#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m39 s LEU 2 N 0.00 4.40 0.87 6.55 1.02 -1.26 -5.08 118.68 125.18 3m39 s LEU 2 Ca 0.00 1.25 -0.12 0.00 0.02 0.00 0.00 54.13 55.27 3m39 s LEU 2 Cb 0.00 -3.27 0.11 0.00 0.02 0.00 0.00 46.19 43.05 3m39 s LEU 2 CO 0.00 0.13 1.14 -0.94 0.02 0.00 0.00 176.35 176.70 3m39 s SER 3 N -1.53 3.89 0.20 2.29 1.04 -1.26 -4.85 113.70 113.49 3m39 s SER 3 Ca 0.37 0.98 -0.10 0.00 0.48 0.00 0.00 55.95 57.68 3m39 s SER 3 Cb -0.17 -1.57 0.23 0.00 0.10 0.00 0.00 66.02 64.62 3m39 s SER 3 CO 0.20 -2.31 1.78 -0.08 0.98 0.00 0.00 173.24 173.81 3m39 h GLU 4 N -1.33 0.54 -0.59 4.02 4.57 -1.99 -1.73 114.58 118.07 3m39 h GLU 4 Ca -0.49 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 57.65 3m39 h GLU 4 Cb 1.32 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 29.76 3m39 h GLU 4 CO 0.62 0.36 0.33 0.78 -1.18 0.00 0.00 179.01 179.92 3m39 h GLY 5 N 0.56 0.86 1.19 1.92 0.00 -1.99 0.29 103.07 105.91 3m39 h GLY 5 Ca 0.29 -0.37 -0.20 0.00 0.00 0.00 0.00 47.33 47.05 3m39 h GLY 5 CO -0.22 0.35 -0.65 0.83 0.00 0.00 0.00 176.54 176.86 3m39 h GLU 6 N 0.82 0.82 -0.57 4.80 5.08 -1.72 -1.17 114.58 122.64 3m39 h GLU 6 Ca 0.21 -0.58 -0.02 0.00 -1.00 0.00 0.00 59.36 57.96 3m39 h GLU 6 Cb 0.01 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 3m39 h GLU 6 CO -0.04 1.21 0.25 -1.49 -1.00 0.00 0.00 179.01 177.94 3m39 h TRP 7 N 0.60 0.80 -0.15 4.33 4.06 -0.95 -1.77 115.95 122.87 3m39 h TRP 7 Ca -0.01 -0.03 -0.10 0.00 2.06 0.00 0.00 58.89 60.81 3m39 h TRP 7 Cb 1.26 -0.25 -0.01 0.00 -1.00 0.00 0.00 29.16 29.16 3m39 h TRP 7 CO 0.08 0.60 -0.35 1.96 -3.56 0.00 0.00 178.44 177.17 3m39 h GLN 8 N 0.80 0.30 -0.38 0.49 4.20 -0.47 -0.96 115.11 119.09 3m39 h GLN 8 Ca 0.20 -0.13 -0.10 0.00 0.06 0.00 0.00 58.65 58.68 3m39 h GLN 8 Cb 0.12 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 3m39 h GLN 8 CO -0.02 0.62 -0.18 -0.07 -0.67 0.00 0.00 178.83 178.50 3m39 h LEU 9 N 0.26 0.71 -0.23 1.46 3.38 -0.65 -0.06 115.31 120.18 3m39 h LEU 9 Ca 0.03 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 3m39 h LEU 9 Cb 0.74 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3m39 h LEU 9 CO 0.06 0.89 0.02 0.58 0.09 0.00 0.00 178.44 180.08 3m39 h VAL 10 N 0.64 1.24 0.00 1.22 2.07 -1.04 -2.43 116.25 117.95 3m39 h VAL 10 Ca 0.10 -0.82 -0.11 0.00 0.82 0.00 0.00 66.70 66.68 3m39 h VAL 10 Cb 0.65 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 3m39 h VAL 10 CO 0.05 0.26 -0.54 -0.07 0.02 0.00 0.00 177.57 177.28 3m39 h LEU 11 N 0.18 0.00 -0.53 2.57 3.38 -1.06 -0.90 115.31 118.95 3m39 h LEU 11 Ca 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 3m39 h LEU 11 Cb 0.36 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3m39 h LEU 11 CO 0.01 0.54 0.20 -0.74 0.09 0.00 0.00 178.44 178.54 3m39 h HIS 12 N 0.00 0.81 0.00 1.13 2.76 -0.92 -1.26 115.15 117.67 3m39 h HIS 12 Ca -0.01 -0.07 -0.09 0.00 -2.20 0.00 0.00 60.37 58.01 3m39 h HIS 12 Cb 1.05 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 29.76 3m39 h HIS 12 CO 0.00 0.67 -0.41 -0.39 -1.30 0.00 0.00 177.93 176.50 3m39 h VAL 13 N 0.71 0.78 -0.12 5.26 -1.51 -1.26 -2.81 116.25 117.30 3m39 h VAL 13 Ca 0.17 -1.83 -0.07 0.00 -1.23 0.00 0.00 66.70 63.74 3m39 h VAL 13 Cb 0.21 2.18 -0.01 0.00 -2.13 0.00 0.00 31.29 31.55 3m39 h VAL 13 CO -0.01 0.40 -0.26 -0.25 -1.23 0.00 0.00 177.57 176.22 3m39 h TRP 14 N 0.00 0.24 -0.02 5.19 2.91 -0.86 -1.14 115.95 122.28 3m39 h TRP 14 Ca -0.00 -0.04 -0.04 0.00 1.13 0.00 0.00 58.89 59.93 3m39 h TRP 14 Cb 1.15 -0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 29.73 3m39 h TRP 14 CO 0.00 0.47 -0.17 0.00 -1.03 0.00 0.00 178.44 177.71 3m39 h ALA 15 N 1.54 1.69 -0.06 2.65 0.00 -0.96 -0.96 119.26 123.15 3m39 h ALA 15 Ca 0.03 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.62 3m39 h ALA 15 Cb 0.57 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3m39 h ALA 15 CO 0.04 0.24 -0.65 0.87 0.00 0.00 0.00 179.25 179.75 3m39 h LYS 16 N 0.03 0.23 -0.45 0.00 1.79 -1.24 -2.86 116.57 114.06 3m39 h LYS 16 Ca 0.00 -0.17 -0.06 0.00 -2.18 0.00 0.00 60.65 58.25 3m39 h LYS 16 Cb 0.32 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.98 3m39 h LYS 16 CO 0.02 0.79 0.04 0.28 -1.08 0.00 0.00 179.45 179.51 3m39 h VAL 17 N 0.16 1.22 0.00 0.50 2.07 -0.42 -2.81 116.25 116.97 3m39 h VAL 17 Ca -0.01 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.64 3m39 h VAL 17 Cb 1.17 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 3m39 h VAL 17 CO 0.10 0.31 0.00 -0.62 0.02 0.00 0.00 177.57 177.38 3m39 n GLU 18 N -4.26 0.22 0.17 1.57 1.02 -0.69 -1.45 120.64 117.22 3m39 n GLU 18 Ca 0.03 0.09 0.04 0.00 -0.02 0.00 0.00 57.16 57.29 3m39 n GLU 18 Cb 0.26 -1.50 0.27 0.00 -0.02 0.00 0.00 31.44 30.44 3m39 n GLU 18 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3m39 h ALA 19 N 2.98 0.94 -0.94 0.62 0.00 -1.45 -3.38 119.26 118.04 3m39 h ALA 19 Ca 0.00 -0.41 -0.38 0.00 0.00 0.00 0.00 54.91 54.13 3m39 h ALA 19 Cb 0.27 -0.07 -0.26 0.00 0.00 0.00 0.00 17.79 17.73 3m39 h ALA 19 CO 0.00 0.56 -0.78 -3.47 0.00 0.00 0.00 179.25 175.56 3m39 n ASP 20 N -3.55 -1.39 -0.29 0.00 4.64 -0.53 -5.00 116.55 110.45 3m39 n ASP 20 Ca -0.00 -3.07 -0.04 0.00 -1.38 0.00 0.00 54.79 50.30 3m39 n ASP 20 Cb 0.56 0.68 0.07 0.00 -1.04 0.00 0.00 41.12 41.39 3m39 n ASP 20 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 3m39 h VAL 21 N 2.47 1.21 -0.42 5.18 2.07 -1.63 -1.40 116.25 123.73 3m39 h VAL 21 Ca -0.04 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.06 3m39 h VAL 21 Cb 0.97 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 3m39 h VAL 21 CO 0.38 0.21 0.26 0.00 0.02 0.00 0.00 177.57 178.43 3m39 h ALA 22 N 1.27 0.54 -0.60 1.67 0.00 -1.90 -0.11 119.26 120.13 3m39 h ALA 22 Ca 0.29 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 3m39 h ALA 22 Cb -0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3m39 h ALA 22 CO -0.06 0.03 -0.01 0.78 0.00 0.00 0.00 179.25 179.99 3m39 h GLY 23 N 0.56 1.15 0.99 0.00 0.00 -1.88 -1.57 103.07 102.33 3m39 h GLY 23 Ca 0.15 -0.86 -0.00 0.00 0.00 0.00 0.00 47.33 46.62 3m39 h GLY 23 CO -0.03 0.79 0.33 0.45 0.00 0.00 0.00 176.54 178.08 3m39 h HIS 24 N 0.96 0.71 -0.68 5.60 3.86 -0.92 -0.71 115.15 123.97 3m39 h HIS 24 Ca 0.17 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.35 3m39 h HIS 24 Cb 0.58 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.78 3m39 h HIS 24 CO 0.04 0.48 0.34 0.78 0.86 0.00 0.00 177.93 180.43 3m39 h GLY 25 N 0.72 1.05 0.80 2.45 0.00 -0.60 0.59 103.07 108.09 3m39 h GLY 25 Ca 0.19 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 47.02 3m39 h GLY 25 CO -0.04 0.49 -0.16 1.46 0.00 0.00 0.00 176.54 178.29 3m39 h GLN 26 N 0.95 -0.34 -0.46 4.80 4.20 -1.14 -1.75 115.11 121.38 3m39 h GLN 26 Ca 0.24 0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.94 3m39 h GLN 26 Cb 0.11 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 3m39 h GLN 26 CO -0.03 -0.22 0.18 -0.44 -0.67 0.00 0.00 178.83 177.64 3m39 h ASP 27 N -0.35 0.59 -0.32 1.46 3.45 -0.63 -0.75 116.42 119.88 3m39 h ASP 27 Ca 0.00 -0.07 -0.12 0.00 0.43 0.00 0.00 57.03 57.28 3m39 h ASP 27 Cb 0.33 -0.15 -0.01 0.00 -0.56 0.00 0.00 39.33 38.95 3m39 h ASP 27 CO -0.04 0.54 -0.26 0.40 -1.57 0.00 0.00 179.24 178.31 3m39 h ILE 28 N 0.65 1.29 -0.43 0.35 2.04 -0.71 -1.96 117.51 118.75 3m39 h ILE 28 Ca 0.16 -1.41 -0.09 0.00 1.00 0.00 0.00 64.86 64.52 3m39 h ILE 28 Cb 0.14 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.69 3m39 h ILE 28 CO -0.02 0.46 -0.07 0.45 0.00 0.00 0.00 178.15 178.97 3m39 h HIS 29 N 0.51 0.89 -0.70 1.37 3.86 -1.01 0.60 115.15 120.66 3m39 h HIS 29 Ca 0.06 -0.18 -0.02 0.00 -1.16 0.00 0.00 60.37 59.07 3m39 h HIS 29 Cb 0.82 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 29.04 3m39 h HIS 29 CO 0.07 0.90 0.38 0.82 0.86 0.00 0.00 177.93 180.95 3m39 h ILE 30 N 0.63 1.22 -0.02 2.45 2.04 -1.09 0.64 117.51 123.38 3m39 h ILE 30 Ca 0.11 -0.57 -0.00 0.00 1.00 0.00 0.00 64.86 65.40 3m39 h ILE 30 Cb 0.59 0.31 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 3m39 h ILE 30 CO 0.04 0.25 0.01 -0.09 0.00 0.00 0.00 178.15 178.35 3m39 h ARG 31 N 0.97 0.03 -0.66 2.37 9.65 -1.23 0.08 114.38 125.59 3m39 h ARG 31 Ca 0.25 -0.01 0.04 0.00 -1.10 0.00 0.00 59.98 59.16 3m39 h ARG 31 Cb 0.06 -0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 28.58 3m39 h ARG 31 CO -0.04 0.24 0.39 1.25 2.80 0.00 0.00 179.97 184.61 3m39 h LEU 32 N -0.18 0.62 -0.62 3.80 5.85 -0.63 -0.41 115.31 123.75 3m39 h LEU 32 Ca 0.01 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.67 3m39 h LEU 32 Cb 0.22 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 3m39 h LEU 32 CO -0.00 0.42 -0.32 -0.26 -0.34 0.00 0.00 178.44 177.94 3m39 h PHE 33 N 0.75 0.00 0.21 1.25 0.04 0.46 -0.80 116.94 118.85 3m39 h PHE 33 Ca 0.28 0.00 -0.32 0.00 2.80 0.00 0.00 57.97 60.73 3m39 h PHE 33 Cb 0.09 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.26 3m39 h PHE 33 CO -0.06 0.32 -1.49 0.87 -0.60 0.00 0.00 178.31 177.35 3m39 h LYS 34 N 0.00 0.45 -0.15 1.51 1.57 -0.79 -3.31 116.57 115.85 3m39 h LYS 34 Ca -0.00 -0.76 -0.15 0.00 -1.87 0.00 0.00 60.65 57.86 3m39 h LYS 34 Cb 1.01 0.28 -0.01 0.00 0.08 0.00 0.00 32.23 33.59 3m39 h LYS 34 CO 0.04 1.36 -0.56 0.77 -0.57 0.00 0.00 179.45 180.50 3m39 h SER 35 N 0.04 0.51 -2.34 0.86 0.02 -1.00 -3.39 113.55 108.24 3m39 h SER 35 Ca -0.28 -0.28 -0.57 0.00 -0.84 0.00 0.00 61.79 59.82 3m39 h SER 35 Cb 2.06 -0.15 -0.37 0.00 0.14 0.00 0.00 62.40 64.08 3m39 h SER 35 CO 0.21 0.97 -0.95 -1.00 -1.14 0.00 0.00 176.83 174.92 3m39 s HIS 36 N -3.94 0.94 0.57 3.45 3.76 -0.31 -4.98 115.29 114.78 3m39 s HIS 36 Ca -0.06 -2.18 0.30 0.00 -0.15 0.00 0.00 55.06 52.97 3m39 s HIS 36 Cb 0.12 -0.87 1.82 0.00 1.11 0.00 0.00 32.58 34.76 3m39 s HIS 36 CO 0.83 -0.84 2.24 -1.35 -0.85 0.00 0.00 174.74 174.76 3m39 h PRO 37 N 5.79 0.00 -0.56 8.40 0.11 -1.77 0.17 132.00 144.14 3m39 h PRO 37 Ca 0.24 0.00 0.12 0.00 0.11 0.00 0.00 66.00 66.46 3m39 h PRO 37 Cb 0.92 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.00 3m39 h PRO 37 CO 0.34 0.02 0.38 1.05 -0.21 0.00 0.00 178.00 179.58 3m39 h GLU 38 N 0.00 0.24 0.00 1.05 4.11 -1.93 -2.26 114.58 115.79 3m39 h GLU 38 Ca -0.00 -0.01 -0.05 0.00 0.07 0.00 0.00 59.36 59.36 3m39 h GLU 38 Cb 0.04 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3m39 h GLU 38 CO 0.00 0.16 -0.25 0.00 0.07 0.00 0.00 179.01 179.00 3m39 h THR 39 N 0.25 0.58 0.00 -1.06 1.03 -0.99 -2.47 112.91 110.26 3m39 h THR 39 Ca 0.26 -1.22 -0.00 0.00 -0.01 0.00 0.00 66.41 65.44 3m39 h THR 39 Cb 0.69 1.83 -0.00 0.00 -1.07 0.00 0.00 68.15 69.60 3m39 h THR 39 CO -0.05 0.24 -0.01 0.25 -0.01 0.00 0.00 175.52 175.93 3m39 h LEU 40 N 0.00 0.00 -0.69 0.00 5.85 -1.52 -3.15 115.31 115.80 3m39 h LEU 40 Ca -0.00 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 3m39 h LEU 40 Cb 0.81 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 3m39 h LEU 40 CO 0.03 0.01 -0.16 -0.33 -0.34 0.00 0.00 178.44 177.65 3m39 h GLU 41 N 0.00 0.84 -0.68 1.25 5.08 -1.45 -2.80 114.58 116.81 3m39 h GLU 41 Ca -0.00 -0.32 0.01 0.00 -1.00 0.00 0.00 59.36 58.06 3m39 h GLU 41 Cb 0.89 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.05 3m39 h GLU 41 CO 0.00 0.95 0.45 0.87 -1.00 0.00 0.00 179.01 180.28 3m39 h LYS 42 N 0.75 0.87 -2.93 2.33 1.79 -1.59 -1.89 116.57 115.89 3m39 h LYS 42 Ca 0.11 -0.05 -0.71 0.00 -2.18 0.00 0.00 60.65 57.82 3m39 h LYS 42 Cb 0.68 -0.20 -0.06 0.00 -1.58 0.00 0.00 32.23 31.08 3m39 h LYS 42 CO 0.05 0.57 3.04 0.72 -1.08 0.00 0.00 179.45 182.76 3m39 n HIS 43 N -4.44 2.61 0.06 -1.35 8.25 -1.06 -4.76 115.22 114.53 3m39 n HIS 43 Ca 0.08 -2.95 0.21 0.00 -0.26 0.00 0.00 57.72 54.80 3m39 n HIS 43 Cb 0.06 -2.17 0.73 0.00 1.12 0.00 0.00 29.99 29.73 3m39 n HIS 43 CO 0.00 0.00 0.00 0.22 0.64 0.00 0.00 176.34 177.20 3m39 h ASP 44 N 4.94 0.00 0.56 0.41 3.58 -1.46 0.24 116.42 124.68 3m39 h ASP 44 Ca 0.75 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.20 3m39 h ASP 44 Cb 0.34 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.39 3m39 h ASP 44 CO 1.65 0.00 -0.04 -2.11 -2.88 0.00 0.00 179.24 175.85 3m39 n ARG 45 N -3.71 0.44 0.00 0.28 1.85 -1.26 -3.03 116.66 111.23 3m39 n ARG 45 Ca 0.09 -0.06 0.00 0.00 -1.00 0.00 0.00 57.85 56.88 3m39 n ARG 45 Cb 0.70 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.61 3m39 n ARG 45 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3m39 n PHE 46 N -1.23 0.00 0.21 2.89 3.72 0.04 -4.82 117.46 118.26 3m39 n PHE 46 Ca 0.13 -0.23 0.18 0.00 -0.05 0.00 0.00 57.45 57.49 3m39 n PHE 46 Cb 0.26 -0.02 0.81 0.00 -0.94 0.00 0.00 39.48 39.59 3m39 n PHE 46 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 3m39 h LYS 47 N 0.00 0.00 -0.01 -1.08 3.64 -1.37 -0.60 116.57 117.15 3m39 h LYS 47 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3m39 h LYS 47 Cb 0.37 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 3m39 h LYS 47 CO 0.00 0.00 -0.46 -2.39 -2.27 0.00 0.00 179.45 174.33 3m39 n HIS 48 N -3.41 0.00 -2.40 1.91 1.44 -1.26 -4.89 115.22 106.60 3m39 n HIS 48 Ca 0.02 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.31 3m39 n HIS 48 Cb 0.45 -0.03 -0.03 0.00 0.12 0.00 0.00 29.99 30.50 3m39 n HIS 48 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3m39 s LEU 49 N -2.52 4.31 -0.19 2.39 2.01 -0.23 -4.90 118.68 119.54 3m39 s LEU 49 Ca 0.19 1.92 0.17 0.00 0.01 0.00 0.00 54.13 56.42 3m39 s LEU 49 Cb 0.18 -3.56 -0.24 0.00 0.01 0.00 0.00 46.19 42.58 3m39 s LEU 49 CO 0.58 -0.58 0.07 0.29 1.01 0.00 0.00 176.35 177.71 3m39 n LYS 50 N 4.94 0.82 -4.39 1.70 4.76 -1.26 -4.97 118.16 119.75 3m39 n LYS 50 Ca 0.11 -0.01 -0.20 0.00 -2.87 0.00 0.00 58.31 55.34 3m39 n LYS 50 Cb 0.46 -1.50 -0.10 0.00 -1.84 0.00 0.00 35.03 32.05 3m39 n LYS 50 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 3m39 s THR 51 N -2.47 1.66 0.23 -0.18 -1.32 -1.26 -5.03 115.64 107.27 3m39 s THR 51 Ca -0.10 -2.16 -0.08 0.00 -1.21 0.00 0.00 61.69 58.14 3m39 s THR 51 Cb 0.06 -2.27 0.21 0.00 -1.51 0.00 0.00 72.50 68.99 3m39 s THR 51 CO 0.80 -0.43 1.90 -0.08 -2.21 0.00 0.00 174.62 174.60 3m39 h GLU 52 N 2.41 1.18 -0.75 7.08 4.81 -1.98 -1.48 114.58 125.85 3m39 h GLU 52 Ca -0.39 -0.08 -0.02 0.00 -0.13 0.00 0.00 59.36 58.74 3m39 h GLU 52 Cb 1.23 -0.26 -0.03 0.00 0.63 0.00 0.00 28.75 30.31 3m39 h GLU 52 CO 0.65 0.79 0.39 0.00 -0.73 0.00 0.00 179.01 180.10 3m39 h ALA 53 N 1.32 0.96 -0.48 2.92 0.00 -1.99 0.16 119.26 122.15 3m39 h ALA 53 Ca 0.33 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 3m39 h ALA 53 Cb -0.13 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.34 3m39 h ALA 53 CO -0.07 0.50 -0.01 0.93 0.00 0.00 0.00 179.25 180.60 3m39 h GLU 54 N 1.04 0.81 -0.20 0.00 5.08 -1.85 -0.86 114.58 118.60 3m39 h GLU 54 Ca 0.26 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3m39 h GLU 54 Cb 0.07 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3m39 h GLU 54 CO -0.04 0.82 0.11 0.52 -1.00 0.00 0.00 179.01 179.42 3m39 h MET 55 N 0.75 0.28 -0.21 2.33 2.86 -0.82 -2.39 114.93 117.73 3m39 h MET 55 Ca 0.14 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.72 3m39 h MET 55 Cb 0.47 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 3m39 h MET 55 CO 0.02 0.27 -0.02 0.87 1.06 0.00 0.00 176.91 179.11 3m39 h LYS 56 N 0.22 0.31 -0.00 1.72 1.57 -0.39 -2.90 116.57 117.10 3m39 h LYS 56 Ca 0.07 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3m39 h LYS 56 Cb 0.07 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.33 3m39 h LYS 56 CO -0.01 0.36 -0.07 0.00 -0.57 0.00 0.00 179.45 179.16 3m39 n ALA 57 N -2.49 2.64 -2.56 3.86 0.00 -0.35 -4.72 120.51 116.89 3m39 n ALA 57 Ca 0.00 -0.21 -0.42 0.00 0.00 0.00 0.00 53.44 52.81 3m39 n ALA 57 Cb 0.20 -1.41 -0.02 0.00 0.00 0.00 0.00 19.45 18.22 3m39 n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3m39 s SER 58 N -2.54 6.39 0.49 0.00 0.15 -0.94 -4.88 113.70 112.37 3m39 s SER 58 Ca 0.28 0.08 0.24 0.00 0.70 0.00 0.00 55.95 57.26 3m39 s SER 58 Cb 0.20 -2.55 1.27 0.00 -1.71 0.00 0.00 66.02 63.23 3m39 s SER 58 CO 0.47 -1.54 2.01 -0.08 1.20 0.00 0.00 173.24 175.31 3m39 h GLU 59 N 9.75 0.00 -0.31 5.44 4.57 -1.89 -1.65 114.58 130.49 3m39 h GLU 59 Ca -0.25 0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 57.77 3m39 h GLU 59 Cb 1.06 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.64 3m39 h GLU 59 CO 1.19 0.17 -0.44 0.22 -1.18 0.00 0.00 179.01 178.96 3m39 h ASP 60 N 0.00 0.87 0.15 1.04 -0.00 -1.96 -0.49 116.42 116.04 3m39 h ASP 60 Ca -0.00 -0.42 -0.18 0.00 -0.00 0.00 0.00 57.03 56.43 3m39 h ASP 60 Cb 0.42 -0.25 -0.00 0.00 -0.00 0.00 0.00 39.33 39.50 3m39 h ASP 60 CO 0.02 1.18 -0.67 0.25 -0.00 0.00 0.00 179.24 180.02 3m39 h LEU 61 N 0.64 0.56 -0.36 2.28 7.12 -1.82 -1.39 115.31 122.35 3m39 h LEU 61 Ca 0.04 -0.34 0.00 0.00 0.13 0.00 0.00 57.88 57.71 3m39 h LEU 61 Cb 1.02 -0.16 -0.02 0.00 -0.53 0.00 0.00 40.66 40.97 3m39 h LEU 61 CO 0.10 1.07 0.23 0.50 -0.13 0.00 0.00 178.44 180.21 3m39 h LYS 62 N 0.34 0.49 -0.41 1.25 3.64 -1.03 -1.11 116.57 119.74 3m39 h LYS 62 Ca -0.02 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.24 3m39 h LYS 62 Cb 1.24 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.94 3m39 h LYS 62 CO 0.12 0.35 -0.06 1.57 -2.27 0.00 0.00 179.45 179.16 3m39 h LYS 63 N 0.48 0.76 -0.66 1.90 2.10 -0.95 -2.46 116.57 117.75 3m39 h LYS 63 Ca 0.13 -0.27 0.13 0.00 -2.00 0.00 0.00 60.65 58.63 3m39 h LYS 63 Cb -0.02 -0.05 -0.09 0.00 -0.90 0.00 0.00 32.23 31.17 3m39 h LYS 63 CO -0.03 0.87 0.18 1.25 -2.00 0.00 0.00 179.45 179.72 3m39 h HIS 64 N 0.58 0.29 -0.20 0.07 2.76 -1.04 -0.90 115.15 116.71 3m39 h HIS 64 Ca 0.11 0.04 -0.07 0.00 -2.20 0.00 0.00 60.37 58.24 3m39 h HIS 64 Cb 0.57 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.49 3m39 h HIS 64 CO 0.05 -0.01 -0.20 0.78 -1.30 0.00 0.00 177.93 177.24 3m39 h GLY 65 N 0.31 0.38 1.19 5.26 0.00 -0.98 -1.33 103.07 107.89 3m39 h GLY 65 Ca 0.35 -0.27 -0.15 0.00 0.00 0.00 0.00 47.33 47.26 3m39 h GLY 65 CO -0.42 0.25 -0.33 -2.08 0.00 0.00 0.00 176.54 173.96 3m39 h VAL 66 N 0.32 1.27 -0.37 4.60 2.07 -0.87 -0.04 116.25 123.24 3m39 h VAL 66 Ca 0.06 -1.50 -0.00 0.00 0.82 0.00 0.00 66.70 66.07 3m39 h VAL 66 Cb 0.54 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 3m39 h VAL 66 CO 0.04 0.50 0.23 0.74 0.02 0.00 0.00 177.57 179.10 3m39 h THR 67 N 0.75 1.12 -0.32 2.57 2.02 -0.68 0.93 112.91 119.30 3m39 h THR 67 Ca 0.07 -0.26 -0.04 0.00 0.77 0.00 0.00 66.41 66.95 3m39 h THR 67 Cb 0.91 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 3m39 h THR 67 CO 0.08 0.12 0.03 -0.33 0.37 0.00 0.00 175.52 175.79 3m39 h GLU 68 N 0.48 0.53 -0.21 6.66 5.08 -1.15 -2.53 114.58 123.45 3m39 h GLU 68 Ca 0.13 -0.15 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 3m39 h GLU 68 Cb -0.01 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3m39 h GLU 68 CO -0.03 0.64 -0.33 -0.07 -1.00 0.00 0.00 179.01 178.23 3m39 h LEU 69 N 0.35 0.44 -0.72 1.33 4.07 -0.79 0.27 115.31 120.26 3m39 h LEU 69 Ca 0.09 -0.17 -0.02 0.00 0.08 0.00 0.00 57.88 57.86 3m39 h LEU 69 Cb 0.38 -0.12 -0.03 0.00 1.08 0.00 0.00 40.66 41.97 3m39 h LEU 69 CO 0.01 0.74 0.36 0.74 -1.08 0.00 0.00 178.44 179.21 3m39 h THR 70 N 0.37 1.23 -0.46 0.22 2.02 -0.81 0.04 112.91 115.53 3m39 h THR 70 Ca 0.04 -0.64 -0.08 0.00 0.77 0.00 0.00 66.41 66.50 3m39 h THR 70 Cb 0.76 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 3m39 h THR 70 CO 0.06 0.27 -0.04 0.00 0.37 0.00 0.00 175.52 176.18 3m39 h ALA 71 N 1.17 0.62 -0.64 6.16 0.00 -1.00 -1.88 119.26 123.69 3m39 h ALA 71 Ca 0.25 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 3m39 h ALA 71 Cb 0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3m39 h ALA 71 CO -0.03 0.46 0.06 1.25 0.00 0.00 0.00 179.25 180.98 3m39 h LEU 72 N 0.68 1.06 -0.83 0.00 5.85 -0.70 -2.26 115.31 119.11 3m39 h LEU 72 Ca 0.12 -0.28 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 3m39 h LEU 72 Cb 0.56 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 3m39 h LEU 72 CO 0.03 1.08 0.38 1.23 -0.34 0.00 0.00 178.44 180.82 3m39 h GLY 73 N 1.00 1.30 1.86 3.75 0.00 -0.90 0.17 103.07 110.25 3m39 h GLY 73 Ca 0.19 -0.66 -0.05 0.00 0.00 0.00 0.00 47.33 46.81 3m39 h GLY 73 CO 0.02 0.63 -0.16 0.00 0.00 0.00 0.00 176.54 177.03 3m39 h ALA 74 N 1.21 1.54 -0.17 3.60 0.00 -1.16 -1.19 119.26 123.09 3m39 h ALA 74 Ca 0.28 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3m39 h ALA 74 Cb 0.15 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3m39 h ALA 74 CO -0.03 0.33 -0.16 0.82 0.00 0.00 0.00 179.25 180.21 3m39 h ILE 75 N 0.16 1.34 -0.56 0.00 2.04 -0.67 -3.19 117.51 116.63 3m39 h ILE 75 Ca 0.03 -1.32 -0.01 0.00 1.00 0.00 0.00 64.86 64.56 3m39 h ILE 75 Cb 0.39 1.81 -0.03 0.00 -0.74 0.00 0.00 36.82 38.25 3m39 h ILE 75 CO 0.02 0.39 0.29 -0.07 0.00 0.00 0.00 178.15 178.79 3m39 h LEU 76 N 0.06 0.68 -0.76 1.44 3.38 -0.18 -1.53 115.31 118.41 3m39 h LEU 76 Ca 0.03 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3m39 h LEU 76 Cb 0.70 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3m39 h LEU 76 CO 0.04 0.57 0.00 0.29 0.09 0.00 0.00 178.44 179.43 3m39 n LYS 77 N -4.39 0.18 0.00 1.13 5.02 -0.50 -1.16 118.16 118.45 3m39 n LYS 77 Ca 0.05 0.44 0.14 0.00 -2.02 0.00 0.00 58.31 56.93 3m39 n LYS 77 Cb 0.11 -1.87 0.67 0.00 -0.02 0.00 0.00 35.03 33.92 3m39 n LYS 77 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3m39 n LYS 78 N -2.22 0.82 -3.96 1.97 5.02 -0.58 -4.94 118.16 114.27 3m39 n LYS 78 Ca 0.02 -0.25 -0.35 0.00 -2.02 0.00 0.00 58.31 55.70 3m39 n LYS 78 Cb 0.21 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.73 3m39 n LYS 78 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3m39 n LYS 79 N -0.87 -1.30 0.00 1.97 5.02 -0.31 -1.57 118.16 121.10 3m39 n LYS 79 Ca 0.17 0.26 0.00 0.00 -2.02 0.00 0.00 58.31 56.72 3m39 n LYS 79 Cb 0.25 -3.60 0.00 0.00 -0.02 0.00 0.00 35.03 31.67 3m39 n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3m39 n GLY 80 N -2.01 3.06 2.62 0.72 0.00 -1.26 -4.92 105.19 103.39 3m39 n GLY 80 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 3m39 n GLY 80 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3m39 n HIS 81 N -0.97 2.75 -1.10 1.61 -0.00 -0.61 -4.66 115.22 112.25 3m39 n HIS 81 Ca 0.00 -2.85 0.09 0.00 -0.00 0.00 0.00 57.72 54.96 3m39 n HIS 81 Cb 0.00 -1.99 0.19 0.00 -0.00 0.00 0.00 29.99 28.18 3m39 n HIS 81 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 3m39 n HIS 82 N 2.99 0.37 -0.35 1.57 1.44 -1.26 -4.74 115.22 115.23 3m39 n HIS 82 Ca 0.55 -1.02 -0.02 0.00 -2.01 0.00 0.00 57.72 55.22 3m39 n HIS 82 Cb 0.30 -0.23 0.10 0.00 0.12 0.00 0.00 29.99 30.28 3m39 n HIS 82 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 3m39 h GLU 83 N 0.71 1.23 0.00 -1.40 4.81 -2.00 -2.10 114.58 115.83 3m39 h GLU 83 Ca 0.01 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.14 3m39 h GLU 83 Cb 1.18 -0.28 -0.00 0.00 0.63 0.00 0.00 28.75 30.28 3m39 h GLU 83 CO 0.09 0.82 -0.13 0.00 -0.73 0.00 0.00 179.01 179.06 3m39 h ALA 84 N 1.35 1.77 -0.02 2.92 0.00 -2.00 -1.98 119.26 121.30 3m39 h ALA 84 Ca 0.35 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3m39 h ALA 84 Cb -0.13 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.64 3m39 h ALA 84 CO -0.08 0.17 0.00 0.39 0.00 0.00 0.00 179.25 179.72 3m39 n GLU 85 N -4.37 1.34 0.07 0.00 -0.58 -0.88 -4.10 120.64 112.13 3m39 n GLU 85 Ca -0.03 -1.51 -0.10 0.00 -0.42 0.00 0.00 57.16 55.11 3m39 n GLU 85 Cb 0.20 -1.32 -0.01 0.00 -0.57 0.00 0.00 31.44 29.74 3m39 n GLU 85 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3m39 h LEU 86 N 3.30 0.38 0.17 -4.62 4.07 -0.74 -3.30 115.31 114.58 3m39 h LEU 86 Ca 0.00 -0.30 0.00 0.00 0.08 0.00 0.00 57.88 57.67 3m39 h LEU 86 Cb 0.70 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.31 3m39 h LEU 86 CO 0.00 1.08 -0.15 0.11 -1.08 0.00 0.00 178.44 178.40 3m39 h LYS 87 N 0.18 -0.33 -0.49 1.13 1.57 -1.55 0.34 116.57 117.42 3m39 h LYS 87 Ca -0.05 0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 3m39 h LYS 87 Cb 1.47 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.84 3m39 h LYS 87 CO 0.14 -0.22 0.04 -1.35 -0.57 0.00 0.00 179.45 177.49 3m39 h PRO 88 N -0.34 0.78 -0.08 3.15 0.11 -1.78 -1.83 132.00 132.00 3m39 h PRO 88 Ca -0.00 -0.19 -0.01 0.00 0.11 0.00 0.00 66.00 65.91 3m39 h PRO 88 Cb 0.31 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.32 3m39 h PRO 88 CO -0.03 0.77 0.03 1.25 -0.21 0.00 0.00 178.00 179.81 3m39 h LEU 89 N 0.74 0.12 -0.98 2.35 5.85 -1.55 -1.62 115.31 120.22 3m39 h LEU 89 Ca 0.15 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.70 3m39 h LEU 89 Cb 0.40 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.35 3m39 h LEU 89 CO 0.01 0.26 0.62 0.00 -0.34 0.00 0.00 178.44 179.00 3m39 h ALA 90 N 0.86 1.24 -0.29 1.25 0.00 -0.21 0.31 119.26 122.42 3m39 h ALA 90 Ca 0.03 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 3m39 h ALA 90 Cb 0.18 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3m39 h ALA 90 CO -0.00 0.66 0.10 0.37 0.00 0.00 0.00 179.25 180.38 3m39 h GLN 91 N 1.33 0.44 -0.45 0.00 4.15 -1.20 0.33 115.11 119.72 3m39 h GLN 91 Ca 0.35 -0.09 -0.13 0.00 0.77 0.00 0.00 58.65 59.56 3m39 h GLN 91 Cb -0.12 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.49 3m39 h GLN 91 CO -0.07 0.48 -0.21 0.66 -1.93 0.00 0.00 178.83 177.76 3m39 h SER 92 N 0.31 0.97 0.85 -0.69 4.64 -1.01 -2.13 113.55 116.49 3m39 h SER 92 Ca 0.09 -0.40 -0.14 0.00 -0.47 0.00 0.00 61.79 60.87 3m39 h SER 92 Cb 0.21 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 3m39 h SER 92 CO -0.01 1.15 -0.68 0.45 -0.87 0.00 0.00 176.83 176.88 3m39 h HIS 93 N 0.78 0.00 0.41 4.77 3.86 -0.81 -1.50 115.15 122.66 3m39 h HIS 93 Ca 0.10 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.29 3m39 h HIS 93 Cb 0.79 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.26 3m39 h HIS 93 CO 0.05 0.68 -0.19 0.00 0.86 0.00 0.00 177.93 179.33 3m39 h ALA 94 N 1.32 -0.57 -0.01 2.45 0.00 -0.31 0.23 119.26 122.37 3m39 h ALA 94 Ca -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3m39 h ALA 94 Cb 1.29 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.29 3m39 h ALA 94 CO 0.09 -0.53 -0.18 0.25 0.00 0.00 0.00 179.25 178.89 3m39 n THR 95 N -4.99 0.00 0.02 0.00 -2.24 -0.81 -3.64 114.28 102.62 3m39 n THR 95 Ca -0.07 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3m39 n THR 95 Cb 0.21 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 3m39 n THR 95 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3m39 n LYS 96 N -0.75 0.00 0.00 -0.78 4.81 -0.60 -4.88 118.16 115.96 3m39 n LYS 96 Ca 0.14 0.00 0.08 0.00 -0.87 0.00 0.00 58.31 57.65 3m39 n LYS 96 Cb 0.32 -0.39 -0.13 0.00 0.02 0.00 0.00 35.03 34.84 3m39 n LYS 96 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 3m39 n HIS 97 N -3.04 0.24 -3.01 5.64 8.25 -0.98 -5.04 115.22 117.28 3m39 n HIS 97 Ca 0.00 0.07 -0.07 0.00 -0.26 0.00 0.00 57.72 57.46 3m39 n HIS 97 Cb 0.29 -0.69 0.03 0.00 1.12 0.00 0.00 29.99 30.75 3m39 n HIS 97 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3m39 n LYS 98 N -2.44 -1.66 -3.75 -0.41 5.02 0.77 -4.99 118.16 110.71 3m39 n LYS 98 Ca -0.07 1.06 -0.38 0.00 -2.02 0.00 0.00 58.31 56.90 3m39 n LYS 98 Cb 0.66 -5.40 -0.12 0.00 -0.02 0.00 0.00 35.03 30.15 3m39 n LYS 98 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3m39 s ILE 99 N -3.19 3.84 0.65 -0.18 -1.09 -0.96 -5.04 121.20 115.22 3m39 s ILE 99 Ca 0.23 -1.03 -0.16 0.00 -2.23 0.00 0.00 60.65 57.47 3m39 s ILE 99 Cb -0.03 -3.13 -0.00 0.00 -1.58 0.00 0.00 42.46 37.72 3m39 s ILE 99 CO 0.67 -0.12 1.13 -2.84 -1.23 0.00 0.00 174.94 172.55 3m39 s PRO 100 N 1.43 2.79 0.32 2.79 0.02 -1.26 -4.85 135.00 136.24 3m39 s PRO 100 Ca -0.01 1.47 0.02 0.00 0.02 0.00 0.00 61.00 62.51 3m39 s PRO 100 Cb -0.19 -1.94 0.59 0.00 0.02 0.00 0.00 34.50 32.98 3m39 s PRO 100 CO 0.03 -1.27 1.94 0.82 -0.33 0.00 0.00 177.00 178.19 3m39 h ILE 101 N 0.15 1.08 -0.33 2.83 1.08 -1.87 0.24 117.51 120.69 3m39 h ILE 101 Ca -0.47 -0.32 0.05 0.00 -0.39 0.00 0.00 64.86 63.72 3m39 h ILE 101 Cb 1.26 0.05 -0.02 0.00 -3.07 0.00 0.00 36.82 35.04 3m39 h ILE 101 CO 0.54 0.17 0.23 0.50 -0.69 0.00 0.00 178.15 178.90 3m39 h LYS 102 N 0.94 0.24 0.00 2.37 3.64 -1.92 0.42 116.57 122.26 3m39 h LYS 102 Ca 0.34 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.64 3m39 h LYS 102 Cb 0.15 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 3m39 h LYS 102 CO -0.11 0.16 -0.33 1.88 -2.27 0.00 0.00 179.45 178.77 3m39 h TYR 103 N 0.24 0.00 -0.06 1.91 -1.99 -1.31 -0.75 116.97 115.01 3m39 h TYR 103 Ca 0.14 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 60.73 3m39 h TYR 103 Cb 0.27 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.98 3m39 h TYR 103 CO -0.00 0.33 -0.60 -0.07 -0.00 0.00 0.00 178.16 177.83 3m39 h LEU 104 N 0.00 0.23 -0.36 3.88 4.07 0.06 0.33 115.31 123.51 3m39 h LEU 104 Ca -0.00 -0.13 -0.18 0.00 0.08 0.00 0.00 57.88 57.65 3m39 h LEU 104 Cb 0.59 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 42.27 3m39 h LEU 104 CO 0.04 0.77 -0.53 -0.33 -1.08 0.00 0.00 178.44 177.32 3m39 h GLU 105 N 0.15 0.82 -0.56 1.13 5.08 -0.43 -0.11 114.58 120.65 3m39 h GLU 105 Ca -0.01 -0.51 0.08 0.00 -1.00 0.00 0.00 59.36 57.93 3m39 h GLU 105 Cb 1.09 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 30.33 3m39 h GLU 105 CO 0.09 1.14 0.21 0.74 -1.00 0.00 0.00 179.01 180.19 3m39 h PHE 106 N 0.63 0.37 -0.29 4.33 0.04 -0.88 -1.03 116.94 120.11 3m39 h PHE 106 Ca 0.02 0.03 -0.11 0.00 2.80 0.00 0.00 57.97 60.71 3m39 h PHE 106 Cb 1.12 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 39.18 3m39 h PHE 106 CO 0.07 0.11 -0.26 1.49 -0.60 0.00 0.00 178.31 179.11 3m39 h GLU 107 N 0.40 0.58 -0.76 1.51 4.81 -0.67 -2.18 114.58 118.26 3m39 h GLU 107 Ca 0.28 -0.23 -0.06 0.00 -0.13 0.00 0.00 59.36 59.22 3m39 h GLU 107 Cb 0.31 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.63 3m39 h GLU 107 CO -0.27 0.79 0.25 0.77 -0.73 0.00 0.00 179.01 179.82 3m39 h SER 108 N 0.51 1.09 -0.68 1.04 0.02 -0.14 0.29 113.55 115.68 3m39 h SER 108 Ca 0.07 -0.20 0.07 0.00 -0.84 0.00 0.00 61.79 60.89 3m39 h SER 108 Cb 0.72 -0.29 -0.06 0.00 0.14 0.00 0.00 62.40 62.92 3m39 h SER 108 CO 0.06 1.00 0.36 -0.33 -1.14 0.00 0.00 176.83 176.78 3m39 h GLU 109 N 1.13 0.64 -0.58 3.45 5.08 -1.05 0.14 114.58 123.39 3m39 h GLU 109 Ca 0.25 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 3m39 h GLU 109 Cb 0.29 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 3m39 h GLU 109 CO -0.01 0.42 0.11 0.00 -1.00 0.00 0.00 179.01 178.53 3m39 h ALA 110 N 1.37 0.76 -0.33 3.43 0.00 -0.74 -1.14 119.26 122.62 3m39 h ALA 110 Ca 0.31 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3m39 h ALA 110 Cb 0.24 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3m39 h ALA 110 CO -0.21 0.50 0.20 0.82 0.00 0.00 0.00 179.25 180.57 3m39 h ILE 111 N 0.84 1.10 -0.43 0.00 2.04 -0.48 -0.30 117.51 120.30 3m39 h ILE 111 Ca 0.18 -0.23 -0.08 0.00 1.00 0.00 0.00 64.86 65.72 3m39 h ILE 111 Cb 0.39 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 3m39 h ILE 111 CO 0.01 0.10 -0.08 0.40 0.00 0.00 0.00 178.15 178.58 3m39 h ILE 112 N 0.43 1.25 -0.12 -0.67 2.04 -0.56 0.51 117.51 120.39 3m39 h ILE 112 Ca 0.12 -1.10 -0.03 0.00 1.00 0.00 0.00 64.86 64.85 3m39 h ILE 112 Cb -0.01 1.01 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 3m39 h ILE 112 CO -0.02 0.38 -0.03 -0.74 0.00 0.00 0.00 178.15 177.74 3m39 h HIS 113 N 0.68 0.25 -0.43 1.37 2.76 -1.00 -0.97 115.15 117.81 3m39 h HIS 113 Ca 0.12 -0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.23 3m39 h HIS 113 Cb 0.54 -0.06 -0.02 0.00 1.55 0.00 0.00 27.41 29.42 3m39 h HIS 113 CO 0.03 0.53 0.24 0.28 -1.30 0.00 0.00 177.93 177.70 3m39 h VAL 114 N -0.09 1.16 -0.38 5.26 2.07 -0.92 -0.09 116.25 123.25 3m39 h VAL 114 Ca 0.03 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 3m39 h VAL 114 Cb 0.45 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 3m39 h VAL 114 CO 0.01 0.16 0.19 -0.07 0.02 0.00 0.00 177.57 177.89 3m39 h LEU 115 N 0.56 0.47 -0.23 2.57 4.07 -0.82 -1.25 115.31 120.67 3m39 h LEU 115 Ca 0.15 -0.03 -0.16 0.00 0.08 0.00 0.00 57.88 57.92 3m39 h LEU 115 Cb 0.05 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 41.67 3m39 h LEU 115 CO -0.02 0.39 -0.48 -0.74 -1.08 0.00 0.00 178.44 176.50 3m39 h HIS 116 N 0.53 0.94 -0.50 1.13 2.76 -0.70 -1.45 115.15 117.86 3m39 h HIS 116 Ca 0.14 -0.34 -0.05 0.00 -2.20 0.00 0.00 60.37 57.92 3m39 h HIS 116 Cb 0.04 -0.17 -0.02 0.00 1.55 0.00 0.00 27.41 28.80 3m39 h HIS 116 CO 0.00 1.14 0.12 0.77 -1.30 0.00 0.00 177.93 178.66 3m39 h SER 117 N 0.47 0.71 0.56 3.26 0.02 -0.63 -3.12 113.55 114.83 3m39 h SER 117 Ca 0.01 -0.12 -0.26 0.00 -0.84 0.00 0.00 61.79 60.57 3m39 h SER 117 Cb 1.09 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 63.40 3m39 h SER 117 CO 0.11 0.71 -1.62 0.03 -1.14 0.00 0.00 176.83 174.92 3m39 h ARG 118 N 0.74 0.00 -1.90 3.45 3.08 -1.22 -3.42 114.38 115.12 3m39 h ARG 118 Ca 0.16 0.00 -0.48 0.00 0.07 0.00 0.00 59.98 59.73 3m39 h ARG 118 Cb 0.28 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 29.93 3m39 h ARG 118 CO -0.00 0.45 -1.11 0.72 -1.07 0.00 0.00 179.97 178.96 3m39 n HIS 119 N -3.01 0.93 -0.18 3.04 8.25 -0.55 -4.96 115.22 118.73 3m39 n HIS 119 Ca -0.15 -3.70 -0.03 0.00 -0.26 0.00 0.00 57.72 53.59 3m39 n HIS 119 Cb 1.00 -0.42 0.17 0.00 1.12 0.00 0.00 29.99 31.86 3m39 n HIS 119 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3m39 h PRO 120 N 2.99 0.93 0.00 -0.41 0.13 -1.75 -0.95 132.00 132.94 3m39 h PRO 120 Ca 0.08 -0.16 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 3m39 h PRO 120 Cb 0.93 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 31.90 3m39 h PRO 120 CO 0.55 0.78 0.00 0.41 -0.23 0.00 0.00 178.00 179.51 3m39 n GLY 121 N -0.95 -1.18 0.25 1.56 0.00 -1.26 -2.06 105.19 101.54 3m39 n GLY 121 Ca 0.05 0.09 0.03 0.00 0.00 0.00 0.00 46.02 46.19 3m39 n GLY 121 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3m39 n ASP 122 N -2.17 2.40 -2.88 1.61 9.92 -0.50 -4.81 116.55 120.12 3m39 n ASP 122 Ca 0.02 -2.11 -0.12 0.00 -0.53 0.00 0.00 54.79 52.05 3m39 n ASP 122 Cb 0.19 -0.13 0.04 0.00 -0.64 0.00 0.00 41.12 40.59 3m39 n ASP 122 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 3m39 n PHE 123 N -0.23 -1.21 -1.16 1.24 7.35 -0.48 -4.62 117.46 118.35 3m39 n PHE 123 Ca 0.06 -2.79 0.00 0.00 -0.76 0.00 0.00 57.45 53.96 3m39 n PHE 123 Cb 0.36 0.64 0.00 0.00 0.35 0.00 0.00 39.48 40.83 3m39 n PHE 123 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3m39 n GLY 124 N 0.15 0.28 0.17 7.13 0.00 -1.23 -4.60 105.19 107.08 3m39 n GLY 124 Ca 0.12 -1.82 -0.06 0.00 0.00 0.00 0.00 46.02 44.26 3m39 n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m39 h ALA 125 N -1.38 0.48 -0.39 4.61 0.00 -1.98 0.19 119.26 120.79 3m39 h ALA 125 Ca 0.00 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3m39 h ALA 125 Cb 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3m39 h ALA 125 CO 0.00 -0.17 0.07 -0.44 0.00 0.00 0.00 179.25 178.70 3m39 h ASP 126 N 0.39 0.61 -0.41 0.00 3.45 -1.99 -1.16 116.42 117.31 3m39 h ASP 126 Ca 0.17 -0.26 -0.03 0.00 0.43 0.00 0.00 57.03 57.34 3m39 h ASP 126 Cb 0.08 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 38.67 3m39 h ASP 126 CO -0.12 0.71 0.13 0.00 -1.57 0.00 0.00 179.24 178.39 3m39 h ALA 127 N 0.92 0.53 -0.50 3.45 0.00 -1.80 -0.85 119.26 121.01 3m39 h ALA 127 Ca 0.12 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 3m39 h ALA 127 Cb 0.36 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3m39 h ALA 127 CO 0.01 0.18 0.14 1.96 0.00 0.00 0.00 179.25 181.54 3m39 h GLN 128 N 0.52 0.76 -0.62 0.00 4.20 -0.61 0.69 115.11 120.03 3m39 h GLN 128 Ca 0.13 -0.14 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 3m39 h GLN 128 Cb 0.26 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 3m39 h GLN 128 CO -0.00 0.67 0.09 0.78 -0.67 0.00 0.00 178.83 179.70 3m39 h GLY 129 N 0.92 1.12 1.06 3.46 0.00 -0.83 0.12 103.07 108.91 3m39 h GLY 129 Ca 0.17 -0.75 -0.10 0.00 0.00 0.00 0.00 47.33 46.64 3m39 h GLY 129 CO -0.01 0.70 -0.08 0.00 0.00 0.00 0.00 176.54 177.15 3m39 h ALA 130 N 1.02 0.70 -0.55 3.60 0.00 -0.46 -2.36 119.26 121.22 3m39 h ALA 130 Ca 0.19 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 3m39 h ALA 130 Cb 0.44 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3m39 h ALA 130 CO 0.01 0.59 -0.06 1.98 0.00 0.00 0.00 179.25 181.77 3m39 h MET 131 N 0.83 1.00 -0.62 0.00 -1.53 -0.71 -1.56 114.93 112.33 3m39 h MET 131 Ca 0.14 -0.35 0.07 0.00 -3.44 0.00 0.00 59.70 56.12 3m39 h MET 131 Cb 0.63 -0.08 -0.06 0.00 -0.55 0.00 0.00 31.60 31.55 3m39 h MET 131 CO 0.04 1.03 0.30 -0.91 0.14 0.00 0.00 176.91 177.51 3m39 h ASN 132 N 0.88 0.40 -0.58 1.39 -0.26 -0.91 -0.37 115.58 116.14 3m39 h ASN 132 Ca 0.15 0.05 0.02 0.00 -0.56 0.00 0.00 56.30 55.95 3m39 h ASN 132 Cb 0.62 -0.02 -0.03 0.00 -1.06 0.00 0.00 38.32 37.82 3m39 h ASN 132 CO 0.04 0.25 0.36 0.11 -1.06 0.00 0.00 177.43 177.13 3m39 h LYS 133 N 0.55 0.71 -0.52 0.81 1.57 -1.19 -0.36 116.57 118.13 3m39 h LYS 133 Ca 0.30 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.97 3m39 h LYS 133 Cb 0.27 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 3m39 h LYS 133 CO -0.23 0.47 0.08 0.00 -0.57 0.00 0.00 179.45 179.20 3m39 h ALA 134 N 1.23 0.69 -0.00 3.86 0.00 -0.52 -1.13 119.26 123.40 3m39 h ALA 134 Ca 0.22 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 3m39 h ALA 134 Cb -0.03 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3m39 h ALA 134 CO -0.08 0.44 -0.72 -0.07 0.00 0.00 0.00 179.25 178.82 3m39 h LEU 135 N 0.75 0.03 -0.57 0.00 3.38 -0.91 -1.32 115.31 116.67 3m39 h LEU 135 Ca 0.16 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.95 3m39 h LEU 135 Cb 0.41 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3m39 h LEU 135 CO 0.01 0.74 -0.64 1.05 0.09 0.00 0.00 178.44 179.69 3m39 h GLU 136 N 0.02 0.29 -0.51 1.13 4.11 -0.85 -0.17 114.58 118.60 3m39 h GLU 136 Ca -0.01 -0.21 0.00 0.00 0.07 0.00 0.00 59.36 59.21 3m39 h GLU 136 Cb 1.27 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.53 3m39 h GLU 136 CO 0.10 0.83 0.33 1.25 0.07 0.00 0.00 179.01 181.59 3m39 h LEU 137 N 0.21 0.60 -0.16 3.06 5.85 -1.04 0.31 115.31 124.14 3m39 h LEU 137 Ca -0.01 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.69 3m39 h LEU 137 Cb 1.17 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 3m39 h LEU 137 CO 0.10 0.45 0.06 0.15 -0.34 0.00 0.00 178.44 178.86 3m39 h PHE 138 N 0.69 0.10 -0.58 1.25 3.57 -1.06 -1.14 116.94 119.78 3m39 h PHE 138 Ca 0.19 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.71 3m39 h PHE 138 Cb -0.05 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.63 3m39 h PHE 138 CO -0.03 0.05 0.37 0.00 -2.23 0.00 0.00 178.31 176.47 3m39 h ARG 139 N 0.14 0.72 -0.13 1.11 3.08 -0.76 -0.77 114.38 117.78 3m39 h ARG 139 Ca 0.07 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.08 3m39 h ARG 139 Cb 0.04 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 3m39 h ARG 139 CO -0.07 0.48 0.08 -0.22 -1.07 0.00 0.00 179.97 179.17 3m39 h LYS 140 N 0.75 0.17 -0.42 0.04 3.64 -0.13 -0.46 116.57 120.15 3m39 h LYS 140 Ca 0.22 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.48 3m39 h LYS 140 Cb -0.05 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 3m39 h LYS 140 CO -0.07 0.14 -0.17 -0.44 -2.27 0.00 0.00 179.45 176.65 3m39 h ASP 141 N 0.15 0.80 1.00 4.20 3.45 -1.08 -2.21 116.42 122.74 3m39 h ASP 141 Ca 0.05 -0.27 -0.16 0.00 0.43 0.00 0.00 57.03 57.08 3m39 h ASP 141 Cb 0.01 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.53 3m39 h ASP 141 CO -0.01 0.97 -0.76 -0.29 -1.57 0.00 0.00 179.24 177.58 3m39 h ILE 142 N 0.71 1.41 -0.62 0.35 2.10 -0.99 -1.40 117.51 119.08 3m39 h ILE 142 Ca 0.11 -2.73 0.09 0.00 1.08 0.00 0.00 64.86 63.41 3m39 h ILE 142 Cb 0.67 2.53 -0.07 0.00 -1.09 0.00 0.00 36.82 38.86 3m39 h ILE 142 CO 0.05 0.75 0.27 0.00 -1.08 0.00 0.00 178.15 178.13 3m39 h ALA 143 N 1.24 0.82 -0.92 0.18 0.00 -0.77 0.28 119.26 120.08 3m39 h ALA 143 Ca -0.01 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3m39 h ALA 143 Cb 1.47 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.22 3m39 h ALA 143 CO 0.10 -0.14 0.59 0.00 0.00 0.00 0.00 179.25 179.80 3m39 h ALA 144 N 1.40 1.31 -0.34 0.00 0.00 -0.95 -2.00 119.26 118.67 3m39 h ALA 144 Ca 0.31 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 3m39 h ALA 144 Cb 0.34 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3m39 h ALA 144 CO -0.27 0.62 -0.35 0.87 0.00 0.00 0.00 179.25 180.12 3m39 h LYS 145 N 1.26 0.78 -0.22 0.00 1.79 -0.07 -1.33 116.57 118.78 3m39 h LYS 145 Ca 0.34 -0.38 0.05 0.00 -2.18 0.00 0.00 60.65 58.48 3m39 h LYS 145 Cb -0.11 -0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.46 3m39 h LYS 145 CO -0.07 1.01 -0.38 1.88 -1.08 0.00 0.00 179.45 180.81 3m39 h TYR 146 N 0.65 -1.08 -0.36 -1.35 -1.99 -0.03 -2.37 116.97 110.44 3m39 h TYR 146 Ca 0.06 0.05 0.04 0.00 2.00 0.00 0.00 58.73 60.88 3m39 h TYR 146 Cb 0.90 0.51 -0.04 0.00 2.00 0.00 0.00 36.73 40.09 3m39 h TYR 146 CO 0.05 -0.44 0.14 0.87 -0.00 0.00 0.00 178.16 178.78 3m39 h LYS 147 N -0.40 0.29 -0.95 4.88 1.57 -1.12 -1.66 116.57 119.17 3m39 h LYS 147 Ca 0.11 -0.02 0.21 0.00 -1.87 0.00 0.00 60.65 59.08 3m39 h LYS 147 Cb 0.59 -0.06 -0.08 0.00 0.08 0.00 0.00 32.23 32.76 3m39 h LYS 147 CO -0.44 0.19 0.62 0.93 -0.57 0.00 0.00 179.45 180.18 3m39 h GLU 148 N 0.29 0.44 -0.01 3.15 5.08 -0.80 0.14 114.58 122.87 3m39 h GLU 148 Ca 0.16 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3m39 h GLU 148 Cb 0.13 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3m39 h GLU 148 CO -0.16 0.29 -0.13 1.28 -1.00 0.00 0.00 179.01 179.30 3m39 n LEU 149 N -4.56 0.68 0.00 1.33 4.77 -0.67 -5.05 117.00 113.51 3m39 n LEU 149 Ca 0.21 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 3m39 n LEU 149 Cb 0.71 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 3m39 n LEU 149 CO 0.29 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 3m39 n GLY 150 N 1.27 -3.79 1.73 -0.72 0.00 0.48 -5.09 105.19 99.07 3m39 n GLY 150 Ca 0.15 -2.07 0.00 0.00 0.00 0.00 0.00 46.02 44.10 3m39 n GLY 150 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3m39 n TYR 151 N -0.06 -2.38 -2.10 1.61 4.01 -1.26 -4.17 117.16 112.81 3m39 n TYR 151 Ca 0.00 1.29 -0.32 0.00 -0.16 0.00 0.00 57.90 58.71 3m39 n TYR 151 Cb 0.00 -2.04 -0.01 0.00 -0.31 0.00 0.00 39.34 36.99 3m39 n TYR 151 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3m39 s GLN 152 N -1.19 3.63 0.00 -0.72 1.11 -1.26 -4.16 119.66 117.07 3m39 s GLN 152 Ca 0.00 0.95 0.20 0.00 0.01 0.00 0.00 55.36 56.52 3m39 s GLN 152 Cb 0.00 -2.09 0.16 0.00 -1.01 0.00 0.00 33.01 30.07 3m39 s GLN 152 CO 0.00 -0.54 1.13 0.41 0.01 0.00 0.00 175.29 176.30