#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jdo s VAL 1 N 0.00 0.07 0.23 3.17 1.01 -1.26 -5.06 120.40 118.56 1jdo s VAL 1 Ca 0.00 0.18 -0.20 0.00 0.00 0.00 0.00 61.98 61.96 1jdo s VAL 1 Cb 0.00 -0.21 -0.08 0.00 0.00 0.00 0.00 36.38 36.09 1jdo s VAL 1 CO 0.00 0.14 0.74 -0.76 0.00 0.00 0.00 175.10 175.22 1jdo s LEU 2 N 1.24 4.35 0.76 3.92 1.02 -1.26 -5.07 118.68 123.63 1jdo s LEU 2 Ca -0.07 1.45 -0.11 0.00 0.02 0.00 0.00 54.13 55.42 1jdo s LEU 2 Cb -0.13 -3.61 0.05 0.00 0.02 0.00 0.00 46.19 42.52 1jdo s LEU 2 CO -0.02 0.03 1.08 -0.94 0.02 0.00 0.00 176.35 176.52 1jdo s SER 3 N -1.63 4.74 0.30 2.29 1.04 -1.26 -4.87 113.70 114.30 1jdo s SER 3 Ca 0.43 1.59 0.02 0.00 0.48 0.00 0.00 55.95 58.48 1jdo s SER 3 Cb -0.17 -2.37 0.58 0.00 0.10 0.00 0.00 66.02 64.16 1jdo s SER 3 CO 0.21 -1.85 1.89 -0.08 0.98 0.00 0.00 173.24 174.39 1jdo h GLU 4 N -1.00 0.94 -0.46 4.02 4.57 -1.99 -1.14 114.58 119.52 1jdo h GLU 4 Ca -0.45 -0.06 -0.08 0.00 -1.18 0.00 0.00 59.36 57.59 1jdo h GLU 4 Cb 1.24 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 29.59 1jdo h GLU 4 CO 0.56 0.62 -0.05 0.78 -1.18 0.00 0.00 179.01 179.74 1jdo h GLY 5 N 0.97 0.86 0.91 1.92 0.00 -1.99 0.11 103.07 105.84 1jdo h GLY 5 Ca 0.43 -0.61 -0.04 0.00 0.00 0.00 0.00 47.33 47.11 1jdo h GLY 5 CO -0.18 0.56 0.06 0.83 0.00 0.00 0.00 176.54 177.81 1jdo h GLU 6 N 0.73 0.55 -0.80 4.80 5.08 -1.74 -2.57 114.58 120.63 1jdo h GLU 6 Ca 0.13 -0.15 0.04 0.00 -1.00 0.00 0.00 59.36 58.39 1jdo h GLU 6 Cb 0.52 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.66 1jdo h GLU 6 CO 0.03 0.63 0.53 -1.49 -1.00 0.00 0.00 179.01 177.71 1jdo h TRP 7 N 0.39 0.94 -0.50 4.33 4.06 -0.80 -2.17 115.95 122.20 1jdo h TRP 7 Ca 0.10 0.02 -0.06 0.00 2.06 0.00 0.00 58.89 61.01 1jdo h TRP 7 Cb 0.34 -0.31 -0.02 0.00 -1.00 0.00 0.00 29.16 28.17 1jdo h TRP 7 CO 0.02 0.54 0.06 1.96 -3.56 0.00 0.00 178.44 177.46 1jdo h GLN 8 N 0.97 0.80 -0.51 0.49 4.20 -0.54 -0.10 115.11 120.43 1jdo h GLN 8 Ca 0.32 -0.19 -0.06 0.00 0.06 0.00 0.00 58.65 58.79 1jdo h GLN 8 Cb 0.07 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 1jdo h GLN 8 CO -0.10 0.77 0.10 -0.07 -0.67 0.00 0.00 178.83 178.86 1jdo h LEU 9 N 0.76 0.80 0.02 1.46 3.38 -1.05 -0.49 115.31 120.19 1jdo h LEU 9 Ca 0.16 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1jdo h LEU 9 Cb 0.38 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1jdo h LEU 9 CO 0.01 0.84 -0.01 0.58 0.09 0.00 0.00 178.44 179.95 1jdo h VAL 10 N 0.72 1.04 0.00 1.22 2.07 -0.97 -2.84 116.25 117.49 1jdo h VAL 10 Ca 0.16 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.44 1jdo h VAL 10 Cb 0.37 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1jdo h VAL 10 CO 0.01 0.05 -0.20 -0.07 0.02 0.00 0.00 177.57 177.37 1jdo h LEU 11 N -0.11 0.00 -0.34 2.57 3.38 -0.98 -1.08 115.31 118.74 1jdo h LEU 11 Ca -0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1jdo h LEU 11 Cb 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1jdo h LEU 11 CO 0.01 0.20 -0.03 -0.74 0.09 0.00 0.00 178.44 177.97 1jdo h HIS 12 N 0.00 0.69 0.00 1.13 2.76 -1.01 -1.33 115.15 117.38 1jdo h HIS 12 Ca -0.00 -0.13 -0.16 0.00 -2.20 0.00 0.00 60.37 57.88 1jdo h HIS 12 Cb 1.02 -0.17 -0.02 0.00 1.55 0.00 0.00 27.41 29.78 1jdo h HIS 12 CO 0.00 0.75 -0.75 -0.24 -1.30 0.00 0.00 177.93 176.40 1jdo h VAL 13 N 0.42 1.45 -0.12 5.26 3.04 -1.34 -3.01 116.25 121.96 1jdo h VAL 13 Ca 0.09 -2.63 -0.05 0.00 -1.01 0.00 0.00 66.70 63.10 1jdo h VAL 13 Cb 0.50 2.45 -0.01 0.00 -2.01 0.00 0.00 31.29 32.22 1jdo h VAL 13 CO 0.02 0.73 -0.17 -0.25 -1.01 0.00 0.00 177.57 176.89 1jdo h TRP 14 N 0.00 0.20 -0.29 3.17 2.91 -1.05 -1.57 115.95 119.31 1jdo h TRP 14 Ca -0.01 -0.03 -0.00 0.00 1.13 0.00 0.00 58.89 59.98 1jdo h TRP 14 Cb 1.39 -0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 29.97 1jdo h TRP 14 CO 0.00 0.36 0.16 0.00 -1.03 0.00 0.00 178.44 177.93 1jdo h ALA 15 N 1.65 1.73 -0.17 2.65 0.00 -1.10 -0.63 119.26 123.40 1jdo h ALA 15 Ca 0.03 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1jdo h ALA 15 Cb 0.42 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1jdo h ALA 15 CO 0.03 0.23 -0.17 0.87 0.00 0.00 0.00 179.25 180.20 1jdo h LYS 16 N 0.40 0.41 -0.73 0.00 1.79 -1.34 -3.14 116.57 113.97 1jdo h LYS 16 Ca 0.11 -0.22 0.14 0.00 -2.18 0.00 0.00 60.65 58.50 1jdo h LYS 16 Cb 0.01 0.01 -0.09 0.00 -1.58 0.00 0.00 32.23 30.57 1jdo h LYS 16 CO -0.02 0.78 0.26 0.28 -1.08 0.00 0.00 179.45 179.67 1jdo h VAL 17 N 0.05 0.64 0.00 0.50 2.07 -0.82 -0.78 116.25 117.91 1jdo h VAL 17 Ca 0.03 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1jdo h VAL 17 Cb 0.71 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1jdo h VAL 17 CO 0.04 0.07 0.00 -0.62 0.02 0.00 0.00 177.57 177.08 1jdo n GLU 18 N -5.04 0.04 0.19 1.57 1.02 -0.31 -1.14 120.64 116.97 1jdo n GLU 18 Ca 0.13 0.38 0.14 0.00 -0.02 0.00 0.00 57.16 57.79 1jdo n GLU 18 Cb 0.40 -1.58 0.56 0.00 -0.02 0.00 0.00 31.44 30.80 1jdo n GLU 18 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1jdo h ALA 19 N 2.28 1.00 -1.01 0.62 0.00 -1.13 -3.36 119.26 117.66 1jdo h ALA 19 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.57 1jdo h ALA 19 Cb 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 17.79 17.72 1jdo h ALA 19 CO 0.00 0.00 -0.71 -3.47 0.00 0.00 0.00 179.25 175.07 1jdo n ASP 20 N -2.59 -1.91 -0.21 0.00 2.03 -0.29 -5.01 116.55 108.57 1jdo n ASP 20 Ca 0.02 -2.96 -0.07 0.00 0.52 0.00 0.00 54.79 52.30 1jdo n ASP 20 Cb 0.27 0.88 0.03 0.00 -0.72 0.00 0.00 41.12 41.58 1jdo n ASP 20 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1jdo h VAL 21 N 3.32 1.21 -0.61 5.18 2.07 -1.70 -2.29 116.25 123.43 1jdo h VAL 21 Ca -0.00 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 66.90 1jdo h VAL 21 Cb 0.99 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 1jdo h VAL 21 CO 0.31 0.24 0.23 0.00 0.02 0.00 0.00 177.57 178.37 1jdo h ALA 22 N 1.12 0.79 -0.53 1.67 0.00 -1.91 0.04 119.26 120.45 1jdo h ALA 22 Ca 0.21 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1jdo h ALA 22 Cb 0.11 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1jdo h ALA 22 CO -0.03 0.42 0.12 0.78 0.00 0.00 0.00 179.25 180.54 1jdo h GLY 23 N 0.85 0.92 1.05 0.00 0.00 -1.91 -1.88 103.07 102.10 1jdo h GLY 23 Ca 0.20 -0.58 -0.10 0.00 0.00 0.00 0.00 47.33 46.85 1jdo h GLY 23 CO -0.01 0.54 -0.09 0.45 0.00 0.00 0.00 176.54 177.43 1jdo h HIS 24 N 0.74 1.04 -0.43 5.60 3.86 -1.23 -1.89 115.15 122.85 1jdo h HIS 24 Ca 0.16 -0.21 0.06 0.00 -1.16 0.00 0.00 60.37 59.22 1jdo h HIS 24 Cb 0.35 -0.26 -0.05 0.00 1.06 0.00 0.00 27.41 28.52 1jdo h HIS 24 CO 0.02 0.99 0.14 0.78 0.86 0.00 0.00 177.93 180.73 1jdo h GLY 25 N 0.79 0.56 0.97 2.45 0.00 -0.79 -1.18 103.07 105.87 1jdo h GLY 25 Ca 0.13 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1jdo h GLY 25 CO 0.04 0.01 -0.01 1.46 0.00 0.00 0.00 176.54 178.05 1jdo h GLN 26 N 0.31 -0.02 -0.84 4.80 4.20 -1.21 -1.83 115.11 120.52 1jdo h GLN 26 Ca 0.20 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.93 1jdo h GLN 26 Cb 0.20 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.94 1jdo h GLN 26 CO -0.21 -0.01 0.55 -0.44 -0.67 0.00 0.00 178.83 178.05 1jdo h ASP 27 N -0.02 0.95 -0.26 1.46 3.32 -1.04 -1.02 116.42 119.81 1jdo h ASP 27 Ca 0.00 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 56.95 1jdo h ASP 27 Cb 0.03 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1jdo h ASP 27 CO -0.01 0.69 -0.16 0.40 -1.72 0.00 0.00 179.24 178.44 1jdo h ILE 28 N 1.12 1.30 -0.11 0.35 2.04 -1.05 -1.14 117.51 120.03 1jdo h ILE 28 Ca 0.31 -1.27 -0.15 0.00 1.00 0.00 0.00 64.86 64.76 1jdo h ILE 28 Cb -0.11 1.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 1jdo h ILE 28 CO -0.07 0.40 -0.57 -0.26 0.00 0.00 0.00 178.15 177.65 1jdo h PHE 29 N 0.30 0.41 -0.53 1.37 0.04 -1.11 -0.34 116.94 117.09 1jdo h PHE 29 Ca 0.06 -0.15 -0.06 0.00 2.80 0.00 0.00 57.97 60.62 1jdo h PHE 29 Cb 0.68 -0.08 -0.02 0.00 2.20 0.00 0.00 35.95 38.73 1jdo h PHE 29 CO 0.07 0.82 0.11 0.82 -0.60 0.00 0.00 178.31 179.52 1jdo h ILE 30 N 0.25 1.25 -0.35 -0.55 2.04 -1.20 0.39 117.51 119.34 1jdo h ILE 30 Ca 0.00 -0.90 -0.00 0.00 1.00 0.00 0.00 64.86 64.96 1jdo h ILE 30 Cb 1.07 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 1jdo h ILE 30 CO 0.09 0.33 0.21 -0.09 0.00 0.00 0.00 178.15 178.69 1jdo h ARG 31 N 0.75 0.48 -0.19 2.37 9.65 -0.99 -0.12 114.38 126.33 1jdo h ARG 31 Ca 0.16 -0.04 0.03 0.00 -1.10 0.00 0.00 59.98 59.03 1jdo h ARG 31 Cb 0.36 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.82 1jdo h ARG 31 CO 0.00 0.36 0.03 1.25 2.80 0.00 0.00 179.97 184.41 1jdo h LEU 32 N 0.46 -0.01 -1.00 3.80 5.85 -0.82 -0.47 115.31 123.11 1jdo h LEU 32 Ca 0.13 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.77 1jdo h LEU 32 Cb 0.01 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1jdo h LEU 32 CO -0.02 0.02 -0.45 -0.26 -0.34 0.00 0.00 178.44 177.39 1jdo h PHE 33 N 0.10 0.13 0.10 1.25 0.04 -0.73 -0.61 116.94 117.22 1jdo h PHE 33 Ca 0.09 -0.04 -0.26 0.00 2.80 0.00 0.00 57.97 60.56 1jdo h PHE 33 Cb 0.09 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.21 1jdo h PHE 33 CO -0.15 0.54 -1.16 0.87 -0.60 0.00 0.00 178.31 177.81 1jdo h LYS 34 N 0.09 0.27 0.01 1.51 1.57 -0.80 -3.12 116.57 116.10 1jdo h LYS 34 Ca 0.01 -0.42 -0.23 0.00 -1.87 0.00 0.00 60.65 58.13 1jdo h LYS 34 Cb 0.83 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.25 1jdo h LYS 34 CO 0.06 1.18 -1.20 0.77 -0.57 0.00 0.00 179.45 179.69 1jdo h SER 35 N 0.10 0.02 -2.11 0.86 0.02 -0.94 -3.40 113.55 108.09 1jdo h SER 35 Ca -0.11 -0.02 -0.57 0.00 -0.84 0.00 0.00 61.79 60.25 1jdo h SER 35 Cb 1.87 -0.01 -0.39 0.00 0.14 0.00 0.00 62.40 64.02 1jdo h SER 35 CO 0.19 1.02 -1.07 1.41 -1.14 0.00 0.00 176.83 177.24 1jdo n HIS 36 N -3.28 -0.53 0.19 3.45 8.25 -0.25 -4.98 115.22 118.08 1jdo n HIS 36 Ca -0.05 -3.48 0.18 0.00 -0.26 0.00 0.00 57.72 54.10 1jdo n HIS 36 Cb 0.97 -0.16 0.82 0.00 1.12 0.00 0.00 29.99 32.74 1jdo n HIS 36 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1jdo h PRO 37 N 4.49 0.00 0.00 -0.41 0.11 -1.73 0.66 132.00 135.12 1jdo h PRO 37 Ca 0.13 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 1jdo h PRO 37 Cb 0.89 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 1jdo h PRO 37 CO 0.43 0.00 -0.03 1.05 -0.21 0.00 0.00 178.00 179.24 1jdo h GLU 38 N 0.00 0.00 0.00 1.05 9.09 -1.92 -1.26 114.58 121.54 1jdo h GLU 38 Ca 0.10 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.45 1jdo h GLU 38 Cb 0.58 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.67 1jdo h GLU 38 CO -0.00 0.03 -0.29 1.79 0.05 0.00 0.00 179.01 180.59 1jdo h THR 39 N 0.00 0.98 -0.26 -1.06 1.35 -1.19 -2.45 112.91 110.27 1jdo h THR 39 Ca -0.00 -1.09 -0.00 0.00 -0.55 0.00 0.00 66.41 64.77 1jdo h THR 39 Cb 0.08 1.63 -0.01 0.00 -1.73 0.00 0.00 68.15 68.11 1jdo h THR 39 CO 0.00 0.28 0.16 0.25 -0.25 0.00 0.00 175.52 175.97 1jdo h LEU 40 N 0.00 0.30 -2.66 3.87 5.85 -1.39 -1.71 115.31 119.57 1jdo h LEU 40 Ca -0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1jdo h LEU 40 Cb 0.60 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.56 1jdo h LEU 40 CO 0.04 0.23 0.00 -0.33 -0.34 0.00 0.00 178.44 178.04 1jdo h GLU 41 N 0.35 0.00 0.00 1.25 5.08 -1.55 -1.66 114.58 118.06 1jdo h GLU 41 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1jdo h GLU 41 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1jdo h GLU 41 CO -0.02 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.62 1jdo n LYS 42 N -2.95 0.19 -3.61 2.33 4.76 -0.64 -4.62 118.16 113.62 1jdo n LYS 42 Ca -0.03 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.02 1jdo n LYS 42 Cb 0.08 -1.50 -0.09 0.00 -1.84 0.00 0.00 35.03 31.68 1jdo n LYS 42 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1jdo s PHE 43 N -2.81 3.49 0.44 2.13 0.40 -0.62 -4.93 117.98 116.07 1jdo s PHE 43 Ca 0.20 -2.15 0.17 0.00 -0.60 0.00 0.00 56.93 54.55 1jdo s PHE 43 Cb 0.20 -3.41 1.09 0.00 0.51 0.00 0.00 43.02 41.40 1jdo s PHE 43 CO 0.50 -0.96 1.92 -0.44 0.70 0.00 0.00 175.22 176.93 1jdo h ASP 44 N 8.06 0.36 1.65 1.36 3.32 -1.85 -0.69 116.42 128.62 1jdo h ASP 44 Ca -0.13 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1jdo h ASP 44 Cb 1.04 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.54 1jdo h ASP 44 CO 0.79 0.18 0.00 0.03 -1.72 0.00 0.00 179.24 178.52 1jdo h ARG 45 N 0.38 0.00 -0.00 3.56 3.08 -1.95 -3.36 114.38 116.09 1jdo h ARG 45 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 1jdo h ARG 45 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.97 1jdo h ARG 45 CO -0.11 0.00 -0.01 1.19 -1.07 0.00 0.00 179.97 179.97 1jdo n PHE 46 N -3.00 0.00 0.52 3.04 3.72 -0.40 -4.74 117.46 116.60 1jdo n PHE 46 Ca 0.03 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.49 1jdo n PHE 46 Cb 0.45 0.00 0.30 0.00 -0.94 0.00 0.00 39.48 39.29 1jdo n PHE 46 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1jdo n LYS 47 N -0.84 0.08 0.07 -1.08 2.85 -0.41 -1.21 118.16 117.63 1jdo n LYS 47 Ca 0.00 0.23 0.13 0.00 -1.05 0.00 0.00 58.31 57.62 1jdo n LYS 47 Cb 0.00 -1.50 0.39 0.00 -0.65 0.00 0.00 35.03 33.27 1jdo n LYS 47 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 177.40 174.96 1jdo n HIS 48 N -1.40 0.66 -1.95 5.58 1.44 -1.26 -4.87 115.22 113.42 1jdo n HIS 48 Ca 0.05 0.19 -0.42 0.00 -2.01 0.00 0.00 57.72 55.52 1jdo n HIS 48 Cb 0.13 -0.78 -0.03 0.00 0.12 0.00 0.00 29.99 29.43 1jdo n HIS 48 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1jdo s LEU 49 N -4.13 4.36 -0.20 2.39 1.43 -0.35 -4.91 118.68 117.27 1jdo s LEU 49 Ca 0.10 2.49 0.12 0.00 -1.03 0.00 0.00 54.13 55.81 1jdo s LEU 49 Cb 0.14 -3.57 -0.21 0.00 0.03 0.00 0.00 46.19 42.59 1jdo s LEU 49 CO 0.61 -0.87 -0.02 0.29 0.23 0.00 0.00 176.35 176.60 1jdo n LYS 50 N 5.31 0.88 -4.28 1.70 5.02 -1.26 -5.02 118.16 120.51 1jdo n LYS 50 Ca 0.15 0.03 -0.15 0.00 -2.02 0.00 0.00 58.31 56.33 1jdo n LYS 50 Cb 0.40 -1.47 -0.10 0.00 -0.02 0.00 0.00 35.03 33.84 1jdo n LYS 50 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1jdo s THR 51 N -2.45 1.07 0.29 -0.18 -4.23 -1.26 -5.04 115.64 103.84 1jdo s THR 51 Ca -0.16 -2.04 -0.02 0.00 -1.18 0.00 0.00 61.69 58.29 1jdo s THR 51 Cb 0.06 -2.06 0.27 0.00 1.34 0.00 0.00 72.50 72.11 1jdo s THR 51 CO 0.69 -0.56 1.95 -0.08 -0.54 0.00 0.00 174.62 176.08 1jdo h GLU 52 N 2.66 1.09 -0.83 3.99 4.81 -1.99 -1.34 114.58 122.97 1jdo h GLU 52 Ca -0.37 -0.07 0.07 0.00 -0.13 0.00 0.00 59.36 58.87 1jdo h GLU 52 Cb 1.20 -0.25 -0.07 0.00 0.63 0.00 0.00 28.75 30.27 1jdo h GLU 52 CO 0.64 0.72 0.50 0.00 -0.73 0.00 0.00 179.01 180.14 1jdo h ALA 53 N 1.48 1.16 -0.42 2.92 0.00 -1.99 0.11 119.26 122.51 1jdo h ALA 53 Ca 0.33 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.14 1jdo h ALA 53 Cb -0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1jdo h ALA 53 CO -0.09 0.19 -0.21 0.93 0.00 0.00 0.00 179.25 180.07 1jdo h GLU 54 N 0.88 0.82 -0.42 0.00 5.08 -1.70 -2.11 114.58 117.13 1jdo h GLU 54 Ca 0.38 -0.33 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1jdo h GLU 54 Cb 0.25 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1jdo h GLU 54 CO -0.20 0.96 0.13 0.52 -1.00 0.00 0.00 179.01 179.42 1jdo h MET 55 N 0.72 0.65 0.00 2.33 2.86 -0.57 -2.23 114.93 118.69 1jdo h MET 55 Ca 0.10 -0.14 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 1jdo h MET 55 Cb 0.73 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 32.29 1jdo h MET 55 CO 0.06 0.64 -0.10 0.87 1.06 0.00 0.00 176.91 179.44 1jdo h LYS 56 N 0.54 0.00 -0.01 1.72 1.57 -0.63 -2.43 116.57 117.33 1jdo h LYS 56 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1jdo h LYS 56 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1jdo h LYS 56 CO -0.00 0.10 -0.31 0.00 -0.57 0.00 0.00 179.45 178.66 1jdo n ALA 57 N -2.46 3.18 -2.57 3.86 0.00 -0.81 -4.84 120.51 116.88 1jdo n ALA 57 Ca -0.03 -0.38 -0.43 0.00 0.00 0.00 0.00 53.44 52.60 1jdo n ALA 57 Cb 0.18 -1.14 -0.02 0.00 0.00 0.00 0.00 19.45 18.47 1jdo n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1jdo s SER 58 N -2.63 6.99 0.22 0.00 0.15 -0.89 -4.89 113.70 112.65 1jdo s SER 58 Ca 0.21 1.41 0.01 0.00 0.70 0.00 0.00 55.95 58.27 1jdo s SER 58 Cb 0.19 -2.54 0.20 0.00 -1.71 0.00 0.00 66.02 62.16 1jdo s SER 58 CO 0.56 -0.76 1.55 -0.33 1.20 0.00 0.00 173.24 175.46 1jdo h GLU 59 N 7.93 0.42 -0.49 5.44 4.39 -1.89 -2.49 114.58 127.88 1jdo h GLU 59 Ca -0.22 -0.26 -0.13 0.00 0.34 0.00 0.00 59.36 59.09 1jdo h GLU 59 Cb 1.08 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.74 1jdo h GLU 59 CO 0.99 0.85 -0.20 -0.44 -1.16 0.00 0.00 179.01 179.05 1jdo h ASP 60 N 0.33 1.02 -0.60 1.42 3.32 -1.97 -1.15 116.42 118.78 1jdo h ASP 60 Ca 0.01 -0.38 -0.08 0.00 0.02 0.00 0.00 57.03 56.60 1jdo h ASP 60 Cb 1.05 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.30 1jdo h ASP 60 CO 0.09 1.18 0.05 0.25 -1.72 0.00 0.00 179.24 179.09 1jdo h LEU 61 N 0.86 0.99 -0.76 1.55 5.85 -1.88 -0.98 115.31 120.95 1jdo h LEU 61 Ca 0.11 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 1jdo h LEU 61 Cb 0.78 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 1jdo h LEU 61 CO 0.06 1.03 0.43 0.50 -0.34 0.00 0.00 178.44 180.12 1jdo h LYS 62 N 0.92 1.05 -0.66 1.25 3.64 -1.29 -0.64 116.57 120.83 1jdo h LYS 62 Ca 0.18 -0.11 -0.08 0.00 -1.27 0.00 0.00 60.65 59.37 1jdo h LYS 62 Cb 0.49 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.07 1jdo h LYS 62 CO 0.02 0.76 0.12 0.87 -2.27 0.00 0.00 179.45 178.95 1jdo h LYS 63 N 1.04 1.09 -0.53 1.90 1.57 -1.01 -2.56 116.57 118.06 1jdo h LYS 63 Ca 0.27 -0.28 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1jdo h LYS 63 Cb 0.01 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 1jdo h LYS 63 CO -0.05 0.99 0.35 1.25 -0.57 0.00 0.00 179.45 181.42 1jdo h HIS 64 N 1.02 0.67 -0.71 -1.35 2.76 -0.83 -1.96 115.15 114.75 1jdo h HIS 64 Ca 0.20 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.39 1jdo h HIS 64 Cb 0.42 -0.23 -0.04 0.00 1.55 0.00 0.00 27.41 29.12 1jdo h HIS 64 CO 0.03 0.43 0.45 0.78 -1.30 0.00 0.00 177.93 178.32 1jdo h GLY 65 N 0.72 1.02 0.91 5.26 0.00 -0.95 -0.94 103.07 109.09 1jdo h GLY 65 Ca 0.19 -0.40 -0.08 0.00 0.00 0.00 0.00 47.33 47.04 1jdo h GLY 65 CO -0.04 0.39 -0.13 -2.08 0.00 0.00 0.00 176.54 174.68 1jdo h VAL 66 N 0.97 1.29 -0.37 4.60 2.07 -1.04 -1.00 116.25 122.77 1jdo h VAL 66 Ca 0.26 -1.22 0.03 0.00 0.82 0.00 0.00 66.70 66.59 1jdo h VAL 66 Cb -0.07 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 1jdo h VAL 66 CO -0.05 0.39 0.16 0.74 0.02 0.00 0.00 177.57 178.83 1jdo h THR 67 N 0.39 0.94 0.23 2.57 2.02 -0.92 -0.52 112.91 117.62 1jdo h THR 67 Ca 0.07 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 1jdo h THR 67 Cb 0.65 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1jdo h THR 67 CO 0.04 0.06 -0.11 0.58 0.37 0.00 0.00 175.52 176.46 1jdo h VAL 68 N 0.33 0.80 -0.09 3.16 2.07 -1.09 -1.81 116.25 119.62 1jdo h VAL 68 Ca 0.16 -0.12 -0.09 0.00 0.82 0.00 0.00 66.70 67.47 1jdo h VAL 68 Cb 0.10 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1jdo h VAL 68 CO -0.14 0.03 -0.34 -0.07 0.02 0.00 0.00 177.57 177.07 1jdo h LEU 69 N -0.37 0.18 -0.62 2.57 3.38 -1.09 -1.17 115.31 118.19 1jdo h LEU 69 Ca -0.03 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1jdo h LEU 69 Cb 0.28 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1jdo h LEU 69 CO 0.05 0.52 0.28 0.74 0.09 0.00 0.00 178.44 180.12 1jdo h THR 70 N 0.16 1.22 -0.61 0.22 2.02 -1.03 0.14 112.91 115.04 1jdo h THR 70 Ca 0.02 -0.67 -0.09 0.00 0.77 0.00 0.00 66.41 66.45 1jdo h THR 70 Cb 0.69 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 67.58 1jdo h THR 70 CO 0.05 0.27 0.03 0.00 0.37 0.00 0.00 175.52 176.24 1jdo h ALA 71 N 1.11 0.91 -0.30 6.16 0.00 -0.81 -2.18 119.26 124.14 1jdo h ALA 71 Ca 0.21 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1jdo h ALA 71 Cb 0.16 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1jdo h ALA 71 CO -0.02 0.66 -0.30 1.25 0.00 0.00 0.00 179.25 180.84 1jdo h LEU 72 N 0.96 0.79 -1.38 0.00 5.85 -0.99 -2.84 115.31 117.69 1jdo h LEU 72 Ca 0.18 -0.47 0.04 0.00 0.84 0.00 0.00 57.88 58.46 1jdo h LEU 72 Cb 0.51 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 1jdo h LEU 72 CO 0.02 1.09 0.45 1.23 -0.34 0.00 0.00 178.44 180.90 1jdo h GLY 73 N 0.49 0.92 1.60 3.75 0.00 -0.67 -0.24 103.07 108.92 1jdo h GLY 73 Ca 0.05 -0.32 -0.10 0.00 0.00 0.00 0.00 47.33 46.97 1jdo h GLY 73 CO 0.07 0.27 -0.26 0.00 0.00 0.00 0.00 176.54 176.63 1jdo h ALA 74 N 1.61 1.11 -0.09 3.60 0.00 -1.19 -1.67 119.26 122.62 1jdo h ALA 74 Ca 0.27 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1jdo h ALA 74 Cb 0.09 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1jdo h ALA 74 CO -0.08 0.56 -0.20 0.82 0.00 0.00 0.00 179.25 180.35 1jdo h ILE 75 N 0.41 1.40 -0.69 0.00 2.04 -1.18 -3.12 117.51 116.38 1jdo h ILE 75 Ca 0.06 -1.50 -0.00 0.00 1.00 0.00 0.00 64.86 64.42 1jdo h ILE 75 Cb 0.67 2.15 -0.03 0.00 -0.74 0.00 0.00 36.82 38.87 1jdo h ILE 75 CO 0.05 0.43 0.42 -0.07 0.00 0.00 0.00 178.15 178.98 1jdo h LEU 76 N -0.16 0.82 -0.31 1.44 3.38 -0.92 -2.15 115.31 117.42 1jdo h LEU 76 Ca 0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1jdo h LEU 76 Cb 0.79 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1jdo h LEU 76 CO 0.04 0.62 0.00 0.29 0.09 0.00 0.00 178.44 179.49 1jdo n LYS 77 N -4.40 0.12 0.09 1.13 5.02 -0.64 -1.37 118.16 118.12 1jdo n LYS 77 Ca 0.07 0.29 0.12 0.00 -2.02 0.00 0.00 58.31 56.78 1jdo n LYS 77 Cb 0.06 -1.71 0.45 0.00 -0.02 0.00 0.00 35.03 33.82 1jdo n LYS 77 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1jdo n LYS 78 N -1.93 0.18 -3.94 1.97 4.76 -0.81 -4.94 118.16 113.45 1jdo n LYS 78 Ca 0.04 0.28 -0.28 0.00 -2.87 0.00 0.00 58.31 55.47 1jdo n LYS 78 Cb 0.25 -1.77 0.00 0.00 -1.84 0.00 0.00 35.03 31.68 1jdo n LYS 78 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1jdo n LYS 79 N -2.10 -4.26 0.00 1.97 5.02 -0.47 -2.02 118.16 116.31 1jdo n LYS 79 Ca 0.04 0.50 0.00 0.00 -2.02 0.00 0.00 58.31 56.83 1jdo n LYS 79 Cb 0.32 -5.06 0.00 0.00 -0.02 0.00 0.00 35.03 30.27 1jdo n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1jdo n GLY 80 N -1.70 2.50 2.56 0.72 0.00 -1.26 -4.97 105.19 103.04 1jdo n GLY 80 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 1jdo n GLY 80 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1jdo n HIS 81 N -1.79 2.65 -0.39 1.61 8.25 -0.86 -4.68 115.22 120.00 1jdo n HIS 81 Ca 0.00 -2.79 0.04 0.00 -0.26 0.00 0.00 57.72 54.71 1jdo n HIS 81 Cb 0.00 -1.78 0.06 0.00 1.12 0.00 0.00 29.99 29.38 1jdo n HIS 81 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1jdo n HIS 82 N 1.87 0.03 -0.27 4.41 1.44 -1.26 -4.75 115.22 116.70 1jdo n HIS 82 Ca 0.57 -0.68 0.08 0.00 -2.01 0.00 0.00 57.72 55.68 1jdo n HIS 82 Cb 0.27 -0.09 0.22 0.00 0.12 0.00 0.00 29.99 30.51 1jdo n HIS 82 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 1jdo h GLU 83 N 0.09 0.29 -0.09 -1.40 3.07 -2.00 -1.05 114.58 113.49 1jdo h GLU 83 Ca 0.00 -0.02 -0.18 0.00 -0.50 0.00 0.00 59.36 58.66 1jdo h GLU 83 Cb 0.70 -0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 28.54 1jdo h GLU 83 CO 0.00 0.19 -0.71 0.00 -1.40 0.00 0.00 179.01 177.10 1jdo h ALA 84 N 1.65 0.61 -0.17 3.43 0.00 -2.01 -2.89 119.26 119.88 1jdo h ALA 84 Ca 0.46 -0.59 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1jdo h ALA 84 Cb 0.82 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1jdo h ALA 84 CO -0.53 0.75 -0.30 0.93 0.00 0.00 0.00 179.25 180.10 1jdo h GLU 85 N 0.30 0.32 0.00 0.00 3.07 -1.72 -3.19 114.58 113.36 1jdo h GLU 85 Ca -0.03 -0.12 -0.11 0.00 -0.50 0.00 0.00 59.36 58.60 1jdo h GLU 85 Cb 1.28 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 29.15 1jdo h GLU 85 CO 0.12 0.60 -0.53 1.25 -1.40 0.00 0.00 179.01 179.05 1jdo h LEU 86 N 0.29 0.00 0.45 1.33 5.85 -1.02 -3.36 115.31 118.84 1jdo h LEU 86 Ca 0.04 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 1jdo h LEU 86 Cb 0.67 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.71 1jdo h LEU 86 CO 0.05 0.53 -0.21 0.11 -0.34 0.00 0.00 178.44 178.58 1jdo h LYS 87 N 0.00 -0.58 -0.03 1.25 1.57 -1.50 0.14 116.57 117.42 1jdo h LYS 87 Ca -0.01 0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.74 1jdo h LYS 87 Cb 1.29 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.72 1jdo h LYS 87 CO 0.07 -0.34 -0.34 -1.00 -0.57 0.00 0.00 179.45 177.27 1jdo h PRO 88 N -0.68 0.05 -0.25 3.15 0.13 -1.76 -1.64 132.00 131.00 1jdo h PRO 88 Ca -0.06 -0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 64.99 1jdo h PRO 88 Cb 0.50 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 1jdo h PRO 88 CO 0.10 0.38 -0.08 1.25 -0.23 0.00 0.00 178.00 179.42 1jdo h LEU 89 N 0.04 0.51 -0.60 1.56 7.12 -1.63 -1.35 115.31 120.96 1jdo h LEU 89 Ca 0.00 -0.38 -0.02 0.00 0.13 0.00 0.00 57.88 57.62 1jdo h LEU 89 Cb 0.62 -0.14 -0.03 0.00 -0.53 0.00 0.00 40.66 40.58 1jdo h LEU 89 CO 0.05 0.77 0.31 0.00 -0.13 0.00 0.00 178.44 179.44 1jdo h ALA 90 N 0.75 0.77 -0.39 1.25 0.00 -0.58 -1.84 119.26 119.23 1jdo h ALA 90 Ca 0.06 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1jdo h ALA 90 Cb 0.56 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1jdo h ALA 90 CO 0.03 0.30 -0.07 0.37 0.00 0.00 0.00 179.25 179.89 1jdo h GLN 91 N 0.81 0.73 -0.12 0.00 4.15 -1.09 -0.01 115.11 119.58 1jdo h GLN 91 Ca 0.21 -0.26 -0.14 0.00 0.77 0.00 0.00 58.65 59.22 1jdo h GLN 91 Cb 0.07 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.70 1jdo h GLN 91 CO -0.03 0.86 -0.55 0.66 -1.93 0.00 0.00 178.83 177.84 1jdo h SER 92 N 0.54 0.38 1.06 -0.69 4.64 -1.20 -1.00 113.55 117.27 1jdo h SER 92 Ca 0.10 -0.20 -0.15 0.00 -0.47 0.00 0.00 61.79 61.08 1jdo h SER 92 Cb 0.57 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.53 1jdo h SER 92 CO 0.03 0.85 -0.70 0.45 -0.87 0.00 0.00 176.83 176.60 1jdo h HIS 93 N 0.26 0.00 0.08 4.77 3.86 -1.22 -0.12 115.15 122.78 1jdo h HIS 93 Ca 0.00 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.06 1jdo h HIS 93 Cb 1.04 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.53 1jdo h HIS 93 CO 0.03 0.70 -0.64 0.00 0.86 0.00 0.00 177.93 178.87 1jdo h ALA 94 N 1.30 -0.03 0.00 2.45 0.00 -0.94 0.90 119.26 122.94 1jdo h ALA 94 Ca -0.01 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1jdo h ALA 94 Cb 1.41 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1jdo h ALA 94 CO 0.09 0.31 -0.88 -2.37 0.00 0.00 0.00 179.25 176.41 1jdo n THR 95 N -4.22 0.00 -0.12 0.00 5.66 -0.39 -3.85 114.28 111.36 1jdo n THR 95 Ca -0.12 -0.25 -0.21 0.00 -3.05 0.00 0.00 64.05 60.42 1jdo n THR 95 Cb 0.73 0.66 -0.07 0.00 -1.55 0.00 0.00 70.33 70.10 1jdo n THR 95 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 1jdo n LYS 96 N -1.49 0.56 0.08 1.09 4.81 -0.52 -4.68 118.16 118.02 1jdo n LYS 96 Ca 0.00 0.26 -0.03 0.00 -0.87 0.00 0.00 58.31 57.67 1jdo n LYS 96 Cb 0.17 -1.48 -0.07 0.00 0.02 0.00 0.00 35.03 33.68 1jdo n LYS 96 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1jdo h HIS 97 N -1.00 0.00 -5.32 5.64 3.86 -1.23 -3.49 115.15 113.61 1jdo h HIS 97 Ca -0.41 0.00 -0.20 0.00 -1.16 0.00 0.00 60.37 58.60 1jdo h HIS 97 Cb 1.34 0.00 0.16 0.00 1.06 0.00 0.00 27.41 29.97 1jdo h HIS 97 CO -0.22 0.77 -0.68 1.63 0.86 0.00 0.00 177.93 180.28 1jdo n LYS 98 N -3.21 -2.00 -3.56 2.45 4.01 -0.48 -5.00 118.16 110.37 1jdo n LYS 98 Ca -0.02 0.93 -0.40 0.00 -0.51 0.00 0.00 58.31 58.31 1jdo n LYS 98 Cb 0.86 -5.62 -0.11 0.00 -0.51 0.00 0.00 35.03 29.66 1jdo n LYS 98 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1jdo s ILE 99 N -3.31 5.10 0.56 -0.18 -1.09 0.19 -5.02 121.20 117.45 1jdo s ILE 99 Ca 0.37 -0.28 -0.18 0.00 -2.23 0.00 0.00 60.65 58.32 1jdo s ILE 99 Cb -0.05 -3.63 -0.05 0.00 -1.58 0.00 0.00 42.46 37.16 1jdo s ILE 99 CO 0.71 -0.00 1.10 -2.16 -1.23 0.00 0.00 174.94 173.36 1jdo s PRO 100 N 1.69 3.33 0.39 2.79 0.04 -1.26 -4.79 135.00 137.19 1jdo s PRO 100 Ca 0.06 1.48 0.14 0.00 0.04 0.00 0.00 61.00 62.72 1jdo s PRO 100 Cb -0.17 -2.01 0.99 0.00 0.04 0.00 0.00 34.50 33.34 1jdo s PRO 100 CO 0.09 -0.85 1.86 0.82 0.04 0.00 0.00 177.00 178.96 1jdo h ILE 101 N 0.97 0.72 -0.71 0.56 1.08 -1.90 0.58 117.51 118.81 1jdo h ILE 101 Ca -0.49 -0.17 0.11 0.00 -0.39 0.00 0.00 64.86 63.92 1jdo h ILE 101 Cb 1.25 0.18 -0.05 0.00 -3.07 0.00 0.00 36.82 35.13 1jdo h ILE 101 CO 0.57 0.09 0.47 0.50 -0.69 0.00 0.00 178.15 179.09 1jdo h LYS 102 N 0.50 0.52 0.00 2.37 1.63 -1.91 -1.03 116.57 118.65 1jdo h LYS 102 Ca 0.47 -0.03 -0.10 0.00 -0.85 0.00 0.00 60.65 60.14 1jdo h LYS 102 Cb 1.02 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 32.52 1jdo h LYS 102 CO -0.20 0.34 -0.47 1.88 -3.45 0.00 0.00 179.45 177.56 1jdo h TYR 103 N 0.53 0.00 -0.03 1.91 -1.99 -1.23 -2.26 116.97 113.90 1jdo h TYR 103 Ca 0.34 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.96 1jdo h TYR 103 Cb 0.59 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.30 1jdo h TYR 103 CO -0.00 0.47 -0.49 -0.07 -0.00 0.00 0.00 178.16 178.07 1jdo h LEU 104 N 0.00 0.07 -0.49 3.88 3.38 -1.18 -1.68 115.31 119.29 1jdo h LEU 104 Ca -0.00 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 1jdo h LEU 104 Cb 1.08 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 1jdo h LEU 104 CO 0.06 0.55 0.12 -0.33 0.09 0.00 0.00 178.44 178.93 1jdo h GLU 105 N 0.05 0.78 -0.71 1.13 5.08 -1.05 -1.72 114.58 118.14 1jdo h GLU 105 Ca -0.00 -0.19 0.02 0.00 -1.00 0.00 0.00 59.36 58.19 1jdo h GLU 105 Cb 0.89 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.99 1jdo h GLU 105 CO 0.07 0.76 0.46 0.74 -1.00 0.00 0.00 179.01 180.03 1jdo h PHE 106 N 0.67 0.86 0.00 4.33 0.04 -1.00 -1.51 116.94 120.33 1jdo h PHE 106 Ca 0.15 0.02 -0.11 0.00 2.80 0.00 0.00 57.97 60.83 1jdo h PHE 106 Cb 0.33 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 38.17 1jdo h PHE 106 CO 0.02 0.52 -0.54 0.97 -0.60 0.00 0.00 178.31 178.67 1jdo h ILE 107 N 0.91 1.16 -0.57 -0.55 2.10 -1.23 -2.19 117.51 117.14 1jdo h ILE 107 Ca 0.27 -2.04 0.01 0.00 1.08 0.00 0.00 64.86 64.19 1jdo h ILE 107 Cb -0.04 2.17 -0.03 0.00 -1.09 0.00 0.00 36.82 37.83 1jdo h ILE 107 CO -0.08 0.53 0.37 0.28 -1.08 0.00 0.00 178.15 178.17 1jdo h SER 108 N 0.00 0.63 -0.62 2.19 0.02 -0.82 -0.17 113.55 114.77 1jdo h SER 108 Ca -0.01 -0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 60.88 1jdo h SER 108 Cb 1.13 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.49 1jdo h SER 108 CO 0.07 0.45 0.20 -0.08 -1.14 0.00 0.00 176.83 176.33 1jdo h GLU 109 N 0.74 1.00 -0.43 3.45 4.81 -1.03 -1.90 114.58 121.23 1jdo h GLU 109 Ca 0.21 -0.20 -0.11 0.00 -0.13 0.00 0.00 59.36 59.14 1jdo h GLU 109 Cb -0.06 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.16 1jdo h GLU 109 CO -0.06 0.85 -0.17 0.00 -0.73 0.00 0.00 179.01 178.91 1jdo h ALA 110 N 1.26 0.89 -0.36 2.92 0.00 -0.94 -0.67 119.26 122.35 1jdo h ALA 110 Ca 0.21 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1jdo h ALA 110 Cb 0.27 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1jdo h ALA 110 CO -0.01 0.63 0.08 0.82 0.00 0.00 0.00 179.25 180.77 1jdo h ILE 111 N 0.73 1.23 -0.75 0.00 2.04 -0.77 -1.96 117.51 118.04 1jdo h ILE 111 Ca 0.11 -0.78 -0.02 0.00 1.00 0.00 0.00 64.86 65.17 1jdo h ILE 111 Cb 0.68 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.76 1jdo h ILE 111 CO 0.05 0.27 0.38 0.40 0.00 0.00 0.00 178.15 179.25 1jdo h ILE 112 N 0.44 1.23 -0.54 -0.67 2.04 -1.18 -1.00 117.51 117.84 1jdo h ILE 112 Ca 0.11 -0.63 -0.01 0.00 1.00 0.00 0.00 64.86 65.33 1jdo h ILE 112 Cb 0.32 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 1jdo h ILE 112 CO 0.00 0.27 0.29 -0.74 0.00 0.00 0.00 178.15 177.98 1jdo h HIS 113 N 1.04 0.74 -0.39 1.37 2.76 -0.94 -1.01 115.15 118.72 1jdo h HIS 113 Ca 0.26 -0.02 -0.16 0.00 -2.20 0.00 0.00 60.37 58.25 1jdo h HIS 113 Cb 0.08 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 28.80 1jdo h HIS 113 CO 0.00 0.54 -0.36 0.28 -1.30 0.00 0.00 177.93 177.09 1jdo h VAL 114 N 0.72 1.27 -0.51 5.26 2.07 -1.10 -1.35 116.25 122.60 1jdo h VAL 114 Ca 0.19 -1.54 -0.11 0.00 0.82 0.00 0.00 66.70 66.06 1jdo h VAL 114 Cb 0.05 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 1jdo h VAL 114 CO -0.03 0.52 -0.11 -0.07 0.02 0.00 0.00 177.57 177.90 1jdo h LEU 115 N 0.77 0.95 -1.05 2.57 3.38 -1.04 0.02 115.31 120.92 1jdo h LEU 115 Ca 0.07 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1jdo h LEU 115 Cb 0.95 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.40 1jdo h LEU 115 CO 0.09 1.07 0.58 -0.74 0.09 0.00 0.00 178.44 179.53 1jdo h HIS 116 N 0.85 1.18 -0.17 1.13 2.76 -1.07 0.14 115.15 119.98 1jdo h HIS 116 Ca 0.14 0.01 -0.16 0.00 -2.20 0.00 0.00 60.37 58.16 1jdo h HIS 116 Cb 0.65 -0.39 0.00 0.00 1.55 0.00 0.00 27.41 29.22 1jdo h HIS 116 CO 0.04 0.76 -0.52 0.77 -1.30 0.00 0.00 177.93 177.68 1jdo h SER 117 N 1.26 0.74 0.83 3.26 0.02 -0.84 -3.31 113.55 115.51 1jdo h SER 117 Ca 0.33 -0.60 -0.15 0.00 -0.84 0.00 0.00 61.79 60.54 1jdo h SER 117 Cb -0.10 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.19 1jdo h SER 117 CO -0.07 1.21 -1.25 0.03 -1.14 0.00 0.00 176.83 175.61 1jdo h ARG 118 N 0.32 0.00 -1.30 3.45 3.08 -0.84 -3.40 114.38 115.69 1jdo h ARG 118 Ca -0.02 0.00 -0.48 0.00 0.07 0.00 0.00 59.98 59.55 1jdo h ARG 118 Cb 1.14 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.78 1jdo h ARG 118 CO 0.11 0.30 -0.95 0.72 -1.07 0.00 0.00 179.97 179.07 1jdo n HIS 119 N -2.92 2.33 -0.06 3.04 8.25 0.49 -4.93 115.22 121.41 1jdo n HIS 119 Ca -0.07 -2.99 0.12 0.00 -0.26 0.00 0.00 57.72 54.51 1jdo n HIS 119 Cb 0.80 -0.23 0.51 0.00 1.12 0.00 0.00 29.99 32.19 1jdo n HIS 119 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1jdo h PRO 120 N 2.79 0.37 0.00 -0.41 0.13 -1.72 -0.36 132.00 132.80 1jdo h PRO 120 Ca 0.11 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1jdo h PRO 120 Cb 1.03 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.08 1jdo h PRO 120 CO 0.68 0.24 0.00 0.78 -0.23 0.00 0.00 178.00 179.48 1jdo h GLY 121 N 0.38 0.00 -0.53 1.56 0.00 -1.92 -2.95 103.07 99.60 1jdo h GLY 121 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1jdo h GLY 121 CO -0.07 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.17 1jdo n ASN 122 N -2.59 2.46 -2.78 0.19 3.02 -0.29 -4.70 115.26 110.56 1jdo n ASN 122 Ca 0.04 -2.14 -0.13 0.00 -0.03 0.00 0.00 54.58 52.32 1jdo n ASN 122 Cb 0.39 -0.14 0.01 0.00 -0.61 0.00 0.00 39.78 39.43 1jdo n ASN 122 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1jdo n PHE 123 N -0.22 1.12 -0.68 3.10 7.35 -0.35 -4.69 117.46 123.09 1jdo n PHE 123 Ca 0.06 -3.08 0.00 0.00 -0.76 0.00 0.00 57.45 53.67 1jdo n PHE 123 Cb 0.38 -0.37 0.00 0.00 0.35 0.00 0.00 39.48 39.83 1jdo n PHE 123 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1jdo n GLY 124 N -0.01 -1.38 0.26 7.13 0.00 -1.24 -4.63 105.19 105.31 1jdo n GLY 124 Ca 0.15 -1.61 -0.07 0.00 0.00 0.00 0.00 46.02 44.50 1jdo n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jdo h ALA 125 N -2.00 0.76 -0.46 4.61 0.00 -1.98 -0.76 119.26 119.43 1jdo h ALA 125 Ca 0.00 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1jdo h ALA 125 Cb 0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1jdo h ALA 125 CO 0.00 0.32 0.07 -0.44 0.00 0.00 0.00 179.25 179.20 1jdo h ASP 126 N 0.81 0.73 -0.40 0.00 3.32 -1.99 -0.07 116.42 118.81 1jdo h ASP 126 Ca 0.20 -0.26 -0.06 0.00 0.02 0.00 0.00 57.03 56.93 1jdo h ASP 126 Cb 0.10 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1jdo h ASP 126 CO -0.03 0.81 0.05 0.00 -1.72 0.00 0.00 179.24 178.35 1jdo h ALA 127 N 0.95 1.19 -0.49 3.45 0.00 -1.84 -0.93 119.26 121.59 1jdo h ALA 127 Ca 0.14 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 1jdo h ALA 127 Cb 0.39 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1jdo h ALA 127 CO 0.01 0.54 -0.18 0.37 0.00 0.00 0.00 179.25 179.99 1jdo h GLN 128 N 0.72 0.97 -0.81 0.00 4.15 -0.91 -1.01 115.11 118.22 1jdo h GLN 128 Ca 0.15 -0.39 0.00 0.00 0.77 0.00 0.00 58.65 59.18 1jdo h GLN 128 Cb 0.37 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 27.98 1jdo h GLN 128 CO 0.01 1.06 0.51 0.78 -1.93 0.00 0.00 178.83 179.27 1jdo h GLY 129 N 0.91 1.16 1.18 2.39 0.00 -0.75 -0.15 103.07 107.82 1jdo h GLY 129 Ca 0.12 -0.46 -0.14 0.00 0.00 0.00 0.00 47.33 46.84 1jdo h GLY 129 CO 0.06 0.45 -0.31 0.00 0.00 0.00 0.00 176.54 176.74 1jdo h ALA 130 N 1.28 0.67 -0.36 3.60 0.00 -0.81 -1.06 119.26 122.58 1jdo h ALA 130 Ca 0.30 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1jdo h ALA 130 Cb -0.08 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1jdo h ALA 130 CO -0.06 0.67 -0.23 1.98 0.00 0.00 0.00 179.25 181.61 1jdo h MET 131 N 0.77 0.72 -0.53 0.00 -1.53 -0.97 -0.49 114.93 112.89 1jdo h MET 131 Ca 0.08 -0.29 -0.01 0.00 -3.44 0.00 0.00 59.70 56.05 1jdo h MET 131 Cb 0.89 -0.03 -0.03 0.00 -0.55 0.00 0.00 31.60 31.88 1jdo h MET 131 CO 0.08 0.88 0.30 -0.97 0.14 0.00 0.00 176.91 177.35 1jdo h ASN 132 N 0.63 0.66 -0.65 1.39 -1.24 -0.87 -0.85 115.58 114.65 1jdo h ASN 132 Ca 0.09 -0.08 -0.03 0.00 0.71 0.00 0.00 56.30 56.99 1jdo h ASN 132 Cb 0.72 -0.17 -0.03 0.00 0.73 0.00 0.00 38.32 39.58 1jdo h ASN 132 CO 0.06 0.55 0.28 0.50 -1.29 0.00 0.00 177.43 177.53 1jdo h LYS 133 N 0.71 0.96 -0.83 6.67 3.64 -0.91 0.42 116.57 127.24 1jdo h LYS 133 Ca 0.19 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1jdo h LYS 133 Cb 0.03 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 31.64 1jdo h LYS 133 CO -0.03 0.79 0.48 0.00 -2.27 0.00 0.00 179.45 178.42 1jdo h ALA 134 N 1.12 1.29 0.01 5.00 0.00 -0.64 -1.03 119.26 125.02 1jdo h ALA 134 Ca 0.22 -0.10 -0.21 0.00 0.00 0.00 0.00 54.91 54.82 1jdo h ALA 134 Cb 0.17 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1jdo h ALA 134 CO -0.02 0.60 -0.91 -0.07 0.00 0.00 0.00 179.25 178.85 1jdo h LEU 135 N 1.15 0.30 -0.73 0.00 3.38 -0.79 -2.10 115.31 116.51 1jdo h LEU 135 Ca 0.30 -0.25 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1jdo h LEU 135 Cb -0.02 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 1jdo h LEU 135 CO -0.05 1.06 0.22 -0.33 0.09 0.00 0.00 178.44 179.43 1jdo h GLU 136 N 0.12 1.14 -0.08 1.13 5.08 -0.66 -0.47 114.58 120.85 1jdo h GLU 136 Ca -0.05 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.06 1jdo h GLU 136 Cb 1.55 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.63 1jdo h GLU 136 CO 0.14 0.98 0.05 1.25 -1.00 0.00 0.00 179.01 180.42 1jdo h LEU 137 N 1.09 0.09 -0.35 1.33 5.85 -1.05 0.57 115.31 122.84 1jdo h LEU 137 Ca 0.23 -0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.97 1jdo h LEU 137 Cb 0.32 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.25 1jdo h LEU 137 CO -0.01 0.12 -0.17 0.15 -0.34 0.00 0.00 178.44 178.20 1jdo h PHE 138 N 0.06 -0.41 -0.68 1.25 3.57 -1.26 -1.06 116.94 118.41 1jdo h PHE 138 Ca 0.03 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.51 1jdo h PHE 138 Cb 0.05 0.23 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 1jdo h PHE 138 CO -0.05 -0.24 0.19 0.00 -2.23 0.00 0.00 178.31 175.98 1jdo h ARG 139 N -0.11 1.05 -0.53 1.11 3.08 -0.87 -0.95 114.38 117.17 1jdo h ARG 139 Ca 0.18 -0.23 -0.09 0.00 0.07 0.00 0.00 59.98 59.91 1jdo h ARG 139 Cb 0.38 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1jdo h ARG 139 CO -0.42 0.91 -0.02 -0.22 -1.07 0.00 0.00 179.97 179.15 1jdo h LYS 140 N 1.01 0.95 -0.10 0.04 3.64 -0.56 0.30 116.57 121.86 1jdo h LYS 140 Ca 0.22 -0.31 -0.16 0.00 -1.27 0.00 0.00 60.65 59.13 1jdo h LYS 140 Cb 0.31 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1jdo h LYS 140 CO -0.00 0.97 -0.61 -0.44 -2.27 0.00 0.00 179.45 177.10 1jdo h ASP 141 N 0.82 0.39 -0.13 4.20 3.32 -1.04 -1.80 116.42 122.19 1jdo h ASP 141 Ca 0.15 -0.23 -0.16 0.00 0.02 0.00 0.00 57.03 56.81 1jdo h ASP 141 Cb 0.55 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1jdo h ASP 141 CO 0.03 0.91 -0.50 0.40 -1.72 0.00 0.00 179.24 178.36 1jdo h ILE 142 N 0.26 1.30 -0.85 0.35 1.08 -1.06 -2.39 117.51 116.19 1jdo h ILE 142 Ca -0.01 -1.70 0.01 0.00 -0.39 0.00 0.00 64.86 62.77 1jdo h ILE 142 Cb 1.13 1.63 -0.04 0.00 -3.07 0.00 0.00 36.82 36.47 1jdo h ILE 142 CO 0.10 0.54 0.57 0.00 -0.69 0.00 0.00 178.15 178.67 1jdo h ALA 143 N 0.89 1.40 -0.61 1.87 0.00 -0.72 0.53 119.26 122.62 1jdo h ALA 143 Ca 0.02 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1jdo h ALA 143 Cb 1.06 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1jdo h ALA 143 CO 0.10 0.55 0.02 0.00 0.00 0.00 0.00 179.25 179.92 1jdo h ALA 144 N 1.47 0.88 -0.31 0.00 0.00 -1.21 -2.07 119.26 118.02 1jdo h ALA 144 Ca 0.32 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 1jdo h ALA 144 Cb -0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1jdo h ALA 144 CO -0.07 0.66 -0.41 0.87 0.00 0.00 0.00 179.25 180.30 1jdo h LYS 145 N 0.97 0.76 -0.46 0.00 6.56 -0.91 -2.23 116.57 121.26 1jdo h LYS 145 Ca 0.18 -0.40 0.09 0.00 -1.06 0.00 0.00 60.65 59.45 1jdo h LYS 145 Cb 0.53 0.02 -0.08 0.00 -0.57 0.00 0.00 32.23 32.12 1jdo h LYS 145 CO 0.03 1.03 -0.06 1.88 -2.06 0.00 0.00 179.45 180.27 1jdo h TYR 146 N 0.62 -0.13 -0.40 -1.35 -1.99 -0.61 0.09 116.97 113.19 1jdo h TYR 146 Ca 0.05 0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.82 1jdo h TYR 146 Cb 0.97 0.13 -0.02 0.00 2.00 0.00 0.00 36.73 39.81 1jdo h TYR 146 CO 0.05 -0.15 0.26 -0.22 -0.00 0.00 0.00 178.16 178.11 1jdo h LYS 147 N 0.05 0.53 -0.37 4.88 3.64 -1.21 -0.93 116.57 123.16 1jdo h LYS 147 Ca 0.23 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 1jdo h LYS 147 Cb 0.34 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 1jdo h LYS 147 CO -0.43 0.35 0.20 0.93 -2.27 0.00 0.00 179.45 178.24 1jdo h GLU 148 N 0.54 0.50 -0.00 1.90 5.08 -0.67 -2.41 114.58 119.52 1jdo h GLU 148 Ca 0.15 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1jdo h GLU 148 Cb -0.06 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1jdo h GLU 148 CO -0.03 0.37 -0.13 1.28 -1.00 0.00 0.00 179.01 179.49 1jdo n LEU 149 N -4.44 0.22 0.00 1.33 4.77 -0.08 -4.93 117.00 113.87 1jdo n LEU 149 Ca 0.02 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 1jdo n LEU 149 Cb 0.09 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 1jdo n LEU 149 CO 0.36 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 1jdo n GLY 150 N 1.43 0.84 0.38 -0.72 0.00 -0.61 -4.98 105.19 101.52 1jdo n GLY 150 Ca 0.09 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.05 1jdo n GLY 150 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1jdo n TYR 151 N -1.95 0.00 -4.09 1.61 9.36 -0.45 -4.98 117.16 116.66 1jdo n TYR 151 Ca 0.00 0.00 -0.33 0.00 3.32 0.00 0.00 57.90 60.89 1jdo n TYR 151 Cb 0.00 -0.36 -0.06 0.00 -0.63 0.00 0.00 39.34 38.29 1jdo n TYR 151 CO 0.00 0.00 0.00 0.94 0.22 0.00 0.00 176.86 178.02 1jdo n GLN 152 N -4.17 -1.31 0.00 2.98 -0.06 -0.93 -4.87 117.38 109.02 1jdo n GLN 152 Ca -0.10 0.12 0.16 0.00 -2.00 0.00 0.00 57.00 55.18 1jdo n GLN 152 Cb 0.37 -4.69 0.95 0.00 -4.06 0.00 0.00 30.24 22.81 1jdo n GLN 152 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27