#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 0.66 0.23 -0.67 3.08 -2.06 -2.68 114.38 112.94 1br0 h ARG 28 Ca 0.00 -0.27 -0.33 0.00 0.07 0.00 0.00 59.98 59.45 1br0 h ARG 28 Cb 0.00 -0.03 0.03 0.00 0.08 0.00 0.00 29.97 30.06 1br0 h ARG 28 CO 0.00 0.85 -1.44 0.74 -1.07 0.00 0.00 179.97 179.05 1br0 h PHE 29 N 0.43 0.92 -0.34 3.04 0.04 -2.06 -2.70 116.94 116.28 1br0 h PHE 29 Ca 0.08 -0.67 -0.13 0.00 2.80 0.00 0.00 57.97 60.05 1br0 h PHE 29 Cb 0.64 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.74 1br0 h PHE 29 CO 0.06 1.52 -0.28 0.52 -0.60 0.00 0.00 178.31 179.53 1br0 h MET 30 N 0.14 0.79 -0.90 1.51 2.86 -2.00 -2.51 114.93 114.83 1br0 h MET 30 Ca -0.24 -0.39 0.08 0.00 -2.06 0.00 0.00 59.70 57.09 1br0 h MET 30 Cb 2.13 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 33.73 1br0 h MET 30 CO 0.27 1.02 0.55 0.22 1.06 0.00 0.00 176.91 180.03 1br0 h ASP 31 N 0.56 0.83 -0.64 1.22 3.58 -1.59 -0.64 116.42 119.75 1br0 h ASP 31 Ca 0.06 0.03 -0.07 0.00 0.42 0.00 0.00 57.03 57.47 1br0 h ASP 31 Cb 0.85 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.73 1br0 h ASP 31 CO 0.07 0.50 0.14 -0.33 -2.88 0.00 0.00 179.24 176.74 1br0 h GLU 32 N 0.95 1.05 -0.80 0.28 5.08 -1.53 -2.87 114.58 116.74 1br0 h GLU 32 Ca 0.41 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 1br0 h GLU 32 Cb 0.29 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 1br0 h GLU 32 CO -0.21 0.94 0.47 0.35 -1.00 0.00 0.00 179.01 179.56 1br0 h PHE 33 N 0.99 1.06 -0.12 4.33 3.57 -1.00 -2.87 116.94 122.91 1br0 h PHE 33 Ca 0.21 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.60 1br0 h PHE 33 Cb 0.38 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1br0 h PHE 33 CO 0.03 0.72 -0.38 0.74 -2.23 0.00 0.00 178.31 177.19 1br0 h PHE 34 N 1.10 0.30 -0.06 0.41 0.04 -1.13 -3.21 116.94 114.39 1br0 h PHE 34 Ca 0.29 -0.08 -0.08 0.00 2.80 0.00 0.00 57.97 60.90 1br0 h PHE 34 Cb -0.03 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.06 1br0 h PHE 34 CO -0.00 0.61 -0.28 1.05 -0.60 0.00 0.00 178.31 179.09 1br0 h GLU 35 N 0.22 0.29 -0.47 1.51 4.11 -1.51 -3.38 114.58 115.36 1br0 h GLU 35 Ca 0.02 -0.23 -0.10 0.00 0.07 0.00 0.00 59.36 59.12 1br0 h GLU 35 Cb 0.77 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.05 1br0 h GLU 35 CO 0.06 0.88 -0.11 -0.56 0.07 0.00 0.00 179.01 179.35 1br0 h GLN 36 N -0.23 0.86 -0.88 1.06 3.07 -1.64 -3.33 115.11 114.02 1br0 h GLN 36 Ca -0.02 -0.29 0.23 0.00 0.09 0.00 0.00 58.65 58.66 1br0 h GLN 36 Cb 0.93 -0.07 -0.14 0.00 0.08 0.00 0.00 27.48 28.28 1br0 h GLN 36 CO 0.06 0.92 0.27 -0.39 0.09 0.00 0.00 178.83 179.78 1br0 h VAL 37 N 0.77 0.34 -0.73 1.86 -1.51 -1.72 -2.22 116.25 113.04 1br0 h VAL 37 Ca 0.13 -0.08 -0.02 0.00 -1.23 0.00 0.00 66.70 65.49 1br0 h VAL 37 Cb 0.61 0.08 -0.03 0.00 -2.13 0.00 0.00 31.29 29.82 1br0 h VAL 37 CO 0.04 0.04 0.37 -0.08 -1.23 0.00 0.00 177.57 176.71 1br0 h GLU 38 N 0.24 1.05 -0.06 5.19 4.81 -1.77 -1.71 114.58 122.33 1br0 h GLU 38 Ca 0.56 -0.14 -0.11 0.00 -0.13 0.00 0.00 59.36 59.54 1br0 h GLU 38 Cb 1.12 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.29 1br0 h GLU 38 CO -0.63 0.81 -0.46 1.05 -0.73 0.00 0.00 179.01 179.05 1br0 h GLU 39 N 1.02 0.14 0.48 1.92 4.11 -1.66 -3.13 114.58 117.47 1br0 h GLU 39 Ca 0.25 -0.07 -0.02 0.00 0.07 0.00 0.00 59.36 59.59 1br0 h GLU 39 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1br0 h GLU 39 CO -0.03 0.57 -0.26 0.82 0.07 0.00 0.00 179.01 180.18 1br0 h ILE 40 N 0.12 0.47 -1.34 -1.06 2.04 -1.22 -2.78 117.51 113.74 1br0 h ILE 40 Ca 0.01 0.00 0.40 0.00 1.00 0.00 0.00 64.86 66.27 1br0 h ILE 40 Cb 0.85 0.47 -0.10 0.00 -0.74 0.00 0.00 36.82 37.31 1br0 h ILE 40 CO 0.07 0.00 0.90 0.03 0.00 0.00 0.00 178.15 179.15 1br0 h ARG 41 N -0.69 0.12 0.31 2.37 3.08 -1.36 0.02 114.38 118.24 1br0 h ARG 41 Ca -0.06 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 1br0 h ARG 41 Cb 0.54 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1br0 h ARG 41 CO 0.09 0.08 -0.15 0.78 -1.07 0.00 0.00 179.97 179.70 1br0 h GLY 42 N 0.12 -0.43 2.00 0.04 0.00 -1.44 -0.46 103.07 102.90 1br0 h GLY 42 Ca 0.74 0.16 -0.02 0.00 0.00 0.00 0.00 47.33 48.21 1br0 h GLY 42 CO -0.25 -0.16 -0.11 0.74 0.00 0.00 0.00 176.54 176.77 1br0 h PHE 43 N -0.44 0.00 0.41 5.60 0.04 -0.95 -1.29 116.94 120.31 1br0 h PHE 43 Ca -0.04 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 1br0 h PHE 43 Cb 0.34 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.49 1br0 h PHE 43 CO -0.05 0.11 -0.20 0.82 -0.60 0.00 0.00 178.31 178.39 1br0 h ILE 44 N 0.00 0.08 -0.95 -0.55 1.08 -0.97 -3.19 117.51 113.01 1br0 h ILE 44 Ca -0.00 -0.62 0.20 0.00 -0.39 0.00 0.00 64.86 64.05 1br0 h ILE 44 Cb 0.23 0.13 -0.08 0.00 -3.07 0.00 0.00 36.82 34.02 1br0 h ILE 44 CO 0.01 0.02 0.61 0.44 -0.69 0.00 0.00 178.15 178.54 1br0 h ASP 45 N -1.13 0.55 0.30 1.72 3.32 -1.11 -2.00 116.42 118.06 1br0 h ASP 45 Ca -0.06 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 1br0 h ASP 45 Cb 0.45 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.96 1br0 h ASP 45 CO 0.09 0.21 -0.03 0.50 -1.72 0.00 0.00 179.24 178.29 1br0 h LYS 46 N 0.54 0.00 0.03 3.56 1.63 -1.33 -0.64 116.57 120.35 1br0 h LYS 46 Ca 0.51 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 60.31 1br0 h LYS 46 Cb 1.09 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.72 1br0 h LYS 46 CO -0.25 0.03 -0.01 0.82 -3.45 0.00 0.00 179.45 176.58 1br0 h ILE 47 N 0.00 0.00 -0.10 2.00 1.08 -1.34 -2.99 117.51 116.15 1br0 h ILE 47 Ca -0.00 -0.21 0.03 0.00 -0.39 0.00 0.00 64.86 64.29 1br0 h ILE 47 Cb 0.18 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 33.93 1br0 h ILE 47 CO 0.00 0.00 0.22 0.00 -0.69 0.00 0.00 178.15 177.68 1br0 h ALA 48 N -1.77 1.51 0.02 1.87 0.00 -1.58 0.86 119.26 120.17 1br0 h ALA 48 Ca -0.00 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 1br0 h ALA 48 Cb 0.03 0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.84 1br0 h ALA 48 CO 0.01 -0.27 -0.51 0.93 0.00 0.00 0.00 179.25 179.41 1br0 h GLU 49 N 0.00 0.31 -0.25 0.00 4.39 -1.29 -2.65 114.58 115.10 1br0 h GLU 49 Ca 0.05 -0.36 -0.10 0.00 0.34 0.00 0.00 59.36 59.29 1br0 h GLU 49 Cb 0.49 0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1br0 h GLU 49 CO -0.00 1.06 -0.24 -0.91 -1.16 0.00 0.00 179.01 177.77 1br0 h ASN 50 N -0.28 0.64 -0.46 1.42 4.21 -1.18 -2.73 115.58 117.20 1br0 h ASN 50 Ca -0.07 -0.47 0.04 0.00 1.21 0.00 0.00 56.30 57.01 1br0 h ASN 50 Cb 1.26 -0.18 -0.04 0.00 -1.12 0.00 0.00 38.32 38.24 1br0 h ASN 50 CO 0.10 0.98 0.23 0.58 -1.29 0.00 0.00 177.43 178.03 1br0 h VAL 51 N 0.31 0.97 -0.53 2.81 2.07 -1.03 -0.49 116.25 120.36 1br0 h VAL 51 Ca 0.04 -0.16 0.07 0.00 0.82 0.00 0.00 66.70 67.47 1br0 h VAL 51 Cb 0.79 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 1br0 h VAL 51 CO 0.06 0.09 0.35 -0.33 0.02 0.00 0.00 177.57 177.76 1br0 h GLU 52 N 0.47 0.44 -0.38 1.57 5.08 -1.54 -2.66 114.58 117.56 1br0 h GLU 52 Ca 0.20 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.46 1br0 h GLU 52 Cb 0.10 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1br0 h GLU 52 CO -0.14 0.29 -0.04 1.49 -1.00 0.00 0.00 179.01 179.61 1br0 h GLU 53 N 0.45 0.70 -0.78 2.33 4.81 -0.97 -3.21 114.58 117.92 1br0 h GLU 53 Ca 0.23 -0.24 0.18 0.00 -0.13 0.00 0.00 59.36 59.40 1br0 h GLU 53 Cb 0.34 -0.05 -0.13 0.00 0.63 0.00 0.00 28.75 29.54 1br0 h GLU 53 CO -0.06 0.82 0.10 0.28 -0.73 0.00 0.00 179.01 179.41 1br0 h VAL 54 N 0.51 0.38 -0.07 0.32 2.07 -0.79 -2.07 116.25 116.60 1br0 h VAL 54 Ca 0.10 -0.06 -0.10 0.00 0.82 0.00 0.00 66.70 67.47 1br0 h VAL 54 Cb 0.53 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1br0 h VAL 54 CO 0.03 0.03 -0.41 0.11 0.02 0.00 0.00 177.57 177.35 1br0 h LYS 55 N 0.16 0.15 0.00 1.57 1.57 -1.53 -0.06 116.57 118.43 1br0 h LYS 55 Ca 0.44 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 59.08 1br0 h LYS 55 Cb 0.80 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 1br0 h LYS 55 CO -0.63 0.54 -0.37 0.07 -0.57 0.00 0.00 179.45 178.49 1br0 h ARG 56 N 0.13 0.00 0.02 3.15 0.11 -1.48 -3.38 114.38 112.93 1br0 h ARG 56 Ca 0.01 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.09 1br0 h ARG 56 Cb 0.78 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.86 1br0 h ARG 56 CO 0.06 0.37 -0.01 0.87 0.10 0.00 0.00 179.97 181.36 1br0 h LYS 57 N 0.00 -0.02 -1.02 0.08 1.79 -1.10 -3.31 116.57 112.98 1br0 h LYS 57 Ca -0.00 0.00 0.25 0.00 -2.18 0.00 0.00 60.65 58.72 1br0 h LYS 57 Cb 0.94 0.01 -0.11 0.00 -1.58 0.00 0.00 32.23 31.48 1br0 h LYS 57 CO 0.05 -0.02 0.63 0.45 -1.08 0.00 0.00 179.45 179.48 1br0 h HIS 58 N -0.49 0.87 0.03 -1.35 3.86 -1.21 -1.69 115.15 115.18 1br0 h HIS 58 Ca -0.00 0.03 -0.24 0.00 -1.16 0.00 0.00 60.37 59.00 1br0 h HIS 58 Cb 0.02 -0.25 -0.03 0.00 1.06 0.00 0.00 27.41 28.21 1br0 h HIS 58 CO 0.00 0.06 -1.21 1.03 0.86 0.00 0.00 177.93 178.68 1br0 h SER 59 N 0.51 0.10 1.53 2.45 0.87 -1.80 0.33 113.55 117.53 1br0 h SER 59 Ca 0.63 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 61.07 1br0 h SER 59 Cb 1.34 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 1br0 h SER 59 CO -0.40 1.10 0.00 0.00 -0.53 0.00 0.00 176.83 176.99 1br0 h ALA 60 N 0.89 1.00 0.04 6.23 0.00 -1.53 -0.70 119.26 125.19 1br0 h ALA 60 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.47 1br0 h ALA 60 Cb 1.86 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.61 1br0 h ALA 60 CO 0.13 0.00 -2.01 -0.89 0.00 0.00 0.00 179.25 176.48 1br0 n ILE 61 N -2.61 1.62 0.23 0.00 5.41 -0.68 -0.84 119.36 122.49 1br0 n ILE 61 Ca 0.04 -0.73 0.06 0.00 1.00 0.00 0.00 62.75 63.13 1br0 n ILE 61 Cb 0.43 -1.24 0.55 0.00 -0.71 0.00 0.00 39.64 38.67 1br0 n ILE 61 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 1br0 h LEU 62 N 0.02 0.01 0.06 1.39 7.12 -0.92 -0.33 115.31 122.67 1br0 h LEU 62 Ca -0.41 -0.00 -0.00 0.00 0.13 0.00 0.00 57.88 57.59 1br0 h LEU 62 Cb 2.04 -0.00 0.00 0.00 -0.53 0.00 0.00 40.66 42.17 1br0 h LEU 62 CO 0.05 0.12 -0.03 0.00 -0.13 0.00 0.00 178.44 178.46 1br0 h ALA 63 N 1.88 -0.08 -1.77 1.25 0.00 -1.23 -3.38 119.26 115.92 1br0 h ALA 63 Ca 0.00 -0.29 -0.76 0.00 0.00 0.00 0.00 54.91 53.86 1br0 h ALA 63 Cb 0.20 0.03 -0.21 0.00 0.00 0.00 0.00 17.79 17.81 1br0 h ALA 63 CO 0.01 -0.13 1.21 0.43 0.00 0.00 0.00 179.25 180.77 1br0 n SER 64 N -4.77 5.41 0.00 0.00 7.64 -0.02 -4.93 113.62 116.94 1br0 n SER 64 Ca -0.07 -3.07 0.00 0.00 1.01 0.00 0.00 58.87 56.74 1br0 n SER 64 Cb 0.29 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.02 1br0 n SER 64 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1br0 n PRO 65 N 4.08 0.00 -3.58 1.43 -0.04 -0.14 -3.11 135.00 133.64 1br0 n PRO 65 Ca 0.33 0.40 -0.27 0.00 -0.04 0.00 0.00 63.50 63.92 1br0 n PRO 65 Cb 0.39 -1.53 -0.10 0.00 -0.04 0.00 0.00 33.50 32.22 1br0 n PRO 65 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1br0 n ASN 66 N -1.39 1.49 -1.81 3.54 2.85 -1.26 -5.08 115.26 113.60 1br0 n ASN 66 Ca 0.00 -2.87 0.00 0.00 -0.11 0.00 0.00 54.58 51.60 1br0 n ASN 66 Cb 0.03 -0.66 0.00 0.00 1.24 0.00 0.00 39.78 40.39 1br0 n ASN 66 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1br0 n PRO 67 N 2.11 1.24 -1.59 1.20 -0.04 -1.18 -5.12 135.00 131.62 1br0 n PRO 67 Ca 0.25 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.41 1br0 n PRO 67 Cb 0.42 0.00 0.09 0.00 -0.04 0.00 0.00 33.50 33.97 1br0 n PRO 67 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1br0 s ASP 68 N -1.00 4.59 0.58 3.54 -1.08 -1.26 -4.98 116.67 117.06 1br0 s ASP 68 Ca 0.00 1.29 0.28 0.00 -0.52 0.00 0.00 52.55 53.60 1br0 s ASP 68 Cb 0.00 -2.03 1.50 0.00 -1.46 0.00 0.00 42.92 40.94 1br0 s ASP 68 CO 0.00 -1.90 1.96 -0.33 0.52 0.00 0.00 175.17 175.41 1br0 h GLU 69 N -1.04 0.00 -0.92 4.34 3.07 -2.02 -2.54 114.58 115.46 1br0 h GLU 69 Ca -0.47 0.00 0.10 0.00 -0.50 0.00 0.00 59.36 58.49 1br0 h GLU 69 Cb 1.27 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 29.11 1br0 h GLU 69 CO 0.60 0.00 0.59 -0.22 -1.40 0.00 0.00 179.01 178.58 1br0 h LYS 70 N 0.00 0.90 0.12 2.33 3.64 -2.00 -3.25 116.57 118.32 1br0 h LYS 70 Ca 0.20 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1br0 h LYS 70 Cb 1.03 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 1br0 h LYS 70 CO -0.00 0.60 -0.06 1.79 -2.27 0.00 0.00 179.45 179.51 1br0 h THR 71 N 0.93 0.00 -0.04 1.00 1.35 -1.83 -3.30 112.91 111.02 1br0 h THR 71 Ca 0.43 -0.45 -0.23 0.00 -0.55 0.00 0.00 66.41 65.61 1br0 h THR 71 Cb 0.41 0.00 0.01 0.00 -1.73 0.00 0.00 68.15 66.84 1br0 h THR 71 CO -0.19 0.00 -0.91 0.11 -0.25 0.00 0.00 175.52 174.28 1br0 h LYS 72 N -0.62 0.56 -0.82 4.72 1.57 -1.73 -2.19 116.57 118.06 1br0 h LYS 72 Ca -0.02 -0.55 0.07 0.00 -1.87 0.00 0.00 60.65 58.29 1br0 h LYS 72 Cb 0.13 0.14 -0.05 0.00 0.08 0.00 0.00 32.23 32.52 1br0 h LYS 72 CO 0.03 1.17 0.54 0.93 -0.57 0.00 0.00 179.45 181.55 1br0 h GLU 73 N 0.34 0.84 0.00 3.15 4.39 -1.80 -2.20 114.58 119.31 1br0 h GLU 73 Ca -0.08 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.57 1br0 h GLU 73 Cb 1.54 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 30.00 1br0 h GLU 73 CO 0.17 0.56 0.00 0.39 -1.16 0.00 0.00 179.01 178.97 1br0 n GLU 74 N -4.49 0.20 -0.03 2.33 1.02 -1.15 -3.98 120.64 114.53 1br0 n GLU 74 Ca 0.13 0.21 -0.12 0.00 -0.02 0.00 0.00 57.16 57.36 1br0 n GLU 74 Cb 0.24 -1.75 -0.08 0.00 -0.02 0.00 0.00 31.44 29.83 1br0 n GLU 74 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1br0 h LEU 75 N 0.00 0.14 -1.79 -4.62 3.38 -0.73 -0.23 115.31 111.45 1br0 h LEU 75 Ca 0.00 -0.37 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 1br0 h LEU 75 Cb 0.61 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 1br0 h LEU 75 CO 0.00 0.48 -0.15 -0.33 0.09 0.00 0.00 178.44 178.53 1br0 h GLU 76 N -0.20 0.00 0.10 1.13 5.08 -1.74 -2.86 114.58 116.09 1br0 h GLU 76 Ca 0.02 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1br0 h GLU 76 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1br0 h GLU 76 CO 0.01 0.15 -0.05 1.49 -1.00 0.00 0.00 179.01 179.61 1br0 h GLU 77 N 0.00 -0.13 -0.42 2.33 4.57 -1.68 -3.20 114.58 116.06 1br0 h GLU 77 Ca -0.00 0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 58.10 1br0 h GLU 77 Cb 0.31 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.91 1br0 h GLU 77 CO 0.02 0.39 -0.07 1.37 -1.18 0.00 0.00 179.01 179.53 1br0 h LEU 78 N -0.79 0.79 -0.32 1.64 8.10 -1.05 -0.19 115.31 123.49 1br0 h LEU 78 Ca -0.01 -0.35 -0.05 0.00 0.11 0.00 0.00 57.88 57.58 1br0 h LEU 78 Cb 0.57 -0.21 -0.01 0.00 -0.44 0.00 0.00 40.66 40.57 1br0 h LEU 78 CO 0.02 0.95 0.00 0.24 -4.11 0.00 0.00 178.44 175.55 1br0 h MET 79 N 0.61 0.56 0.00 0.17 2.86 -1.72 -2.96 114.93 114.45 1br0 h MET 79 Ca 0.11 -0.18 -0.03 0.00 -2.06 0.00 0.00 59.70 57.54 1br0 h MET 79 Cb 0.59 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.20 1br0 h MET 79 CO 0.04 0.69 -0.16 1.03 1.06 0.00 0.00 176.91 179.57 1br0 h SER 80 N 0.36 0.00 -0.26 1.22 0.87 -1.57 -2.95 113.55 111.22 1br0 h SER 80 Ca 0.09 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.62 1br0 h SER 80 Cb 0.44 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.39 1br0 h SER 80 CO 0.02 0.16 0.04 -0.78 -0.53 0.00 0.00 176.83 175.73 1br0 h ASP 81 N 0.00 0.41 -0.07 6.23 1.82 -0.94 -0.75 116.42 123.12 1br0 h ASP 81 Ca -0.00 -0.26 -0.14 0.00 -0.39 0.00 0.00 57.03 56.24 1br0 h ASP 81 Cb 0.39 -0.11 -0.01 0.00 0.68 0.00 0.00 39.33 40.28 1br0 h ASP 81 CO 0.02 0.56 -0.43 0.40 -1.61 0.00 0.00 179.24 178.18 1br0 h ILE 82 N 0.24 1.30 -0.00 2.25 2.04 -1.55 -0.59 117.51 121.20 1br0 h ILE 82 Ca 0.08 -1.62 -0.00 0.00 1.00 0.00 0.00 64.86 64.32 1br0 h ILE 82 Cb 0.33 1.58 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 1br0 h ILE 82 CO 0.00 0.51 0.00 0.50 0.00 0.00 0.00 178.15 179.17 1br0 h LYS 83 N 0.49 0.00 -0.25 2.37 3.11 -1.56 -0.73 116.57 120.00 1br0 h LYS 83 Ca 0.04 -0.00 -0.09 0.00 -2.81 0.00 0.00 60.65 57.78 1br0 h LYS 83 Cb 0.96 -0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.18 1br0 h LYS 83 CO 0.09 0.07 -0.21 0.87 -2.81 0.00 0.00 179.45 177.46 1br0 h LYS 84 N -0.07 0.59 -0.00 1.90 1.57 -1.16 -2.72 116.57 116.68 1br0 h LYS 84 Ca 0.00 -0.29 -0.00 0.00 -1.87 0.00 0.00 60.65 58.49 1br0 h LYS 84 Cb 0.07 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 1br0 h LYS 84 CO -0.00 0.88 -0.00 1.15 -0.57 0.00 0.00 179.45 180.91 1br0 h THR 85 N 0.30 1.36 -0.86 -0.16 2.02 -1.21 -2.59 112.91 111.77 1br0 h THR 85 Ca 0.05 -1.05 0.02 0.00 0.77 0.00 0.00 66.41 66.19 1br0 h THR 85 Cb 0.75 2.07 -0.05 0.00 -1.74 0.00 0.00 68.15 69.18 1br0 h THR 85 CO 0.05 0.27 0.56 0.00 0.37 0.00 0.00 175.52 176.78 1br0 h ALA 86 N 0.56 1.10 -0.21 6.16 0.00 -1.26 -2.55 119.26 123.07 1br0 h ALA 86 Ca 0.00 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1br0 h ALA 86 Cb 0.45 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1br0 h ALA 86 CO 0.00 0.44 -0.25 -0.97 0.00 0.00 0.00 179.25 178.48 1br0 h ASN 87 N 1.12 0.38 -0.61 0.00 -0.73 -1.59 0.15 115.58 114.31 1br0 h ASN 87 Ca 0.33 -0.12 -0.02 0.00 1.87 0.00 0.00 56.30 58.36 1br0 h ASN 87 Cb -0.07 -0.10 -0.03 0.00 0.27 0.00 0.00 38.32 38.39 1br0 h ASN 87 CO -0.09 0.64 0.33 0.50 -0.37 0.00 0.00 177.43 178.43 1br0 h LYS 88 N 0.34 0.87 0.00 6.67 3.64 -1.21 -3.29 116.57 123.60 1br0 h LYS 88 Ca 0.05 -0.10 -0.15 0.00 -1.27 0.00 0.00 60.65 59.18 1br0 h LYS 88 Cb 0.62 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 1br0 h LYS 88 CO 0.04 0.66 -1.02 1.55 -2.27 0.00 0.00 179.45 178.42 1br0 n VAL 89 N -4.37 1.49 -0.29 2.00 3.14 -0.98 -4.30 118.33 115.02 1br0 n VAL 89 Ca 0.06 0.06 -0.00 0.00 -2.96 0.00 0.00 64.34 61.49 1br0 n VAL 89 Cb 0.11 -2.17 0.13 0.00 -1.06 0.00 0.00 33.84 30.85 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 0.90 0.00 1.45 0.11 -0.85 -0.15 114.38 114.84 1br0 h ARG 90 Ca -0.23 -0.05 -0.02 0.00 0.10 0.00 0.00 59.98 59.77 1br0 h ARG 90 Cb 1.02 -0.20 -0.00 0.00 1.11 0.00 0.00 29.97 31.89 1br0 h ARG 90 CO -0.14 0.59 -0.11 0.77 0.10 0.00 0.00 179.97 181.18 1br0 h SER 91 N 0.92 0.00 0.37 0.08 0.02 -1.77 -0.57 113.55 112.59 1br0 h SER 91 Ca 0.35 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.98 1br0 h SER 91 Cb 0.15 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1br0 h SER 91 CO -0.16 0.11 -1.63 0.11 -1.14 0.00 0.00 176.83 174.11 1br0 h LYS 92 N 0.00 0.27 -0.46 3.45 1.79 -1.42 -3.21 116.57 116.98 1br0 h LYS 92 Ca -0.00 -0.46 -0.11 0.00 -2.18 0.00 0.00 60.65 57.90 1br0 h LYS 92 Cb 0.54 0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 31.34 1br0 h LYS 92 CO 0.01 1.13 -0.17 1.25 -1.08 0.00 0.00 179.45 180.59 1br0 h LEU 93 N 0.07 0.90 -1.81 2.94 6.46 -1.14 -3.12 115.31 119.62 1br0 h LEU 93 Ca -0.28 -0.31 -0.02 0.00 -0.12 0.00 0.00 57.88 57.15 1br0 h LEU 93 Cb 2.04 -0.25 -0.00 0.00 -0.73 0.00 0.00 40.66 41.72 1br0 h LEU 93 CO 0.15 1.05 -0.10 0.11 -0.62 0.00 0.00 178.44 179.04 1br0 h LYS 94 N 0.78 0.00 0.00 1.25 1.57 -1.25 -2.52 116.57 116.40 1br0 h LYS 94 Ca 0.11 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1br0 h LYS 94 Cb 0.71 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.02 1br0 h LYS 94 CO 0.05 0.10 -0.02 1.03 -0.57 0.00 0.00 179.45 180.03 1br0 h SER 95 N 0.00 0.00 0.07 0.86 0.87 -1.54 0.11 113.55 113.92 1br0 h SER 95 Ca -0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1br0 h SER 95 Cb 0.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 1br0 h SER 95 CO 0.01 0.02 -0.03 0.40 -0.53 0.00 0.00 176.83 176.70 1br0 h ILE 96 N 0.00 0.85 -0.45 2.23 1.08 -1.54 -3.01 117.51 116.68 1br0 h ILE 96 Ca -0.00 -1.44 -0.00 0.00 -0.39 0.00 0.00 64.86 63.02 1br0 h ILE 96 Cb 0.12 1.55 -0.02 0.00 -3.07 0.00 0.00 36.82 35.40 1br0 h ILE 96 CO 0.00 0.26 0.26 -0.08 -0.69 0.00 0.00 178.15 177.91 1br0 h GLU 97 N -0.95 0.60 -0.68 2.37 4.81 -1.38 -2.93 114.58 116.42 1br0 h GLU 97 Ca -0.01 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.13 1br0 h GLU 97 Cb 0.51 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 1br0 h GLU 97 CO 0.02 0.43 0.28 1.96 -0.73 0.00 0.00 179.01 180.96 1br0 h GLN 98 N 0.61 1.01 -0.08 1.92 4.20 -0.94 -3.22 115.11 118.61 1br0 h GLN 98 Ca 0.16 -0.18 -0.11 0.00 0.06 0.00 0.00 58.65 58.58 1br0 h GLN 98 Cb -0.01 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.59 1br0 h GLN 98 CO -0.03 0.84 -0.46 0.77 -0.67 0.00 0.00 178.83 179.27 1br0 h SER 99 N 0.96 0.20 0.05 1.46 0.02 -1.37 -3.10 113.55 111.76 1br0 h SER 99 Ca 0.23 -0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1br0 h SER 99 Cb 0.20 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1br0 h SER 99 CO -0.02 0.63 -0.02 0.40 -1.14 0.00 0.00 176.83 176.68 1br0 h ILE 100 N 0.15 0.87 0.00 3.27 2.04 -1.58 -1.54 117.51 120.72 1br0 h ILE 100 Ca 0.01 -1.52 0.00 0.00 1.00 0.00 0.00 64.86 64.34 1br0 h ILE 100 Cb 0.88 1.61 0.00 0.00 -0.74 0.00 0.00 36.82 38.56 1br0 h ILE 100 CO 0.07 0.28 0.00 -0.33 0.00 0.00 0.00 178.15 178.17 1br0 h GLU 101 N -0.97 0.00 0.16 2.37 5.08 -1.74 -1.55 114.58 117.93 1br0 h GLU 101 Ca -0.01 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.09 1br0 h GLU 101 Cb 0.51 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.77 1br0 h GLU 101 CO 0.01 0.00 -1.24 0.37 -1.00 0.00 0.00 179.01 177.15 1br0 h GLN 102 N 0.00 0.34 -0.14 2.33 4.15 -1.54 -3.36 115.11 116.89 1br0 h GLN 102 Ca 0.00 -0.58 -0.16 0.00 0.77 0.00 0.00 58.65 58.68 1br0 h GLN 102 Cb 0.00 0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 1br0 h GLN 102 CO 0.00 1.28 -0.57 0.93 -1.93 0.00 0.00 178.83 178.54 1br0 h GLU 103 N -0.20 0.44 -0.29 1.69 5.08 -1.13 -3.32 114.58 116.85 1br0 h GLU 103 Ca -0.24 -0.28 0.06 0.00 -1.00 0.00 0.00 59.36 57.90 1br0 h GLU 103 Cb 1.83 0.04 -0.08 0.00 0.50 0.00 0.00 28.75 31.04 1br0 h GLU 103 CO 0.15 0.89 -0.37 1.49 -1.00 0.00 0.00 179.01 180.16 1br0 h GLU 104 N 0.33 -0.34 -1.65 2.33 4.81 -1.48 -2.81 114.58 115.76 1br0 h GLU 104 Ca 0.00 0.02 0.49 0.00 -0.13 0.00 0.00 59.36 59.74 1br0 h GLU 104 Cb 1.10 0.08 -0.08 0.00 0.63 0.00 0.00 28.75 30.48 1br0 h GLU 104 CO 0.10 -0.23 1.17 0.78 -0.73 0.00 0.00 179.01 180.10 1br0 h GLY 105 N -0.35 0.27 2.00 1.92 0.00 -1.71 -0.74 103.07 104.45 1br0 h GLY 105 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1br0 h GLY 105 CO -0.48 -0.08 0.00 1.04 0.00 0.00 0.00 176.54 177.02 1br0 n LEU 106 N -4.15 0.21 -1.92 3.11 4.32 -1.06 -4.95 117.00 112.56 1br0 n LEU 106 Ca 0.38 0.59 -0.02 0.00 -0.02 0.00 0.00 56.01 56.94 1br0 n LEU 106 Cb 1.71 -0.60 0.00 0.00 -1.62 0.00 0.00 43.42 42.91 1br0 n LEU 106 CO 0.39 -0.59 -0.05 -3.20 -1.22 0.00 0.00 177.39 172.72 1br0 n ASN 107 N -1.77 -3.93 -3.81 -1.43 2.85 -0.29 -5.14 115.26 101.75 1br0 n ASN 107 Ca 0.00 0.28 -0.12 0.00 -0.11 0.00 0.00 54.58 54.63 1br0 n ASN 107 Cb 0.05 -2.41 -0.11 0.00 1.24 0.00 0.00 39.78 38.55 1br0 n ASN 107 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1br0 s ARG 108 N -1.17 0.31 -0.20 1.20 1.70 -1.24 -5.09 118.95 114.47 1br0 s ARG 108 Ca 0.05 0.14 -0.05 0.00 -0.47 0.00 0.00 55.73 55.41 1br0 s ARG 108 Cb -0.01 0.14 0.07 0.00 -0.57 0.00 0.00 34.95 34.58 1br0 s ARG 108 CO 0.25 -0.05 0.12 -1.54 -1.08 0.00 0.00 175.30 173.00 1br0 s SER 109 N -0.23 2.41 0.02 -2.89 1.04 -1.26 -4.85 113.70 107.95 1br0 s SER 109 Ca -0.03 -0.69 -0.05 0.00 0.48 0.00 0.00 55.95 55.66 1br0 s SER 109 Cb -0.03 -0.15 -0.01 0.00 0.10 0.00 0.00 66.02 65.93 1br0 s SER 109 CO 0.01 -0.37 0.09 -0.55 0.98 0.00 0.00 173.24 173.40 1br0 s SER 110 N 2.17 0.14 0.17 7.02 0.15 -1.26 -5.09 113.70 116.99 1br0 s SER 110 Ca 0.04 -0.43 -0.06 0.00 0.70 0.00 0.00 55.95 56.20 1br0 s SER 110 Cb -0.16 0.20 0.04 0.00 -1.71 0.00 0.00 66.02 64.39 1br0 s SER 110 CO -0.15 -0.43 1.47 0.00 1.20 0.00 0.00 173.24 175.33 1br0 h ALA 111 N 4.00 0.62 -0.95 5.45 0.00 -2.01 -3.31 119.26 123.07 1br0 h ALA 111 Ca -0.32 -0.51 0.18 0.00 0.00 0.00 0.00 54.91 54.27 1br0 h ALA 111 Cb 1.19 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.81 1br0 h ALA 111 CO 0.46 0.68 0.60 -0.44 0.00 0.00 0.00 179.25 180.56 1br0 h ASP 112 N 0.53 0.62 -0.15 0.00 5.19 -1.99 -0.48 116.42 120.13 1br0 h ASP 112 Ca 0.01 0.06 -0.04 0.00 -0.62 0.00 0.00 57.03 56.44 1br0 h ASP 112 Cb 1.10 -0.05 -0.02 0.00 0.18 0.00 0.00 39.33 40.54 1br0 h ASP 112 CO 0.11 0.25 -0.02 0.25 -3.12 0.00 0.00 179.24 176.71 1br0 h LEU 113 N 0.62 0.38 0.10 1.55 5.85 -2.01 -3.28 115.31 118.52 1br0 h LEU 113 Ca 0.51 -0.07 -0.36 0.00 0.84 0.00 0.00 57.88 58.81 1br0 h LEU 113 Cb 0.97 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 1br0 h LEU 113 CO -0.26 0.46 -1.98 0.54 -0.34 0.00 0.00 178.44 176.86 1br0 n ARG 114 N -4.30 0.74 -0.30 1.25 1.74 -0.77 -3.59 116.66 111.43 1br0 n ARG 114 Ca 0.01 0.26 0.16 0.00 -0.77 0.00 0.00 57.85 57.51 1br0 n ARG 114 Cb 0.23 -1.71 0.42 0.00 -1.02 0.00 0.00 32.46 30.38 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 0.06 0.70 -0.28 0.55 2.04 -1.26 -1.59 117.51 117.72 1br0 h ILE 115 Ca -0.41 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.24 1br0 h ILE 115 Cb 2.03 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 38.16 1br0 h ILE 115 CO 0.08 0.11 0.16 0.03 0.00 0.00 0.00 178.15 178.52 1br0 h ARG 116 N 0.58 0.39 0.00 2.37 3.08 -1.65 -3.03 114.38 116.13 1br0 h ARG 116 Ca 0.52 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.52 1br0 h ARG 116 Cb 1.04 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 31.01 1br0 h ARG 116 CO -0.27 0.33 -0.06 0.87 -1.07 0.00 0.00 179.97 179.78 1br0 h LYS 117 N 0.34 0.00 -0.09 0.04 1.79 -1.38 -2.75 116.57 114.52 1br0 h LYS 117 Ca 0.10 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.56 1br0 h LYS 117 Cb 0.05 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.70 1br0 h LYS 117 CO -0.02 0.06 0.03 1.15 -1.08 0.00 0.00 179.45 179.59 1br0 h THR 118 N 0.00 1.16 0.01 -0.16 2.02 -1.21 -0.67 112.91 114.06 1br0 h THR 118 Ca -0.00 -0.47 -0.26 0.00 0.77 0.00 0.00 66.41 66.44 1br0 h THR 118 Cb 0.22 1.31 0.02 0.00 -1.74 0.00 0.00 68.15 67.96 1br0 h THR 118 CO 0.01 0.14 -1.04 1.56 0.37 0.00 0.00 175.52 176.55 1br0 h GLN 119 N -0.03 0.68 -0.39 6.66 4.20 -1.61 -3.10 115.11 121.52 1br0 h GLN 119 Ca 0.03 -0.75 -0.05 0.00 0.06 0.00 0.00 58.65 57.94 1br0 h GLN 119 Cb 0.19 0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1br0 h GLN 119 CO -0.00 1.32 0.04 1.25 -0.67 0.00 0.00 178.83 180.77 1br0 h HIS 120 N 0.36 0.62 -0.24 2.96 2.76 -1.59 -0.60 115.15 119.41 1br0 h HIS 120 Ca -0.13 -0.06 -0.13 0.00 -2.20 0.00 0.00 60.37 57.85 1br0 h HIS 120 Cb 1.70 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 30.47 1br0 h HIS 120 CO 0.11 0.57 -0.41 0.66 -1.30 0.00 0.00 177.93 177.56 1br0 h SER 121 N 0.58 0.61 -0.13 3.26 4.64 -1.23 0.03 113.55 121.30 1br0 h SER 121 Ca 0.13 -0.27 -0.08 0.00 -0.47 0.00 0.00 61.79 61.10 1br0 h SER 121 Cb 0.31 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1br0 h SER 121 CO 0.01 0.95 -0.22 0.74 -0.87 0.00 0.00 176.83 177.43 1br0 h THR 122 N 0.47 1.37 -0.26 2.95 2.02 -1.55 -2.15 112.91 115.76 1br0 h THR 122 Ca 0.04 -1.47 0.00 0.00 0.77 0.00 0.00 66.41 65.75 1br0 h THR 122 Cb 0.91 2.01 -0.01 0.00 -1.74 0.00 0.00 68.15 69.31 1br0 h THR 122 CO 0.08 0.43 0.17 -0.07 0.37 0.00 0.00 175.52 176.50 1br0 h LEU 123 N -0.02 0.31 -0.22 2.58 3.38 -1.19 -2.77 115.31 117.38 1br0 h LEU 123 Ca 0.01 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1br0 h LEU 123 Cb 0.80 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1br0 h LEU 123 CO 0.05 0.25 -0.08 -1.28 0.09 0.00 0.00 178.44 177.47 1br0 h SER 124 N 0.35 0.45 -0.86 -0.43 0.87 -1.11 -2.20 113.55 110.61 1br0 h SER 124 Ca 0.10 -0.39 0.14 0.00 -1.23 0.00 0.00 61.79 60.41 1br0 h SER 124 Cb -0.01 -0.12 -0.09 0.00 -0.44 0.00 0.00 62.40 61.73 1br0 h SER 124 CO -0.02 0.73 0.46 -0.09 -0.53 0.00 0.00 176.83 177.39 1br0 h ARG 125 N 0.16 0.65 -0.16 2.24 9.65 -1.46 -0.17 114.38 125.28 1br0 h ARG 125 Ca 0.05 -0.04 -0.10 0.00 -1.10 0.00 0.00 59.98 58.79 1br0 h ARG 125 Cb 0.55 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 28.97 1br0 h ARG 125 CO 0.03 0.43 -0.34 -0.22 2.80 0.00 0.00 179.97 182.67 1br0 h LYS 126 N 0.67 0.32 -0.68 0.20 3.64 -1.54 -2.62 116.57 116.57 1br0 h LYS 126 Ca 0.47 -0.14 -0.06 0.00 -1.27 0.00 0.00 60.65 59.65 1br0 h LYS 126 Cb 0.63 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.41 1br0 h LYS 126 CO -0.35 0.63 0.20 0.35 -2.27 0.00 0.00 179.45 178.01 1br0 h PHE 127 N 0.28 1.10 -0.09 1.91 3.57 -0.50 -3.20 116.94 120.01 1br0 h PHE 127 Ca 0.03 -0.12 -0.23 0.00 3.53 0.00 0.00 57.97 61.19 1br0 h PHE 127 Cb 0.73 -0.32 0.01 0.00 2.79 0.00 0.00 35.95 39.17 1br0 h PHE 127 CO 0.02 0.89 -0.86 0.28 -2.23 0.00 0.00 178.31 176.41 1br0 h VAL 128 N 0.99 1.30 0.00 1.41 2.07 -1.16 0.60 116.25 121.47 1br0 h VAL 128 Ca 0.22 -2.12 0.00 0.00 0.82 0.00 0.00 66.70 65.62 1br0 h VAL 128 Cb 0.32 2.15 0.00 0.00 -1.52 0.00 0.00 31.29 32.24 1br0 h VAL 128 CO -0.00 0.66 0.04 -0.62 0.02 0.00 0.00 177.57 177.66 1br0 n GLU 129 N -3.88 0.00 0.04 1.57 1.02 -0.99 -3.23 120.64 115.17 1br0 n GLU 129 Ca -0.08 0.31 0.00 0.00 -0.02 0.00 0.00 57.16 57.37 1br0 n GLU 129 Cb 0.79 -1.54 0.00 0.00 -0.02 0.00 0.00 31.44 30.67 1br0 n GLU 129 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 1br0 n VAL 130 N -1.29 0.32 -0.28 2.62 3.14 -1.20 -4.79 118.33 116.86 1br0 n VAL 130 Ca 0.00 0.11 -0.06 0.00 -2.96 0.00 0.00 64.34 61.43 1br0 n VAL 130 Cb 0.04 -1.12 0.06 0.00 -1.06 0.00 0.00 33.84 31.76 1br0 n VAL 130 CO 0.00 0.00 0.00 0.24 -6.46 0.00 0.00 176.83 170.61 1br0 h MET 131 N 0.00 1.11 0.00 1.45 2.86 -1.00 -0.04 114.93 119.31 1br0 h MET 131 Ca 0.00 -0.18 -0.02 0.00 -2.06 0.00 0.00 59.70 57.43 1br0 h MET 131 Cb 0.33 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.80 1br0 h MET 131 CO 0.00 0.89 -0.11 0.66 1.06 0.00 0.00 176.91 179.41 1br0 h SER 132 N 1.08 0.00 0.01 1.22 4.64 -1.74 -2.71 113.55 116.05 1br0 h SER 132 Ca 0.26 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.35 1br0 h SER 132 Cb 0.17 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.28 1br0 h SER 132 CO -0.03 0.11 -0.87 -0.08 -0.87 0.00 0.00 176.83 175.09 1br0 h GLU 133 N 0.00 0.58 -0.48 4.77 4.57 -1.66 -3.32 114.58 119.04 1br0 h GLU 133 Ca -0.00 -0.63 0.11 0.00 -1.18 0.00 0.00 59.36 57.65 1br0 h GLU 133 Cb 0.27 0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 29.02 1br0 h GLU 133 CO 0.01 1.24 0.33 -0.92 -1.18 0.00 0.00 179.01 178.50 1br0 h TYR 134 N 0.18 0.19 -0.34 0.92 3.20 -0.79 -1.53 116.97 118.79 1br0 h TYR 134 Ca -0.11 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.73 1br0 h TYR 134 Cb 1.56 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.75 1br0 h TYR 134 CO 0.12 0.09 0.09 -0.97 -1.64 0.00 0.00 178.16 175.85 1br0 h ASN 135 N 0.17 0.50 0.78 -2.11 -1.24 -1.61 -2.85 115.58 109.23 1br0 h ASN 135 Ca 0.23 -0.22 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1br0 h ASN 135 Cb 0.66 -0.13 0.00 0.00 0.73 0.00 0.00 38.32 39.58 1br0 h ASN 135 CO -0.03 0.59 0.00 0.00 -1.29 0.00 0.00 177.43 176.70 1br0 h ALA 136 N 0.93 1.00 -0.36 1.57 0.00 -1.59 -3.36 119.26 117.44 1br0 h ALA 136 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 1br0 h ALA 136 Cb 0.28 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1br0 h ALA 136 CO -0.00 0.00 -0.31 1.15 0.00 0.00 0.00 179.25 180.09 1br0 h THR 137 N 0.00 1.28 -0.25 0.00 2.02 -1.03 -0.54 112.91 114.39 1br0 h THR 137 Ca 0.00 -1.48 -0.19 0.00 0.77 0.00 0.00 66.41 65.51 1br0 h THR 137 Cb 0.39 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.21 1br0 h THR 137 CO 0.00 0.49 -0.60 -0.61 0.37 0.00 0.00 175.52 175.17 1br0 h GLN 138 N 0.65 0.81 -0.01 6.66 4.15 -1.71 -0.29 115.11 125.37 1br0 h GLN 138 Ca 0.06 -0.54 -0.21 0.00 0.77 0.00 0.00 58.65 58.73 1br0 h GLN 138 Cb 0.89 0.08 0.02 0.00 0.21 0.00 0.00 27.48 28.67 1br0 h GLN 138 CO 0.08 1.17 -0.81 1.03 -1.93 0.00 0.00 178.83 178.37 1br0 h SER 139 N 0.61 0.74 0.36 -0.69 0.87 -1.76 -3.24 113.55 110.44 1br0 h SER 139 Ca -0.00 -0.74 0.00 0.00 -1.23 0.00 0.00 61.79 59.82 1br0 h SER 139 Cb 1.20 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 1br0 h SER 139 CO 0.13 1.38 0.00 0.47 -0.53 0.00 0.00 176.83 178.27 1br0 n ASP 140 N -4.04 0.00 0.27 6.23 8.00 -0.21 -2.61 116.55 124.19 1br0 n ASP 140 Ca -0.10 0.31 0.14 0.00 0.71 0.00 0.00 54.79 55.85 1br0 n ASP 140 Cb 0.77 -0.40 0.75 0.00 -0.02 0.00 0.00 41.12 42.22 1br0 n ASP 140 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1br0 h TYR 141 N 0.00 0.00 -0.02 1.24 3.20 -1.06 -3.34 116.97 116.98 1br0 h TYR 141 Ca 0.00 0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.70 1br0 h TYR 141 Cb 0.18 0.00 -0.16 0.00 1.54 0.00 0.00 36.73 38.29 1br0 h TYR 141 CO 0.00 0.10 -0.32 2.89 -1.64 0.00 0.00 178.16 179.20 1br0 n ARG 142 N -3.50 1.37 0.05 1.82 1.85 -1.07 -4.31 116.66 112.87 1br0 n ARG 142 Ca -0.01 -1.34 -0.10 0.00 -1.00 0.00 0.00 57.85 55.40 1br0 n ARG 142 Cb 0.25 0.32 0.02 0.00 -1.05 0.00 0.00 32.46 31.99 1br0 n ARG 142 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 1br0 h GLU 143 N 1.08 0.40 0.00 2.89 4.39 -1.79 -3.44 114.58 118.11 1br0 h GLU 143 Ca -0.43 -0.34 0.00 0.00 0.34 0.00 0.00 59.36 58.93 1br0 h GLU 143 Cb 1.30 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 30.03 1br0 h GLU 143 CO -0.17 0.99 0.00 -2.13 -1.16 0.00 0.00 179.01 176.54 1br0 n ARG 144 N -3.82 0.00 -4.15 2.33 0.63 -1.26 -5.01 116.66 105.38 1br0 n ARG 144 Ca -0.05 0.00 -0.34 0.00 -0.92 0.00 0.00 57.85 56.55 1br0 n ARG 144 Cb 0.73 0.00 -0.02 0.00 0.45 0.00 0.00 32.46 33.61 1br0 n ARG 144 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1br0 n SER 145 N 0.00 -2.69 0.00 6.15 2.88 -1.25 -5.04 113.62 113.66 1br0 n SER 145 Ca 0.00 -1.00 0.00 0.00 -1.33 0.00 0.00 58.87 56.54 1br0 n SER 145 Cb 0.00 -2.87 0.00 0.00 -0.75 0.00 0.00 64.21 60.59 1br0 n SER 145 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10