#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2br9 h ARG 4 N 0.00 0.24 -0.49 -0.67 2.43 -1.99 0.14 114.38 114.04 2br9 h ARG 4 Ca 0.00 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.07 2br9 h ARG 4 Cb 0.00 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 2br9 h ARG 4 CO 0.00 0.16 -0.03 0.93 -1.51 0.00 0.00 179.97 179.52 2br9 h GLU 5 N 0.25 0.83 -0.45 0.20 3.07 -2.04 -1.90 114.58 114.55 2br9 h GLU 5 Ca 0.45 -0.25 -0.02 0.00 -0.50 0.00 0.00 59.36 59.04 2br9 h GLU 5 Cb 0.80 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.61 2br9 h GLU 5 CO -0.56 0.86 0.20 -0.44 -1.40 0.00 0.00 179.01 177.67 2br9 h ASP 6 N 0.77 0.59 -0.65 1.42 5.19 -1.87 -0.62 116.42 121.25 2br9 h ASP 6 Ca 0.14 -0.14 -0.07 0.00 -0.62 0.00 0.00 57.03 56.34 2br9 h ASP 6 Cb 0.51 -0.15 -0.03 0.00 0.18 0.00 0.00 39.33 39.84 2br9 h ASP 6 CO 0.03 0.57 0.15 -0.07 -3.12 0.00 0.00 179.24 176.80 2br9 h LEU 7 N 0.58 1.00 -0.56 1.55 3.38 -0.44 -0.24 115.31 120.58 2br9 h LEU 7 Ca 0.15 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2br9 h LEU 7 Cb 0.14 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2br9 h LEU 7 CO -0.02 0.98 0.23 0.58 0.09 0.00 0.00 178.44 180.31 2br9 h VAL 8 N 0.97 1.22 -0.31 1.22 2.07 -1.16 0.58 116.25 120.85 2br9 h VAL 8 Ca 0.20 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 2br9 h VAL 8 Cb 0.38 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 2br9 h VAL 8 CO 0.00 0.26 0.15 0.22 0.02 0.00 0.00 177.57 178.23 2br9 h TYR 9 N 0.76 0.44 -0.90 1.57 5.03 -0.86 -0.93 116.97 122.09 2br9 h TYR 9 Ca 0.19 -0.02 0.09 0.00 2.58 0.00 0.00 58.73 61.57 2br9 h TYR 9 Cb 0.18 -0.14 -0.06 0.00 1.55 0.00 0.00 36.73 38.26 2br9 h TYR 9 CO 0.01 0.38 0.58 1.96 -1.32 0.00 0.00 178.16 179.77 2br9 h GLN 10 N 0.37 0.88 -0.53 1.82 4.20 -0.81 -0.92 115.11 120.12 2br9 h GLN 10 Ca 0.11 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 2br9 h GLN 10 Cb 0.10 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 2br9 h GLN 10 CO -0.01 0.58 0.21 0.00 -0.67 0.00 0.00 178.83 178.94 2br9 h ALA 11 N 1.55 0.69 -0.30 3.87 0.00 -0.44 -0.96 119.26 123.67 2br9 h ALA 11 Ca 0.41 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 55.08 2br9 h ALA 11 Cb 0.38 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2br9 h ALA 11 CO -0.17 0.31 -0.15 0.87 0.00 0.00 0.00 179.25 180.10 2br9 h LYS 12 N 0.72 0.53 -0.22 0.00 1.57 -0.70 0.92 116.57 119.39 2br9 h LYS 12 Ca 0.18 -0.17 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 2br9 h LYS 12 Cb 0.20 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2br9 h LYS 12 CO -0.01 0.67 -0.11 -0.07 -0.57 0.00 0.00 179.45 179.36 2br9 h LEU 13 N 0.48 0.48 -1.13 2.94 3.38 -0.96 -1.36 115.31 119.14 2br9 h LEU 13 Ca 0.08 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 2br9 h LEU 13 Cb 0.55 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 2br9 h LEU 13 CO 0.04 0.78 0.51 0.00 0.09 0.00 0.00 178.44 179.85 2br9 h ALA 14 N 0.71 1.35 -0.28 1.53 0.00 -0.87 -1.40 119.26 120.30 2br9 h ALA 14 Ca 0.05 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2br9 h ALA 14 Cb 0.60 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2br9 h ALA 14 CO 0.03 0.57 0.04 1.49 0.00 0.00 0.00 179.25 181.38 2br9 h GLU 15 N 1.12 0.47 -0.86 0.00 4.81 -0.53 0.21 114.58 119.81 2br9 h GLU 15 Ca 0.30 -0.13 0.09 0.00 -0.13 0.00 0.00 59.36 59.48 2br9 h GLU 15 Cb -0.07 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.18 2br9 h GLU 15 CO -0.06 0.58 0.51 1.96 -0.73 0.00 0.00 179.01 181.28 2br9 h GLN 16 N 0.28 0.85 0.00 1.92 1.08 -0.96 -1.93 115.11 116.36 2br9 h GLN 16 Ca 0.09 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 2br9 h GLN 16 Cb 0.34 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.58 2br9 h GLN 16 CO 0.01 0.56 0.00 0.00 -0.95 0.00 0.00 178.83 178.45 2br9 n ALA 17 N -2.37 2.39 -3.73 3.87 0.00 -0.55 -4.92 120.51 115.20 2br9 n ALA 17 Ca 0.14 -0.12 -0.26 0.00 0.00 0.00 0.00 53.44 53.19 2br9 n ALA 17 Cb 0.25 -1.47 0.06 0.00 0.00 0.00 0.00 19.45 18.28 2br9 n ALA 17 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2br9 n GLU 18 N -1.38 -6.80 -3.37 0.00 1.02 -0.32 -4.96 120.64 104.83 2br9 n GLU 18 Ca 0.11 0.72 -0.39 0.00 -0.02 0.00 0.00 57.16 57.59 2br9 n GLU 18 Cb 0.28 -5.70 -0.03 0.00 -0.02 0.00 0.00 31.44 25.97 2br9 n GLU 18 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2br9 n ARG 19 N -4.82 3.34 0.27 3.49 1.74 -0.09 -4.92 116.66 115.67 2br9 n ARG 19 Ca 0.00 -4.53 0.16 0.00 -0.77 0.00 0.00 57.85 52.71 2br9 n ARG 19 Cb 0.55 -2.45 0.69 0.00 -1.02 0.00 0.00 32.46 30.24 2br9 n ARG 19 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 2br9 h TYR 20 N 5.70 0.00 -0.29 -1.55 0.05 -1.93 -2.30 116.97 116.65 2br9 h TYR 20 Ca 0.18 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.96 2br9 h TYR 20 Cb 0.74 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.47 2br9 h TYR 20 CO 0.81 0.06 0.17 -0.44 -1.05 0.00 0.00 178.16 177.71 2br9 h ASP 21 N 0.00 0.35 -0.12 3.88 3.32 -1.91 -0.06 116.42 121.88 2br9 h ASP 21 Ca -0.00 -0.06 -0.14 0.00 0.02 0.00 0.00 57.03 56.85 2br9 h ASP 21 Cb 0.50 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 2br9 h ASP 21 CO 0.01 0.31 -0.39 -0.33 -1.72 0.00 0.00 179.24 177.12 2br9 h GLU 22 N 0.37 0.64 -0.61 3.56 5.08 -1.85 -2.41 114.58 119.36 2br9 h GLU 22 Ca 0.10 -0.33 0.07 0.00 -1.00 0.00 0.00 59.36 58.21 2br9 h GLU 22 Cb 0.03 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.22 2br9 h GLU 22 CO -0.02 0.93 0.29 1.98 -1.00 0.00 0.00 179.01 181.19 2br9 h MET 23 N 0.53 0.51 -0.55 2.33 4.05 -1.03 -1.69 114.93 119.08 2br9 h MET 23 Ca 0.05 -0.03 0.01 0.00 -0.28 0.00 0.00 59.70 59.45 2br9 h MET 23 Cb 0.91 -0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 31.57 2br9 h MET 23 CO 0.08 0.34 0.35 0.28 0.23 0.00 0.00 176.91 178.19 2br9 h VAL 24 N 0.53 1.11 -0.66 -5.77 2.07 -0.81 -1.90 116.25 110.81 2br9 h VAL 24 Ca 0.29 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 2br9 h VAL 24 Cb 0.27 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 2br9 h VAL 24 CO -0.23 0.13 0.37 -0.33 0.02 0.00 0.00 177.57 177.52 2br9 h GLU 25 N 0.71 0.92 -0.31 1.57 5.08 -0.93 0.35 114.58 121.96 2br9 h GLU 25 Ca 0.21 -0.11 -0.09 0.00 -1.00 0.00 0.00 59.36 58.38 2br9 h GLU 25 Cb -0.04 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 2br9 h GLU 25 CO -0.07 0.69 -0.14 0.77 -1.00 0.00 0.00 179.01 179.26 2br9 h SER 26 N 0.90 0.66 0.27 1.42 0.02 -1.13 -2.75 113.55 112.95 2br9 h SER 26 Ca 0.23 -0.40 -0.18 0.00 -0.84 0.00 0.00 61.79 60.60 2br9 h SER 26 Cb 0.03 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 2br9 h SER 26 CO -0.04 0.92 -0.72 0.24 -1.14 0.00 0.00 176.83 176.09 2br9 h MET 27 N 0.41 0.39 -0.72 3.45 2.86 -1.07 -2.90 114.93 117.35 2br9 h MET 27 Ca 0.07 -0.31 0.10 0.00 -2.06 0.00 0.00 59.70 57.49 2br9 h MET 27 Cb 0.66 0.06 -0.07 0.00 0.06 0.00 0.00 31.60 32.31 2br9 h MET 27 CO 0.04 0.95 0.36 0.87 1.06 0.00 0.00 176.91 180.20 2br9 h LYS 28 N 0.27 0.59 -0.90 1.72 1.57 -0.26 -1.31 116.57 118.24 2br9 h LYS 28 Ca -0.03 -0.04 0.10 0.00 -1.87 0.00 0.00 60.65 58.81 2br9 h LYS 28 Cb 1.29 -0.13 -0.08 0.00 0.08 0.00 0.00 32.23 33.39 2br9 h LYS 28 CO 0.12 0.39 0.55 0.87 -0.57 0.00 0.00 179.45 180.81 2br9 h LYS 29 N 0.61 0.88 -0.34 3.15 1.57 -1.30 0.57 116.57 121.71 2br9 h LYS 29 Ca 0.36 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 59.04 2br9 h LYS 29 Cb 0.38 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2br9 h LYS 29 CO -0.27 0.59 0.05 0.28 -0.57 0.00 0.00 179.45 179.53 2br9 h VAL 30 N 0.91 1.24 -0.47 0.50 2.07 -1.27 -2.74 116.25 116.48 2br9 h VAL 30 Ca 0.43 -0.83 -0.04 0.00 0.82 0.00 0.00 66.70 67.08 2br9 h VAL 30 Cb 0.37 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 2br9 h VAL 30 CO -0.24 0.28 0.11 0.00 0.02 0.00 0.00 177.57 177.74 2br9 h ALA 31 N 0.90 1.32 0.00 1.67 0.00 -0.81 -1.52 119.26 120.81 2br9 h ALA 31 Ca 0.10 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2br9 h ALA 31 Cb 0.35 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2br9 h ALA 31 CO 0.01 0.48 0.02 0.78 0.00 0.00 0.00 179.25 180.54 2br9 h GLY 32 N 0.89 0.00 1.93 0.00 0.00 -0.58 -2.75 103.07 102.56 2br9 h GLY 32 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2br9 h GLY 32 CO -0.00 0.00 0.00 1.03 0.00 0.00 0.00 176.54 177.57 2br9 n MET 33 N -2.76 0.05 -3.50 4.80 2.81 -0.57 -4.92 117.12 113.03 2br9 n MET 33 Ca -0.02 0.12 -0.21 0.00 -1.81 0.00 0.00 57.70 55.78 2br9 n MET 33 Cb 0.07 -1.50 0.08 0.00 -0.71 0.00 0.00 33.22 31.16 2br9 n MET 33 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2br9 n ASP 34 N -1.47 -4.54 -4.24 7.83 8.00 -1.04 -5.00 116.55 116.09 2br9 n ASP 34 Ca 0.06 -0.56 -0.14 0.00 0.71 0.00 0.00 54.79 54.86 2br9 n ASP 34 Cb 0.24 -4.98 -0.10 0.00 -0.02 0.00 0.00 41.12 36.27 2br9 n ASP 34 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2br9 s VAL 35 N -3.33 1.09 0.09 2.53 -7.23 -1.26 -4.85 120.40 107.44 2br9 s VAL 35 Ca 0.34 -2.04 -0.31 0.00 -1.81 0.00 0.00 61.98 58.16 2br9 s VAL 35 Cb -0.15 -1.86 -0.10 0.00 0.56 0.00 0.00 36.38 34.83 2br9 s VAL 35 CO 0.71 -0.73 1.81 -0.70 -0.31 0.00 0.00 175.10 175.89 2br9 s GLU 36 N -3.77 4.15 0.40 4.82 2.56 -1.26 -4.90 118.70 120.70 2br9 s GLU 36 Ca 0.17 2.54 -0.23 0.00 0.00 0.00 0.00 54.97 57.45 2br9 s GLU 36 Cb 0.03 -3.70 -0.10 0.00 2.00 0.00 0.00 34.13 32.36 2br9 s GLU 36 CO 0.00 -0.84 0.97 -0.51 -0.56 0.00 0.00 175.26 174.32 2br9 s LEU 37 N 3.04 4.08 1.04 2.70 1.43 -1.26 -5.06 118.68 124.65 2br9 s LEU 37 Ca 0.81 1.81 -0.12 0.00 -1.03 0.00 0.00 54.13 55.59 2br9 s LEU 37 Cb -0.44 -4.33 0.21 0.00 0.03 0.00 0.00 46.19 41.66 2br9 s LEU 37 CO 0.36 -0.34 1.08 0.42 0.23 0.00 0.00 176.35 178.10 2br9 s THR 38 N -1.91 2.08 0.20 5.49 -4.23 -1.26 -4.78 115.64 111.23 2br9 s THR 38 Ca 0.58 0.03 -0.10 0.00 -1.18 0.00 0.00 61.69 61.02 2br9 s THR 38 Cb -0.15 -2.41 0.14 0.00 1.34 0.00 0.00 72.50 71.42 2br9 s THR 38 CO 0.19 -0.04 1.84 0.58 -0.54 0.00 0.00 174.62 176.65 2br9 h VAL 39 N -2.06 1.21 -0.37 2.29 2.07 -1.99 -0.09 116.25 117.31 2br9 h VAL 39 Ca -0.56 -0.48 0.02 0.00 0.82 0.00 0.00 66.70 66.50 2br9 h VAL 39 Cb 1.33 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 2br9 h VAL 39 CO 0.56 0.22 0.19 -0.08 0.02 0.00 0.00 177.57 178.48 2br9 h GLU 40 N 1.01 0.37 -0.48 1.57 4.81 -1.99 -1.19 114.58 118.68 2br9 h GLU 40 Ca 0.26 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.42 2br9 h GLU 40 Cb -0.02 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 2br9 h GLU 40 CO -0.05 0.25 0.10 0.93 -0.73 0.00 0.00 179.01 179.51 2br9 h GLU 41 N 0.38 0.77 -0.67 1.92 5.08 -1.82 -1.21 114.58 119.04 2br9 h GLU 41 Ca 0.15 -0.19 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 2br9 h GLU 41 Cb 0.05 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.16 2br9 h GLU 41 CO -0.10 0.76 0.42 0.00 -1.00 0.00 0.00 179.01 179.09 2br9 h ARG 42 N 0.65 0.79 -0.38 2.33 3.08 -0.86 0.68 114.38 120.67 2br9 h ARG 42 Ca 0.15 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 60.05 2br9 h ARG 42 Cb 0.35 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 2br9 h ARG 42 CO 0.00 0.53 -0.17 -0.91 -1.07 0.00 0.00 179.97 178.35 2br9 h ASN 43 N 0.82 0.71 -0.34 7.04 2.35 -0.96 -0.18 115.58 125.02 2br9 h ASN 43 Ca 0.27 -0.23 -0.08 0.00 -0.55 0.00 0.00 56.30 55.71 2br9 h ASN 43 Cb 0.02 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.18 2br9 h ASN 43 CO -0.10 0.89 -0.11 -0.07 -1.65 0.00 0.00 177.43 176.38 2br9 h LEU 44 N 0.63 0.69 -0.37 1.61 3.38 -0.86 0.25 115.31 120.64 2br9 h LEU 44 Ca 0.10 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2br9 h LEU 44 Cb 0.65 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2br9 h LEU 44 CO 0.05 0.91 0.23 0.25 0.09 0.00 0.00 178.44 179.97 2br9 h LEU 45 N 0.46 0.43 -0.38 1.67 6.46 -0.77 -1.15 115.31 122.03 2br9 h LEU 45 Ca 0.08 -0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.80 2br9 h LEU 45 Cb 0.62 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.43 2br9 h LEU 45 CO 0.04 0.34 0.19 -1.28 -0.62 0.00 0.00 178.44 177.11 2br9 h SER 46 N 0.49 0.49 -0.87 1.25 0.87 -0.75 -2.44 113.55 112.60 2br9 h SER 46 Ca 0.13 -0.11 -0.00 0.00 -1.23 0.00 0.00 61.79 60.58 2br9 h SER 46 Cb -0.02 -0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 61.77 2br9 h SER 46 CO -0.03 0.47 0.54 0.58 -0.53 0.00 0.00 176.83 177.86 2br9 h VAL 47 N 0.48 1.23 0.08 2.23 2.07 -0.29 0.66 116.25 122.71 2br9 h VAL 47 Ca 0.13 -0.48 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 2br9 h VAL 47 Cb 0.10 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.86 2br9 h VAL 47 CO -0.02 0.24 -0.04 0.00 0.02 0.00 0.00 177.57 177.77 2br9 h ALA 48 N 1.29 -0.10 -0.03 1.67 0.00 -0.88 -1.21 119.26 119.99 2br9 h ALA 48 Ca 0.31 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 2br9 h ALA 48 Cb -0.08 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2br9 h ALA 48 CO -0.06 -0.46 -0.55 1.88 0.00 0.00 0.00 179.25 180.06 2br9 h TYR 49 N -0.30 0.12 -0.61 0.00 0.05 -1.34 -1.76 116.97 113.12 2br9 h TYR 49 Ca -0.01 -0.04 -0.06 0.00 0.05 0.00 0.00 58.73 58.67 2br9 h TYR 49 Cb 0.26 -0.02 -0.03 0.00 1.01 0.00 0.00 36.73 37.95 2br9 h TYR 49 CO -0.01 0.63 0.16 -0.22 -1.05 0.00 0.00 178.16 177.67 2br9 h LYS 50 N 0.08 0.98 -0.26 4.88 3.64 -0.50 -0.08 116.57 125.30 2br9 h LYS 50 Ca -0.00 -0.23 -0.19 0.00 -1.27 0.00 0.00 60.65 58.96 2br9 h LYS 50 Cb 1.00 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 2br9 h LYS 50 CO 0.08 0.89 -0.57 -0.91 -2.27 0.00 0.00 179.45 176.66 2br9 h ASN 51 N 0.89 0.92 -0.29 4.20 2.35 -1.05 0.28 115.58 122.87 2br9 h ASN 51 Ca 0.19 -0.50 -0.05 0.00 -0.55 0.00 0.00 56.30 55.39 2br9 h ASN 51 Cb 0.34 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 2br9 h ASN 51 CO 0.00 1.29 0.00 0.58 -1.65 0.00 0.00 177.43 177.65 2br9 h VAL 52 N 0.62 1.26 0.01 2.81 2.07 -1.02 -2.35 116.25 119.64 2br9 h VAL 52 Ca 0.01 -0.93 -0.21 0.00 0.82 0.00 0.00 66.70 66.38 2br9 h VAL 52 Cb 1.17 1.29 -0.00 0.00 -1.52 0.00 0.00 31.29 32.23 2br9 h VAL 52 CO 0.12 0.30 -0.92 -0.29 0.02 0.00 0.00 177.57 176.80 2br9 h ILE 53 N 0.31 1.45 -0.99 4.57 6.09 -1.10 -3.25 117.51 124.60 2br9 h ILE 53 Ca 0.08 -2.57 0.02 0.00 -1.37 0.00 0.00 64.86 61.02 2br9 h ILE 53 Cb 0.43 2.47 -0.05 0.00 0.47 0.00 0.00 36.82 40.14 2br9 h ILE 53 CO 0.02 0.76 0.65 1.23 -3.07 0.00 0.00 178.15 177.73 2br9 h GLY 54 N 1.56 1.40 1.02 8.18 0.00 -0.86 0.11 103.07 114.49 2br9 h GLY 54 Ca -0.06 -0.51 -0.05 0.00 0.00 0.00 0.00 47.33 46.70 2br9 h GLY 54 CO 0.15 0.49 0.19 0.00 0.00 0.00 0.00 176.54 177.37 2br9 h ALA 55 N 1.39 0.84 -0.08 3.60 0.00 -1.45 -0.67 119.26 122.90 2br9 h ALA 55 Ca 0.37 -0.21 -0.18 0.00 0.00 0.00 0.00 54.91 54.89 2br9 h ALA 55 Cb -0.11 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2br9 h ALA 55 CO -0.09 0.52 -0.71 0.00 0.00 0.00 0.00 179.25 178.97 2br9 h ARG 56 N 0.93 0.37 -0.32 0.00 -0.00 -1.35 -1.41 114.38 112.59 2br9 h ARG 56 Ca 0.21 -0.30 -0.12 0.00 -0.50 0.00 0.00 59.98 59.27 2br9 h ARG 56 Cb 0.30 0.06 -0.01 0.00 0.00 0.00 0.00 29.97 30.32 2br9 h ARG 56 CO -0.01 0.94 -0.30 0.00 0.00 0.00 0.00 179.97 180.60 2br9 h ARG 57 N 0.26 0.67 -0.32 0.04 3.08 -0.51 0.76 114.38 118.36 2br9 h ARG 57 Ca -0.03 -0.30 -0.06 0.00 0.07 0.00 0.00 59.98 59.67 2br9 h ARG 57 Cb 1.28 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.30 2br9 h ARG 57 CO 0.12 0.89 -0.02 0.00 -1.07 0.00 0.00 179.97 179.90 2br9 h ALA 58 N 1.09 0.44 -0.67 0.04 0.00 -1.03 -1.14 119.26 118.00 2br9 h ALA 58 Ca 0.07 -0.25 0.08 0.00 0.00 0.00 0.00 54.91 54.80 2br9 h ALA 58 Cb 0.80 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.41 2br9 h ALA 58 CO 0.07 0.21 0.34 0.77 0.00 0.00 0.00 179.25 180.64 2br9 h SER 59 N 0.38 0.47 -0.40 0.00 0.02 -0.90 -1.48 113.55 111.64 2br9 h SER 59 Ca 0.09 0.05 -0.08 0.00 -0.84 0.00 0.00 61.79 61.01 2br9 h SER 59 Cb 0.47 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 2br9 h SER 59 CO 0.02 0.29 -0.05 -0.25 -1.14 0.00 0.00 176.83 175.70 2br9 h TRP 60 N 0.62 0.83 -0.52 3.45 7.01 -0.55 -0.19 115.95 126.60 2br9 h TRP 60 Ca 0.32 -0.16 -0.07 0.00 2.11 0.00 0.00 58.89 61.08 2br9 h TRP 60 Cb 0.27 -0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 27.11 2br9 h TRP 60 CO -0.10 0.85 0.06 0.00 -2.79 0.00 0.00 178.44 176.47 2br9 h ARG 61 N 0.57 0.88 -0.03 2.65 3.08 -0.97 0.52 114.38 121.08 2br9 h ARG 61 Ca 0.11 -0.25 0.01 0.00 0.07 0.00 0.00 59.98 59.93 2br9 h ARG 61 Cb 0.56 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 2br9 h ARG 61 CO 0.03 0.87 -0.06 0.82 -1.07 0.00 0.00 179.97 180.57 2br9 h ILE 62 N 0.75 0.84 -0.80 2.04 2.04 -0.99 -1.14 117.51 120.27 2br9 h ILE 62 Ca 0.16 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.97 2br9 h ILE 62 Cb 0.43 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.32 2br9 h ILE 62 CO 0.01 0.00 0.32 0.40 0.00 0.00 0.00 178.15 178.89 2br9 h ILE 63 N -0.09 1.26 -0.47 -0.67 2.04 -0.85 -1.71 117.51 117.02 2br9 h ILE 63 Ca 0.03 -0.82 -0.05 0.00 1.00 0.00 0.00 64.86 65.03 2br9 h ILE 63 Cb 0.13 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 2br9 h ILE 63 CO -0.08 0.34 0.08 0.28 0.00 0.00 0.00 178.15 178.77 2br9 h SER 64 N 1.15 0.68 -0.08 1.72 0.02 -0.81 -0.23 113.55 116.01 2br9 h SER 64 Ca 0.27 -0.13 -0.11 0.00 -0.84 0.00 0.00 61.79 60.98 2br9 h SER 64 Cb 0.21 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 2br9 h SER 64 CO -0.02 0.70 -0.30 0.28 -1.14 0.00 0.00 176.83 176.35 2br9 h SER 65 N 0.70 0.56 -0.51 3.07 0.02 -0.38 -0.81 113.55 116.21 2br9 h SER 65 Ca 0.15 -0.21 -0.11 0.00 -0.84 0.00 0.00 61.79 60.78 2br9 h SER 65 Cb 0.31 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 2br9 h SER 65 CO 0.00 0.83 -0.11 0.40 -1.14 0.00 0.00 176.83 176.81 2br9 h ILE 66 N 0.47 1.27 -0.60 3.27 2.04 -0.68 -0.99 117.51 122.29 2br9 h ILE 66 Ca 0.06 -1.26 0.01 0.00 1.00 0.00 0.00 64.86 64.67 2br9 h ILE 66 Cb 0.76 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 2br9 h ILE 66 CO 0.06 0.44 0.39 -0.08 0.00 0.00 0.00 178.15 178.96 2br9 h GLU 67 N 0.83 0.77 -0.46 2.37 4.81 -0.85 -0.42 114.58 121.63 2br9 h GLU 67 Ca 0.13 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.21 2br9 h GLU 67 Cb 0.67 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.86 2br9 h GLU 67 CO 0.05 0.51 -0.14 0.37 -0.73 0.00 0.00 179.01 179.07 2br9 h GLN 68 N 0.79 0.86 -0.28 1.92 4.15 -0.76 -0.95 115.11 120.85 2br9 h GLN 68 Ca 0.22 -0.31 0.01 0.00 0.77 0.00 0.00 58.65 59.34 2br9 h GLN 68 Cb -0.07 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.55 2br9 h GLN 68 CO -0.06 0.95 0.17 -0.22 -1.93 0.00 0.00 178.83 177.74 2br9 h LYS 69 N 0.77 0.34 -0.05 1.69 3.64 -0.90 -2.42 116.57 119.64 2br9 h LYS 69 Ca 0.12 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.34 2br9 h LYS 69 Cb 0.66 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 2br9 h LYS 69 CO 0.05 0.22 -0.61 0.93 -2.27 0.00 0.00 179.45 177.77 2br9 h GLU 70 N 0.35 0.18 -0.97 1.90 4.39 -0.76 -1.77 114.58 117.90 2br9 h GLU 70 Ca 0.11 -0.13 0.02 0.00 0.34 0.00 0.00 59.36 59.70 2br9 h GLU 70 Cb -0.02 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 28.60 2br9 h GLU 70 CO -0.04 0.73 0.64 0.93 -1.16 0.00 0.00 179.01 180.11 2br9 h GLU 71 N 0.14 1.23 0.00 2.33 5.08 -1.13 0.26 114.58 122.49 2br9 h GLU 71 Ca -0.01 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.17 2br9 h GLU 71 Cb 1.10 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 2br9 h GLU 71 CO 0.09 0.82 -0.50 -0.91 -1.00 0.00 0.00 179.01 177.51 2br9 h ASN 72 N 1.27 0.00 0.85 1.42 2.35 -1.06 -3.15 115.58 117.26 2br9 h ASN 72 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 2br9 h ASN 72 Cb -0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.30 2br9 h ASN 72 CO -0.10 0.50 -0.73 0.11 -1.65 0.00 0.00 177.43 175.56 2br9 h LYS 73 N 0.00 0.00 -0.04 0.81 1.57 -0.72 -3.48 116.57 114.71 2br9 h LYS 73 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2br9 h LYS 73 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2br9 h LYS 73 CO 0.07 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.36 2br9 n GLY 74 N 1.31 0.60 2.75 3.86 0.00 0.67 -4.98 105.19 109.41 2br9 n GLY 74 Ca 0.03 -0.77 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 2br9 n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2br9 n GLY 75 N -0.97 4.63 0.27 -0.02 0.00 0.19 -4.83 105.19 104.46 2br9 n GLY 75 Ca 0.00 -1.86 -0.03 0.00 0.00 0.00 0.00 46.02 44.13 2br9 n GLY 75 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2br9 h GLU 76 N 5.73 0.78 -0.44 1.61 3.07 -1.94 0.07 114.58 123.46 2br9 h GLU 76 Ca 0.51 -0.05 -0.06 0.00 -0.50 0.00 0.00 59.36 59.26 2br9 h GLU 76 Cb 0.59 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 28.31 2br9 h GLU 76 CO 1.73 0.52 0.05 -0.44 -1.40 0.00 0.00 179.01 179.47 2br9 h ASP 77 N 0.80 0.72 -0.17 1.42 3.32 -2.00 -2.58 116.42 117.93 2br9 h ASP 77 Ca 0.28 -0.28 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 2br9 h ASP 77 Cb 0.06 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 2br9 h ASP 77 CO -0.12 0.82 -0.22 0.11 -1.72 0.00 0.00 179.24 178.10 2br9 h LYS 78 N 0.60 0.61 -0.54 3.56 1.57 -1.88 -3.06 116.57 117.43 2br9 h LYS 78 Ca 0.13 -0.23 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2br9 h LYS 78 Cb 0.42 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.67 2br9 h LYS 78 CO 0.01 0.79 0.30 -0.07 -0.57 0.00 0.00 179.45 179.91 2br9 h LEU 79 N 0.54 0.65 -0.47 2.94 3.38 -0.65 0.88 115.31 122.59 2br9 h LEU 79 Ca 0.08 -0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.08 2br9 h LEU 79 Cb 0.67 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.21 2br9 h LEU 79 CO 0.05 0.51 0.15 0.11 0.09 0.00 0.00 178.44 179.36 2br9 h LYS 80 N 0.74 0.31 -0.42 1.13 1.57 -1.36 -0.30 116.57 118.24 2br9 h LYS 80 Ca 0.19 -0.02 -0.15 0.00 -1.87 0.00 0.00 60.65 58.80 2br9 h LYS 80 Cb 0.00 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2br9 h LYS 80 CO -0.03 0.20 -0.33 0.52 -0.57 0.00 0.00 179.45 179.24 2br9 h MET 81 N 0.32 0.96 -0.54 3.15 2.86 -1.43 -2.56 114.93 117.69 2br9 h MET 81 Ca 0.22 -0.48 -0.02 0.00 -2.06 0.00 0.00 59.70 57.37 2br9 h MET 81 Cb 0.24 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2br9 h MET 81 CO -0.24 1.14 0.27 0.82 1.06 0.00 0.00 176.91 179.96 2br9 h ILE 82 N 0.80 1.20 -0.52 -1.22 2.04 -0.59 -1.79 117.51 117.42 2br9 h ILE 82 Ca 0.08 -0.54 -0.11 0.00 1.00 0.00 0.00 64.86 65.29 2br9 h ILE 82 Cb 0.92 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 2br9 h ILE 82 CO 0.09 0.22 -0.12 0.03 0.00 0.00 0.00 178.15 178.37 2br9 h ARG 83 N 0.73 0.98 -0.29 2.37 3.08 -1.05 -0.04 114.38 120.17 2br9 h ARG 83 Ca 0.19 -0.36 -0.08 0.00 0.07 0.00 0.00 59.98 59.80 2br9 h ARG 83 Cb 0.10 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 2br9 h ARG 83 CO -0.03 1.04 -0.15 0.93 -1.07 0.00 0.00 179.97 180.69 2br9 h GLU 84 N 0.87 0.50 -0.11 0.04 5.08 -1.36 -1.16 114.58 118.44 2br9 h GLU 84 Ca 0.14 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 2br9 h GLU 84 Cb 0.67 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 2br9 h GLU 84 CO 0.05 0.64 -0.13 -0.92 -1.00 0.00 0.00 179.01 177.64 2br9 h TYR 85 N 0.46 0.35 -0.63 4.33 3.20 -0.85 -1.61 116.97 122.22 2br9 h TYR 85 Ca 0.08 -0.11 0.07 0.00 3.14 0.00 0.00 58.73 61.91 2br9 h TYR 85 Cb 0.53 -0.07 -0.06 0.00 1.54 0.00 0.00 36.73 38.66 2br9 h TYR 85 CO 0.02 0.72 0.32 -0.09 -1.64 0.00 0.00 178.16 177.48 2br9 h ARG 86 N -0.12 0.56 -0.54 1.82 2.43 -0.81 -2.09 114.38 115.62 2br9 h ARG 86 Ca 0.02 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 2br9 h ARG 86 Cb 0.67 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 2br9 h ARG 86 CO 0.03 0.37 0.06 1.96 -1.51 0.00 0.00 179.97 180.88 2br9 h GLN 87 N 0.57 0.88 -0.77 0.20 4.20 -1.05 0.35 115.11 119.49 2br9 h GLN 87 Ca 0.30 -0.22 0.00 0.00 0.06 0.00 0.00 58.65 58.79 2br9 h GLN 87 Cb 0.26 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.89 2br9 h GLN 87 CO -0.22 0.84 0.49 1.98 -0.67 0.00 0.00 178.83 181.25 2br9 h MET 88 N 0.83 1.03 -0.25 1.46 1.85 -0.73 -1.59 114.93 117.54 2br9 h MET 88 Ca 0.17 -0.08 -0.15 0.00 -0.61 0.00 0.00 59.70 59.03 2br9 h MET 88 Cb 0.41 -0.23 -0.01 0.00 0.43 0.00 0.00 31.60 32.21 2br9 h MET 88 CO 0.01 0.70 -0.46 0.28 -0.40 0.00 0.00 176.91 177.04 2br9 h VAL 89 N 1.05 1.30 -0.61 -5.77 2.07 -0.66 -2.37 116.25 111.26 2br9 h VAL 89 Ca 0.28 -1.66 -0.03 0.00 0.82 0.00 0.00 66.70 66.11 2br9 h VAL 89 Cb -0.09 1.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 2br9 h VAL 89 CO -0.06 0.53 0.26 -0.33 0.02 0.00 0.00 177.57 177.98 2br9 h GLU 90 N 0.51 0.88 -0.62 1.57 5.08 -0.76 0.15 114.58 121.39 2br9 h GLU 90 Ca 0.03 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 2br9 h GLU 90 Cb 1.00 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 30.06 2br9 h GLU 90 CO 0.09 0.71 0.36 1.15 -1.00 0.00 0.00 179.01 180.32 2br9 h THR 91 N 0.87 1.19 -0.31 1.13 2.02 -0.90 0.14 112.91 117.06 2br9 h THR 91 Ca 0.21 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 66.93 2br9 h THR 91 Cb 0.15 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 2br9 h THR 91 CO -0.02 0.20 0.19 -0.33 0.37 0.00 0.00 175.52 175.94 2br9 h GLU 92 N 0.84 0.42 -0.42 6.66 5.08 -1.03 -0.70 114.58 125.43 2br9 h GLU 92 Ca 0.22 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.59 2br9 h GLU 92 Cb 0.01 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.13 2br9 h GLU 92 CO -0.04 0.30 0.19 -0.07 -1.00 0.00 0.00 179.01 178.39 2br9 h LEU 93 N 0.41 0.25 -0.59 1.33 3.38 -0.35 -0.88 115.31 118.86 2br9 h LEU 93 Ca 0.11 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2br9 h LEU 93 Cb -0.01 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2br9 h LEU 93 CO -0.02 0.18 0.37 0.11 0.09 0.00 0.00 178.44 179.18 2br9 h LYS 94 N 0.38 0.78 -0.36 1.13 1.57 -0.45 -0.98 116.57 118.65 2br9 h LYS 94 Ca 0.19 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.89 2br9 h LYS 94 Cb 0.12 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 2br9 h LYS 94 CO -0.15 0.54 0.14 -0.07 -0.57 0.00 0.00 179.45 179.33 2br9 h LEU 95 N 0.79 0.50 -0.15 2.94 3.38 -0.85 -0.22 115.31 121.71 2br9 h LEU 95 Ca 0.21 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2br9 h LEU 95 Cb -0.06 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2br9 h LEU 95 CO -0.04 0.54 0.08 0.40 0.09 0.00 0.00 178.44 179.51 2br9 h ILE 96 N 0.43 1.09 -0.38 1.22 2.04 -0.95 -0.55 117.51 120.41 2br9 h ILE 96 Ca 0.12 -0.25 0.03 0.00 1.00 0.00 0.00 64.86 65.76 2br9 h ILE 96 Cb 0.20 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 2br9 h ILE 96 CO -0.01 0.08 0.18 0.00 0.00 0.00 0.00 178.15 178.40 2br9 h ASP 99 N 0.80 -0.96 0.09 0.00 3.58 -0.66 -1.31 116.42 117.95 2br9 h ASP 99 Ca 0.25 0.03 -0.10 0.00 0.42 0.00 0.00 57.03 57.63 2br9 h ASP 99 Cb 0.03 0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.31 2br9 h ASP 99 CO -0.07 -0.69 -0.34 -0.29 -2.88 0.00 0.00 179.24 174.98 2br9 h ILE 100 N -1.14 1.28 -0.34 2.25 6.09 -1.27 -2.25 117.51 122.13 2br9 h ILE 100 Ca -0.12 -1.39 -0.04 0.00 -1.37 0.00 0.00 64.86 61.94 2br9 h ILE 100 Cb 0.87 1.53 -0.02 0.00 0.47 0.00 0.00 36.82 39.67 2br9 h ILE 100 CO 0.19 0.43 0.04 -0.07 -3.07 0.00 0.00 178.15 175.67 2br9 h LEU 101 N 0.30 0.48 -0.29 2.19 3.38 -0.97 0.13 115.31 120.54 2br9 h LEU 101 Ca 0.04 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 2br9 h LEU 101 Cb 0.75 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 2br9 h LEU 101 CO 0.06 0.52 -0.36 -0.78 0.09 0.00 0.00 178.44 177.97 2br9 h ASP 102 N 0.50 0.82 -0.55 -0.43 1.82 -0.75 -1.09 116.42 116.73 2br9 h ASP 102 Ca 0.11 -0.49 -0.01 0.00 -0.39 0.00 0.00 57.03 56.25 2br9 h ASP 102 Cb 0.27 -0.23 -0.03 0.00 0.68 0.00 0.00 39.33 40.02 2br9 h ASP 102 CO 0.00 1.15 0.31 0.58 -1.61 0.00 0.00 179.24 179.67 2br9 h VAL 103 N 0.51 1.18 -0.44 2.25 2.07 -1.14 -0.39 116.25 120.29 2br9 h VAL 103 Ca 0.04 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.10 2br9 h VAL 103 Cb 0.95 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 2br9 h VAL 103 CO 0.09 0.19 0.24 -0.07 0.02 0.00 0.00 177.57 178.04 2br9 h LEU 104 N 0.74 0.56 -0.26 2.57 3.38 -0.66 -1.04 115.31 120.59 2br9 h LEU 104 Ca 0.19 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 2br9 h LEU 104 Cb 0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2br9 h LEU 104 CO -0.03 0.49 -0.18 -0.78 0.09 0.00 0.00 178.44 178.03 2br9 h ASP 105 N 0.58 0.61 1.13 -0.43 3.58 -0.94 0.30 116.42 121.25 2br9 h ASP 105 Ca 0.16 -0.44 -0.08 0.00 0.42 0.00 0.00 57.03 57.08 2br9 h ASP 105 Cb 0.06 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 40.93 2br9 h ASP 105 CO -0.02 0.92 -0.91 0.11 -2.88 0.00 0.00 179.24 176.46 2br9 h LYS 106 N 0.30 0.00 0.00 0.28 1.79 -1.13 -3.40 116.57 114.41 2br9 h LYS 106 Ca 0.05 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 2br9 h LYS 106 Cb 0.72 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.37 2br9 h LYS 106 CO 0.05 0.21 0.00 0.72 -1.08 0.00 0.00 179.45 179.35 2br9 n HIS 107 N -2.92 -0.94 0.03 -1.35 8.25 -0.48 -4.80 115.22 113.01 2br9 n HIS 107 Ca -0.02 0.17 -0.12 0.00 -0.26 0.00 0.00 57.72 57.48 2br9 n HIS 107 Cb 0.69 0.25 -0.09 0.00 1.12 0.00 0.00 29.99 31.96 2br9 n HIS 107 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2br9 h LEU 108 N 0.00 -0.13 0.27 2.41 3.38 -1.31 -2.65 115.31 117.29 2br9 h LEU 108 Ca 0.00 -0.43 -0.01 0.00 0.09 0.00 0.00 57.88 57.53 2br9 h LEU 108 Cb 0.00 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2br9 h LEU 108 CO 0.00 0.43 -0.15 0.40 0.09 0.00 0.00 178.44 179.21 2br9 h ILE 109 N -0.76 0.69 -0.76 1.22 2.04 -1.18 -1.65 117.51 117.11 2br9 h ILE 109 Ca -0.02 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.98 2br9 h ILE 109 Cb 0.55 0.69 -0.05 0.00 -0.74 0.00 0.00 36.82 37.27 2br9 h ILE 109 CO 0.03 0.00 0.50 -0.65 0.00 0.00 0.00 178.15 178.03 2br9 h PRO 110 N -0.40 0.47 -0.00 2.37 0.11 -1.76 -2.07 132.00 130.73 2br9 h PRO 110 Ca -0.03 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2br9 h PRO 110 Cb 0.32 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.32 2br9 h PRO 110 CO 0.04 0.31 -0.31 0.00 -0.21 0.00 0.00 178.00 177.83 2br9 n ALA 111 N -2.50 3.13 -2.21 -0.75 0.00 -1.00 -4.90 120.51 112.27 2br9 n ALA 111 Ca 0.14 -0.29 -0.42 0.00 0.00 0.00 0.00 53.44 52.87 2br9 n ALA 111 Cb 0.48 -1.23 -0.03 0.00 0.00 0.00 0.00 19.45 18.67 2br9 n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2br9 s ALA 112 N -2.89 3.56 -0.02 0.00 0.00 -0.64 -4.17 121.76 117.60 2br9 s ALA 112 Ca 0.15 1.04 0.05 0.00 0.00 0.00 0.00 51.96 53.20 2br9 s ALA 112 Cb 0.18 -3.53 0.08 0.00 0.00 0.00 0.00 23.12 19.85 2br9 s ALA 112 CO 0.62 -0.64 1.04 -1.71 0.00 0.00 0.00 175.76 175.07 2br9 n ASN 113 N 4.18 0.38 -4.32 0.00 5.15 -1.26 -4.91 115.26 114.48 2br9 n ASN 113 Ca 0.11 -2.15 -0.18 0.00 -0.60 0.00 0.00 54.58 51.76 2br9 n ASN 113 Cb 0.43 -0.24 -0.10 0.00 -0.53 0.00 0.00 39.78 39.34 2br9 n ASN 113 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2br9 s THR 114 N -0.36 1.63 0.11 -0.44 -4.23 -1.26 -5.05 115.64 106.02 2br9 s THR 114 Ca 0.07 -2.09 -0.24 0.00 -1.18 0.00 0.00 61.69 58.26 2br9 s THR 114 Cb 0.07 -1.93 -0.10 0.00 1.34 0.00 0.00 72.50 71.89 2br9 s THR 114 CO -0.01 -0.55 1.69 1.23 -0.54 0.00 0.00 174.62 176.44 2br9 h GLY 115 N 2.81 -0.14 0.33 3.99 0.00 -1.97 -0.82 103.07 107.26 2br9 h GLY 115 Ca -0.39 0.12 0.07 0.00 0.00 0.00 0.00 47.33 47.14 2br9 h GLY 115 CO 0.59 -0.11 -0.02 0.83 0.00 0.00 0.00 176.54 177.84 2br9 h GLU 116 N -0.19 0.08 -0.10 4.80 5.08 -1.96 -0.57 114.58 121.72 2br9 h GLU 116 Ca 0.03 -0.01 -0.20 0.00 -1.00 0.00 0.00 59.36 58.18 2br9 h GLU 116 Cb 0.23 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2br9 h GLU 116 CO -0.09 0.06 -0.77 0.66 -1.00 0.00 0.00 179.01 177.87 2br9 h SER 117 N 0.09 0.67 -0.38 1.42 4.64 -1.92 -0.21 113.55 117.85 2br9 h SER 117 Ca 0.20 -0.45 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 2br9 h SER 117 Cb 0.28 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.16 2br9 h SER 117 CO -0.34 1.22 0.25 0.11 -0.87 0.00 0.00 176.83 177.20 2br9 h LYS 118 N 0.38 0.51 -0.48 4.77 1.57 -1.00 -0.88 116.57 121.43 2br9 h LYS 118 Ca -0.05 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.60 2br9 h LYS 118 Cb 1.37 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.55 2br9 h LYS 118 CO 0.14 0.34 -0.13 0.28 -0.57 0.00 0.00 179.45 179.51 2br9 h VAL 119 N 0.52 1.27 -0.35 0.50 2.07 -0.89 -1.70 116.25 117.66 2br9 h VAL 119 Ca 0.14 -1.25 0.04 0.00 0.82 0.00 0.00 66.70 66.44 2br9 h VAL 119 Cb -0.06 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 2br9 h VAL 119 CO -0.03 0.43 0.14 0.15 0.02 0.00 0.00 177.57 178.28 2br9 h PHE 120 N 0.80 0.25 0.03 1.57 3.04 -0.55 -0.42 116.94 121.66 2br9 h PHE 120 Ca 0.13 0.02 -0.25 0.00 3.98 0.00 0.00 57.97 61.84 2br9 h PHE 120 Cb 0.66 -0.06 0.01 0.00 2.56 0.00 0.00 35.95 39.12 2br9 h PHE 120 CO 0.04 0.11 -1.03 1.88 -2.02 0.00 0.00 178.31 177.29 2br9 h TYR 121 N 0.30 0.76 -0.64 0.41 0.05 -1.02 -1.31 116.97 115.51 2br9 h TYR 121 Ca 0.16 -0.43 -0.08 0.00 0.05 0.00 0.00 58.73 58.42 2br9 h TYR 121 Cb 0.12 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.75 2br9 h TYR 121 CO -0.13 1.27 0.07 1.88 -1.05 0.00 0.00 178.16 180.20 2br9 h TYR 122 N 0.26 1.16 -0.56 4.88 -1.99 -1.24 0.14 116.97 119.62 2br9 h TYR 122 Ca -0.11 -0.17 0.05 0.00 2.00 0.00 0.00 58.73 60.50 2br9 h TYR 122 Cb 1.68 -0.31 -0.05 0.00 2.00 0.00 0.00 36.73 40.05 2br9 h TYR 122 CO 0.08 0.99 0.29 -0.22 -0.00 0.00 0.00 178.16 179.29 2br9 h LYS 123 N 1.01 0.53 -0.70 4.88 3.64 -1.03 0.02 116.57 124.91 2br9 h LYS 123 Ca 0.19 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.49 2br9 h LYS 123 Cb 0.48 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.15 2br9 h LYS 123 CO 0.02 0.35 0.23 1.98 -2.27 0.00 0.00 179.45 179.76 2br9 h MET 124 N 0.55 1.08 -0.47 1.90 4.05 -0.84 0.17 114.93 121.36 2br9 h MET 124 Ca 0.25 -0.22 -0.02 0.00 -0.28 0.00 0.00 59.70 59.43 2br9 h MET 124 Cb 0.16 -0.16 -0.02 0.00 -0.80 0.00 0.00 31.60 30.78 2br9 h MET 124 CO -0.17 0.91 0.21 -0.22 0.23 0.00 0.00 176.91 177.86 2br9 h LYS 125 N 1.04 0.68 -0.38 0.39 3.64 -0.61 -0.23 116.57 121.11 2br9 h LYS 125 Ca 0.23 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.51 2br9 h LYS 125 Cb 0.28 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 2br9 h LYS 125 CO -0.01 0.60 0.24 0.78 -2.27 0.00 0.00 179.45 178.79 2br9 h GLY 126 N 0.61 0.53 0.59 5.01 0.00 -0.46 -1.90 103.07 107.44 2br9 h GLY 126 Ca 0.16 -0.19 0.02 0.00 0.00 0.00 0.00 47.33 47.32 2br9 h GLY 126 CO -0.02 0.18 -0.21 -0.55 0.00 0.00 0.00 176.54 175.94 2br9 h ASP 127 N 0.49 -0.61 0.40 0.19 3.32 -0.11 0.98 116.42 121.08 2br9 h ASP 127 Ca 0.14 0.08 -0.12 0.00 0.02 0.00 0.00 57.03 57.14 2br9 h ASP 127 Cb -0.04 0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 2br9 h ASP 127 CO -0.04 -0.29 -0.53 1.88 -1.72 0.00 0.00 179.24 178.54 2br9 h TYR 128 N -0.38 0.18 -0.39 4.55 -1.99 -0.96 0.15 116.97 118.13 2br9 h TYR 128 Ca 0.04 -0.06 -0.09 0.00 2.00 0.00 0.00 58.73 60.62 2br9 h TYR 128 Cb 0.42 -0.03 -0.02 0.00 2.00 0.00 0.00 36.73 39.10 2br9 h TYR 128 CO -0.22 0.64 -0.12 0.45 -0.00 0.00 0.00 178.16 178.91 2br9 h HIS 129 N 0.11 0.75 -0.83 4.88 3.86 -1.30 -1.89 115.15 120.73 2br9 h HIS 129 Ca 0.00 -0.13 -0.03 0.00 -1.16 0.00 0.00 60.37 59.05 2br9 h HIS 129 Cb 0.97 -0.19 -0.04 0.00 1.06 0.00 0.00 27.41 29.21 2br9 h HIS 129 CO 0.01 0.77 0.39 -0.09 0.86 0.00 0.00 177.93 179.87 2br9 h ARG 130 N 0.62 1.21 -0.54 2.45 2.43 -0.20 -1.01 114.38 119.34 2br9 h ARG 130 Ca 0.11 -0.18 -0.07 0.00 -0.81 0.00 0.00 59.98 59.02 2br9 h ARG 130 Cb 0.57 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 2br9 h ARG 130 CO 0.04 0.94 0.06 1.88 -1.51 0.00 0.00 179.97 181.37 2br9 h TYR 131 N 1.19 0.92 -0.82 2.20 0.99 -0.70 -1.34 116.97 119.41 2br9 h TYR 131 Ca 0.29 -0.12 0.04 0.00 2.00 0.00 0.00 58.73 60.94 2br9 h TYR 131 Cb 0.13 -0.26 -0.05 0.00 1.00 0.00 0.00 36.73 37.56 2br9 h TYR 131 CO 0.02 0.81 0.51 -0.07 -0.00 0.00 0.00 178.16 179.43 2br9 h LEU 132 N 0.82 0.83 -1.14 3.88 3.38 -1.06 -2.76 115.31 119.26 2br9 h LEU 132 Ca 0.17 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 2br9 h LEU 132 Cb 0.41 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2br9 h LEU 132 CO 0.01 0.56 -0.29 0.00 0.09 0.00 0.00 178.44 178.81 2br9 h ALA 133 N 1.36 1.06 -1.00 1.53 0.00 -0.15 -2.72 119.26 119.34 2br9 h ALA 133 Ca 0.34 -0.26 0.04 0.00 0.00 0.00 0.00 54.91 55.03 2br9 h ALA 133 Cb 0.08 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 2br9 h ALA 133 CO -0.14 0.36 0.66 0.93 0.00 0.00 0.00 179.25 181.06 2br9 h GLU 134 N 0.00 1.23 -0.01 0.00 5.08 -0.98 -3.06 114.58 116.84 2br9 h GLU 134 Ca -0.00 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2br9 h GLU 134 Cb 0.76 -0.28 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2br9 h GLU 134 CO 0.04 0.81 -0.24 1.97 -1.00 0.00 0.00 179.01 180.59 2br9 n PHE 135 N -4.44 0.00 -2.25 4.33 -1.74 -1.22 -5.02 117.46 107.12 2br9 n PHE 135 Ca 0.14 0.00 -0.33 0.00 -0.56 0.00 0.00 57.45 56.70 2br9 n PHE 135 Cb 0.10 0.00 -0.01 0.00 1.52 0.00 0.00 39.48 41.09 2br9 n PHE 135 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2br9 s ALA 136 N -1.52 2.89 0.20 1.98 0.00 -1.03 -5.06 121.76 119.21 2br9 s ALA 136 Ca 0.10 0.34 0.10 0.00 0.00 0.00 0.00 51.96 52.50 2br9 s ALA 136 Cb 0.10 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 2br9 s ALA 136 CO 0.30 -0.51 -0.20 0.95 0.00 0.00 0.00 175.76 176.30 2br9 s THR 137 N -2.46 2.06 0.00 0.00 -4.23 -1.26 -4.63 115.64 105.12 2br9 s THR 137 Ca 0.62 -2.06 0.00 0.00 -1.18 0.00 0.00 61.69 59.07 2br9 s THR 137 Cb -0.14 -2.01 0.00 0.00 1.34 0.00 0.00 72.50 71.69 2br9 s THR 137 CO 0.32 -0.31 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 2br9 n GLY 138 N 0.07 2.82 0.35 3.99 0.00 -1.26 -2.45 105.19 108.71 2br9 n GLY 138 Ca -0.11 -0.27 0.05 0.00 0.00 0.00 0.00 46.02 45.69 2br9 n GLY 138 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2br9 h ASN 139 N 5.53 0.70 -0.59 1.61 -1.24 -1.99 -1.48 115.58 118.12 2br9 h ASN 139 Ca 0.00 -0.00 -0.02 0.00 0.71 0.00 0.00 56.30 56.99 2br9 h ASN 139 Cb 0.00 -0.15 -0.03 0.00 0.73 0.00 0.00 38.32 38.87 2br9 h ASN 139 CO 0.00 0.47 0.31 0.44 -1.29 0.00 0.00 177.43 177.36 2br9 h ASP 140 N 0.80 0.76 -0.23 1.15 3.32 -1.89 0.89 116.42 121.23 2br9 h ASP 140 Ca 0.29 -0.07 -0.11 0.00 0.02 0.00 0.00 57.03 57.17 2br9 h ASP 140 Cb 0.15 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 2br9 h ASP 140 CO -0.09 0.64 -0.28 -0.09 -1.72 0.00 0.00 179.24 177.70 2br9 h ARG 141 N 0.86 0.60 -0.30 3.56 2.43 -1.10 -1.06 114.38 119.36 2br9 h ARG 141 Ca 0.22 -0.34 0.03 0.00 -0.81 0.00 0.00 59.98 59.08 2br9 h ARG 141 Cb 0.06 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 2br9 h ARG 141 CO -0.03 0.94 0.12 -0.22 -1.51 0.00 0.00 179.97 179.27 2br9 h LYS 142 N 0.30 0.26 -0.51 0.20 3.64 -0.92 0.57 116.57 120.11 2br9 h LYS 142 Ca 0.03 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2br9 h LYS 142 Cb 0.85 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.59 2br9 h LYS 142 CO 0.07 0.17 0.33 0.93 -2.27 0.00 0.00 179.45 178.68 2br9 h GLU 143 N 0.27 0.67 -0.29 1.90 5.08 -0.74 0.14 114.58 121.61 2br9 h GLU 143 Ca 0.13 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.34 2br9 h GLU 143 Cb 0.08 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 2br9 h GLU 143 CO -0.12 0.46 -0.27 0.00 -1.00 0.00 0.00 179.01 178.08 2br9 h ALA 144 N 1.17 0.99 -0.37 3.43 0.00 -0.95 -1.01 119.26 122.52 2br9 h ALA 144 Ca 0.18 -0.37 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 2br9 h ALA 144 Cb -0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2br9 h ALA 144 CO -0.04 0.60 -0.28 0.00 0.00 0.00 0.00 179.25 179.53 2br9 h ALA 145 N 1.20 0.53 -0.37 0.00 0.00 -0.41 0.62 119.26 120.84 2br9 h ALA 145 Ca 0.07 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 2br9 h ALA 145 Cb 0.73 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2br9 h ALA 145 CO 0.06 0.55 0.23 0.93 0.00 0.00 0.00 179.25 181.02 2br9 h GLU 146 N 0.64 0.50 -0.46 0.00 5.08 -0.74 0.56 114.58 120.16 2br9 h GLU 146 Ca 0.07 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.35 2br9 h GLU 146 Cb 0.85 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 2br9 h GLU 146 CO 0.07 0.36 0.15 -0.91 -1.00 0.00 0.00 179.01 177.69 2br9 h ASN 147 N 0.49 0.66 -0.27 1.42 2.35 -0.98 -0.62 115.58 118.64 2br9 h ASN 147 Ca 0.13 -0.20 -0.00 0.00 -0.55 0.00 0.00 56.30 55.68 2br9 h ASN 147 Cb -0.01 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.17 2br9 h ASN 147 CO -0.03 0.69 0.16 -1.28 -1.65 0.00 0.00 177.43 175.32 2br9 h SER 148 N 0.61 0.33 -0.02 5.81 0.87 -0.77 -2.06 113.55 118.31 2br9 h SER 148 Ca 0.15 -0.06 0.01 0.00 -1.23 0.00 0.00 61.79 60.66 2br9 h SER 148 Cb 0.26 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 2br9 h SER 148 CO -0.01 0.29 -0.04 0.25 -0.53 0.00 0.00 176.83 176.80 2br9 h LEU 149 N 0.34 -0.11 -0.87 2.23 5.85 -0.67 0.74 115.31 122.82 2br9 h LEU 149 Ca 0.10 0.02 0.12 0.00 0.84 0.00 0.00 57.88 58.96 2br9 h LEU 149 Cb 0.02 0.05 -0.09 0.00 0.37 0.00 0.00 40.66 41.02 2br9 h LEU 149 CO -0.02 -0.05 0.49 0.58 -0.34 0.00 0.00 178.44 179.09 2br9 h VAL 150 N -0.06 0.82 -0.21 1.05 2.07 -1.09 -0.21 116.25 118.63 2br9 h VAL 150 Ca 0.02 -0.26 -0.08 0.00 0.82 0.00 0.00 66.70 67.21 2br9 h VAL 150 Cb 0.09 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 29.87 2br9 h VAL 150 CO -0.05 0.14 -0.18 0.00 0.02 0.00 0.00 177.57 177.50 2br9 h ALA 151 N 1.52 0.31 -0.36 1.67 0.00 -0.76 -1.59 119.26 120.05 2br9 h ALA 151 Ca 0.45 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2br9 h ALA 151 Cb 0.53 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2br9 h ALA 151 CO -0.31 0.22 -0.06 1.88 0.00 0.00 0.00 179.25 180.99 2br9 h TYR 152 N 0.18 0.62 -0.69 0.00 0.05 -0.54 -0.63 116.97 115.97 2br9 h TYR 152 Ca 0.04 -0.08 -0.06 0.00 0.05 0.00 0.00 58.73 58.67 2br9 h TYR 152 Cb 0.71 -0.17 -0.03 0.00 1.01 0.00 0.00 36.73 38.25 2br9 h TYR 152 CO 0.07 0.64 0.19 0.87 -1.05 0.00 0.00 178.16 178.88 2br9 h LYS 153 N 0.55 1.08 -0.35 4.88 1.57 -0.81 -0.47 116.57 123.02 2br9 h LYS 153 Ca 0.11 -0.24 -0.13 0.00 -1.87 0.00 0.00 60.65 58.52 2br9 h LYS 153 Cb 0.44 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 2br9 h LYS 153 CO 0.02 0.94 -0.28 0.00 -0.57 0.00 0.00 179.45 179.56 2br9 h ALA 154 N 1.16 0.51 -0.52 3.86 0.00 -0.68 -0.97 119.26 122.62 2br9 h ALA 154 Ca 0.22 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 2br9 h ALA 154 Cb 0.33 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2br9 h ALA 154 CO -0.00 0.53 0.05 0.00 0.00 0.00 0.00 179.25 179.82 2br9 h ALA 155 N 0.76 1.12 -0.14 0.00 0.00 -1.08 -2.66 119.26 117.26 2br9 h ALA 155 Ca 0.06 -0.25 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 2br9 h ALA 155 Cb 0.86 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 2br9 h ALA 155 CO 0.07 0.57 -0.68 0.77 0.00 0.00 0.00 179.25 179.98 2br9 h SER 156 N 0.79 0.66 0.17 0.00 0.02 -0.54 -0.22 113.55 114.43 2br9 h SER 156 Ca 0.16 -0.40 0.01 0.00 -0.84 0.00 0.00 61.79 60.71 2br9 h SER 156 Cb 0.40 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 2br9 h SER 156 CO 0.01 1.15 -0.21 -0.78 -1.14 0.00 0.00 176.83 175.87 2br9 h ASP 157 N 0.40 -0.57 -0.62 3.07 3.58 -1.04 -0.76 116.42 120.49 2br9 h ASP 157 Ca -0.02 0.06 -0.09 0.00 0.42 0.00 0.00 57.03 57.39 2br9 h ASP 157 Cb 1.26 0.20 -0.02 0.00 1.72 0.00 0.00 39.33 42.49 2br9 h ASP 157 CO 0.13 -0.30 0.03 0.40 -2.88 0.00 0.00 179.24 176.61 2br9 h ILE 158 N -0.43 1.26 -0.69 2.25 2.04 -1.38 -2.76 117.51 117.79 2br9 h ILE 158 Ca 0.01 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 64.75 2br9 h ILE 158 Cb 0.42 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.22 2br9 h ILE 158 CO -0.08 0.41 0.44 0.00 0.00 0.00 0.00 178.15 178.92 2br9 h ALA 159 N 1.03 0.88 0.00 1.87 0.00 -0.77 0.65 119.26 122.92 2br9 h ALA 159 Ca 0.18 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 2br9 h ALA 159 Cb 0.53 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2br9 h ALA 159 CO 0.03 0.33 -0.46 0.52 0.00 0.00 0.00 179.25 179.67 2br9 h MET 160 N 0.94 0.00 0.00 0.00 2.86 -0.93 -1.19 114.93 116.61 2br9 h MET 160 Ca 0.25 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.61 2br9 h MET 160 Cb -0.07 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.55 2br9 h MET 160 CO -0.05 0.46 -1.71 0.25 1.06 0.00 0.00 176.91 176.93 2br9 n THR 161 N -3.76 1.54 -0.01 2.22 -2.24 -1.03 -4.65 114.28 106.35 2br9 n THR 161 Ca -0.01 -0.78 0.03 0.00 -2.27 0.00 0.00 64.05 61.02 2br9 n THR 161 Cb 0.52 -0.97 -0.07 0.00 -2.10 0.00 0.00 70.33 67.71 2br9 n THR 161 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2br9 n GLU 162 N -3.01 0.59 -4.88 -0.78 1.02 0.19 -5.03 120.64 108.75 2br9 n GLU 162 Ca -0.17 -0.07 -0.29 0.00 -0.02 0.00 0.00 57.16 56.60 2br9 n GLU 162 Cb 1.03 -1.22 -0.15 0.00 -0.02 0.00 0.00 31.44 31.08 2br9 n GLU 162 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2br9 s LEU 163 N -3.78 2.16 0.71 -4.62 1.43 -0.45 -4.92 118.68 109.21 2br9 s LEU 163 Ca -0.04 -0.58 -0.13 0.00 -1.03 0.00 0.00 54.13 52.35 2br9 s LEU 163 Cb 0.05 -1.24 0.03 0.00 0.03 0.00 0.00 46.19 45.06 2br9 s LEU 163 CO 0.38 0.25 1.11 -2.16 0.23 0.00 0.00 176.35 176.16 2br9 s PRO 164 N -1.22 2.52 0.44 1.29 0.04 -1.26 -4.66 135.00 132.15 2br9 s PRO 164 Ca 0.11 1.35 0.30 0.00 0.04 0.00 0.00 61.00 62.80 2br9 s PRO 164 Cb -0.10 -1.92 1.52 0.00 0.04 0.00 0.00 34.50 34.04 2br9 s PRO 164 CO 0.02 -1.46 1.91 -1.00 0.04 0.00 0.00 177.00 176.51 2br9 h PRO 165 N -0.44 0.00 -0.00 0.56 0.13 -1.92 -1.02 132.00 129.32 2br9 h PRO 165 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2br9 h PRO 165 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2br9 h PRO 165 CO 0.52 0.00 -0.22 0.25 -0.23 0.00 0.00 178.00 178.32 2br9 n THR 166 N -2.59 0.00 -1.89 1.56 -2.24 -1.26 -4.38 114.28 103.49 2br9 n THR 166 Ca -0.01 -0.05 -0.42 0.00 -2.27 0.00 0.00 64.05 61.31 2br9 n THR 166 Cb 0.11 0.02 -0.02 0.00 -2.10 0.00 0.00 70.33 68.34 2br9 n THR 166 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2br9 s HIS 167 N -2.71 2.95 0.47 4.78 5.04 -0.39 -4.75 115.29 120.68 2br9 s HIS 167 Ca 0.21 0.73 0.14 0.00 -1.54 0.00 0.00 55.06 54.60 2br9 s HIS 167 Cb 0.19 -3.96 1.09 0.00 0.04 0.00 0.00 32.58 29.94 2br9 s HIS 167 CO 0.55 -3.39 2.06 -1.00 -2.34 0.00 0.00 174.74 170.63 2br9 h PRO 168 N 5.82 0.07 -0.21 2.88 0.13 -1.90 -0.03 132.00 138.75 2br9 h PRO 168 Ca -0.45 -0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 64.56 2br9 h PRO 168 Cb 1.21 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 2br9 h PRO 168 CO 0.85 0.13 -0.30 0.82 -0.23 0.00 0.00 178.00 179.27 2br9 h ILE 169 N 0.07 1.33 -0.30 -3.56 2.04 -1.96 0.22 117.51 115.34 2br9 h ILE 169 Ca 0.02 -1.51 0.01 0.00 1.00 0.00 0.00 64.86 64.38 2br9 h ILE 169 Cb 0.15 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 2br9 h ILE 169 CO 0.01 0.46 0.18 -0.09 0.00 0.00 0.00 178.15 178.72 2br9 h ARG 170 N 0.25 0.37 -0.37 2.37 2.43 -1.68 -0.51 114.38 117.24 2br9 h ARG 170 Ca 0.02 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2br9 h ARG 170 Cb 0.88 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.33 2br9 h ARG 170 CO 0.07 0.24 0.21 -0.07 -1.51 0.00 0.00 179.97 178.91 2br9 h LEU 171 N 0.38 0.45 -1.09 3.80 3.38 -1.06 -0.58 115.31 120.59 2br9 h LEU 171 Ca 0.11 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.05 2br9 h LEU 171 Cb -0.02 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.56 2br9 h LEU 171 CO -0.04 0.40 0.62 1.23 0.09 0.00 0.00 178.44 180.73 2br9 h GLY 172 N 0.47 1.37 0.93 0.83 0.00 -0.88 -0.23 103.07 105.55 2br9 h GLY 172 Ca 0.13 -0.46 -0.00 0.00 0.00 0.00 0.00 47.33 47.00 2br9 h GLY 172 CO -0.02 0.38 0.05 -2.00 0.00 0.00 0.00 176.54 174.94 2br9 h LEU 173 N 1.16 0.11 -0.78 3.11 5.85 -0.91 -0.23 115.31 123.62 2br9 h LEU 173 Ca 0.38 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 59.04 2br9 h LEU 173 Cb 0.06 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2br9 h LEU 173 CO -0.13 0.16 0.50 0.00 -0.34 0.00 0.00 178.44 178.64 2br9 h ALA 174 N 0.95 1.01 -0.04 1.25 0.00 -0.51 -0.29 119.26 121.64 2br9 h ALA 174 Ca 0.03 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2br9 h ALA 174 Cb 0.08 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2br9 h ALA 174 CO -0.00 0.33 0.02 1.25 0.00 0.00 0.00 179.25 180.84 2br9 h LEU 175 N 0.99 0.05 -0.66 0.00 5.85 -0.80 -0.66 115.31 120.07 2br9 h LEU 175 Ca 0.30 -0.10 -0.13 0.00 0.84 0.00 0.00 57.88 58.80 2br9 h LEU 175 Cb -0.02 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 2br9 h LEU 175 CO -0.10 0.13 -0.31 0.78 -0.34 0.00 0.00 178.44 178.61 2br9 h ASN 176 N -0.05 0.74 -0.30 1.25 4.21 -0.66 -1.60 115.58 119.18 2br9 h ASN 176 Ca 0.01 -0.29 -0.15 0.00 1.21 0.00 0.00 56.30 57.08 2br9 h ASN 176 Cb 0.10 -0.20 -0.01 0.00 -1.12 0.00 0.00 38.32 37.09 2br9 h ASN 176 CO -0.00 0.99 -0.35 0.15 -1.29 0.00 0.00 177.43 176.93 2br9 h PHE 177 N 0.60 0.99 -0.61 1.19 3.57 -0.99 0.21 116.94 121.90 2br9 h PHE 177 Ca 0.07 -0.28 -0.09 0.00 3.53 0.00 0.00 57.97 61.20 2br9 h PHE 177 Cb 0.82 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.33 2br9 h PHE 177 CO 0.04 1.06 0.04 0.66 -2.23 0.00 0.00 178.31 177.89 2br9 h SER 178 N 0.69 1.02 -0.81 0.41 4.64 -0.93 -1.30 113.55 117.27 2br9 h SER 178 Ca 0.07 -0.29 -0.01 0.00 -0.47 0.00 0.00 61.79 61.09 2br9 h SER 178 Cb 0.91 -0.27 -0.04 0.00 -0.31 0.00 0.00 62.40 62.69 2br9 h SER 178 CO 0.08 1.06 0.47 0.58 -0.87 0.00 0.00 176.83 178.15 2br9 h VAL 179 N 0.95 1.23 -0.18 0.95 2.07 -0.97 -1.45 116.25 118.85 2br9 h VAL 179 Ca 0.18 -0.54 0.05 0.00 0.82 0.00 0.00 66.70 67.21 2br9 h VAL 179 Cb 0.51 0.12 -0.06 0.00 -1.52 0.00 0.00 31.29 30.33 2br9 h VAL 179 CO 0.02 0.25 -0.22 0.15 0.02 0.00 0.00 177.57 177.79 2br9 h PHE 180 N 1.12 -0.59 -0.93 1.57 3.57 -0.17 0.13 116.94 121.64 2br9 h PHE 180 Ca 0.29 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.88 2br9 h PHE 180 Cb -0.01 0.29 -0.06 0.00 2.79 0.00 0.00 35.95 38.95 2br9 h PHE 180 CO -0.00 -0.30 0.59 1.88 -2.23 0.00 0.00 178.31 178.25 2br9 h TYR 181 N -0.26 1.10 0.06 0.41 0.05 -0.77 0.27 116.97 117.84 2br9 h TYR 181 Ca 0.12 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.92 2br9 h TYR 181 Cb 0.44 -0.36 0.00 0.00 1.01 0.00 0.00 36.73 37.82 2br9 h TYR 181 CO -0.35 0.57 -0.03 -0.92 -1.05 0.00 0.00 178.16 176.38 2br9 h TYR 182 N 1.09 -0.07 0.08 4.88 3.20 -0.83 0.34 116.97 125.65 2br9 h TYR 182 Ca 0.40 -0.00 -0.33 0.00 3.14 0.00 0.00 58.73 61.94 2br9 h TYR 182 Cb 0.15 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 2br9 h TYR 182 CO -0.02 0.47 -1.84 0.93 -1.64 0.00 0.00 178.16 176.07 2br9 h GLU 183 N -0.69 0.16 0.02 1.82 5.08 -0.72 -3.16 114.58 117.09 2br9 h GLU 183 Ca -0.01 -0.28 -0.38 0.00 -1.00 0.00 0.00 59.36 57.69 2br9 h GLU 183 Cb 0.58 0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.88 2br9 h GLU 183 CO 0.01 0.93 -2.14 -0.89 -1.00 0.00 0.00 179.01 175.92 2br9 n ILE 184 N -3.31 1.55 1.45 3.13 2.08 0.03 -4.52 119.36 119.77 2br9 n ILE 184 Ca -0.24 -0.36 0.14 0.00 0.56 0.00 0.00 62.75 62.84 2br9 n ILE 184 Cb 1.05 -1.82 0.50 0.00 -0.75 0.00 0.00 39.64 38.62 2br9 n ILE 184 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 2br9 n LEU 185 N -4.01 1.40 -3.63 1.39 4.77 -0.85 -4.94 117.00 111.12 2br9 n LEU 185 Ca -0.45 -0.45 -0.23 0.00 -0.03 0.00 0.00 56.01 54.85 2br9 n LEU 185 Cb 0.88 -0.03 0.07 0.00 -2.33 0.00 0.00 43.42 42.01 2br9 n LEU 185 CO 0.16 0.24 0.17 -3.20 -1.33 0.00 0.00 177.39 173.43 2br9 n ASN 186 N 0.00 -4.72 -3.54 -1.43 5.15 -0.79 -4.95 115.26 104.98 2br9 n ASN 186 Ca 0.18 -0.62 -0.27 0.00 -0.60 0.00 0.00 54.58 53.26 2br9 n ASN 186 Cb 0.35 -4.77 -0.10 0.00 -0.53 0.00 0.00 39.78 34.73 2br9 n ASN 186 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 2br9 n SER 187 N -3.01 1.75 -0.09 1.20 2.88 0.11 -4.95 113.62 111.50 2br9 n SER 187 Ca -0.08 -2.95 0.06 0.00 -1.33 0.00 0.00 58.87 54.57 2br9 n SER 187 Cb 0.59 -0.66 0.40 0.00 -0.75 0.00 0.00 64.21 63.78 2br9 n SER 187 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2br9 h PRO 188 N 4.97 0.62 0.12 -1.46 0.13 -1.85 -1.09 132.00 133.44 2br9 h PRO 188 Ca 0.18 -0.04 0.02 0.00 -0.87 0.00 0.00 66.00 65.29 2br9 h PRO 188 Cb 0.80 -0.14 -0.04 0.00 0.13 0.00 0.00 31.00 31.75 2br9 h PRO 188 CO 0.61 0.41 -0.29 -0.44 -0.23 0.00 0.00 178.00 178.05 2br9 h ASP 189 N 0.64 -0.85 -0.39 1.44 5.19 -1.95 0.85 116.42 121.36 2br9 h ASP 189 Ca 0.23 0.10 -0.09 0.00 -0.62 0.00 0.00 57.03 56.65 2br9 h ASP 189 Cb 0.13 0.32 -0.02 0.00 0.18 0.00 0.00 39.33 39.94 2br9 h ASP 189 CO -0.06 -0.38 -0.09 0.03 -3.12 0.00 0.00 179.24 175.61 2br9 h ARG 190 N -0.51 0.83 -0.10 3.56 3.08 -1.86 -1.04 114.38 118.33 2br9 h ARG 190 Ca 0.03 -0.27 -0.00 0.00 0.07 0.00 0.00 59.98 59.81 2br9 h ARG 190 Cb 0.54 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.52 2br9 h ARG 190 CO -0.18 0.89 0.05 0.00 -1.07 0.00 0.00 179.97 179.66 2br9 h ALA 191 N 1.14 0.13 -0.44 0.04 0.00 -0.99 -1.55 119.26 117.59 2br9 h ALA 191 Ca 0.13 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 2br9 h ALA 191 Cb 0.58 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2br9 h ALA 191 CO 0.04 -0.30 -0.06 0.00 0.00 0.00 0.00 179.25 178.92 2br9 h ARG 193 N 0.70 0.61 -0.20 0.00 -0.00 -0.93 0.12 114.38 114.67 2br9 h ARG 193 Ca 0.13 -0.15 -0.03 0.00 -0.00 0.00 0.00 59.98 59.93 2br9 h ARG 193 Cb 0.52 -0.08 -0.01 0.00 -0.00 0.00 0.00 29.97 30.40 2br9 h ARG 193 CO 0.03 0.64 0.01 1.25 -0.00 0.00 0.00 179.97 181.90 2br9 h LEU 194 N 0.47 0.34 -0.33 0.08 5.85 -1.18 -0.09 115.31 120.45 2br9 h LEU 194 Ca 0.12 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 2br9 h LEU 194 Cb 0.30 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 2br9 h LEU 194 CO 0.00 0.55 0.08 0.00 -0.34 0.00 0.00 178.44 178.72 2br9 h ALA 195 N 0.81 0.44 -0.63 1.25 0.00 -1.26 -0.48 119.26 119.39 2br9 h ALA 195 Ca 0.06 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 2br9 h ALA 195 Cb 0.36 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2br9 h ALA 195 CO 0.01 0.11 0.13 -0.22 0.00 0.00 0.00 179.25 179.28 2br9 h LYS 196 N 0.38 1.00 -0.18 0.00 1.63 -0.72 -1.62 116.57 117.06 2br9 h LYS 196 Ca 0.10 -0.24 -0.01 0.00 -0.85 0.00 0.00 60.65 59.65 2br9 h LYS 196 Cb 0.31 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.79 2br9 h LYS 196 CO 0.00 0.90 0.06 0.00 -3.45 0.00 0.00 179.45 176.96 2br9 h ALA 197 N 1.19 0.23 -0.42 5.00 0.00 -0.69 -0.44 119.26 124.12 2br9 h ALA 197 Ca 0.20 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2br9 h ALA 197 Cb 0.37 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2br9 h ALA 197 CO 0.00 -0.15 0.27 0.00 0.00 0.00 0.00 179.25 179.38 2br9 h ALA 198 N 0.88 0.54 0.06 0.00 0.00 -0.93 -0.36 119.26 119.45 2br9 h ALA 198 Ca 0.06 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2br9 h ALA 198 Cb 0.22 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2br9 h ALA 198 CO -0.00 0.00 -0.08 0.35 0.00 0.00 0.00 179.25 179.52 2br9 h PHE 199 N 0.57 -0.21 -0.24 0.00 3.57 -1.12 -2.28 116.94 117.22 2br9 h PHE 199 Ca 0.15 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.60 2br9 h PHE 199 Cb -0.05 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 2br9 h PHE 199 CO -0.04 -0.13 -0.10 -0.44 -2.23 0.00 0.00 178.31 175.37 2br9 h ASP 200 N -0.17 0.38 -0.25 0.41 3.32 -0.91 -0.80 116.42 118.39 2br9 h ASP 200 Ca 0.01 -0.08 -0.15 0.00 0.02 0.00 0.00 57.03 56.83 2br9 h ASP 200 Cb 0.18 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 2br9 h ASP 200 CO -0.04 0.52 -0.38 0.44 -1.72 0.00 0.00 179.24 178.06 2br9 h ASP 201 N 0.37 0.84 -0.30 6.45 3.32 -0.95 -2.11 116.42 124.04 2br9 h ASP 201 Ca 0.07 -0.38 -0.05 0.00 0.02 0.00 0.00 57.03 56.70 2br9 h ASP 201 Cb 0.42 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 2br9 h ASP 201 CO 0.02 1.13 0.00 0.00 -1.72 0.00 0.00 179.24 178.67 2br9 h ALA 202 N 0.91 0.40 -0.97 3.45 0.00 -0.91 -3.04 119.26 119.10 2br9 h ALA 202 Ca 0.06 -0.23 0.11 0.00 0.00 0.00 0.00 54.91 54.85 2br9 h ALA 202 Cb 0.94 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.54 2br9 h ALA 202 CO 0.09 0.15 0.60 0.82 0.00 0.00 0.00 179.25 180.90 2br9 h ILE 203 N 0.32 0.93 0.00 0.00 1.08 -1.00 -1.75 117.51 117.09 2br9 h ILE 203 Ca 0.08 -0.33 0.00 0.00 -0.39 0.00 0.00 64.86 64.22 2br9 h ILE 203 Cb 0.43 -0.12 0.00 0.00 -3.07 0.00 0.00 36.82 34.06 2br9 h ILE 203 CO 0.02 0.18 0.00 0.00 -0.69 0.00 0.00 178.15 177.65 2br9 h ALA 204 N 1.51 1.00 -0.73 1.87 0.00 -1.27 -3.22 119.26 118.42 2br9 h ALA 204 Ca 0.47 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 55.03 2br9 h ALA 204 Cb 0.44 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 17.82 2br9 h ALA 204 CO -0.26 0.00 -1.06 0.39 0.00 0.00 0.00 179.25 178.33 2br9 n GLU 205 N -2.86 2.05 0.29 0.00 1.02 -0.68 -4.88 120.64 115.57 2br9 n GLU 205 Ca 0.00 -3.64 0.15 0.00 -0.02 0.00 0.00 57.16 53.65 2br9 n GLU 205 Cb 0.25 -1.68 0.86 0.00 -0.02 0.00 0.00 31.44 30.85 2br9 n GLU 205 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2br9 h LEU 206 N 2.64 0.00 0.00 -4.62 3.38 -1.52 -0.65 115.31 114.54 2br9 h LEU 206 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2br9 h LEU 206 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2br9 h LEU 206 CO 0.42 0.05 0.00 -0.90 0.09 0.00 0.00 178.44 178.10 2br9 n ASP 207 N -3.64 0.00 -0.28 -0.43 3.85 -1.26 -1.58 116.55 113.22 2br9 n ASP 207 Ca -0.02 0.33 0.13 0.00 -0.71 0.00 0.00 54.79 54.51 2br9 n ASP 207 Cb 0.16 -0.37 0.41 0.00 -1.35 0.00 0.00 41.12 39.96 2br9 n ASP 207 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 2br9 n THR 208 N -1.37 0.00 -1.68 2.12 -2.24 -0.25 -4.95 114.28 105.91 2br9 n THR 208 Ca 0.02 -0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.25 2br9 n THR 208 Cb 0.05 0.40 0.01 0.00 -2.10 0.00 0.00 70.33 68.69 2br9 n THR 208 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2br9 n LEU 209 N -0.54 3.71 -4.77 3.22 4.77 -0.61 -4.86 117.00 117.92 2br9 n LEU 209 Ca 0.13 1.09 -0.35 0.00 -0.03 0.00 0.00 56.01 56.86 2br9 n LEU 209 Cb 0.35 -1.47 -0.08 0.00 -2.33 0.00 0.00 43.42 39.90 2br9 n LEU 209 CO 0.24 -0.84 -0.25 -0.55 -1.33 0.00 0.00 177.39 174.67 2br9 s SER 210 N -0.59 5.71 0.42 -1.43 0.15 -1.26 -4.98 113.70 111.72 2br9 s SER 210 Ca 0.62 0.23 0.19 0.00 0.70 0.00 0.00 55.95 57.68 2br9 s SER 210 Cb -0.52 -1.69 1.12 0.00 -1.71 0.00 0.00 66.02 63.22 2br9 s SER 210 CO 0.58 0.34 1.84 1.05 1.20 0.00 0.00 173.24 178.24 2br9 h GLU 211 N 4.65 0.36 0.00 5.44 9.09 -2.01 -0.03 114.58 132.08 2br9 h GLU 211 Ca -0.51 -0.02 -0.05 0.00 0.05 0.00 0.00 59.36 58.82 2br9 h GLU 211 Cb 1.20 -0.08 -0.01 0.00 -1.65 0.00 0.00 28.75 28.21 2br9 h GLU 211 CO 0.59 0.24 -0.26 0.93 0.05 0.00 0.00 179.01 180.56 2br9 h GLU 212 N 0.37 0.00 0.00 1.06 4.39 -2.02 -3.37 114.58 115.01 2br9 h GLU 212 Ca 0.50 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.20 2br9 h GLU 212 Cb 1.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 2br9 h GLU 212 CO -0.19 0.26 0.00 -1.13 -1.16 0.00 0.00 179.01 176.79 2br9 n SER 213 N -3.77 0.00 0.15 1.42 3.41 -0.79 -4.88 113.62 109.16 2br9 n SER 213 Ca -0.01 -1.00 0.09 0.00 -0.26 0.00 0.00 58.87 57.69 2br9 n SER 213 Cb 0.36 0.00 0.59 0.00 -0.26 0.00 0.00 64.21 64.90 2br9 n SER 213 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 2br9 h TYR 214 N 0.00 0.14 -0.31 7.33 -0.00 -1.20 0.79 116.97 123.73 2br9 h TYR 214 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 58.73 58.60 2br9 h TYR 214 Cb 0.88 -0.05 -0.01 0.00 -0.00 0.00 0.00 36.73 37.56 2br9 h TYR 214 CO 0.00 0.08 -0.37 0.87 -0.00 0.00 0.00 178.16 178.75 2br9 h LYS 215 N 0.15 0.70 -0.55 0.10 6.56 -1.90 -1.21 116.57 120.42 2br9 h LYS 215 Ca 0.08 -0.35 -0.07 0.00 -1.06 0.00 0.00 60.65 59.25 2br9 h LYS 215 Cb 0.15 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.79 2br9 h LYS 215 CO -0.01 0.96 0.05 -0.44 -2.06 0.00 0.00 179.45 177.95 2br9 h ASP 216 N 0.58 0.91 -0.67 0.86 3.32 -1.44 -1.25 116.42 118.73 2br9 h ASP 216 Ca 0.06 -0.28 -0.02 0.00 0.02 0.00 0.00 57.03 56.81 2br9 h ASP 216 Cb 0.90 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 2br9 h ASP 216 CO 0.08 0.96 0.35 0.28 -1.72 0.00 0.00 179.24 179.19 2br9 h SER 217 N 0.82 0.86 -0.51 6.45 0.02 -0.81 -1.50 113.55 118.89 2br9 h SER 217 Ca 0.16 -0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 60.97 2br9 h SER 217 Cb 0.46 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 2br9 h SER 217 CO 0.02 0.73 0.19 0.74 -1.14 0.00 0.00 176.83 177.37 2br9 h THR 218 N 0.93 1.22 -0.31 -2.27 2.02 -1.01 -0.02 112.91 113.46 2br9 h THR 218 Ca 0.23 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.70 2br9 h THR 218 Cb 0.08 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 2br9 h THR 218 CO -0.03 0.26 0.17 0.25 0.37 0.00 0.00 175.52 176.54 2br9 h LEU 219 N 0.69 0.39 -0.65 2.58 5.85 -1.09 -0.59 115.31 122.49 2br9 h LEU 219 Ca 0.17 -0.09 -0.09 0.00 0.84 0.00 0.00 57.88 58.71 2br9 h LEU 219 Cb 0.22 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 2br9 h LEU 219 CO -0.01 0.37 0.06 0.40 -0.34 0.00 0.00 178.44 178.93 2br9 h ILE 220 N 0.39 1.27 -0.81 4.05 2.04 -0.60 -1.18 117.51 122.66 2br9 h ILE 220 Ca 0.11 -1.09 0.03 0.00 1.00 0.00 0.00 64.86 64.91 2br9 h ILE 220 Cb 0.07 0.69 -0.05 0.00 -0.74 0.00 0.00 36.82 36.79 2br9 h ILE 220 CO -0.02 0.41 0.52 0.24 0.00 0.00 0.00 178.15 179.29 2br9 h MET 221 N 1.02 0.97 -0.85 2.37 2.86 -0.78 -0.15 114.93 120.37 2br9 h MET 221 Ca 0.19 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.77 2br9 h MET 221 Cb 0.49 -0.22 -0.04 0.00 0.06 0.00 0.00 31.60 31.89 2br9 h MET 221 CO 0.02 0.64 0.50 0.37 1.06 0.00 0.00 176.91 179.51 2br9 h GLN 222 N 1.00 1.16 -0.45 1.72 5.75 -0.51 -1.68 115.11 122.10 2br9 h GLN 222 Ca 0.32 -0.11 -0.14 0.00 -0.15 0.00 0.00 58.65 58.57 2br9 h GLN 222 Cb 0.02 -0.24 -0.01 0.00 1.07 0.00 0.00 27.48 28.32 2br9 h GLN 222 CO -0.12 0.82 -0.27 -0.07 -2.65 0.00 0.00 178.83 176.55 2br9 h LEU 223 N 1.18 1.00 -0.40 -2.39 3.38 -0.20 0.86 115.31 118.75 2br9 h LEU 223 Ca 0.31 -0.40 0.05 0.00 0.09 0.00 0.00 57.88 57.92 2br9 h LEU 223 Cb -0.03 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.40 2br9 h LEU 223 CO -0.06 1.20 0.15 -0.07 0.09 0.00 0.00 178.44 179.75 2br9 h LEU 224 N 0.82 0.17 -0.55 1.67 3.38 -0.91 -0.91 115.31 118.98 2br9 h LEU 224 Ca 0.09 0.04 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 2br9 h LEU 224 Cb 0.85 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 2br9 h LEU 224 CO 0.08 0.13 0.11 -0.09 0.09 0.00 0.00 178.44 178.75 2br9 h ARG 225 N 0.31 0.89 -0.17 1.13 2.43 -0.95 -0.98 114.38 117.05 2br9 h ARG 225 Ca 0.18 -0.23 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2br9 h ARG 225 Cb 0.15 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 2br9 h ARG 225 CO -0.18 0.85 0.10 -0.44 -1.51 0.00 0.00 179.97 178.80 2br9 h ASP 226 N 0.79 0.20 -0.43 -3.80 3.32 -0.61 0.37 116.42 116.26 2br9 h ASP 226 Ca 0.17 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2br9 h ASP 226 Cb 0.38 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 2br9 h ASP 226 CO 0.01 0.20 0.28 0.78 -1.72 0.00 0.00 179.24 178.79 2br9 h ASN 227 N 0.19 0.49 -0.90 6.45 2.35 -1.01 -0.89 115.58 122.26 2br9 h ASN 227 Ca 0.06 -0.01 0.09 0.00 -0.55 0.00 0.00 56.30 55.89 2br9 h ASN 227 Cb 0.04 -0.12 -0.06 0.00 0.05 0.00 0.00 38.32 38.22 2br9 h ASN 227 CO -0.01 0.36 0.58 -0.07 -1.65 0.00 0.00 177.43 176.64 2br9 h LEU 228 N 0.58 0.83 -0.06 1.61 3.38 -0.98 0.24 115.31 120.91 2br9 h LEU 228 Ca 0.16 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 2br9 h LEU 228 Cb -0.07 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 2br9 h LEU 228 CO -0.03 0.50 0.03 0.74 0.09 0.00 0.00 178.44 179.77 2br9 h THR 229 N 0.92 1.07 -0.19 0.22 2.02 -0.26 -1.52 112.91 115.17 2br9 h THR 229 Ca 0.41 -0.18 0.03 0.00 0.77 0.00 0.00 66.41 67.44 2br9 h THR 229 Cb 0.36 1.08 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 2br9 h THR 229 CO -0.17 0.06 0.00 0.25 0.37 0.00 0.00 175.52 176.03 2br9 h LEU 230 N 0.02 -0.06 -0.57 2.58 5.85 -0.30 -3.16 115.31 119.68 2br9 h LEU 230 Ca 0.02 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2br9 h LEU 230 Cb 0.06 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.16 2br9 h LEU 230 CO -0.00 -0.01 0.00 -0.50 -0.34 0.00 0.00 178.44 177.59 2br9 h TRP 231 N 0.07 0.00 0.00 1.25 6.55 -0.42 -3.51 115.95 119.89 2br9 h TRP 231 Ca 0.09 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.93 2br9 h TRP 231 Cb 0.11 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.41 2br9 h TRP 231 CO -0.17 0.00 0.00 0.25 -1.05 0.00 0.00 178.44 177.47