#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bd9 h SER 6 N 0.00 0.00 -0.30 -1.43 4.64 -2.01 -1.14 113.55 113.31 1bd9 h SER 6 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1bd9 h SER 6 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1bd9 h SER 6 CO 0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 1bd9 n LYS 7 N -3.94 2.35 -0.17 4.77 5.02 -1.26 -4.32 118.16 120.60 1bd9 n LYS 7 Ca -0.01 -1.36 -0.01 0.00 -2.02 0.00 0.00 58.31 54.90 1bd9 n LYS 7 Cb 0.16 -1.58 0.08 0.00 -0.02 0.00 0.00 35.03 33.67 1bd9 n LYS 7 CO 0.00 0.00 0.00 2.35 -0.52 0.00 0.00 177.40 179.23 1bd9 h TRP 8 N 1.93 0.24 -0.60 2.13 2.91 -1.65 -2.20 115.95 118.71 1bd9 h TRP 8 Ca 0.00 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.05 1bd9 h TRP 8 Cb 0.85 -0.03 0.00 0.00 -0.51 0.00 0.00 29.16 29.48 1bd9 h TRP 8 CO 0.38 0.03 0.00 0.43 -1.03 0.00 0.00 178.44 178.25 1bd9 n SER 9 N -5.07 5.26 -1.51 2.65 7.64 -1.26 -0.62 113.62 120.70 1bd9 n SER 9 Ca 0.07 -2.70 0.00 0.00 1.01 0.00 0.00 58.87 57.24 1bd9 n SER 9 Cb 0.25 -0.64 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 1bd9 n SER 9 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bd9 n GLY 10 N 0.85 0.96 0.33 0.23 0.00 -0.83 -4.64 105.19 102.09 1bd9 n GLY 10 Ca 0.27 -1.45 0.14 0.00 0.00 0.00 0.00 46.02 44.98 1bd9 n GLY 10 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1bd9 h PRO 11 N 0.00 0.48 0.00 1.61 0.11 -1.90 -0.99 132.00 131.31 1bd9 h PRO 11 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1bd9 h PRO 11 Cb 0.00 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.00 1bd9 h PRO 11 CO 0.00 0.32 0.00 1.28 -0.21 0.00 0.00 178.00 179.39 1bd9 n LEU 12 N -4.97 0.62 -4.07 2.35 4.77 -1.26 -4.89 117.00 109.54 1bd9 n LEU 12 Ca 0.24 0.69 -0.36 0.00 -0.03 0.00 0.00 56.01 56.55 1bd9 n LEU 12 Cb 0.67 -0.66 -0.02 0.00 -2.33 0.00 0.00 43.42 41.08 1bd9 n LEU 12 CO 0.15 -0.68 -0.26 -1.20 -1.33 0.00 0.00 177.39 174.06 1bd9 n SER 13 N -2.23 -1.99 -0.06 -1.43 7.64 -0.38 -4.82 113.62 110.36 1bd9 n SER 13 Ca 0.01 -1.20 0.15 0.00 1.01 0.00 0.00 58.87 58.84 1bd9 n SER 13 Cb 0.16 -2.15 0.71 0.00 -1.01 0.00 0.00 64.21 61.92 1bd9 n SER 13 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1bd9 n LEU 14 N -4.67 0.23 0.10 -3.43 4.77 0.21 -2.27 117.00 111.94 1bd9 n LEU 14 Ca -0.21 0.12 0.10 0.00 -0.03 0.00 0.00 56.01 55.99 1bd9 n LEU 14 Cb 0.63 -0.21 0.44 0.00 -2.33 0.00 0.00 43.42 41.96 1bd9 n LEU 14 CO 0.77 0.04 0.82 0.00 -1.33 0.00 0.00 177.39 177.69 1bd9 n GLN 15 N -1.09 0.14 0.11 3.23 0.00 -1.26 -1.39 117.38 117.12 1bd9 n GLN 15 Ca 0.15 0.39 0.11 0.00 0.00 0.00 0.00 57.00 57.66 1bd9 n GLN 15 Cb 0.25 -1.78 0.45 0.00 0.00 0.00 0.00 30.24 29.16 1bd9 n GLN 15 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1bd9 n GLU 16 N -2.05 0.15 -0.07 2.61 1.02 -0.96 -3.68 120.64 117.67 1bd9 n GLU 16 Ca 0.02 0.40 -0.12 0.00 -0.02 0.00 0.00 57.16 57.44 1bd9 n GLU 16 Cb 0.20 -1.80 -0.04 0.00 -0.02 0.00 0.00 31.44 29.78 1bd9 n GLU 16 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1bd9 n VAL 17 N -2.09 1.34 -3.82 2.62 0.31 -0.49 -5.08 118.33 111.12 1bd9 n VAL 17 Ca 0.02 0.05 -0.06 0.00 -0.01 0.00 0.00 64.34 64.34 1bd9 n VAL 17 Cb 0.21 -2.04 0.00 0.00 -0.91 0.00 0.00 33.84 31.10 1bd9 n VAL 17 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1bd9 s ASP 18 N -6.23 -0.11 0.40 4.52 -1.08 -1.10 -4.03 116.67 109.04 1bd9 s ASP 18 Ca -0.24 -0.73 -0.27 0.00 -0.52 0.00 0.00 52.55 50.79 1bd9 s ASP 18 Cb 0.06 0.66 -0.09 0.00 -1.46 0.00 0.00 42.92 42.08 1bd9 s ASP 18 CO 0.34 -1.27 1.36 -1.61 0.52 0.00 0.00 175.17 174.51 1bd9 s GLU 19 N -2.94 3.98 -0.17 4.34 2.02 -1.26 -4.04 118.70 120.63 1bd9 s GLU 19 Ca 0.15 2.29 -0.39 0.00 0.02 0.00 0.00 54.97 57.03 1bd9 s GLU 19 Cb -0.04 -2.81 -0.16 0.00 0.10 0.00 0.00 34.13 31.22 1bd9 s GLU 19 CO 0.07 -0.53 1.59 0.94 0.02 0.00 0.00 175.26 177.34 1bd9 n GLN 20 N 0.20 1.06 -0.92 1.61 7.27 -1.26 -4.37 117.38 120.96 1bd9 n GLN 20 Ca 0.03 0.38 -0.30 0.00 0.07 0.00 0.00 57.00 57.19 1bd9 n GLN 20 Cb 0.42 -2.04 0.17 0.00 2.41 0.00 0.00 30.24 31.20 1bd9 n GLN 20 CO 0.00 0.00 0.00 -2.14 0.07 0.00 0.00 177.06 174.99 1bd9 s PRO 21 N 2.44 0.82 0.16 3.69 0.02 -1.26 -4.72 135.00 136.15 1bd9 s PRO 21 Ca 0.94 1.08 -0.07 0.00 0.02 0.00 0.00 61.00 62.97 1bd9 s PRO 21 Cb -1.06 -1.74 0.02 0.00 0.02 0.00 0.00 34.50 31.74 1bd9 s PRO 21 CO 0.60 -2.62 1.46 1.96 -0.33 0.00 0.00 177.00 178.08 1bd9 h GLN 22 N -1.83 0.72 -4.87 5.54 4.20 -1.25 -3.46 115.11 114.16 1bd9 h GLN 22 Ca -0.50 -0.45 -0.36 0.00 0.06 0.00 0.00 58.65 57.41 1bd9 h GLN 22 Cb 1.28 0.05 -0.24 0.00 0.30 0.00 0.00 27.48 28.87 1bd9 h GLN 22 CO 0.49 1.07 -0.76 -1.01 -0.67 0.00 0.00 178.83 177.95 1bd9 s HIS 23 N -4.09 0.89 0.22 2.96 3.76 -0.08 -4.94 115.29 114.01 1bd9 s HIS 23 Ca -0.09 -0.37 -0.30 0.00 -0.15 0.00 0.00 55.06 54.15 1bd9 s HIS 23 Cb 0.11 -0.53 -0.09 0.00 1.11 0.00 0.00 32.58 33.18 1bd9 s HIS 23 CO 0.86 -0.01 1.33 -1.25 -0.85 0.00 0.00 174.74 174.83 1bd9 s PRO 24 N -1.19 4.36 -0.23 8.40 0.04 -1.26 -1.72 135.00 143.41 1bd9 s PRO 24 Ca -0.03 2.12 -0.12 0.00 0.04 0.00 0.00 61.00 63.00 1bd9 s PRO 24 Cb -0.08 -3.17 -0.05 0.00 0.04 0.00 0.00 34.50 31.25 1bd9 s PRO 24 CO 0.01 -0.28 0.24 -1.17 0.04 0.00 0.00 177.00 175.84 1bd9 s LEU 25 N -0.32 4.12 -0.24 -3.56 2.96 -0.33 -4.56 118.68 116.75 1bd9 s LEU 25 Ca 0.56 0.24 -0.21 0.00 -0.22 0.00 0.00 54.13 54.51 1bd9 s LEU 25 Cb -0.38 -2.25 -0.02 0.00 0.50 0.00 0.00 46.19 44.05 1bd9 s LEU 25 CO 0.40 0.01 0.66 -2.28 -1.32 0.00 0.00 176.35 173.82 1bd9 s HIS 26 N 1.19 3.31 -0.15 5.38 5.65 0.04 -4.63 115.29 126.08 1bd9 s HIS 26 Ca 0.11 0.88 0.01 0.00 0.25 0.00 0.00 55.06 56.32 1bd9 s HIS 26 Cb -0.14 -2.86 0.00 0.00 -1.18 0.00 0.00 32.58 28.40 1bd9 s HIS 26 CO 0.06 -0.30 -0.18 0.08 -0.65 0.00 0.00 174.74 173.74 1bd9 s VAL 27 N 2.42 2.39 0.01 0.89 1.01 -1.12 -1.37 120.40 124.63 1bd9 s VAL 27 Ca 0.28 -0.87 0.05 0.00 0.00 0.00 0.00 61.98 61.44 1bd9 s VAL 27 Cb -0.16 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 1bd9 s VAL 27 CO 0.09 0.53 -0.12 0.42 0.00 0.00 0.00 175.10 176.01 1bd9 s THR 28 N 0.80 3.22 0.46 3.92 -4.23 0.42 -0.42 115.64 119.82 1bd9 s THR 28 Ca -0.06 -0.94 0.04 0.00 -1.18 0.00 0.00 61.69 59.54 1bd9 s THR 28 Cb -0.15 -2.37 -0.04 0.00 1.34 0.00 0.00 72.50 71.27 1bd9 s THR 28 CO -0.01 0.39 0.02 -0.31 -0.54 0.00 0.00 174.62 174.17 1bd9 s TYR 29 N -0.94 2.18 0.22 3.99 2.02 0.86 -0.21 117.35 125.48 1bd9 s TYR 29 Ca 0.15 -0.81 -0.08 0.00 -0.37 0.00 0.00 57.07 55.96 1bd9 s TYR 29 Cb -0.11 -1.70 0.35 0.00 -0.40 0.00 0.00 41.96 40.10 1bd9 s TYR 29 CO 0.06 0.32 1.70 0.00 -1.57 0.00 0.00 175.55 176.06 1bd9 h ALA 30 N 1.53 0.80 -0.21 3.71 0.00 -1.84 -3.14 119.26 120.11 1bd9 h ALA 30 Ca -0.44 0.14 -0.20 0.00 0.00 0.00 0.00 54.91 54.41 1bd9 h ALA 30 Cb 1.28 0.19 -0.28 0.00 0.00 0.00 0.00 17.79 18.98 1bd9 h ALA 30 CO 0.77 -0.31 -0.85 0.41 0.00 0.00 0.00 179.25 179.28 1bd9 n GLY 31 N -1.33 3.37 3.83 0.00 0.00 -1.26 -5.09 105.19 104.71 1bd9 n GLY 31 Ca 0.11 -1.35 -0.06 0.00 0.00 0.00 0.00 46.02 44.72 1bd9 n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bd9 s ALA 32 N -2.33 -1.26 -0.14 4.61 0.00 -1.19 -5.07 121.76 116.37 1bd9 s ALA 32 Ca 0.37 -0.29 -0.29 0.00 0.00 0.00 0.00 51.96 51.75 1bd9 s ALA 32 Cb 0.37 0.76 0.08 0.00 0.00 0.00 0.00 23.12 24.33 1bd9 s ALA 32 CO -0.08 -1.03 0.76 0.00 0.00 0.00 0.00 175.76 175.41 1bd9 s ALA 33 N -3.32 -1.81 -0.63 0.00 0.00 -1.26 -0.10 121.76 114.64 1bd9 s ALA 33 Ca 0.13 1.58 -0.15 0.00 0.00 0.00 0.00 51.96 53.51 1bd9 s ALA 33 Cb -0.04 -0.50 0.16 0.00 0.00 0.00 0.00 23.12 22.73 1bd9 s ALA 33 CO 0.07 -0.34 0.58 0.08 0.00 0.00 0.00 175.76 176.14 1bd9 s VAL 34 N -0.68 5.32 -0.47 0.00 1.01 0.44 -4.83 120.40 121.20 1bd9 s VAL 34 Ca -0.06 -1.81 0.05 0.00 0.00 0.00 0.00 61.98 60.17 1bd9 s VAL 34 Cb -0.02 -4.37 0.14 0.00 0.00 0.00 0.00 36.38 32.13 1bd9 s VAL 34 CO 0.05 -0.92 1.08 -0.90 0.00 0.00 0.00 175.10 174.42 1bd9 n ASP 35 N 4.85 2.36 -3.76 3.32 5.68 -1.26 -2.80 116.55 124.94 1bd9 n ASP 35 Ca -0.05 -1.93 -0.13 0.00 -0.50 0.00 0.00 54.79 52.18 1bd9 n ASP 35 Cb 0.42 -0.10 -0.12 0.00 -1.14 0.00 0.00 41.12 40.18 1bd9 n ASP 35 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 1bd9 s GLU 36 N -0.95 0.27 -0.06 0.11 2.12 -1.26 -5.09 118.70 113.84 1bd9 s GLU 36 Ca 0.11 0.43 -0.30 0.00 0.36 0.00 0.00 54.97 55.57 1bd9 s GLU 36 Cb 0.06 0.06 -0.06 0.00 0.26 0.00 0.00 34.13 34.44 1bd9 s GLU 36 CO 0.08 -0.08 1.84 -1.17 -0.54 0.00 0.00 175.26 175.38 1bd9 s LEU 37 N 0.54 4.21 0.00 2.70 2.96 -1.26 -1.84 118.68 125.98 1bd9 s LEU 37 Ca -0.03 2.28 0.00 0.00 -0.22 0.00 0.00 54.13 56.16 1bd9 s LEU 37 Cb -0.05 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.11 1bd9 s LEU 37 CO -0.03 -1.14 0.00 0.61 -1.32 0.00 0.00 176.35 174.47 1bd9 n GLY 38 N 4.55 0.73 3.63 7.98 0.00 0.27 -4.96 105.19 117.39 1bd9 n GLY 38 Ca 0.20 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.73 1bd9 n GLY 38 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1bd9 n LYS 39 N -2.43 1.63 -2.65 1.61 4.81 -0.77 -3.88 118.16 116.48 1bd9 n LYS 39 Ca 0.00 0.59 -0.42 0.00 -0.87 0.00 0.00 58.31 57.60 1bd9 n LYS 39 Cb 0.00 -2.26 -0.03 0.00 0.02 0.00 0.00 35.03 32.76 1bd9 n LYS 39 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1bd9 s VAL 40 N 0.51 4.70 0.32 3.15 1.01 -1.26 -0.82 120.40 128.01 1bd9 s VAL 40 Ca 0.79 1.95 0.03 0.00 0.00 0.00 0.00 61.98 64.75 1bd9 s VAL 40 Cb -0.80 -4.25 -0.06 0.00 0.00 0.00 0.00 36.38 31.27 1bd9 s VAL 40 CO 0.44 0.09 0.08 -0.76 0.00 0.00 0.00 175.10 174.95 1bd9 s LEU 41 N 1.42 2.02 0.19 3.92 1.43 0.37 -4.90 118.68 123.13 1bd9 s LEU 41 Ca 0.52 -1.42 0.05 0.00 -1.03 0.00 0.00 54.13 52.25 1bd9 s LEU 41 Cb -0.21 -0.25 -0.03 0.00 0.03 0.00 0.00 46.19 45.72 1bd9 s LEU 41 CO 0.25 -0.68 0.24 0.42 0.23 0.00 0.00 176.35 176.81 1bd9 s THR 42 N -3.39 4.90 0.22 5.49 -4.23 -1.26 -4.23 115.64 113.14 1bd9 s THR 42 Ca 0.35 -1.01 -0.08 0.00 -1.18 0.00 0.00 61.69 59.77 1bd9 s THR 42 Cb 0.08 -3.58 0.16 0.00 1.34 0.00 0.00 72.50 70.50 1bd9 s THR 42 CO 0.15 -0.20 1.76 -0.65 -0.54 0.00 0.00 174.62 175.13 1bd9 h PRO 43 N 1.86 0.47 -0.65 3.99 0.11 -1.83 -1.44 132.00 134.51 1bd9 h PRO 43 Ca -0.49 -0.03 0.13 0.00 0.11 0.00 0.00 66.00 65.72 1bd9 h PRO 43 Cb 1.21 -0.11 -0.10 0.00 0.11 0.00 0.00 31.00 32.12 1bd9 h PRO 43 CO 0.64 0.31 0.11 1.15 -0.21 0.00 0.00 178.00 180.00 1bd9 h THR 44 N 0.48 0.56 -0.56 -1.15 2.02 -1.95 -1.12 112.91 111.20 1bd9 h THR 44 Ca 0.33 -0.08 0.01 0.00 0.77 0.00 0.00 66.41 67.43 1bd9 h THR 44 Cb 0.38 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 1bd9 h THR 44 CO -0.29 0.04 0.37 1.56 0.37 0.00 0.00 175.52 177.57 1bd9 h GLN 45 N 0.23 0.73 -0.47 6.66 4.20 -1.67 -2.84 115.11 121.95 1bd9 h GLN 45 Ca 0.35 -0.04 -0.15 0.00 0.06 0.00 0.00 58.65 58.87 1bd9 h GLN 45 Cb 0.56 -0.16 -0.09 0.00 0.30 0.00 0.00 27.48 28.09 1bd9 h GLN 45 CO -0.47 0.48 0.09 1.33 -0.67 0.00 0.00 178.83 179.60 1bd9 n VAL 46 N -4.45 2.61 0.24 -0.54 0.24 -0.64 -4.63 118.33 111.16 1bd9 n VAL 46 Ca 0.05 -2.07 0.10 0.00 -2.04 0.00 0.00 64.34 60.38 1bd9 n VAL 46 Cb 0.05 -0.32 0.59 0.00 -1.47 0.00 0.00 33.84 32.69 1bd9 n VAL 46 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 1bd9 h LYS 47 N 1.77 0.00 -6.23 7.34 2.10 -0.99 -3.39 116.57 117.17 1bd9 h LYS 47 Ca 0.18 0.00 -0.55 0.00 -2.00 0.00 0.00 60.65 58.28 1bd9 h LYS 47 Cb 1.85 0.00 -0.09 0.00 -0.90 0.00 0.00 32.23 33.10 1bd9 h LYS 47 CO 0.48 0.19 -0.62 -0.80 -2.00 0.00 0.00 179.45 176.70 1bd9 s ASN 48 N -6.37 4.83 0.74 7.07 0.01 -1.26 -4.50 114.94 115.46 1bd9 s ASN 48 Ca -0.02 -0.50 -0.16 0.00 -0.71 0.00 0.00 52.86 51.47 1bd9 s ASN 48 Cb 0.13 -1.01 -0.03 0.00 0.41 0.00 0.00 41.25 40.74 1bd9 s ASN 48 CO 0.63 0.01 0.51 0.54 -1.51 0.00 0.00 177.10 177.28 1bd9 n ARG 49 N -0.81 0.25 -1.76 -0.60 1.74 -1.26 -4.89 116.66 109.33 1bd9 n ARG 49 Ca -0.07 0.12 -0.40 0.00 -0.77 0.00 0.00 57.85 56.73 1bd9 n ARG 49 Cb 0.58 -1.83 0.02 0.00 -1.02 0.00 0.00 32.46 30.21 1bd9 n ARG 49 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1bd9 n PRO 50 N -0.81 2.20 0.13 5.56 -0.04 -1.26 -4.72 135.00 136.06 1bd9 n PRO 50 Ca 0.10 0.79 0.13 0.00 -0.04 0.00 0.00 63.50 64.47 1bd9 n PRO 50 Cb 0.50 -2.64 0.29 0.00 -0.04 0.00 0.00 33.50 31.62 1bd9 n PRO 50 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1bd9 h THR 51 N 2.18 0.00 -1.84 0.52 1.35 -0.88 -3.47 112.91 110.78 1bd9 h THR 51 Ca -0.51 -0.65 0.13 0.00 -0.55 0.00 0.00 66.41 64.83 1bd9 h THR 51 Cb 1.27 1.58 -0.19 0.00 -1.73 0.00 0.00 68.15 69.08 1bd9 h THR 51 CO 0.60 0.00 0.58 -0.94 -0.25 0.00 0.00 175.52 175.51 1bd9 s SER 52 N -5.01 -0.32 0.03 5.36 1.04 -1.13 -5.00 113.70 108.67 1bd9 s SER 52 Ca 0.09 0.16 0.01 0.00 0.48 0.00 0.00 55.95 56.69 1bd9 s SER 52 Cb 0.10 0.30 -0.02 0.00 0.10 0.00 0.00 66.02 66.50 1bd9 s SER 52 CO 0.64 -0.43 -0.05 0.27 0.98 0.00 0.00 173.24 174.64 1bd9 s ILE 53 N -2.17 0.34 -0.03 -1.02 -4.36 -1.26 -0.44 121.20 112.27 1bd9 s ILE 53 Ca 0.03 -1.04 -0.24 0.00 -0.26 0.00 0.00 60.65 59.15 1bd9 s ILE 53 Cb -0.01 -0.49 0.05 0.00 1.25 0.00 0.00 42.46 43.26 1bd9 s ILE 53 CO -0.04 -0.46 0.51 -0.55 0.24 0.00 0.00 174.94 174.64 1bd9 s SER 54 N -1.58 -0.45 0.03 4.36 0.15 -0.47 -4.86 113.70 110.87 1bd9 s SER 54 Ca -0.12 0.41 -0.17 0.00 0.70 0.00 0.00 55.95 56.77 1bd9 s SER 54 Cb -0.09 0.44 0.03 0.00 -1.71 0.00 0.00 66.02 64.69 1bd9 s SER 54 CO -0.01 -0.56 0.38 -1.66 1.20 0.00 0.00 173.24 172.60 1bd9 s TRP 55 N -1.37 -0.23 0.08 3.44 -2.14 -1.26 -0.78 118.94 116.68 1bd9 s TRP 55 Ca -0.11 0.22 -0.31 0.00 2.66 0.00 0.00 56.10 58.56 1bd9 s TRP 55 Cb -0.02 0.17 -0.09 0.00 -3.10 0.00 0.00 33.47 30.43 1bd9 s TRP 55 CO 0.07 -0.52 1.73 0.34 -2.66 0.00 0.00 176.95 175.91 1bd9 s ASP 56 N -1.84 6.53 0.00 -2.66 2.15 -1.26 -1.85 116.67 117.74 1bd9 s ASP 56 Ca -0.07 2.59 0.00 0.00 0.43 0.00 0.00 52.55 55.50 1bd9 s ASP 56 Cb -0.02 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 1bd9 s ASP 56 CO -0.01 -0.94 0.00 0.61 -0.17 0.00 0.00 175.17 174.66 1bd9 n GLY 57 N 4.11 0.71 3.68 2.66 0.00 -1.26 -4.95 105.19 110.15 1bd9 n GLY 57 Ca 0.17 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1bd9 n GLY 57 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1bd9 s LEU 58 N 0.00 4.34 -0.21 0.99 0.05 -0.77 -4.96 118.68 118.12 1bd9 s LEU 58 Ca 0.00 2.34 -0.03 0.00 0.05 0.00 0.00 54.13 56.49 1bd9 s LEU 58 Cb 0.00 -3.56 -0.00 0.00 -2.05 0.00 0.00 46.19 40.58 1bd9 s LEU 58 CO 0.00 -0.84 -0.07 -0.62 -0.55 0.00 0.00 176.35 174.27 1bd9 s ASP 59 N 2.39 4.13 0.50 1.48 -1.08 -1.26 -5.00 116.67 117.82 1bd9 s ASP 59 Ca 0.71 -0.42 0.33 0.00 -0.52 0.00 0.00 52.55 52.65 1bd9 s ASP 59 Cb -0.36 -1.70 1.60 0.00 -1.46 0.00 0.00 42.92 41.00 1bd9 s ASP 59 CO 0.30 -0.01 2.01 0.77 0.52 0.00 0.00 175.17 178.75 1bd9 h SER 60 N 8.06 0.00 -0.12 -0.34 4.64 -1.94 -2.18 113.55 121.67 1bd9 h SER 60 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1bd9 h SER 60 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1bd9 h SER 60 CO 0.61 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.18 1bd9 n GLY 61 N -0.54 0.79 3.82 -0.77 0.00 -1.26 -4.13 105.19 103.11 1bd9 n GLY 61 Ca -0.01 -0.60 -0.23 0.00 0.00 0.00 0.00 46.02 45.18 1bd9 n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bd9 s LYS 62 N -1.86 2.94 -0.11 1.61 1.02 -0.82 -4.98 119.74 117.54 1bd9 s LYS 62 Ca 0.33 -0.98 -0.04 0.00 0.02 0.00 0.00 55.97 55.30 1bd9 s LYS 62 Cb 0.20 -2.60 -0.04 0.00 -0.52 0.00 0.00 37.83 34.88 1bd9 s LYS 62 CO 0.31 0.43 0.07 -0.51 -0.92 0.00 0.00 175.35 174.73 1bd9 s LEU 63 N -3.61 3.98 0.07 3.17 1.43 -1.26 -1.73 118.68 120.73 1bd9 s LEU 63 Ca 0.32 0.30 0.03 0.00 -1.03 0.00 0.00 54.13 53.75 1bd9 s LEU 63 Cb -0.09 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.16 1bd9 s LEU 63 CO 0.25 0.39 -0.09 -0.31 0.23 0.00 0.00 176.35 176.82 1bd9 s TYR 64 N -0.91 0.85 -0.15 0.29 1.51 0.50 0.17 117.35 119.61 1bd9 s TYR 64 Ca 0.14 -0.61 -0.04 0.00 -1.01 0.00 0.00 57.07 55.54 1bd9 s TYR 64 Cb -0.12 -0.49 -0.03 0.00 -0.11 0.00 0.00 41.96 41.21 1bd9 s TYR 64 CO 0.03 -0.07 -0.00 0.99 -1.11 0.00 0.00 175.55 175.39 1bd9 s THR 65 N -2.05 4.21 -0.10 -0.71 2.01 0.17 -0.94 115.64 118.23 1bd9 s THR 65 Ca -0.02 -0.25 0.04 0.00 0.31 0.00 0.00 61.69 61.77 1bd9 s THR 65 Cb -0.05 -2.84 -0.00 0.00 0.01 0.00 0.00 72.50 69.61 1bd9 s THR 65 CO -0.01 0.51 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.98 1bd9 s LEU 66 N 0.10 2.13 0.02 4.42 2.96 0.81 -0.73 118.68 128.39 1bd9 s LEU 66 Ca 0.01 -0.55 0.02 0.00 -0.22 0.00 0.00 54.13 53.40 1bd9 s LEU 66 Cb -0.13 -1.42 -0.01 0.00 0.50 0.00 0.00 46.19 45.12 1bd9 s LEU 66 CO 0.02 0.16 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.45 1bd9 s VAL 67 N 0.33 0.57 -0.15 1.68 1.01 0.10 -0.93 120.40 123.01 1bd9 s VAL 67 Ca -0.18 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.16 1bd9 s VAL 67 Cb -0.18 -0.55 0.02 0.00 0.00 0.00 0.00 36.38 35.68 1bd9 s VAL 67 CO 0.09 -0.07 -0.13 -0.22 0.00 0.00 0.00 175.10 174.77 1bd9 s LEU 68 N -0.77 1.65 0.02 3.92 2.96 -0.81 -0.68 118.68 124.97 1bd9 s LEU 68 Ca -0.02 -0.48 0.02 0.00 -0.22 0.00 0.00 54.13 53.42 1bd9 s LEU 68 Cb -0.06 -1.13 -0.02 0.00 0.50 0.00 0.00 46.19 45.48 1bd9 s LEU 68 CO 0.00 -0.07 -0.07 0.28 -1.32 0.00 0.00 176.35 175.17 1bd9 s THR 69 N 1.51 0.49 -0.35 3.68 -1.32 -0.34 -0.95 115.64 118.37 1bd9 s THR 69 Ca 0.05 -0.76 0.01 0.00 -1.21 0.00 0.00 61.69 59.77 1bd9 s THR 69 Cb -0.13 -0.51 0.09 0.00 -1.51 0.00 0.00 72.50 70.44 1bd9 s THR 69 CO -0.10 -0.20 0.09 -0.62 -2.21 0.00 0.00 174.62 171.58 1bd9 s ASP 70 N -1.04 4.94 0.47 8.08 2.15 -0.53 -0.61 116.67 130.13 1bd9 s ASP 70 Ca -0.06 -1.93 0.30 0.00 0.43 0.00 0.00 52.55 51.29 1bd9 s ASP 70 Cb -0.07 -1.71 1.08 0.00 -0.30 0.00 0.00 42.92 41.92 1bd9 s ASP 70 CO 0.00 -0.41 1.86 1.55 -0.17 0.00 0.00 175.17 178.00 1bd9 h PRO 71 N 7.83 0.00 -1.79 4.34 0.13 -1.85 -0.57 132.00 140.09 1bd9 h PRO 71 Ca -0.11 0.00 -0.74 0.00 -0.87 0.00 0.00 66.00 64.28 1bd9 h PRO 71 Cb 1.04 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 31.88 1bd9 h PRO 71 CO 0.58 0.00 0.91 -0.25 -0.23 0.00 0.00 178.00 179.01 1bd9 n ASP 72 N -2.92 7.37 -4.47 1.44 8.00 -1.26 -4.30 116.55 120.42 1bd9 n ASP 72 Ca 0.02 -3.82 -0.34 0.00 0.71 0.00 0.00 54.79 51.35 1bd9 n ASP 72 Cb 0.34 -1.01 -0.12 0.00 -0.02 0.00 0.00 41.12 40.31 1bd9 n ASP 72 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bd9 s ALA 73 N -4.00 2.98 -1.45 2.24 0.00 -1.25 -1.38 121.76 118.90 1bd9 s ALA 73 Ca 0.54 -0.89 0.27 0.00 0.00 0.00 0.00 51.96 51.88 1bd9 s ALA 73 Cb 0.45 -1.60 0.91 0.00 0.00 0.00 0.00 23.12 22.87 1bd9 s ALA 73 CO -0.33 0.09 1.67 -0.35 0.00 0.00 0.00 175.76 176.83 1bd9 n PRO 74 N 3.78 0.49 -3.62 0.00 -0.04 -1.25 -1.08 135.00 133.27 1bd9 n PRO 74 Ca -0.17 -0.23 -0.13 0.00 -0.04 0.00 0.00 63.50 62.93 1bd9 n PRO 74 Cb 0.52 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.43 1bd9 n PRO 74 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1bd9 s SER 75 N -2.67 -0.35 0.31 3.54 1.04 -0.48 -4.59 113.70 110.50 1bd9 s SER 75 Ca 0.21 0.06 0.03 0.00 0.48 0.00 0.00 55.95 56.73 1bd9 s SER 75 Cb 0.19 0.46 0.51 0.00 0.10 0.00 0.00 66.02 67.28 1bd9 s SER 75 CO 0.55 -0.70 1.81 -0.09 0.98 0.00 0.00 173.24 175.79 1bd9 h ARG 76 N 2.87 0.53 -0.58 4.02 2.43 -1.77 -2.33 114.38 119.55 1bd9 h ARG 76 Ca -0.31 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 58.70 1bd9 h ARG 76 Cb 1.21 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.67 1bd9 h ARG 76 CO 0.43 0.63 0.32 -0.22 -1.51 0.00 0.00 179.97 179.62 1bd9 h LYS 77 N 0.50 0.81 -2.40 0.20 3.64 -1.91 -3.36 116.57 114.04 1bd9 h LYS 77 Ca 0.10 -0.09 -0.59 0.00 -1.27 0.00 0.00 60.65 58.79 1bd9 h LYS 77 Cb 0.46 -0.16 -0.40 0.00 -0.41 0.00 0.00 32.23 31.72 1bd9 h LYS 77 CO 0.02 0.61 -0.85 -3.47 -2.27 0.00 0.00 179.45 173.50 1bd9 n ASP 78 N -4.59 1.24 -3.21 4.20 2.03 -1.13 -5.05 116.55 110.04 1bd9 n ASP 78 Ca 0.04 -2.84 -0.36 0.00 0.52 0.00 0.00 54.79 52.14 1bd9 n ASP 78 Cb 0.08 -0.64 -0.04 0.00 -0.72 0.00 0.00 41.12 39.80 1bd9 n ASP 78 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1bd9 n PRO 79 N 1.91 3.74 0.24 -0.67 -0.04 -0.89 -3.81 135.00 135.48 1bd9 n PRO 79 Ca 0.25 -2.42 0.16 0.00 -0.04 0.00 0.00 63.50 61.45 1bd9 n PRO 79 Cb 0.45 -2.66 0.71 0.00 -0.04 0.00 0.00 33.50 31.96 1bd9 n PRO 79 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1bd9 h LYS 80 N 4.65 0.00 -0.57 0.54 2.10 -1.83 -0.73 116.57 120.73 1bd9 h LYS 80 Ca 0.76 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.41 1bd9 h LYS 80 Cb 0.41 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.74 1bd9 h LYS 80 CO 1.54 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 179.65 1bd9 n TYR 81 N -2.82 0.76 -1.66 0.07 4.01 -0.24 -4.88 117.16 112.40 1bd9 n TYR 81 Ca 0.00 -0.41 -0.56 0.00 -0.16 0.00 0.00 57.90 56.78 1bd9 n TYR 81 Cb 0.24 -0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.19 1bd9 n TYR 81 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 1bd9 n ARG 82 N 1.48 1.04 -4.06 -0.72 0.63 -0.28 -1.44 116.66 113.31 1bd9 n ARG 82 Ca 0.21 0.38 -0.29 0.00 -0.92 0.00 0.00 57.85 57.24 1bd9 n ARG 82 Cb 0.59 -2.03 -0.06 0.00 0.45 0.00 0.00 32.46 31.42 1bd9 n ARG 82 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 1bd9 s GLU 83 N 2.18 2.89 -0.38 -0.14 2.02 0.76 -3.91 118.70 122.11 1bd9 s GLU 83 Ca 0.93 -0.77 -0.14 0.00 0.02 0.00 0.00 54.97 55.01 1bd9 s GLU 83 Cb -1.06 -2.69 0.01 0.00 0.10 0.00 0.00 34.13 30.49 1bd9 s GLU 83 CO 0.59 0.53 0.27 -0.46 0.02 0.00 0.00 175.26 176.21 1bd9 s TRP 84 N -1.55 3.23 -0.09 1.61 -0.00 -0.22 -0.34 118.94 121.59 1bd9 s TRP 84 Ca 0.30 -0.52 -0.17 0.00 -0.00 0.00 0.00 56.10 55.71 1bd9 s TRP 84 Cb -0.11 -2.53 -0.05 0.00 -0.00 0.00 0.00 33.47 30.78 1bd9 s TRP 84 CO 0.23 -0.52 0.46 -3.38 -0.00 0.00 0.00 176.95 173.73 1bd9 s HIS 85 N 1.68 3.56 -0.13 5.86 -3.43 -0.56 -1.45 115.29 120.81 1bd9 s HIS 85 Ca 0.05 0.92 0.16 0.00 -0.80 0.00 0.00 55.06 55.39 1bd9 s HIS 85 Cb -0.18 -2.49 -0.24 0.00 -1.43 0.00 0.00 32.58 28.23 1bd9 s HIS 85 CO 0.10 0.28 0.34 0.72 -2.00 0.00 0.00 174.74 174.17 1bd9 n HIS 86 N 3.24 0.41 -3.67 0.38 8.25 -0.12 -4.88 115.22 118.83 1bd9 n HIS 86 Ca -0.09 0.15 -0.13 0.00 -0.26 0.00 0.00 57.72 57.39 1bd9 n HIS 86 Cb 0.52 -1.05 -0.08 0.00 1.12 0.00 0.00 29.99 30.49 1bd9 n HIS 86 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1bd9 s PHE 87 N -2.60 -0.67 -0.15 4.41 5.36 -1.13 -0.98 117.98 122.22 1bd9 s PHE 87 Ca -0.08 1.61 -0.04 0.00 -0.96 0.00 0.00 56.93 57.47 1bd9 s PHE 87 Cb 0.07 0.25 0.07 0.00 -0.34 0.00 0.00 43.02 43.07 1bd9 s PHE 87 CO 0.83 -0.33 0.19 -1.17 -1.46 0.00 0.00 175.22 173.28 1bd9 s LEU 88 N 0.43 -0.07 -0.05 6.12 2.96 -0.70 -1.92 118.68 125.44 1bd9 s LEU 88 Ca -0.01 0.04 0.03 0.00 -0.22 0.00 0.00 54.13 53.97 1bd9 s LEU 88 Cb -0.04 0.32 0.01 0.00 0.50 0.00 0.00 46.19 46.97 1bd9 s LEU 88 CO -0.01 -0.29 -0.12 -0.69 -1.32 0.00 0.00 176.35 173.92 1bd9 s VAL 89 N 2.31 1.12 0.26 1.68 1.01 -0.11 -0.52 120.40 126.15 1bd9 s VAL 89 Ca 0.04 -0.50 0.11 0.00 0.00 0.00 0.00 61.98 61.64 1bd9 s VAL 89 Cb -0.14 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.19 1bd9 s VAL 89 CO -0.09 0.34 -0.20 0.68 0.00 0.00 0.00 175.10 175.84 1bd9 s VAL 90 N 0.45 2.38 -1.35 2.92 -7.23 -0.26 -0.13 120.40 117.18 1bd9 s VAL 90 Ca -0.10 -2.36 -0.06 0.00 -1.81 0.00 0.00 61.98 57.65 1bd9 s VAL 90 Cb -0.14 -2.25 0.02 0.00 0.56 0.00 0.00 36.38 34.57 1bd9 s VAL 90 CO 0.03 -0.40 0.96 0.59 -0.31 0.00 0.00 175.10 175.96 1bd9 n ASN 91 N -0.53 -3.53 -4.72 4.85 3.02 -1.14 0.03 115.26 113.23 1bd9 n ASN 91 Ca -0.06 -0.70 -0.40 0.00 -0.03 0.00 0.00 54.58 53.39 1bd9 n ASN 91 Cb 0.60 -4.48 -0.05 0.00 -0.61 0.00 0.00 39.78 35.24 1bd9 n ASN 91 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1bd9 s MET 92 N -6.09 4.46 -0.29 3.52 -2.45 -0.12 -4.28 119.30 114.05 1bd9 s MET 92 Ca 0.31 0.97 -0.24 0.00 -1.25 0.00 0.00 55.69 55.48 1bd9 s MET 92 Cb -0.15 -3.43 0.00 0.00 1.25 0.00 0.00 34.83 32.50 1bd9 s MET 92 CO 0.78 0.09 0.82 0.15 1.05 0.00 0.00 175.02 177.91 1bd9 s LYS 93 N 0.66 4.02 6.23 4.11 1.02 -1.26 -0.37 119.74 134.16 1bd9 s LYS 93 Ca 0.39 0.71 0.00 0.00 0.02 0.00 0.00 55.97 57.09 1bd9 s LYS 93 Cb -0.19 -3.71 0.00 0.00 -0.52 0.00 0.00 37.83 33.42 1bd9 s LYS 93 CO 0.20 -0.65 0.00 0.41 -0.92 0.00 0.00 175.35 174.39 1bd9 n GLY 94 N 4.07 3.16 1.61 -3.33 0.00 -0.71 -1.62 105.19 108.37 1bd9 n GLY 94 Ca 0.05 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1bd9 n GLY 94 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1bd9 n ASN 95 N 2.59 4.50 -4.46 1.61 6.94 -1.26 -4.73 115.26 120.45 1bd9 n ASN 95 Ca 0.00 -3.19 -0.44 0.00 -0.02 0.00 0.00 54.58 50.94 1bd9 n ASN 95 Cb 0.00 -0.67 -0.03 0.00 -2.36 0.00 0.00 39.78 36.72 1bd9 n ASN 95 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1bd9 s ASP 96 N -1.39 6.58 0.22 0.53 -1.08 -0.64 -4.64 116.67 116.24 1bd9 s ASP 96 Ca 0.51 -1.90 -0.08 0.00 -0.52 0.00 0.00 52.55 50.56 1bd9 s ASP 96 Cb 0.41 -2.41 0.30 0.00 -1.46 0.00 0.00 42.92 39.76 1bd9 s ASP 96 CO 0.11 -1.13 1.79 0.40 0.52 0.00 0.00 175.17 176.86 1bd9 h ILE 97 N 5.92 0.90 0.00 4.11 2.04 -1.89 -1.49 117.51 127.10 1bd9 h ILE 97 Ca 0.12 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.76 1bd9 h ILE 97 Cb 1.03 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1bd9 h ILE 97 CO 1.14 0.12 0.00 0.77 0.00 0.00 0.00 178.15 180.18 1bd9 h SER 98 N 0.64 0.00 1.15 1.72 4.64 -1.97 -1.33 113.55 118.40 1bd9 h SER 98 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1bd9 h SER 98 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1bd9 h SER 98 CO -0.24 0.00 -0.09 -1.54 -0.87 0.00 0.00 176.83 174.09 1bd9 n SER 99 N -2.88 0.43 -4.90 4.97 3.41 -0.56 -4.93 113.62 109.16 1bd9 n SER 99 Ca -0.02 0.44 -0.29 0.00 -0.26 0.00 0.00 58.87 58.75 1bd9 n SER 99 Cb 0.11 -0.51 0.08 0.00 -0.26 0.00 0.00 64.21 63.63 1bd9 n SER 99 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1bd9 s GLY 100 N -3.29 1.61 -0.36 5.00 0.00 -0.50 -4.61 107.32 105.16 1bd9 s GLY 100 Ca 0.12 -0.63 -0.14 0.00 0.00 0.00 0.00 44.72 44.07 1bd9 s GLY 100 CO 0.59 -0.18 0.28 -1.59 0.00 0.00 0.00 173.10 172.19 1bd9 s THR 101 N -3.48 5.26 -0.55 0.90 2.01 0.10 -4.93 115.64 114.95 1bd9 s THR 101 Ca 0.61 -0.31 -0.26 0.00 0.31 0.00 0.00 61.69 62.04 1bd9 s THR 101 Cb -0.11 -3.80 0.04 0.00 0.01 0.00 0.00 72.50 68.63 1bd9 s THR 101 CO 0.49 -0.12 1.03 -0.69 -0.69 0.00 0.00 174.62 174.64 1bd9 s VAL 102 N 1.77 4.26 0.04 3.82 1.01 -1.26 -1.10 120.40 128.93 1bd9 s VAL 102 Ca 0.07 0.57 -0.09 0.00 0.00 0.00 0.00 61.98 62.53 1bd9 s VAL 102 Cb -0.18 -4.60 -0.31 0.00 0.00 0.00 0.00 36.38 31.30 1bd9 s VAL 102 CO 0.11 -1.16 1.01 -0.07 0.00 0.00 0.00 175.10 174.98 1bd9 h LEU 103 N 11.27 0.58 -7.36 3.92 3.38 -1.17 -3.43 115.31 122.50 1bd9 h LEU 103 Ca -0.25 -0.67 -0.53 0.00 0.09 0.00 0.00 57.88 56.52 1bd9 h LEU 103 Cb 1.07 -0.19 -0.39 0.00 0.09 0.00 0.00 40.66 41.23 1bd9 h LEU 103 CO 1.12 1.53 -0.77 -0.44 0.09 0.00 0.00 178.44 179.97 1bd9 s SER 104 N -7.29 3.00 0.60 -0.43 0.01 -1.04 -0.77 113.70 107.78 1bd9 s SER 104 Ca -0.07 -0.84 -0.18 0.00 1.31 0.00 0.00 55.95 56.17 1bd9 s SER 104 Cb 0.06 -0.70 -0.03 0.00 0.21 0.00 0.00 66.02 65.55 1bd9 s SER 104 CO 0.90 -0.28 1.20 -0.62 0.41 0.00 0.00 173.24 174.85 1bd9 s ASP 105 N 1.77 5.14 0.09 2.44 -1.08 -0.60 -1.73 116.67 122.71 1bd9 s ASP 105 Ca -0.01 2.36 -0.31 0.00 -0.52 0.00 0.00 52.55 54.07 1bd9 s ASP 105 Cb -0.17 -2.60 -0.10 0.00 -1.46 0.00 0.00 42.92 38.60 1bd9 s ASP 105 CO -0.07 -1.62 1.85 -0.47 0.52 0.00 0.00 175.17 175.37 1bd9 s TYR 106 N -1.66 1.90 -0.12 -5.34 5.04 -1.26 -4.53 117.35 111.38 1bd9 s TYR 106 Ca 0.77 -0.12 0.02 0.00 -2.44 0.00 0.00 57.07 55.30 1bd9 s TYR 106 Cb -0.30 -4.17 -0.00 0.00 0.35 0.00 0.00 41.96 37.84 1bd9 s TYR 106 CO 0.34 -4.97 -0.20 0.08 -1.34 0.00 0.00 175.55 169.46 1bd9 s VAL 107 N 3.29 2.35 0.60 3.14 1.01 -0.16 -4.79 120.40 125.84 1bd9 s VAL 107 Ca 0.82 -0.91 -0.10 0.00 0.00 0.00 0.00 61.98 61.80 1bd9 s VAL 107 Cb -0.44 -1.94 0.15 0.00 0.00 0.00 0.00 36.38 34.15 1bd9 s VAL 107 CO 0.37 0.54 0.56 0.61 0.00 0.00 0.00 175.10 177.18 1bd9 n GLY 108 N 3.68 -2.48 3.69 4.51 0.00 -1.26 -4.75 105.19 108.58 1bd9 n GLY 108 Ca -0.19 -1.49 -0.42 0.00 0.00 0.00 0.00 46.02 43.91 1bd9 n GLY 108 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bd9 s SER 109 N -3.02 6.98 -0.44 1.61 0.01 -1.26 -4.96 113.70 112.62 1bd9 s SER 109 Ca 0.35 1.95 0.10 0.00 1.31 0.00 0.00 55.95 59.67 1bd9 s SER 109 Cb -0.03 -2.56 0.35 0.00 0.21 0.00 0.00 66.02 63.99 1bd9 s SER 109 CO 0.27 -0.62 0.82 0.61 0.41 0.00 0.00 173.24 174.73 1bd9 n GLY 110 N 3.45 4.27 3.69 3.44 0.00 -1.26 -4.68 105.19 114.10 1bd9 n GLY 110 Ca 0.11 -2.07 -0.42 0.00 0.00 0.00 0.00 46.02 43.65 1bd9 n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1bd9 s PRO 111 N -2.82 4.24 0.54 1.61 0.04 -1.26 -4.97 135.00 132.38 1bd9 s PRO 111 Ca 0.43 2.17 -0.21 0.00 0.04 0.00 0.00 61.00 63.43 1bd9 s PRO 111 Cb 0.33 -3.51 -0.05 0.00 0.04 0.00 0.00 34.50 31.31 1bd9 s PRO 111 CO -0.10 -0.63 1.26 -2.14 0.04 0.00 0.00 177.00 175.43 1bd9 s PRO 112 N 2.24 3.26 0.28 0.56 0.02 -1.26 -3.79 135.00 136.30 1bd9 s PRO 112 Ca 0.69 2.00 -0.30 0.00 0.02 0.00 0.00 61.00 63.40 1bd9 s PRO 112 Cb -0.37 -2.21 -0.12 0.00 0.02 0.00 0.00 34.50 31.82 1bd9 s PRO 112 CO 0.30 -1.02 1.56 1.17 -0.33 0.00 0.00 177.00 178.68 1bd9 n LYS 113 N -1.04 2.56 -0.56 5.54 4.81 -1.26 -2.27 118.16 125.94 1bd9 n LYS 113 Ca 0.10 0.91 0.00 0.00 -0.87 0.00 0.00 58.31 58.46 1bd9 n LYS 113 Cb 0.47 -2.67 0.00 0.00 0.02 0.00 0.00 35.03 32.85 1bd9 n LYS 113 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1bd9 n GLY 114 N 2.24 0.98 0.99 3.14 0.00 -1.26 -4.92 105.19 106.36 1bd9 n GLY 114 Ca 0.09 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.21 1bd9 n GLY 114 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bd9 n THR 115 N -2.00 0.65 -4.58 2.61 -2.24 -0.96 -5.07 114.28 102.69 1bd9 n THR 115 Ca 0.00 -0.70 0.00 0.00 -2.27 0.00 0.00 64.05 61.08 1bd9 n THR 115 Cb 0.00 0.47 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 1bd9 n THR 115 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bd9 n GLY 116 N 1.38 -1.02 3.71 3.38 0.00 -1.26 -4.46 105.19 106.92 1bd9 n GLY 116 Ca 0.18 -1.13 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 1bd9 n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bd9 s LEU 117 N 0.00 4.36 0.07 0.99 1.43 -1.26 -4.42 118.68 119.84 1bd9 s LEU 117 Ca 0.00 1.96 0.00 0.00 -1.03 0.00 0.00 54.13 55.07 1bd9 s LEU 117 Cb 0.00 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.61 1bd9 s LEU 117 CO 0.00 -0.47 0.21 -1.00 0.23 0.00 0.00 176.35 175.32 1bd9 s HIS 118 N 1.23 3.51 -0.18 0.29 3.76 -0.32 -4.67 115.29 118.91 1bd9 s HIS 118 Ca 0.58 0.23 -0.23 0.00 -0.15 0.00 0.00 55.06 55.50 1bd9 s HIS 118 Cb -0.28 -1.75 -0.02 0.00 1.11 0.00 0.00 32.58 31.64 1bd9 s HIS 118 CO 0.28 0.58 0.71 1.03 -0.85 0.00 0.00 174.74 176.50 1bd9 s ARG 119 N -2.57 4.25 -0.30 1.40 0.52 -1.26 -2.32 118.95 118.67 1bd9 s ARG 119 Ca 0.35 0.79 -0.09 0.00 -0.52 0.00 0.00 55.73 56.26 1bd9 s ARG 119 Cb -0.13 -3.57 -0.01 0.00 0.52 0.00 0.00 34.95 31.76 1bd9 s ARG 119 CO 0.28 -0.27 0.12 0.71 0.02 0.00 0.00 175.30 176.16 1bd9 s TYR 120 N 1.97 3.16 -0.24 -0.53 2.02 0.72 -4.01 117.35 120.44 1bd9 s TYR 120 Ca 0.33 -0.66 -0.05 0.00 -0.37 0.00 0.00 57.07 56.32 1bd9 s TYR 120 Cb -0.16 -2.31 -0.00 0.00 -0.40 0.00 0.00 41.96 39.08 1bd9 s TYR 120 CO 0.11 -0.47 -0.01 0.08 -1.57 0.00 0.00 175.55 173.69 1bd9 s VAL 121 N 1.58 3.54 -0.14 0.71 1.01 0.23 -1.34 120.40 126.00 1bd9 s VAL 121 Ca 0.04 -0.53 -0.12 0.00 0.00 0.00 0.00 61.98 61.37 1bd9 s VAL 121 Cb -0.17 -2.67 -0.05 0.00 0.00 0.00 0.00 36.38 33.50 1bd9 s VAL 121 CO 0.05 0.34 0.26 0.26 0.00 0.00 0.00 175.10 176.01 1bd9 s TRP 122 N 1.49 3.52 -0.01 5.22 0.52 -0.50 -1.19 118.94 127.98 1bd9 s TRP 122 Ca 0.05 0.61 -0.01 0.00 0.02 0.00 0.00 56.10 56.77 1bd9 s TRP 122 Cb -0.15 -2.25 0.00 0.00 -1.15 0.00 0.00 33.47 29.93 1bd9 s TRP 122 CO -0.02 0.38 0.02 -0.51 0.02 0.00 0.00 176.95 176.84 1bd9 s LEU 123 N -0.01 1.92 -0.08 2.99 1.43 0.14 -1.36 118.68 123.72 1bd9 s LEU 123 Ca 0.16 0.03 0.04 0.00 -1.03 0.00 0.00 54.13 53.33 1bd9 s LEU 123 Cb -0.13 0.05 -0.00 0.00 0.03 0.00 0.00 46.19 46.14 1bd9 s LEU 123 CO 0.04 -0.01 -0.22 -0.69 0.23 0.00 0.00 176.35 175.71 1bd9 s VAL 124 N 0.03 1.85 -0.07 -1.59 1.01 0.40 -0.72 120.40 121.32 1bd9 s VAL 124 Ca -0.00 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 61.11 1bd9 s VAL 124 Cb -0.00 -1.60 -0.01 0.00 0.00 0.00 0.00 36.38 34.77 1bd9 s VAL 124 CO -0.00 0.52 -0.24 -0.31 0.00 0.00 0.00 175.10 175.07 1bd9 s TYR 125 N 0.24 2.39 0.10 5.22 1.51 0.10 -1.35 117.35 125.56 1bd9 s TYR 125 Ca -0.13 -0.79 -0.29 0.00 -1.01 0.00 0.00 57.07 54.84 1bd9 s TYR 125 Cb -0.16 -1.58 -0.06 0.00 -0.11 0.00 0.00 41.96 40.05 1bd9 s TYR 125 CO 0.06 -0.27 0.93 -2.00 -1.11 0.00 0.00 175.55 173.16 1bd9 s GLU 126 N 0.02 4.67 0.22 -0.62 2.12 -1.26 -0.65 118.70 123.19 1bd9 s GLU 126 Ca -0.08 1.40 0.05 0.00 0.36 0.00 0.00 54.97 56.69 1bd9 s GLU 126 Cb -0.15 -3.37 -0.03 0.00 0.26 0.00 0.00 34.13 30.84 1bd9 s GLU 126 CO 0.05 0.22 0.32 -0.65 -0.54 0.00 0.00 175.26 174.66 1bd9 s GLN 127 N -0.01 3.36 0.00 4.30 -0.21 0.13 -4.69 119.66 122.53 1bd9 s GLN 127 Ca 0.46 -0.77 0.22 0.00 0.02 0.00 0.00 55.36 55.28 1bd9 s GLN 127 Cb -0.23 -2.85 -0.12 0.00 1.00 0.00 0.00 33.01 30.80 1bd9 s GLN 127 CO 0.29 0.44 0.93 -0.25 -2.12 0.00 0.00 175.29 174.59 1bd9 n ASP 128 N -1.21 0.80 -3.55 5.90 8.00 -1.26 -4.49 116.55 120.74 1bd9 n ASP 128 Ca -0.08 -0.73 -0.03 0.00 0.71 0.00 0.00 54.79 54.66 1bd9 n ASP 128 Cb 0.57 0.99 0.00 0.00 -0.02 0.00 0.00 41.12 42.66 1bd9 n ASP 128 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bd9 s ARG 129 N -3.07 1.16 0.32 -1.24 1.70 -1.26 -5.06 118.95 111.50 1bd9 s ARG 129 Ca 0.06 -0.70 -0.29 0.00 -0.47 0.00 0.00 55.73 54.34 1bd9 s ARG 129 Cb 0.16 0.36 -0.10 0.00 -0.57 0.00 0.00 34.95 34.79 1bd9 s ARG 129 CO 0.85 -0.54 1.37 -2.14 -1.08 0.00 0.00 175.30 173.76 1bd9 s PRO 130 N -2.64 4.29 0.14 3.89 0.02 -1.26 -4.98 135.00 134.47 1bd9 s PRO 130 Ca 0.17 2.30 -0.01 0.00 0.02 0.00 0.00 61.00 63.49 1bd9 s PRO 130 Cb -0.01 -3.06 -0.04 0.00 0.02 0.00 0.00 34.50 31.41 1bd9 s PRO 130 CO 0.03 -0.30 0.32 -0.51 -0.33 0.00 0.00 177.00 176.21 1bd9 s LEU 131 N -1.58 4.29 -0.40 -5.54 1.43 -1.26 -5.07 118.68 110.54 1bd9 s LEU 131 Ca 0.52 0.37 0.03 0.00 -1.03 0.00 0.00 54.13 54.02 1bd9 s LEU 131 Cb -0.41 -3.10 0.11 0.00 0.03 0.00 0.00 46.19 42.81 1bd9 s LEU 131 CO 0.53 0.05 0.14 -0.54 0.23 0.00 0.00 176.35 176.76 1bd9 s LYS 132 N -2.93 1.53 -0.00 1.70 1.02 -1.26 -4.94 119.74 114.86 1bd9 s LYS 132 Ca 0.37 -2.03 -0.08 0.00 0.02 0.00 0.00 55.97 54.25 1bd9 s LYS 132 Cb -0.12 -3.02 -0.05 0.00 -0.52 0.00 0.00 37.83 34.12 1bd9 s LYS 132 CO 0.28 -1.02 0.29 0.00 -0.92 0.00 0.00 175.35 173.98 1bd9 n ASP 134 N 1.33 4.04 -4.76 0.00 5.75 -1.26 -4.99 116.55 116.65 1bd9 n ASP 134 Ca -0.12 -2.16 -0.39 0.00 -0.01 0.00 0.00 54.79 52.10 1bd9 n ASP 134 Cb 0.53 -0.48 0.02 0.00 -1.03 0.00 0.00 41.12 40.16 1bd9 n ASP 134 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1bd9 s GLU 135 N -1.30 3.63 0.32 0.11 8.01 -1.26 -4.92 118.70 123.30 1bd9 s GLU 135 Ca 0.45 2.31 -0.29 0.00 0.01 0.00 0.00 54.97 57.45 1bd9 s GLU 135 Cb 0.26 -2.59 -0.12 0.00 -4.31 0.00 0.00 34.13 27.38 1bd9 s GLU 135 CO 0.27 -0.82 1.53 -2.30 0.01 0.00 0.00 175.26 173.95 1bd9 n PRO 136 N -0.31 2.62 -2.64 0.39 -0.02 -1.26 -4.92 135.00 128.86 1bd9 n PRO 136 Ca 0.06 0.93 -0.43 0.00 -2.02 0.00 0.00 63.50 62.04 1bd9 n PRO 136 Cb 0.43 -2.67 -0.02 0.00 -0.02 0.00 0.00 33.50 31.22 1bd9 n PRO 136 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1bd9 s ILE 137 N -0.47 4.66 -0.10 4.25 -1.09 -1.26 -4.81 121.20 122.38 1bd9 s ILE 137 Ca 0.60 1.98 -0.01 0.00 -2.23 0.00 0.00 60.65 60.99 1bd9 s ILE 137 Cb -0.50 -4.28 -0.03 0.00 -1.58 0.00 0.00 42.46 36.08 1bd9 s ILE 137 CO 0.55 -0.12 -0.06 -0.76 -1.23 0.00 0.00 174.94 173.31 1bd9 s LEU 138 N 2.89 3.16 0.70 2.97 1.43 0.05 -5.02 118.68 124.86 1bd9 s LEU 138 Ca 0.46 -0.07 -0.06 0.00 -1.03 0.00 0.00 54.13 53.43 1bd9 s LEU 138 Cb -0.17 -1.71 0.07 0.00 0.03 0.00 0.00 46.19 44.41 1bd9 s LEU 138 CO 0.10 0.29 1.01 -0.94 0.23 0.00 0.00 176.35 177.04 1bd9 s SER 139 N -0.38 4.76 -0.26 2.29 1.04 -1.26 -1.55 113.70 118.34 1bd9 s SER 139 Ca 0.06 0.36 0.10 0.00 0.48 0.00 0.00 55.95 56.95 1bd9 s SER 139 Cb -0.12 -0.99 0.70 0.00 0.10 0.00 0.00 66.02 65.71 1bd9 s SER 139 CO 0.02 -1.62 1.67 -0.46 0.98 0.00 0.00 173.24 173.83 1bd9 n ASN 140 N -2.90 4.86 -0.49 7.02 0.23 -1.26 -4.19 115.26 118.52 1bd9 n ASN 140 Ca 0.09 -2.98 0.07 0.00 -0.53 0.00 0.00 54.58 51.22 1bd9 n ASN 140 Cb 0.60 -0.70 0.19 0.00 -2.08 0.00 0.00 39.78 37.79 1bd9 n ASN 140 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1bd9 n ARG 141 N 0.18 1.47 -3.55 -3.83 1.74 -1.26 -4.50 116.66 106.92 1bd9 n ARG 141 Ca 0.32 -3.09 -0.17 0.00 -0.77 0.00 0.00 57.85 54.13 1bd9 n ARG 141 Cb 1.21 -1.55 -0.06 0.00 -1.02 0.00 0.00 32.46 31.04 1bd9 n ARG 141 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1bd9 s SER 142 N -3.11 -0.66 0.00 0.55 0.15 -1.22 -4.58 113.70 104.82 1bd9 s SER 142 Ca 0.36 0.83 0.26 0.00 0.70 0.00 0.00 55.95 58.10 1bd9 s SER 142 Cb 0.35 0.70 0.60 0.00 -1.71 0.00 0.00 66.02 65.96 1bd9 s SER 142 CO -0.05 -0.54 1.49 0.61 1.20 0.00 0.00 173.24 175.95 1bd9 n GLY 143 N 1.24 0.30 3.63 9.45 0.00 -1.23 -4.86 105.19 113.73 1bd9 n GLY 143 Ca -0.18 -0.55 -0.48 0.00 0.00 0.00 0.00 46.02 44.81 1bd9 n GLY 143 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bd9 n ASP 144 N 0.49 2.28 -1.58 1.61 9.92 -1.26 -2.13 116.55 125.89 1bd9 n ASP 144 Ca 0.15 1.12 -0.19 0.00 -0.53 0.00 0.00 54.79 55.34 1bd9 n ASP 144 Cb 0.45 -1.32 -0.08 0.00 -0.64 0.00 0.00 41.12 39.54 1bd9 n ASP 144 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1bd9 n HIS 145 N 2.52 -0.12 0.04 1.24 8.25 -1.26 -4.87 115.22 121.03 1bd9 n HIS 145 Ca 0.16 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.40 1bd9 n HIS 145 Cb 0.25 -3.28 -0.14 0.00 1.12 0.00 0.00 29.99 27.94 1bd9 n HIS 145 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1bd9 h ARG 146 N 0.00 0.31 -7.57 -0.41 2.47 -1.77 -3.47 114.38 103.95 1bd9 h ARG 146 Ca -0.39 -0.54 -0.47 0.00 -1.26 0.00 0.00 59.98 57.32 1bd9 h ARG 146 Cb 1.25 0.20 0.10 0.00 -1.65 0.00 0.00 29.97 29.87 1bd9 h ARG 146 CO 0.57 1.26 0.38 0.20 0.56 0.00 0.00 179.97 182.94 1bd9 s GLY 147 N -4.87 1.59 -1.77 0.04 0.00 -1.26 -1.50 107.32 99.54 1bd9 s GLY 147 Ca -0.17 -0.57 0.00 0.00 0.00 0.00 0.00 44.72 43.98 1bd9 s GLY 147 CO 0.81 -0.08 0.00 0.28 0.00 0.00 0.00 173.10 174.11 1bd9 n LYS 148 N -3.39 -1.62 -3.34 2.90 4.76 -0.52 -4.88 118.16 112.08 1bd9 n LYS 148 Ca 0.08 1.00 -0.30 0.00 -2.87 0.00 0.00 58.31 56.22 1bd9 n LYS 148 Cb 0.60 -5.62 -0.04 0.00 -1.84 0.00 0.00 35.03 28.13 1bd9 n LYS 148 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 1bd9 s PHE 149 N -3.00 3.45 -0.26 2.13 5.36 0.54 -4.68 117.98 121.52 1bd9 s PHE 149 Ca 0.00 0.77 -0.03 0.00 -0.96 0.00 0.00 56.93 56.71 1bd9 s PHE 149 Cb 0.00 -2.19 0.09 0.00 -0.34 0.00 0.00 43.02 40.58 1bd9 s PHE 149 CO 0.00 0.20 0.10 0.15 -1.46 0.00 0.00 175.22 174.21 1bd9 s LYS 150 N -3.25 0.39 0.43 10.12 -0.14 -1.26 -0.17 119.74 125.86 1bd9 s LYS 150 Ca 0.46 -0.60 0.10 0.00 -1.36 0.00 0.00 55.97 54.56 1bd9 s LYS 150 Cb -0.11 -1.63 0.94 0.00 -1.68 0.00 0.00 37.83 35.36 1bd9 s LYS 150 CO 0.26 -0.90 2.04 -0.24 -0.76 0.00 0.00 175.35 175.75 1bd9 h VAL 151 N 6.45 1.04 -0.78 3.17 3.04 -1.97 -0.72 116.25 126.47 1bd9 h VAL 151 Ca -0.17 -0.16 -0.04 0.00 -1.01 0.00 0.00 66.70 65.32 1bd9 h VAL 151 Cb 1.05 0.53 -0.04 0.00 -2.01 0.00 0.00 31.29 30.82 1bd9 h VAL 151 CO 0.41 0.09 0.32 0.00 -1.01 0.00 0.00 177.57 177.38 1bd9 h ALA 152 N 1.75 1.10 -0.34 3.17 0.00 -1.96 -1.06 119.26 121.91 1bd9 h ALA 152 Ca 0.18 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1bd9 h ALA 152 Cb 0.12 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1bd9 h ALA 152 CO -0.04 0.65 -0.14 0.77 0.00 0.00 0.00 179.25 180.49 1bd9 h SER 153 N 1.13 0.72 0.24 0.00 0.02 -1.55 -1.85 113.55 112.26 1bd9 h SER 153 Ca 0.26 -0.39 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 1bd9 h SER 153 Cb 0.19 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.53 1bd9 h SER 153 CO -0.02 0.95 -0.14 0.15 -1.14 0.00 0.00 176.83 176.62 1bd9 h PHE 154 N 0.48 -0.37 -0.33 3.45 3.57 -1.04 -0.47 116.94 122.24 1bd9 h PHE 154 Ca 0.08 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.50 1bd9 h PHE 154 Cb 0.67 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.52 1bd9 h PHE 154 CO 0.06 -0.23 -0.13 0.07 -2.23 0.00 0.00 178.31 175.85 1bd9 h ARG 155 N -0.37 0.56 -0.13 1.11 -0.00 -1.22 -2.37 114.38 111.98 1bd9 h ARG 155 Ca -0.02 -0.17 -0.14 0.00 -0.00 0.00 0.00 59.98 59.64 1bd9 h ARG 155 Cb 0.30 -0.06 -0.01 0.00 -0.00 0.00 0.00 29.97 30.21 1bd9 h ARG 155 CO 0.03 0.68 -0.53 0.87 -0.00 0.00 0.00 179.97 181.01 1bd9 h LYS 156 N 0.52 0.37 -0.93 0.08 1.57 -1.25 -0.11 116.57 116.82 1bd9 h LYS 156 Ca 0.09 -0.23 0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1bd9 h LYS 156 Cb 0.53 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.81 1bd9 h LYS 156 CO 0.03 0.81 0.61 -0.22 -0.57 0.00 0.00 179.45 180.11 1bd9 h LYS 157 N 0.29 1.15 -0.71 3.15 3.64 -0.58 0.26 116.57 123.77 1bd9 h LYS 157 Ca 0.01 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1bd9 h LYS 157 Cb 1.03 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1bd9 h LYS 157 CO 0.09 0.76 0.00 0.66 -2.27 0.00 0.00 179.45 178.69 1bd9 n TYR 158 N -4.43 1.09 -3.53 1.91 4.01 -0.97 -4.91 117.16 110.32 1bd9 n TYR 158 Ca 0.12 -0.39 -0.25 0.00 -0.16 0.00 0.00 57.90 57.22 1bd9 n TYR 158 Cb 0.09 -0.28 0.05 0.00 -0.31 0.00 0.00 39.34 38.88 1bd9 n TYR 158 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1bd9 n GLU 159 N 0.42 -6.12 -3.50 -0.72 1.02 0.08 -4.97 120.64 106.85 1bd9 n GLU 159 Ca 0.16 0.75 -0.34 0.00 -0.02 0.00 0.00 57.16 57.70 1bd9 n GLU 159 Cb 0.72 -5.68 -0.05 0.00 -0.02 0.00 0.00 31.44 26.40 1bd9 n GLU 159 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1bd9 s LEU 160 N -7.09 4.30 0.96 -4.62 1.43 -0.08 -5.00 118.68 108.58 1bd9 s LEU 160 Ca 0.53 0.87 -0.14 0.00 -1.03 0.00 0.00 54.13 54.35 1bd9 s LEU 160 Cb -0.25 -3.23 0.21 0.00 0.03 0.00 0.00 46.19 42.96 1bd9 s LEU 160 CO 0.65 0.09 1.30 -0.13 0.23 0.00 0.00 176.35 178.50 1bd9 s ARG 161 N -2.18 0.54 0.99 1.70 0.52 -1.26 -4.42 118.95 114.83 1bd9 s ARG 161 Ca 0.38 -0.63 -0.13 0.00 -0.52 0.00 0.00 55.73 54.82 1bd9 s ARG 161 Cb -0.13 -1.90 0.09 0.00 0.52 0.00 0.00 34.95 33.52 1bd9 s ARG 161 CO 0.20 -2.43 0.53 0.00 0.02 0.00 0.00 175.30 173.62 1bd9 n ALA 162 N -3.71 -2.52 -1.77 2.13 0.00 -1.26 -4.86 120.51 108.50 1bd9 n ALA 162 Ca 0.17 -0.75 -0.40 0.00 0.00 0.00 0.00 53.44 52.45 1bd9 n ALA 162 Cb 0.59 -1.85 0.01 0.00 0.00 0.00 0.00 19.45 18.20 1bd9 n ALA 162 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1bd9 s PRO 163 N -3.86 3.88 0.15 0.00 0.02 -1.26 -4.79 135.00 129.13 1bd9 s PRO 163 Ca 0.60 2.49 0.11 0.00 0.02 0.00 0.00 61.00 64.22 1bd9 s PRO 163 Cb -0.20 -2.80 -0.12 0.00 0.02 0.00 0.00 34.50 31.40 1bd9 s PRO 163 CO 0.65 -0.69 1.24 -0.39 -0.33 0.00 0.00 177.00 177.48 1bd9 h VAL 164 N 2.61 1.26 -2.77 3.83 -1.51 -1.55 -1.98 116.25 116.14 1bd9 h VAL 164 Ca -0.51 -2.85 -0.08 0.00 -1.23 0.00 0.00 66.70 62.03 1bd9 h VAL 164 Cb 1.25 2.61 -0.18 0.00 -2.13 0.00 0.00 31.29 32.84 1bd9 h VAL 164 CO 0.62 0.72 -0.05 0.00 -1.23 0.00 0.00 177.57 177.63 1bd9 s ALA 165 N -2.80 -1.18 -0.07 5.19 0.00 -1.16 -0.90 121.76 120.83 1bd9 s ALA 165 Ca 0.01 0.57 -0.32 0.00 0.00 0.00 0.00 51.96 52.23 1bd9 s ALA 165 Cb 0.09 0.23 0.13 0.00 0.00 0.00 0.00 23.12 23.57 1bd9 s ALA 165 CO 0.80 -0.41 1.26 0.20 0.00 0.00 0.00 175.76 177.61 1bd9 s GLY 166 N -1.70 -0.38 0.16 0.00 0.00 -0.70 -0.46 107.32 104.25 1bd9 s GLY 166 Ca -0.08 0.98 -0.08 0.00 0.00 0.00 0.00 44.72 45.53 1bd9 s GLY 166 CO 0.02 0.25 0.43 -0.37 0.00 0.00 0.00 173.10 173.43 1bd9 n THR 167 N -0.37 0.00 -3.72 0.90 5.66 -0.46 -1.18 114.28 115.12 1bd9 n THR 167 Ca -0.06 -0.42 -0.12 0.00 -3.05 0.00 0.00 64.05 60.40 1bd9 n THR 167 Cb 0.61 0.45 -0.10 0.00 -1.55 0.00 0.00 70.33 69.75 1bd9 n THR 167 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1bd9 s TYR 169 N 0.62 2.26 0.08 0.00 1.13 -0.45 0.97 117.35 121.97 1bd9 s TYR 169 Ca -0.03 -0.37 0.05 0.00 -1.41 0.00 0.00 57.07 55.31 1bd9 s TYR 169 Cb -0.05 -1.14 -0.04 0.00 -1.10 0.00 0.00 41.96 39.64 1bd9 s TYR 169 CO -0.04 0.47 -0.02 -0.65 -2.51 0.00 0.00 175.55 172.79 1bd9 s GLN 170 N -2.59 2.47 -0.05 -3.49 -0.21 -0.00 -0.20 119.66 115.59 1bd9 s GLN 170 Ca 0.19 -0.86 -0.17 0.00 0.02 0.00 0.00 55.36 54.54 1bd9 s GLN 170 Cb -0.08 -2.50 0.03 0.00 1.00 0.00 0.00 33.01 31.47 1bd9 s GLN 170 CO 0.09 0.54 0.39 0.00 -2.12 0.00 0.00 175.29 174.19 1bd9 s ALA 171 N -1.27 -0.98 0.27 6.09 0.00 -0.98 -0.48 121.76 124.41 1bd9 s ALA 171 Ca 0.24 0.65 0.07 0.00 0.00 0.00 0.00 51.96 52.92 1bd9 s ALA 171 Cb -0.12 -0.09 -0.06 0.00 0.00 0.00 0.00 23.12 22.86 1bd9 s ALA 171 CO 0.16 -0.26 -0.08 -1.83 0.00 0.00 0.00 175.76 173.76 1bd9 s GLU 172 N -0.99 1.53 0.39 0.00 -1.05 -1.26 -1.17 118.70 116.15 1bd9 s GLU 172 Ca -0.10 -1.76 -0.23 0.00 -0.15 0.00 0.00 54.97 52.73 1bd9 s GLU 172 Cb -0.04 -1.17 -0.14 0.00 -0.44 0.00 0.00 34.13 32.34 1bd9 s GLU 172 CO 0.04 0.07 0.41 1.87 0.95 0.00 0.00 175.26 178.61 1bd9 n TRP 173 N -0.56 -0.95 -4.08 4.83 -0.00 -1.25 -4.44 117.44 111.00 1bd9 n TRP 173 Ca -0.06 0.65 -0.15 0.00 -0.00 0.00 0.00 57.50 57.94 1bd9 n TRP 173 Cb 0.63 -1.93 -0.04 0.00 -0.00 0.00 0.00 31.31 29.97 1bd9 n TRP 173 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 177.69 177.85 1bd9 s ASP 174 N -0.96 0.99 0.00 5.87 1.47 -1.26 -4.95 116.67 117.83 1bd9 s ASP 174 Ca 0.62 -1.52 0.18 0.00 1.18 0.00 0.00 52.55 53.01 1bd9 s ASP 174 Cb -0.65 0.68 0.91 0.00 -0.34 0.00 0.00 42.92 43.53 1bd9 s ASP 174 CO 0.59 -1.33 1.54 -0.90 0.68 0.00 0.00 175.17 175.75 1bd9 n ASP 175 N -1.52 0.00 0.09 2.11 5.68 -1.26 -2.02 116.55 119.63 1bd9 n ASP 175 Ca 0.01 0.01 -0.09 0.00 -0.50 0.00 0.00 54.79 54.22 1bd9 n ASP 175 Cb 0.61 -0.28 -0.03 0.00 -1.14 0.00 0.00 41.12 40.28 1bd9 n ASP 175 CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 1bd9 h TYR 176 N 0.00 0.23 -0.62 2.11 3.20 -1.96 -3.37 116.97 116.55 1bd9 h TYR 176 Ca 0.00 -0.14 0.12 0.00 3.14 0.00 0.00 58.73 61.85 1bd9 h TYR 176 Cb 0.16 -0.02 -0.12 0.00 1.54 0.00 0.00 36.73 38.29 1bd9 h TYR 176 CO 0.00 0.99 -0.22 0.28 -1.64 0.00 0.00 178.16 177.57 1bd9 h VAL 177 N 0.07 0.28 -0.93 1.81 2.07 -1.72 -0.05 116.25 117.79 1bd9 h VAL 177 Ca -0.04 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.59 1bd9 h VAL 177 Cb 1.59 0.28 -0.08 0.00 -1.52 0.00 0.00 31.29 31.55 1bd9 h VAL 177 CO 0.14 0.00 0.56 -0.65 0.02 0.00 0.00 177.57 177.63 1bd9 h PRO 178 N -0.06 0.85 -0.68 1.57 0.11 -1.78 -0.36 132.00 131.65 1bd9 h PRO 178 Ca 0.29 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.31 1bd9 h PRO 178 Cb 0.51 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.40 1bd9 h PRO 178 CO -0.67 0.56 0.30 0.87 -0.21 0.00 0.00 178.00 178.85 1bd9 h LYS 179 N 0.88 0.97 -0.78 1.05 1.57 -1.24 -0.60 116.57 118.42 1bd9 h LYS 179 Ca 0.47 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 59.08 1bd9 h LYS 179 Cb 0.48 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 1bd9 h LYS 179 CO -0.28 0.77 0.40 1.25 -0.57 0.00 0.00 179.45 181.03 1bd9 h LEU 180 N 0.96 1.00 -0.98 2.94 6.46 -0.60 -1.23 115.31 123.87 1bd9 h LEU 180 Ca 0.23 -0.12 -0.08 0.00 -0.12 0.00 0.00 57.88 57.79 1bd9 h LEU 180 Cb 0.14 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 39.80 1bd9 h LEU 180 CO -0.03 0.83 -0.15 1.88 -0.62 0.00 0.00 178.44 180.36 1bd9 h TYR 181 N 1.09 0.62 -0.57 1.25 0.05 -0.27 -0.07 116.97 119.08 1bd9 h TYR 181 Ca 0.27 -0.11 -0.05 0.00 0.05 0.00 0.00 58.73 58.90 1bd9 h TYR 181 Cb 0.08 -0.16 -0.02 0.00 1.01 0.00 0.00 36.73 37.63 1bd9 h TYR 181 CO 0.01 0.69 0.18 0.93 -1.05 0.00 0.00 178.16 178.91 1bd9 h GLU 182 N 0.52 0.89 -0.37 4.88 4.39 -0.69 -2.72 114.58 121.48 1bd9 h GLU 182 Ca 0.09 -0.19 0.05 0.00 0.34 0.00 0.00 59.36 59.65 1bd9 h GLU 182 Cb 0.55 -0.13 -0.05 0.00 -0.10 0.00 0.00 28.75 29.03 1bd9 h GLU 182 CO 0.04 0.80 0.09 0.37 -1.16 0.00 0.00 179.01 179.14 1bd9 h GLN 183 N 0.80 0.21 0.00 2.33 4.15 -0.22 -3.51 115.11 118.87 1bd9 h GLN 183 Ca 0.18 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.59 1bd9 h GLN 183 Cb 0.29 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.93 1bd9 h GLN 183 CO -0.01 0.14 0.00 1.28 -1.93 0.00 0.00 178.83 178.31