#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mob s VAL 1 N 0.00 -0.15 0.24 3.17 1.01 -1.26 -5.07 120.40 118.34 1mob s VAL 1 Ca 0.00 0.04 -0.20 0.00 0.00 0.00 0.00 61.98 61.82 1mob s VAL 1 Cb 0.00 -0.87 -0.08 0.00 0.00 0.00 0.00 36.38 35.43 1mob s VAL 1 CO 0.00 0.02 0.74 -0.76 0.00 0.00 0.00 175.10 175.09 1mob s LEU 2 N 1.76 4.31 0.70 3.92 1.02 -1.26 -5.03 118.68 124.11 1mob s LEU 2 Ca -0.09 1.43 -0.11 0.00 0.02 0.00 0.00 54.13 55.38 1mob s LEU 2 Cb -0.07 -3.66 0.02 0.00 0.02 0.00 0.00 46.19 42.49 1mob s LEU 2 CO -0.17 0.00 1.09 -0.94 0.02 0.00 0.00 176.35 176.35 1mob s SER 3 N -1.71 5.42 0.35 2.29 1.04 -1.26 -4.91 113.70 114.92 1mob s SER 3 Ca 0.44 1.09 0.05 0.00 0.48 0.00 0.00 55.95 58.01 1mob s SER 3 Cb -0.16 -1.88 0.71 0.00 0.10 0.00 0.00 66.02 64.79 1mob s SER 3 CO 0.21 -1.34 1.94 -0.08 0.98 0.00 0.00 173.24 174.94 1mob h GLU 4 N -0.64 0.77 0.00 4.02 4.57 -2.00 -2.22 114.58 119.09 1mob h GLU 4 Ca -0.45 -0.05 -0.06 0.00 -1.18 0.00 0.00 59.36 57.62 1mob h GLU 4 Cb 1.26 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.66 1mob h GLU 4 CO 0.64 0.51 -0.28 0.78 -1.18 0.00 0.00 179.01 179.48 1mob h GLY 5 N 0.80 0.00 1.11 1.92 0.00 -1.99 0.47 103.07 105.38 1mob h GLY 5 Ca 0.34 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.45 1mob h GLY 5 CO -0.12 0.00 -0.84 0.83 0.00 0.00 0.00 176.54 176.41 1mob h GLU 6 N 0.00 0.69 -0.48 4.80 5.08 -1.83 -1.61 114.58 121.23 1mob h GLU 6 Ca -0.00 -0.65 -0.02 0.00 -1.00 0.00 0.00 59.36 57.69 1mob h GLU 6 Cb 0.66 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.05 1mob h GLU 6 CO 0.04 1.25 0.22 -1.49 -1.00 0.00 0.00 179.01 178.03 1mob h TRP 7 N 0.37 0.67 -0.68 4.33 -0.00 -0.78 -1.26 115.95 118.59 1mob h TRP 7 Ca -0.09 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 58.78 1mob h TRP 7 Cb 1.49 -0.21 -0.03 0.00 -0.00 0.00 0.00 29.16 30.41 1mob h TRP 7 CO 0.10 0.51 0.39 1.96 -0.00 0.00 0.00 178.44 181.40 1mob h GLN 8 N 0.68 0.94 -0.37 0.49 4.20 -0.54 0.20 115.11 120.70 1mob h GLN 8 Ca 0.17 -0.10 -0.10 0.00 0.06 0.00 0.00 58.65 58.68 1mob h GLN 8 Cb 0.09 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 1mob h GLN 8 CO -0.02 0.69 -0.16 -0.07 -0.67 0.00 0.00 178.83 178.60 1mob h LEU 9 N 0.93 0.68 -0.17 1.46 3.38 -0.91 -1.28 115.31 119.41 1mob h LEU 9 Ca 0.24 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1mob h LEU 9 Cb 0.01 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 1mob h LEU 9 CO -0.04 0.85 -0.08 0.58 0.09 0.00 0.00 178.44 179.84 1mob h VAL 10 N 0.62 1.31 0.00 1.22 2.07 -0.09 -2.83 116.25 118.54 1mob h VAL 10 Ca 0.10 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.48 1mob h VAL 10 Cb 0.62 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 1mob h VAL 10 CO 0.04 0.34 0.00 -0.07 0.02 0.00 0.00 177.57 177.90 1mob h LEU 11 N 0.03 0.00 0.01 2.57 3.38 -0.55 -1.55 115.31 119.19 1mob h LEU 11 Ca 0.04 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 1mob h LEU 11 Cb 0.56 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.32 1mob h LEU 11 CO 0.03 0.00 -0.42 -0.74 0.09 0.00 0.00 178.44 177.40 1mob h HIS 12 N 0.00 0.40 -0.18 1.13 2.76 -1.25 0.24 115.15 118.25 1mob h HIS 12 Ca 0.00 -0.23 -0.01 0.00 -2.20 0.00 0.00 60.37 57.94 1mob h HIS 12 Cb 0.65 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.56 1mob h HIS 12 CO 0.00 1.05 0.09 0.28 -1.30 0.00 0.00 177.93 178.05 1mob h VAL 13 N -0.36 1.13 -0.96 5.26 2.07 -1.29 -3.08 116.25 119.02 1mob h VAL 13 Ca -0.05 -0.38 0.18 0.00 0.82 0.00 0.00 66.70 67.27 1mob h VAL 13 Cb 1.17 1.05 -0.10 0.00 -1.52 0.00 0.00 31.29 31.89 1mob h VAL 13 CO 0.08 0.12 0.56 -0.25 0.02 0.00 0.00 177.57 178.10 1mob h TRP 14 N 0.16 0.98 -0.01 1.57 2.91 -1.04 -0.66 115.95 119.86 1mob h TRP 14 Ca 0.06 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.12 1mob h TRP 14 Cb 0.12 -0.29 -0.00 0.00 -0.51 0.00 0.00 29.16 28.48 1mob h TRP 14 CO -0.03 0.22 0.01 0.00 -1.03 0.00 0.00 178.44 177.62 1mob h ALA 15 N 1.62 1.44 0.07 2.65 0.00 -0.86 0.27 119.26 124.46 1mob h ALA 15 Ca 0.54 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.34 1mob h ALA 15 Cb 0.82 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.62 1mob h ALA 15 CO -0.38 -0.02 -0.48 0.87 0.00 0.00 0.00 179.25 179.25 1mob h LYS 16 N 0.00 0.19 -0.64 0.00 1.79 -1.15 -2.76 116.57 114.00 1mob h LYS 16 Ca 0.00 -0.31 0.12 0.00 -2.18 0.00 0.00 60.65 58.29 1mob h LYS 16 Cb 0.03 0.11 -0.09 0.00 -1.58 0.00 0.00 32.23 30.70 1mob h LYS 16 CO -0.00 1.13 0.16 0.28 -1.08 0.00 0.00 179.45 179.93 1mob h VAL 17 N -0.59 0.63 -0.30 0.50 2.07 -0.84 -3.08 116.25 114.64 1mob h VAL 17 Ca -0.08 -0.10 0.09 0.00 0.82 0.00 0.00 66.70 67.43 1mob h VAL 17 Cb 1.35 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 1mob h VAL 17 CO 0.09 0.05 0.27 -0.33 0.02 0.00 0.00 177.57 177.68 1mob h GLU 18 N 0.29 0.00 -0.19 1.57 5.08 -0.65 -2.20 114.58 118.47 1mob h GLU 18 Ca 0.34 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.76 1mob h GLU 18 Cb 0.52 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1mob h GLU 18 CO -0.42 0.00 0.18 0.00 -1.00 0.00 0.00 179.01 177.78 1mob h ALA 19 N 1.74 1.90 -1.76 3.43 0.00 -1.51 -3.35 119.26 119.71 1mob h ALA 19 Ca 0.14 -0.01 -0.46 0.00 0.00 0.00 0.00 54.91 54.59 1mob h ALA 19 Cb 0.69 0.01 -0.37 0.00 0.00 0.00 0.00 17.79 18.13 1mob h ALA 19 CO -0.00 -0.28 -1.10 -3.47 0.00 0.00 0.00 179.25 174.40 1mob n ASP 20 N -3.98 0.36 -0.33 0.00 2.03 -0.84 -5.01 116.55 108.77 1mob n ASP 20 Ca 0.02 -3.04 0.11 0.00 0.52 0.00 0.00 54.79 52.39 1mob n ASP 20 Cb 0.31 -0.32 0.28 0.00 -0.72 0.00 0.00 41.12 40.68 1mob n ASP 20 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1mob h VAL 21 N 1.37 0.69 -0.27 5.18 2.07 -1.66 -1.84 116.25 121.79 1mob h VAL 21 Ca 0.07 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.29 1mob h VAL 21 Cb 0.97 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1mob h VAL 21 CO 0.45 0.12 -0.10 0.00 0.02 0.00 0.00 177.57 178.07 1mob h ALA 22 N 1.62 0.38 -0.73 1.67 0.00 -1.92 -0.97 119.26 119.31 1mob h ALA 22 Ca 0.54 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1mob h ALA 22 Cb 0.82 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1mob h ALA 22 CO -0.39 0.22 0.34 0.78 0.00 0.00 0.00 179.25 180.20 1mob h GLY 23 N 0.29 1.12 0.86 0.00 0.00 -1.88 -1.94 103.07 101.52 1mob h GLY 23 Ca 0.06 -0.55 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 1mob h GLY 23 CO 0.03 0.52 -0.08 0.45 0.00 0.00 0.00 176.54 177.47 1mob h HIS 24 N 1.03 -0.21 -0.84 5.60 3.86 -1.20 -2.09 115.15 121.30 1mob h HIS 24 Ca 0.25 -0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.58 1mob h HIS 24 Cb 0.12 0.07 -0.09 0.00 1.06 0.00 0.00 27.41 28.57 1mob h HIS 24 CO 0.01 -0.01 0.45 0.78 0.86 0.00 0.00 177.93 180.02 1mob h GLY 25 N -0.36 1.35 0.97 2.45 0.00 -1.18 -0.50 103.07 105.79 1mob h GLY 25 Ca -0.02 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 1mob h GLY 25 CO 0.04 0.03 -0.04 1.46 0.00 0.00 0.00 176.54 178.03 1mob h GLN 26 N 0.69 -0.09 0.11 4.80 4.20 -1.30 -1.91 115.11 121.61 1mob h GLN 26 Ca 0.44 0.01 0.02 0.00 0.06 0.00 0.00 58.65 59.18 1mob h GLN 26 Cb 0.55 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.30 1mob h GLN 26 CO -0.32 -0.06 -0.36 -0.44 -0.67 0.00 0.00 178.83 176.99 1mob h ASP 27 N -0.09 -1.04 -0.80 1.46 5.19 -1.19 -0.34 116.42 119.60 1mob h ASP 27 Ca -0.00 0.12 0.09 0.00 -0.62 0.00 0.00 57.03 56.62 1mob h ASP 27 Cb 0.08 0.40 -0.07 0.00 0.18 0.00 0.00 39.33 39.92 1mob h ASP 27 CO -0.00 -0.44 0.45 0.40 -3.12 0.00 0.00 179.24 176.53 1mob h ILE 28 N -0.58 0.90 -0.08 0.35 2.04 -1.07 -1.91 117.51 117.17 1mob h ILE 28 Ca 0.03 -0.26 -0.24 0.00 1.00 0.00 0.00 64.86 65.39 1mob h ILE 28 Cb 0.61 0.08 0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1mob h ILE 28 CO -0.22 0.14 -0.89 -0.07 0.00 0.00 0.00 178.15 177.11 1mob h LEU 29 N 0.76 0.90 -1.49 1.44 3.38 -1.29 -0.30 115.31 118.71 1mob h LEU 29 Ca 0.38 -0.65 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1mob h LEU 29 Cb 0.35 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1mob h LEU 29 CO -0.25 1.44 0.17 0.40 0.09 0.00 0.00 178.44 180.30 1mob h ILE 30 N 0.46 1.13 -0.17 1.22 2.04 -1.05 -0.86 117.51 120.28 1mob h ILE 30 Ca -0.08 -0.39 -0.20 0.00 1.00 0.00 0.00 64.86 65.19 1mob h ILE 30 Cb 1.53 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 1mob h ILE 30 CO 0.18 0.16 -0.68 -0.09 0.00 0.00 0.00 178.15 177.71 1mob h ARG 31 N 0.52 0.69 -0.65 2.37 9.65 -0.82 0.50 114.38 126.63 1mob h ARG 31 Ca 0.13 -0.51 -0.05 0.00 -1.10 0.00 0.00 59.98 58.45 1mob h ARG 31 Cb 0.07 0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.71 1mob h ARG 31 CO -0.02 1.13 0.21 1.25 2.80 0.00 0.00 179.97 185.35 1mob h LEU 32 N 0.49 0.94 -0.42 3.80 5.85 -0.86 -0.08 115.31 125.03 1mob h LEU 32 Ca -0.02 -0.20 -0.07 0.00 0.84 0.00 0.00 57.88 58.42 1mob h LEU 32 Cb 1.28 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 1mob h LEU 32 CO 0.14 0.89 -0.33 -0.26 -0.34 0.00 0.00 178.44 178.54 1mob h PHE 33 N 0.94 0.00 -0.01 1.25 0.04 -1.07 0.90 116.94 119.00 1mob h PHE 33 Ca 0.21 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.89 1mob h PHE 33 Cb 0.28 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.44 1mob h PHE 33 CO 0.02 0.33 -0.37 0.87 -0.60 0.00 0.00 178.31 178.56 1mob h LYS 34 N 0.00 0.26 -0.49 1.51 1.57 0.66 -3.19 116.57 116.89 1mob h LYS 34 Ca -0.00 -0.27 -0.11 0.00 -1.87 0.00 0.00 60.65 58.40 1mob h LYS 34 Cb 1.09 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.46 1mob h LYS 34 CO 0.04 0.98 -0.12 0.77 -0.57 0.00 0.00 179.45 180.55 1mob h SER 35 N -0.34 0.92 -2.13 0.86 0.02 -0.97 -3.38 113.55 108.53 1mob h SER 35 Ca -0.04 -0.30 -0.58 0.00 -0.84 0.00 0.00 61.79 60.03 1mob h SER 35 Cb 1.10 -0.25 -0.40 0.00 0.14 0.00 0.00 62.40 62.99 1mob h SER 35 CO 0.07 1.04 -0.94 1.41 -1.14 0.00 0.00 176.83 177.27 1mob n HIS 36 N -4.15 0.72 -0.36 3.45 8.25 0.30 -4.99 115.22 118.44 1mob n HIS 36 Ca 0.01 -3.71 0.28 0.00 -0.26 0.00 0.00 57.72 54.04 1mob n HIS 36 Cb 0.39 -0.35 0.57 0.00 1.12 0.00 0.00 29.99 31.73 1mob n HIS 36 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1mob h PRO 37 N 4.28 0.26 -0.91 -0.41 0.11 -1.73 0.61 132.00 134.20 1mob h PRO 37 Ca 0.13 -0.02 0.21 0.00 0.11 0.00 0.00 66.00 66.43 1mob h PRO 37 Cb 0.82 -0.06 -0.07 0.00 0.11 0.00 0.00 31.00 31.81 1mob h PRO 37 CO 0.55 0.17 0.61 1.05 -0.21 0.00 0.00 178.00 180.17 1mob h GLU 38 N 0.26 0.37 0.00 1.05 9.09 -1.93 -1.85 114.58 121.58 1mob h GLU 38 Ca 0.67 -0.02 -0.01 0.00 0.05 0.00 0.00 59.36 60.05 1mob h GLU 38 Cb 1.91 -0.08 -0.00 0.00 -1.65 0.00 0.00 28.75 28.93 1mob h GLU 38 CO -0.32 0.25 -0.03 1.79 0.05 0.00 0.00 179.01 180.75 1mob h THR 39 N 0.38 0.46 -0.30 -1.06 1.35 -1.21 -2.46 112.91 110.08 1mob h THR 39 Ca 0.48 -0.12 -0.06 0.00 -0.55 0.00 0.00 66.41 66.15 1mob h THR 39 Cb 1.23 1.08 -0.02 0.00 -1.73 0.00 0.00 68.15 68.71 1mob h THR 39 CO -0.18 0.03 -0.08 0.25 -0.25 0.00 0.00 175.52 175.29 1mob h LEU 40 N 0.00 0.47 -1.68 3.87 5.85 -1.51 -2.37 115.31 119.94 1mob h LEU 40 Ca -0.00 -0.11 0.12 0.00 0.84 0.00 0.00 57.88 58.74 1mob h LEU 40 Cb 0.08 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 1mob h LEU 40 CO 0.00 0.59 0.43 -0.33 -0.34 0.00 0.00 178.44 178.80 1mob h GLU 41 N 0.46 0.33 0.00 1.25 5.08 -1.57 0.19 114.58 120.32 1mob h GLU 41 Ca 0.09 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1mob h GLU 41 Cb 0.42 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1mob h GLU 41 CO 0.02 0.22 0.00 1.63 -1.00 0.00 0.00 179.01 179.88 1mob n LYS 42 N -4.46 0.08 -3.74 2.33 4.76 -0.89 -4.23 118.16 112.01 1mob n LYS 42 Ca 0.11 0.26 -0.37 0.00 -2.87 0.00 0.00 58.31 55.44 1mob n LYS 42 Cb 0.46 -1.50 -0.11 0.00 -1.84 0.00 0.00 35.03 32.04 1mob n LYS 42 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1mob s PHE 43 N -2.68 3.47 0.31 2.13 0.40 0.65 -4.91 117.98 117.36 1mob s PHE 43 Ca 0.06 -2.08 0.33 0.00 -0.60 0.00 0.00 56.93 54.63 1mob s PHE 43 Cb 0.05 -3.02 1.55 0.00 0.51 0.00 0.00 43.02 42.11 1mob s PHE 43 CO 0.12 -0.92 2.07 -0.44 0.70 0.00 0.00 175.22 176.75 1mob h ASP 44 N 8.16 0.00 0.01 1.36 5.19 -1.83 0.21 116.42 129.52 1mob h ASP 44 Ca -0.17 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.24 1mob h ASP 44 Cb 1.06 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.57 1mob h ASP 44 CO 0.70 0.07 -0.08 -2.11 -3.12 0.00 0.00 179.24 174.70 1mob n ARG 45 N -3.30 1.76 0.00 3.56 1.85 -1.26 -4.17 116.66 115.10 1mob n ARG 45 Ca -0.01 -1.26 0.00 0.00 -1.00 0.00 0.00 57.85 55.58 1mob n ARG 45 Cb 0.25 -1.47 0.00 0.00 -1.05 0.00 0.00 32.46 30.19 1mob n ARG 45 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1mob n PHE 46 N 0.48 0.00 0.00 2.89 3.72 0.58 -4.75 117.46 120.37 1mob n PHE 46 Ca 0.15 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.55 1mob n PHE 46 Cb 0.45 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.99 1mob n PHE 46 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1mob n LYS 47 N -1.52 0.00 0.00 -1.08 4.81 -0.16 -0.89 118.16 119.31 1mob n LYS 47 Ca 0.00 0.00 0.15 0.00 -0.87 0.00 0.00 58.31 57.59 1mob n LYS 47 Cb 0.30 0.00 0.80 0.00 0.02 0.00 0.00 35.03 36.15 1mob n LYS 47 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18 1mob n HIS 48 N -2.65 0.00 -2.09 5.64 1.44 -1.26 -4.86 115.22 111.43 1mob n HIS 48 Ca 0.00 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.29 1mob n HIS 48 Cb 0.00 -0.20 -0.03 0.00 0.12 0.00 0.00 29.99 29.88 1mob n HIS 48 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1mob s LEU 49 N -2.41 4.29 0.14 2.39 1.43 -0.07 -4.92 118.68 119.53 1mob s LEU 49 Ca 0.34 2.12 0.18 0.00 -1.03 0.00 0.00 54.13 55.74 1mob s LEU 49 Cb 0.21 -3.53 -0.06 0.00 0.03 0.00 0.00 46.19 42.83 1mob s LEU 49 CO 0.44 -0.89 1.01 0.11 0.23 0.00 0.00 176.35 177.24 1mob h LYS 50 N 9.25 0.00 -4.72 1.70 1.57 -1.90 -3.49 116.57 118.98 1mob h LYS 50 Ca -0.37 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.14 1mob h LYS 50 Cb 1.16 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.33 1mob h LYS 50 CO 0.96 0.27 -0.65 0.95 -0.57 0.00 0.00 179.45 180.40 1mob s THR 51 N -3.02 0.48 0.48 -0.16 -4.23 -1.26 -5.02 115.64 102.91 1mob s THR 51 Ca -0.01 -1.97 0.14 0.00 -1.18 0.00 0.00 61.69 58.67 1mob s THR 51 Cb 0.08 -2.22 0.23 0.00 1.34 0.00 0.00 72.50 71.93 1mob s THR 51 CO 0.79 -0.36 2.07 -0.08 -0.54 0.00 0.00 174.62 176.50 1mob h GLU 52 N 2.67 0.06 -0.51 3.99 4.81 -1.99 -2.43 114.58 121.18 1mob h GLU 52 Ca -0.37 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 58.74 1mob h GLU 52 Cb 1.21 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.57 1mob h GLU 52 CO 0.61 0.12 -0.13 0.00 -0.73 0.00 0.00 179.01 178.88 1mob h ALA 53 N 1.89 0.71 -0.21 2.92 0.00 -1.98 0.28 119.26 122.86 1mob h ALA 53 Ca 0.02 -0.36 -0.11 0.00 0.00 0.00 0.00 54.91 54.46 1mob h ALA 53 Cb 0.14 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1mob h ALA 53 CO 0.01 0.64 -0.34 0.93 0.00 0.00 0.00 179.25 180.49 1mob h GLU 54 N 0.86 0.44 -0.09 0.00 5.08 -1.94 -1.32 114.58 117.61 1mob h GLU 54 Ca 0.13 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1mob h GLU 54 Cb 0.70 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.94 1mob h GLU 54 CO 0.05 0.72 -0.01 0.52 -1.00 0.00 0.00 179.01 179.29 1mob h MET 55 N 0.38 0.17 -0.51 2.33 2.86 -0.91 -2.07 114.93 117.18 1mob h MET 55 Ca 0.04 -0.06 0.12 0.00 -2.06 0.00 0.00 59.70 57.74 1mob h MET 55 Cb 0.77 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.39 1mob h MET 55 CO 0.06 0.46 0.35 0.87 1.06 0.00 0.00 176.91 179.72 1mob h LYS 56 N -0.13 0.16 -0.02 1.72 6.56 -0.79 -2.41 116.57 121.66 1mob h LYS 56 Ca 0.02 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.61 1mob h LYS 56 Cb 0.39 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.02 1mob h LYS 56 CO 0.01 0.11 -0.05 0.00 -2.06 0.00 0.00 179.45 177.46 1mob n ALA 57 N -2.58 2.66 -2.68 3.86 0.00 -0.51 -4.86 120.51 116.39 1mob n ALA 57 Ca 0.09 -0.46 -0.38 0.00 0.00 0.00 0.00 53.44 52.69 1mob n ALA 57 Cb 0.47 -1.13 -0.08 0.00 0.00 0.00 0.00 19.45 18.71 1mob n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1mob s SER 58 N -2.09 6.39 0.20 0.00 0.15 -0.82 -4.95 113.70 112.59 1mob s SER 58 Ca 0.35 0.46 0.01 0.00 0.70 0.00 0.00 55.95 57.47 1mob s SER 58 Cb 0.21 -2.21 0.15 0.00 -1.71 0.00 0.00 66.02 62.46 1mob s SER 58 CO 0.36 -0.03 1.50 -0.08 1.20 0.00 0.00 173.24 176.19 1mob h GLU 59 N 7.28 0.32 -0.42 5.44 4.57 -1.89 -2.77 114.58 127.12 1mob h GLU 59 Ca -0.37 -0.24 -0.01 0.00 -1.18 0.00 0.00 59.36 57.55 1mob h GLU 59 Cb 1.16 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.78 1mob h GLU 59 CO 0.71 0.87 0.22 -0.44 -1.18 0.00 0.00 179.01 179.20 1mob h ASP 60 N 0.23 0.54 -0.79 1.04 3.32 -1.97 0.71 116.42 119.50 1mob h ASP 60 Ca -0.02 -0.10 0.08 0.00 0.02 0.00 0.00 57.03 57.01 1mob h ASP 60 Cb 1.21 -0.14 -0.07 0.00 0.22 0.00 0.00 39.33 40.55 1mob h ASP 60 CO 0.11 0.49 0.45 0.25 -1.72 0.00 0.00 179.24 178.82 1mob h LEU 61 N 0.55 0.66 -0.69 1.55 6.46 -1.89 0.37 115.31 122.32 1mob h LEU 61 Ca 0.15 0.04 -0.07 0.00 -0.12 0.00 0.00 57.88 57.88 1mob h LEU 61 Cb 0.08 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 39.89 1mob h LEU 61 CO -0.02 0.39 0.15 0.50 -0.62 0.00 0.00 178.44 178.83 1mob h LYS 62 N 0.78 1.12 -0.60 1.25 3.64 -1.25 0.41 116.57 121.92 1mob h LYS 62 Ca 0.37 -0.28 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 1mob h LYS 62 Cb 0.30 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 1mob h LYS 62 CO -0.23 1.00 0.28 0.87 -2.27 0.00 0.00 179.45 179.10 1mob h LYS 63 N 1.05 0.86 -0.31 1.90 1.57 -0.40 -1.98 116.57 119.26 1mob h LYS 63 Ca 0.21 -0.13 -0.08 0.00 -1.87 0.00 0.00 60.65 58.79 1mob h LYS 63 Cb 0.40 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 1mob h LYS 63 CO 0.01 0.70 -0.13 0.78 -0.57 0.00 0.00 179.45 180.24 1mob h GLY 64 N 0.81 0.57 1.45 3.86 0.00 0.43 -1.99 103.07 108.21 1mob h GLY 64 Ca 0.20 -0.41 -0.08 0.00 0.00 0.00 0.00 47.33 47.05 1mob h GLY 64 CO -0.02 0.37 -0.10 -1.33 0.00 0.00 0.00 176.54 175.46 1mob h GLY 65 N 0.94 0.71 1.03 4.60 0.00 -0.34 -0.76 103.07 109.26 1mob h GLY 65 Ca 0.09 -0.51 -0.04 0.00 0.00 0.00 0.00 47.33 46.86 1mob h GLY 65 CO 0.03 0.47 0.29 -2.08 0.00 0.00 0.00 176.54 175.26 1mob h VAL 66 N 0.60 1.25 -0.64 4.60 2.07 -1.04 0.89 116.25 123.99 1mob h VAL 66 Ca 0.11 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.81 1mob h VAL 66 Cb 0.53 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1mob h VAL 66 CO 0.03 0.32 0.32 0.74 0.02 0.00 0.00 177.57 179.00 1mob h THR 67 N 1.06 1.22 -0.07 2.57 2.02 -0.58 0.29 112.91 119.41 1mob h THR 67 Ca 0.24 -0.59 -0.01 0.00 0.77 0.00 0.00 66.41 66.82 1mob h THR 67 Cb 0.21 0.43 -0.00 0.00 -1.74 0.00 0.00 68.15 67.05 1mob h THR 67 CO -0.02 0.25 0.00 0.58 0.37 0.00 0.00 175.52 176.70 1mob h VAL 68 N 0.88 1.24 -0.48 3.16 2.07 -0.85 -1.35 116.25 120.92 1mob h VAL 68 Ca 0.22 -0.74 -0.08 0.00 0.82 0.00 0.00 66.70 66.92 1mob h VAL 68 Cb 0.10 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 1mob h VAL 68 CO -0.03 0.20 -0.03 -0.07 0.02 0.00 0.00 177.57 177.66 1mob h LEU 69 N -0.16 0.85 -0.30 2.57 3.38 -0.80 0.79 115.31 121.64 1mob h LEU 69 Ca 0.02 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1mob h LEU 69 Cb 0.32 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1mob h LEU 69 CO 0.00 0.97 0.20 0.74 0.09 0.00 0.00 178.44 180.44 1mob h THR 70 N 0.71 1.09 -0.95 0.22 2.02 -0.91 0.35 112.91 115.44 1mob h THR 70 Ca 0.13 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 1mob h THR 70 Cb 0.55 0.66 -0.05 0.00 -1.74 0.00 0.00 68.15 67.58 1mob h THR 70 CO 0.03 0.08 0.58 0.00 0.37 0.00 0.00 175.52 176.59 1mob h ALA 71 N 1.10 1.21 -0.34 6.16 0.00 -0.84 -2.39 119.26 124.16 1mob h ALA 71 Ca 0.11 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1mob h ALA 71 Cb -0.03 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.36 1mob h ALA 71 CO -0.02 0.65 0.09 1.25 0.00 0.00 0.00 179.25 181.22 1mob h LEU 72 N 1.31 0.51 -1.49 0.00 5.85 -0.67 -1.94 115.31 118.86 1mob h LEU 72 Ca 0.34 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.85 1mob h LEU 72 Cb -0.08 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 1mob h LEU 72 CO -0.07 0.59 0.35 1.23 -0.34 0.00 0.00 178.44 180.21 1mob h GLY 73 N 0.39 0.74 2.00 3.75 0.00 -0.26 0.63 103.07 110.32 1mob h GLY 73 Ca 0.11 -0.27 -0.09 0.00 0.00 0.00 0.00 47.33 47.08 1mob h GLY 73 CO -0.00 0.26 -0.42 0.00 0.00 0.00 0.00 176.54 176.38 1mob h ALA 74 N 1.67 1.09 0.11 3.60 0.00 -0.88 -1.52 119.26 123.33 1mob h ALA 74 Ca 0.20 -0.38 -0.27 0.00 0.00 0.00 0.00 54.91 54.46 1mob h ALA 74 Cb -0.05 -0.07 0.03 0.00 0.00 0.00 0.00 17.79 17.70 1mob h ALA 74 CO -0.05 0.52 -1.12 0.82 0.00 0.00 0.00 179.25 179.43 1mob h ILE 75 N 0.00 1.32 0.00 0.00 2.04 -0.31 -3.11 117.51 117.46 1mob h ILE 75 Ca -0.00 -2.42 -0.05 0.00 1.00 0.00 0.00 64.86 63.39 1mob h ILE 75 Cb 0.86 2.74 -0.01 0.00 -0.74 0.00 0.00 36.82 39.67 1mob h ILE 75 CO 0.05 0.73 -0.23 -0.07 0.00 0.00 0.00 178.15 178.63 1mob h LEU 76 N 0.16 0.00 -0.42 1.44 3.38 -0.55 -1.15 115.31 118.17 1mob h LEU 76 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1mob h LEU 76 Cb 1.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.56 1mob h LEU 76 CO 0.22 0.23 0.00 0.11 0.09 0.00 0.00 178.44 179.08 1mob h LYS 77 N 0.00 0.00 0.00 1.13 1.57 -1.23 -0.89 116.57 117.14 1mob h LYS 77 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1mob h LYS 77 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1mob h LYS 77 CO 0.03 0.00 0.00 0.87 -0.57 0.00 0.00 179.45 179.78 1mob h LYS 78 N 0.00 0.00 -5.23 3.15 1.79 -1.14 -3.48 116.57 111.67 1mob h LYS 78 Ca 0.00 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.14 1mob h LYS 78 Cb 0.60 0.00 0.13 0.00 -1.58 0.00 0.00 32.23 31.38 1mob h LYS 78 CO 0.00 0.00 -0.62 1.63 -1.08 0.00 0.00 179.45 179.38 1mob n LYS 79 N -2.89 -6.58 0.00 3.15 5.02 -0.34 -1.26 118.16 115.25 1mob n LYS 79 Ca 0.02 0.73 0.00 0.00 -2.02 0.00 0.00 58.31 57.04 1mob n LYS 79 Cb 0.34 -5.46 0.00 0.00 -0.02 0.00 0.00 35.03 29.89 1mob n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mob n GLY 80 N -1.57 3.25 2.52 0.72 0.00 -1.26 -4.94 105.19 103.90 1mob n GLY 80 Ca -0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 1mob n GLY 80 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1mob n HIS 81 N -1.03 2.63 -0.35 1.61 8.25 -0.39 -4.58 115.22 121.36 1mob n HIS 81 Ca 0.00 -2.82 0.08 0.00 -0.26 0.00 0.00 57.72 54.72 1mob n HIS 81 Cb 0.00 -1.86 0.24 0.00 1.12 0.00 0.00 29.99 29.49 1mob n HIS 81 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1mob n HIS 82 N 1.98 0.79 -0.31 4.41 1.44 -1.26 -4.80 115.22 117.47 1mob n HIS 82 Ca 0.60 -0.54 0.00 0.00 -2.01 0.00 0.00 57.72 55.78 1mob n HIS 82 Cb 0.26 -0.06 0.07 0.00 0.12 0.00 0.00 29.99 30.37 1mob n HIS 82 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 1mob h GLU 83 N 3.03 -0.04 -0.27 -1.40 3.07 -2.00 -1.42 114.58 115.56 1mob h GLU 83 Ca 0.00 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.77 1mob h GLU 83 Cb 0.95 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.86 1mob h GLU 83 CO 0.04 -0.02 -0.23 0.00 -1.40 0.00 0.00 179.01 177.40 1mob h ALA 84 N 1.51 1.11 0.00 3.43 0.00 -2.00 -1.86 119.26 121.45 1mob h ALA 84 Ca 0.36 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1mob h ALA 84 Cb 0.61 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1mob h ALA 84 CO -0.89 0.55 -0.43 0.93 0.00 0.00 0.00 179.25 179.42 1mob h GLU 85 N 0.44 0.00 0.00 0.00 3.07 -1.64 -3.32 114.58 113.13 1mob h GLU 85 Ca 0.07 0.00 -0.17 0.00 -0.50 0.00 0.00 59.36 58.76 1mob h GLU 85 Cb 0.64 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.53 1mob h GLU 85 CO 0.05 0.43 -0.82 -0.07 -1.40 0.00 0.00 179.01 177.19 1mob h LEU 86 N 0.00 0.00 0.16 1.33 4.07 -0.51 -3.36 115.31 117.01 1mob h LEU 86 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1mob h LEU 86 Cb 0.77 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.48 1mob h LEU 86 CO 0.06 0.82 -0.41 0.11 -1.08 0.00 0.00 178.44 177.93 1mob h LYS 87 N 0.00 -0.61 -0.97 1.13 1.57 -1.59 0.80 116.57 116.89 1mob h LYS 87 Ca -0.01 0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.85 1mob h LYS 87 Cb 1.61 0.14 -0.06 0.00 0.08 0.00 0.00 32.23 34.01 1mob h LYS 87 CO 0.11 -0.41 0.64 -1.00 -0.57 0.00 0.00 179.45 178.22 1mob h PRO 88 N -0.64 1.19 0.11 3.15 0.13 -1.78 -1.36 132.00 132.80 1mob h PRO 88 Ca -0.02 -0.07 -0.01 0.00 -0.87 0.00 0.00 66.00 65.04 1mob h PRO 88 Cb 0.61 -0.27 0.00 0.00 0.13 0.00 0.00 31.00 31.48 1mob h PRO 88 CO -0.18 0.78 -0.05 1.25 -0.23 0.00 0.00 178.00 179.57 1mob h LEU 89 N 1.22 -0.13 -2.00 1.56 7.12 -1.55 -2.31 115.31 119.22 1mob h LEU 89 Ca 0.39 -0.16 -0.01 0.00 0.13 0.00 0.00 57.88 58.23 1mob h LEU 89 Cb 0.02 0.03 -0.00 0.00 -0.53 0.00 0.00 40.66 40.19 1mob h LEU 89 CO -0.12 0.08 -0.07 0.00 -0.13 0.00 0.00 178.44 178.20 1mob h ALA 90 N 0.53 1.72 -0.05 1.25 0.00 0.84 -2.60 119.26 120.95 1mob h ALA 90 Ca -0.02 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 1mob h ALA 90 Cb 0.28 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.06 1mob h ALA 90 CO 0.03 0.08 -0.46 0.37 0.00 0.00 0.00 179.25 179.26 1mob h GLN 91 N 0.00 0.40 -0.04 0.00 4.15 -1.15 -0.72 115.11 117.74 1mob h GLN 91 Ca -0.00 -0.36 -0.20 0.00 0.77 0.00 0.00 58.65 58.85 1mob h GLN 91 Cb 0.13 0.09 -0.00 0.00 0.21 0.00 0.00 27.48 27.91 1mob h GLN 91 CO 0.01 1.02 -0.82 0.66 -1.93 0.00 0.00 178.83 177.76 1mob h SER 92 N -0.09 0.49 0.01 -0.69 4.64 -1.45 -2.03 113.55 114.43 1mob h SER 92 Ca -0.04 -0.36 -0.12 0.00 -0.47 0.00 0.00 61.79 60.80 1mob h SER 92 Cb 1.14 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 63.07 1mob h SER 92 CO 0.09 1.12 -0.39 0.45 -0.87 0.00 0.00 176.83 177.24 1mob h HIS 93 N 0.25 0.58 -0.05 4.77 3.86 -1.37 0.94 115.15 124.12 1mob h HIS 93 Ca -0.05 -0.16 -0.20 0.00 -1.16 0.00 0.00 60.37 58.80 1mob h HIS 93 Cb 1.43 -0.13 0.01 0.00 1.06 0.00 0.00 27.41 29.78 1mob h HIS 93 CO 0.05 0.81 -0.73 0.00 0.86 0.00 0.00 177.93 178.92 1mob h ALA 94 N 1.17 0.16 0.03 2.45 0.00 -1.11 0.27 119.26 122.23 1mob h ALA 94 Ca 0.04 -0.59 -0.36 0.00 0.00 0.00 0.00 54.91 54.00 1mob h ALA 94 Cb 0.86 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 1mob h ALA 94 CO 0.07 0.51 -2.17 2.41 0.00 0.00 0.00 179.25 180.07 1mob n THR 95 N -4.08 1.56 -0.12 0.00 -1.04 -0.77 -3.68 114.28 106.16 1mob n THR 95 Ca -0.09 -0.72 -0.24 0.00 -2.04 0.00 0.00 64.05 60.96 1mob n THR 95 Cb 0.73 -1.17 -0.08 0.00 -1.82 0.00 0.00 70.33 67.99 1mob n THR 95 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1mob n LYS 96 N -3.14 0.54 0.09 -2.82 3.00 -0.33 -4.70 118.16 110.80 1mob n LYS 96 Ca -0.33 0.23 -0.23 0.00 -0.00 0.00 0.00 58.31 57.98 1mob n LYS 96 Cb 1.06 -1.41 -0.15 0.00 0.00 0.00 0.00 35.03 34.53 1mob n LYS 96 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1mob h HIS 97 N -0.93 0.76 -3.08 5.64 -0.00 -1.05 -3.49 115.15 113.00 1mob h HIS 97 Ca -0.52 -0.56 -0.08 0.00 -0.00 0.00 0.00 60.37 59.22 1mob h HIS 97 Cb 1.44 -0.03 0.05 0.00 -0.00 0.00 0.00 27.41 28.86 1mob h HIS 97 CO -0.15 1.60 -0.21 1.63 -0.00 0.00 0.00 177.93 180.80 1mob n LYS 98 N -3.72 -1.53 -3.08 2.45 5.02 0.88 -4.99 118.16 113.18 1mob n LYS 98 Ca -0.21 0.22 -0.43 0.00 -2.02 0.00 0.00 58.31 55.87 1mob n LYS 98 Cb 1.04 -3.25 -0.06 0.00 -0.02 0.00 0.00 35.03 32.75 1mob n LYS 98 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1mob s ILE 99 N -3.10 4.76 0.92 -0.18 -1.09 -0.77 -5.03 121.20 116.71 1mob s ILE 99 Ca 0.02 -0.22 -0.10 0.00 -2.23 0.00 0.00 60.65 58.11 1mob s ILE 99 Cb -0.00 -4.34 0.13 0.00 -1.58 0.00 0.00 42.46 36.68 1mob s ILE 99 CO 0.19 -0.84 1.07 -0.81 -1.23 0.00 0.00 174.94 173.32 1mob n PRO 100 N 6.47 -0.42 -0.13 2.79 -0.04 -1.26 -4.77 135.00 137.63 1mob n PRO 100 Ca -0.04 -0.06 -0.01 0.00 -0.04 0.00 0.00 63.50 63.35 1mob n PRO 100 Cb 0.46 -2.32 0.24 0.00 -0.04 0.00 0.00 33.50 31.84 1mob n PRO 100 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1mob h ILE 101 N -1.83 1.20 -0.92 0.52 1.08 -1.99 0.33 117.51 115.89 1mob h ILE 101 Ca -0.43 -0.60 0.21 0.00 -0.39 0.00 0.00 64.86 63.65 1mob h ILE 101 Cb 1.27 0.49 -0.12 0.00 -3.07 0.00 0.00 36.82 35.39 1mob h ILE 101 CO 0.40 0.24 0.47 0.50 -0.69 0.00 0.00 178.15 179.08 1mob h LYS 102 N 0.82 0.50 -0.32 2.37 1.63 -1.99 -2.10 116.57 117.47 1mob h LYS 102 Ca 0.20 -0.03 -0.10 0.00 -0.85 0.00 0.00 60.65 59.87 1mob h LYS 102 Cb 0.13 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 31.63 1mob h LYS 102 CO -0.02 0.33 -0.22 1.88 -3.45 0.00 0.00 179.45 177.97 1mob h TYR 103 N 0.52 0.69 -0.56 1.91 -1.99 -0.69 -2.01 116.97 114.84 1mob h TYR 103 Ca 0.57 -0.15 -0.09 0.00 2.00 0.00 0.00 58.73 61.06 1mob h TYR 103 Cb 1.02 -0.17 -0.02 0.00 2.00 0.00 0.00 36.73 39.56 1mob h TYR 103 CO -0.08 0.79 0.01 -0.07 -0.00 0.00 0.00 178.16 178.81 1mob h LEU 104 N 0.55 0.94 -0.61 3.88 3.38 -1.39 -2.00 115.31 120.06 1mob h LEU 104 Ca 0.08 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 1mob h LEU 104 Cb 0.67 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1mob h LEU 104 CO 0.05 0.99 0.36 -0.33 0.09 0.00 0.00 178.44 179.60 1mob h GLU 105 N 0.89 0.82 0.28 1.13 5.08 -1.26 -1.16 114.58 120.36 1mob h GLU 105 Ca 0.17 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1mob h GLU 105 Cb 0.51 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1mob h GLU 105 CO 0.02 0.59 -0.14 0.74 -1.00 0.00 0.00 179.01 179.23 1mob h PHE 106 N 0.82 -0.36 -0.65 4.33 0.04 -0.98 -1.95 116.94 118.20 1mob h PHE 106 Ca 0.22 -0.01 0.03 0.00 2.80 0.00 0.00 57.97 61.01 1mob h PHE 106 Cb -0.02 0.12 -0.04 0.00 2.20 0.00 0.00 35.95 38.22 1mob h PHE 106 CO -0.02 -0.22 0.43 0.97 -0.60 0.00 0.00 178.31 178.87 1mob h ILE 107 N -0.38 1.11 -0.41 -0.55 2.10 -1.37 -1.62 117.51 116.39 1mob h ILE 107 Ca -0.04 -0.27 0.06 0.00 1.08 0.00 0.00 64.86 65.70 1mob h ILE 107 Cb 0.30 0.24 -0.02 0.00 -1.09 0.00 0.00 36.82 36.25 1mob h ILE 107 CO 0.05 0.15 0.28 0.28 -1.08 0.00 0.00 178.15 177.83 1mob h SER 108 N 0.80 0.25 -0.01 2.19 0.02 -0.49 -0.87 113.55 115.44 1mob h SER 108 Ca 0.25 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.20 1mob h SER 108 Cb 0.03 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 62.52 1mob h SER 108 CO -0.07 0.16 -0.00 -0.08 -1.14 0.00 0.00 176.83 175.70 1mob h GLU 109 N 0.28 0.01 0.00 3.45 4.81 -1.08 -1.30 114.58 120.75 1mob h GLU 109 Ca 0.18 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.38 1mob h GLU 109 Cb 0.36 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.74 1mob h GLU 109 CO -0.04 0.47 -0.11 0.00 -0.73 0.00 0.00 179.01 178.60 1mob h ALA 110 N 0.55 1.65 0.11 2.92 0.00 -0.91 -2.23 119.26 121.33 1mob h ALA 110 Ca 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1mob h ALA 110 Cb 0.46 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1mob h ALA 110 CO 0.00 0.14 -0.05 0.82 0.00 0.00 0.00 179.25 180.16 1mob h ILE 111 N 0.00 1.09 -0.29 0.00 2.04 -0.37 -2.41 117.51 117.57 1mob h ILE 111 Ca -0.00 -0.89 0.08 0.00 1.00 0.00 0.00 64.86 65.05 1mob h ILE 111 Cb 0.23 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.94 1mob h ILE 111 CO 0.01 0.21 0.21 0.40 0.00 0.00 0.00 178.15 178.98 1mob h ILE 112 N -0.57 0.88 0.11 -0.67 2.04 -1.15 -1.29 117.51 116.87 1mob h ILE 112 Ca -0.01 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 1mob h ILE 112 Cb 0.46 0.82 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1mob h ILE 112 CO 0.02 0.01 -0.05 -0.74 0.00 0.00 0.00 178.15 177.39 1mob h HIS 113 N 0.05 -0.14 -0.38 1.37 2.76 -1.30 -1.43 115.15 116.09 1mob h HIS 113 Ca 0.14 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.29 1mob h HIS 113 Cb 0.49 0.05 -0.02 0.00 1.55 0.00 0.00 27.41 29.48 1mob h HIS 113 CO -0.00 0.23 0.19 0.28 -1.30 0.00 0.00 177.93 177.34 1mob h VAL 114 N -0.55 1.16 -0.54 5.26 2.07 -1.29 -0.47 116.25 121.89 1mob h VAL 114 Ca -0.02 -0.44 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 1mob h VAL 114 Cb 0.44 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1mob h VAL 114 CO 0.03 0.17 0.20 -0.07 0.02 0.00 0.00 177.57 177.91 1mob h LEU 115 N 0.48 0.72 -0.08 2.57 3.38 -1.19 -1.32 115.31 119.87 1mob h LEU 115 Ca 0.13 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1mob h LEU 115 Cb 0.10 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1mob h LEU 115 CO -0.02 0.66 0.02 -0.74 0.09 0.00 0.00 178.44 178.45 1mob h HIS 116 N 0.77 0.14 0.12 1.13 2.76 -1.09 0.15 115.15 119.14 1mob h HIS 116 Ca 0.18 -0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.35 1mob h HIS 116 Cb 0.18 -0.04 -0.03 0.00 1.55 0.00 0.00 27.41 29.08 1mob h HIS 116 CO 0.01 0.33 -0.21 0.77 -1.30 0.00 0.00 177.93 177.54 1mob h SER 117 N -0.10 -0.58 0.20 3.26 0.02 -0.70 -3.33 113.55 112.32 1mob h SER 117 Ca 0.02 0.07 -0.21 0.00 -0.84 0.00 0.00 61.79 60.83 1mob h SER 117 Cb 0.27 0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.02 1mob h SER 117 CO 0.00 -0.29 -0.82 0.03 -1.14 0.00 0.00 176.83 174.60 1mob h ARG 118 N -0.40 0.49 -2.29 3.45 3.08 -1.29 -3.41 114.38 114.02 1mob h ARG 118 Ca 0.02 -0.45 -0.63 0.00 0.07 0.00 0.00 59.98 59.00 1mob h ARG 118 Cb 0.41 0.11 -0.40 0.00 0.08 0.00 0.00 29.97 30.17 1mob h ARG 118 CO -0.11 1.08 -0.38 0.72 -1.07 0.00 0.00 179.97 180.22 1mob n HIS 119 N -3.83 3.69 0.18 3.04 8.25 0.04 -4.90 115.22 121.69 1mob n HIS 119 Ca -0.06 -3.84 0.02 0.00 -0.26 0.00 0.00 57.72 53.59 1mob n HIS 119 Cb 0.76 -0.63 0.34 0.00 1.12 0.00 0.00 29.99 31.58 1mob n HIS 119 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1mob h PRO 120 N 3.68 0.00 0.00 -0.41 0.13 -1.74 0.61 132.00 134.27 1mob h PRO 120 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 1mob h PRO 120 Cb 0.55 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.68 1mob h PRO 120 CO 0.89 0.40 -0.27 0.78 -0.23 0.00 0.00 178.00 179.57 1mob h GLY 121 N 1.20 0.00 -0.77 1.56 0.00 -1.92 -2.94 103.07 100.20 1mob h GLY 121 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1mob h GLY 121 CO 0.05 0.00 -0.19 0.70 0.00 0.00 0.00 176.54 177.11 1mob n ASN 122 N -2.78 1.66 -2.99 0.19 3.02 0.71 -4.64 115.26 110.44 1mob n ASN 122 Ca 0.03 -1.33 -0.29 0.00 -0.03 0.00 0.00 54.58 52.96 1mob n ASN 122 Cb 0.51 0.32 -0.02 0.00 -0.61 0.00 0.00 39.78 39.97 1mob n ASN 122 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1mob n PHE 123 N 0.13 3.77 -1.65 3.10 7.35 0.18 -4.72 117.46 125.62 1mob n PHE 123 Ca 0.06 -3.64 -0.29 0.00 -0.76 0.00 0.00 57.45 52.83 1mob n PHE 123 Cb 0.30 -0.57 0.21 0.00 0.35 0.00 0.00 39.48 39.78 1mob n PHE 123 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1mob n GLY 124 N -0.26 -1.86 0.28 7.13 0.00 -1.26 -4.67 105.19 104.56 1mob n GLY 124 Ca 0.35 -1.65 -0.11 0.00 0.00 0.00 0.00 46.02 44.61 1mob n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mob h ALA 125 N -2.06 -0.34 -0.90 4.61 0.00 -1.97 0.63 119.26 119.23 1mob h ALA 125 Ca -0.41 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.60 1mob h ALA 125 Cb 1.16 0.43 -0.08 0.00 0.00 0.00 0.00 17.79 19.30 1mob h ALA 125 CO 0.28 -0.75 0.54 -0.44 0.00 0.00 0.00 179.25 178.88 1mob h ASP 126 N -0.39 0.77 -0.25 0.00 3.32 -1.99 -0.33 116.42 117.54 1mob h ASP 126 Ca 0.06 0.05 -0.12 0.00 0.02 0.00 0.00 57.03 57.04 1mob h ASP 126 Cb 0.47 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 1mob h ASP 126 CO -0.21 0.42 -0.28 0.00 -1.72 0.00 0.00 179.24 177.45 1mob h ALA 127 N 1.50 0.84 -0.05 3.45 0.00 -1.74 -1.86 119.26 121.40 1mob h ALA 127 Ca 0.44 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1mob h ALA 127 Cb 0.43 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1mob h ALA 127 CO -0.26 0.64 -0.32 0.37 0.00 0.00 0.00 179.25 179.68 1mob h GLN 128 N 0.64 0.09 -0.17 0.00 4.15 -0.67 -1.14 115.11 118.02 1mob h GLN 128 Ca 0.08 -0.03 -0.10 0.00 0.77 0.00 0.00 58.65 59.37 1mob h GLN 128 Cb 0.79 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 28.48 1mob h GLN 128 CO 0.07 0.41 -0.27 0.78 -1.93 0.00 0.00 178.83 177.89 1mob h GLY 129 N 1.03 0.53 1.61 2.39 0.00 -0.94 0.22 103.07 107.92 1mob h GLY 129 Ca 0.01 -0.60 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 1mob h GLY 129 CO 0.04 0.54 0.09 0.00 0.00 0.00 0.00 176.54 177.22 1mob h ALA 130 N 0.59 1.52 -0.07 3.60 0.00 -1.15 -1.25 119.26 122.51 1mob h ALA 130 Ca 0.02 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.58 1mob h ALA 130 Cb 0.85 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1mob h ALA 130 CO 0.06 0.36 -0.83 1.98 0.00 0.00 0.00 179.25 180.83 1mob h MET 131 N 0.49 0.53 -0.29 0.00 -1.53 -0.86 -0.23 114.93 113.05 1mob h MET 131 Ca 0.12 -0.48 -0.01 0.00 -3.44 0.00 0.00 59.70 55.89 1mob h MET 131 Cb 0.18 0.11 -0.01 0.00 -0.55 0.00 0.00 31.60 31.33 1mob h MET 131 CO -0.01 1.11 0.15 -0.97 0.14 0.00 0.00 176.91 177.33 1mob h ASN 132 N 0.34 0.37 -0.39 1.39 -1.24 -0.87 -0.02 115.58 115.15 1mob h ASN 132 Ca -0.06 -0.11 0.02 0.00 0.71 0.00 0.00 56.30 56.86 1mob h ASN 132 Cb 1.44 -0.09 -0.03 0.00 0.73 0.00 0.00 38.32 40.37 1mob h ASN 132 CO 0.15 0.37 0.22 0.50 -1.29 0.00 0.00 177.43 177.38 1mob h LYS 133 N 0.34 0.43 -0.70 6.67 3.64 -1.00 0.18 116.57 126.13 1mob h LYS 133 Ca 0.10 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 1mob h LYS 133 Cb 0.09 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 1mob h LYS 133 CO -0.01 0.28 0.32 0.00 -2.27 0.00 0.00 179.45 177.77 1mob h ALA 134 N 1.18 1.25 -0.00 5.00 0.00 -0.60 0.12 119.26 126.21 1mob h ALA 134 Ca 0.16 -0.15 -0.23 0.00 0.00 0.00 0.00 54.91 54.69 1mob h ALA 134 Cb 0.03 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.54 1mob h ALA 134 CO -0.09 0.57 -0.95 -0.07 0.00 0.00 0.00 179.25 178.71 1mob h LEU 135 N 0.99 0.60 -0.69 0.00 3.38 -0.83 -0.80 115.31 117.96 1mob h LEU 135 Ca 0.24 -0.48 -0.04 0.00 0.09 0.00 0.00 57.88 57.70 1mob h LEU 135 Cb 0.12 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1mob h LEU 135 CO -0.03 1.27 0.29 -0.33 0.09 0.00 0.00 178.44 179.74 1mob h GLU 136 N 0.26 1.02 -0.94 1.13 5.08 -0.38 -1.12 114.58 119.64 1mob h GLU 136 Ca -0.09 -0.18 0.03 0.00 -1.00 0.00 0.00 59.36 58.13 1mob h GLU 136 Cb 1.59 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 30.61 1mob h GLU 136 CO 0.17 0.84 0.62 1.25 -1.00 0.00 0.00 179.01 180.88 1mob h LEU 137 N 0.98 1.04 -0.02 1.33 5.85 -0.40 -1.12 115.31 122.96 1mob h LEU 137 Ca 0.23 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.96 1mob h LEU 137 Cb 0.19 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1mob h LEU 137 CO -0.02 0.72 -0.09 0.15 -0.34 0.00 0.00 178.44 178.86 1mob h PHE 138 N 1.21 -0.22 -0.73 1.25 3.57 -0.79 -2.50 116.94 118.72 1mob h PHE 138 Ca 0.37 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.86 1mob h PHE 138 Cb -0.04 0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.77 1mob h PHE 138 CO -0.01 -0.14 0.40 0.00 -2.23 0.00 0.00 178.31 176.33 1mob h ARG 139 N -0.14 1.02 -0.35 1.11 3.08 -1.03 -0.71 114.38 117.35 1mob h ARG 139 Ca 0.04 -0.11 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 1mob h ARG 139 Cb 0.20 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 1mob h ARG 139 CO -0.11 0.75 0.05 -0.22 -1.07 0.00 0.00 179.97 179.37 1mob h LYS 140 N 1.02 0.59 -0.05 0.04 3.64 -1.05 0.70 116.57 121.46 1mob h LYS 140 Ca 0.26 -0.16 -0.12 0.00 -1.27 0.00 0.00 60.65 59.36 1mob h LYS 140 Cb 0.03 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1mob h LYS 140 CO -0.04 0.67 -0.50 -0.44 -2.27 0.00 0.00 179.45 176.87 1mob h ASP 141 N 0.43 0.14 -0.10 4.20 5.19 -1.40 -0.47 116.42 124.42 1mob h ASP 141 Ca 0.11 -0.07 -0.21 0.00 -0.62 0.00 0.00 57.03 56.24 1mob h ASP 141 Cb 0.37 -0.04 0.01 0.00 0.18 0.00 0.00 39.33 39.86 1mob h ASP 141 CO 0.01 0.62 -0.76 0.40 -3.12 0.00 0.00 179.24 176.40 1mob h ILE 142 N 0.11 1.31 -0.76 0.35 1.08 -1.06 -1.65 117.51 116.88 1mob h ILE 142 Ca 0.00 -2.00 -0.02 0.00 -0.39 0.00 0.00 64.86 62.45 1mob h ILE 142 Cb 0.92 2.17 -0.04 0.00 -3.07 0.00 0.00 36.82 36.81 1mob h ILE 142 CO 0.07 0.62 0.41 0.00 -0.69 0.00 0.00 178.15 178.56 1mob h ALA 143 N 0.48 1.29 -0.08 1.87 0.00 0.14 0.23 119.26 123.18 1mob h ALA 143 Ca -0.07 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1mob h ALA 143 Cb 1.40 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1mob h ALA 143 CO 0.15 0.57 -0.42 0.00 0.00 0.00 0.00 179.25 179.56 1mob h ALA 144 N 1.39 1.14 -0.35 0.00 0.00 -0.81 -2.15 119.26 118.48 1mob h ALA 144 Ca 0.27 -0.41 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 1mob h ALA 144 Cb 0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1mob h ALA 144 CO -0.04 0.58 -0.40 0.87 0.00 0.00 0.00 179.25 180.26 1mob h LYS 145 N 0.15 0.86 -0.55 0.00 6.56 -0.63 -2.17 116.57 120.78 1mob h LYS 145 Ca 0.01 -0.45 0.08 0.00 -1.06 0.00 0.00 60.65 59.23 1mob h LYS 145 Cb 0.81 0.02 -0.06 0.00 -0.57 0.00 0.00 32.23 32.43 1mob h LYS 145 CO 0.06 1.10 0.21 1.88 -2.06 0.00 0.00 179.45 180.64 1mob h TYR 146 N 0.70 0.36 -0.69 -1.35 -1.99 -0.53 -1.20 116.97 112.26 1mob h TYR 146 Ca 0.05 0.03 0.06 0.00 2.00 0.00 0.00 58.73 60.87 1mob h TYR 146 Cb 0.98 -0.08 -0.05 0.00 2.00 0.00 0.00 36.73 39.58 1mob h TYR 146 CO 0.06 0.11 0.40 -0.22 -0.00 0.00 0.00 178.16 178.51 1mob h LYS 147 N 0.39 0.72 0.00 4.88 3.64 -0.80 -0.87 116.57 124.53 1mob h LYS 147 Ca 0.27 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.57 1mob h LYS 147 Cb 0.31 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 1mob h LYS 147 CO -0.27 0.47 -0.19 0.93 -2.27 0.00 0.00 179.45 178.12 1mob h GLU 148 N 0.74 0.00 0.00 1.90 5.08 -0.84 -2.42 114.58 119.04 1mob h GLU 148 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1mob h GLU 148 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1mob h GLU 148 CO -0.17 0.19 -0.53 1.28 -1.00 0.00 0.00 179.01 178.78 1mob n LEU 149 N -4.21 0.60 0.00 1.33 4.77 -0.53 -4.92 117.00 114.04 1mob n LEU 149 Ca -0.02 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1mob n LEU 149 Cb 0.26 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1mob n LEU 149 CO 0.36 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1mob n GLY 150 N 1.39 1.26 3.72 -0.72 0.00 -0.70 -5.02 105.19 105.12 1mob n GLY 150 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1mob n GLY 150 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1mob s TYR 151 N -2.00 3.02 0.00 1.61 5.04 -0.43 -5.00 117.35 119.59 1mob s TYR 151 Ca 0.00 -0.03 0.00 0.00 -2.44 0.00 0.00 57.07 54.60 1mob s TYR 151 Cb 0.00 -1.51 0.00 0.00 0.35 0.00 0.00 41.96 40.80 1mob s TYR 151 CO 0.00 0.50 0.00 1.04 -1.34 0.00 0.00 175.55 175.75 1mob n GLN 152 N 0.24 0.00 0.00 4.97 6.02 -1.26 -3.82 117.38 123.52 1mob n GLN 152 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.89 1mob n GLN 152 Cb 0.53 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.79 1mob n GLN 152 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46