#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1br0 h ARG 28 N 0.00 0.70 0.11 -1.24 3.08 -2.06 -2.63 114.38 112.34 1br0 h ARG 28 Ca 0.00 -0.17 -0.22 0.00 0.07 0.00 0.00 59.98 59.66 1br0 h ARG 28 Cb 0.00 -0.09 0.02 0.00 0.08 0.00 0.00 29.97 29.98 1br0 h ARG 28 CO 0.00 0.70 -0.93 0.74 -1.07 0.00 0.00 179.97 179.41 1br0 h PHE 29 N 0.58 0.73 -0.25 3.04 0.04 -2.05 -2.73 116.94 116.30 1br0 h PHE 29 Ca 0.14 -0.47 -0.14 0.00 2.80 0.00 0.00 57.97 60.29 1br0 h PHE 29 Cb 0.31 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.40 1br0 h PHE 29 CO 0.02 1.33 -0.43 0.52 -0.60 0.00 0.00 178.31 179.15 1br0 h MET 30 N -0.08 0.62 -0.62 1.51 2.86 -1.99 -2.40 114.93 114.84 1br0 h MET 30 Ca -0.15 -0.33 -0.04 0.00 -2.06 0.00 0.00 59.70 57.12 1br0 h MET 30 Cb 1.67 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 33.32 1br0 h MET 30 CO 0.18 0.94 0.25 -0.44 1.06 0.00 0.00 176.91 178.89 1br0 h ASP 31 N 0.51 0.86 -0.39 1.22 3.32 -1.57 -0.37 116.42 119.99 1br0 h ASP 31 Ca 0.04 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 56.85 1br0 h ASP 31 Cb 0.95 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 1br0 h ASP 31 CO 0.09 0.79 -0.02 1.05 -1.72 0.00 0.00 179.24 179.43 1br0 h GLU 32 N 0.87 0.70 -0.68 3.56 4.11 -1.55 -2.96 114.58 118.62 1br0 h GLU 32 Ca 0.21 -0.23 -0.01 0.00 0.07 0.00 0.00 59.36 59.40 1br0 h GLU 32 Cb 0.20 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 1br0 h GLU 32 CO -0.02 0.80 0.38 0.35 0.07 0.00 0.00 179.01 180.60 1br0 h PHE 33 N 0.51 0.92 -0.12 2.06 3.04 -1.44 -2.82 116.94 119.09 1br0 h PHE 33 Ca 0.11 -0.02 -0.15 0.00 3.98 0.00 0.00 57.97 61.89 1br0 h PHE 33 Cb 0.50 -0.30 -0.01 0.00 2.56 0.00 0.00 35.95 38.71 1br0 h PHE 33 CO 0.04 0.64 -0.57 0.74 -2.02 0.00 0.00 178.31 177.14 1br0 h PHE 34 N 0.93 0.47 -0.23 0.41 0.04 -1.15 -3.21 116.94 114.19 1br0 h PHE 34 Ca 0.24 -0.17 -0.07 0.00 2.80 0.00 0.00 57.97 60.77 1br0 h PHE 34 Cb 0.02 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.07 1br0 h PHE 34 CO -0.01 0.86 -0.14 1.05 -0.60 0.00 0.00 178.31 179.47 1br0 h GLU 35 N 0.28 0.51 -0.66 1.51 4.11 -1.56 -3.36 114.58 115.41 1br0 h GLU 35 Ca -0.00 -0.23 -0.08 0.00 0.07 0.00 0.00 59.36 59.11 1br0 h GLU 35 Cb 1.09 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 1br0 h GLU 35 CO 0.10 0.79 0.09 -0.56 0.07 0.00 0.00 179.01 179.50 1br0 h GLN 36 N 0.21 1.10 -0.61 1.06 3.07 -1.62 -3.32 115.11 114.99 1br0 h GLN 36 Ca 0.05 -0.30 0.10 0.00 0.09 0.00 0.00 58.65 58.59 1br0 h GLN 36 Cb 0.66 -0.12 -0.08 0.00 0.08 0.00 0.00 27.48 28.01 1br0 h GLN 36 CO 0.04 1.01 0.20 -0.39 0.09 0.00 0.00 178.83 179.78 1br0 h VAL 37 N 1.02 0.72 -0.42 1.86 -1.51 -1.69 -2.37 116.25 113.86 1br0 h VAL 37 Ca 0.20 -0.12 0.11 0.00 -1.23 0.00 0.00 66.70 65.66 1br0 h VAL 37 Cb 0.46 0.33 -0.02 0.00 -2.13 0.00 0.00 31.29 29.93 1br0 h VAL 37 CO 0.02 0.07 0.30 -0.33 -1.23 0.00 0.00 177.57 176.39 1br0 h GLU 38 N 0.36 0.06 -0.21 5.19 5.08 -1.70 -1.59 114.58 121.75 1br0 h GLU 38 Ca 0.32 -0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.51 1br0 h GLU 38 Cb 0.43 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1br0 h GLU 38 CO -0.34 0.04 -0.50 0.93 -1.00 0.00 0.00 179.01 178.13 1br0 h GLU 39 N 0.06 0.72 -0.06 2.33 5.08 -1.57 -2.92 114.58 118.21 1br0 h GLU 39 Ca 0.20 -0.49 -0.01 0.00 -1.00 0.00 0.00 59.36 58.07 1br0 h GLU 39 Cb 0.72 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.04 1br0 h GLU 39 CO -0.01 1.11 0.01 0.82 -1.00 0.00 0.00 179.01 179.94 1br0 h ILE 40 N 0.43 1.19 0.00 3.13 2.04 -1.11 -1.57 117.51 121.63 1br0 h ILE 40 Ca -0.00 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.26 1br0 h ILE 40 Cb 1.11 1.47 -0.00 0.00 -0.74 0.00 0.00 36.82 38.66 1br0 h ILE 40 CO 0.11 0.16 -0.06 0.08 0.00 0.00 0.00 178.15 178.44 1br0 h ARG 41 N -0.12 0.00 0.12 2.37 0.11 -1.46 -1.73 114.38 113.67 1br0 h ARG 41 Ca 0.02 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.09 1br0 h ARG 41 Cb 0.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.33 1br0 h ARG 41 CO 0.00 0.06 -0.06 0.78 0.10 0.00 0.00 179.97 180.85 1br0 h GLY 42 N 0.18 -0.17 1.02 0.08 0.00 -1.31 -2.62 103.07 100.24 1br0 h GLY 42 Ca -0.00 0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 1br0 h GLY 42 CO 0.01 -0.06 0.50 0.74 0.00 0.00 0.00 176.54 177.73 1br0 h PHE 43 N -0.40 1.14 -0.89 5.60 0.04 -1.27 -2.67 116.94 118.48 1br0 h PHE 43 Ca -0.02 -0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.77 1br0 h PHE 43 Cb 0.33 -0.37 -0.05 0.00 2.20 0.00 0.00 35.95 38.06 1br0 h PHE 43 CO 0.01 0.77 0.58 0.82 -0.60 0.00 0.00 178.31 179.89 1br0 h ILE 44 N 1.18 1.19 -0.54 -0.55 2.04 -1.39 -0.42 117.51 119.01 1br0 h ILE 44 Ca 0.31 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 1br0 h ILE 44 Cb -0.03 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 35.96 1br0 h ILE 44 CO -0.06 0.21 0.25 0.44 0.00 0.00 0.00 178.15 179.00 1br0 h ASP 45 N 1.15 0.71 -0.55 1.72 3.32 -1.35 -0.39 116.42 121.04 1br0 h ASP 45 Ca 0.34 -0.14 -0.04 0.00 0.02 0.00 0.00 57.03 57.21 1br0 h ASP 45 Cb -0.06 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.28 1br0 h ASP 45 CO -0.09 0.65 0.19 0.11 -1.72 0.00 0.00 179.24 178.38 1br0 h LYS 46 N 0.73 0.88 0.46 3.56 1.79 -1.14 -1.72 116.57 121.12 1br0 h LYS 46 Ca 0.18 -0.16 -0.02 0.00 -2.18 0.00 0.00 60.65 58.47 1br0 h LYS 46 Cb 0.13 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 1br0 h LYS 46 CO -0.02 0.75 -0.22 0.82 -1.08 0.00 0.00 179.45 179.70 1br0 h ILE 47 N 0.86 0.00 -0.06 1.86 1.08 -1.02 -1.93 117.51 118.30 1br0 h ILE 47 Ca 0.20 -0.47 0.02 0.00 -0.39 0.00 0.00 64.86 64.22 1br0 h ILE 47 Cb 0.23 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 33.98 1br0 h ILE 47 CO -0.01 0.00 0.14 0.00 -0.69 0.00 0.00 178.15 177.59 1br0 h ALA 48 N -1.25 1.38 0.01 1.87 0.00 -1.15 0.17 119.26 120.29 1br0 h ALA 48 Ca -0.06 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1br0 h ALA 48 Cb 0.47 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.27 1br0 h ALA 48 CO 0.10 -0.17 -0.37 0.93 0.00 0.00 0.00 179.25 179.74 1br0 h GLU 49 N 0.00 0.24 -0.15 0.00 5.08 -1.35 -2.59 114.58 115.80 1br0 h GLU 49 Ca 0.03 -0.27 -0.04 0.00 -1.00 0.00 0.00 59.36 58.08 1br0 h GLU 49 Cb 0.30 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1br0 h GLU 49 CO -0.00 1.00 -0.05 -0.91 -1.00 0.00 0.00 179.01 178.05 1br0 h ASN 50 N -0.41 0.30 -0.46 1.42 2.35 -0.86 -2.83 115.58 115.10 1br0 h ASN 50 Ca -0.05 -0.39 0.04 0.00 -0.55 0.00 0.00 56.30 55.35 1br0 h ASN 50 Cb 1.14 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 39.38 1br0 h ASN 50 CO 0.07 0.62 0.23 0.58 -1.65 0.00 0.00 177.43 177.28 1br0 h VAL 51 N -0.02 0.97 -0.66 2.81 2.07 -0.84 0.07 116.25 120.65 1br0 h VAL 51 Ca 0.04 -0.16 0.03 0.00 0.82 0.00 0.00 66.70 67.43 1br0 h VAL 51 Cb 0.49 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 1br0 h VAL 51 CO 0.02 0.08 0.44 -0.33 0.02 0.00 0.00 177.57 177.80 1br0 h GLU 52 N 0.46 0.79 -0.43 1.57 5.08 -1.55 -2.40 114.58 118.09 1br0 h GLU 52 Ca 0.20 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.38 1br0 h GLU 52 Cb 0.10 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1br0 h GLU 52 CO -0.14 0.52 -0.23 1.49 -1.00 0.00 0.00 179.01 179.66 1br0 h GLU 53 N 0.82 0.92 -0.85 2.33 4.81 -1.08 -3.19 114.58 118.34 1br0 h GLU 53 Ca 0.26 -0.41 0.16 0.00 -0.13 0.00 0.00 59.36 59.24 1br0 h GLU 53 Cb 0.03 -0.02 -0.10 0.00 0.63 0.00 0.00 28.75 29.29 1br0 h GLU 53 CO -0.07 1.07 0.42 0.28 -0.73 0.00 0.00 179.01 179.98 1br0 h VAL 54 N 0.75 0.69 -0.66 0.32 2.07 -0.83 -2.80 116.25 115.78 1br0 h VAL 54 Ca 0.09 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.43 1br0 h VAL 54 Cb 0.80 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 1br0 h VAL 54 CO 0.07 0.10 0.44 0.50 0.02 0.00 0.00 177.57 178.70 1br0 h LYS 55 N 0.57 0.83 -0.11 1.57 3.64 -1.42 0.79 116.57 122.44 1br0 h LYS 55 Ca 0.47 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 59.64 1br0 h LYS 55 Cb 0.71 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 1br0 h LYS 55 CO -0.39 0.55 -0.62 0.07 -2.27 0.00 0.00 179.45 176.79 1br0 h ARG 56 N 0.86 0.41 -0.07 1.90 0.11 -1.52 -3.36 114.38 112.70 1br0 h ARG 56 Ca 0.25 -0.29 -0.07 0.00 0.10 0.00 0.00 59.98 59.97 1br0 h ARG 56 Cb -0.04 0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.09 1br0 h ARG 56 CO -0.06 0.90 -0.25 0.87 0.10 0.00 0.00 179.97 181.53 1br0 h LYS 57 N 0.30 0.29 -0.30 0.08 1.57 -1.26 -3.36 116.57 113.89 1br0 h LYS 57 Ca -0.01 -0.22 -0.13 0.00 -1.87 0.00 0.00 60.65 58.42 1br0 h LYS 57 Cb 1.16 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.50 1br0 h LYS 57 CO 0.11 0.85 -0.34 0.45 -0.57 0.00 0.00 179.45 179.95 1br0 h HIS 58 N -0.20 0.78 -0.04 -1.35 3.86 -1.00 -1.83 115.15 115.37 1br0 h HIS 58 Ca -0.01 -0.21 -0.11 0.00 -1.16 0.00 0.00 60.37 58.88 1br0 h HIS 58 Cb 0.88 -0.18 0.01 0.00 1.06 0.00 0.00 27.41 29.18 1br0 h HIS 58 CO 0.12 0.92 -0.42 1.03 0.86 0.00 0.00 177.93 180.44 1br0 h SER 59 N 0.56 0.44 0.27 2.45 0.87 -1.79 0.01 113.55 116.36 1br0 h SER 59 Ca 0.06 -0.71 -0.03 0.00 -1.23 0.00 0.00 61.79 59.88 1br0 h SER 59 Cb 0.85 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 62.67 1br0 h SER 59 CO 0.07 1.08 -0.14 0.00 -0.53 0.00 0.00 176.83 177.32 1br0 h ALA 60 N 0.37 1.45 0.00 6.23 0.00 -1.70 -0.58 119.26 125.03 1br0 h ALA 60 Ca -0.04 -0.12 -0.24 0.00 0.00 0.00 0.00 54.91 54.50 1br0 h ALA 60 Cb 1.11 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 1br0 h ALA 60 CO 0.09 0.17 -1.39 0.82 0.00 0.00 0.00 179.25 178.93 1br0 h ILE 61 N 0.00 1.07 0.00 0.00 2.04 -1.44 -2.36 117.51 116.81 1br0 h ILE 61 Ca -0.00 -2.81 -0.02 0.00 1.00 0.00 0.00 64.86 63.02 1br0 h ILE 61 Cb 0.31 2.50 -0.00 0.00 -0.74 0.00 0.00 36.82 38.89 1br0 h ILE 61 CO 0.02 0.61 -0.11 0.25 0.00 0.00 0.00 178.15 178.92 1br0 h LEU 62 N 0.00 0.00 0.34 1.44 6.46 -0.72 -1.77 115.31 121.07 1br0 h LEU 62 Ca -0.17 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.57 1br0 h LEU 62 Cb 1.86 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.79 1br0 h LEU 62 CO 0.09 0.11 -0.16 0.00 -0.62 0.00 0.00 178.44 177.86 1br0 h ALA 63 N 1.89 -0.50 -2.15 1.25 0.00 -1.16 -3.39 119.26 115.21 1br0 h ALA 63 Ca -0.00 -0.10 -0.72 0.00 0.00 0.00 0.00 54.91 54.08 1br0 h ALA 63 Cb 0.47 0.18 -0.20 0.00 0.00 0.00 0.00 17.79 18.24 1br0 h ALA 63 CO 0.01 -0.46 0.70 -1.12 0.00 0.00 0.00 179.25 178.38 1br0 s SER 64 N -4.74 6.74 0.51 0.00 0.01 -0.89 -4.92 113.70 110.41 1br0 s SER 64 Ca -0.07 -2.37 0.34 0.00 1.31 0.00 0.00 55.95 55.16 1br0 s SER 64 Cb 0.01 -2.35 1.82 0.00 0.21 0.00 0.00 66.02 65.71 1br0 s SER 64 CO 0.20 -0.88 2.05 -0.65 0.41 0.00 0.00 173.24 174.37 1br0 h PRO 65 N 8.30 0.00 -2.96 12.44 0.11 -1.52 -2.98 132.00 145.39 1br0 h PRO 65 Ca 0.16 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.66 1br0 h PRO 65 Cb 1.01 0.00 -0.41 0.00 0.11 0.00 0.00 31.00 31.71 1br0 h PRO 65 CO 1.03 0.00 -0.67 -0.80 -0.21 0.00 0.00 178.00 177.35 1br0 s ASN 66 N -4.71 4.04 0.00 -2.05 0.01 -1.26 -5.04 114.94 105.93 1br0 s ASN 66 Ca -0.03 -3.54 0.00 0.00 -0.71 0.00 0.00 52.86 48.57 1br0 s ASN 66 Cb 0.10 -1.36 0.00 0.00 0.41 0.00 0.00 41.25 40.40 1br0 s ASN 66 CO 0.33 -0.13 0.05 -0.81 -1.51 0.00 0.00 177.10 175.04 1br0 n PRO 67 N 2.35 0.00 -3.81 -0.60 -0.05 -1.13 -5.08 135.00 126.68 1br0 n PRO 67 Ca 0.20 0.01 -0.10 0.00 -0.05 0.00 0.00 63.50 63.56 1br0 n PRO 67 Cb 0.37 -0.56 -0.07 0.00 -0.05 0.00 0.00 33.50 33.19 1br0 n PRO 67 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 175.50 175.79 1br0 s ASP 68 N -1.13 0.02 0.59 3.54 -1.08 -1.26 -5.07 116.67 112.27 1br0 s ASP 68 Ca 0.00 -0.48 0.28 0.00 -0.52 0.00 0.00 52.55 51.83 1br0 s ASP 68 Cb 0.00 0.35 1.68 0.00 -1.46 0.00 0.00 42.92 43.49 1br0 s ASP 68 CO 0.00 -0.69 2.14 -0.08 0.52 0.00 0.00 175.17 177.05 1br0 h GLU 69 N 2.91 0.00 -0.90 4.34 4.81 -2.04 -2.86 114.58 120.85 1br0 h GLU 69 Ca -0.33 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 58.98 1br0 h GLU 69 Cb 1.21 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.52 1br0 h GLU 69 CO 0.52 0.00 0.58 -0.22 -0.73 0.00 0.00 179.01 179.16 1br0 h LYS 70 N 0.00 0.91 0.16 1.92 3.64 -2.01 -3.34 116.57 117.85 1br0 h LYS 70 Ca 0.07 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1br0 h LYS 70 Cb 0.36 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1br0 h LYS 70 CO -0.00 0.60 -0.07 1.79 -2.27 0.00 0.00 179.45 179.50 1br0 h THR 71 N 0.94 0.88 0.15 1.00 1.35 -1.94 -3.35 112.91 111.94 1br0 h THR 71 Ca 0.41 -1.14 -0.20 0.00 -0.55 0.00 0.00 66.41 64.93 1br0 h THR 71 Cb 0.33 1.47 0.02 0.00 -1.73 0.00 0.00 68.15 68.24 1br0 h THR 71 CO -0.17 0.23 -0.87 0.11 -0.25 0.00 0.00 175.52 174.56 1br0 h LYS 72 N -0.85 0.32 -1.14 4.72 1.57 -1.73 -3.25 116.57 116.21 1br0 h LYS 72 Ca -0.02 -0.55 0.44 0.00 -1.87 0.00 0.00 60.65 58.65 1br0 h LYS 72 Cb 0.53 0.20 -0.16 0.00 0.08 0.00 0.00 32.23 32.88 1br0 h LYS 72 CO 0.03 1.26 0.67 0.93 -0.57 0.00 0.00 179.45 181.78 1br0 h GLU 73 N -0.33 0.01 0.00 3.15 4.39 -1.78 -0.47 114.58 119.56 1br0 h GLU 73 Ca -0.15 -0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.38 1br0 h GLU 73 Cb 1.69 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 30.31 1br0 h GLU 73 CO 0.16 0.01 -0.96 1.49 -1.16 0.00 0.00 179.01 178.55 1br0 h GLU 74 N 0.01 0.00 -0.46 2.33 4.81 -1.70 -3.41 114.58 116.16 1br0 h GLU 74 Ca 0.86 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 60.13 1br0 h GLU 74 Cb 2.45 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 31.80 1br0 h GLU 74 CO -0.66 0.63 0.31 -0.07 -0.73 0.00 0.00 179.01 178.49 1br0 h LEU 75 N 0.00 0.41 -1.27 1.64 3.38 -1.10 -1.61 115.31 116.76 1br0 h LEU 75 Ca -0.07 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 1br0 h LEU 75 Cb 1.62 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.26 1br0 h LEU 75 CO 0.08 0.28 -0.35 -0.33 0.09 0.00 0.00 178.44 178.22 1br0 h GLU 76 N 0.48 0.00 0.18 1.13 5.08 -1.79 -2.36 114.58 117.29 1br0 h GLU 76 Ca 0.19 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1br0 h GLU 76 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1br0 h GLU 76 CO -0.05 0.35 -0.09 1.49 -1.00 0.00 0.00 179.01 179.71 1br0 h GLU 77 N 0.00 -0.23 0.00 2.33 4.81 -1.55 -2.07 114.58 117.87 1br0 h GLU 77 Ca -0.00 0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.18 1br0 h GLU 77 Cb 0.68 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 1br0 h GLU 77 CO 0.05 0.18 -0.28 1.37 -0.73 0.00 0.00 179.01 179.59 1br0 h LEU 78 N -0.79 0.00 -0.01 1.64 8.10 -1.60 -0.63 115.31 122.03 1br0 h LEU 78 Ca -0.02 0.00 -0.07 0.00 0.11 0.00 0.00 57.88 57.90 1br0 h LEU 78 Cb 0.52 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.74 1br0 h LEU 78 CO 0.04 0.28 -0.26 0.24 -4.11 0.00 0.00 178.44 174.63 1br0 h MET 79 N 0.00 0.20 0.00 0.17 2.86 -1.56 -2.92 114.93 113.69 1br0 h MET 79 Ca -0.00 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.44 1br0 h MET 79 Cb 0.50 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.21 1br0 h MET 79 CO 0.04 0.91 0.00 0.77 1.06 0.00 0.00 176.91 179.68 1br0 h SER 80 N -0.43 0.00 -0.00 1.22 0.02 -1.40 -2.08 113.55 110.89 1br0 h SER 80 Ca -0.03 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.87 1br0 h SER 80 Cb 0.99 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.53 1br0 h SER 80 CO 0.05 0.00 -0.19 -0.78 -1.14 0.00 0.00 176.83 174.78 1br0 h ASP 81 N 0.00 0.17 -0.65 3.07 1.82 -1.17 -3.11 116.42 116.55 1br0 h ASP 81 Ca 0.00 -0.78 -0.06 0.00 -0.39 0.00 0.00 57.03 55.80 1br0 h ASP 81 Cb 0.16 -0.05 -0.03 0.00 0.68 0.00 0.00 39.33 40.09 1br0 h ASP 81 CO 0.00 0.93 0.17 0.40 -1.61 0.00 0.00 179.24 179.12 1br0 h ILE 82 N -0.58 1.25 -0.41 2.25 2.04 -1.47 -2.95 117.51 117.65 1br0 h ILE 82 Ca -0.02 -0.93 0.06 0.00 1.00 0.00 0.00 64.86 64.96 1br0 h ILE 82 Cb 0.95 0.56 -0.05 0.00 -0.74 0.00 0.00 36.82 37.55 1br0 h ILE 82 CO 0.04 0.36 0.12 0.50 0.00 0.00 0.00 178.15 179.16 1br0 h LYS 83 N 1.00 0.25 -0.24 2.37 3.11 -1.52 -0.24 116.57 121.30 1br0 h LYS 83 Ca 0.21 -0.02 -0.16 0.00 -2.81 0.00 0.00 60.65 57.87 1br0 h LYS 83 Cb 0.35 -0.06 0.00 0.00 -1.00 0.00 0.00 32.23 31.52 1br0 h LYS 83 CO 0.00 0.17 -0.49 0.87 -2.81 0.00 0.00 179.45 177.19 1br0 h LYS 84 N 0.26 0.76 0.26 1.90 1.57 -1.50 -2.39 116.57 117.44 1br0 h LYS 84 Ca 0.19 -0.49 -0.01 0.00 -1.87 0.00 0.00 60.65 58.47 1br0 h LYS 84 Cb 0.21 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1br0 h LYS 84 CO -0.22 1.12 -0.13 1.15 -0.57 0.00 0.00 179.45 180.80 1br0 h THR 85 N 0.49 0.00 -1.07 -0.16 2.02 -1.60 -2.72 112.91 109.87 1br0 h THR 85 Ca 0.01 -0.54 0.30 0.00 0.77 0.00 0.00 66.41 66.94 1br0 h THR 85 Cb 1.10 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.45 1br0 h THR 85 CO 0.11 0.00 0.75 0.00 0.37 0.00 0.00 175.52 176.75 1br0 h ALA 86 N -1.29 2.82 -0.05 6.16 0.00 -1.18 0.69 119.26 126.39 1br0 h ALA 86 Ca -0.04 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1br0 h ALA 86 Cb 0.27 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1br0 h ALA 86 CO 0.06 -1.15 -0.15 -0.91 0.00 0.00 0.00 179.25 177.11 1br0 h ASN 87 N 0.10 0.22 -0.62 0.00 2.35 -1.57 -0.31 115.58 115.75 1br0 h ASN 87 Ca 0.53 -0.60 0.15 0.00 -0.55 0.00 0.00 56.30 55.83 1br0 h ASN 87 Cb 1.91 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 40.18 1br0 h ASN 87 CO -0.08 0.78 0.43 0.11 -1.65 0.00 0.00 177.43 177.02 1br0 h LYS 88 N -0.33 0.19 0.00 0.81 1.57 -0.77 -2.72 116.57 115.31 1br0 h LYS 88 Ca -0.00 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.68 1br0 h LYS 88 Cb 0.76 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 1br0 h LYS 88 CO 0.03 0.13 -0.61 0.28 -0.57 0.00 0.00 179.45 178.71 1br0 h VAL 89 N 0.20 0.61 -0.89 0.50 2.07 -1.00 -3.31 116.25 114.43 1br0 h VAL 89 Ca 0.30 -1.63 0.13 0.00 0.82 0.00 0.00 66.70 66.31 1br0 h VAL 89 Cb 0.90 1.33 -0.09 0.00 -1.52 0.00 0.00 31.29 31.92 1br0 h VAL 89 CO -0.05 0.21 0.51 0.08 0.02 0.00 0.00 177.57 178.33 1br0 h ARG 90 N -1.00 0.75 -0.01 1.57 0.11 -1.10 -2.04 114.38 112.66 1br0 h ARG 90 Ca -0.12 -0.05 -0.01 0.00 0.10 0.00 0.00 59.98 59.90 1br0 h ARG 90 Cb 0.79 -0.17 -0.00 0.00 1.11 0.00 0.00 29.97 31.69 1br0 h ARG 90 CO -0.07 0.50 -0.03 0.77 0.10 0.00 0.00 179.97 181.23 1br0 h SER 91 N 0.78 0.01 0.24 0.08 0.02 -1.68 -2.75 113.55 110.25 1br0 h SER 91 Ca 0.46 -0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 61.17 1br0 h SER 91 Cb 0.54 -0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.08 1br0 h SER 91 CO -0.30 0.05 -0.97 0.11 -1.14 0.00 0.00 176.83 174.58 1br0 h LYS 92 N 0.02 0.50 -0.59 3.45 1.57 -1.47 -3.30 116.57 116.74 1br0 h LYS 92 Ca 0.00 -0.53 -0.03 0.00 -1.87 0.00 0.00 60.65 58.22 1br0 h LYS 92 Cb 0.07 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1br0 h LYS 92 CO 0.00 1.17 0.24 -0.07 -0.57 0.00 0.00 179.45 180.22 1br0 h LEU 93 N 0.28 0.82 -1.28 2.94 3.38 -1.38 -3.12 115.31 116.94 1br0 h LEU 93 Ca -0.09 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 57.74 1br0 h LEU 93 Cb 1.61 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 42.10 1br0 h LEU 93 CO 0.17 0.76 0.50 0.07 0.09 0.00 0.00 178.44 180.04 1br0 h LYS 94 N 0.82 0.90 0.00 1.13 2.10 -1.64 -2.94 116.57 116.94 1br0 h LYS 94 Ca 0.20 -0.05 -0.02 0.00 -2.00 0.00 0.00 60.65 58.77 1br0 h LYS 94 Cb 0.20 -0.20 -0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1br0 h LYS 94 CO -0.02 0.59 -0.11 0.77 -2.00 0.00 0.00 179.45 178.69 1br0 h SER 95 N 0.92 0.00 0.03 7.07 0.02 -1.62 0.12 113.55 120.09 1br0 h SER 95 Ca 0.31 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.26 1br0 h SER 95 Cb 0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.61 1br0 h SER 95 CO -0.09 0.11 -0.01 0.40 -1.14 0.00 0.00 176.83 176.09 1br0 h ILE 96 N 0.00 1.40 -1.00 3.27 5.03 -1.55 -2.56 117.51 122.10 1br0 h ILE 96 Ca -0.00 -1.76 0.01 0.00 -0.12 0.00 0.00 64.86 62.99 1br0 h ILE 96 Cb 0.28 2.51 -0.05 0.00 -3.03 0.00 0.00 36.82 36.53 1br0 h ILE 96 CO 0.01 0.42 0.66 -0.08 -0.68 0.00 0.00 178.15 178.49 1br0 h GLU 97 N -0.86 1.31 -0.52 2.37 4.81 -1.49 -2.17 114.58 118.03 1br0 h GLU 97 Ca -0.00 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.10 1br0 h GLU 97 Cb 0.72 -0.30 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 1br0 h GLU 97 CO 0.01 0.87 0.13 1.96 -0.73 0.00 0.00 179.01 181.25 1br0 h GLN 98 N 1.35 0.83 0.00 1.92 1.08 -0.92 -2.86 115.11 116.52 1br0 h GLN 98 Ca 0.37 -0.20 -0.04 0.00 -1.45 0.00 0.00 58.65 57.33 1br0 h GLN 98 Cb -0.14 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.17 1br0 h GLN 98 CO -0.08 0.79 -0.20 1.03 -0.95 0.00 0.00 178.83 179.41 1br0 h SER 99 N 0.73 0.00 0.07 1.46 0.87 -1.37 -2.66 113.55 112.65 1br0 h SER 99 Ca 0.16 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.72 1br0 h SER 99 Cb 0.32 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 1br0 h SER 99 CO 0.00 0.20 -0.03 0.40 -0.53 0.00 0.00 176.83 176.87 1br0 h ILE 100 N 0.00 0.00 -1.17 2.23 2.04 -1.45 -0.62 117.51 118.53 1br0 h ILE 100 Ca -0.00 -0.66 0.34 0.00 1.00 0.00 0.00 64.86 65.54 1br0 h ILE 100 Cb 0.74 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.72 1br0 h ILE 100 CO 0.03 0.00 0.76 -0.33 0.00 0.00 0.00 178.15 178.61 1br0 h GLU 101 N -0.76 0.23 0.00 2.37 4.39 -1.63 0.40 114.58 119.57 1br0 h GLU 101 Ca -0.01 -0.01 -0.06 0.00 0.34 0.00 0.00 59.36 59.61 1br0 h GLU 101 Cb 0.07 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 1br0 h GLU 101 CO 0.02 0.15 -1.25 0.94 -1.16 0.00 0.00 179.01 177.70 1br0 n GLN 102 N -4.61 0.62 -3.22 2.33 0.00 -1.00 -4.53 117.38 106.98 1br0 n GLN 102 Ca 0.30 0.12 -0.24 0.00 -0.00 0.00 0.00 57.00 57.19 1br0 n GLN 102 Cb 1.14 -1.79 -0.06 0.00 0.00 0.00 0.00 30.24 29.53 1br0 n GLN 102 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1br0 n GLU 103 N -2.71 1.40 0.00 3.69 1.02 -0.24 -4.85 120.64 118.95 1br0 n GLU 103 Ca -0.04 -3.73 0.10 0.00 -0.02 0.00 0.00 57.16 53.47 1br0 n GLU 103 Cb 0.66 -1.64 0.50 0.00 -0.02 0.00 0.00 31.44 30.93 1br0 n GLU 103 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 1br0 n GLU 104 N 0.89 0.25 -0.60 3.49 0.28 0.13 -4.54 120.64 120.55 1br0 n GLU 104 Ca 0.25 0.10 0.00 0.00 -0.16 0.00 0.00 57.16 57.35 1br0 n GLU 104 Cb 0.52 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.89 1br0 n GLU 104 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1br0 n GLY 105 N 0.44 0.65 3.10 -1.84 0.00 -1.26 -3.73 105.19 102.56 1br0 n GLY 105 Ca 0.09 -0.45 -0.14 0.00 0.00 0.00 0.00 46.02 45.52 1br0 n GLY 105 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1br0 n LEU 106 N 0.00 -5.24 -1.64 0.99 7.99 -1.26 -4.36 117.00 113.47 1br0 n LEU 106 Ca 0.00 -0.64 -0.01 0.00 -0.01 0.00 0.00 56.01 55.35 1br0 n LEU 106 Cb 0.00 -2.98 0.00 0.00 -0.11 0.00 0.00 43.42 40.33 1br0 n LEU 106 CO 0.00 0.11 0.01 -3.20 -1.51 0.00 0.00 177.39 172.80 1br0 n ASN 107 N -3.07 -2.59 -4.07 -1.43 5.15 -1.26 -5.14 115.26 102.85 1br0 n ASN 107 Ca -0.08 0.04 -0.10 0.00 -0.60 0.00 0.00 54.58 53.85 1br0 n ASN 107 Cb 0.61 -1.43 -0.09 0.00 -0.53 0.00 0.00 39.78 38.34 1br0 n ASN 107 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1br0 s ARG 108 N -1.43 1.03 -0.20 1.20 1.81 -1.24 -5.16 118.95 114.95 1br0 s ARG 108 Ca 0.02 -1.33 -0.07 0.00 -1.72 0.00 0.00 55.73 52.63 1br0 s ARG 108 Cb -0.01 0.30 0.09 0.00 -0.45 0.00 0.00 34.95 34.88 1br0 s ARG 108 CO 0.08 -0.33 0.44 0.45 -0.68 0.00 0.00 175.30 175.25 1br0 s SER 109 N -3.01 -0.35 -0.06 0.23 0.15 -1.26 -4.89 113.70 104.51 1br0 s SER 109 Ca 0.21 1.03 -0.14 0.00 0.70 0.00 0.00 55.95 57.75 1br0 s SER 109 Cb 0.06 1.35 0.03 0.00 -1.71 0.00 0.00 66.02 65.75 1br0 s SER 109 CO 0.01 -0.23 0.34 -0.44 1.20 0.00 0.00 173.24 174.12 1br0 s SER 110 N 2.50 -0.27 0.22 5.45 0.01 -1.26 -5.10 113.70 115.25 1br0 s SER 110 Ca -0.03 0.32 -0.08 0.00 1.31 0.00 0.00 55.95 57.47 1br0 s SER 110 Cb -0.12 0.46 0.19 0.00 0.21 0.00 0.00 66.02 66.77 1br0 s SER 110 CO -0.13 -0.34 1.86 0.00 0.41 0.00 0.00 173.24 175.04 1br0 h ALA 111 N 4.44 1.09 -0.56 1.44 0.00 -2.02 -2.01 119.26 121.63 1br0 h ALA 111 Ca -0.28 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 1br0 h ALA 111 Cb 1.18 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1br0 h ALA 111 CO 0.36 0.57 0.24 -0.44 0.00 0.00 0.00 179.25 179.98 1br0 h ASP 112 N 1.17 0.73 0.20 0.00 5.19 -2.00 -1.17 116.42 120.54 1br0 h ASP 112 Ca 0.30 -0.08 -0.05 0.00 -0.62 0.00 0.00 57.03 56.58 1br0 h ASP 112 Cb -0.01 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 39.30 1br0 h ASP 112 CO -0.05 0.64 -0.22 0.25 -3.12 0.00 0.00 179.24 176.74 1br0 h LEU 113 N 0.80 0.05 0.04 1.55 6.46 -1.90 -3.29 115.31 119.01 1br0 h LEU 113 Ca 0.19 -0.01 -0.32 0.00 -0.12 0.00 0.00 57.88 57.62 1br0 h LEU 113 Cb 0.13 -0.01 -0.04 0.00 -0.73 0.00 0.00 40.66 40.01 1br0 h LEU 113 CO -0.02 0.27 -1.85 0.54 -0.62 0.00 0.00 178.44 176.76 1br0 n ARG 114 N -4.25 0.68 -0.17 1.25 1.74 -0.79 -4.01 116.66 111.10 1br0 n ARG 114 Ca -0.02 0.27 -0.01 0.00 -0.77 0.00 0.00 57.85 57.32 1br0 n ARG 114 Cb 0.29 -1.75 0.08 0.00 -1.02 0.00 0.00 32.46 30.07 1br0 n ARG 114 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1br0 h ILE 115 N 0.02 0.70 -0.67 0.55 2.04 -1.32 -1.79 117.51 117.04 1br0 h ILE 115 Ca -0.35 -0.09 0.06 0.00 1.00 0.00 0.00 64.86 65.49 1br0 h ILE 115 Cb 2.03 0.42 -0.06 0.00 -0.74 0.00 0.00 36.82 38.48 1br0 h ILE 115 CO 0.08 0.05 0.36 0.03 0.00 0.00 0.00 178.15 178.67 1br0 h ARG 116 N 0.25 0.65 -0.64 2.37 3.08 -1.71 -1.62 114.38 116.76 1br0 h ARG 116 Ca 0.27 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.25 1br0 h ARG 116 Cb 0.38 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 1br0 h ARG 116 CO -0.35 0.43 0.26 0.87 -1.07 0.00 0.00 179.97 180.11 1br0 h LYS 117 N 0.67 0.93 -0.36 0.04 1.57 -1.66 -1.75 116.57 116.01 1br0 h LYS 117 Ca 0.31 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.91 1br0 h LYS 117 Cb 0.21 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1br0 h LYS 117 CO -0.20 0.76 0.13 1.15 -0.57 0.00 0.00 179.45 180.72 1br0 h THR 118 N 0.92 1.20 -0.28 -0.16 2.02 -0.92 -2.88 112.91 112.80 1br0 h THR 118 Ca 0.22 -0.62 -0.17 0.00 0.77 0.00 0.00 66.41 66.61 1br0 h THR 118 Cb 0.17 0.94 -0.00 0.00 -1.74 0.00 0.00 68.15 67.52 1br0 h THR 118 CO -0.02 0.22 -0.49 1.56 0.37 0.00 0.00 175.52 177.16 1br0 h GLN 119 N 0.43 0.77 -0.46 6.66 1.08 -1.32 -3.15 115.11 119.11 1br0 h GLN 119 Ca 0.12 -0.46 -0.05 0.00 -1.45 0.00 0.00 58.65 56.82 1br0 h GLN 119 Cb 0.21 0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.66 1br0 h GLN 119 CO -0.01 1.08 0.10 1.25 -0.95 0.00 0.00 178.83 180.30 1br0 h HIS 120 N 0.61 0.72 -0.56 2.96 2.76 -1.38 -0.39 115.15 119.87 1br0 h HIS 120 Ca 0.03 -0.06 -0.11 0.00 -2.20 0.00 0.00 60.37 58.02 1br0 h HIS 120 Cb 1.07 -0.21 -0.02 0.00 1.55 0.00 0.00 27.41 29.80 1br0 h HIS 120 CO 0.06 0.63 -0.08 1.03 -1.30 0.00 0.00 177.93 178.26 1br0 h SER 121 N 0.68 1.04 -0.24 3.26 0.87 -1.59 -0.55 113.55 117.02 1br0 h SER 121 Ca 0.15 -0.33 -0.08 0.00 -1.23 0.00 0.00 61.79 60.30 1br0 h SER 121 Cb 0.28 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 1br0 h SER 121 CO -0.00 1.14 -0.15 0.74 -0.53 0.00 0.00 176.83 178.03 1br0 h THR 122 N 0.93 1.31 -0.70 2.23 2.02 -1.53 -1.41 112.91 115.76 1br0 h THR 122 Ca 0.15 -1.26 0.05 0.00 0.77 0.00 0.00 66.41 66.12 1br0 h THR 122 Cb 0.65 1.61 -0.05 0.00 -1.74 0.00 0.00 68.15 68.62 1br0 h THR 122 CO 0.05 0.39 0.41 -0.07 0.37 0.00 0.00 175.52 176.67 1br0 h LEU 123 N 0.23 0.64 -1.12 2.58 3.38 -1.14 -2.56 115.31 117.32 1br0 h LEU 123 Ca 0.05 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 1br0 h LEU 123 Cb 0.67 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1br0 h LEU 123 CO 0.04 0.42 -0.41 -1.28 0.09 0.00 0.00 178.44 177.30 1br0 h SER 124 N 0.77 0.00 -0.36 -0.43 0.87 -1.15 -2.67 113.55 110.57 1br0 h SER 124 Ca 0.30 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.76 1br0 h SER 124 Cb 0.14 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 1br0 h SER 124 CO -0.16 0.41 -0.16 -0.09 -0.53 0.00 0.00 176.83 176.30 1br0 h ARG 125 N 0.00 0.83 0.02 2.24 2.43 -0.98 -0.52 114.38 118.40 1br0 h ARG 125 Ca -0.00 -0.31 -0.27 0.00 -0.81 0.00 0.00 59.98 58.59 1br0 h ARG 125 Cb 0.79 -0.05 0.02 0.00 -0.42 0.00 0.00 29.97 30.31 1br0 h ARG 125 CO 0.05 0.94 -1.06 -0.22 -1.51 0.00 0.00 179.97 178.17 1br0 h LYS 126 N 0.74 0.65 -0.58 0.20 1.63 -1.54 -3.23 116.57 114.44 1br0 h LYS 126 Ca 0.11 -0.72 -0.00 0.00 -0.85 0.00 0.00 60.65 59.19 1br0 h LYS 126 Cb 0.67 0.21 -0.03 0.00 -0.60 0.00 0.00 32.23 32.48 1br0 h LYS 126 CO 0.05 1.30 0.35 0.35 -3.45 0.00 0.00 179.45 178.05 1br0 h PHE 127 N 0.36 0.75 -0.21 1.91 3.57 -1.53 -3.27 116.94 118.52 1br0 h PHE 127 Ca -0.13 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.30 1br0 h PHE 127 Cb 1.71 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 40.20 1br0 h PHE 127 CO 0.10 0.50 -0.18 -0.24 -2.23 0.00 0.00 178.31 176.26 1br0 h VAL 128 N 0.80 1.32 -0.80 1.41 3.04 -1.20 -0.63 116.25 120.19 1br0 h VAL 128 Ca 0.21 -1.32 0.22 0.00 -1.01 0.00 0.00 66.70 64.80 1br0 h VAL 128 Cb -0.04 1.71 -0.04 0.00 -2.01 0.00 0.00 31.29 30.91 1br0 h VAL 128 CO -0.04 0.40 0.56 -0.33 -1.01 0.00 0.00 177.57 177.16 1br0 h GLU 129 N 0.18 0.08 0.00 4.17 5.08 -1.61 -0.72 114.58 121.77 1br0 h GLU 129 Ca 0.04 -0.01 -0.44 0.00 -1.00 0.00 0.00 59.36 57.96 1br0 h GLU 129 Cb 0.72 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.88 1br0 h GLU 129 CO 0.05 0.06 -2.38 1.55 -1.00 0.00 0.00 179.01 177.28 1br0 n VAL 130 N -4.35 1.53 -0.11 3.13 3.14 -1.24 -3.99 118.33 116.44 1br0 n VAL 130 Ca 0.16 -0.34 -0.10 0.00 -2.96 0.00 0.00 64.34 61.10 1br0 n VAL 130 Cb 0.81 -1.90 -0.02 0.00 -1.06 0.00 0.00 33.84 31.66 1br0 n VAL 130 CO 0.00 0.00 0.00 -0.03 -6.46 0.00 0.00 176.83 170.34 1br0 h MET 131 N -1.00 0.52 0.00 1.45 -1.53 -1.13 0.10 114.93 113.34 1br0 h MET 131 Ca -0.66 -0.11 -0.05 0.00 -3.44 0.00 0.00 59.70 55.45 1br0 h MET 131 Cb 1.58 -0.08 -0.01 0.00 -0.55 0.00 0.00 31.60 32.54 1br0 h MET 131 CO -0.40 0.54 -0.22 1.03 0.14 0.00 0.00 176.91 178.01 1br0 h SER 132 N 0.39 0.00 -0.19 1.39 0.87 -1.33 -1.56 113.55 113.12 1br0 h SER 132 Ca 0.11 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.58 1br0 h SER 132 Cb 0.24 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.20 1br0 h SER 132 CO -0.00 0.22 -0.23 -0.08 -0.53 0.00 0.00 176.83 176.20 1br0 h GLU 133 N 0.00 0.49 -0.63 2.24 4.81 -1.66 -3.15 114.58 116.69 1br0 h GLU 133 Ca -0.00 -0.28 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 1br0 h GLU 133 Cb 0.41 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 1br0 h GLU 133 CO 0.03 0.86 0.41 -0.92 -0.73 0.00 0.00 179.01 178.66 1br0 h TYR 134 N 0.16 0.79 -0.70 0.92 3.20 -0.71 -1.22 116.97 119.41 1br0 h TYR 134 Ca 0.02 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.93 1br0 h TYR 134 Cb 0.79 -0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.76 1br0 h TYR 134 CO 0.08 0.51 0.45 -0.97 -1.64 0.00 0.00 178.16 176.59 1br0 h ASN 135 N 0.85 0.76 0.89 -2.11 -1.24 -1.35 -2.54 115.58 110.83 1br0 h ASN 135 Ca 0.23 -0.01 -0.11 0.00 0.71 0.00 0.00 56.30 57.12 1br0 h ASN 135 Cb -0.09 -0.18 -0.02 0.00 0.73 0.00 0.00 38.32 38.77 1br0 h ASN 135 CO -0.05 0.54 -0.51 0.00 -1.29 0.00 0.00 177.43 176.12 1br0 h ALA 136 N 1.28 0.89 -0.17 1.57 0.00 -1.49 -3.27 119.26 118.06 1br0 h ALA 136 Ca 0.27 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1br0 h ALA 136 Cb -0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1br0 h ALA 136 CO -0.08 0.64 -0.05 1.15 0.00 0.00 0.00 179.25 180.90 1br0 h THR 137 N 0.00 1.30 -0.23 0.00 2.02 -1.09 -2.23 112.91 112.67 1br0 h THR 137 Ca -0.01 -1.05 -0.04 0.00 0.77 0.00 0.00 66.41 66.09 1br0 h THR 137 Cb 1.10 1.63 -0.01 0.00 -1.74 0.00 0.00 68.15 69.13 1br0 h THR 137 CO 0.07 0.31 0.01 -0.61 0.37 0.00 0.00 175.52 175.67 1br0 h GLN 138 N 0.04 0.41 -0.10 6.66 4.15 -1.61 -2.88 115.11 121.79 1br0 h GLN 138 Ca 0.04 -0.13 -0.04 0.00 0.77 0.00 0.00 58.65 59.30 1br0 h GLN 138 Cb 0.51 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.15 1br0 h GLN 138 CO 0.02 0.58 -0.11 0.77 -1.93 0.00 0.00 178.83 178.16 1br0 h SER 139 N 0.18 0.13 0.45 -0.69 0.02 -1.69 -2.99 113.55 108.97 1br0 h SER 139 Ca 0.07 -0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 60.94 1br0 h SER 139 Cb 0.39 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 1br0 h SER 139 CO 0.01 0.27 -0.28 -0.78 -1.14 0.00 0.00 176.83 174.91 1br0 h ASP 140 N 0.14 0.00 0.00 3.07 3.58 -1.38 -0.63 116.42 121.20 1br0 h ASP 140 Ca 0.03 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.48 1br0 h ASP 140 Cb 0.29 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.34 1br0 h ASP 140 CO 0.02 0.28 0.00 0.00 -2.88 0.00 0.00 179.24 176.65 1br0 n TYR 141 N -3.86 0.00 -1.65 0.28 9.36 -1.09 -3.90 117.16 116.31 1br0 n TYR 141 Ca -0.02 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.20 1br0 n TYR 141 Cb 0.36 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.07 1br0 n TYR 141 CO 0.00 0.00 0.00 2.89 0.22 0.00 0.00 176.86 179.97 1br0 n ARG 142 N -0.65 0.00 0.00 2.98 1.85 -1.15 -4.50 116.66 115.19 1br0 n ARG 142 Ca 0.07 -0.06 0.00 0.00 -1.00 0.00 0.00 57.85 56.86 1br0 n ARG 142 Cb 0.03 -0.18 0.00 0.00 -1.05 0.00 0.00 32.46 31.27 1br0 n ARG 142 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77 1br0 n GLU 143 N 0.00 0.00 -3.90 2.89 0.28 -0.25 -4.71 120.64 114.94 1br0 n GLU 143 Ca 0.00 0.16 -0.32 0.00 -0.16 0.00 0.00 57.16 56.84 1br0 n GLU 143 Cb 0.33 -0.58 -0.13 0.00 1.43 0.00 0.00 31.44 32.49 1br0 n GLU 143 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 1br0 s ARG 144 N -0.72 2.06 0.08 3.44 3.52 -1.26 -4.72 118.95 121.34 1br0 s ARG 144 Ca 0.00 -2.52 0.17 0.00 -0.13 0.00 0.00 55.73 53.25 1br0 s ARG 144 Cb 0.00 -3.40 -0.12 0.00 -1.56 0.00 0.00 34.95 29.87 1br0 s ARG 144 CO 0.00 -1.11 0.86 1.03 -0.81 0.00 0.00 175.30 175.27 1br0 h SER 145 N 6.74 0.00 0.00 -2.12 0.87 -1.79 -3.43 113.55 113.82 1br0 h SER 145 Ca -0.06 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 1br0 h SER 145 Cb 0.92 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.88 1br0 h SER 145 CO 0.68 0.51 0.00 2.29 -0.53 0.00 0.00 176.83 179.78