#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 0.76 -0.02 -0.67 0.11 -2.06 -2.62 114.38 109.88 1br0 h ARG 28 Ca 0.00 -0.18 -0.17 0.00 0.10 0.00 0.00 59.98 59.73 1br0 h ARG 28 Cb 0.00 -0.10 0.01 0.00 1.11 0.00 0.00 29.97 30.99 1br0 h ARG 28 CO 0.00 0.74 -0.65 0.74 0.10 0.00 0.00 179.97 180.90 1br0 h PHE 29 N 0.64 0.69 -0.22 4.08 0.04 -2.06 -2.67 116.94 117.46 1br0 h PHE 29 Ca 0.15 -0.36 -0.19 0.00 2.80 0.00 0.00 57.97 60.37 1br0 h PHE 29 Cb 0.32 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.38 1br0 h PHE 29 CO 0.02 1.18 -0.63 0.52 -0.60 0.00 0.00 178.31 178.80 1br0 h MET 30 N 0.02 0.75 -0.93 1.51 2.86 -2.00 -2.84 114.93 114.29 1br0 h MET 30 Ca -0.08 -0.52 0.06 0.00 -2.06 0.00 0.00 59.70 57.10 1br0 h MET 30 Cb 1.34 0.08 -0.06 0.00 0.06 0.00 0.00 31.60 33.02 1br0 h MET 30 CO 0.13 1.15 0.61 -0.44 1.06 0.00 0.00 176.91 179.41 1br0 h ASP 31 N 0.56 0.96 -0.47 1.22 3.32 -1.56 -0.75 116.42 119.69 1br0 h ASP 31 Ca -0.01 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 1br0 h ASP 31 Cb 1.23 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.56 1br0 h ASP 31 CO 0.13 0.62 -0.17 1.05 -1.72 0.00 0.00 179.24 179.15 1br0 h GLU 32 N 1.09 0.94 -0.32 3.56 4.11 -1.52 -2.61 114.58 119.83 1br0 h GLU 32 Ca 0.40 -0.39 0.04 0.00 0.07 0.00 0.00 59.36 59.48 1br0 h GLU 32 Cb 0.16 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 1br0 h GLU 32 CO -0.15 1.05 0.11 0.35 0.07 0.00 0.00 179.01 180.44 1br0 h PHE 33 N 0.79 0.20 -0.23 2.06 3.57 -1.26 -1.63 116.94 120.43 1br0 h PHE 33 Ca 0.11 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 1br0 h PHE 33 Cb 0.73 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.42 1br0 h PHE 33 CO 0.05 0.09 -0.18 0.74 -2.23 0.00 0.00 178.31 176.77 1br0 h PHE 34 N 0.25 0.43 -0.22 0.41 0.04 -1.23 -3.13 116.94 113.50 1br0 h PHE 34 Ca 0.14 -0.07 -0.12 0.00 2.80 0.00 0.00 57.97 60.72 1br0 h PHE 34 Cb 0.11 -0.11 -0.00 0.00 2.20 0.00 0.00 35.95 38.15 1br0 h PHE 34 CO -0.14 0.57 -0.35 0.93 -0.60 0.00 0.00 178.31 178.72 1br0 h GLU 35 N 0.36 0.62 -0.40 1.51 4.39 -1.39 -3.37 114.58 116.30 1br0 h GLU 35 Ca 0.06 -0.38 -0.13 0.00 0.34 0.00 0.00 59.36 59.26 1br0 h GLU 35 Cb 0.54 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.22 1br0 h GLU 35 CO 0.04 0.99 -0.26 -0.56 -1.16 0.00 0.00 179.01 178.05 1br0 h GLN 36 N 0.31 0.87 -0.96 2.33 3.07 -1.39 -3.31 115.11 116.03 1br0 h GLN 36 Ca 0.02 -0.41 0.28 0.00 0.09 0.00 0.00 58.65 58.63 1br0 h GLN 36 Cb 0.94 -0.01 -0.14 0.00 0.08 0.00 0.00 27.48 28.35 1br0 h GLN 36 CO 0.08 1.06 0.46 -0.39 0.09 0.00 0.00 178.83 180.13 1br0 h VAL 37 N 0.69 0.33 -0.66 1.86 -1.51 -1.71 -2.34 116.25 112.91 1br0 h VAL 37 Ca 0.08 -0.11 -0.03 0.00 -1.23 0.00 0.00 66.70 65.41 1br0 h VAL 37 Cb 0.84 -0.01 -0.03 0.00 -2.13 0.00 0.00 31.29 29.95 1br0 h VAL 37 CO 0.07 0.06 0.27 -0.33 -1.23 0.00 0.00 177.57 176.41 1br0 h GLU 38 N 0.31 0.96 0.00 5.19 4.39 -1.72 -1.73 114.58 121.98 1br0 h GLU 38 Ca 0.66 -0.15 -0.11 0.00 0.34 0.00 0.00 59.36 60.10 1br0 h GLU 38 Cb 1.44 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 29.90 1br0 h GLU 38 CO -0.61 0.78 -0.51 1.05 -1.16 0.00 0.00 179.01 178.56 1br0 h GLU 39 N 0.95 0.00 0.78 2.33 4.11 -1.61 -3.28 114.58 117.86 1br0 h GLU 39 Ca 0.22 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.62 1br0 h GLU 39 Cb 0.17 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.43 1br0 h GLU 39 CO -0.02 0.51 -0.37 0.82 0.07 0.00 0.00 179.01 180.02 1br0 h ILE 40 N 0.00 0.11 -1.30 -1.06 2.04 -1.20 -2.84 117.51 113.26 1br0 h ILE 40 Ca -0.01 -0.18 0.38 0.00 1.00 0.00 0.00 64.86 66.05 1br0 h ILE 40 Cb 1.12 0.14 -0.06 0.00 -0.74 0.00 0.00 36.82 37.27 1br0 h ILE 40 CO 0.07 0.01 0.92 0.08 0.00 0.00 0.00 178.15 179.22 1br0 h ARG 41 N -1.20 0.06 0.29 2.37 0.11 -1.45 -0.32 114.38 114.24 1br0 h ARG 41 Ca -0.11 -0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.96 1br0 h ARG 41 Cb 0.81 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.88 1br0 h ARG 41 CO 0.17 0.04 -0.14 0.78 0.10 0.00 0.00 179.97 180.93 1br0 h GLY 42 N 0.06 -0.40 1.65 0.08 0.00 -1.60 -1.31 103.07 101.56 1br0 h GLY 42 Ca 0.65 0.15 -0.01 0.00 0.00 0.00 0.00 47.33 48.12 1br0 h GLY 42 CO -0.08 -0.15 0.17 0.74 0.00 0.00 0.00 176.54 177.23 1br0 h PHE 43 N -0.62 0.45 0.14 5.60 0.04 -1.09 -2.58 116.94 118.89 1br0 h PHE 43 Ca -0.04 -0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 1br0 h PHE 43 Cb 0.44 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.45 1br0 h PHE 43 CO 0.00 0.33 -0.07 0.82 -0.60 0.00 0.00 178.31 178.80 1br0 h ILE 44 N 0.47 1.01 -0.96 -0.55 2.04 -1.14 -3.06 117.51 115.32 1br0 h ILE 44 Ca 0.12 -0.98 0.25 0.00 1.00 0.00 0.00 64.86 65.25 1br0 h ILE 44 Cb 0.04 1.59 -0.13 0.00 -0.74 0.00 0.00 36.82 37.58 1br0 h ILE 44 CO -0.02 0.22 0.50 0.44 0.00 0.00 0.00 178.15 179.29 1br0 h ASP 45 N -0.68 0.49 0.37 1.72 3.32 -1.24 -0.80 116.42 119.59 1br0 h ASP 45 Ca -0.02 0.15 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 1br0 h ASP 45 Cb 0.50 0.10 -0.00 0.00 0.22 0.00 0.00 39.33 40.15 1br0 h ASP 45 CO 0.03 0.01 -0.08 0.50 -1.72 0.00 0.00 179.24 177.98 1br0 h LYS 46 N 0.45 0.00 0.20 3.56 1.63 -1.50 -2.85 116.57 118.06 1br0 h LYS 46 Ca 0.62 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 60.41 1br0 h LYS 46 Cb 1.23 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.86 1br0 h LYS 46 CO -0.52 0.08 -0.10 0.82 -3.45 0.00 0.00 179.45 176.28 1br0 h ILE 47 N 0.00 0.88 -0.56 2.00 1.08 -1.04 -2.69 117.51 117.19 1br0 h ILE 47 Ca -0.00 -0.82 -0.03 0.00 -0.39 0.00 0.00 64.86 63.62 1br0 h ILE 47 Cb 0.29 1.33 -0.03 0.00 -3.07 0.00 0.00 36.82 35.34 1br0 h ILE 47 CO 0.01 0.17 0.22 0.00 -0.69 0.00 0.00 178.15 177.86 1br0 h ALA 48 N -0.06 1.34 -0.32 1.87 0.00 -1.44 0.47 119.26 121.13 1br0 h ALA 48 Ca -0.03 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 1br0 h ALA 48 Cb 0.49 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1br0 h ALA 48 CO 0.05 0.49 -0.03 0.93 0.00 0.00 0.00 179.25 180.68 1br0 h GLU 49 N 0.79 0.59 -0.34 0.00 5.08 -1.65 -2.80 114.58 116.25 1br0 h GLU 49 Ca 0.19 -0.20 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 1br0 h GLU 49 Cb 0.16 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1br0 h GLU 49 CO -0.02 0.74 -0.22 -0.97 -1.00 0.00 0.00 179.01 177.54 1br0 h ASN 50 N 0.38 0.79 -0.10 1.42 -0.73 -1.31 -2.63 115.58 113.40 1br0 h ASN 50 Ca 0.09 -0.43 -0.01 0.00 1.87 0.00 0.00 56.30 57.82 1br0 h ASN 50 Cb 0.50 -0.22 -0.00 0.00 0.27 0.00 0.00 38.32 38.87 1br0 h ASN 50 CO 0.02 1.05 0.03 1.62 -0.37 0.00 0.00 177.43 179.79 1br0 h VAL 51 N 0.54 1.17 -0.49 2.57 3.04 -1.00 -0.87 116.25 121.20 1br0 h VAL 51 Ca 0.07 -0.51 0.05 0.00 -1.01 0.00 0.00 66.70 65.30 1br0 h VAL 51 Cb 0.78 1.32 -0.03 0.00 -2.01 0.00 0.00 31.29 31.35 1br0 h VAL 51 CO 0.06 0.15 0.33 -0.33 -1.01 0.00 0.00 177.57 176.77 1br0 h GLU 52 N -0.02 0.45 -0.31 4.17 5.08 -1.62 -1.76 114.58 120.56 1br0 h GLU 52 Ca 0.03 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1br0 h GLU 52 Cb 0.20 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1br0 h GLU 52 CO -0.00 0.30 0.06 1.49 -1.00 0.00 0.00 179.01 179.86 1br0 h GLU 53 N 0.46 0.51 -0.73 2.33 4.57 -1.11 -2.99 114.58 117.62 1br0 h GLU 53 Ca 0.21 -0.13 0.14 0.00 -1.18 0.00 0.00 59.36 58.41 1br0 h GLU 53 Cb 0.25 -0.06 -0.10 0.00 -0.16 0.00 0.00 28.75 28.68 1br0 h GLU 53 CO -0.05 0.59 0.25 0.28 -1.18 0.00 0.00 179.01 178.90 1br0 h VAL 54 N 0.34 0.61 -0.29 0.32 2.07 -0.73 -2.74 116.25 115.83 1br0 h VAL 54 Ca 0.10 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1br0 h VAL 54 Cb 0.32 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1br0 h VAL 54 CO 0.00 0.07 0.18 0.50 0.02 0.00 0.00 177.57 178.35 1br0 h LYS 55 N 0.37 0.39 -0.04 1.57 3.64 -1.23 0.14 116.57 121.41 1br0 h LYS 55 Ca 0.41 -0.03 -0.21 0.00 -1.27 0.00 0.00 60.65 59.56 1br0 h LYS 55 Cb 0.64 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1br0 h LYS 55 CO -0.43 0.26 -0.83 0.07 -2.27 0.00 0.00 179.45 176.25 1br0 h ARG 56 N 0.40 0.42 0.18 1.90 0.11 -1.35 -3.39 114.38 112.65 1br0 h ARG 56 Ca 0.11 -0.39 -0.31 0.00 0.10 0.00 0.00 59.98 59.48 1br0 h ARG 56 Cb -0.03 0.10 0.03 0.00 1.11 0.00 0.00 29.97 31.18 1br0 h ARG 56 CO -0.02 1.05 -1.33 0.87 0.10 0.00 0.00 179.97 180.63 1br0 h LYS 57 N 0.26 0.58 -0.42 0.08 1.57 -1.25 -3.41 116.57 113.99 1br0 h LYS 57 Ca -0.05 -0.87 -0.05 0.00 -1.87 0.00 0.00 60.65 57.80 1br0 h LYS 57 Cb 1.44 0.31 -0.02 0.00 0.08 0.00 0.00 32.23 34.04 1br0 h LYS 57 CO 0.14 1.41 0.04 0.45 -0.57 0.00 0.00 179.45 180.92 1br0 h HIS 58 N 0.20 0.67 0.00 -1.35 3.86 -0.91 -2.91 115.15 114.71 1br0 h HIS 58 Ca -0.22 -0.07 -0.04 0.00 -1.16 0.00 0.00 60.37 58.88 1br0 h HIS 58 Cb 2.02 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 30.30 1br0 h HIS 58 CO 0.13 0.62 -0.17 0.66 0.86 0.00 0.00 177.93 180.02 1br0 h SER 59 N 0.62 0.14 0.39 2.45 4.64 -1.78 0.22 113.55 120.24 1br0 h SER 59 Ca 0.13 -0.80 -0.06 0.00 -0.47 0.00 0.00 61.79 60.59 1br0 h SER 59 Cb 0.33 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1br0 h SER 59 CO 0.01 0.93 -0.30 0.00 -0.87 0.00 0.00 176.83 176.60 1br0 h ALA 60 N 0.22 1.38 0.04 5.18 0.00 -1.78 -1.95 119.26 122.35 1br0 h ALA 60 Ca -0.02 -0.27 -0.24 0.00 0.00 0.00 0.00 54.91 54.38 1br0 h ALA 60 Cb 0.96 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1br0 h ALA 60 CO 0.03 0.37 -1.17 0.82 0.00 0.00 0.00 179.25 179.31 1br0 h ILE 61 N 0.00 1.54 0.00 0.00 2.04 -1.64 -1.51 117.51 117.94 1br0 h ILE 61 Ca -0.00 -3.22 -0.01 0.00 1.00 0.00 0.00 64.86 62.62 1br0 h ILE 61 Cb 0.57 2.83 -0.00 0.00 -0.74 0.00 0.00 36.82 39.48 1br0 h ILE 61 CO 0.04 0.90 -0.05 0.25 0.00 0.00 0.00 178.15 179.29 1br0 h LEU 62 N 0.02 0.00 0.16 1.44 5.85 -0.85 -1.95 115.31 119.98 1br0 h LEU 62 Ca -0.08 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1br0 h LEU 62 Cb 1.86 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.89 1br0 h LEU 62 CO 0.15 0.05 -0.08 0.00 -0.34 0.00 0.00 178.44 178.22 1br0 h ALA 63 N 1.95 -0.23 -2.06 1.25 0.00 -1.30 -3.41 119.26 115.46 1br0 h ALA 63 Ca -0.00 -0.05 -0.71 0.00 0.00 0.00 0.00 54.91 54.16 1br0 h ALA 63 Cb 0.36 0.08 -0.19 0.00 0.00 0.00 0.00 17.79 18.03 1br0 h ALA 63 CO 0.01 -0.21 0.46 -1.12 0.00 0.00 0.00 179.25 178.39 1br0 s SER 64 N -5.05 6.48 0.00 0.00 0.01 -0.58 -4.89 113.70 109.67 1br0 s SER 64 Ca -0.03 -1.89 0.26 0.00 1.31 0.00 0.00 55.95 55.60 1br0 s SER 64 Cb 0.00 -2.34 1.21 0.00 0.21 0.00 0.00 66.02 65.10 1br0 s SER 64 CO 0.09 -1.03 1.86 -0.81 0.41 0.00 0.00 173.24 173.76 1br0 n PRO 65 N 6.12 0.18 -3.80 12.44 -0.04 -0.74 -3.91 135.00 145.26 1br0 n PRO 65 Ca 0.10 0.05 -0.32 0.00 -0.04 0.00 0.00 63.50 63.29 1br0 n PRO 65 Cb 0.46 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.32 1br0 n PRO 65 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1br0 s ASN 66 N -2.79 5.23 0.00 3.54 0.01 -1.26 -5.06 114.94 114.60 1br0 s ASN 66 Ca 0.18 -3.67 0.00 0.00 -0.71 0.00 0.00 52.86 48.67 1br0 s ASN 66 Cb 0.17 -1.75 0.00 0.00 0.41 0.00 0.00 41.25 40.08 1br0 s ASN 66 CO 0.43 -0.15 0.00 -0.81 -1.51 0.00 0.00 177.10 175.06 1br0 n PRO 67 N 2.30 3.63 -2.68 -0.60 -0.04 -1.25 -5.12 135.00 131.25 1br0 n PRO 67 Ca 0.18 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.31 1br0 n PRO 67 Cb 0.36 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.76 1br0 n PRO 67 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1br0 s ASP 68 N -0.44 6.78 0.56 3.54 1.01 -1.26 -5.00 116.67 121.86 1br0 s ASP 68 Ca 0.00 1.69 0.28 0.00 0.71 0.00 0.00 52.55 55.23 1br0 s ASP 68 Cb 0.00 -2.53 1.48 0.00 1.01 0.00 0.00 42.92 42.88 1br0 s ASP 68 CO 0.00 -0.47 1.96 -0.33 0.21 0.00 0.00 175.17 176.53 1br0 h GLU 69 N 1.61 0.00 -0.82 8.23 5.08 -2.04 -2.21 114.58 124.43 1br0 h GLU 69 Ca -0.48 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 57.91 1br0 h GLU 69 Cb 1.19 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.39 1br0 h GLU 69 CO 0.61 0.00 0.54 -0.22 -1.00 0.00 0.00 179.01 178.94 1br0 h LYS 70 N 0.00 0.98 0.02 2.33 3.64 -2.02 -3.36 116.57 118.16 1br0 h LYS 70 Ca 0.23 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1br0 h LYS 70 Cb 1.09 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 1br0 h LYS 70 CO -0.00 0.65 -0.01 1.79 -2.27 0.00 0.00 179.45 179.61 1br0 h THR 71 N 1.01 1.49 0.18 1.00 1.35 -1.79 -3.33 112.91 112.81 1br0 h THR 71 Ca 0.33 -1.71 -0.34 0.00 -0.55 0.00 0.00 66.41 64.15 1br0 h THR 71 Cb 0.06 2.62 0.01 0.00 -1.73 0.00 0.00 68.15 69.11 1br0 h THR 71 CO -0.10 0.43 -1.64 0.11 -0.25 0.00 0.00 175.52 174.07 1br0 h LYS 72 N -0.78 0.38 -0.53 4.72 1.79 -1.75 -3.26 116.57 117.14 1br0 h LYS 72 Ca -0.00 -0.66 0.13 0.00 -2.18 0.00 0.00 60.65 57.94 1br0 h LYS 72 Cb 0.72 0.24 -0.03 0.00 -1.58 0.00 0.00 32.23 31.59 1br0 h LYS 72 CO 0.00 1.29 0.37 1.05 -1.08 0.00 0.00 179.45 181.08 1br0 h GLU 73 N 0.10 0.14 0.00 3.15 -0.00 -1.79 -2.39 114.58 113.80 1br0 h GLU 73 Ca -0.30 -0.01 -0.12 0.00 -0.00 0.00 0.00 59.36 58.93 1br0 h GLU 73 Cb 2.09 -0.03 -0.02 0.00 -0.00 0.00 0.00 28.75 30.79 1br0 h GLU 73 CO 0.19 0.09 -0.57 0.93 -0.00 0.00 0.00 179.01 179.65 1br0 h GLU 74 N 0.15 0.00 -0.80 1.06 5.08 -1.68 -3.39 114.58 115.00 1br0 h GLU 74 Ca 0.25 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.57 1br0 h GLU 74 Cb 0.80 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.02 1br0 h GLU 74 CO -0.03 0.57 0.32 -0.07 -1.00 0.00 0.00 179.01 178.80 1br0 h LEU 75 N 0.00 1.10 -2.18 1.33 3.38 -1.46 -2.19 115.31 115.28 1br0 h LEU 75 Ca -0.01 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1br0 h LEU 75 Cb 1.08 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1br0 h LEU 75 CO 0.07 0.97 -0.06 -0.33 0.09 0.00 0.00 178.44 179.19 1br0 h GLU 76 N 1.16 0.00 0.07 1.13 5.08 -1.75 -2.89 114.58 117.38 1br0 h GLU 76 Ca 0.27 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.62 1br0 h GLU 76 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1br0 h GLU 76 CO -0.02 0.06 -0.03 1.49 -1.00 0.00 0.00 179.01 179.50 1br0 h GLU 77 N 0.00 -0.09 -0.45 2.33 4.81 -1.60 -2.88 114.58 116.70 1br0 h GLU 77 Ca -0.00 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 1br0 h GLU 77 Cb 0.14 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 1br0 h GLU 77 CO 0.01 0.40 -0.05 1.37 -0.73 0.00 0.00 179.01 180.01 1br0 h LEU 78 N -0.64 0.75 -0.16 1.64 8.10 -1.43 -0.34 115.31 123.24 1br0 h LEU 78 Ca -0.01 -0.20 -0.13 0.00 0.11 0.00 0.00 57.88 57.65 1br0 h LEU 78 Cb 0.54 -0.20 0.00 0.00 -0.44 0.00 0.00 40.66 40.56 1br0 h LEU 78 CO 0.02 0.85 -0.41 0.24 -4.11 0.00 0.00 178.44 175.02 1br0 h MET 79 N 0.71 0.55 0.00 0.17 2.86 -1.69 -2.92 114.93 114.61 1br0 h MET 79 Ca 0.13 -0.39 -0.00 0.00 -2.06 0.00 0.00 59.70 57.38 1br0 h MET 79 Cb 0.51 0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.23 1br0 h MET 79 CO 0.03 1.01 -0.01 0.77 1.06 0.00 0.00 176.91 179.76 1br0 h SER 80 N 0.19 0.00 -0.00 1.22 0.02 -1.51 -2.15 113.55 111.31 1br0 h SER 80 Ca -0.01 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1br0 h SER 80 Cb 1.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.57 1br0 h SER 80 CO 0.09 0.01 -0.04 -0.78 -1.14 0.00 0.00 176.83 174.97 1br0 h ASP 81 N 0.00 0.05 -0.56 3.07 3.58 -1.08 -2.23 116.42 119.25 1br0 h ASP 81 Ca -0.00 -0.71 -0.11 0.00 0.42 0.00 0.00 57.03 56.63 1br0 h ASP 81 Cb 0.32 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.33 1br0 h ASP 81 CO 0.00 0.75 -0.06 0.40 -2.88 0.00 0.00 179.24 177.45 1br0 h ILE 82 N -0.66 1.27 0.12 2.25 2.04 -1.55 -0.63 117.51 120.35 1br0 h ILE 82 Ca -0.00 -1.22 0.01 0.00 1.00 0.00 0.00 64.86 64.64 1br0 h ILE 82 Cb 0.76 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 1br0 h ILE 82 CO 0.01 0.44 -0.15 0.50 0.00 0.00 0.00 178.15 178.94 1br0 h LYS 83 N 0.94 -0.31 -0.26 2.37 3.64 -1.53 -0.55 116.57 120.87 1br0 h LYS 83 Ca 0.15 0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.44 1br0 h LYS 83 Cb 0.63 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1br0 h LYS 83 CO 0.04 -0.21 -0.27 0.87 -2.27 0.00 0.00 179.45 177.61 1br0 h LYS 84 N -0.32 0.65 0.46 1.90 1.79 -1.39 -2.40 116.57 117.26 1br0 h LYS 84 Ca 0.01 -0.35 -0.02 0.00 -2.18 0.00 0.00 60.65 58.12 1br0 h LYS 84 Cb 0.32 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.99 1br0 h LYS 84 CO -0.07 0.95 -0.22 1.15 -1.08 0.00 0.00 179.45 180.18 1br0 h THR 85 N 0.37 0.00 -0.95 -0.16 2.02 -1.22 -2.72 112.91 110.24 1br0 h THR 85 Ca 0.04 -0.51 0.20 0.00 0.77 0.00 0.00 66.41 66.92 1br0 h THR 85 Cb 0.84 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.17 1br0 h THR 85 CO 0.07 0.00 0.61 0.00 0.37 0.00 0.00 175.52 176.57 1br0 h ALA 86 N -1.21 2.06 -0.43 6.16 0.00 -1.23 -1.62 119.26 122.99 1br0 h ALA 86 Ca -0.06 0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 1br0 h ALA 86 Cb 0.48 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1br0 h ALA 86 CO 0.10 -0.38 -0.31 -0.91 0.00 0.00 0.00 179.25 177.76 1br0 h ASN 87 N 0.52 0.99 -0.98 0.00 2.35 -1.55 0.17 115.58 117.08 1br0 h ASN 87 Ca 0.51 -0.42 0.11 0.00 -0.55 0.00 0.00 56.30 55.95 1br0 h ASN 87 Cb 1.12 -0.28 -0.08 0.00 0.05 0.00 0.00 38.32 39.14 1br0 h ASN 87 CO -0.24 1.21 0.62 0.50 -1.65 0.00 0.00 177.43 177.87 1br0 h LYS 88 N 0.80 0.96 0.00 0.81 3.64 -0.97 -2.86 116.57 118.95 1br0 h LYS 88 Ca 0.08 -0.06 -0.17 0.00 -1.27 0.00 0.00 60.65 59.24 1br0 h LYS 88 Cb 0.89 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 1br0 h LYS 88 CO 0.08 0.64 -1.07 1.55 -2.27 0.00 0.00 179.45 178.37 1br0 n VAL 89 N -4.58 1.50 -0.13 2.00 3.14 -1.05 -3.77 118.33 115.44 1br0 n VAL 89 Ca 0.18 0.04 -0.06 0.00 -2.96 0.00 0.00 64.34 61.53 1br0 n VAL 89 Cb 0.33 -2.15 0.02 0.00 -1.06 0.00 0.00 33.84 30.98 1br0 n VAL 89 CO 0.00 0.00 0.00 0.08 -6.46 0.00 0.00 176.83 170.45 1br0 h ARG 90 N -1.00 0.42 0.00 1.45 0.11 -0.80 -1.16 114.38 113.41 1br0 h ARG 90 Ca -0.25 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 59.80 1br0 h ARG 90 Cb 1.07 -0.10 0.00 0.00 1.11 0.00 0.00 29.97 32.05 1br0 h ARG 90 CO -0.15 0.28 0.00 1.03 0.10 0.00 0.00 179.97 181.23 1br0 h SER 91 N 0.44 0.00 0.21 0.08 0.87 -1.69 -1.02 113.55 112.44 1br0 h SER 91 Ca 0.17 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.55 1br0 h SER 91 Cb 0.06 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1br0 h SER 91 CO -0.11 0.00 -0.70 0.50 -0.53 0.00 0.00 176.83 175.99 1br0 h LYS 92 N 0.00 0.43 -0.79 2.24 1.63 -1.31 -3.17 116.57 115.61 1br0 h LYS 92 Ca 0.00 -0.34 -0.00 0.00 -0.85 0.00 0.00 60.65 59.46 1br0 h LYS 92 Cb 0.01 0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 31.67 1br0 h LYS 92 CO 0.00 0.97 0.48 -0.07 -3.45 0.00 0.00 179.45 177.38 1br0 h LEU 93 N 0.30 0.93 -2.03 5.20 3.38 -0.87 -3.15 115.31 119.08 1br0 h LEU 93 Ca -0.02 -0.05 0.11 0.00 0.09 0.00 0.00 57.88 58.01 1br0 h LEU 93 Cb 1.27 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 1br0 h LEU 93 CO 0.12 0.71 0.30 0.11 0.09 0.00 0.00 178.44 179.77 1br0 h LYS 94 N 1.08 0.00 0.00 1.13 1.79 -1.45 0.16 116.57 119.28 1br0 h LYS 94 Ca 0.28 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.72 1br0 h LYS 94 Cb -0.06 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.58 1br0 h LYS 94 CO -0.06 0.00 -0.17 1.03 -1.08 0.00 0.00 179.45 179.18 1br0 h SER 95 N 0.00 0.00 0.01 0.86 0.87 -1.65 0.11 113.55 113.75 1br0 h SER 95 Ca 0.19 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.71 1br0 h SER 95 Cb 0.79 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.74 1br0 h SER 95 CO -0.00 0.17 -0.18 0.40 -0.53 0.00 0.00 176.83 176.69 1br0 h ILE 96 N 0.00 1.69 -0.91 2.23 1.08 -1.21 -3.32 117.51 117.07 1br0 h ILE 96 Ca -0.00 -2.34 0.08 0.00 -0.39 0.00 0.00 64.86 62.20 1br0 h ILE 96 Cb 0.59 3.27 -0.06 0.00 -3.07 0.00 0.00 36.82 37.55 1br0 h ILE 96 CO 0.02 0.59 0.59 -0.08 -0.69 0.00 0.00 178.15 178.58 1br0 h GLU 97 N -0.97 0.97 -0.89 2.37 4.81 -0.79 -2.94 114.58 117.14 1br0 h GLU 97 Ca -0.04 -0.06 0.08 0.00 -0.13 0.00 0.00 59.36 59.21 1br0 h GLU 97 Cb 1.07 -0.22 -0.06 0.00 0.63 0.00 0.00 28.75 30.17 1br0 h GLU 97 CO -0.01 0.64 0.57 1.96 -0.73 0.00 0.00 179.01 181.44 1br0 h GLN 98 N 0.99 0.91 -0.05 1.92 4.20 -0.93 0.99 115.11 123.14 1br0 h GLN 98 Ca 0.40 -0.05 -0.14 0.00 0.06 0.00 0.00 58.65 58.91 1br0 h GLN 98 Cb 0.27 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1br0 h GLN 98 CO -0.16 0.60 -0.62 1.03 -0.67 0.00 0.00 178.83 179.02 1br0 h SER 99 N 0.94 0.21 0.74 1.46 0.87 -1.61 -3.02 113.55 113.13 1br0 h SER 99 Ca 0.40 -0.12 -0.14 0.00 -1.23 0.00 0.00 61.79 60.70 1br0 h SER 99 Cb 0.31 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 1br0 h SER 99 CO -0.16 0.77 -1.36 -0.38 -0.53 0.00 0.00 176.83 175.18 1br0 n ILE 100 N -3.85 1.07 0.65 2.23 5.41 -1.19 -3.26 119.36 120.41 1br0 n ILE 100 Ca -0.02 -0.66 0.08 0.00 1.00 0.00 0.00 62.75 63.15 1br0 n ILE 100 Cb 0.62 -0.65 0.38 0.00 -0.71 0.00 0.00 39.64 39.28 1br0 n ILE 100 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1br0 n GLU 101 N -2.84 0.05 0.15 0.38 2.13 0.34 -0.66 120.64 120.19 1br0 n GLU 101 Ca -0.08 0.19 0.00 0.00 0.66 0.00 0.00 57.16 57.93 1br0 n GLU 101 Cb 0.79 -1.50 0.23 0.00 0.27 0.00 0.00 31.44 31.23 1br0 n GLU 101 CO 0.00 0.00 0.00 0.37 -0.41 0.00 0.00 177.13 177.09 1br0 h GLN 102 N 0.00 0.00 -4.31 5.31 5.75 -1.51 -3.48 115.11 116.88 1br0 h GLN 102 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1br0 h GLN 102 Cb 0.27 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.82 1br0 h GLN 102 CO 0.00 0.54 -0.37 -1.91 -2.65 0.00 0.00 178.83 174.44 1br0 n GLU 103 N -3.88 -1.57 -0.01 1.69 4.07 0.16 -4.97 120.64 116.13 1br0 n GLU 103 Ca -0.01 1.56 -0.20 0.00 -0.06 0.00 0.00 57.16 58.44 1br0 n GLU 103 Cb 0.55 -3.85 -0.14 0.00 -0.06 0.00 0.00 31.44 27.95 1br0 n GLU 103 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 1br0 n GLU 104 N -0.17 0.75 0.00 5.31 0.28 -1.23 -3.71 120.64 121.85 1br0 n GLU 104 Ca 0.05 0.25 0.05 0.00 -0.16 0.00 0.00 57.16 57.36 1br0 n GLU 104 Cb 0.20 -1.70 0.30 0.00 1.43 0.00 0.00 31.44 31.67 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 2.00 -0.63 0.39 -1.84 0.00 -1.26 -4.31 105.19 99.53 1br0 n GLY 105 Ca -0.32 -0.06 0.31 0.00 0.00 0.00 0.00 46.02 45.95 1br0 n GLY 105 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1br0 n LEU 106 N -0.75 0.09 0.00 0.99 7.94 -1.24 -4.76 117.00 119.27 1br0 n LEU 106 Ca 0.08 0.87 0.00 0.00 -1.11 0.00 0.00 56.01 55.85 1br0 n LEU 106 Cb 0.03 -0.43 0.00 0.00 0.53 0.00 0.00 43.42 43.56 1br0 n LEU 106 CO 0.06 -0.92 0.00 -3.20 -1.11 0.00 0.00 177.39 172.21 1br0 n ASN 107 N -3.81 0.00 0.00 1.96 2.85 -1.26 -5.11 115.26 109.89 1br0 n ASN 107 Ca 0.29 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.76 1br0 n ASN 107 Cb 1.21 0.00 0.00 0.00 1.24 0.00 0.00 39.78 42.23 1br0 n ASN 107 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1br0 n ARG 108 N 0.00 0.25 -2.93 1.20 1.74 -1.26 -5.11 116.66 110.56 1br0 n ARG 108 Ca 0.00 -0.11 -0.11 0.00 -0.77 0.00 0.00 57.85 56.86 1br0 n ARG 108 Cb 0.00 -0.52 0.01 0.00 -1.02 0.00 0.00 32.46 30.93 1br0 n ARG 108 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1br0 n SER 109 N -0.07 -7.61 -3.59 0.55 7.64 -1.26 -5.10 113.62 104.18 1br0 n SER 109 Ca 0.00 0.57 -0.14 0.00 1.01 0.00 0.00 58.87 60.31 1br0 n SER 109 Cb 0.14 -4.78 -0.06 0.00 -1.01 0.00 0.00 64.21 58.50 1br0 n SER 109 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1br0 s SER 110 N -2.27 -0.42 0.00 6.43 0.01 -1.26 -5.18 113.70 111.01 1br0 s SER 110 Ca 0.23 0.20 0.00 0.00 1.31 0.00 0.00 55.95 57.68 1br0 s SER 110 Cb -0.05 0.48 0.00 0.00 0.21 0.00 0.00 66.02 66.65 1br0 s SER 110 CO 0.77 -0.68 0.00 0.00 0.41 0.00 0.00 173.24 173.73 1br0 n ALA 111 N 0.52 0.00 0.00 1.44 0.00 -1.26 -4.67 120.51 116.55 1br0 n ALA 111 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1br0 n ALA 111 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 1br0 n ALA 111 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1br0 n ASP 112 N -1.14 0.00 0.00 0.00 2.03 -1.26 -4.41 116.55 111.77 1br0 n ASP 112 Ca 0.00 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.28 1br0 n ASP 112 Cb 0.00 0.00 0.20 0.00 -0.72 0.00 0.00 41.12 40.60 1br0 n ASP 112 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1br0 h LEU 113 N 0.00 0.52 0.04 -2.67 6.46 -2.02 -3.28 115.31 114.36 1br0 h LEU 113 Ca 0.00 -0.16 -0.29 0.00 -0.12 0.00 0.00 57.88 57.31 1br0 h LEU 113 Cb 0.00 -0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 39.75 1br0 h LEU 113 CO 0.00 0.73 -1.61 0.03 -0.62 0.00 0.00 178.44 176.97 1br0 h ARG 114 N 0.47 0.08 -0.21 1.25 3.08 -1.83 -3.19 114.38 114.02 1br0 h ARG 114 Ca 0.07 -0.13 0.03 0.00 0.07 0.00 0.00 59.98 60.02 1br0 h ARG 114 Cb 0.62 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.69 1br0 h ARG 114 CO 0.04 0.76 0.05 0.82 -1.07 0.00 0.00 179.97 180.58 1br0 h ILE 115 N 0.02 0.92 -0.58 2.04 2.04 -1.93 -1.90 117.51 118.12 1br0 h ILE 115 Ca -0.25 -0.05 0.04 0.00 1.00 0.00 0.00 64.86 65.60 1br0 h ILE 115 Cb 1.98 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 38.78 1br0 h ILE 115 CO 0.10 0.02 0.33 0.03 0.00 0.00 0.00 178.15 178.63 1br0 h ARG 116 N 0.14 0.61 -0.38 2.37 3.08 -1.64 -2.62 114.38 115.94 1br0 h ARG 116 Ca 0.09 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 1br0 h ARG 116 Cb 0.08 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 1br0 h ARG 116 CO -0.12 0.41 0.13 0.87 -1.07 0.00 0.00 179.97 180.19 1br0 h LYS 117 N 0.63 0.54 -0.26 0.04 1.57 -1.53 -0.84 116.57 116.72 1br0 h LYS 117 Ca 0.25 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1br0 h LYS 117 Cb 0.10 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1br0 h LYS 117 CO -0.14 0.47 0.13 1.15 -0.57 0.00 0.00 179.45 180.49 1br0 h THR 118 N 0.54 1.14 0.14 -0.16 2.02 -0.97 -2.63 112.91 112.99 1br0 h THR 118 Ca 0.13 -0.38 -0.31 0.00 0.77 0.00 0.00 66.41 66.62 1br0 h THR 118 Cb 0.14 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 1br0 h THR 118 CO -0.01 0.14 -1.50 0.06 0.37 0.00 0.00 175.52 174.57 1br0 h GLN 119 N 0.29 0.29 -0.74 6.66 3.07 -1.56 -3.28 115.11 119.85 1br0 h GLN 119 Ca 0.09 -0.50 0.03 0.00 0.09 0.00 0.00 58.65 58.36 1br0 h GLN 119 Cb 0.10 0.19 -0.04 0.00 0.08 0.00 0.00 27.48 27.81 1br0 h GLN 119 CO -0.01 1.18 0.49 1.25 0.09 0.00 0.00 178.83 181.83 1br0 h HIS 120 N 0.08 0.89 -0.32 0.06 2.76 -1.26 -0.24 115.15 117.12 1br0 h HIS 120 Ca -0.24 0.02 -0.18 0.00 -2.20 0.00 0.00 60.37 57.78 1br0 h HIS 120 Cb 2.03 -0.30 -0.00 0.00 1.55 0.00 0.00 27.41 30.69 1br0 h HIS 120 CO 0.07 0.53 -0.48 0.77 -1.30 0.00 0.00 177.93 177.51 1br0 h SER 121 N 0.93 0.99 -0.30 3.26 0.02 -1.64 -0.50 113.55 116.30 1br0 h SER 121 Ca 0.29 -0.51 -0.10 0.00 -0.84 0.00 0.00 61.79 60.63 1br0 h SER 121 Cb 0.01 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 1br0 h SER 121 CO -0.08 1.30 -0.21 0.74 -1.14 0.00 0.00 176.83 177.44 1br0 h THR 122 N 0.70 1.30 0.13 -2.27 2.02 -1.61 -0.50 112.91 112.68 1br0 h THR 122 Ca 0.03 -1.35 0.00 0.00 0.77 0.00 0.00 66.41 65.87 1br0 h THR 122 Cb 1.09 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.99 1br0 h THR 122 CO 0.11 0.43 -0.14 -0.07 0.37 0.00 0.00 175.52 176.23 1br0 h LEU 123 N 0.43 -0.36 -0.89 2.58 3.38 -1.14 -2.31 115.31 117.00 1br0 h LEU 123 Ca 0.06 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1br0 h LEU 123 Cb 0.76 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.59 1br0 h LEU 123 CO 0.06 -0.21 0.53 -1.28 0.09 0.00 0.00 178.44 177.63 1br0 h SER 124 N -0.30 1.08 -0.78 -0.43 0.87 -1.17 -2.84 113.55 109.98 1br0 h SER 124 Ca 0.01 -0.08 0.12 0.00 -1.23 0.00 0.00 61.79 60.61 1br0 h SER 124 Cb 0.29 -0.27 -0.08 0.00 -0.44 0.00 0.00 62.40 61.89 1br0 h SER 124 CO -0.04 0.84 0.39 -0.09 -0.53 0.00 0.00 176.83 177.40 1br0 h ARG 125 N 1.23 0.60 -0.46 2.24 2.43 -1.06 -1.40 114.38 117.97 1br0 h ARG 125 Ca 0.32 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 1br0 h ARG 125 Cb -0.03 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 1br0 h ARG 125 CO -0.06 0.40 0.28 -0.22 -1.51 0.00 0.00 179.97 178.86 1br0 h LYS 126 N 0.62 0.61 -0.31 0.20 3.64 -1.20 -1.05 116.57 119.08 1br0 h LYS 126 Ca 0.40 -0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.60 1br0 h LYS 126 Cb 0.49 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1br0 h LYS 126 CO -0.31 0.42 -0.36 0.74 -2.27 0.00 0.00 179.45 177.66 1br0 h PHE 127 N 0.62 0.85 -0.15 1.91 0.04 -1.09 -3.25 116.94 115.88 1br0 h PHE 127 Ca 0.17 -0.24 -0.19 0.00 2.80 0.00 0.00 57.97 60.51 1br0 h PHE 127 Cb -0.04 -0.19 -0.00 0.00 2.20 0.00 0.00 35.95 37.92 1br0 h PHE 127 CO 0.00 0.98 -0.68 0.28 -0.60 0.00 0.00 178.31 178.29 1br0 h VAL 128 N 0.60 1.33 0.00 -0.55 2.07 -1.12 0.12 116.25 118.70 1br0 h VAL 128 Ca 0.06 -1.97 0.00 0.00 0.82 0.00 0.00 66.70 65.61 1br0 h VAL 128 Cb 0.90 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 1br0 h VAL 128 CO 0.08 0.61 0.00 -0.62 0.02 0.00 0.00 177.57 177.66 1br0 n GLU 129 N -3.91 0.05 0.00 1.57 1.02 -0.41 -3.02 120.64 115.94 1br0 n GLU 129 Ca -0.05 0.26 0.00 0.00 -0.02 0.00 0.00 57.16 57.35 1br0 n GLU 129 Cb 0.69 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.61 1br0 n GLU 129 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1br0 n VAL 130 N -1.29 0.00 -0.07 2.62 0.31 -1.17 -4.55 118.33 114.17 1br0 n VAL 130 Ca 0.02 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.23 1br0 n VAL 130 Cb 0.03 -0.48 -0.05 0.00 -0.91 0.00 0.00 33.84 32.43 1br0 n VAL 130 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1br0 h MET 131 N 0.00 0.39 0.00 5.55 2.86 -0.90 0.18 114.93 123.01 1br0 h MET 131 Ca 0.00 -0.14 -0.07 0.00 -2.06 0.00 0.00 59.70 57.44 1br0 h MET 131 Cb 0.41 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 1br0 h MET 131 CO 0.00 0.61 -0.32 1.03 1.06 0.00 0.00 176.91 179.30 1br0 h SER 132 N 0.13 0.00 0.00 1.22 0.87 -1.72 -2.41 113.55 111.64 1br0 h SER 132 Ca 0.06 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.54 1br0 h SER 132 Cb 0.45 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.42 1br0 h SER 132 CO 0.02 0.32 -0.29 -0.08 -0.53 0.00 0.00 176.83 176.27 1br0 h GLU 133 N 0.00 0.19 -0.35 2.24 4.81 -1.69 -3.32 114.58 116.45 1br0 h GLU 133 Ca -0.00 -0.21 0.08 0.00 -0.13 0.00 0.00 59.36 59.10 1br0 h GLU 133 Cb 0.75 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 1br0 h GLU 133 CO 0.04 0.94 0.25 -0.92 -0.73 0.00 0.00 179.01 178.59 1br0 h TYR 134 N -0.48 0.11 -0.98 0.92 3.20 -0.70 -2.55 116.97 116.50 1br0 h TYR 134 Ca -0.04 0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.03 1br0 h TYR 134 Cb 1.05 -0.03 -0.09 0.00 1.54 0.00 0.00 36.73 39.19 1br0 h TYR 134 CO 0.18 0.05 0.61 -0.97 -1.64 0.00 0.00 178.16 176.40 1br0 h ASN 135 N 0.10 0.66 -0.03 -2.11 -1.24 -1.53 0.18 115.58 111.60 1br0 h ASN 135 Ca 0.16 0.08 -0.12 0.00 0.71 0.00 0.00 56.30 57.13 1br0 h ASN 135 Cb 0.52 -0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.52 1br0 h ASN 135 CO -0.02 0.24 -0.37 0.00 -1.29 0.00 0.00 177.43 176.00 1br0 h ALA 136 N 1.63 0.92 0.21 1.57 0.00 -1.59 -2.67 119.26 119.32 1br0 h ALA 136 Ca 0.54 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1br0 h ALA 136 Cb 1.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1br0 h ALA 136 CO -0.31 0.62 -0.10 1.15 0.00 0.00 0.00 179.25 180.62 1br0 h THR 137 N 0.45 0.50 -0.56 0.00 2.02 -1.45 -2.45 112.91 111.43 1br0 h THR 137 Ca 0.05 -0.99 0.01 0.00 0.77 0.00 0.00 66.41 66.24 1br0 h THR 137 Cb 0.85 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 1br0 h THR 137 CO 0.07 0.14 0.37 -0.61 0.37 0.00 0.00 175.52 175.86 1br0 h GLN 138 N -0.98 0.72 -0.02 6.66 4.15 -1.14 -2.49 115.11 122.01 1br0 h GLN 138 Ca -0.03 -0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.28 1br0 h GLN 138 Cb 0.44 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.97 1br0 h GLN 138 CO 0.05 0.48 -0.25 1.03 -1.93 0.00 0.00 178.83 178.20 1br0 h SER 139 N 0.74 0.25 0.00 -0.69 0.87 -1.64 -3.34 113.55 109.75 1br0 h SER 139 Ca 0.21 -0.73 0.00 0.00 -1.23 0.00 0.00 61.79 60.03 1br0 h SER 139 Cb -0.07 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 61.81 1br0 h SER 139 CO -0.05 0.95 0.15 -0.78 -0.53 0.00 0.00 176.83 176.57 1br0 h ASP 140 N -0.42 0.00 -0.12 6.23 3.58 -1.28 0.61 116.42 125.02 1br0 h ASP 140 Ca -0.03 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.26 1br0 h ASP 140 Cb 0.97 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.02 1br0 h ASP 140 CO 0.05 0.00 -0.49 0.22 -2.88 0.00 0.00 179.24 176.14 1br0 h TYR 141 N 0.00 0.85 0.00 0.28 3.20 -1.57 -3.41 116.97 116.32 1br0 h TYR 141 Ca 0.00 -0.28 0.00 0.00 3.14 0.00 0.00 58.73 61.59 1br0 h TYR 141 Cb 0.29 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.39 1br0 h TYR 141 CO 0.00 1.04 0.00 2.89 -1.64 0.00 0.00 178.16 180.45 1br0 n ARG 142 N -4.00 1.32 -0.08 1.82 1.85 -0.57 -3.56 116.66 113.44 1br0 n ARG 142 Ca -0.03 -0.94 -0.09 0.00 -1.00 0.00 0.00 57.85 55.79 1br0 n ARG 142 Cb 0.58 -0.80 -0.04 0.00 -1.05 0.00 0.00 32.46 31.15 1br0 n ARG 142 CO 0.00 0.00 0.00 1.05 -0.01 0.00 0.00 177.63 178.67 1br0 h GLU 143 N 0.00 0.00 0.15 2.89 4.11 -1.17 -3.40 114.58 117.16 1br0 h GLU 143 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 1br0 h GLU 143 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1br0 h GLU 143 CO 0.00 0.26 -0.07 -0.09 0.07 0.00 0.00 179.01 179.18 1br0 h ARG 144 N -1.00 -0.19 -6.95 1.06 2.43 -1.80 -3.48 114.38 104.45 1br0 h ARG 144 Ca -0.09 0.01 -0.59 0.00 -0.81 0.00 0.00 59.98 58.51 1br0 h ARG 144 Cb 0.70 0.04 -0.25 0.00 -0.42 0.00 0.00 29.97 30.04 1br0 h ARG 144 CO -0.05 0.24 -0.89 -1.13 -1.51 0.00 0.00 179.97 176.62 1br0 n SER 145 N -4.94 -1.58 0.00 -3.80 3.41 -1.23 -5.14 113.62 100.34 1br0 n SER 145 Ca -0.08 -1.15 0.00 0.00 -0.26 0.00 0.00 58.87 57.38 1br0 n SER 145 Cb 0.27 -2.16 0.00 0.00 -0.26 0.00 0.00 64.21 62.06 1br0 n SER 145 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17