#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 1.01 -0.04 -0.67 3.08 -2.06 -2.63 114.38 113.07 1br0 h ARG 28 Ca 0.00 -0.19 -0.16 0.00 0.07 0.00 0.00 59.98 59.71 1br0 h ARG 28 Cb 0.00 -0.16 0.01 0.00 0.08 0.00 0.00 29.97 29.90 1br0 h ARG 28 CO 0.00 0.84 -0.58 0.74 -1.07 0.00 0.00 179.97 179.90 1br0 h PHE 29 N 0.96 0.66 -0.13 3.04 0.04 -2.06 -2.73 116.94 116.71 1br0 h PHE 29 Ca 0.22 -0.33 -0.16 0.00 2.80 0.00 0.00 57.97 60.51 1br0 h PHE 29 Cb 0.21 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.27 1br0 h PHE 29 CO 0.01 1.14 -0.58 0.52 -0.60 0.00 0.00 178.31 178.80 1br0 h MET 30 N -0.01 0.43 -0.78 1.51 2.86 -2.00 -2.82 114.93 114.12 1br0 h MET 30 Ca -0.06 -0.28 0.04 0.00 -2.06 0.00 0.00 59.70 57.34 1br0 h MET 30 Cb 1.27 0.04 -0.05 0.00 0.06 0.00 0.00 31.60 32.92 1br0 h MET 30 CO 0.12 0.89 0.49 0.22 1.06 0.00 0.00 176.91 179.68 1br0 h ASP 31 N 0.32 0.78 -0.62 1.22 3.58 -1.53 -1.71 116.42 118.46 1br0 h ASP 31 Ca -0.00 0.01 -0.09 0.00 0.42 0.00 0.00 57.03 57.36 1br0 h ASP 31 Cb 1.11 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.98 1br0 h ASP 31 CO 0.10 0.53 0.04 1.05 -2.88 0.00 0.00 179.24 178.08 1br0 h GLU 32 N 0.92 1.08 -0.74 0.28 4.11 -1.52 -2.81 114.58 115.90 1br0 h GLU 32 Ca 0.32 -0.32 0.11 0.00 0.07 0.00 0.00 59.36 59.54 1br0 h GLU 32 Cb 0.07 -0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.14 1br0 h GLU 32 CO -0.14 1.03 0.36 0.35 0.07 0.00 0.00 179.01 180.68 1br0 h PHE 33 N 1.00 0.64 -0.34 2.06 3.04 -1.27 -1.86 116.94 120.19 1br0 h PHE 33 Ca 0.18 0.03 -0.17 0.00 3.98 0.00 0.00 57.97 61.99 1br0 h PHE 33 Cb 0.52 -0.17 -0.00 0.00 2.56 0.00 0.00 35.95 38.85 1br0 h PHE 33 CO 0.04 0.20 -0.45 0.74 -2.02 0.00 0.00 178.31 176.82 1br0 h PHE 34 N 0.59 1.11 -0.67 0.41 0.04 -1.36 -3.26 116.94 113.79 1br0 h PHE 34 Ca 0.37 -0.36 -0.01 0.00 2.80 0.00 0.00 57.97 60.77 1br0 h PHE 34 Cb 0.44 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 38.33 1br0 h PHE 34 CO -0.11 1.19 0.38 0.93 -0.60 0.00 0.00 178.31 180.10 1br0 h GLU 35 N 0.72 0.93 0.00 1.51 5.08 -1.39 -3.22 114.58 118.21 1br0 h GLU 35 Ca 0.04 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.24 1br0 h GLU 35 Cb 1.05 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 1br0 h GLU 35 CO 0.11 0.69 -0.29 -0.56 -1.00 0.00 0.00 179.01 177.96 1br0 h GLN 36 N 0.92 0.00 -0.22 2.33 3.07 -1.47 -3.28 115.11 116.46 1br0 h GLN 36 Ca 0.24 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.96 1br0 h GLN 36 Cb 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.57 1br0 h GLN 36 CO -0.04 0.29 0.05 0.28 0.09 0.00 0.00 178.83 179.50 1br0 h VAL 37 N 0.00 1.21 -0.53 1.86 2.07 -1.60 -2.77 116.25 116.49 1br0 h VAL 37 Ca -0.00 -0.67 0.15 0.00 0.82 0.00 0.00 66.70 67.00 1br0 h VAL 37 Cb 0.61 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 1br0 h VAL 37 CO 0.04 0.21 0.42 -0.33 0.02 0.00 0.00 177.57 177.93 1br0 h GLU 38 N 0.17 0.00 0.11 1.57 5.08 -1.62 -0.46 114.58 119.43 1br0 h GLU 38 Ca 0.07 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.27 1br0 h GLU 38 Cb 0.27 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.54 1br0 h GLU 38 CO 0.00 0.00 -0.70 1.05 -1.00 0.00 0.00 179.01 178.36 1br0 h GLU 39 N 0.00 0.27 -0.83 2.33 4.11 -1.68 -3.36 114.58 115.43 1br0 h GLU 39 Ca 0.25 -0.45 0.07 0.00 0.07 0.00 0.00 59.36 59.30 1br0 h GLU 39 Cb 1.08 0.16 -0.05 0.00 0.50 0.00 0.00 28.75 30.44 1br0 h GLU 39 CO -0.00 1.20 0.54 0.82 0.07 0.00 0.00 179.01 181.64 1br0 h ILE 40 N -0.42 1.03 -0.30 -1.06 1.08 -1.12 -0.87 117.51 115.85 1br0 h ILE 40 Ca -0.12 -0.31 0.09 0.00 -0.39 0.00 0.00 64.86 64.13 1br0 h ILE 40 Cb 1.53 0.06 -0.01 0.00 -3.07 0.00 0.00 36.82 35.33 1br0 h ILE 40 CO 0.13 0.16 0.23 0.03 -0.69 0.00 0.00 178.15 178.02 1br0 h ARG 41 N 0.89 0.00 -0.16 2.37 3.08 -1.26 0.51 114.38 119.81 1br0 h ARG 41 Ca 0.36 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.38 1br0 h ARG 41 Cb 0.25 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 1br0 h ARG 41 CO -0.13 0.00 -0.04 0.78 -1.07 0.00 0.00 179.97 179.51 1br0 h GLY 42 N 0.00 0.33 1.17 0.04 0.00 -1.31 -2.37 103.07 100.93 1br0 h GLY 42 Ca 0.14 -0.27 0.05 0.00 0.00 0.00 0.00 47.33 47.26 1br0 h GLY 42 CO -0.00 0.25 0.43 0.74 0.00 0.00 0.00 176.54 177.95 1br0 h PHE 43 N 0.01 0.68 0.23 5.60 -1.00 -1.04 -0.46 116.94 120.96 1br0 h PHE 43 Ca 0.04 0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.83 1br0 h PHE 43 Cb 0.46 -0.23 0.00 0.00 3.61 0.00 0.00 35.95 39.80 1br0 h PHE 43 CO 0.05 0.38 -0.11 0.82 -1.61 0.00 0.00 178.31 177.83 1br0 h ILE 44 N 0.69 0.81 -0.94 -0.55 1.08 -0.95 -2.74 117.51 114.91 1br0 h ILE 44 Ca 0.27 -0.78 0.08 0.00 -0.39 0.00 0.00 64.86 64.04 1br0 h ILE 44 Cb 0.21 1.22 -0.07 0.00 -3.07 0.00 0.00 36.82 35.11 1br0 h ILE 44 CO -0.08 0.16 0.60 -0.78 -0.69 0.00 0.00 178.15 177.36 1br0 h ASP 45 N -0.74 0.91 0.19 1.72 1.82 -1.44 -2.80 116.42 116.08 1br0 h ASP 45 Ca -0.03 0.02 -0.02 0.00 -0.39 0.00 0.00 57.03 56.60 1br0 h ASP 45 Cb 0.50 -0.18 -0.00 0.00 0.68 0.00 0.00 39.33 40.33 1br0 h ASP 45 CO 0.05 0.56 -0.11 0.50 -1.61 0.00 0.00 179.24 178.63 1br0 h LYS 46 N 1.02 0.00 0.05 0.28 1.63 -1.09 -1.49 116.57 116.97 1br0 h LYS 46 Ca 0.42 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 60.22 1br0 h LYS 46 Cb 0.28 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.91 1br0 h LYS 46 CO -0.17 0.11 -0.02 0.82 -3.45 0.00 0.00 179.45 176.74 1br0 h ILE 47 N 0.00 0.02 -0.49 2.00 1.08 -1.35 -3.23 117.51 115.54 1br0 h ILE 47 Ca -0.00 -0.96 0.14 0.00 -0.39 0.00 0.00 64.86 63.65 1br0 h ILE 47 Cb 0.24 0.03 -0.02 0.00 -3.07 0.00 0.00 36.82 34.00 1br0 h ILE 47 CO 0.01 0.01 0.50 0.00 -0.69 0.00 0.00 178.15 177.98 1br0 h ALA 48 N -1.01 2.23 0.02 1.87 0.00 -1.48 0.69 119.26 121.58 1br0 h ALA 48 Ca -0.01 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1br0 h ALA 48 Cb 0.06 0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1br0 h ALA 48 CO 0.01 -0.75 -0.35 1.05 0.00 0.00 0.00 179.25 179.21 1br0 h GLU 49 N 0.00 0.20 -0.69 0.00 4.11 -1.45 -2.72 114.58 114.03 1br0 h GLU 49 Ca 0.23 -0.24 -0.02 0.00 0.07 0.00 0.00 59.36 59.40 1br0 h GLU 49 Cb 1.23 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.52 1br0 h GLU 49 CO -0.00 1.01 0.36 -0.91 0.07 0.00 0.00 179.01 179.54 1br0 h ASN 50 N -0.51 0.86 -0.16 3.06 2.35 -1.37 -2.75 115.58 117.06 1br0 h ASN 50 Ca -0.05 -0.08 -0.02 0.00 -0.55 0.00 0.00 56.30 55.60 1br0 h ASN 50 Cb 1.16 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 39.30 1br0 h ASN 50 CO 0.07 0.71 0.01 0.58 -1.65 0.00 0.00 177.43 177.15 1br0 h VAL 51 N 0.97 1.25 -0.62 2.81 2.07 -1.03 -2.73 116.25 118.96 1br0 h VAL 51 Ca 0.24 -0.81 0.16 0.00 0.82 0.00 0.00 66.70 67.11 1br0 h VAL 51 Cb 0.05 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 1br0 h VAL 51 CO -0.04 0.24 0.44 -0.33 0.02 0.00 0.00 177.57 177.90 1br0 h GLU 52 N 0.04 0.13 -0.05 1.57 4.39 -1.42 -1.68 114.58 117.56 1br0 h GLU 52 Ca 0.05 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.71 1br0 h GLU 52 Cb 0.36 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.98 1br0 h GLU 52 CO 0.01 0.09 -0.08 1.49 -1.16 0.00 0.00 179.01 179.35 1br0 h GLU 53 N 0.13 0.15 -0.92 2.33 4.81 -1.39 -3.13 114.58 116.56 1br0 h GLU 53 Ca 0.30 -0.09 0.19 0.00 -0.13 0.00 0.00 59.36 59.63 1br0 h GLU 53 Cb 1.00 0.01 -0.11 0.00 0.63 0.00 0.00 28.75 30.28 1br0 h GLU 53 CO -0.04 0.64 0.48 0.28 -0.73 0.00 0.00 179.01 179.65 1br0 h VAL 54 N -0.34 0.62 -0.13 0.32 2.07 -1.23 -2.28 116.25 115.28 1br0 h VAL 54 Ca 0.00 -0.20 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 1br0 h VAL 54 Cb 0.63 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1br0 h VAL 54 CO 0.02 0.11 -0.11 0.50 0.02 0.00 0.00 177.57 178.10 1br0 h LYS 55 N 0.58 0.19 -0.02 1.57 3.64 -1.37 -0.06 116.57 121.10 1br0 h LYS 55 Ca 0.54 -0.04 -0.21 0.00 -1.27 0.00 0.00 60.65 59.67 1br0 h LYS 55 Cb 0.91 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.70 1br0 h LYS 55 CO -0.43 0.31 -0.88 0.07 -2.27 0.00 0.00 179.45 176.25 1br0 h ARG 56 N 0.19 0.38 -0.17 1.90 0.11 -1.36 -3.38 114.38 112.05 1br0 h ARG 56 Ca 0.04 -0.39 -0.06 0.00 0.10 0.00 0.00 59.98 59.67 1br0 h ARG 56 Cb 0.32 0.10 -0.00 0.00 1.11 0.00 0.00 29.97 31.50 1br0 h ARG 56 CO 0.02 1.05 -0.15 0.87 0.10 0.00 0.00 179.97 181.86 1br0 h LYS 57 N 0.23 0.39 0.00 0.08 1.79 -1.34 -3.39 116.57 114.33 1br0 h LYS 57 Ca -0.06 -0.20 0.00 0.00 -2.18 0.00 0.00 60.65 58.21 1br0 h LYS 57 Cb 1.50 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.15 1br0 h LYS 57 CO 0.15 0.76 0.00 0.72 -1.08 0.00 0.00 179.45 180.00 1br0 n HIS 58 N -4.53 0.76 0.06 -1.35 8.25 -0.05 -2.64 115.22 115.72 1br0 n HIS 58 Ca -0.06 0.30 0.05 0.00 -0.26 0.00 0.00 57.72 57.75 1br0 n HIS 58 Cb 0.36 -0.98 -0.05 0.00 1.12 0.00 0.00 29.99 30.44 1br0 n HIS 58 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1br0 n SER 59 N -2.19 0.86 -0.02 0.41 2.88 -1.26 -2.86 113.62 111.44 1br0 n SER 59 Ca 0.02 0.36 -0.10 0.00 -1.33 0.00 0.00 58.87 57.82 1br0 n SER 59 Cb 0.22 0.28 -0.14 0.00 -0.75 0.00 0.00 64.21 63.82 1br0 n SER 59 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1br0 n ALA 60 N -2.30 1.44 -0.12 -1.46 0.00 -1.23 -4.76 120.51 112.07 1br0 n ALA 60 Ca -0.06 -0.74 -0.16 0.00 0.00 0.00 0.00 53.44 52.48 1br0 n ALA 60 Cb 0.72 -0.84 -0.12 0.00 0.00 0.00 0.00 19.45 19.20 1br0 n ALA 60 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1br0 n ILE 61 N -3.09 1.41 -0.65 0.00 5.41 -1.08 -3.16 119.36 118.21 1br0 n ILE 61 Ca -0.18 -0.58 0.50 0.00 1.00 0.00 0.00 62.75 63.48 1br0 n ILE 61 Cb 1.05 -1.27 0.78 0.00 -0.71 0.00 0.00 39.64 39.49 1br0 n ILE 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1br0 n LEU 62 N -3.16 0.04 -0.43 1.39 -0.00 -1.13 -1.67 117.00 112.04 1br0 n LEU 62 Ca -0.42 1.06 0.06 0.00 -0.00 0.00 0.00 56.01 56.70 1br0 n LEU 62 Cb 0.99 -0.53 0.11 0.00 -0.00 0.00 0.00 43.42 43.99 1br0 n LEU 62 CO 0.27 -1.08 0.40 0.00 -0.00 0.00 0.00 177.39 176.98 1br0 n ALA 63 N -2.82 2.50 -0.23 1.47 0.00 -1.26 -4.27 120.51 115.90 1br0 n ALA 63 Ca 0.43 -2.36 0.00 0.00 0.00 0.00 0.00 53.44 51.51 1br0 n ALA 63 Cb 1.89 -0.44 0.00 0.00 0.00 0.00 0.00 19.45 20.90 1br0 n ALA 63 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1br0 n SER 64 N -0.83 -0.40 0.14 0.00 3.41 -0.67 -4.83 113.62 110.44 1br0 n SER 64 Ca 0.12 -0.27 0.13 0.00 -0.26 0.00 0.00 58.87 58.59 1br0 n SER 64 Cb 0.72 -0.10 0.36 0.00 -0.26 0.00 0.00 64.21 64.93 1br0 n SER 64 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1br0 h PRO 65 N 1.94 0.00 0.00 4.33 0.11 -1.92 -3.44 132.00 133.02 1br0 h PRO 65 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1br0 h PRO 65 Cb 0.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.31 1br0 h PRO 65 CO 0.20 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.08 1br0 n ASN 66 N -2.48 0.00 0.00 -2.05 3.02 -1.26 -5.14 115.26 107.35 1br0 n ASN 66 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 1br0 n ASN 66 Cb 0.44 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 1br0 n ASN 66 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1br0 n PRO 67 N -0.08 0.00 -4.28 3.52 -0.04 -1.26 -5.05 135.00 127.81 1br0 n PRO 67 Ca 0.00 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.27 1br0 n PRO 67 Cb 0.00 -0.33 -0.08 0.00 -0.04 0.00 0.00 33.50 33.04 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 -1.92 1.66 0.00 3.54 2.15 -1.26 -5.08 116.67 115.76 1br0 s ASP 68 Ca 0.00 -1.75 0.00 0.00 0.43 0.00 0.00 52.55 51.23 1br0 s ASP 68 Cb 0.00 0.55 0.00 0.00 -0.30 0.00 0.00 42.92 43.17 1br0 s ASP 68 CO 0.00 -1.06 0.00 -0.62 -0.17 0.00 0.00 175.17 173.32 1br0 n GLU 69 N -0.62 0.00 -3.10 4.34 1.02 -1.26 -4.45 120.64 116.58 1br0 n GLU 69 Ca 0.07 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.76 1br0 n GLU 69 Cb 0.62 -0.10 -0.03 0.00 -0.02 0.00 0.00 31.44 31.91 1br0 n GLU 69 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1br0 s LYS 70 N 0.00 3.43 0.11 3.49 -0.14 -1.26 -4.36 119.74 121.02 1br0 s LYS 70 Ca 0.00 -1.82 -0.01 0.00 -1.36 0.00 0.00 55.97 52.77 1br0 s LYS 70 Cb 0.00 -4.57 -0.16 0.00 -1.68 0.00 0.00 37.83 31.42 1br0 s LYS 70 CO 0.00 -1.56 1.25 1.79 -0.76 0.00 0.00 175.35 176.07 1br0 h THR 71 N 5.54 1.51 0.00 2.17 1.35 -1.99 -2.58 112.91 118.91 1br0 h THR 71 Ca 0.00 -2.87 -0.00 0.00 -0.55 0.00 0.00 66.41 62.99 1br0 h THR 71 Cb 1.05 2.71 -0.00 0.00 -1.73 0.00 0.00 68.15 70.17 1br0 h THR 71 CO 1.00 0.84 -0.02 0.11 -0.25 0.00 0.00 175.52 177.20 1br0 h LYS 72 N 0.10 0.00 -0.99 4.72 1.57 -1.93 -3.19 116.57 116.85 1br0 h LYS 72 Ca -0.09 0.00 0.33 0.00 -1.87 0.00 0.00 60.65 59.02 1br0 h LYS 72 Cb 1.75 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.90 1br0 h LYS 72 CO 0.17 0.02 0.52 0.93 -0.57 0.00 0.00 179.45 180.52 1br0 h GLU 73 N 0.00 0.24 0.00 3.15 4.39 -1.81 -2.01 114.58 118.55 1br0 h GLU 73 Ca -0.00 -0.01 -0.11 0.00 0.34 0.00 0.00 59.36 59.58 1br0 h GLU 73 Cb 0.07 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 1br0 h GLU 73 CO 0.00 0.16 -1.28 0.39 -1.16 0.00 0.00 179.01 177.12 1br0 n GLU 74 N -5.11 0.62 -0.23 2.33 1.02 -1.21 -4.70 120.64 113.36 1br0 n GLU 74 Ca 0.32 0.18 -0.04 0.00 -0.02 0.00 0.00 57.16 57.59 1br0 n GLU 74 Cb 1.00 -1.81 0.12 0.00 -0.02 0.00 0.00 31.44 30.73 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 0.97 -2.74 -4.62 3.38 -1.42 -2.08 115.31 108.81 1br0 h LEU 75 Ca -0.10 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1br0 h LEU 75 Cb 1.37 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 1br0 h LEU 75 CO 0.03 0.89 -0.01 1.05 0.09 0.00 0.00 178.44 180.49 1br0 h GLU 76 N 1.02 0.00 0.10 1.13 4.11 -1.84 -2.87 114.58 116.23 1br0 h GLU 76 Ca 0.23 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.66 1br0 h GLU 76 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1br0 h GLU 76 CO -0.01 0.01 -0.05 1.49 0.07 0.00 0.00 179.01 180.51 1br0 h GLU 77 N 0.00 -0.13 -0.61 1.06 4.81 -1.68 -3.31 114.58 114.72 1br0 h GLU 77 Ca -0.00 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1br0 h GLU 77 Cb 0.04 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 1br0 h GLU 77 CO 0.00 -0.06 0.24 1.37 -0.73 0.00 0.00 179.01 179.83 1br0 h LEU 78 N -1.03 0.81 -0.13 1.64 8.10 -1.47 -0.60 115.31 122.63 1br0 h LEU 78 Ca -0.01 -0.11 -0.15 0.00 0.11 0.00 0.00 57.88 57.72 1br0 h LEU 78 Cb 0.13 -0.21 0.01 0.00 -0.44 0.00 0.00 40.66 40.15 1br0 h LEU 78 CO 0.02 0.73 -0.51 0.24 -4.11 0.00 0.00 178.44 174.81 1br0 h MET 79 N 0.87 0.57 0.00 0.17 2.86 -1.75 -2.84 114.93 114.82 1br0 h MET 79 Ca 0.21 -0.44 -0.06 0.00 -2.06 0.00 0.00 59.70 57.35 1br0 h MET 79 Cb 0.18 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 1br0 h MET 79 CO -0.02 1.07 -0.27 1.03 1.06 0.00 0.00 176.91 179.78 1br0 h SER 80 N 0.21 0.00 -0.22 1.22 0.87 -1.64 -2.85 113.55 111.14 1br0 h SER 80 Ca -0.03 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.48 1br0 h SER 80 Cb 1.14 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.10 1br0 h SER 80 CO 0.11 0.27 -0.07 -0.78 -0.53 0.00 0.00 176.83 175.82 1br0 h ASP 81 N 0.00 0.44 -0.33 6.23 3.58 -1.15 -2.99 116.42 122.20 1br0 h ASP 81 Ca -0.00 -0.38 -0.10 0.00 0.42 0.00 0.00 57.03 56.97 1br0 h ASP 81 Cb 0.61 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.53 1br0 h ASP 81 CO 0.03 0.72 -0.17 0.40 -2.88 0.00 0.00 179.24 177.34 1br0 h ILE 82 N 0.15 1.29 -0.86 2.25 2.04 -1.56 -3.12 117.51 117.70 1br0 h ILE 82 Ca 0.05 -1.29 0.15 0.00 1.00 0.00 0.00 64.86 64.77 1br0 h ILE 82 Cb 0.54 1.42 -0.09 0.00 -0.74 0.00 0.00 36.82 37.94 1br0 h ILE 82 CO 0.02 0.42 0.45 0.50 0.00 0.00 0.00 178.15 179.54 1br0 h LYS 83 N 0.47 0.61 0.01 2.37 3.11 -1.61 -0.05 116.57 121.48 1br0 h LYS 83 Ca 0.07 -0.04 -0.00 0.00 -2.81 0.00 0.00 60.65 57.87 1br0 h LYS 83 Cb 0.71 -0.14 0.00 0.00 -1.00 0.00 0.00 32.23 31.80 1br0 h LYS 83 CO 0.05 0.40 -0.01 0.87 -2.81 0.00 0.00 179.45 177.96 1br0 h LYS 84 N 0.63 -0.01 -0.04 1.90 1.79 -1.51 -2.68 116.57 116.64 1br0 h LYS 84 Ca 0.47 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.93 1br0 h LYS 84 Cb 0.67 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.32 1br0 h LYS 84 CO -0.37 0.44 -0.00 1.15 -1.08 0.00 0.00 179.45 179.60 1br0 h THR 85 N -0.48 1.26 -0.87 -0.16 2.02 -1.59 -2.71 112.91 110.39 1br0 h THR 85 Ca -0.00 -0.80 0.20 0.00 0.77 0.00 0.00 66.41 66.57 1br0 h THR 85 Cb 0.47 1.72 -0.12 0.00 -1.74 0.00 0.00 68.15 68.48 1br0 h THR 85 CO 0.00 0.22 0.38 0.00 0.37 0.00 0.00 175.52 176.49 1br0 h ALA 86 N 0.69 1.34 -0.28 6.16 0.00 -1.11 0.03 119.26 126.09 1br0 h ALA 86 Ca 0.01 0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 1br0 h ALA 86 Cb 0.35 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1br0 h ALA 86 CO 0.00 -0.28 -0.42 -0.97 0.00 0.00 0.00 179.25 177.58 1br0 h ASN 87 N 0.44 0.73 -0.32 0.00 -1.24 -1.56 -0.77 115.58 112.86 1br0 h ASN 87 Ca 0.52 -0.34 0.01 0.00 0.71 0.00 0.00 56.30 57.20 1br0 h ASN 87 Cb 0.92 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 39.75 1br0 h ASN 87 CO -0.48 1.05 0.20 0.11 -1.29 0.00 0.00 177.43 177.02 1br0 h LYS 88 N 0.55 0.40 0.09 6.67 1.57 -0.95 -3.27 116.57 121.64 1br0 h LYS 88 Ca 0.04 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1br0 h LYS 88 Cb 0.96 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.18 1br0 h LYS 88 CO 0.09 0.27 -0.05 -0.24 -0.57 0.00 0.00 179.45 178.95 1br0 h VAL 89 N 0.41 1.11 -0.97 0.50 3.04 -1.11 -3.34 116.25 115.90 1br0 h VAL 89 Ca 0.12 -1.31 0.18 0.00 -1.01 0.00 0.00 66.70 64.68 1br0 h VAL 89 Cb -0.04 1.88 -0.09 0.00 -2.01 0.00 0.00 31.29 31.03 1br0 h VAL 89 CO -0.03 0.29 0.61 0.08 -1.01 0.00 0.00 177.57 177.51 1br0 h ARG 90 N -0.79 0.66 0.00 4.17 0.11 -1.26 -0.58 114.38 116.70 1br0 h ARG 90 Ca -0.01 -0.04 -0.05 0.00 0.10 0.00 0.00 59.98 59.98 1br0 h ARG 90 Cb 0.58 -0.15 -0.01 0.00 1.11 0.00 0.00 29.97 31.50 1br0 h ARG 90 CO 0.02 0.44 -0.22 0.77 0.10 0.00 0.00 179.97 181.08 1br0 h SER 91 N 0.68 0.00 1.39 0.08 0.02 -1.75 -2.17 113.55 111.80 1br0 h SER 91 Ca 0.53 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 61.36 1br0 h SER 91 Cb 0.93 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.45 1br0 h SER 91 CO -0.30 0.22 -0.60 0.11 -1.14 0.00 0.00 176.83 175.12 1br0 h LYS 92 N 0.00 0.00 -0.20 3.45 6.56 -1.23 -3.04 116.57 122.12 1br0 h LYS 92 Ca -0.00 0.00 -0.11 0.00 -1.06 0.00 0.00 60.65 59.47 1br0 h LYS 92 Cb 0.68 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.34 1br0 h LYS 92 CO 0.03 0.60 -0.32 -0.07 -2.06 0.00 0.00 179.45 177.63 1br0 h LEU 93 N 0.00 0.62 -0.35 2.94 3.38 -1.46 -3.18 115.31 117.27 1br0 h LEU 93 Ca -0.01 -0.53 -0.00 0.00 0.09 0.00 0.00 57.88 57.43 1br0 h LEU 93 Cb 1.46 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 1br0 h LEU 93 CO 0.08 1.03 0.21 0.11 0.09 0.00 0.00 178.44 179.97 1br0 h LYS 94 N 0.23 0.47 -0.65 1.13 1.57 -1.51 -2.86 116.57 114.95 1br0 h LYS 94 Ca 0.01 -0.04 0.19 0.00 -1.87 0.00 0.00 60.65 58.94 1br0 h LYS 94 Cb 0.91 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.09 1br0 h LYS 94 CO 0.07 0.34 0.55 0.66 -0.57 0.00 0.00 179.45 180.50 1br0 h SER 95 N 0.45 0.00 0.01 0.86 4.64 -1.61 0.30 113.55 118.21 1br0 h SER 95 Ca 0.13 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.41 1br0 h SER 95 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1br0 h SER 95 CO -0.02 0.00 -0.15 0.40 -0.87 0.00 0.00 176.83 176.19 1br0 h ILE 96 N 0.00 1.61 -0.72 0.95 1.08 -1.51 -2.40 117.51 116.52 1br0 h ILE 96 Ca 0.31 -2.00 -0.03 0.00 -0.39 0.00 0.00 64.86 62.75 1br0 h ILE 96 Cb 1.40 2.93 -0.03 0.00 -3.07 0.00 0.00 36.82 38.04 1br0 h ILE 96 CO -0.00 0.53 0.35 -0.08 -0.69 0.00 0.00 178.15 178.26 1br0 h GLU 97 N -0.67 1.04 -0.77 2.37 4.81 -1.08 -2.54 114.58 117.75 1br0 h GLU 97 Ca -0.02 -0.16 0.01 0.00 -0.13 0.00 0.00 59.36 59.07 1br0 h GLU 97 Cb 0.95 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 30.11 1br0 h GLU 97 CO 0.03 0.82 0.51 1.96 -0.73 0.00 0.00 179.01 181.59 1br0 h GLN 98 N 1.01 1.00 0.00 1.92 4.20 -0.59 -3.10 115.11 119.55 1br0 h GLN 98 Ca 0.25 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.81 1br0 h GLN 98 Cb 0.12 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 1br0 h GLN 98 CO -0.03 0.66 -0.40 1.03 -0.67 0.00 0.00 178.83 179.42 1br0 h SER 99 N 1.03 0.00 0.38 1.46 0.87 -1.37 -2.90 113.55 113.02 1br0 h SER 99 Ca 0.29 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.83 1br0 h SER 99 Cb -0.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.86 1br0 h SER 99 CO -0.07 0.40 -0.18 0.40 -0.53 0.00 0.00 176.83 176.85 1br0 h ILE 100 N 0.00 0.00 -0.37 2.23 2.04 -1.46 -2.81 117.51 117.14 1br0 h ILE 100 Ca -0.00 -0.49 0.11 0.00 1.00 0.00 0.00 64.86 65.47 1br0 h ILE 100 Cb 0.86 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 1br0 h ILE 100 CO 0.05 0.00 0.53 1.05 0.00 0.00 0.00 178.15 179.78 1br0 h GLU 101 N -1.00 0.00 0.13 2.37 4.11 -1.67 -0.59 114.58 117.94 1br0 h GLU 101 Ca -0.05 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 59.07 1br0 h GLU 101 Cb 0.39 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 1br0 h GLU 101 CO 0.08 0.00 -1.50 1.96 0.07 0.00 0.00 179.01 179.62 1br0 h GLN 102 N 0.00 0.27 -0.01 1.06 4.20 -1.59 -3.31 115.11 115.72 1br0 h GLN 102 Ca 0.18 -0.45 0.00 0.00 0.06 0.00 0.00 58.65 58.43 1br0 h GLN 102 Cb 1.24 0.17 0.00 0.00 0.30 0.00 0.00 27.48 29.18 1br0 h GLN 102 CO -0.00 1.14 -0.20 0.39 -0.67 0.00 0.00 178.83 179.49 1br0 n GLU 103 N -3.47 0.98 0.02 1.46 4.71 -0.90 -4.02 120.64 119.42 1br0 n GLU 103 Ca -0.16 -0.56 -0.02 0.00 -0.01 0.00 0.00 57.16 56.41 1br0 n GLU 103 Cb 1.04 -1.49 -0.01 0.00 -1.01 0.00 0.00 31.44 29.98 1br0 n GLU 103 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 1br0 h GLU 104 N 1.37 -0.12 -0.63 3.49 4.81 -1.29 -3.38 114.58 118.83 1br0 h GLU 104 Ca 0.00 0.01 0.18 0.00 -0.13 0.00 0.00 59.36 59.42 1br0 h GLU 104 Cb 0.50 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.88 1br0 h GLU 104 CO 0.00 -0.08 0.91 0.78 -0.73 0.00 0.00 179.01 179.89 1br0 h GLY 105 N -0.74 0.00 1.90 1.92 0.00 -1.76 -2.55 103.07 101.85 1br0 h GLY 105 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1br0 h GLY 105 CO 0.02 0.00 0.03 1.04 0.00 0.00 0.00 176.54 177.63 1br0 n LEU 106 N -3.21 0.28 -2.05 3.11 4.77 -1.26 -4.94 117.00 113.70 1br0 n LEU 106 Ca 0.13 0.61 -0.02 0.00 -0.03 0.00 0.00 56.01 56.71 1br0 n LEU 106 Cb 1.12 -0.64 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1br0 n LEU 106 CO 0.20 -0.71 -0.05 0.59 -1.33 0.00 0.00 177.39 176.08 1br0 n ASN 107 N -1.88 -4.54 -3.82 -1.43 4.13 -0.96 -5.13 115.26 101.63 1br0 n ASN 107 Ca -0.01 0.35 -0.12 0.00 1.68 0.00 0.00 54.58 56.48 1br0 n ASN 107 Cb 0.05 -2.86 -0.10 0.00 -1.54 0.00 0.00 39.78 35.32 1br0 n ASN 107 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1br0 s ARG 108 N -1.36 0.46 -0.25 3.52 0.52 -1.24 -5.12 118.95 115.48 1br0 s ARG 108 Ca 0.07 -0.11 -0.02 0.00 -0.52 0.00 0.00 55.73 55.15 1br0 s ARG 108 Cb -0.02 0.20 0.12 0.00 0.52 0.00 0.00 34.95 35.77 1br0 s ARG 108 CO 0.33 -0.10 0.26 0.45 0.02 0.00 0.00 175.30 176.26 1br0 s SER 109 N -0.88 1.50 0.03 0.23 0.15 -1.26 -4.94 113.70 108.53 1br0 s SER 109 Ca -0.10 -0.45 -0.05 0.00 0.70 0.00 0.00 55.95 56.05 1br0 s SER 109 Cb -0.05 0.47 -0.01 0.00 -1.71 0.00 0.00 66.02 64.71 1br0 s SER 109 CO 0.02 -0.36 0.07 -0.55 1.20 0.00 0.00 173.24 173.63 1br0 s SER 110 N 2.35 0.17 0.30 5.45 0.15 -1.26 -5.08 113.70 115.78 1br0 s SER 110 Ca 0.09 -0.48 0.08 0.00 0.70 0.00 0.00 55.95 56.33 1br0 s SER 110 Cb -0.15 0.20 0.48 0.00 -1.71 0.00 0.00 66.02 64.84 1br0 s SER 110 CO -0.22 -0.44 1.71 0.00 1.20 0.00 0.00 173.24 175.48 1br0 h ALA 111 N 3.95 1.13 -0.96 5.45 0.00 -2.02 -3.27 119.26 123.54 1br0 h ALA 111 Ca -0.32 -0.42 0.02 0.00 0.00 0.00 0.00 54.91 54.18 1br0 h ALA 111 Cb 1.19 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.84 1br0 h ALA 111 CO 0.47 0.59 0.63 -0.44 0.00 0.00 0.00 179.25 180.51 1br0 h ASP 112 N 0.14 1.09 -0.53 0.00 3.32 -1.99 -1.68 116.42 116.77 1br0 h ASP 112 Ca 0.01 -0.02 0.07 0.00 0.02 0.00 0.00 57.03 57.10 1br0 h ASP 112 Cb 0.83 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 40.09 1br0 h ASP 112 CO 0.06 0.78 0.35 0.25 -1.72 0.00 0.00 179.24 178.96 1br0 h LEU 113 N 1.28 0.39 0.08 1.55 5.85 -2.00 -3.14 115.31 119.32 1br0 h LEU 113 Ca 0.36 0.00 -0.34 0.00 0.84 0.00 0.00 57.88 58.74 1br0 h LEU 113 Cb -0.11 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 1br0 h LEU 113 CO -0.09 0.25 -1.93 0.54 -0.34 0.00 0.00 178.44 176.87 1br0 n ARG 114 N -4.47 0.72 -0.27 1.25 1.74 -1.09 -3.66 116.66 110.87 1br0 n ARG 114 Ca 0.07 0.27 0.11 0.00 -0.77 0.00 0.00 57.85 57.53 1br0 n ARG 114 Cb 0.27 -1.73 0.37 0.00 -1.02 0.00 0.00 32.46 30.35 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 0.05 0.85 -0.28 0.55 2.04 -1.38 -2.50 117.51 116.83 1br0 h ILE 115 Ca -0.39 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.19 1br0 h ILE 115 Cb 2.03 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 1br0 h ILE 115 CO 0.08 0.13 0.03 0.03 0.00 0.00 0.00 178.15 178.42 1br0 h ARG 116 N 0.71 0.48 -0.00 2.37 3.08 -1.61 -2.99 114.38 116.42 1br0 h ARG 116 Ca 0.44 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 60.30 1br0 h ARG 116 Cb 0.69 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 1br0 h ARG 116 CO -0.20 0.61 -0.27 0.87 -1.07 0.00 0.00 179.97 179.91 1br0 h LYS 117 N 0.29 0.00 -0.16 0.04 1.57 -1.62 -2.42 116.57 114.27 1br0 h LYS 117 Ca 0.08 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1br0 h LYS 117 Cb 0.38 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 1br0 h LYS 117 CO 0.01 0.27 0.09 1.15 -0.57 0.00 0.00 179.45 180.40 1br0 h THR 118 N 0.00 1.10 -0.24 -0.16 2.02 -1.32 -1.74 112.91 112.56 1br0 h THR 118 Ca -0.00 -0.26 -0.17 0.00 0.77 0.00 0.00 66.41 66.75 1br0 h THR 118 Cb 0.48 0.98 -0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1br0 h THR 118 CO 0.04 0.09 -0.52 1.56 0.37 0.00 0.00 175.52 177.06 1br0 h GLN 119 N 0.17 0.70 -0.39 6.66 4.20 -1.59 -3.21 115.11 121.64 1br0 h GLN 119 Ca 0.06 -0.42 0.00 0.00 0.06 0.00 0.00 58.65 58.34 1br0 h GLN 119 Cb 0.07 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 1br0 h GLN 119 CO -0.01 1.04 0.25 1.25 -0.67 0.00 0.00 178.83 180.69 1br0 h HIS 120 N 0.54 0.50 0.00 2.96 2.76 -1.43 -0.92 115.15 119.56 1br0 h HIS 120 Ca 0.02 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.15 1br0 h HIS 120 Cb 1.08 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 29.87 1br0 h HIS 120 CO 0.05 0.33 -0.21 0.66 -1.30 0.00 0.00 177.93 177.47 1br0 h SER 121 N 0.52 0.00 0.06 3.26 4.64 -1.45 0.65 113.55 121.23 1br0 h SER 121 Ca 0.14 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.31 1br0 h SER 121 Cb -0.03 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.07 1br0 h SER 121 CO -0.03 0.21 -0.62 0.74 -0.87 0.00 0.00 176.83 176.26 1br0 h THR 122 N 0.00 1.50 -0.30 2.95 2.02 -1.55 -3.00 112.91 114.53 1br0 h THR 122 Ca -0.00 -2.28 -0.01 0.00 0.77 0.00 0.00 66.41 64.89 1br0 h THR 122 Cb 0.41 2.92 -0.01 0.00 -1.74 0.00 0.00 68.15 69.73 1br0 h THR 122 CO 0.03 0.65 0.14 -0.07 0.37 0.00 0.00 175.52 176.63 1br0 h LEU 123 N -0.31 0.40 -0.72 2.58 3.38 -1.15 -2.76 115.31 116.73 1br0 h LEU 123 Ca -0.09 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.60 1br0 h LEU 123 Cb 1.40 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 1br0 h LEU 123 CO 0.12 0.43 -0.63 0.77 0.09 0.00 0.00 178.44 179.22 1br0 h SER 124 N 0.35 0.06 -0.38 -0.43 4.64 -1.05 -2.30 113.55 114.43 1br0 h SER 124 Ca 0.10 -0.04 -0.11 0.00 -0.47 0.00 0.00 61.79 61.27 1br0 h SER 124 Cb 0.14 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 1br0 h SER 124 CO -0.01 0.67 -0.20 -0.09 -0.87 0.00 0.00 176.83 176.33 1br0 h ARG 125 N 0.04 0.81 -0.26 4.77 9.65 -1.59 -0.56 114.38 127.25 1br0 h ARG 125 Ca -0.01 -0.36 -0.15 0.00 -1.10 0.00 0.00 59.98 58.36 1br0 h ARG 125 Cb 1.12 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.67 1br0 h ARG 125 CO 0.09 0.99 -0.45 -0.22 2.80 0.00 0.00 179.97 183.17 1br0 h LYS 126 N 0.62 0.66 -0.57 0.20 3.64 -1.58 -2.97 116.57 116.57 1br0 h LYS 126 Ca 0.08 -0.37 -0.06 0.00 -1.27 0.00 0.00 60.65 59.04 1br0 h LYS 126 Cb 0.76 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.57 1br0 h LYS 126 CO 0.06 0.98 0.13 0.35 -2.27 0.00 0.00 179.45 178.69 1br0 h PHE 127 N 0.53 0.91 -0.25 1.91 3.57 -1.46 -3.26 116.94 118.88 1br0 h PHE 127 Ca 0.03 -0.09 -0.12 0.00 3.53 0.00 0.00 57.97 61.32 1br0 h PHE 127 Cb 0.99 -0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.47 1br0 h PHE 127 CO 0.05 0.77 -0.30 -0.24 -2.23 0.00 0.00 178.31 176.36 1br0 h VAL 128 N 0.85 1.31 -0.86 1.41 3.04 -1.16 -0.39 116.25 120.44 1br0 h VAL 128 Ca 0.18 -1.48 0.22 0.00 -1.01 0.00 0.00 66.70 64.61 1br0 h VAL 128 Cb 0.32 1.68 -0.05 0.00 -2.01 0.00 0.00 31.29 31.23 1br0 h VAL 128 CO 0.00 0.47 0.59 -0.33 -1.01 0.00 0.00 177.57 177.29 1br0 h GLU 129 N 0.36 0.23 0.00 4.17 5.08 -1.60 -0.70 114.58 122.13 1br0 h GLU 129 Ca 0.03 -0.01 -0.30 0.00 -1.00 0.00 0.00 59.36 58.08 1br0 h GLU 129 Cb 0.87 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.03 1br0 h GLU 129 CO 0.07 0.15 -1.81 1.55 -1.00 0.00 0.00 179.01 177.98 1br0 n VAL 130 N -4.42 1.52 -0.16 3.13 3.14 -1.23 -4.06 118.33 116.25 1br0 n VAL 130 Ca 0.18 -0.16 -0.09 0.00 -2.96 0.00 0.00 64.34 61.31 1br0 n VAL 130 Cb 0.77 -2.04 0.00 0.00 -1.06 0.00 0.00 33.84 31.52 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 0.74 0.00 1.45 -1.53 -1.11 0.89 114.93 114.37 1br0 h MET 131 Ca -0.45 -0.16 -0.03 0.00 -3.44 0.00 0.00 59.70 55.62 1br0 h MET 131 Cb 1.35 -0.10 -0.00 0.00 -0.55 0.00 0.00 31.60 32.29 1br0 h MET 131 CO -0.27 0.71 -0.16 1.03 0.14 0.00 0.00 176.91 178.35 1br0 h SER 132 N 0.63 0.00 -0.15 1.39 0.87 -1.31 -1.67 113.55 113.30 1br0 h SER 132 Ca 0.15 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.54 1br0 h SER 132 Cb 0.28 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.25 1br0 h SER 132 CO -0.00 0.16 -0.57 -0.08 -0.53 0.00 0.00 176.83 175.80 1br0 h GLU 133 N 0.00 0.65 -0.51 2.24 4.22 -1.63 -3.25 114.58 116.30 1br0 h GLU 133 Ca -0.00 -0.50 -0.02 0.00 0.08 0.00 0.00 59.36 58.92 1br0 h GLU 133 Cb 0.34 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 1br0 h GLU 133 CO 0.02 1.12 0.25 -0.92 -2.18 0.00 0.00 179.01 177.30 1br0 h TYR 134 N 0.33 0.71 -0.88 0.92 3.20 -0.68 -2.02 116.97 118.54 1br0 h TYR 134 Ca -0.03 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.87 1br0 h TYR 134 Cb 1.20 -0.23 -0.06 0.00 1.54 0.00 0.00 36.73 39.19 1br0 h TYR 134 CO 0.10 0.52 0.56 -0.97 -1.64 0.00 0.00 178.16 176.73 1br0 h ASN 135 N 0.72 0.90 1.24 -2.11 -1.24 -1.40 -2.66 115.58 111.03 1br0 h ASN 135 Ca 0.18 0.01 -0.04 0.00 0.71 0.00 0.00 56.30 57.16 1br0 h ASN 135 Cb 0.08 -0.19 -0.01 0.00 0.73 0.00 0.00 38.32 38.94 1br0 h ASN 135 CO -0.02 0.59 -0.17 0.00 -1.29 0.00 0.00 177.43 176.54 1br0 h ALA 136 N 1.39 0.96 -0.23 1.57 0.00 -1.55 -3.36 119.26 118.04 1br0 h ALA 136 Ca 0.37 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1br0 h ALA 136 Cb 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1br0 h ALA 136 CO -0.15 0.21 -0.02 1.15 0.00 0.00 0.00 179.25 180.43 1br0 h THR 137 N 0.00 1.27 -0.33 0.00 2.02 -1.00 -0.60 112.91 114.26 1br0 h THR 137 Ca -0.00 -0.97 -0.05 0.00 0.77 0.00 0.00 66.41 66.17 1br0 h THR 137 Cb 0.84 1.44 -0.01 0.00 -1.74 0.00 0.00 68.15 68.67 1br0 h THR 137 CO 0.02 0.30 0.03 -0.61 0.37 0.00 0.00 175.52 175.63 1br0 h GLN 138 N 0.18 0.56 -0.53 6.66 4.15 -1.71 -2.60 115.11 121.82 1br0 h GLN 138 Ca 0.06 -0.16 -0.11 0.00 0.77 0.00 0.00 58.65 59.21 1br0 h GLN 138 Cb 0.46 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.07 1br0 h GLN 138 CO 0.02 0.67 -0.10 0.77 -1.93 0.00 0.00 178.83 178.26 1br0 h SER 139 N 0.38 0.98 0.25 -0.69 0.02 -1.71 -3.12 113.55 109.68 1br0 h SER 139 Ca 0.10 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 1br0 h SER 139 Cb 0.39 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.67 1br0 h SER 139 CO 0.01 1.09 0.00 0.44 -1.14 0.00 0.00 176.83 177.23 1br0 h ASP 140 N 0.88 0.00 0.30 3.07 3.32 -1.13 0.20 116.42 123.07 1br0 h ASP 140 Ca 0.14 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.10 1br0 h ASP 140 Cb 0.65 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 1br0 h ASP 140 CO 0.05 0.00 -0.37 0.22 -1.72 0.00 0.00 179.24 177.41 1br0 h TYR 141 N 0.00 0.12 0.00 4.55 3.20 -1.39 -3.41 116.97 120.04 1br0 h TYR 141 Ca 0.00 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.84 1br0 h TYR 141 Cb 0.13 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.37 1br0 h TYR 141 CO 0.00 0.47 0.00 2.89 -1.64 0.00 0.00 178.16 179.88 1br0 n ARG 142 N -4.07 -0.02 -0.01 1.82 1.85 -1.09 -3.93 116.66 111.20 1br0 n ARG 142 Ca -0.02 -0.14 -0.11 0.00 -1.00 0.00 0.00 57.85 56.58 1br0 n ARG 142 Cb 0.43 -0.54 -0.09 0.00 -1.05 0.00 0.00 32.46 31.21 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 -0.08 0.00 2.89 4.11 -1.19 -3.38 114.58 116.92 1br0 h GLU 143 Ca 0.00 0.01 -0.10 0.00 0.07 0.00 0.00 59.36 59.33 1br0 h GLU 143 Cb 0.56 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 1br0 h GLU 143 CO 0.00 0.48 -0.62 0.07 0.07 0.00 0.00 179.01 179.02 1br0 h ARG 144 N -0.89 0.00 -5.57 1.06 0.11 -1.81 -3.48 114.38 103.79 1br0 h ARG 144 Ca -0.01 0.00 -0.27 0.00 0.10 0.00 0.00 59.98 59.80 1br0 h ARG 144 Cb 0.61 0.00 -0.12 0.00 1.11 0.00 0.00 29.97 31.57 1br0 h ARG 144 CO 0.01 0.77 -0.39 0.43 0.10 0.00 0.00 179.97 180.89 1br0 n SER 145 N -4.55 -2.06 0.00 0.08 7.64 -1.25 -5.06 113.62 108.42 1br0 n SER 145 Ca -0.18 -0.18 0.00 0.00 1.01 0.00 0.00 58.87 59.52 1br0 n SER 145 Cb 0.49 -1.81 0.00 0.00 -1.01 0.00 0.00 64.21 61.88 1br0 n SER 145 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32