#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 0.90 0.22 -1.24 3.08 -2.05 -2.69 114.38 112.59 1br0 h ARG 28 Ca 0.00 -0.25 -0.33 0.00 0.07 0.00 0.00 59.98 59.47 1br0 h ARG 28 Cb 0.00 -0.10 0.03 0.00 0.08 0.00 0.00 29.97 29.98 1br0 h ARG 28 CO 0.00 0.88 -1.52 0.74 -1.07 0.00 0.00 179.97 179.00 1br0 h PHE 29 N 0.78 0.83 -0.21 3.04 0.04 -2.06 -2.56 116.94 116.81 1br0 h PHE 29 Ca 0.16 -0.61 -0.13 0.00 2.80 0.00 0.00 57.97 60.19 1br0 h PHE 29 Cb 0.43 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.55 1br0 h PHE 29 CO 0.03 1.54 -0.38 0.52 -0.60 0.00 0.00 178.31 179.42 1br0 h MET 30 N 0.12 0.62 -0.92 1.51 2.86 -2.00 -2.61 114.93 114.51 1br0 h MET 30 Ca -0.26 -0.39 0.09 0.00 -2.06 0.00 0.00 59.70 57.07 1br0 h MET 30 Cb 2.12 0.05 -0.07 0.00 0.06 0.00 0.00 31.60 33.76 1br0 h MET 30 CO 0.24 1.01 0.59 -0.44 1.06 0.00 0.00 176.91 179.37 1br0 h ASP 31 N 0.31 0.87 -0.64 1.22 3.32 -1.61 -1.71 116.42 118.17 1br0 h ASP 31 Ca 0.01 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.99 1br0 h ASP 31 Cb 0.98 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.34 1br0 h ASP 31 CO 0.09 0.52 0.07 -0.33 -1.72 0.00 0.00 179.24 177.86 1br0 h GLU 32 N 0.96 1.09 -0.75 3.56 5.08 -1.52 -2.91 114.58 120.10 1br0 h GLU 32 Ca 0.42 -0.31 0.04 0.00 -1.00 0.00 0.00 59.36 58.51 1br0 h GLU 32 Cb 0.35 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.43 1br0 h GLU 32 CO -0.18 1.02 0.46 0.35 -1.00 0.00 0.00 179.01 179.67 1br0 h PHE 33 N 1.01 0.86 -0.19 4.33 3.57 -1.04 -2.64 116.94 122.85 1br0 h PHE 33 Ca 0.19 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.66 1br0 h PHE 33 Cb 0.49 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 38.94 1br0 h PHE 33 CO 0.04 0.48 -0.12 0.74 -2.23 0.00 0.00 178.31 177.21 1br0 h PHE 34 N 0.89 0.48 -0.78 0.41 0.04 -1.34 -3.24 116.94 113.40 1br0 h PHE 34 Ca 0.31 -0.13 -0.01 0.00 2.80 0.00 0.00 57.97 60.94 1br0 h PHE 34 Cb 0.06 -0.11 -0.04 0.00 2.20 0.00 0.00 35.95 38.07 1br0 h PHE 34 CO -0.04 0.73 0.43 0.93 -0.60 0.00 0.00 178.31 179.77 1br0 h GLU 35 N 0.10 1.08 -0.19 1.51 5.08 -1.58 -3.30 114.58 117.27 1br0 h GLU 35 Ca 0.04 -0.12 -0.15 0.00 -1.00 0.00 0.00 59.36 58.13 1br0 h GLU 35 Cb 0.62 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1br0 h GLU 35 CO 0.03 0.79 -0.51 -0.56 -1.00 0.00 0.00 179.01 177.76 1br0 h GLN 36 N 1.09 0.53 -0.64 2.33 3.07 -1.58 -3.37 115.11 116.55 1br0 h GLN 36 Ca 0.28 -0.32 0.13 0.00 0.09 0.00 0.00 58.65 58.83 1br0 h GLN 36 Cb 0.01 0.03 -0.11 0.00 0.08 0.00 0.00 27.48 27.49 1br0 h GLN 36 CO -0.05 0.92 -0.06 0.28 0.09 0.00 0.00 178.83 180.01 1br0 h VAL 37 N 0.42 0.42 0.00 1.86 2.07 -1.63 -1.76 116.25 117.63 1br0 h VAL 37 Ca 0.02 -0.02 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1br0 h VAL 37 Cb 1.03 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1br0 h VAL 37 CO 0.10 0.01 -0.01 -0.08 0.02 0.00 0.00 177.57 177.61 1br0 h GLU 38 N 0.07 0.00 -0.16 1.57 4.81 -1.76 -0.09 114.58 119.02 1br0 h GLU 38 Ca 0.33 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.43 1br0 h GLU 38 Cb 0.53 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.91 1br0 h GLU 38 CO -0.59 0.01 -0.42 0.93 -0.73 0.00 0.00 179.01 178.20 1br0 h GLU 39 N 0.00 0.56 0.43 1.92 4.39 -1.53 -1.88 114.58 118.48 1br0 h GLU 39 Ca -0.00 -0.39 -0.02 0.00 0.34 0.00 0.00 59.36 59.29 1br0 h GLU 39 Cb 0.01 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1br0 h GLU 39 CO 0.00 1.01 -0.21 0.82 -1.16 0.00 0.00 179.01 179.48 1br0 h ILE 40 N 0.21 0.58 -0.72 3.13 2.04 -1.23 -2.60 117.51 118.91 1br0 h ILE 40 Ca -0.01 -0.06 0.19 0.00 1.00 0.00 0.00 64.86 65.98 1br0 h ILE 40 Cb 1.03 0.61 -0.04 0.00 -0.74 0.00 0.00 36.82 37.69 1br0 h ILE 40 CO 0.09 0.01 0.51 0.03 0.00 0.00 0.00 178.15 178.79 1br0 h ARG 41 N -0.61 0.12 0.01 2.37 3.08 -1.14 -0.94 114.38 117.27 1br0 h ARG 41 Ca -0.06 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 1br0 h ARG 41 Cb 0.46 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.48 1br0 h ARG 41 CO 0.10 0.08 -0.00 0.78 -1.07 0.00 0.00 179.97 179.86 1br0 h GLY 42 N 0.13 -0.01 1.00 0.04 0.00 -1.12 -0.71 103.07 102.39 1br0 h GLY 42 Ca 0.35 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.67 1br0 h GLY 42 CO -0.05 -0.00 0.36 0.74 0.00 0.00 0.00 176.54 177.59 1br0 h PHE 43 N -0.16 0.85 -0.47 5.60 0.04 -1.12 -2.79 116.94 118.88 1br0 h PHE 43 Ca -0.00 -0.01 0.06 0.00 2.80 0.00 0.00 57.97 60.82 1br0 h PHE 43 Cb 0.16 -0.27 -0.05 0.00 2.20 0.00 0.00 35.95 37.99 1br0 h PHE 43 CO -0.02 0.60 0.17 0.82 -0.60 0.00 0.00 178.31 179.28 1br0 h ILE 44 N 0.85 0.85 -0.66 -0.55 2.04 -1.21 -1.11 117.51 117.72 1br0 h ILE 44 Ca 0.22 -0.12 0.13 0.00 1.00 0.00 0.00 64.86 66.10 1br0 h ILE 44 Cb 0.02 0.47 -0.10 0.00 -0.74 0.00 0.00 36.82 36.47 1br0 h ILE 44 CO -0.04 0.06 0.14 -0.78 0.00 0.00 0.00 178.15 177.54 1br0 h ASP 45 N 0.35 -0.01 0.94 1.72 1.82 -1.03 -0.41 116.42 119.79 1br0 h ASP 45 Ca 0.22 0.13 -0.02 0.00 -0.39 0.00 0.00 57.03 56.98 1br0 h ASP 45 Cb 0.22 0.18 -0.00 0.00 0.68 0.00 0.00 39.33 40.41 1br0 h ASP 45 CO -0.23 -0.02 -0.08 0.50 -1.61 0.00 0.00 179.24 177.81 1br0 h LYS 46 N 0.26 0.00 0.23 0.28 1.63 -1.21 -2.61 116.57 115.16 1br0 h LYS 46 Ca 0.36 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 60.15 1br0 h LYS 46 Cb 0.57 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.21 1br0 h LYS 46 CO -0.46 0.08 -0.11 0.82 -3.45 0.00 0.00 179.45 176.32 1br0 h ILE 47 N 0.00 0.48 -0.43 2.00 1.08 -0.26 -2.83 117.51 117.55 1br0 h ILE 47 Ca -0.00 -0.95 -0.03 0.00 -0.39 0.00 0.00 64.86 63.49 1br0 h ILE 47 Cb 0.57 0.81 -0.02 0.00 -3.07 0.00 0.00 36.82 35.10 1br0 h ILE 47 CO 0.01 0.13 0.14 0.00 -0.69 0.00 0.00 178.15 177.74 1br0 h ALA 48 N -0.67 1.45 -0.34 1.87 0.00 -1.15 0.88 119.26 121.28 1br0 h ALA 48 Ca -0.03 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 1br0 h ALA 48 Cb 0.45 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1br0 h ALA 48 CO 0.05 0.42 -0.13 0.93 0.00 0.00 0.00 179.25 180.51 1br0 h GLU 49 N 0.62 0.70 -0.16 0.00 5.08 -1.64 -2.66 114.58 116.51 1br0 h GLU 49 Ca 0.15 -0.29 -0.09 0.00 -1.00 0.00 0.00 59.36 58.13 1br0 h GLU 49 Cb 0.17 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 1br0 h GLU 49 CO -0.01 0.89 -0.24 -0.97 -1.00 0.00 0.00 179.01 177.68 1br0 h ASN 50 N 0.48 0.48 -0.19 1.42 -0.73 -1.27 -2.63 115.58 113.14 1br0 h ASN 50 Ca 0.08 -0.52 -0.00 0.00 1.87 0.00 0.00 56.30 57.73 1br0 h ASN 50 Cb 0.66 -0.14 -0.01 0.00 0.27 0.00 0.00 38.32 39.10 1br0 h ASN 50 CO 0.04 0.91 0.11 1.62 -0.37 0.00 0.00 177.43 179.74 1br0 h VAL 51 N 0.07 1.10 -0.48 2.57 3.04 -0.94 -1.21 116.25 120.40 1br0 h VAL 51 Ca 0.02 -0.26 0.07 0.00 -1.01 0.00 0.00 66.70 65.52 1br0 h VAL 51 Cb 0.81 0.93 -0.03 0.00 -2.01 0.00 0.00 31.29 30.99 1br0 h VAL 51 CO 0.05 0.09 0.32 -0.33 -1.01 0.00 0.00 177.57 176.70 1br0 h GLU 52 N 0.21 0.34 -0.15 4.17 5.08 -1.60 -2.61 114.58 120.01 1br0 h GLU 52 Ca 0.07 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1br0 h GLU 52 Cb 0.06 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 1br0 h GLU 52 CO -0.01 0.22 -0.02 1.49 -1.00 0.00 0.00 179.01 179.69 1br0 h GLU 53 N 0.35 0.27 -0.80 2.33 4.81 -1.03 -3.23 114.58 117.28 1br0 h GLU 53 Ca 0.21 -0.10 0.18 0.00 -0.13 0.00 0.00 59.36 59.53 1br0 h GLU 53 Cb 0.39 -0.02 -0.15 0.00 0.63 0.00 0.00 28.75 29.61 1br0 h GLU 53 CO -0.05 0.53 -0.06 0.28 -0.73 0.00 0.00 179.01 178.98 1br0 h VAL 54 N -0.01 0.25 0.00 0.32 2.07 -0.89 -1.94 116.25 116.05 1br0 h VAL 54 Ca 0.04 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 1br0 h VAL 54 Cb 0.42 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1br0 h VAL 54 CO 0.01 0.01 -0.15 0.11 0.02 0.00 0.00 177.57 177.57 1br0 h LYS 55 N 0.05 0.00 0.01 1.57 1.57 -1.52 -0.03 116.57 118.22 1br0 h LYS 55 Ca 0.43 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.99 1br0 h LYS 55 Cb 0.74 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.02 1br0 h LYS 55 CO -0.75 0.15 -1.04 0.07 -0.57 0.00 0.00 179.45 177.31 1br0 h ARG 56 N 0.00 0.02 0.08 3.15 0.11 -1.38 -3.35 114.38 113.00 1br0 h ARG 56 Ca -0.00 -0.03 -0.20 0.00 0.10 0.00 0.00 59.98 59.85 1br0 h ARG 56 Cb 0.36 0.01 0.02 0.00 1.11 0.00 0.00 29.97 31.47 1br0 h ARG 56 CO 0.02 1.00 -0.82 0.87 0.10 0.00 0.00 179.97 181.13 1br0 h LYS 57 N 0.00 0.42 -0.91 0.08 1.57 -1.31 -3.35 116.57 113.08 1br0 h LYS 57 Ca -0.03 -0.56 0.26 0.00 -1.87 0.00 0.00 60.65 58.45 1br0 h LYS 57 Cb 1.79 0.18 -0.04 0.00 0.08 0.00 0.00 32.23 34.24 1br0 h LYS 57 CO 0.13 1.22 0.64 0.45 -0.57 0.00 0.00 179.45 181.32 1br0 h HIS 58 N -0.10 0.08 0.11 -1.35 3.86 -1.18 -2.64 115.15 113.93 1br0 h HIS 58 Ca -0.12 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 58.90 1br0 h HIS 58 Cb 1.57 -0.02 0.01 0.00 1.06 0.00 0.00 27.41 30.02 1br0 h HIS 58 CO 0.16 0.02 -0.90 1.03 0.86 0.00 0.00 177.93 179.10 1br0 h SER 59 N 0.06 0.37 0.51 2.45 0.87 -1.73 -2.65 113.55 113.42 1br0 h SER 59 Ca 0.44 -0.91 -0.01 0.00 -1.23 0.00 0.00 61.79 60.08 1br0 h SER 59 Cb 1.66 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 63.50 1br0 h SER 59 CO -0.03 1.41 -0.04 0.00 -0.53 0.00 0.00 176.83 177.63 1br0 h ALA 60 N 0.01 1.09 0.01 6.23 0.00 -1.67 -0.59 119.26 124.33 1br0 h ALA 60 Ca -0.18 -0.04 -0.39 0.00 0.00 0.00 0.00 54.91 54.31 1br0 h ALA 60 Cb 1.58 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 19.30 1br0 h ALA 60 CO 0.09 0.06 -2.45 -0.89 0.00 0.00 0.00 179.25 176.06 1br0 n ILE 61 N -3.26 1.50 0.20 0.00 5.41 -1.01 -0.95 119.36 121.24 1br0 n ILE 61 Ca -0.01 -0.60 0.07 0.00 1.00 0.00 0.00 62.75 63.21 1br0 n ILE 61 Cb 0.22 -1.37 0.58 0.00 -0.71 0.00 0.00 39.64 38.36 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 0.00 0.10 -0.10 1.39 6.46 -1.55 -2.61 115.31 119.00 1br0 h LEU 62 Ca -0.57 -0.00 -0.23 0.00 -0.12 0.00 0.00 57.88 56.95 1br0 h LEU 62 Cb 1.93 -0.03 0.01 0.00 -0.73 0.00 0.00 40.66 41.85 1br0 h LEU 62 CO -0.07 0.09 -0.85 0.00 -0.62 0.00 0.00 178.44 176.99 1br0 h ALA 63 N 1.93 0.24 -2.19 1.25 0.00 -1.22 -3.39 119.26 115.88 1br0 h ALA 63 Ca 0.03 -0.63 -0.72 0.00 0.00 0.00 0.00 54.91 53.59 1br0 h ALA 63 Cb 0.02 0.01 -0.20 0.00 0.00 0.00 0.00 17.79 17.62 1br0 h ALA 63 CO -0.00 0.67 0.54 -1.54 0.00 0.00 0.00 179.25 178.91 1br0 s SER 64 N -7.15 6.62 0.00 0.00 1.04 -0.13 -4.89 113.70 109.19 1br0 s SER 64 Ca -0.10 -2.16 0.24 0.00 0.48 0.00 0.00 55.95 54.41 1br0 s SER 64 Cb 0.08 -2.33 1.17 0.00 0.10 0.00 0.00 66.02 65.04 1br0 s SER 64 CO 0.91 -0.93 1.80 -2.65 0.98 0.00 0.00 173.24 173.35 1br0 n PRO 65 N 5.78 0.25 -3.90 4.02 -0.02 -1.22 -3.74 135.00 136.16 1br0 n PRO 65 Ca 0.17 0.06 -0.28 0.00 -2.02 0.00 0.00 63.50 61.43 1br0 n PRO 65 Cb 0.48 -1.50 -0.12 0.00 -0.02 0.00 0.00 33.50 32.34 1br0 n PRO 65 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1br0 s ASN 66 N -2.70 4.81 0.83 2.55 0.01 -1.26 -5.15 114.94 114.03 1br0 s ASN 66 Ca 0.20 -3.80 -0.12 0.00 -0.71 0.00 0.00 52.86 48.43 1br0 s ASN 66 Cb 0.16 -1.64 0.09 0.00 0.41 0.00 0.00 41.25 40.27 1br0 s ASN 66 CO 0.39 -0.09 1.11 -2.84 -1.51 0.00 0.00 177.10 174.16 1br0 s PRO 67 N -1.38 1.83 -0.16 -0.60 0.02 -1.25 -5.10 135.00 128.37 1br0 s PRO 67 Ca 0.24 0.48 -0.03 0.00 0.02 0.00 0.00 61.00 61.72 1br0 s PRO 67 Cb -0.06 -1.90 -0.02 0.00 0.02 0.00 0.00 34.50 32.54 1br0 s PRO 67 CO -0.15 -1.76 -0.07 0.34 -0.33 0.00 0.00 177.00 175.03 1br0 s ASP 68 N -4.02 4.46 -0.81 2.53 -1.08 -1.26 -4.62 116.67 111.88 1br0 s ASP 68 Ca 0.62 -0.23 -0.01 0.00 -0.52 0.00 0.00 52.55 52.40 1br0 s ASP 68 Cb -0.14 -1.72 0.00 0.00 -1.46 0.00 0.00 42.92 39.60 1br0 s ASP 68 CO 0.53 0.14 0.61 -0.62 0.52 0.00 0.00 175.17 176.35 1br0 n GLU 69 N 3.72 -1.55 -0.56 4.34 -0.58 -1.26 -3.97 120.64 120.77 1br0 n GLU 69 Ca -0.18 0.84 -0.07 0.00 -0.42 0.00 0.00 57.16 57.33 1br0 n GLU 69 Cb 0.52 -2.53 -0.08 0.00 -0.57 0.00 0.00 31.44 28.79 1br0 n GLU 69 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1br0 n LYS 70 N -2.48 0.00 0.00 3.49 4.76 -1.26 -4.35 118.16 118.32 1br0 n LYS 70 Ca -0.29 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.15 1br0 n LYS 70 Cb 0.68 -0.40 0.00 0.00 -1.84 0.00 0.00 35.03 33.47 1br0 n LYS 70 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1br0 n THR 71 N 2.12 0.00 0.46 -0.18 -2.24 -1.26 -0.95 114.28 112.23 1br0 n THR 71 Ca 0.22 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.12 1br0 n THR 71 Cb 0.08 -0.83 0.07 0.00 -2.10 0.00 0.00 70.33 67.56 1br0 n THR 71 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1br0 n LYS 72 N -0.36 0.36 -0.30 -0.78 5.02 -1.26 -4.35 118.16 116.50 1br0 n LYS 72 Ca 0.00 0.05 0.19 0.00 -2.02 0.00 0.00 58.31 56.54 1br0 n LYS 72 Cb 0.00 -1.68 0.36 0.00 -0.02 0.00 0.00 35.03 33.70 1br0 n LYS 72 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1br0 n GLU 73 N -2.18 -0.06 0.03 1.97 -0.58 -0.13 -1.05 120.64 118.64 1br0 n GLU 73 Ca 0.02 1.28 -0.00 0.00 -0.42 0.00 0.00 57.16 58.03 1br0 n GLU 73 Cb 0.46 -2.13 -0.08 0.00 -0.57 0.00 0.00 31.44 29.12 1br0 n GLU 73 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1br0 n GLU 74 N -5.17 0.62 -0.05 3.49 4.71 -1.26 -4.64 120.64 118.35 1br0 n GLU 74 Ca 0.26 0.23 -0.01 0.00 -0.01 0.00 0.00 57.16 57.63 1br0 n GLU 74 Cb 0.86 -1.81 0.25 0.00 -1.01 0.00 0.00 31.44 29.73 1br0 n GLU 74 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 1br0 h LEU 75 N 0.00 0.59 -2.18 -4.62 3.38 -1.29 -2.14 115.31 109.06 1br0 h LEU 75 Ca -0.17 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 1br0 h LEU 75 Cb 1.60 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 42.20 1br0 h LEU 75 CO 0.05 0.65 -0.05 -0.33 0.09 0.00 0.00 178.44 178.85 1br0 h GLU 76 N 0.60 0.00 0.09 1.13 4.39 -1.80 -2.81 114.58 116.19 1br0 h GLU 76 Ca 0.13 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.82 1br0 h GLU 76 Cb 0.35 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1br0 h GLU 76 CO 0.01 0.05 -0.05 1.49 -1.16 0.00 0.00 179.01 179.36 1br0 h GLU 77 N 0.00 -0.12 -0.10 2.33 4.81 -1.67 -3.29 114.58 116.54 1br0 h GLU 77 Ca -0.00 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 1br0 h GLU 77 Cb 0.25 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 1br0 h GLU 77 CO 0.01 0.18 -0.25 1.37 -0.73 0.00 0.00 179.01 179.59 1br0 h LEU 78 N -0.99 0.17 -0.05 1.64 8.10 -1.51 -0.24 115.31 122.42 1br0 h LEU 78 Ca -0.01 -0.05 -0.06 0.00 0.11 0.00 0.00 57.88 57.87 1br0 h LEU 78 Cb 0.36 -0.05 0.00 0.00 -0.44 0.00 0.00 40.66 40.54 1br0 h LEU 78 CO 0.02 0.43 -0.21 0.24 -4.11 0.00 0.00 178.44 174.81 1br0 h MET 79 N 0.16 0.24 0.00 0.17 2.86 -1.72 -2.88 114.93 113.76 1br0 h MET 79 Ca 0.03 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 57.48 1br0 h MET 79 Cb 0.54 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.24 1br0 h MET 79 CO 0.04 0.82 0.00 1.03 1.06 0.00 0.00 176.91 179.86 1br0 h SER 80 N -0.29 0.00 0.06 1.22 0.87 -1.62 -2.31 113.55 111.49 1br0 h SER 80 Ca -0.01 0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.42 1br0 h SER 80 Cb 0.85 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.83 1br0 h SER 80 CO 0.04 0.00 -0.54 -0.78 -0.53 0.00 0.00 176.83 175.03 1br0 h ASP 81 N 0.00 0.37 -0.25 6.23 3.58 -1.06 -2.80 116.42 122.49 1br0 h ASP 81 Ca 0.00 -0.88 -0.07 0.00 0.42 0.00 0.00 57.03 56.50 1br0 h ASP 81 Cb 0.24 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.17 1br0 h ASP 81 CO 0.00 1.22 -0.10 0.40 -2.88 0.00 0.00 179.24 177.87 1br0 h ILE 82 N -0.43 1.30 -0.49 2.25 2.04 -1.51 -0.72 117.51 119.95 1br0 h ILE 82 Ca -0.08 -1.17 0.10 0.00 1.00 0.00 0.00 64.86 64.70 1br0 h ILE 82 Cb 1.35 1.53 -0.10 0.00 -0.74 0.00 0.00 36.82 38.86 1br0 h ILE 82 CO 0.10 0.36 -0.26 0.50 0.00 0.00 0.00 178.15 178.85 1br0 h LYS 83 N 0.24 -0.15 -0.13 2.37 3.64 -1.58 0.14 116.57 121.11 1br0 h LYS 83 Ca 0.06 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.41 1br0 h LYS 83 Cb 0.60 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.45 1br0 h LYS 83 CO 0.03 -0.10 -0.08 0.87 -2.27 0.00 0.00 179.45 177.90 1br0 h LYS 84 N -0.15 0.28 0.32 1.90 1.79 -1.50 -2.75 116.57 116.45 1br0 h LYS 84 Ca 0.22 -0.13 -0.02 0.00 -2.18 0.00 0.00 60.65 58.54 1br0 h LYS 84 Cb 0.50 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 1br0 h LYS 84 CO -0.58 0.64 -0.15 1.15 -1.08 0.00 0.00 179.45 179.43 1br0 h THR 85 N -0.08 0.55 -1.01 -0.16 2.02 -1.13 -2.76 112.91 110.33 1br0 h THR 85 Ca 0.03 -0.74 0.25 0.00 0.77 0.00 0.00 66.41 66.72 1br0 h THR 85 Cb 0.57 0.85 -0.12 0.00 -1.74 0.00 0.00 68.15 67.71 1br0 h THR 85 CO 0.02 0.12 0.61 0.00 0.37 0.00 0.00 175.52 176.64 1br0 h ALA 86 N -0.52 1.86 -0.21 6.16 0.00 -0.85 -0.53 119.26 125.17 1br0 h ALA 86 Ca -0.04 0.11 -0.19 0.00 0.00 0.00 0.00 54.91 54.79 1br0 h ALA 86 Cb 0.52 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1br0 h ALA 86 CO 0.07 -0.32 -0.61 -0.97 0.00 0.00 0.00 179.25 177.42 1br0 h ASN 87 N 0.56 0.82 -0.70 0.00 -0.73 -1.59 0.08 115.58 114.02 1br0 h ASN 87 Ca 0.63 -0.47 -0.04 0.00 1.87 0.00 0.00 56.30 58.30 1br0 h ASN 87 Cb 1.25 -0.24 -0.03 0.00 0.27 0.00 0.00 38.32 39.57 1br0 h ASN 87 CO -0.44 1.24 0.30 0.50 -0.37 0.00 0.00 177.43 178.66 1br0 h LYS 88 N 0.54 1.03 0.04 6.67 3.64 -1.00 -3.04 116.57 124.44 1br0 h LYS 88 Ca -0.01 -0.18 -0.00 0.00 -1.27 0.00 0.00 60.65 59.20 1br0 h LYS 88 Cb 1.20 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1br0 h LYS 88 CO 0.13 0.84 -0.02 -0.24 -2.27 0.00 0.00 179.45 177.89 1br0 h VAL 89 N 0.99 1.26 -0.56 2.00 3.04 -1.22 -3.29 116.25 118.48 1br0 h VAL 89 Ca 0.24 -1.71 0.01 0.00 -1.01 0.00 0.00 66.70 64.23 1br0 h VAL 89 Cb 0.18 2.28 -0.03 0.00 -2.01 0.00 0.00 31.29 31.71 1br0 h VAL 89 CO -0.02 0.39 0.36 0.08 -1.01 0.00 0.00 177.57 177.36 1br0 h ARG 90 N -0.90 0.70 0.00 4.17 0.11 -1.10 -1.85 114.38 115.50 1br0 h ARG 90 Ca -0.01 -0.04 -0.00 0.00 0.10 0.00 0.00 59.98 60.03 1br0 h ARG 90 Cb 0.68 -0.16 -0.00 0.00 1.11 0.00 0.00 29.97 31.60 1br0 h ARG 90 CO 0.01 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 0.05 0.08 0.02 -1.74 -2.04 113.55 110.63 1br0 h SER 91 Ca 0.21 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.09 1br0 h SER 91 Cb -0.04 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.51 1br0 h SER 91 CO -0.07 0.00 -0.31 0.50 -1.14 0.00 0.00 176.83 175.82 1br0 h LYS 92 N 0.00 0.12 0.00 3.45 1.63 -1.41 -3.19 116.57 117.17 1br0 h LYS 92 Ca -0.00 -0.20 -0.01 0.00 -0.85 0.00 0.00 60.65 59.60 1br0 h LYS 92 Cb 0.01 0.07 -0.00 0.00 -0.60 0.00 0.00 32.23 31.71 1br0 h LYS 92 CO 0.00 1.08 -0.03 1.37 -3.45 0.00 0.00 179.45 178.42 1br0 h LEU 93 N -0.73 0.00 0.13 5.20 8.10 -1.53 -3.22 115.31 123.25 1br0 h LEU 93 Ca -0.05 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.93 1br0 h LEU 93 Cb 1.23 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.45 1br0 h LEU 93 CO 0.06 0.03 -0.06 0.50 -4.11 0.00 0.00 178.44 174.85 1br0 h LYS 94 N 0.00 -0.17 -0.28 0.17 1.63 -1.48 -2.80 116.57 113.64 1br0 h LYS 94 Ca -0.00 0.01 0.08 0.00 -0.85 0.00 0.00 60.65 59.89 1br0 h LYS 94 Cb 0.54 0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 32.19 1br0 h LYS 94 CO 0.00 -0.10 0.49 0.77 -3.45 0.00 0.00 179.45 177.16 1br0 h SER 95 N -0.19 0.00 0.12 4.20 0.02 -1.56 -0.29 113.55 115.85 1br0 h SER 95 Ca -0.02 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 1br0 h SER 95 Cb 0.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1br0 h SER 95 CO 0.03 0.00 -0.06 0.40 -1.14 0.00 0.00 176.83 176.06 1br0 h ILE 96 N 0.00 1.00 -0.33 3.27 1.08 -1.61 -2.57 117.51 118.35 1br0 h ILE 96 Ca 0.13 -1.26 -0.03 0.00 -0.39 0.00 0.00 64.86 63.32 1br0 h ILE 96 Cb 1.11 1.69 -0.02 0.00 -3.07 0.00 0.00 36.82 36.53 1br0 h ILE 96 CO -0.00 0.27 0.09 -0.08 -0.69 0.00 0.00 178.15 177.73 1br0 h GLU 97 N -0.83 0.48 -0.45 2.37 4.22 -1.13 -2.69 114.58 116.54 1br0 h GLU 97 Ca -0.02 -0.07 -0.05 0.00 0.08 0.00 0.00 59.36 59.31 1br0 h GLU 97 Cb 0.56 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 1br0 h GLU 97 CO 0.03 0.44 0.09 1.96 -2.18 0.00 0.00 179.01 179.35 1br0 h GLN 98 N 0.48 0.73 0.00 1.92 1.08 -1.21 -2.32 115.11 115.79 1br0 h GLN 98 Ca 0.11 -0.18 -0.07 0.00 -1.45 0.00 0.00 58.65 57.06 1br0 h GLN 98 Cb 0.17 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.50 1br0 h GLN 98 CO -0.01 0.74 -0.32 0.77 -0.95 0.00 0.00 178.83 179.06 1br0 h SER 99 N 0.60 0.00 0.00 1.46 0.02 -1.41 -2.85 113.55 111.37 1br0 h SER 99 Ca 0.14 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1br0 h SER 99 Cb 0.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1br0 h SER 99 CO 0.00 0.32 -0.00 0.40 -1.14 0.00 0.00 176.83 176.41 1br0 h ILE 100 N 0.00 0.03 -1.06 3.27 2.04 -1.57 -3.11 117.51 117.12 1br0 h ILE 100 Ca -0.00 -1.02 0.31 0.00 1.00 0.00 0.00 64.86 65.14 1br0 h ILE 100 Cb 1.01 0.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 1br0 h ILE 100 CO 0.04 0.01 1.06 -0.08 0.00 0.00 0.00 178.15 179.18 1br0 h GLU 101 N -1.00 0.00 0.08 2.37 4.22 -1.54 -0.39 114.58 118.31 1br0 h GLU 101 Ca -0.00 0.00 -0.33 0.00 0.08 0.00 0.00 59.36 59.11 1br0 h GLU 101 Cb 0.02 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1br0 h GLU 101 CO 0.00 0.00 -1.84 0.37 -2.18 0.00 0.00 179.01 175.36 1br0 h GLN 102 N 0.00 0.16 0.00 1.92 4.15 -1.66 -3.37 115.11 116.31 1br0 h GLN 102 Ca 0.50 -0.28 0.00 0.00 0.77 0.00 0.00 58.65 59.65 1br0 h GLN 102 Cb 2.61 0.10 0.00 0.00 0.21 0.00 0.00 27.48 30.41 1br0 h GLN 102 CO -0.01 0.93 0.00 0.39 -1.93 0.00 0.00 178.83 178.21 1br0 n GLU 103 N -3.31 0.89 0.07 1.69 4.71 -0.32 -4.00 120.64 120.37 1br0 n GLU 103 Ca -0.25 0.00 -0.04 0.00 -0.01 0.00 0.00 57.16 56.87 1br0 n GLU 103 Cb 1.05 -1.33 -0.02 0.00 -1.01 0.00 0.00 31.44 30.13 1br0 n GLU 103 CO 0.00 0.00 0.00 1.05 0.09 0.00 0.00 177.13 178.27 1br0 h GLU 104 N 0.00 -0.23 -0.64 3.49 -0.00 -1.31 -3.34 114.58 112.56 1br0 h GLU 104 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 59.36 59.38 1br0 h GLU 104 Cb 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 28.75 28.80 1br0 h GLU 104 CO 0.00 -0.15 0.00 0.41 -0.00 0.00 0.00 179.01 179.27 1br0 n GLY 105 N 0.99 2.32 0.02 1.06 0.00 -1.26 -4.24 105.19 104.09 1br0 n GLY 105 Ca -0.03 -0.71 -0.00 0.00 0.00 0.00 0.00 46.02 45.28 1br0 n GLY 105 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1br0 h LEU 106 N 3.42 -0.01 -5.08 0.99 6.46 -1.70 -3.48 115.31 115.91 1br0 h LEU 106 Ca 0.00 0.00 0.09 0.00 -0.12 0.00 0.00 57.88 57.85 1br0 h LEU 106 Cb 1.30 0.00 -0.16 0.00 -0.73 0.00 0.00 40.66 41.07 1br0 h LEU 106 CO 0.22 0.20 -0.09 0.54 -0.62 0.00 0.00 178.44 178.68 1br0 s ASN 107 N -4.02 -0.21 -0.21 1.25 4.22 -1.25 -5.12 114.94 109.59 1br0 s ASN 107 Ca -0.00 -0.17 -0.11 0.00 -2.14 0.00 0.00 52.86 50.44 1br0 s ASN 107 Cb 0.00 0.27 0.07 0.00 1.28 0.00 0.00 41.25 42.88 1br0 s ASN 107 CO 0.00 -0.02 0.50 -0.13 -2.04 0.00 0.00 177.10 175.41 1br0 s ARG 108 N 1.54 0.47 -0.38 3.55 0.52 -1.25 -5.03 118.95 118.38 1br0 s ARG 108 Ca 0.18 0.99 0.02 0.00 -0.52 0.00 0.00 55.73 56.39 1br0 s ARG 108 Cb 0.08 0.14 0.15 0.00 0.52 0.00 0.00 34.95 35.84 1br0 s ARG 108 CO -0.14 -0.18 0.27 -1.54 0.02 0.00 0.00 175.30 173.74 1br0 s SER 109 N 1.77 2.25 0.03 0.23 1.04 -1.26 -4.90 113.70 112.87 1br0 s SER 109 Ca -0.08 -2.51 -0.17 0.00 0.48 0.00 0.00 55.95 53.67 1br0 s SER 109 Cb -0.08 -0.36 0.03 0.00 0.10 0.00 0.00 66.02 65.71 1br0 s SER 109 CO -0.15 -0.25 0.38 -0.44 0.98 0.00 0.00 173.24 173.76 1br0 s SER 110 N 0.69 -0.25 -0.76 7.02 0.01 -1.26 -5.10 113.70 114.05 1br0 s SER 110 Ca 0.24 -0.01 -0.11 0.00 1.31 0.00 0.00 55.95 57.39 1br0 s SER 110 Cb -0.12 0.40 0.20 0.00 0.21 0.00 0.00 66.02 66.71 1br0 s SER 110 CO -0.07 -0.62 0.66 0.00 0.41 0.00 0.00 173.24 173.61 1br0 s ALA 111 N -2.30 3.92 0.04 1.44 0.00 -1.26 -4.03 121.76 119.57 1br0 s ALA 111 Ca -0.06 -3.28 0.00 0.00 0.00 0.00 0.00 51.96 48.62 1br0 s ALA 111 Cb -0.01 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.85 1br0 s ALA 111 CO -0.01 -2.22 0.00 -3.47 0.00 0.00 0.00 175.76 170.06 1br0 n ASP 112 N 3.87 -0.36 0.28 0.00 -0.08 -1.26 -4.83 116.55 114.17 1br0 n ASP 112 Ca 0.11 0.13 0.12 0.00 -1.51 0.00 0.00 54.79 53.64 1br0 n ASP 112 Cb 0.44 0.55 0.79 0.00 2.34 0.00 0.00 41.12 45.24 1br0 n ASP 112 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1br0 h LEU 113 N 0.00 0.00 0.07 -2.67 6.46 -2.01 -3.00 115.31 114.16 1br0 h LEU 113 Ca 0.00 0.00 -0.30 0.00 -0.12 0.00 0.00 57.88 57.46 1br0 h LEU 113 Cb 0.00 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 39.91 1br0 h LEU 113 CO 0.00 0.02 -1.66 0.54 -0.62 0.00 0.00 178.44 176.72 1br0 n ARG 114 N -4.09 0.67 -0.09 1.25 5.12 -1.26 -2.88 116.66 115.39 1br0 n ARG 114 Ca -0.03 0.41 -0.06 0.00 -1.93 0.00 0.00 57.85 56.24 1br0 n ARG 114 Cb 0.11 -1.73 -0.00 0.00 -1.16 0.00 0.00 32.46 29.68 1br0 n ARG 114 CO 0.00 0.00 0.00 0.82 -1.93 0.00 0.00 177.63 176.52 1br0 h ILE 115 N -0.43 0.65 -0.70 0.55 2.04 -1.88 -0.67 117.51 117.07 1br0 h ILE 115 Ca -0.39 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.41 1br0 h ILE 115 Cb 1.70 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 38.40 1br0 h ILE 115 CO -0.05 0.00 0.19 0.03 0.00 0.00 0.00 178.15 178.32 1br0 h ARG 116 N -0.02 1.10 -0.18 2.37 3.08 -1.67 -2.75 114.38 116.32 1br0 h ARG 116 Ca 0.16 -0.25 -0.08 0.00 0.07 0.00 0.00 59.98 59.88 1br0 h ARG 116 Cb 0.26 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1br0 h ARG 116 CO -0.34 0.96 -0.26 0.87 -1.07 0.00 0.00 179.97 180.13 1br0 h LYS 117 N 1.05 0.33 -0.79 0.04 1.79 -1.45 -2.50 116.57 115.04 1br0 h LYS 117 Ca 0.22 -0.12 0.04 0.00 -2.18 0.00 0.00 60.65 58.62 1br0 h LYS 117 Cb 0.34 -0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.92 1br0 h LYS 117 CO -0.00 0.57 0.49 1.15 -1.08 0.00 0.00 179.45 180.58 1br0 h THR 118 N 0.29 1.09 -0.14 -0.16 2.02 -0.83 -1.19 112.91 114.00 1br0 h THR 118 Ca 0.05 -0.32 -0.10 0.00 0.77 0.00 0.00 66.41 66.80 1br0 h THR 118 Cb 0.62 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.09 1br0 h THR 118 CO 0.04 0.17 -0.30 1.56 0.37 0.00 0.00 175.52 177.37 1br0 h GLN 119 N 0.95 0.45 -0.42 6.66 1.08 -1.54 -3.08 115.11 119.21 1br0 h GLN 119 Ca 0.32 -0.30 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 1br0 h GLN 119 Cb 0.06 0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.50 1br0 h GLN 119 CO -0.13 0.91 0.22 1.25 -0.95 0.00 0.00 178.83 180.12 1br0 h HIS 120 N 0.06 0.56 -0.42 2.96 2.76 -1.41 0.18 115.15 119.85 1br0 h HIS 120 Ca 0.00 -0.00 -0.15 0.00 -2.20 0.00 0.00 60.37 58.02 1br0 h HIS 120 Cb 0.90 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 29.67 1br0 h HIS 120 CO 0.10 0.40 -0.31 0.77 -1.30 0.00 0.00 177.93 177.59 1br0 h SER 121 N 0.58 1.00 -0.27 3.26 0.02 -1.33 -0.47 113.55 116.34 1br0 h SER 121 Ca 0.15 -0.44 -0.10 0.00 -0.84 0.00 0.00 61.79 60.56 1br0 h SER 121 Cb 0.04 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 1br0 h SER 121 CO -0.02 1.23 -0.22 0.74 -1.14 0.00 0.00 176.83 177.42 1br0 h THR 122 N 0.78 1.31 -0.33 -2.27 2.02 -1.46 -0.65 112.91 112.31 1br0 h THR 122 Ca 0.08 -1.36 0.03 0.00 0.77 0.00 0.00 66.41 65.93 1br0 h THR 122 Cb 0.90 1.59 -0.03 0.00 -1.74 0.00 0.00 68.15 68.88 1br0 h THR 122 CO 0.08 0.43 0.14 -0.07 0.37 0.00 0.00 175.52 176.48 1br0 h LEU 123 N 0.35 0.19 -0.78 2.58 3.38 -1.05 -2.71 115.31 117.26 1br0 h LEU 123 Ca 0.05 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 1br0 h LEU 123 Cb 0.77 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 1br0 h LEU 123 CO 0.06 0.15 0.25 -1.28 0.09 0.00 0.00 178.44 177.70 1br0 h SER 124 N 0.30 1.09 -0.67 -0.43 0.87 -1.15 -2.33 113.55 111.23 1br0 h SER 124 Ca 0.14 -0.20 0.07 0.00 -1.23 0.00 0.00 61.79 60.58 1br0 h SER 124 Cb 0.09 -0.28 -0.06 0.00 -0.44 0.00 0.00 62.40 61.70 1br0 h SER 124 CO -0.12 1.00 0.35 -0.09 -0.53 0.00 0.00 176.83 177.44 1br0 h ARG 125 N 1.12 0.62 0.00 2.24 2.43 -1.01 -0.23 114.38 119.56 1br0 h ARG 125 Ca 0.25 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.28 1br0 h ARG 125 Cb 0.29 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 1br0 h ARG 125 CO -0.01 0.41 -0.47 -0.22 -1.51 0.00 0.00 179.97 178.16 1br0 h LYS 126 N 0.64 0.00 -0.65 0.20 3.64 -1.53 -2.62 116.57 116.24 1br0 h LYS 126 Ca 0.32 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.61 1br0 h LYS 126 Cb 0.26 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 1br0 h LYS 126 CO -0.22 0.47 0.07 0.35 -2.27 0.00 0.00 179.45 177.85 1br0 h PHE 127 N 0.00 1.18 0.06 1.91 3.57 -0.78 -2.77 116.94 120.11 1br0 h PHE 127 Ca -0.00 -0.18 -0.16 0.00 3.53 0.00 0.00 57.97 61.16 1br0 h PHE 127 Cb 0.99 -0.32 0.02 0.00 2.79 0.00 0.00 35.95 39.43 1br0 h PHE 127 CO 0.00 1.00 -0.67 0.28 -2.23 0.00 0.00 178.31 176.69 1br0 h VAL 128 N 1.02 1.48 0.00 1.41 2.07 -1.15 -0.07 116.25 121.01 1br0 h VAL 128 Ca 0.19 -2.28 0.00 0.00 0.82 0.00 0.00 66.70 65.43 1br0 h VAL 128 Cb 0.49 2.88 0.00 0.00 -1.52 0.00 0.00 31.29 33.14 1br0 h VAL 128 CO 0.02 0.65 0.05 -0.62 0.02 0.00 0.00 177.57 177.69 1br0 n GLU 129 N -4.20 0.00 -0.00 1.57 -0.58 -0.99 -2.65 120.64 113.79 1br0 n GLU 129 Ca -0.12 0.43 -0.01 0.00 -0.42 0.00 0.00 57.16 57.04 1br0 n GLU 129 Cb 0.73 -1.55 -0.00 0.00 -0.57 0.00 0.00 31.44 30.05 1br0 n GLU 129 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1br0 n VAL 130 N -1.43 0.41 -0.10 2.62 0.31 -1.05 -4.58 118.33 114.51 1br0 n VAL 130 Ca 0.00 0.23 -0.10 0.00 -0.01 0.00 0.00 64.34 64.47 1br0 n VAL 130 Cb 0.05 -1.42 -0.03 0.00 -0.91 0.00 0.00 33.84 31.53 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 -0.13 0.45 0.00 5.55 2.86 -1.09 0.52 114.93 123.10 1br0 h MET 131 Ca 0.00 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1br0 h MET 131 Cb 0.13 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.71 1br0 h MET 131 CO 0.00 0.48 -0.04 0.77 1.06 0.00 0.00 176.91 179.18 1br0 h SER 132 N 0.33 0.00 -0.02 1.22 0.02 -1.69 -0.45 113.55 112.96 1br0 h SER 132 Ca 0.10 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.93 1br0 h SER 132 Cb 0.20 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.75 1br0 h SER 132 CO -0.01 0.04 -0.47 -0.08 -1.14 0.00 0.00 176.83 175.17 1br0 h GLU 133 N 0.00 0.35 -0.56 3.45 4.57 -1.45 -3.31 114.58 117.62 1br0 h GLU 133 Ca -0.00 -0.35 0.01 0.00 -1.18 0.00 0.00 59.36 57.84 1br0 h GLU 133 Cb 0.26 0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.91 1br0 h GLU 133 CO 0.00 1.03 0.37 -0.92 -1.18 0.00 0.00 179.01 178.32 1br0 h TYR 134 N -0.20 0.71 -0.98 0.92 3.20 -0.75 -2.87 116.97 117.00 1br0 h TYR 134 Ca -0.05 0.02 0.23 0.00 3.14 0.00 0.00 58.73 62.06 1br0 h TYR 134 Cb 1.18 -0.24 -0.12 0.00 1.54 0.00 0.00 36.73 39.09 1br0 h TYR 134 CO 0.15 0.45 0.56 -0.91 -1.64 0.00 0.00 178.16 176.76 1br0 h ASN 135 N 0.76 0.63 1.34 -2.11 4.21 -1.17 -0.79 115.58 118.45 1br0 h ASN 135 Ca 0.21 0.13 -0.07 0.00 1.21 0.00 0.00 56.30 57.77 1br0 h ASN 135 Cb -0.09 0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.14 1br0 h ASN 135 CO -0.04 0.12 -0.36 0.00 -1.29 0.00 0.00 177.43 175.86 1br0 h ALA 136 N 1.71 0.83 -0.07 -0.83 0.00 -1.60 -3.30 119.26 116.00 1br0 h ALA 136 Ca 0.61 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1br0 h ALA 136 Cb 1.13 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1br0 h ALA 136 CO -0.47 0.44 0.01 1.15 0.00 0.00 0.00 179.25 180.38 1br0 h THR 137 N 0.00 1.23 -0.12 0.00 2.02 -1.01 -1.92 112.91 113.11 1br0 h THR 137 Ca -0.00 -0.71 -0.06 0.00 0.77 0.00 0.00 66.41 66.41 1br0 h THR 137 Cb 1.12 1.58 -0.00 0.00 -1.74 0.00 0.00 68.15 69.11 1br0 h THR 137 CO 0.05 0.20 -0.15 -0.61 0.37 0.00 0.00 175.52 175.37 1br0 h GLN 138 N -0.15 0.32 0.00 6.66 4.15 -1.64 -2.40 115.11 122.05 1br0 h GLN 138 Ca 0.02 -0.18 -0.12 0.00 0.77 0.00 0.00 58.65 59.14 1br0 h GLN 138 Cb 0.31 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.99 1br0 h GLN 138 CO 0.00 0.74 -0.56 0.77 -1.93 0.00 0.00 178.83 177.85 1br0 h SER 139 N -0.08 0.00 1.48 -0.69 0.02 -1.71 -3.03 113.55 109.54 1br0 h SER 139 Ca 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1br0 h SER 139 Cb 0.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1br0 h SER 139 CO 0.04 0.56 0.00 -0.78 -1.14 0.00 0.00 176.83 175.51 1br0 h ASP 140 N 0.00 0.00 0.37 3.07 3.58 -1.45 0.01 116.42 122.00 1br0 h ASP 140 Ca -0.01 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.43 1br0 h ASP 140 Cb 1.02 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.07 1br0 h ASP 140 CO 0.07 0.00 -0.18 0.22 -2.88 0.00 0.00 179.24 176.48 1br0 h TYR 141 N 0.00 -0.46 -0.00 0.28 3.20 -1.35 -3.33 116.97 115.31 1br0 h TYR 141 Ca 0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1br0 h TYR 141 Cb 0.74 0.15 0.00 0.00 1.54 0.00 0.00 36.73 39.16 1br0 h TYR 141 CO 0.00 -0.29 -0.16 2.89 -1.64 0.00 0.00 178.16 178.97 1br0 n ARG 142 N -4.15 0.02 -3.35 1.82 -4.01 -1.15 -1.05 116.66 104.78 1br0 n ARG 142 Ca -0.06 -0.00 -0.26 0.00 -1.04 0.00 0.00 57.85 56.49 1br0 n ARG 142 Cb 0.19 -1.50 -0.09 0.00 -3.04 0.00 0.00 32.46 28.03 1br0 n ARG 142 CO 0.00 0.00 0.00 0.39 -3.04 0.00 0.00 177.63 174.98 1br0 n GLU 143 N -1.49 0.86 0.00 2.89 1.02 -0.01 -3.97 120.64 119.94 1br0 n GLU 143 Ca 0.07 -3.50 0.00 0.00 -0.02 0.00 0.00 57.16 53.71 1br0 n GLU 143 Cb 0.34 -1.59 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 1br0 n GLU 143 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1br0 n ARG 144 N 1.87 0.00 0.00 3.49 0.63 -1.25 -4.44 116.66 116.96 1br0 n ARG 144 Ca 0.25 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.18 1br0 n ARG 144 Cb 0.48 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.39 1br0 n ARG 144 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1br0 n SER 145 N -0.38 0.00 0.00 6.15 3.41 -0.22 -5.07 113.62 117.51 1br0 n SER 145 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1br0 n SER 145 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1br0 n SER 145 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17