.29 0.03 -0.03 1.63 -1.40 0.00 0.00 179.01 178.95 1bzh n LYS 131 N -3.13 2.75 -1.25 2.33 5.02 -0.48 -5.06 118.16 118.34 1bzh n LYS 131 Ca 0.01 -4.48 -0.31 0.00 -2.02 0.00 0.00 58.31 51.51 1bzh n LYS 131 Cb 0.36 -2.42 0.09 0.00 -0.02 0.00 0.00 35.03 33.04 1bzh n LYS 131 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1bzh s GLU 132 N -1.43 2.18 -0.05 1.97 1.03 -1.26 -4.58 118.70 116.57 1bzh s GLU 132 Ca 0.28 1.22 0.03 0.00 0.03 0.00 0.00 54.97 56.54 1bzh s GLU 132 Cb -0.07 -1.88 -0.03 0.00 -0.80 0.00 0.00 34.13 31.35 1bzh s GLU 132 CO -0.12 -1.71 -0.12 -1.64 -1.33 0.00 0.00 175.26 170.34 1bzh s MET 133 N -4.81 2.56 -0.14 -4.83 -1.94 0.14 -4.96 119.30 105.31 1bzh s MET 133 Ca 0.62 -0.66 0.01 0.00 -1.71 0.00 0.00 55.69 53.95 1bzh s MET 133 Cb -0.18 -2.43 -0.01 0.00 2.01 0.00 0.00 34.83 34.22 1bzh s MET 133 CO 0.55 0.63 -0.16 0.42 -0.01 0.00 0.00 175.02 176.46 1bzh s ILE 134 N -0.76 2.70 -0.53 2.53 1.01 -1.26 0.69 121.20 125.57 1bzh s ILE 134 Ca 0.12 -0.77 -0.17 0.00 0.00 0.00 0.00 60.65 59.83 1bzh s ILE 134 Cb -0.11 -2.13 0.10 0.00 0.01 0.00 0.00 42.46 40.34 1bzh s ILE 134 CO 0.01 0.52 0.54 -0.36 0.00 0.00 0.00 174.94 175.65 1bzh s PHE 135 N 0.63 3.16 -0.02 3.97 0.08 0.20 -4.93 117.98 121.08 1bzh s PHE 135 Ca -0.08 -1.00 -0.23 0.00 0.12 0.00 0.00 56.93 55.73 1bzh s PHE 135 Cb -0.16 -3.64 -0.20 0.00 -0.57 0.00 0.00 43.02 38.45 1bzh s PHE 135 CO 0.03 -1.03 1.16 1.49 -0.10 0.00 0.00 175.22 176.77 1bzh h GLU 136 N 8.94 0.21 -0.93 0.44 4.57 -1.96 0.81 114.58 126.66 1bzh h GLU 136 Ca -0.29 -0.17 0.23 0.00 -1.18 0.00 0.00 59.36 57.95 1bzh h GLU 136 Cb 1.10 0.03 -0.12 0.00 -0.16 0.00 0.00 28.75 29.60 1bzh h GLU 136 CO 1.00 0.81 0.46 0.38 -1.18 0.00 0.00 179.01 180.48 1bzh h ASP 137 N -0.33 0.45 0.00 1.04 2.03 -1.97 -1.86 116.42 115.78 1bzh h ASP 137 Ca -0.01 0.15 0.00 0.00 -0.73 0.00 0.00 57.03 56.44 1bzh h ASP 137 Cb 0.84 0.10 0.00 0.00 -0.83 0.00 0.00 39.33 39.43 1bzh h ASP 137 CO 0.04 0.04 -0.81 0.41 -1.03 0.00 0.00 179.24 177.89 1bzh n THR 138 N -4.99 0.00 -3.09 1.15 -1.04 -1.17 -5.01 114.28 100.12 1bzh n THR 138 Ca 0.24 -0.10 -0.13 0.00 -2.04 0.00 0.00 64.05 62.02 1bzh n THR 138 Cb 0.68 1.00 0.07 0.00 -1.82 0.00 0.00 70.33 70.26 1bzh n THR 138 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1bzh n ASN 139 N -1.40 -2.52 -4.29 8.00 5.15 0.27 -4.94 115.26 115.53 1bzh n ASN 139 Ca 0.03 -0.50 -0.26 0.00 -0.60 0.00 0.00 54.58 53.25 1bzh n ASN 139 Cb 0.27 -4.16 -0.14 0.00 -0.53 0.00 0.00 39.78 35.22 1bzh n ASN 139 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1bzh s LEU 140 N -5.36 2.21 -0.07 1.20 1.43 -0.62 -1.77 118.68 115.70 1bzh s LEU 140 Ca 0.05 -0.59 0.02 0.00 -1.03 0.00 0.00 54.13 52.58 1bzh s LEU 140 Cb -0.01 -1.04 -0.02 0.00 0.03 0.00 0.00 46.19 45.15 1bzh s LEU 140 CO 0.58 0.16 -0.13 -0.75 0.23 0.00 0.00 176.35 176.44 1bzh s LYS 141 N -1.43 2.73 -0.09 1.70 2.20 0.34 0.60 119.74 125.79 1bzh s LYS 141 Ca 0.09 -0.67 0.00 0.00 -0.36 0.00 0.00 55.97 55.03 1bzh s LYS 141 Cb -0.09 -2.47 0.02 0.00 -1.51 0.00 0.00 37.83 33.78 1bzh s LYS 141 CO 0.03 0.54 -0.06 -1.17 -0.36 0.00 0.00 175.35 174.33 1bzh s LEU 142 N -0.52 1.15 -0.05 5.43 2.96 0.22 0.27 118.68 128.14 1bzh s LEU 142 Ca 0.07 -0.23 0.02 0.00 -0.22 0.00 0.00 54.13 53.78 1bzh s LEU 142 Cb -0.12 -0.70 0.01 0.00 0.50 0.00 0.00 46.19 45.89 1bzh s LEU 142 CO 0.02 -0.10 -0.11 -0.89 -1.32 0.00 0.00 176.35 173.95 1bzh s THR 143 N 1.48 1.00 -0.20 3.68 2.01 0.34 0.24 115.64 124.19 1bzh s THR 143 Ca -0.01 -0.43 -0.29 0.00 0.31 0.00 0.00 61.69 61.27 1bzh s THR 143 Cb -0.13 -0.91 0.00 0.00 0.01 0.00 0.00 72.50 71.47 1bzh s THR 143 CO -0.04 0.32 1.12 -0.22 -0.69 0.00 0.00 174.62 175.10 1bzh s LEU 144 N 0.48 4.14 -0.19 4.42 2.96 -1.26 0.29 118.68 129.52 1bzh s LEU 144 Ca -0.10 1.50 -0.09 0.00 -0.22 0.00 0.00 54.13 55.23 1bzh s LEU 144 Cb -0.13 -3.54 -0.21 0.00 0.50 0.00 0.00 46.19 42.81 1bzh s LEU 144 CO 0.02 -0.70 0.13 -0.38 -1.32 0.00 0.00 176.35 174.11 1bzh n ILE 145 N 5.31 1.64 -3.66 6.68 2.08 0.26 -4.33 119.36 127.35 1bzh n ILE 145 Ca 0.13 -0.47 -0.06 0.00 0.56 0.00 0.00 62.75 62.90 1bzh n ILE 145 Cb 0.46 -1.75 -0.02 0.00 -0.75 0.00 0.00 39.64 37.58 1bzh n ILE 145 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 1bzh s SER 146 N -6.95 -0.28 0.03 4.38 1.04 -0.97 -5.00 113.70 105.96 1bzh s SER 146 Ca -0.28 -0.26 -0.05 0.00 0.48 0.00 0.00 55.95 55.84 1bzh s SER 146 Cb 0.08 0.49 -0.01 0.00 0.10 0.00 0.00 66.02 66.68 1bzh s SER 146 CO 0.67 -0.87 0.08 -1.83 0.98 0.00 0.00 173.24 172.27 1bzh s GLU 147 N -3.34 0.54 -0.39 4.02 -1.05 -1.26 0.31 118.70 117.53 1bzh s GLU 147 Ca 0.09 -0.69 0.01 0.00 -0.15 0.00 0.00 54.97 54.22 1bzh s GLU 147 Cb -0.02 0.21 0.13 0.00 -0.44 0.00 0.00 34.13 34.01 1bzh s GLU 147 CO -0.02 -0.13 0.19 0.34 0.95 0.00 0.00 175.26 176.59 1bzh s ASP 148 N -1.95 3.63 -0.33 0.83 2.15 0.30 -4.96 116.67 116.35 1bzh s ASP 148 Ca -0.08 -2.27 -0.29 0.00 0.43 0.00 0.00 52.55 50.35 1bzh s ASP 148 Cb -0.03 -0.87 0.01 0.00 -0.30 0.00 0.00 42.92 41.73 1bzh s ASP 148 CO -0.03 -0.32 1.23 -0.63 -0.17 0.00 0.00 175.17 175.25 1bzh s ILE 149 N 0.84 4.24 0.51 4.11 1.01 -1.26 -1.88 121.20 128.77 1bzh s ILE 149 Ca 0.15 1.39 0.05 0.00 0.00 0.00 0.00 60.65 62.25 1bzh s ILE 149 Cb -0.22 -4.28 0.05 0.00 0.01 0.00 0.00 42.46 38.02 1bzh s ILE 149 CO -0.07 -0.55 0.43 0.29 0.00 0.00 0.00 174.94 175.04 1bzh n LYS 150 N 7.28 0.73 0.02 2.79 4.76 0.03 -5.01 118.16 128.76 1bzh n LYS 150 Ca 0.14 -3.11 -0.06 0.00 -2.87 0.00 0.00 58.31 52.40 1bzh n LYS 150 Cb 0.47 0.25 0.13 0.00 -1.84 0.00 0.00 35.03 34.04 1bzh n LYS 150 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 1bzh h SER 151 N 0.53 0.50 -0.01 4.39 0.02 -1.95 -3.34 113.55 113.70 1bzh h SER 151 Ca -0.31 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 1bzh h SER 151 Cb 1.16 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.56 1bzh h SER 151 CO 0.48 0.88 -0.08 0.00 -1.14 0.00 0.00 176.83 176.97 1bzh n TYR 152 N -4.01 0.00 -3.62 3.45 4.11 -1.26 -4.85 117.16 110.98 1bzh n TYR 152 Ca -0.02 0.00 -0.10 0.00 -0.00 0.00 0.00 57.90 57.78 1bzh n TYR 152 Cb 0.53 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.83 1bzh n TYR 152 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.86 178.38 1bzh s TYR 153 N -0.83 -0.29 -0.05 -3.48 1.13 -1.25 -1.92 117.35 110.66 1bzh s TYR 153 Ca 0.06 -0.02 0.03 0.00 -1.41 0.00 0.00 57.07 55.73 1bzh s TYR 153 Cb 0.05 0.46 0.01 0.00 -1.10 0.00 0.00 41.96 41.38 1bzh s TYR 153 CO 0.13 -0.89 -0.12 0.99 -2.51 0.00 0.00 175.55 173.14 1bzh s THR 154 N -3.82 1.07 -0.21 -3.49 2.01 -0.19 -0.79 115.64 110.22 1bzh s THR 154 Ca 0.06 -0.47 -0.05 0.00 0.31 0.00 0.00 61.69 61.54 1bzh s THR 154 Cb -0.01 -0.97 -0.02 0.00 0.01 0.00 0.00 72.50 71.51 1bzh s THR 154 CO -0.07 0.33 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.49 1bzh s VAL 155 N 0.49 3.76 0.02 3.82 1.01 -0.79 -0.89 120.40 127.83 1bzh s VAL 155 Ca -0.11 -0.37 0.06 0.00 0.00 0.00 0.00 61.98 61.56 1bzh s VAL 155 Cb -0.14 -2.71 -0.03 0.00 0.00 0.00 0.00 36.38 33.51 1bzh s VAL 155 CO 0.03 0.42 -0.14 -0.13 0.00 0.00 0.00 175.10 175.27 1bzh s ARG 156 N 1.21 2.25 -0.43 2.72 0.52 0.44 0.11 118.95 125.77 1bzh s ARG 156 Ca 0.03 -0.88 -0.10 0.00 -0.52 0.00 0.00 55.73 54.26 1bzh s ARG 156 Cb -0.15 -2.29 0.08 0.00 0.52 0.00 0.00 34.95 33.11 1bzh s ARG 156 CO 0.00 0.56 0.28 -1.14 0.02 0.00 0.00 175.30 175.03 1bzh s GLN 157 N -1.37 2.64 0.12 3.54 0.74 0.15 -0.08 119.66 125.41 1bzh s GLN 157 Ca 0.15 -1.47 0.03 0.00 0.05 0.00 0.00 55.36 54.13 1bzh s GLN 157 Cb -0.11 -3.84 -0.04 0.00 1.10 0.00 0.00 33.01 30.13 1bzh s GLN 157 CO 0.06 -0.98 0.15 -0.51 -0.55 0.00 0.00 175.29 173.46 1bzh s LEU 158 N 1.45 3.98 -0.22 3.68 1.43 -0.37 0.93 118.68 129.55 1bzh s LEU 158 Ca 0.03 0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.17 1bzh s LEU 158 Cb -0.23 -2.60 0.05 0.00 0.03 0.00 0.00 46.19 43.43 1bzh s LEU 158 CO 0.02 0.11 -0.13 -0.70 0.23 0.00 0.00 176.35 175.89 1bzh s GLU 159 N -2.81 2.32 -0.23 1.70 2.12 0.15 -0.09 118.70 121.86 1bzh s GLU 159 Ca 0.32 -1.08 -0.09 0.00 0.36 0.00 0.00 54.97 54.47 1bzh s GLU 159 Cb -0.11 -2.68 -0.04 0.00 0.26 0.00 0.00 34.13 31.55 1bzh s GLU 159 CO 0.24 -0.45 0.12 -1.17 -0.54 0.00 0.00 175.26 173.46 1bzh s LEU 160 N 1.24 3.92 -0.15 2.70 2.96 -0.03 -0.51 118.68 128.81 1bzh s LEU 160 Ca -0.04 0.05 0.02 0.00 -0.22 0.00 0.00 54.13 53.94 1bzh s LEU 160 Cb -0.17 -2.04 0.01 0.00 0.50 0.00 0.00 46.19 44.48 1bzh s LEU 160 CO -0.08 0.08 -0.19 -0.70 -1.32 0.00 0.00 176.35 174.14 1bzh s GLU 161 N 0.98 3.10 -0.56 1.98 2.12 0.14 -0.51 118.70 125.95 1bzh s GLU 161 Ca 0.06 -0.81 -0.27 0.00 0.36 0.00 0.00 54.97 54.31 1bzh s GLU 161 Cb -0.14 -2.52 0.03 0.00 0.26 0.00 0.00 34.13 31.77 1bzh s GLU 161 CO 0.03 -0.00 1.08 1.21 -0.54 0.00 0.00 175.26 177.04 1bzh s ASN 162 N 0.82 6.42 0.42 -1.70 2.47 0.14 -0.50 114.94 123.01 1bzh s ASN 162 Ca -0.06 -0.05 0.12 0.00 0.42 0.00 0.00 52.86 53.29 1bzh s ASN 162 Cb -0.15 -2.50 0.91 0.00 -1.45 0.00 0.00 41.25 38.05 1bzh s ASN 162 CO -0.01 -1.35 1.97 -0.07 -3.72 0.00 0.00 177.10 173.92 1bzh h LEU 163 N 11.46 0.15 -0.01 3.21 3.38 -1.63 -1.50 115.31 130.37 1bzh h LEU 163 Ca -0.25 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.69 1bzh h LEU 163 Cb 1.06 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 1bzh h LEU 163 CO 1.14 0.28 0.01 0.74 0.09 0.00 0.00 178.44 180.69 1bzh h THR 164 N 0.16 1.06 -0.35 0.22 2.02 -1.90 -3.29 112.91 110.83 1bzh h THR 164 Ca 0.03 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 67.03 1bzh h THR 164 Cb 0.29 1.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1bzh h THR 164 CO 0.02 0.05 0.00 0.35 0.37 0.00 0.00 175.52 176.31 1bzh n THR 165 N -5.04 0.45 -3.39 3.16 -2.24 -1.03 -4.95 114.28 101.24 1bzh n THR 165 Ca -0.07 -0.71 -0.25 0.00 -2.27 0.00 0.00 64.05 60.75 1bzh n THR 165 Cb 0.06 1.00 0.02 0.00 -2.10 0.00 0.00 70.33 69.32 1bzh n THR 165 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bzh n GLN 166 N 1.45 -4.77 -5.15 -0.78 6.02 -0.59 -4.96 117.38 108.60 1bzh n GLN 166 Ca 0.19 0.68 -0.31 0.00 -0.01 0.00 0.00 57.00 57.55 1bzh n GLN 166 Cb 0.60 -5.51 -0.15 0.00 1.02 0.00 0.00 30.24 26.19 1bzh n GLN 166 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1bzh s GLU 167 N -6.07 2.11 0.05 -1.09 2.12 -1.16 -4.99 118.70 109.67 1bzh s GLU 167 Ca 0.44 -0.93 0.06 0.00 0.36 0.00 0.00 54.97 54.90 1bzh s GLU 167 Cb -0.22 -2.08 -0.02 0.00 0.26 0.00 0.00 34.13 32.06 1bzh s GLU 167 CO 0.55 0.56 -0.17 0.95 -0.54 0.00 0.00 175.26 176.61 1bzh s THR 168 N -0.68 1.32 0.09 -1.70 -4.23 -1.26 -0.68 115.64 108.51 1bzh s THR 168 Ca 0.11 -1.12 0.04 0.00 -1.18 0.00 0.00 61.69 59.54 1bzh s THR 168 Cb -0.10 -1.18 -0.03 0.00 1.34 0.00 0.00 72.50 72.52 1bzh s THR 168 CO 0.00 0.05 -0.11 -0.13 -0.54 0.00 0.00 174.62 173.89 1bzh s ARG 169 N -1.24 0.85 -0.21 3.99 0.52 0.33 -4.99 118.95 118.19 1bzh s ARG 169 Ca 0.03 -1.13 -0.08 0.00 -0.52 0.00 0.00 55.73 54.03 1bzh s ARG 169 Cb -0.08 -0.58 -0.04 0.00 0.52 0.00 0.00 34.95 34.76 1bzh s ARG 169 CO 0.02 0.10 0.10 -2.00 0.02 0.00 0.00 175.30 173.53 1bzh s GLU 170 N -2.62 3.96 -0.15 3.54 2.12 -1.26 -0.85 118.70 123.43 1bzh s GLU 170 Ca 0.04 -0.34 -0.01 0.00 0.36 0.00 0.00 54.97 55.02 1bzh s GLU 170 Cb -0.04 -3.34 -0.01 0.00 0.26 0.00 0.00 34.13 30.99 1bzh s GLU 170 CO 0.01 0.13 -0.11 0.42 -0.54 0.00 0.00 175.26 175.16 1bzh s ILE 171 N 0.80 3.11 -0.11 -3.70 -1.09 0.86 -4.87 121.20 116.21 1bzh s ILE 171 Ca 0.05 -0.63 -0.19 0.00 -2.23 0.00 0.00 60.65 57.65 1bzh s ILE 171 Cb -0.13 -2.33 -0.04 0.00 -1.58 0.00 0.00 42.46 38.38 1bzh s ILE 171 CO 0.02 0.50 0.51 -0.76 -1.23 0.00 0.00 174.94 173.99 1bzh s LEU 172 N 0.61 4.28 -0.28 2.97 1.43 0.28 -1.24 118.68 126.73 1bzh s LEU 172 Ca -0.07 0.86 -0.07 0.00 -1.03 0.00 0.00 54.13 53.82 1bzh s LEU 172 Cb -0.15 -2.75 -0.01 0.00 0.03 0.00 0.00 46.19 43.31 1bzh s LEU 172 CO 0.03 -0.02 0.09 -2.28 0.23 0.00 0.00 176.35 174.40 1bzh s HIS 173 N 0.67 3.13 -0.35 0.29 2.46 0.89 -1.48 115.29 120.90 1bzh s HIS 173 Ca 0.28 -0.74 -0.11 0.00 0.47 0.00 0.00 55.06 54.96 1bzh s HIS 173 Cb -0.15 -2.27 0.01 0.00 -0.13 0.00 0.00 32.58 30.04 1bzh s HIS 173 CO 0.11 -0.49 0.19 -0.06 -2.47 0.00 0.00 174.74 172.03 1bzh s PHE 174 N 1.55 3.21 -0.37 3.88 0.08 0.10 -0.42 117.98 126.03 1bzh s PHE 174 Ca 0.04 -0.70 0.04 0.00 0.12 0.00 0.00 56.93 56.43 1bzh s PHE 174 Cb -0.16 -2.42 0.10 0.00 -0.57 0.00 0.00 43.02 39.97 1bzh s PHE 174 CO 0.03 -0.53 0.09 -1.58 -0.10 0.00 0.00 175.22 173.12 1bzh s HIS 175 N 1.60 3.69 -0.34 0.36 2.46 -0.07 0.55 115.29 123.55 1bzh s HIS 175 Ca 0.04 -3.00 -0.29 0.00 0.47 0.00 0.00 55.06 52.28 1bzh s HIS 175 Cb -0.18 -2.93 -0.00 0.00 -0.13 0.00 0.00 32.58 29.34 1bzh s HIS 175 CO 0.07 -0.93 1.43 -0.47 -2.47 0.00 0.00 174.74 172.38 1bzh s TYR 176 N 0.76 2.41 -1.29 3.88 5.04 -0.07 -1.02 117.35 127.07 1bzh s TYR 176 Ca 0.12 0.72 0.23 0.00 -2.44 0.00 0.00 57.07 55.69 1bzh s TYR 176 Cb -0.20 -4.11 0.07 0.00 0.35 0.00 0.00 41.96 38.07 1bzh s TYR 176 CO -0.07 -2.10 1.12 0.25 -1.34 0.00 0.00 175.55 173.41 1bzh n THR 177 N 6.70 0.00 -0.07 4.34 -2.24 -0.81 -4.08 114.28 118.13 1bzh n THR 177 Ca 0.17 -0.07 0.09 0.00 -2.27 0.00 0.00 64.05 61.97 1bzh n THR 177 Cb 0.47 0.83 0.21 0.00 -2.10 0.00 0.00 70.33 69.74 1bzh n THR 177 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1bzh n THR 178 N -1.11 0.79 -1.76 4.28 -2.24 -1.21 -4.92 114.28 108.11 1bzh n THR 178 Ca 0.06 -0.89 -0.42 0.00 -2.27 0.00 0.00 64.05 60.53 1bzh n THR 178 Cb 0.36 0.68 -0.03 0.00 -2.10 0.00 0.00 70.33 69.24 1bzh n THR 178 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1bzh s TRP 179 N -1.10 2.51 0.82 4.78 -0.11 -1.26 -4.94 118.94 119.64 1bzh s TRP 179 Ca 0.33 0.19 -0.11 0.00 1.22 0.00 0.00 56.10 57.73 1bzh s TRP 179 Cb 0.18 -4.13 0.09 0.00 -1.50 0.00 0.00 33.47 28.12 1bzh s TRP 179 CO 0.24 -4.47 1.14 -1.25 -4.62 0.00 0.00 176.95 167.99 1bzh s PRO 180 N 2.06 1.70 0.36 5.86 0.04 -1.26 -4.94 135.00 138.83 1bzh s PRO 180 Ca 0.77 1.47 0.06 0.00 0.04 0.00 0.00 61.00 63.35 1bzh s PRO 180 Cb -0.47 -1.81 0.70 0.00 0.04 0.00 0.00 34.50 32.96 1bzh s PRO 180 CO 0.34 -2.11 1.92 -0.44 0.04 0.00 0.00 177.00 176.74 1bzh h ASP 181 N -1.24 0.41 -4.46 6.66 5.19 -1.99 -3.44 116.42 117.55 1bzh h ASP 181 Ca -0.44 -0.07 -0.39 0.00 -0.62 0.00 0.00 57.03 55.51 1bzh h ASP 181 Cb 1.26 -0.11 -0.23 0.00 0.18 0.00 0.00 39.33 40.44 1bzh h ASP 181 CO 0.47 0.48 -0.77 -0.36 -3.12 0.00 0.00 179.24 175.93 1bzh s PHE 182 N -4.98 1.07 0.01 4.55 0.08 -1.26 -4.75 117.98 112.70 1bzh s PHE 182 Ca -0.07 -0.42 0.00 0.00 0.12 0.00 0.00 56.93 56.56 1bzh s PHE 182 Cb 0.16 -0.62 0.00 0.00 -0.57 0.00 0.00 43.02 41.99 1bzh s PHE 182 CO 0.75 0.02 0.00 0.41 -0.10 0.00 0.00 175.22 176.30 1bzh n GLY 183 N 1.59 -1.46 3.74 4.36 0.00 -1.26 -4.95 105.19 107.21 1bzh n GLY 183 Ca -0.20 -1.19 -0.26 0.00 0.00 0.00 0.00 46.02 44.37 1bzh n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1bzh s VAL 184 N -0.08 2.12 0.36 1.61 -7.23 -1.26 -4.69 120.40 111.23 1bzh s VAL 184 Ca 0.00 -1.74 -0.28 0.00 -1.81 0.00 0.00 61.98 58.15 1bzh s VAL 184 Cb 0.00 -2.86 -0.12 0.00 0.56 0.00 0.00 36.38 33.96 1bzh s VAL 184 CO 0.00 0.00 1.41 -2.65 -0.31 0.00 0.00 175.10 173.55 1bzh n PRO 185 N -1.25 2.46 0.22 4.82 -0.02 -1.26 -4.87 135.00 135.10 1bzh n PRO 185 Ca -0.03 0.86 0.05 0.00 -2.02 0.00 0.00 63.50 62.37 1bzh n PRO 185 Cb 0.65 -2.54 0.49 0.00 -0.02 0.00 0.00 33.50 32.08 1bzh n PRO 185 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1bzh h GLU 186 N 2.83 0.00 -6.41 -0.52 4.11 -2.00 -3.42 114.58 109.16 1bzh h GLU 186 Ca -0.49 0.00 -0.62 0.00 0.07 0.00 0.00 59.36 58.33 1bzh h GLU 186 Cb 1.26 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 30.27 1bzh h GLU 186 CO 0.64 0.23 -0.85 0.45 0.07 0.00 0.00 179.01 179.55 1bzh s SER 187 N -6.87 2.81 0.00 3.06 0.15 -1.26 -5.02 113.70 106.56 1bzh s SER 187 Ca -0.03 -0.65 0.29 0.00 0.70 0.00 0.00 55.95 56.26 1bzh s SER 187 Cb 0.15 -0.20 1.41 0.00 -1.71 0.00 0.00 66.02 65.67 1bzh s SER 187 CO 0.69 0.14 2.00 -0.81 1.20 0.00 0.00 173.24 176.46 1bzh n PRO 188 N 1.33 0.28 -0.20 5.44 -0.04 -1.26 -4.33 135.00 136.22 1bzh n PRO 188 Ca -0.18 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.19 1bzh n PRO 188 Cb 0.53 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.44 1bzh n PRO 188 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bzh h ALA 189 N 3.27 -0.42 -0.50 0.55 0.00 -1.95 0.04 119.26 120.25 1bzh h ALA 189 Ca 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1bzh h ALA 189 Cb 0.35 1.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 1bzh h ALA 189 CO 0.00 -0.87 0.07 0.77 0.00 0.00 0.00 179.25 179.22 1bzh h SER 190 N -0.25 0.79 -0.19 0.00 0.02 -1.88 -1.88 113.55 110.16 1bzh h SER 190 Ca 0.16 -0.27 0.03 0.00 -0.84 0.00 0.00 61.79 60.87 1bzh h SER 190 Cb 0.57 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.87 1bzh h SER 190 CO -0.68 0.86 0.03 0.15 -1.14 0.00 0.00 176.83 176.05 1bzh h PHE 191 N 0.70 0.05 -0.68 3.45 3.57 -1.74 0.18 116.94 122.47 1bzh h PHE 191 Ca 0.15 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.63 1bzh h PHE 191 Cb 0.41 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.12 1bzh h PHE 191 CO 0.03 0.01 0.30 -0.07 -2.23 0.00 0.00 178.31 176.35 1bzh h LEU 192 N 0.10 0.90 -0.52 0.59 3.38 -0.94 0.82 115.31 119.65 1bzh h LEU 192 Ca 0.08 -0.11 -0.16 0.00 0.09 0.00 0.00 57.88 57.78 1bzh h LEU 192 Cb 0.08 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1bzh h LEU 192 CO -0.12 0.78 -0.61 -1.13 0.09 0.00 0.00 178.44 177.46 1bzh h ASN 193 N 0.97 0.52 -0.32 -0.43 -0.73 -0.96 0.06 115.58 114.69 1bzh h ASN 193 Ca 0.23 -0.29 -0.03 0.00 1.87 0.00 0.00 56.30 58.08 1bzh h ASN 193 Cb 0.15 -0.15 -0.01 0.00 0.27 0.00 0.00 38.32 38.58 1bzh h ASN 193 CO -0.03 1.00 0.09 0.15 -0.37 0.00 0.00 177.43 178.27 1bzh h PHE 194 N 0.34 0.53 -0.72 0.67 3.57 0.32 -2.06 116.94 119.59 1bzh h PHE 194 Ca -0.01 -0.06 0.09 0.00 3.53 0.00 0.00 57.97 61.53 1bzh h PHE 194 Cb 1.15 -0.15 -0.07 0.00 2.79 0.00 0.00 35.95 39.67 1bzh h PHE 194 CO 0.04 0.54 0.36 1.25 -2.23 0.00 0.00 178.31 178.28 1bzh h LEU 195 N 0.36 0.48 -0.74 0.59 5.85 0.11 -1.80 115.31 120.16 1bzh h LEU 195 Ca 0.10 0.06 -0.13 0.00 0.84 0.00 0.00 57.88 58.75 1bzh h LEU 195 Cb 0.27 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1bzh h LEU 195 CO -0.00 0.27 -0.41 -0.26 -0.34 0.00 0.00 178.44 177.70 1bzh h PHE 196 N 0.62 0.57 -0.58 1.25 0.04 -0.72 -1.45 116.94 116.67 1bzh h PHE 196 Ca 0.35 -0.16 -0.06 0.00 2.80 0.00 0.00 57.97 60.90 1bzh h PHE 196 Cb 0.37 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 38.37 1bzh h PHE 196 CO -0.10 0.81 0.12 0.87 -0.60 0.00 0.00 178.31 179.41 1bzh h LYS 197 N 0.40 0.91 0.11 1.51 1.79 -0.79 0.36 116.57 120.86 1bzh h LYS 197 Ca 0.03 -0.20 -0.00 0.00 -2.18 0.00 0.00 60.65 58.30 1bzh h LYS 197 Cb 0.89 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.41 1bzh h LYS 197 CO 0.08 0.83 -0.05 0.28 -1.08 0.00 0.00 179.45 179.50 1bzh h VAL 198 N 0.87 0.89 -0.76 0.50 2.07 -1.08 -0.60 116.25 118.14 1bzh h VAL 198 Ca 0.19 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.76 1bzh h VAL 198 Cb 0.34 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 30.94 1bzh h VAL 198 CO 0.00 0.00 0.46 0.03 0.02 0.00 0.00 177.57 178.08 1bzh h ARG 199 N -0.15 0.83 -0.39 1.57 3.08 -0.84 -2.87 114.38 115.61 1bzh h ARG 199 Ca -0.01 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 59.92 1bzh h ARG 199 Cb 0.12 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 1bzh h ARG 199 CO 0.02 0.55 -0.06 1.49 -1.07 0.00 0.00 179.97 180.90 1bzh h GLU 200 N 0.85 0.64 0.00 0.04 4.81 -0.05 -2.55 114.58 118.32 1bzh h GLU 200 Ca 0.33 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1bzh h GLU 200 Cb 0.14 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1bzh h GLU 200 CO -0.16 0.70 0.00 0.66 -0.73 0.00 0.00 179.01 179.48 1bzh h SER 201 N 0.60 0.00 0.00 1.04 4.64 -0.88 -3.45 113.55 115.50 1bzh h SER 201 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1bzh h SER 201 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1bzh h SER 201 CO 0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 1bzh n GLY 202 N -0.69 0.76 0.24 -0.77 0.00 -0.96 -4.91 105.19 98.85 1bzh n GLY 202 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 1bzh n GLY 202 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1bzh h SER 203 N 0.00 0.00 -0.12 1.61 0.02 -1.76 -2.21 113.55 111.09 1bzh h SER 203 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1bzh h SER 203 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1bzh h SER 203 CO 0.00 0.10 0.00 0.18 -1.14 0.00 0.00 176.83 175.97 1bzh n LEU 204 N -4.36 1.99 -4.76 5.07 4.77 -1.26 -4.46 117.00 113.99 1bzh n LEU 204 Ca -0.03 -0.75 -0.34 0.00 -0.03 0.00 0.00 56.01 54.86 1bzh n LEU 204 Cb 0.17 -0.07 0.05 0.00 -2.33 0.00 0.00 43.42 41.25 1bzh n LEU 204 CO 0.35 0.38 0.76 -0.55 -1.33 0.00 0.00 177.39 177.00 1bzh s SER 205 N -1.78 4.97 0.13 -1.43 0.15 -0.83 -4.89 113.70 110.02 1bzh s SER 205 Ca 0.35 2.12 0.20 0.00 0.70 0.00 0.00 55.95 59.31 1bzh s SER 205 Cb 0.20 -2.57 0.81 0.00 -1.71 0.00 0.00 66.02 62.76 1bzh s SER 205 CO 0.30 -1.73 1.61 -2.65 1.20 0.00 0.00 173.24 171.97 1bzh n PRO 206 N -2.32 0.10 0.28 5.44 -0.02 -1.26 -1.68 135.00 135.53 1bzh n PRO 206 Ca 0.11 0.32 0.18 0.00 -2.02 0.00 0.00 63.50 62.09 1bzh n PRO 206 Cb 0.51 -1.68 0.81 0.00 -0.02 0.00 0.00 33.50 33.12 1bzh n PRO 206 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1bzh h GLU 207 N 0.00 0.00 -6.11 -0.52 5.08 -1.93 -3.44 114.58 107.66 1bzh h GLU 207 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 1bzh h GLU 207 Cb 0.33 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.54 1bzh h GLU 207 CO 0.00 0.00 -0.32 -1.01 -1.00 0.00 0.00 179.01 176.68 1bzh s HIS 208 N -3.76 2.09 1.00 4.33 3.76 -0.68 -5.12 115.29 116.91 1bzh s HIS 208 Ca -0.00 -0.67 -0.15 0.00 -0.15 0.00 0.00 55.06 54.08 1bzh s HIS 208 Cb 0.10 -2.05 0.19 0.00 1.11 0.00 0.00 32.58 31.93 1bzh s HIS 208 CO 0.48 -0.37 1.17 0.20 -0.85 0.00 0.00 174.74 175.37 1bzh s GLY 209 N -4.24 1.62 0.46 -2.22 0.00 0.18 -4.93 107.32 98.18 1bzh s GLY 209 Ca 0.43 -0.77 -0.25 0.00 0.00 0.00 0.00 44.72 44.13 1bzh s GLY 209 CO 0.26 -0.08 1.42 -4.14 0.00 0.00 0.00 173.10 170.56 1bzh s PRO 210 N -5.42 3.65 0.37 2.90 0.02 -1.26 -4.42 135.00 130.85 1bzh s PRO 210 Ca 0.68 2.40 -0.28 0.00 0.02 0.00 0.00 61.00 63.82 1bzh s PRO 210 Cb -0.11 -2.63 -0.10 0.00 0.02 0.00 0.00 34.50 31.67 1bzh s PRO 210 CO 0.54 -0.84 1.40 0.54 -0.33 0.00 0.00 177.00 178.32 1bzh s VAL 211 N -1.21 2.33 -0.42 3.83 0.11 -1.26 -4.48 120.40 119.31 1bzh s VAL 211 Ca 0.62 0.32 -0.16 0.00 -2.93 0.00 0.00 61.98 59.83 1bzh s VAL 211 Cb -0.43 -3.20 0.02 0.00 -1.53 0.00 0.00 36.38 31.23 1bzh s VAL 211 CO 0.56 0.07 0.38 -0.69 -3.33 0.00 0.00 175.10 172.09 1bzh s VAL 212 N -1.15 5.16 -0.19 2.04 1.01 -0.77 -0.78 120.40 125.73 1bzh s VAL 212 Ca 0.52 -0.47 -0.06 0.00 0.00 0.00 0.00 61.98 61.97 1bzh s VAL 212 Cb -0.43 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 31.92 1bzh s VAL 212 CO 0.58 -0.37 0.04 -0.69 0.00 0.00 0.00 175.10 174.65 1bzh s VAL 213 N 1.95 4.45 0.09 2.92 1.01 0.13 0.23 120.40 131.17 1bzh s VAL 213 Ca 0.09 -0.15 -0.07 0.00 0.00 0.00 0.00 61.98 61.85 1bzh s VAL 213 Cb -0.18 -3.00 -0.01 0.00 0.00 0.00 0.00 36.38 33.19 1bzh s VAL 213 CO 0.12 0.45 0.15 -1.38 0.00 0.00 0.00 175.10 174.44 1bzh s HIS 214 N 0.58 0.26 0.00 5.22 -3.43 0.38 -1.37 115.29 116.93 1bzh s HIS 214 Ca 0.01 -0.71 0.00 0.00 -0.80 0.00 0.00 55.06 53.56 1bzh s HIS 214 Cb -0.13 -0.14 0.00 0.00 -1.43 0.00 0.00 32.58 30.88 1bzh s HIS 214 CO 0.02 -0.53 0.00 0.00 -2.00 0.00 0.00 174.74 172.23 1bzh n SER 216 N 0.00 1.85 0.11 0.00 2.88 -1.26 -2.19 113.62 115.02 1bzh n SER 216 Ca 0.00 0.52 0.11 0.00 -1.33 0.00 0.00 58.87 58.17 1bzh n SER 216 Cb 0.00 -0.88 0.01 0.00 -0.75 0.00 0.00 64.21 62.59 1bzh n SER 216 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1bzh h ALA 217 N -0.84 0.56 -0.28 -1.46 0.00 -1.88 -1.17 119.26 114.18 1bzh h ALA 217 Ca -0.16 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1bzh h ALA 217 Cb 0.90 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1bzh h ALA 217 CO -0.10 0.04 0.00 0.41 0.00 0.00 0.00 179.25 179.60 1bzh n GLY 218 N 1.18 0.54 0.00 0.00 0.00 -1.24 -3.88 105.19 101.78 1bzh n GLY 218 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1bzh n GLY 218 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1bzh n ILE 219 N -3.58 0.00 0.00 -0.61 -5.35 -1.26 -4.38 119.36 104.18 1bzh n ILE 219 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1bzh n ILE 219 Cb 0.50 -0.12 0.00 0.00 -1.74 0.00 0.00 39.64 38.28 1bzh n ILE 219 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1bzh n GLY 220 N 1.95 -0.12 0.25 3.28 0.00 -1.26 -0.69 105.19 108.61 1bzh n GLY 220 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 1bzh n GLY 220 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1bzh h ARG 221 N 0.00 0.61 -0.41 1.61 3.08 -1.95 -1.63 114.38 115.69 1bzh h ARG 221 Ca 0.00 -0.22 -0.08 0.00 0.07 0.00 0.00 59.98 59.75 1bzh h ARG 221 Cb 0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1bzh h ARG 221 CO 0.00 0.77 -0.08 0.77 -1.07 0.00 0.00 179.97 180.36 1bzh h SER 222 N 0.54 0.68 -0.69 7.04 0.02 -1.87 -1.59 113.55 117.68 1bzh h SER 222 Ca 0.09 -0.18 -0.05 0.00 -0.84 0.00 0.00 61.79 60.80 1bzh h SER 222 Cb 0.64 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.97 1bzh h SER 222 CO 0.05 0.80 0.24 1.23 -1.14 0.00 0.00 176.83 178.01 1bzh h GLY 223 N 0.96 1.14 0.95 -3.77 0.00 -1.13 -1.70 103.07 99.52 1bzh h GLY 223 Ca 0.12 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 46.80 1bzh h GLY 223 CO 0.03 0.61 -0.01 -0.84 0.00 0.00 0.00 176.54 176.33 1bzh h THR 224 N 1.00 0.96 0.12 4.70 2.02 -0.53 0.16 112.91 121.35 1bzh h THR 224 Ca 0.23 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.43 1bzh h THR 224 Cb 0.26 0.96 -0.05 0.00 -1.74 0.00 0.00 68.15 67.58 1bzh h THR 224 CO -0.01 0.00 -0.41 0.15 0.37 0.00 0.00 175.52 175.62 1bzh h PHE 225 N -0.02 -1.15 -0.16 3.16 3.57 -1.24 -0.27 116.94 120.83 1bzh h PHE 225 Ca 0.01 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1bzh h PHE 225 Cb 0.04 0.49 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 1bzh h PHE 225 CO -0.09 -0.51 0.06 0.00 -2.23 0.00 0.00 178.31 175.53 1bzh h LEU 227 N 0.09 -0.93 -0.47 0.00 5.85 -0.64 0.10 115.31 119.31 1bzh h LEU 227 Ca 0.05 0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.91 1bzh h LEU 227 Cb 0.19 0.34 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 1bzh h LEU 227 CO -0.00 -0.43 0.23 0.00 -0.34 0.00 0.00 178.44 177.90 1bzh h ALA 228 N -0.00 0.60 -0.53 1.25 0.00 -0.97 0.15 119.26 119.75 1bzh h ALA 228 Ca 0.01 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1bzh h ALA 228 Cb 0.60 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1bzh h ALA 228 CO -0.15 -0.12 -0.03 0.22 0.00 0.00 0.00 179.25 179.17 1bzh h ASP 229 N 0.46 0.94 -0.26 0.00 3.58 -0.87 -1.33 116.42 118.94 1bzh h ASP 229 Ca 0.21 -0.32 -0.15 0.00 0.42 0.00 0.00 57.03 57.19 1bzh h ASP 229 Cb 0.12 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 1bzh h ASP 229 CO -0.15 1.04 -0.39 0.74 -2.88 0.00 0.00 179.24 177.59 1bzh h THR 230 N 0.83 1.28 -0.34 2.25 2.02 -0.40 -0.21 112.91 118.34 1bzh h THR 230 Ca 0.15 -1.57 -0.08 0.00 0.77 0.00 0.00 66.41 65.68 1bzh h THR 230 Cb 0.57 1.44 -0.02 0.00 -1.74 0.00 0.00 68.15 68.40 1bzh h THR 230 CO 0.03 0.51 -0.13 0.00 0.37 0.00 0.00 175.52 176.31 1bzh h LEU 232 N 0.55 0.83 -0.10 0.00 3.38 -1.00 -1.40 115.31 117.58 1bzh h LEU 232 Ca 0.10 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1bzh h LEU 232 Cb 0.54 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 1bzh h LEU 232 CO 0.03 1.03 0.06 -0.07 0.09 0.00 0.00 178.44 179.59 1bzh h LEU 233 N 0.71 0.11 -0.52 1.67 3.38 -0.27 -2.49 115.31 117.90 1bzh h LEU 233 Ca 0.09 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.93 1bzh h LEU 233 Cb 0.76 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1bzh h LEU 233 CO 0.06 0.08 -0.20 -0.07 0.09 0.00 0.00 178.44 178.41 1bzh h LEU 234 N 0.13 1.02 0.73 1.67 3.38 -0.95 -3.11 115.31 118.19 1bzh h LEU 234 Ca 0.03 -0.38 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 1bzh h LEU 234 Cb -0.01 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 40.46 1bzh h LEU 234 CO -0.01 1.18 -0.37 0.24 0.09 0.00 0.00 178.44 179.57 1bzh h MET 235 N 0.87 -0.97 -1.89 1.13 2.86 -1.09 0.69 114.93 116.53 1bzh h MET 235 Ca 0.12 0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 1bzh h MET 235 Cb 0.77 0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.65 1bzh h MET 235 CO 0.06 -0.64 0.00 -0.25 1.06 0.00 0.00 176.91 177.14 1bzh n ASP 236 N -5.53 4.75 0.00 1.22 8.00 -0.95 -2.10 116.55 121.94 1bzh n ASP 236 Ca -0.14 -2.27 0.00 0.00 0.71 0.00 0.00 54.79 53.09 1bzh n ASP 236 Cb 0.41 -0.99 0.00 0.00 -0.02 0.00 0.00 41.12 40.52 1bzh n ASP 236 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1bzh n LYS 237 N 1.42 0.00 -1.95 -1.24 4.81 -1.11 -4.97 118.16 115.12 1bzh n LYS 237 Ca 0.00 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.14 1bzh n LYS 237 Cb 0.47 -0.33 0.03 0.00 0.02 0.00 0.00 35.03 35.21 1bzh n LYS 237 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1bzh s ARG 238 N -1.00 3.22 0.19 1.64 0.52 0.22 -4.97 118.95 118.77 1bzh s ARG 238 Ca 0.00 0.54 -0.12 0.00 -0.52 0.00 0.00 55.73 55.63 1bzh s ARG 238 Cb 0.00 -2.08 0.12 0.00 0.52 0.00 0.00 34.95 33.51 1bzh s ARG 238 CO 0.00 -0.76 1.84 -0.22 0.02 0.00 0.00 175.30 176.18 1bzh h LYS 239 N -0.43 0.74 -4.30 3.54 3.64 -1.90 -3.38 116.57 114.49 1bzh h LYS 239 Ca -0.45 -0.04 -0.53 0.00 -1.27 0.00 0.00 60.65 58.36 1bzh h LYS 239 Cb 1.22 -0.17 -0.36 0.00 -0.41 0.00 0.00 32.23 32.51 1bzh h LYS 239 CO 0.63 0.49 -0.81 0.16 -2.27 0.00 0.00 179.45 177.65 1bzh s ASP 240 N -5.69 2.10 0.49 4.20 -4.77 -1.26 -5.00 116.67 106.73 1bzh s ASP 240 Ca -0.13 -0.31 0.16 0.00 -3.30 0.00 0.00 52.55 48.98 1bzh s ASP 240 Cb 0.14 -0.84 1.18 0.00 -1.09 0.00 0.00 42.92 42.31 1bzh s ASP 240 CO 0.75 -0.09 2.06 1.55 0.70 0.00 0.00 175.17 180.15 1bzh h PRO 241 N 7.92 0.17 -0.52 2.11 0.13 -1.75 -1.90 132.00 138.17 1bzh h PRO 241 Ca -0.31 -0.01 0.15 0.00 -0.87 0.00 0.00 66.00 64.97 1bzh h PRO 241 Cb 1.14 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 1bzh h PRO 241 CO 0.43 0.11 0.49 0.66 -0.23 0.00 0.00 178.00 179.46 1bzh h SER 242 N 0.18 0.00 0.74 1.44 4.64 -1.94 -1.53 113.55 117.08 1bzh h SER 242 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1bzh h SER 242 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1bzh h SER 242 CO -0.02 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.40 1bzh n SER 243 N -3.87 0.15 -4.69 4.97 3.41 -0.71 -3.51 113.62 109.36 1bzh n SER 243 Ca 0.10 0.53 -0.42 0.00 -0.26 0.00 0.00 58.87 58.81 1bzh n SER 243 Cb 0.70 -0.56 -0.03 0.00 -0.26 0.00 0.00 64.21 64.06 1bzh n SER 243 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1bzh s VAL 244 N -3.05 4.26 -0.41 -3.33 1.01 -0.58 -5.00 120.40 113.30 1bzh s VAL 244 Ca 0.09 1.59 -0.08 0.00 0.00 0.00 0.00 61.98 63.58 1bzh s VAL 244 Cb 0.12 -4.02 0.08 0.00 0.00 0.00 0.00 36.38 32.57 1bzh s VAL 244 CO 0.38 0.01 0.24 -0.62 0.00 0.00 0.00 175.10 175.12 1bzh s ASP 245 N 1.42 5.54 0.47 3.32 -1.08 -1.26 -4.82 116.67 120.26 1bzh s ASP 245 Ca 0.56 -1.60 0.19 0.00 -0.52 0.00 0.00 52.55 51.18 1bzh s ASP 245 Cb -0.25 -1.95 1.19 0.00 -1.46 0.00 0.00 42.92 40.45 1bzh s ASP 245 CO 0.23 -0.53 1.97 -0.29 0.52 0.00 0.00 175.17 177.06 1bzh h ILE 246 N 6.15 0.80 -0.52 4.11 2.10 -1.99 0.33 117.51 128.49 1bzh h ILE 246 Ca -0.21 -0.08 -0.12 0.00 1.08 0.00 0.00 64.86 65.52 1bzh h ILE 246 Cb 1.08 0.54 -0.02 0.00 -1.09 0.00 0.00 36.82 37.33 1bzh h ILE 246 CO 0.74 0.04 -0.16 0.11 -1.08 0.00 0.00 178.15 177.81 1bzh h LYS 247 N 0.24 1.02 -0.00 2.19 1.57 -1.98 0.05 116.57 119.65 1bzh h LYS 247 Ca 0.29 -0.41 -0.22 0.00 -1.87 0.00 0.00 60.65 58.45 1bzh h LYS 247 Cb 0.82 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.08 1bzh h LYS 247 CO -0.06 1.09 -0.92 -0.22 -0.57 0.00 0.00 179.45 178.77 1bzh h LYS 248 N 0.89 0.36 0.04 3.15 3.11 -1.42 -0.07 116.57 122.64 1bzh h LYS 248 Ca 0.13 -0.38 0.00 0.00 -2.81 0.00 0.00 60.65 57.59 1bzh h LYS 248 Cb 0.74 0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 32.07 1bzh h LYS 248 CO 0.06 1.06 -0.05 0.28 -2.81 0.00 0.00 179.45 177.99 1bzh h VAL 249 N 0.20 0.87 -0.36 2.00 2.07 -1.10 0.80 116.25 120.74 1bzh h VAL 249 Ca -0.07 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.51 1bzh h VAL 249 Cb 1.55 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 32.14 1bzh h VAL 249 CO 0.15 0.00 0.03 0.25 0.02 0.00 0.00 177.57 178.03 1bzh h LEU 250 N -0.12 -0.08 -0.87 2.57 5.85 -0.78 -0.01 115.31 121.87 1bzh h LEU 250 Ca 0.01 0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 1bzh h LEU 250 Cb 0.12 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 1bzh h LEU 250 CO -0.02 -0.00 0.25 -0.07 -0.34 0.00 0.00 178.44 178.26 1bzh h LEU 251 N 0.14 1.01 -0.82 2.25 3.38 -0.76 -0.34 115.31 120.18 1bzh h LEU 251 Ca 0.17 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 1bzh h LEU 251 Cb 0.22 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1bzh h LEU 251 CO -0.26 0.92 -0.14 -0.78 0.09 0.00 0.00 178.44 178.27 1bzh h ASP 252 N 1.05 0.73 -0.56 -0.43 3.58 0.06 -2.71 116.42 118.13 1bzh h ASP 252 Ca 0.24 -0.22 -0.07 0.00 0.42 0.00 0.00 57.03 57.39 1bzh h ASP 252 Cb 0.25 -0.20 -0.03 0.00 1.72 0.00 0.00 39.33 41.08 1bzh h ASP 252 CO -0.01 0.88 0.10 0.24 -2.88 0.00 0.00 179.24 177.57 1bzh h MET 253 N 0.66 0.97 0.00 0.28 2.86 -0.40 -2.59 114.93 116.71 1bzh h MET 253 Ca 0.11 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 1bzh h MET 253 Cb 0.61 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.15 1bzh h MET 253 CO 0.04 0.90 0.00 0.54 1.06 0.00 0.00 176.91 179.45 1bzh n ARG 254 N -4.23 0.07 0.19 1.72 1.74 -0.19 -1.16 116.66 114.80 1bzh n ARG 254 Ca 0.04 0.42 0.05 0.00 -0.77 0.00 0.00 57.85 57.58 1bzh n ARG 254 Cb 0.28 -1.68 0.38 0.00 -1.02 0.00 0.00 32.46 30.42 1bzh n ARG 254 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1bzh h LYS 255 N 0.00 0.00 0.00 5.56 1.57 -1.20 -3.29 116.57 119.21 1bzh h LYS 255 Ca 0.00 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.43 1bzh h LYS 255 Cb 0.18 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.43 1bzh h LYS 255 CO 0.00 0.37 -2.19 1.19 -0.57 0.00 0.00 179.45 178.24 1bzh n PHE 256 N -3.81 0.30 -3.72 -1.35 3.72 -0.31 -4.95 117.46 107.34 1bzh n PHE 256 Ca -0.01 0.11 -0.12 0.00 -0.05 0.00 0.00 57.45 57.37 1bzh n PHE 256 Cb 0.44 -1.05 -0.10 0.00 -0.94 0.00 0.00 39.48 37.83 1bzh n PHE 256 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 1bzh s ARG 257 N -2.52 0.48 0.45 -1.08 3.52 -1.10 -4.44 118.95 114.26 1bzh s ARG 257 Ca -0.09 0.66 -0.22 0.00 -0.13 0.00 0.00 55.73 55.95 1bzh s ARG 257 Cb 0.07 0.18 -0.08 0.00 -1.56 0.00 0.00 34.95 33.55 1bzh s ARG 257 CO 0.83 -0.08 1.07 0.00 -0.81 0.00 0.00 175.30 176.30 1bzh s MET 258 N 0.53 3.90 -0.88 5.12 0.23 -1.26 -3.99 119.30 122.95 1bzh s MET 258 Ca -0.02 1.50 0.00 0.00 -1.03 0.00 0.00 55.69 56.13 1bzh s MET 258 Cb -0.04 -2.30 0.00 0.00 -1.53 0.00 0.00 34.83 30.95 1bzh s MET 258 CO -0.03 -0.37 0.00 0.41 -2.03 0.00 0.00 175.02 173.00 1bzh n GLY 259 N 0.11 0.98 3.68 3.16 0.00 -1.26 -4.89 105.19 106.97 1bzh n GLY 259 Ca 0.07 -0.38 -0.45 0.00 0.00 0.00 0.00 46.02 45.27 1bzh n GLY 259 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bzh n LEU 260 N -0.94 3.23 -1.77 0.99 4.77 -1.26 -3.80 117.00 118.22 1bzh n LEU 260 Ca -0.08 1.11 -0.01 0.00 -0.03 0.00 0.00 56.01 56.99 1bzh n LEU 260 Cb 0.34 -1.45 -0.01 0.00 -2.33 0.00 0.00 43.42 39.98 1bzh n LEU 260 CO 0.13 -0.31 -0.25 -0.38 -1.33 0.00 0.00 177.39 175.25 1bzh n ILE 261 N 2.80 -7.19 0.07 -0.08 -0.00 0.14 -4.95 119.36 110.15 1bzh n ILE 261 Ca 0.14 1.32 0.11 0.00 -0.00 0.00 0.00 62.75 64.32 1bzh n ILE 261 Cb 0.31 -4.59 -0.05 0.00 -0.00 0.00 0.00 39.64 35.30 1bzh n ILE 261 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1bzh n GLN 262 N 0.78 0.62 -4.35 0.38 1.13 -1.25 -4.91 117.38 109.79 1bzh n GLN 262 Ca -0.09 0.03 -0.18 0.00 -1.94 0.00 0.00 57.00 54.82 1bzh n GLN 262 Cb 0.14 -1.74 -0.10 0.00 0.11 0.00 0.00 30.24 28.65 1bzh n GLN 262 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1bzh s THR 263 N -3.40 1.19 0.26 5.09 -4.23 -1.26 -5.01 115.64 108.28 1bzh s THR 263 Ca -0.03 -2.06 0.23 0.00 -1.18 0.00 0.00 61.69 58.65 1bzh s THR 263 Cb 0.11 -2.33 0.22 0.00 1.34 0.00 0.00 72.50 71.84 1bzh s THR 263 CO 0.83 -0.35 1.89 0.00 -0.54 0.00 0.00 174.62 176.44 1bzh h ALA 264 N 2.45 1.14 -0.08 3.99 0.00 -1.93 -2.00 119.26 122.84 1bzh h ALA 264 Ca -0.39 -0.22 -0.18 0.00 0.00 0.00 0.00 54.91 54.12 1bzh h ALA 264 Cb 1.22 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1bzh h ALA 264 CO 0.65 0.30 -0.73 1.49 0.00 0.00 0.00 179.25 180.96 1bzh h GLU 265 N 0.00 0.39 -0.15 0.00 4.81 -1.95 -0.37 114.58 117.32 1bzh h GLU 265 Ca -0.00 -0.32 -0.12 0.00 -0.13 0.00 0.00 59.36 58.78 1bzh h GLU 265 Cb 0.63 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 1bzh h GLU 265 CO 0.03 0.96 -0.45 1.96 -0.73 0.00 0.00 179.01 180.78 1bzh h GLN 266 N 0.27 0.36 -0.42 1.92 4.20 -1.88 0.82 115.11 120.38 1bzh h GLN 266 Ca -0.03 -0.19 -0.13 0.00 0.06 0.00 0.00 58.65 58.36 1bzh h GLN 266 Cb 1.30 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 29.08 1bzh h GLN 266 CO 0.12 0.74 -0.24 1.25 -0.67 0.00 0.00 178.83 180.04 1bzh h LEU 267 N 0.29 0.93 -0.73 1.46 5.85 -1.18 0.03 115.31 121.96 1bzh h LEU 267 Ca 0.02 -0.42 -0.10 0.00 0.84 0.00 0.00 57.88 58.22 1bzh h LEU 267 Cb 0.91 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 1bzh h LEU 267 CO 0.08 1.14 -0.11 -0.09 -0.34 0.00 0.00 178.44 179.12 1bzh h ARG 268 N 0.72 0.86 -0.73 1.25 2.43 -0.65 -1.25 114.38 117.00 1bzh h ARG 268 Ca 0.09 -0.30 -0.02 0.00 -0.81 0.00 0.00 59.98 58.94 1bzh h ARG 268 Cb 0.81 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.26 1bzh h ARG 268 CO 0.07 0.93 0.39 0.35 -1.51 0.00 0.00 179.97 180.19 1bzh h PHE 269 N 0.77 1.03 -0.71 2.20 3.57 0.93 -0.28 116.94 124.46 1bzh h PHE 269 Ca 0.13 -0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.52 1bzh h PHE 269 Cb 0.62 -0.32 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 1bzh h PHE 269 CO 0.03 0.74 0.16 0.77 -2.23 0.00 0.00 178.31 177.78 1bzh h SER 270 N 1.02 1.08 -0.41 0.41 0.02 -0.56 0.77 113.55 115.88 1bzh h SER 270 Ca 0.26 -0.24 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1bzh h SER 270 Cb 0.07 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 1bzh h SER 270 CO -0.04 1.04 0.25 1.88 -1.14 0.00 0.00 176.83 178.83 1bzh h TYR 271 N 1.07 0.53 0.03 3.45 -1.99 -0.89 -0.44 116.97 118.73 1bzh h TYR 271 Ca 0.22 0.00 0.03 0.00 2.00 0.00 0.00 58.73 60.98 1bzh h TYR 271 Cb 0.39 -0.18 -0.04 0.00 2.00 0.00 0.00 36.73 38.90 1bzh h TYR 271 CO 0.03 0.36 -0.22 -0.07 -0.00 0.00 0.00 178.16 178.26 1bzh h LEU 272 N 0.54 -0.65 -0.35 3.88 3.38 -0.53 0.12 115.31 121.70 1bzh h LEU 272 Ca 0.15 0.09 0.06 0.00 0.09 0.00 0.00 57.88 58.26 1bzh h LEU 272 Cb -0.02 0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 1bzh h LEU 272 CO -0.03 -0.30 0.04 0.00 0.09 0.00 0.00 178.44 178.24 1bzh h ALA 273 N 0.47 0.35 -0.29 1.53 0.00 -0.66 0.32 119.26 120.97 1bzh h ALA 273 Ca 0.05 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1bzh h ALA 273 Cb 0.44 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1bzh h ALA 273 CO -0.18 -0.36 -0.15 0.28 0.00 0.00 0.00 179.25 178.84 1bzh h VAL 274 N 0.15 1.30 -0.05 0.00 2.07 -0.90 0.22 116.25 119.04 1bzh h VAL 274 Ca 0.17 -1.25 0.02 0.00 0.82 0.00 0.00 66.70 66.46 1bzh h VAL 274 Cb 0.21 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 1bzh h VAL 274 CO -0.24 0.40 -0.07 0.40 0.02 0.00 0.00 177.57 178.07 1bzh h ILE 275 N 0.36 0.81 -0.26 4.57 2.04 -0.42 0.99 117.51 125.60 1bzh h ILE 275 Ca 0.06 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.78 1bzh h ILE 275 Cb 0.67 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 37.56 1bzh h ILE 275 CO 0.04 0.00 -0.38 -0.08 0.00 0.00 0.00 178.15 177.73 1bzh h GLU 276 N -0.10 0.71 -0.59 2.37 4.57 -0.38 -2.71 114.58 118.44 1bzh h GLU 276 Ca 0.04 -0.42 -0.01 0.00 -1.18 0.00 0.00 59.36 57.79 1bzh h GLU 276 Cb 0.16 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.76 1bzh h GLU 276 CO -0.11 1.05 0.34 0.78 -1.18 0.00 0.00 179.01 179.89 1bzh h GLY 277 N 0.44 0.86 0.92 1.92 0.00 -0.34 -2.36 103.07 104.52 1bzh h GLY 277 Ca 0.02 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 46.89 1bzh h GLY 277 CO 0.09 0.35 -0.27 0.00 0.00 0.00 0.00 176.54 176.70 1bzh h ALA 278 N 1.56 0.37 -0.13 3.60 0.00 -0.77 -2.99 119.26 120.90 1bzh h ALA 278 Ca 0.21 -0.39 0.05 0.00 0.00 0.00 0.00 54.91 54.78 1bzh h ALA 278 Cb -0.01 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 1bzh h ALA 278 CO -0.04 0.37 -0.26 -0.22 0.00 0.00 0.00 179.25 179.10 1bzh h LYS 279 N 0.34 -0.31 -0.70 0.00 3.64 -1.09 0.79 116.57 119.24 1bzh h LYS 279 Ca 0.04 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1bzh h LYS 279 Cb 0.84 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.69 1bzh h LYS 279 CO 0.07 -0.21 0.42 0.74 -2.27 0.00 0.00 179.45 178.20 1bzh h PHE 280 N -0.32 0.91 0.10 1.91 0.04 -1.53 -3.24 116.94 114.80 1bzh h PHE 280 Ca 0.10 0.00 -0.36 0.00 2.80 0.00 0.00 57.97 60.52 1bzh h PHE 280 Cb 0.47 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 38.30 1bzh h PHE 280 CO -0.35 0.60 -1.99 -0.89 -0.60 0.00 0.00 178.31 175.07 1bzh n ILE 281 N -4.40 1.73 -0.28 -0.55 2.08 -0.97 -3.92 119.36 113.05 1bzh n ILE 281 Ca 0.07 -0.68 0.09 0.00 0.56 0.00 0.00 62.75 62.79 1bzh n ILE 281 Cb 0.06 -1.59 0.24 0.00 -0.75 0.00 0.00 39.64 37.60 1bzh n ILE 281 CO 0.00 0.00 0.00 -0.03 0.56 0.00 0.00 176.55 177.08 1bzh h MET 282 N 0.06 0.40 0.00 0.38 4.05 0.57 -3.42 114.93 116.97 1bzh h MET 282 Ca -0.42 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 58.98 1bzh h MET 282 Cb 2.03 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 32.74 1bzh h MET 282 CO 0.07 0.26 0.00 0.41 0.23 0.00 0.00 176.91 177.89 1bzh n GLY 283 N -1.34 0.41 3.57 1.39 0.00 -1.24 -5.03 105.19 102.95 1bzh n GLY 283 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1bzh n GLY 283 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bzh s ASP 284 N 0.00 6.73 0.55 1.61 1.11 -1.25 -4.75 116.67 120.67 1bzh s ASP 284 Ca 0.00 -2.12 0.26 0.00 0.18 0.00 0.00 52.55 50.87 1bzh s ASP 284 Cb 0.00 -2.58 1.46 0.00 1.07 0.00 0.00 42.92 42.88 1bzh s ASP 284 CO 0.00 -1.28 2.02 0.28 1.18 0.00 0.00 175.17 177.36 1bzh h SER 285 N 8.32 0.00 -0.52 0.27 0.02 -1.95 0.29 113.55 119.98 1bzh h SER 285 Ca 0.37 0.00 0.11 0.00 -0.84 0.00 0.00 61.79 61.43 1bzh h SER 285 Cb 0.92 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.43 1bzh h SER 285 CO 1.45 0.00 0.36 0.77 -1.14 0.00 0.00 176.83 178.27 1bzh h SER 286 N 0.00 0.20 -0.44 3.07 4.64 -1.97 -3.45 113.55 115.59 1bzh h SER 286 Ca 0.19 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1bzh h SER 286 Cb 0.85 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1bzh h SER 286 CO -0.00 0.12 0.00 1.33 -0.87 0.00 0.00 176.83 177.40 1bzh n VAL 287 N -4.45 0.00 0.02 0.95 0.24 0.10 -5.07 118.33 110.13 1bzh n VAL 287 Ca 0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.39 1bzh n VAL 287 Cb 0.44 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.81 1bzh n VAL 287 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1bzh n GLN 288 N 0.00 0.00 -3.81 7.34 7.27 -1.26 -4.74 117.38 122.18 1bzh n GLN 288 Ca 0.00 0.00 -0.31 0.00 0.07 0.00 0.00 57.00 56.76 1bzh n GLN 288 Cb 0.00 0.00 -0.10 0.00 2.41 0.00 0.00 30.24 32.55 1bzh n GLN 288 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1bzh s ASP 289 N -2.47 5.23 -0.98 1.69 1.11 -1.26 -4.47 116.67 115.51 1bzh s ASP 289 Ca 0.00 -3.75 -0.01 0.00 0.18 0.00 0.00 52.55 48.97 1bzh s ASP 289 Cb 0.00 -1.74 0.33 0.00 1.07 0.00 0.00 42.92 42.58 1bzh s ASP 289 CO 0.00 -0.13 1.88 1.67 1.18 0.00 0.00 175.17 179.77 1bzh n GLN 290 N 2.18 4.77 -2.58 8.23 7.27 -1.26 -4.62 117.38 131.37 1bzh n GLN 290 Ca 0.19 -4.38 -0.22 0.00 0.07 0.00 0.00 57.00 52.66 1bzh n GLN 290 Cb 0.36 -2.42 0.00 0.00 2.41 0.00 0.00 30.24 30.59 1bzh n GLN 290 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 1bzh n TRP 291 N -0.18 2.78 0.00 3.69 8.01 -1.26 -4.92 117.44 125.56 1bzh n TRP 291 Ca 0.49 -3.12 0.00 0.00 -1.31 0.00 0.00 57.50 53.56 1bzh n TRP 291 Cb 0.25 -0.20 0.00 0.00 -2.01 0.00 0.00 31.31 29.36 1bzh n TRP 291 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 1bzh n LYS 292 N -0.33 0.00 -0.09 -0.99 5.02 -1.26 -2.94 118.16 117.57 1bzh n LYS 292 Ca 0.30 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.53 1bzh n LYS 292 Cb 0.68 -0.55 0.01 0.00 -0.02 0.00 0.00 35.03 35.15 1bzh n LYS 292 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1bzh h GLU 293 N 0.00 0.15 -0.35 1.97 3.07 -1.92 0.83 114.58 118.33 1bzh h GLU 293 Ca 0.00 -0.01 0.03 0.00 -0.50 0.00 0.00 59.36 58.88 1bzh h GLU 293 Cb 0.00 -0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 27.83 1bzh h GLU 293 CO 0.00 0.10 -0.23 -0.07 -1.40 0.00 0.00 179.01 177.41 1bzh h LEU 294 N 0.15 -0.82 -0.19 1.33 4.07 -1.92 0.21 115.31 118.15 1bzh h LEU 294 Ca 0.15 0.12 0.00 0.00 0.08 0.00 0.00 57.88 58.24 1bzh h LEU 294 Cb 0.18 0.36 0.00 0.00 1.08 0.00 0.00 40.66 42.28 1bzh h LEU 294 CO -0.22 -0.10 -0.10 -1.20 -1.08 0.00 0.00 178.44 175.75 1bzh n SER 295 N -3.85 0.39 0.00 -0.43 7.64 -1.15 -4.82 113.62 111.40 1bzh n SER 295 Ca 0.00 -0.49 0.00 0.00 1.01 0.00 0.00 58.87 59.39 1bzh n SER 295 Cb 0.11 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1bzh n SER 295 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1bzh n HIS 296 N -1.02 0.00 -1.29 1.43 8.25 0.29 -4.82 115.22 118.05 1bzh n HIS 296 Ca 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.60 1bzh n HIS 296 Cb 0.27 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.38 1bzh n HIS 296 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1bzh n GLU 297 N 0.00 -3.69 0.00 -0.41 4.71 -1.26 -4.35 120.64 115.64 1bzh n GLU 297 Ca 0.00 2.72 0.13 0.00 -0.01 0.00 0.00 57.16 59.99 1bzh n GLU 297 Cb 0.00 -3.04 0.22 0.00 -1.01 0.00 0.00 31.44 27.62 1bzh n GLU 297 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97