#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 0.31 0.19 -1.24 3.08 -2.06 -2.66 114.38 112.00 1br0 h ARG 28 Ca 0.00 -0.09 -0.31 0.00 0.07 0.00 0.00 59.98 59.65 1br0 h ARG 28 Cb 0.00 -0.03 0.02 0.00 0.08 0.00 0.00 29.97 30.04 1br0 h ARG 28 CO 0.00 0.50 -1.42 0.74 -1.07 0.00 0.00 179.97 178.72 1br0 h PHE 29 N 0.08 0.72 -0.37 3.04 0.04 -2.06 -2.86 116.94 115.52 1br0 h PHE 29 Ca 0.05 -0.52 -0.14 0.00 2.80 0.00 0.00 57.97 60.15 1br0 h PHE 29 Cb 0.35 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.46 1br0 h PHE 29 CO 0.03 1.44 -0.34 0.52 -0.60 0.00 0.00 178.31 179.36 1br0 h MET 30 N 0.11 0.85 -0.78 1.51 2.86 -2.00 -2.20 114.93 115.27 1br0 h MET 30 Ca -0.22 -0.41 0.01 0.00 -2.06 0.00 0.00 59.70 57.02 1br0 h MET 30 Cb 2.07 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 33.69 1br0 h MET 30 CO 0.23 1.05 0.51 -0.44 1.06 0.00 0.00 176.91 179.32 1br0 h ASP 31 N 0.71 0.90 0.20 1.22 3.32 -1.59 -2.60 116.42 118.58 1br0 h ASP 31 Ca 0.07 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.03 1br0 h ASP 31 Cb 0.90 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 1br0 h ASP 31 CO 0.08 0.65 -0.24 -0.33 -1.72 0.00 0.00 179.24 177.69 1br0 h GLU 32 N 1.05 0.08 -0.30 3.56 5.08 -1.55 -2.81 114.58 119.70 1br0 h GLU 32 Ca 0.28 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.62 1br0 h GLU 32 Cb -0.11 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1br0 h GLU 32 CO -0.06 0.31 0.16 0.35 -1.00 0.00 0.00 179.01 178.77 1br0 h PHE 33 N 0.07 0.41 -0.28 4.33 3.04 -1.11 -2.68 116.94 120.73 1br0 h PHE 33 Ca 0.01 -0.01 -0.15 0.00 3.98 0.00 0.00 57.97 61.80 1br0 h PHE 33 Cb 0.46 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.83 1br0 h PHE 33 CO 0.00 0.34 -0.44 0.74 -2.02 0.00 0.00 178.31 176.93 1br0 h PHE 34 N 0.36 0.85 -0.79 0.41 0.04 -1.48 -3.28 116.94 113.05 1br0 h PHE 34 Ca 0.10 -0.26 0.02 0.00 2.80 0.00 0.00 57.97 60.63 1br0 h PHE 34 Cb 0.06 -0.17 -0.04 0.00 2.20 0.00 0.00 35.95 38.00 1br0 h PHE 34 CO -0.03 1.01 0.51 0.93 -0.60 0.00 0.00 178.31 180.14 1br0 h GLU 35 N 0.57 1.00 0.00 1.51 5.08 -1.57 -3.23 114.58 117.93 1br0 h GLU 35 Ca 0.04 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1br0 h GLU 35 Cb 0.98 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 1br0 h GLU 35 CO 0.09 0.66 -0.27 -0.56 -1.00 0.00 0.00 179.01 177.93 1br0 h GLN 36 N 1.03 0.00 -0.26 2.33 3.07 -1.56 -3.32 115.11 116.39 1br0 h GLN 36 Ca 0.30 0.00 0.01 0.00 0.09 0.00 0.00 58.65 59.05 1br0 h GLN 36 Cb -0.06 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.48 1br0 h GLN 36 CO -0.09 0.27 0.16 0.28 0.09 0.00 0.00 178.83 179.54 1br0 h VAL 37 N 0.00 1.04 -0.33 1.86 2.07 -1.61 -2.65 116.25 116.63 1br0 h VAL 37 Ca -0.00 -0.11 0.10 0.00 0.82 0.00 0.00 66.70 67.50 1br0 h VAL 37 Cb 0.57 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1br0 h VAL 37 CO 0.03 0.06 0.24 -0.33 0.02 0.00 0.00 177.57 177.59 1br0 h GLU 38 N 0.33 0.00 0.01 1.57 4.39 -1.71 -0.12 114.58 119.06 1br0 h GLU 38 Ca 0.10 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.60 1br0 h GLU 38 Cb -0.02 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 1br0 h GLU 38 CO -0.04 0.00 -0.92 1.05 -1.16 0.00 0.00 179.01 177.94 1br0 h GLU 39 N 0.00 0.08 0.80 2.33 4.11 -1.70 -2.76 114.58 117.45 1br0 h GLU 39 Ca 0.16 -0.10 -0.04 0.00 0.07 0.00 0.00 59.36 59.44 1br0 h GLU 39 Cb 0.63 0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.92 1br0 h GLU 39 CO -0.00 0.94 -0.38 0.82 0.07 0.00 0.00 179.01 180.46 1br0 h ILE 40 N 0.04 0.00 -1.29 -1.06 2.04 -1.01 -2.86 117.51 113.37 1br0 h ILE 40 Ca -0.03 -0.13 0.38 0.00 1.00 0.00 0.00 64.86 66.09 1br0 h ILE 40 Cb 1.60 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 37.59 1br0 h ILE 40 CO 0.13 0.00 0.87 0.03 0.00 0.00 0.00 178.15 179.18 1br0 h ARG 41 N -1.20 0.14 0.05 2.37 3.08 -1.18 -0.28 114.38 117.35 1br0 h ARG 41 Ca -0.11 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 1br0 h ARG 41 Cb 0.82 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.84 1br0 h ARG 41 CO 0.18 0.09 -0.02 0.78 -1.07 0.00 0.00 179.97 179.93 1br0 h GLY 42 N 0.14 -0.07 1.15 0.04 0.00 -1.44 -2.49 103.07 100.39 1br0 h GLY 42 Ca 0.71 0.03 -0.03 0.00 0.00 0.00 0.00 47.33 48.03 1br0 h GLY 42 CO -0.23 -0.03 0.36 0.74 0.00 0.00 0.00 176.54 177.38 1br0 h PHE 43 N -0.13 1.10 -0.24 5.60 0.04 -0.93 -2.87 116.94 119.52 1br0 h PHE 43 Ca -0.01 -0.05 0.03 0.00 2.80 0.00 0.00 57.97 60.74 1br0 h PHE 43 Cb 0.12 -0.34 -0.03 0.00 2.20 0.00 0.00 35.95 37.89 1br0 h PHE 43 CO -0.05 0.80 0.05 0.82 -0.60 0.00 0.00 178.31 179.33 1br0 h ILE 44 N 1.09 0.89 -0.60 -0.55 1.08 -1.10 -1.10 117.51 117.22 1br0 h ILE 44 Ca 0.26 -0.05 0.04 0.00 -0.39 0.00 0.00 64.86 64.73 1br0 h ILE 44 Cb 0.12 0.74 -0.05 0.00 -3.07 0.00 0.00 36.82 34.57 1br0 h ILE 44 CO -0.03 0.03 0.35 -0.78 -0.69 0.00 0.00 178.15 177.02 1br0 h ASP 45 N 0.14 0.53 -0.01 1.72 3.58 -1.49 -2.66 116.42 118.23 1br0 h ASP 45 Ca 0.11 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.58 1br0 h ASP 45 Cb 0.10 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.06 1br0 h ASP 45 CO -0.14 0.36 0.01 0.50 -2.88 0.00 0.00 179.24 177.09 1br0 h LYS 46 N 0.66 0.00 0.21 0.28 1.63 -1.24 -0.78 116.57 117.33 1br0 h LYS 46 Ca 0.26 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 60.05 1br0 h LYS 46 Cb 0.10 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.74 1br0 h LYS 46 CO -0.14 0.00 -0.10 0.82 -3.45 0.00 0.00 179.45 176.58 1br0 h ILE 47 N 0.00 0.00 -0.45 2.00 1.08 -0.99 -2.93 117.51 116.22 1br0 h ILE 47 Ca 0.01 -0.40 0.13 0.00 -0.39 0.00 0.00 64.86 64.21 1br0 h ILE 47 Cb 0.03 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 33.77 1br0 h ILE 47 CO -0.00 0.00 0.42 0.00 -0.69 0.00 0.00 178.15 177.88 1br0 h ALA 48 N -1.48 2.24 -0.05 1.87 0.00 -1.43 0.24 119.26 120.65 1br0 h ALA 48 Ca -0.03 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1br0 h ALA 48 Cb 0.21 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1br0 h ALA 48 CO 0.05 -0.65 -0.16 0.93 0.00 0.00 0.00 179.25 179.42 1br0 h GLU 49 N 0.00 0.20 -0.36 0.00 5.08 -1.28 -2.83 114.58 115.39 1br0 h GLU 49 Ca 0.22 -0.15 -0.12 0.00 -1.00 0.00 0.00 59.36 58.31 1br0 h GLU 49 Cb 1.04 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 1br0 h GLU 49 CO -0.00 0.76 -0.24 -0.97 -1.00 0.00 0.00 179.01 177.57 1br0 h ASN 50 N -0.33 0.83 -0.29 1.42 -0.73 -1.17 -2.84 115.58 112.47 1br0 h ASN 50 Ca -0.00 -0.43 -0.00 0.00 1.87 0.00 0.00 56.30 57.73 1br0 h ASN 50 Cb 0.78 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 39.12 1br0 h ASN 50 CO 0.03 1.08 0.18 0.58 -0.37 0.00 0.00 177.43 178.93 1br0 h VAL 51 N 0.58 1.10 -0.47 2.57 2.07 -1.12 -0.63 116.25 120.35 1br0 h VAL 51 Ca 0.07 -0.22 0.02 0.00 0.82 0.00 0.00 66.70 67.39 1br0 h VAL 51 Cb 0.80 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1br0 h VAL 51 CO 0.06 0.10 0.31 1.05 0.02 0.00 0.00 177.57 179.11 1br0 h GLU 52 N 0.37 0.56 -0.15 1.57 4.11 -1.59 -2.66 114.58 116.80 1br0 h GLU 52 Ca 0.10 -0.03 -0.02 0.00 0.07 0.00 0.00 59.36 59.48 1br0 h GLU 52 Cb 0.00 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1br0 h GLU 52 CO -0.02 0.37 0.03 1.49 0.07 0.00 0.00 179.01 180.95 1br0 h GLU 53 N 0.58 0.25 -0.71 1.06 4.81 -1.17 -3.14 114.58 116.26 1br0 h GLU 53 Ca 0.18 -0.06 0.15 0.00 -0.13 0.00 0.00 59.36 59.50 1br0 h GLU 53 Cb 0.03 -0.03 -0.13 0.00 0.63 0.00 0.00 28.75 29.25 1br0 h GLU 53 CO -0.04 0.42 -0.08 0.28 -0.73 0.00 0.00 179.01 178.86 1br0 h VAL 54 N 0.04 0.34 0.00 0.32 2.07 -1.02 -2.34 116.25 115.66 1br0 h VAL 54 Ca 0.05 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 1br0 h VAL 54 Cb 0.29 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1br0 h VAL 54 CO 0.00 0.01 -0.13 0.50 0.02 0.00 0.00 177.57 177.97 1br0 h LYS 55 N 0.05 0.00 0.06 1.57 3.64 -1.49 0.44 116.57 120.85 1br0 h LYS 55 Ca 0.37 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 59.51 1br0 h LYS 55 Cb 0.61 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1br0 h LYS 55 CO -0.67 0.13 -1.07 0.07 -2.27 0.00 0.00 179.45 175.64 1br0 h ARG 56 N 0.00 0.27 -0.09 1.90 0.11 -1.40 -3.39 114.38 111.77 1br0 h ARG 56 Ca -0.00 -0.37 -0.17 0.00 0.10 0.00 0.00 59.98 59.54 1br0 h ARG 56 Cb 0.24 0.12 0.01 0.00 1.11 0.00 0.00 29.97 31.45 1br0 h ARG 56 CO 0.02 1.11 -0.60 0.87 0.10 0.00 0.00 179.97 181.47 1br0 h LYS 57 N 0.11 0.57 -0.68 0.08 1.79 -1.06 -3.41 116.57 113.97 1br0 h LYS 57 Ca -0.09 -0.49 -0.01 0.00 -2.18 0.00 0.00 60.65 57.88 1br0 h LYS 57 Cb 1.75 0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 32.48 1br0 h LYS 57 CO 0.17 1.12 0.37 0.45 -1.08 0.00 0.00 179.45 180.48 1br0 h HIS 58 N 0.19 0.92 0.00 -1.35 3.86 -1.11 -3.09 115.15 114.57 1br0 h HIS 58 Ca -0.05 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 1br0 h HIS 58 Cb 1.25 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 29.43 1br0 h HIS 58 CO 0.11 0.64 -0.85 0.77 0.86 0.00 0.00 177.93 179.46 1br0 h SER 59 N 0.95 0.00 0.93 2.45 0.02 -1.81 -1.08 113.55 115.01 1br0 h SER 59 Ca 0.24 -0.15 -0.08 0.00 -0.84 0.00 0.00 61.79 60.96 1br0 h SER 59 Cb 0.03 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 1br0 h SER 59 CO -0.04 0.07 -1.12 0.00 -1.14 0.00 0.00 176.83 174.60 1br0 h ALA 60 N 2.29 0.60 0.00 3.77 0.00 -1.80 -3.43 119.26 120.69 1br0 h ALA 60 Ca 0.00 -0.42 -0.20 0.00 0.00 0.00 0.00 54.91 54.29 1br0 h ALA 60 Cb 0.85 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.73 1br0 h ALA 60 CO 0.00 0.47 -1.75 -0.89 0.00 0.00 0.00 179.25 177.08 1br0 n ILE 61 N -2.83 0.75 -0.18 0.00 5.41 -1.17 -3.85 119.36 117.50 1br0 n ILE 61 Ca -0.04 -0.40 0.27 0.00 1.00 0.00 0.00 62.75 63.58 1br0 n ILE 61 Cb 0.70 -0.81 0.49 0.00 -0.71 0.00 0.00 39.64 39.31 1br0 n ILE 61 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 176.55 176.72 1br0 h LEU 62 N 0.00 0.00 -5.35 1.39 8.10 -1.44 -2.88 115.31 115.13 1br0 h LEU 62 Ca -0.29 0.00 -0.23 0.00 0.11 0.00 0.00 57.88 57.47 1br0 h LEU 62 Cb 1.59 0.00 -0.36 0.00 -0.44 0.00 0.00 40.66 41.46 1br0 h LEU 62 CO -0.01 0.00 -0.97 0.00 -4.11 0.00 0.00 178.44 173.36 1br0 n ALA 63 N -2.26 2.64 -0.18 0.17 0.00 -1.26 -4.74 120.51 114.87 1br0 n ALA 63 Ca 0.21 -2.44 0.00 0.00 0.00 0.00 0.00 53.44 51.22 1br0 n ALA 63 Cb 1.41 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1br0 n ALA 63 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1br0 n SER 64 N -0.77 -0.27 0.00 0.00 7.64 -1.09 -4.81 113.62 114.32 1br0 n SER 64 Ca 0.03 -0.17 0.10 0.00 1.01 0.00 0.00 58.87 59.83 1br0 n SER 64 Cb 0.81 -0.05 0.44 0.00 -1.01 0.00 0.00 64.21 64.40 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 0.72 0.04 0.03 1.43 -0.05 -1.25 -4.40 135.00 131.51 1br0 n PRO 65 Ca 0.00 0.15 0.00 0.00 -0.05 0.00 0.00 63.50 63.60 1br0 n PRO 65 Cb 0.07 -1.50 0.00 0.00 -0.05 0.00 0.00 33.50 32.02 1br0 n PRO 65 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 175.50 173.74 1br0 n ASN 66 N -1.47 -0.00 -2.75 3.54 2.85 -1.26 -5.16 115.26 111.00 1br0 n ASN 66 Ca 0.05 0.10 0.00 0.00 -0.11 0.00 0.00 54.58 54.63 1br0 n ASN 66 Cb 0.23 0.07 0.00 0.00 1.24 0.00 0.00 39.78 41.32 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 -2.78 -0.76 -2.09 1.20 -0.04 -1.26 -5.13 135.00 124.14 1br0 n PRO 67 Ca 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.43 1br0 n PRO 67 Cb 0.05 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.51 1br0 n PRO 67 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1br0 n ASP 68 N -2.46 -0.37 0.11 3.54 2.03 -1.26 -4.84 116.55 113.30 1br0 n ASP 68 Ca 0.00 -1.45 0.20 0.00 0.52 0.00 0.00 54.79 54.05 1br0 n ASP 68 Cb 0.00 0.67 0.76 0.00 -0.72 0.00 0.00 41.12 41.82 1br0 n ASP 68 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1br0 h GLU 69 N 0.00 0.00 -0.98 -0.67 4.39 -2.01 -2.85 114.58 112.46 1br0 h GLU 69 Ca -0.07 0.00 0.21 0.00 0.34 0.00 0.00 59.36 59.84 1br0 h GLU 69 Cb 0.29 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 28.85 1br0 h GLU 69 CO 0.09 0.00 0.62 -0.22 -1.16 0.00 0.00 179.01 178.34 1br0 h LYS 70 N 0.00 0.56 -0.08 2.33 3.11 -2.02 -2.66 116.57 117.82 1br0 h LYS 70 Ca 0.18 -0.03 -0.12 0.00 -2.81 0.00 0.00 60.65 57.87 1br0 h LYS 70 Cb 1.00 -0.13 0.01 0.00 -1.00 0.00 0.00 32.23 32.11 1br0 h LYS 70 CO -0.00 0.37 -0.40 1.79 -2.81 0.00 0.00 179.45 178.40 1br0 h THR 71 N 0.58 1.40 -0.18 1.00 1.35 -1.92 -3.39 112.91 111.76 1br0 h THR 71 Ca 0.55 -1.79 -0.19 0.00 -0.55 0.00 0.00 66.41 64.43 1br0 h THR 71 Cb 1.11 2.29 0.00 0.00 -1.73 0.00 0.00 68.15 69.82 1br0 h THR 71 CO -0.30 0.52 -0.64 0.11 -0.25 0.00 0.00 175.52 174.96 1br0 h LYS 72 N -0.05 0.67 -0.83 4.72 1.57 -1.59 -2.79 116.57 118.26 1br0 h LYS 72 Ca -0.03 -0.48 0.13 0.00 -1.87 0.00 0.00 60.65 58.40 1br0 h LYS 72 Cb 1.06 0.08 -0.06 0.00 0.08 0.00 0.00 32.23 33.38 1br0 h LYS 72 CO 0.08 1.10 0.54 1.05 -0.57 0.00 0.00 179.45 181.65 1br0 h GLU 73 N 0.49 0.63 0.00 3.15 4.11 -1.72 -2.14 114.58 119.10 1br0 h GLU 73 Ca -0.01 -0.04 -0.09 0.00 0.07 0.00 0.00 59.36 59.29 1br0 h GLU 73 Cb 1.23 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 1br0 h GLU 73 CO 0.13 0.42 -0.42 1.49 0.07 0.00 0.00 179.01 180.69 1br0 h GLU 74 N 0.65 0.00 -0.25 1.06 4.81 -1.72 -3.36 114.58 115.77 1br0 h GLU 74 Ca 0.41 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.63 1br0 h GLU 74 Cb 0.66 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 1br0 h GLU 74 CO -0.17 0.42 0.13 -0.07 -0.73 0.00 0.00 179.01 178.59 1br0 h LEU 75 N 0.00 0.30 -1.83 1.64 3.38 -1.11 -1.87 115.31 115.83 1br0 h LEU 75 Ca -0.00 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1br0 h LEU 75 Cb 1.11 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 1br0 h LEU 75 CO 0.06 0.26 -0.08 -0.33 0.09 0.00 0.00 178.44 178.43 1br0 h GLU 76 N 0.35 0.00 0.06 1.13 4.39 -1.70 -2.36 114.58 116.45 1br0 h GLU 76 Ca 0.09 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.79 1br0 h GLU 76 Cb 0.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 1br0 h GLU 76 CO -0.01 0.08 -0.03 1.49 -1.16 0.00 0.00 179.01 179.38 1br0 h GLU 77 N 0.00 -0.08 -0.38 2.33 4.81 -1.54 -2.97 114.58 116.76 1br0 h GLU 77 Ca -0.00 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.15 1br0 h GLU 77 Cb 0.40 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 1br0 h GLU 77 CO 0.01 0.53 -0.13 1.37 -0.73 0.00 0.00 179.01 180.06 1br0 h LEU 78 N -0.86 0.66 -0.30 1.64 8.10 -1.54 -0.57 115.31 122.43 1br0 h LEU 78 Ca -0.01 -0.20 -0.05 0.00 0.11 0.00 0.00 57.88 57.73 1br0 h LEU 78 Cb 0.64 -0.18 -0.01 0.00 -0.44 0.00 0.00 40.66 40.67 1br0 h LEU 78 CO 0.01 0.82 -0.02 0.24 -4.11 0.00 0.00 178.44 175.39 1br0 h MET 79 N 0.61 0.55 0.00 0.17 2.86 -1.61 -2.83 114.93 114.67 1br0 h MET 79 Ca 0.10 -0.18 -0.03 0.00 -2.06 0.00 0.00 59.70 57.54 1br0 h MET 79 Cb 0.58 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.19 1br0 h MET 79 CO 0.04 0.70 -0.13 1.03 1.06 0.00 0.00 176.91 179.61 1br0 h SER 80 N 0.33 0.00 -0.27 1.22 0.87 -1.53 -2.73 113.55 111.44 1br0 h SER 80 Ca 0.08 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.50 1br0 h SER 80 Cb 0.46 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.42 1br0 h SER 80 CO 0.02 0.13 -0.38 -0.78 -0.53 0.00 0.00 176.83 175.29 1br0 h ASP 81 N 0.00 0.81 -0.19 6.23 1.82 -1.02 -1.42 116.42 122.65 1br0 h ASP 81 Ca -0.00 -0.50 -0.20 0.00 -0.39 0.00 0.00 57.03 55.94 1br0 h ASP 81 Cb 0.37 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 40.16 1br0 h ASP 81 CO 0.02 1.15 -0.63 0.40 -1.61 0.00 0.00 179.24 178.57 1br0 h ILE 82 N 0.48 1.28 -0.47 2.25 2.04 -1.53 -2.10 117.51 119.46 1br0 h ILE 82 Ca 0.03 -1.83 0.04 0.00 1.00 0.00 0.00 64.86 64.09 1br0 h ILE 82 Cb 0.97 1.77 -0.04 0.00 -0.74 0.00 0.00 36.82 38.78 1br0 h ILE 82 CO 0.09 0.59 0.25 0.50 0.00 0.00 0.00 178.15 179.57 1br0 h LYS 83 N 0.59 0.47 -0.11 2.37 3.11 -1.57 -0.17 116.57 121.27 1br0 h LYS 83 Ca -0.01 -0.03 -0.05 0.00 -2.81 0.00 0.00 60.65 57.76 1br0 h LYS 83 Cb 1.24 -0.11 -0.00 0.00 -1.00 0.00 0.00 32.23 32.36 1br0 h LYS 83 CO 0.13 0.31 -0.11 0.87 -2.81 0.00 0.00 179.45 177.85 1br0 h LYS 84 N 0.49 0.27 -0.02 1.90 1.79 -1.32 -2.53 116.57 117.13 1br0 h LYS 84 Ca 0.20 -0.14 -0.01 0.00 -2.18 0.00 0.00 60.65 58.53 1br0 h LYS 84 Cb 0.10 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.75 1br0 h LYS 84 CO -0.13 0.68 -0.01 1.15 -1.08 0.00 0.00 179.45 180.06 1br0 h THR 85 N -0.13 1.29 -0.99 -0.16 2.02 -1.45 -2.73 112.91 110.75 1br0 h THR 85 Ca 0.02 -0.88 0.12 0.00 0.77 0.00 0.00 66.41 66.44 1br0 h THR 85 Cb 0.63 1.84 -0.08 0.00 -1.74 0.00 0.00 68.15 68.79 1br0 h THR 85 CO 0.03 0.23 0.62 0.00 0.37 0.00 0.00 175.52 176.77 1br0 h ALA 86 N 0.65 1.49 -0.23 6.16 0.00 -1.17 -2.84 119.26 123.32 1br0 h ALA 86 Ca 0.01 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1br0 h ALA 86 Cb 0.38 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1br0 h ALA 86 CO 0.00 0.22 -0.30 -0.97 0.00 0.00 0.00 179.25 178.20 1br0 h ASN 87 N 0.98 0.47 -0.59 0.00 -0.73 -1.47 0.15 115.58 114.39 1br0 h ASN 87 Ca 0.49 -0.17 -0.03 0.00 1.87 0.00 0.00 56.30 58.46 1br0 h ASN 87 Cb 0.48 -0.13 -0.03 0.00 0.27 0.00 0.00 38.32 38.92 1br0 h ASN 87 CO -0.27 0.75 0.25 0.50 -0.37 0.00 0.00 177.43 178.29 1br0 h LYS 88 N 0.40 0.88 0.01 6.67 3.64 -1.32 -3.27 116.57 123.58 1br0 h LYS 88 Ca 0.05 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1br0 h LYS 88 Cb 0.73 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1br0 h LYS 88 CO 0.06 0.74 -0.01 -0.24 -2.27 0.00 0.00 179.45 177.73 1br0 h VAL 89 N 0.82 1.07 -0.67 2.00 3.04 -1.51 -3.32 116.25 117.68 1br0 h VAL 89 Ca 0.20 -1.76 0.05 0.00 -1.01 0.00 0.00 66.70 64.18 1br0 h VAL 89 Cb 0.19 2.01 -0.05 0.00 -2.01 0.00 0.00 31.29 31.42 1br0 h VAL 89 CO -0.02 0.36 0.39 0.08 -1.01 0.00 0.00 177.57 177.36 1br0 h ARG 90 N -0.99 0.70 0.00 4.17 0.11 -0.84 -0.19 114.38 117.35 1br0 h ARG 90 Ca -0.00 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 60.04 1br0 h ARG 90 Cb 0.60 -0.16 0.00 0.00 1.11 0.00 0.00 29.97 31.52 1br0 h ARG 90 CO 0.00 0.46 0.00 0.77 0.10 0.00 0.00 179.97 181.31 1br0 h SER 91 N 0.72 0.00 0.27 0.08 0.02 -1.78 -2.71 113.55 110.15 1br0 h SER 91 Ca 0.29 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.90 1br0 h SER 91 Cb 0.14 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 1br0 h SER 91 CO -0.16 0.00 -1.83 0.50 -1.14 0.00 0.00 176.83 174.20 1br0 h LYS 92 N 0.00 0.21 -0.50 3.45 1.63 -1.21 -3.30 116.57 116.86 1br0 h LYS 92 Ca 0.00 -0.37 -0.02 0.00 -0.85 0.00 0.00 60.65 59.42 1br0 h LYS 92 Cb 0.40 0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.14 1br0 h LYS 92 CO 0.00 1.04 0.25 1.25 -3.45 0.00 0.00 179.45 178.54 1br0 h LEU 93 N 0.06 0.65 -1.23 5.20 6.46 -1.18 -3.09 115.31 122.18 1br0 h LEU 93 Ca -0.36 -0.12 0.05 0.00 -0.12 0.00 0.00 57.88 57.33 1br0 h LEU 93 Cb 2.03 -0.17 -0.05 0.00 -0.73 0.00 0.00 40.66 41.75 1br0 h LEU 93 CO 0.11 0.59 0.54 0.07 -0.62 0.00 0.00 178.44 179.13 1br0 h LYS 94 N 0.66 0.93 -0.51 1.25 5.09 -1.66 -2.27 116.57 120.06 1br0 h LYS 94 Ca 0.17 -0.06 0.15 0.00 0.09 0.00 0.00 60.65 61.00 1br0 h LYS 94 Cb 0.11 -0.21 -0.02 0.00 0.10 0.00 0.00 32.23 32.21 1br0 h LYS 94 CO -0.02 0.62 0.41 0.77 -2.09 0.00 0.00 179.45 179.14 1br0 h SER 95 N 0.96 0.00 -0.13 7.07 0.02 -1.62 0.30 113.55 120.15 1br0 h SER 95 Ca 0.35 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.24 1br0 h SER 95 Cb 0.15 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 1br0 h SER 95 CO -0.12 0.00 -0.14 0.40 -1.14 0.00 0.00 176.83 175.83 1br0 h ILE 96 N 0.00 1.36 -0.65 3.27 1.08 -1.43 -1.70 117.51 119.44 1br0 h ILE 96 Ca 0.24 -1.32 0.05 0.00 -0.39 0.00 0.00 64.86 63.44 1br0 h ILE 96 Cb 1.07 1.93 -0.05 0.00 -3.07 0.00 0.00 36.82 36.70 1br0 h ILE 96 CO -0.00 0.38 0.38 -0.08 -0.69 0.00 0.00 178.15 178.14 1br0 h GLU 97 N -0.06 0.69 -0.72 2.37 4.22 -0.96 -2.66 114.58 117.45 1br0 h GLU 97 Ca 0.02 -0.04 0.01 0.00 0.08 0.00 0.00 59.36 59.43 1br0 h GLU 97 Cb 0.68 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 1br0 h GLU 97 CO 0.04 0.46 0.48 1.96 -2.18 0.00 0.00 179.01 179.76 1br0 h GLN 98 N 0.71 0.94 0.00 1.92 1.08 -0.54 -2.95 115.11 116.27 1br0 h GLN 98 Ca 0.28 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.40 1br0 h GLN 98 Cb 0.13 -0.21 -0.00 0.00 -0.05 0.00 0.00 27.48 27.34 1br0 h GLN 98 CO -0.16 0.63 -0.12 0.77 -0.95 0.00 0.00 178.83 179.00 1br0 h SER 99 N 0.97 0.00 0.15 1.46 0.02 -1.23 -2.48 113.55 112.44 1br0 h SER 99 Ca 0.27 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.21 1br0 h SER 99 Cb -0.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.44 1br0 h SER 99 CO -0.06 0.12 -0.07 0.40 -1.14 0.00 0.00 176.83 176.08 1br0 h ILE 100 N 0.00 0.00 -1.08 3.27 2.04 -1.40 -3.33 117.51 117.02 1br0 h ILE 100 Ca -0.00 -0.83 0.30 0.00 1.00 0.00 0.00 64.86 65.34 1br0 h ILE 100 Cb 0.47 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.50 1br0 h ILE 100 CO 0.02 0.00 0.76 -0.08 0.00 0.00 0.00 178.15 178.84 1br0 h GLU 101 N -1.02 0.08 0.00 2.37 4.81 -1.62 -2.11 114.58 117.08 1br0 h GLU 101 Ca -0.02 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1br0 h GLU 101 Cb 0.15 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.51 1br0 h GLU 101 CO 0.03 0.05 0.00 1.04 -0.73 0.00 0.00 179.01 179.40 1br0 n GLN 102 N -4.29 0.05 -0.00 1.92 1.13 -0.93 -3.63 117.38 111.62 1br0 n GLN 102 Ca 0.23 0.13 0.03 0.00 -1.94 0.00 0.00 57.00 55.45 1br0 n GLN 102 Cb 1.09 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 29.90 1br0 n GLN 102 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 1br0 n GLU 103 N -1.47 1.99 0.34 -1.09 2.13 -0.84 -4.75 120.64 116.96 1br0 n GLU 103 Ca 0.06 -0.03 -0.18 0.00 0.66 0.00 0.00 57.16 57.66 1br0 n GLU 103 Cb 0.24 -1.01 -0.09 0.00 0.27 0.00 0.00 31.44 30.85 1br0 n GLU 103 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1br0 h GLU 104 N 0.00 -0.95 -0.15 5.31 4.81 -1.50 -3.21 114.58 118.89 1br0 h GLU 104 Ca 0.00 0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.34 1br0 h GLU 104 Cb 0.23 0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1br0 h GLU 104 CO 0.00 -0.64 0.31 0.78 -0.73 0.00 0.00 179.01 178.73 1br0 h GLY 105 N -0.99 0.00 1.42 1.92 0.00 -1.87 -2.68 103.07 100.86 1br0 h GLY 105 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.26 1br0 h GLY 105 CO 0.04 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.62 1br0 n LEU 106 N -3.31 0.00 -2.81 3.11 4.32 -1.21 -4.95 117.00 112.14 1br0 n LEU 106 Ca 0.01 0.21 -0.03 0.00 -0.02 0.00 0.00 56.01 56.19 1br0 n LEU 106 Cb 0.41 -0.21 0.00 0.00 -1.62 0.00 0.00 43.42 42.00 1br0 n LEU 106 CO 0.21 -0.13 0.21 0.59 -1.22 0.00 0.00 177.39 177.04 1br0 n ASN 107 N -1.21 -7.20 -3.68 -1.43 3.02 -1.01 -5.10 115.26 98.64 1br0 n ASN 107 Ca 0.06 0.14 -0.10 0.00 -0.03 0.00 0.00 54.58 54.65 1br0 n ASN 107 Cb 0.08 -4.86 -0.10 0.00 -0.61 0.00 0.00 39.78 34.29 1br0 n ASN 107 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1br0 s ARG 108 N -2.79 0.47 -0.36 3.52 0.52 -1.25 -5.10 118.95 113.96 1br0 s ARG 108 Ca 0.08 0.87 0.01 0.00 -0.52 0.00 0.00 55.73 56.17 1br0 s ARG 108 Cb -0.02 0.04 0.19 0.00 0.52 0.00 0.00 34.95 35.67 1br0 s ARG 108 CO 0.67 -0.15 0.79 -1.54 0.02 0.00 0.00 175.30 175.09 1br0 s SER 109 N 1.34 -1.08 -0.29 0.23 1.04 -1.26 -4.52 113.70 109.16 1br0 s SER 109 Ca -0.09 -0.40 -0.14 0.00 0.48 0.00 0.00 55.95 55.80 1br0 s SER 109 Cb -0.07 1.44 0.11 0.00 0.10 0.00 0.00 66.02 67.60 1br0 s SER 109 CO -0.13 -0.14 0.71 -0.44 0.98 0.00 0.00 173.24 174.22 1br0 s SER 110 N 2.10 -0.97 0.00 7.02 0.01 -1.26 -5.06 113.70 115.54 1br0 s SER 110 Ca 0.16 1.46 0.00 0.00 1.31 0.00 0.00 55.95 58.88 1br0 s SER 110 Cb -0.02 1.71 0.00 0.00 0.21 0.00 0.00 66.02 67.91 1br0 s SER 110 CO -0.13 -0.22 0.00 0.00 0.41 0.00 0.00 173.24 173.30 1br0 n ALA 111 N 4.69 0.00 -0.02 1.44 0.00 -1.26 -4.09 120.51 121.28 1br0 n ALA 111 Ca -0.17 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.16 1br0 n ALA 111 Cb 0.55 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.91 1br0 n ALA 111 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1br0 h ASP 112 N 0.00 -0.06 0.27 0.00 3.04 -1.99 -2.26 116.42 115.42 1br0 h ASP 112 Ca 0.00 -0.59 0.00 0.00 -3.24 0.00 0.00 57.03 53.20 1br0 h ASP 112 Cb 0.00 0.02 0.00 0.00 -1.04 0.00 0.00 39.33 38.31 1br0 h ASP 112 CO 0.00 0.66 0.00 0.00 -2.04 0.00 0.00 179.24 177.86 1br0 n LEU 113 N -4.77 0.00 -0.08 0.15 -0.00 -1.26 -3.02 117.00 108.02 1br0 n LEU 113 Ca -0.08 0.14 -0.22 0.00 -0.00 0.00 0.00 56.01 55.85 1br0 n LEU 113 Cb 0.32 -0.14 -0.12 0.00 -0.00 0.00 0.00 43.42 43.48 1br0 n LEU 113 CO 0.27 -0.00 -0.69 0.54 -0.00 0.00 0.00 177.39 177.50 1br0 n ARG 114 N -1.14 0.62 -0.12 1.47 1.74 -1.25 -3.34 116.66 114.64 1br0 n ARG 114 Ca 0.19 0.46 -0.05 0.00 -0.77 0.00 0.00 57.85 57.68 1br0 n ARG 114 Cb 0.17 -1.71 0.02 0.00 -1.02 0.00 0.00 32.46 29.92 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 -0.71 0.59 -0.69 0.55 2.04 -1.49 -0.79 117.51 117.00 1br0 h ILE 115 Ca -0.40 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 1br0 h ILE 115 Cb 1.53 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 38.16 1br0 h ILE 115 CO -0.15 0.00 0.42 0.03 0.00 0.00 0.00 178.15 178.45 1br0 h ARG 116 N -0.00 0.94 0.00 2.37 3.08 -1.73 -2.71 114.38 116.32 1br0 h ARG 116 Ca 0.20 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 60.10 1br0 h ARG 116 Cb 0.30 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1br0 h ARG 116 CO -0.42 0.67 -0.28 0.87 -1.07 0.00 0.00 179.97 179.73 1br0 h LYS 117 N 0.94 0.00 -0.15 0.04 1.57 -1.53 -2.69 116.57 114.75 1br0 h LYS 117 Ca 0.25 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.02 1br0 h LYS 117 Cb -0.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1br0 h LYS 117 CO -0.05 0.28 0.06 1.15 -0.57 0.00 0.00 179.45 180.33 1br0 h THR 118 N 0.00 1.15 0.05 -0.16 2.02 -0.81 -3.25 112.91 111.91 1br0 h THR 118 Ca -0.00 -0.44 -0.15 0.00 0.77 0.00 0.00 66.41 66.60 1br0 h THR 118 Cb 0.57 1.16 0.01 0.00 -1.74 0.00 0.00 68.15 68.16 1br0 h THR 118 CO 0.04 0.14 -0.60 1.56 0.37 0.00 0.00 175.52 177.02 1br0 h GLN 119 N 0.09 0.32 -0.57 6.66 1.08 -1.63 -3.30 115.11 117.76 1br0 h GLN 119 Ca 0.05 -0.41 0.11 0.00 -1.45 0.00 0.00 58.65 56.95 1br0 h GLN 119 Cb 0.16 0.13 -0.11 0.00 -0.05 0.00 0.00 27.48 27.61 1br0 h GLN 119 CO -0.00 1.12 -0.22 1.25 -0.95 0.00 0.00 178.83 180.03 1br0 h HIS 120 N -0.30 -0.54 -0.02 2.96 2.76 -1.60 -0.91 115.15 117.50 1br0 h HIS 120 Ca -0.09 0.06 -0.15 0.00 -2.20 0.00 0.00 60.37 57.99 1br0 h HIS 120 Cb 1.38 0.32 -0.02 0.00 1.55 0.00 0.00 27.41 30.65 1br0 h HIS 120 CO 0.18 -0.31 -0.66 1.03 -1.30 0.00 0.00 177.93 176.87 1br0 h SER 121 N -0.08 0.11 -0.08 3.26 0.87 -1.75 0.12 113.55 116.00 1br0 h SER 121 Ca 0.26 -0.07 -0.06 0.00 -1.23 0.00 0.00 61.79 60.70 1br0 h SER 121 Cb 0.49 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.42 1br0 h SER 121 CO -0.62 0.74 -0.18 0.74 -0.53 0.00 0.00 176.83 176.97 1br0 h THR 122 N 0.06 1.41 -0.66 2.23 2.02 -1.59 -1.51 112.91 114.88 1br0 h THR 122 Ca -0.01 -1.50 -0.01 0.00 0.77 0.00 0.00 66.41 65.66 1br0 h THR 122 Cb 1.18 2.19 -0.03 0.00 -1.74 0.00 0.00 68.15 69.75 1br0 h THR 122 CO 0.09 0.42 0.37 0.17 0.37 0.00 0.00 175.52 176.95 1br0 h LEU 123 N -0.21 0.82 -1.50 2.58 8.10 -1.25 -2.78 115.31 121.07 1br0 h LEU 123 Ca 0.00 -0.09 -0.03 0.00 0.11 0.00 0.00 57.88 57.87 1br0 h LEU 123 Cb 0.77 -0.21 -0.01 0.00 -0.44 0.00 0.00 40.66 40.77 1br0 h LEU 123 CO 0.04 0.67 -0.02 0.28 -4.11 0.00 0.00 178.44 175.30 1br0 h SER 124 N 0.90 0.28 -0.20 0.17 0.02 -1.07 -2.13 113.55 111.51 1br0 h SER 124 Ca 0.23 -0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1br0 h SER 124 Cb 0.02 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 1br0 h SER 124 CO -0.04 0.35 0.12 -0.09 -1.14 0.00 0.00 176.83 176.02 1br0 h ARG 125 N 0.30 0.27 0.00 3.45 2.43 -1.04 -2.47 114.38 117.32 1br0 h ARG 125 Ca 0.07 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 1br0 h ARG 125 Cb 0.23 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1br0 h ARG 125 CO 0.01 0.24 -0.12 -0.22 -1.51 0.00 0.00 179.97 178.37 1br0 h LYS 126 N 0.23 0.00 -0.48 0.20 3.64 -1.42 -2.68 116.57 116.06 1br0 h LYS 126 Ca 0.07 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.40 1br0 h LYS 126 Cb 0.04 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 1br0 h LYS 126 CO -0.01 0.12 0.10 0.35 -2.27 0.00 0.00 179.45 177.73 1br0 h PHE 127 N 0.00 0.83 -0.13 1.91 3.04 -1.08 -3.06 116.94 118.46 1br0 h PHE 127 Ca -0.00 -0.11 -0.15 0.00 3.98 0.00 0.00 57.97 61.69 1br0 h PHE 127 Cb 0.32 -0.23 0.01 0.00 2.56 0.00 0.00 35.95 38.60 1br0 h PHE 127 CO 0.00 0.76 -0.51 0.28 -2.02 0.00 0.00 178.31 176.82 1br0 h VAL 128 N 0.66 1.35 0.00 1.41 2.07 -1.42 -0.14 116.25 120.18 1br0 h VAL 128 Ca 0.15 -1.80 0.00 0.00 0.82 0.00 0.00 66.70 65.86 1br0 h VAL 128 Cb 0.36 2.11 0.00 0.00 -1.52 0.00 0.00 31.29 32.24 1br0 h VAL 128 CO 0.01 0.55 0.11 -0.62 0.02 0.00 0.00 177.57 177.63 1br0 n GLU 129 N -4.20 0.06 -0.02 1.57 1.02 -1.01 -2.02 120.64 116.04 1br0 n GLU 129 Ca -0.08 0.52 -0.04 0.00 -0.02 0.00 0.00 57.16 57.54 1br0 n GLU 129 Cb 0.60 -1.82 -0.01 0.00 -0.02 0.00 0.00 31.44 30.19 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 -1.82 1.36 -0.19 2.62 0.31 -1.15 -4.64 118.33 114.81 1br0 n VAL 130 Ca -0.01 0.28 -0.03 0.00 -0.01 0.00 0.00 64.34 64.57 1br0 n VAL 130 Cb 0.12 -1.95 0.16 0.00 -0.91 0.00 0.00 33.84 31.26 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 -0.47 0.96 0.00 5.55 2.86 -1.06 -0.17 114.93 122.60 1br0 h MET 131 Ca -0.00 -0.18 -0.03 0.00 -2.06 0.00 0.00 59.70 57.44 1br0 h MET 131 Cb 0.48 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 1br0 h MET 131 CO -0.00 0.81 -0.12 0.77 1.06 0.00 0.00 176.91 179.43 1br0 h SER 132 N 0.93 0.00 0.03 1.22 0.02 -1.63 -0.83 113.55 113.29 1br0 h SER 132 Ca 0.21 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 61.04 1br0 h SER 132 Cb 0.24 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.79 1br0 h SER 132 CO -0.01 0.12 -0.49 -0.08 -1.14 0.00 0.00 176.83 175.23 1br0 h GLU 133 N 0.00 0.28 0.00 3.45 4.57 -1.57 -3.31 114.58 118.00 1br0 h GLU 133 Ca -0.00 -0.34 -0.01 0.00 -1.18 0.00 0.00 59.36 57.83 1br0 h GLU 133 Cb 0.25 0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.94 1br0 h GLU 133 CO 0.02 1.06 -0.04 -0.92 -1.18 0.00 0.00 179.01 177.95 1br0 h TYR 134 N -0.34 0.00 -0.63 0.92 3.20 -0.97 -2.67 116.97 116.47 1br0 h TYR 134 Ca -0.07 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.79 1br0 h TYR 134 Cb 1.25 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 39.49 1br0 h TYR 134 CO 0.18 0.04 0.33 -0.97 -1.64 0.00 0.00 178.16 176.10 1br0 h ASN 135 N 0.00 0.80 1.07 -2.11 -0.73 -1.26 -3.03 115.58 110.32 1br0 h ASN 135 Ca -0.00 -0.11 -0.04 0.00 1.87 0.00 0.00 56.30 58.02 1br0 h ASN 135 Cb 0.10 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 38.48 1br0 h ASN 135 CO 0.01 0.68 -0.19 0.00 -0.37 0.00 0.00 177.43 177.55 1br0 h ALA 136 N 1.15 0.99 -0.10 1.57 0.00 -1.61 -3.35 119.26 117.92 1br0 h ALA 136 Ca 0.22 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1br0 h ALA 136 Cb 0.07 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1br0 h ALA 136 CO -0.03 0.24 -0.10 1.15 0.00 0.00 0.00 179.25 180.51 1br0 h THR 137 N 0.00 1.36 -0.70 0.00 2.02 -1.36 -1.51 112.91 112.72 1br0 h THR 137 Ca -0.00 -1.25 0.01 0.00 0.77 0.00 0.00 66.41 65.93 1br0 h THR 137 Cb 0.78 1.96 -0.03 0.00 -1.74 0.00 0.00 68.15 69.11 1br0 h THR 137 CO 0.02 0.35 0.46 -0.61 0.37 0.00 0.00 175.52 176.12 1br0 h GLN 138 N -0.16 0.92 0.00 6.66 -0.00 -1.71 -2.69 115.11 118.14 1br0 h GLN 138 Ca 0.02 -0.06 -0.06 0.00 -0.00 0.00 0.00 58.65 58.55 1br0 h GLN 138 Cb 0.61 -0.21 -0.01 0.00 0.00 0.00 0.00 27.48 27.88 1br0 h GLN 138 CO 0.02 0.62 -0.28 0.77 0.00 0.00 0.00 178.83 179.96 1br0 h SER 139 N 0.95 0.00 -0.10 -0.69 0.02 -1.69 -3.19 113.55 108.85 1br0 h SER 139 Ca 0.26 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.20 1br0 h SER 139 Cb -0.10 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 1br0 h SER 139 CO -0.05 0.28 0.05 -0.78 -1.14 0.00 0.00 176.83 175.19 1br0 h ASP 140 N 0.00 0.14 -0.18 3.07 3.58 -0.92 0.86 116.42 122.97 1br0 h ASP 140 Ca -0.00 -0.01 0.03 0.00 0.42 0.00 0.00 57.03 57.47 1br0 h ASP 140 Cb 0.56 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.57 1br0 h ASP 140 CO 0.04 0.13 0.13 0.22 -2.88 0.00 0.00 179.24 176.87 1br0 h TYR 141 N 0.16 0.12 0.00 0.28 3.20 -1.53 -3.38 116.97 115.82 1br0 h TYR 141 Ca 0.04 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1br0 h TYR 141 Cb 0.03 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.26 1br0 h TYR 141 CO 0.00 0.07 0.00 2.89 -1.64 0.00 0.00 178.16 179.48 1br0 n ARG 142 N -4.50 -0.16 -0.06 1.82 1.85 -1.10 -3.65 116.66 110.87 1br0 n ARG 142 Ca 0.01 -0.15 -0.14 0.00 -1.00 0.00 0.00 57.85 56.56 1br0 n ARG 142 Cb 0.17 -0.63 -0.13 0.00 -1.05 0.00 0.00 32.46 30.83 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 0.02 0.00 2.89 4.11 -1.02 -3.39 114.58 117.19 1br0 h GLU 143 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.40 1br0 h GLU 143 Cb 0.32 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1br0 h GLU 143 CO 0.00 0.93 0.00 -2.13 0.07 0.00 0.00 179.01 177.88 1br0 n ARG 144 N -4.62 0.00 -0.47 1.06 0.63 -1.26 -4.92 116.66 107.08 1br0 n ARG 144 Ca -0.10 0.23 0.00 0.00 -0.92 0.00 0.00 57.85 57.06 1br0 n ARG 144 Cb 0.46 -0.68 0.00 0.00 0.45 0.00 0.00 32.46 32.69 1br0 n ARG 144 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1br0 n SER 145 N -1.57 -1.88 0.00 6.15 7.64 -1.24 -5.12 113.62 117.59 1br0 n SER 145 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1br0 n SER 145 Cb 0.00 -1.97 0.00 0.00 -1.01 0.00 0.00 64.21 61.23 1br0 n SER 145 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32