#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mbi s LEU 2 N 0.00 4.29 0.89 6.55 1.02 -1.26 -5.09 118.68 125.08 1mbi s LEU 2 Ca 0.00 0.74 -0.13 0.00 0.02 0.00 0.00 54.13 54.76 1mbi s LEU 2 Cb 0.00 -3.23 0.13 0.00 0.02 0.00 0.00 46.19 43.11 1mbi s LEU 2 CO 0.00 0.08 1.16 -0.94 0.02 0.00 0.00 176.35 176.67 1mbi s SER 3 N -2.12 3.71 0.22 2.29 1.04 -1.26 -4.86 113.70 112.71 1mbi s SER 3 Ca 0.39 0.86 -0.06 0.00 0.48 0.00 0.00 55.95 57.62 1mbi s SER 3 Cb -0.13 -1.37 0.18 0.00 0.10 0.00 0.00 66.02 64.81 1mbi s SER 3 CO 0.21 -2.41 1.68 -0.08 0.98 0.00 0.00 173.24 173.62 1mbi h GLU 4 N -1.41 0.93 -0.98 4.02 4.57 -1.99 -0.97 114.58 118.75 1mbi h GLU 4 Ca -0.49 -0.29 0.01 0.00 -1.18 0.00 0.00 59.36 57.41 1mbi h GLU 4 Cb 1.32 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 29.78 1mbi h GLU 4 CO 0.61 0.94 0.64 0.78 -1.18 0.00 0.00 179.01 180.80 1mbi h GLY 5 N 0.99 1.39 1.18 1.92 0.00 -1.99 -0.59 103.07 105.96 1mbi h GLY 5 Ca 0.15 -0.53 -0.21 0.00 0.00 0.00 0.00 47.33 46.74 1mbi h GLY 5 CO 0.03 0.52 -0.71 0.83 0.00 0.00 0.00 176.54 177.21 1mbi h GLU 6 N 1.34 0.82 -0.26 4.80 5.08 -1.83 -2.88 114.58 121.65 1mbi h GLU 6 Ca 0.36 -0.62 -0.07 0.00 -1.00 0.00 0.00 59.36 58.03 1mbi h GLU 6 Cb -0.13 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1mbi h GLU 6 CO -0.07 1.24 -0.14 -1.49 -1.00 0.00 0.00 179.01 177.54 1mbi h TRP 7 N 0.58 0.47 -0.36 4.33 -0.00 -0.74 -1.90 115.95 118.33 1mbi h TRP 7 Ca -0.03 -0.07 -0.09 0.00 -0.00 0.00 0.00 58.89 58.70 1mbi h TRP 7 Cb 1.33 -0.13 -0.02 0.00 -0.00 0.00 0.00 29.16 30.35 1mbi h TRP 7 CO 0.08 0.56 -0.15 1.96 -0.00 0.00 0.00 178.44 180.90 1mbi h GLN 8 N 0.40 0.64 -0.44 0.49 4.20 -1.11 0.50 115.11 119.81 1mbi h GLN 8 Ca 0.08 -0.21 -0.03 0.00 0.06 0.00 0.00 58.65 58.54 1mbi h GLN 8 Cb 0.49 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 1mbi h GLN 8 CO 0.03 0.77 0.15 -0.07 -0.67 0.00 0.00 178.83 179.04 1mbi h LEU 9 N 0.58 0.62 0.33 1.46 3.38 -1.23 -1.31 115.31 119.15 1mbi h LEU 9 Ca 0.10 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1mbi h LEU 9 Cb 0.59 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1mbi h LEU 9 CO 0.04 0.65 -0.16 0.58 0.09 0.00 0.00 178.44 179.64 1mbi h VAL 10 N 0.56 0.69 0.00 1.22 2.07 -0.91 -2.90 116.25 116.99 1mbi h VAL 10 Ca 0.14 -0.24 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 1mbi h VAL 10 Cb 0.24 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 1mbi h VAL 10 CO -0.01 0.05 -0.25 -0.07 0.02 0.00 0.00 177.57 177.32 1mbi h LEU 11 N -0.57 0.00 -0.21 2.57 3.38 -0.92 -1.88 115.31 117.67 1mbi h LEU 11 Ca -0.05 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.80 1mbi h LEU 11 Cb 0.42 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1mbi h LEU 11 CO 0.08 0.25 -0.36 -0.74 0.09 0.00 0.00 178.44 177.75 1mbi h HIS 12 N 0.00 0.77 -0.52 1.13 2.76 -1.20 -1.49 115.15 116.60 1mbi h HIS 12 Ca -0.00 -0.27 -0.12 0.00 -2.20 0.00 0.00 60.37 57.78 1mbi h HIS 12 Cb 0.65 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 29.45 1mbi h HIS 12 CO 0.00 1.02 -0.14 0.28 -1.30 0.00 0.00 177.93 177.79 1mbi h VAL 13 N 0.31 1.27 -0.75 5.26 2.07 -1.35 -3.11 116.25 119.95 1mbi h VAL 13 Ca 0.02 -1.30 0.02 0.00 0.82 0.00 0.00 66.70 66.26 1mbi h VAL 13 Cb 0.95 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.69 1mbi h VAL 13 CO 0.08 0.45 0.49 -0.25 0.02 0.00 0.00 177.57 178.37 1mbi h TRP 14 N 0.89 0.90 -0.03 1.57 2.91 -1.21 0.21 115.95 121.19 1mbi h TRP 14 Ca 0.13 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.18 1mbi h TRP 14 Cb 0.71 -0.30 -0.00 0.00 -0.51 0.00 0.00 29.16 29.05 1mbi h TRP 14 CO 0.05 0.54 0.02 0.00 -1.03 0.00 0.00 178.44 178.02 1mbi h ALA 15 N 1.55 1.90 -0.03 2.65 0.00 -1.20 -0.10 119.26 124.04 1mbi h ALA 15 Ca 0.29 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.95 1mbi h ALA 15 Cb -0.01 0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.79 1mbi h ALA 15 CO -0.08 -0.04 -0.97 0.87 0.00 0.00 0.00 179.25 179.03 1mbi h LYS 16 N 0.00 0.66 -0.73 0.00 1.79 -1.05 -3.19 116.57 114.04 1mbi h LYS 16 Ca 0.01 -0.67 -0.04 0.00 -2.18 0.00 0.00 60.65 57.77 1mbi h LYS 16 Cb 0.06 0.18 -0.03 0.00 -1.58 0.00 0.00 32.23 30.86 1mbi h LYS 16 CO -0.00 1.27 0.30 0.28 -1.08 0.00 0.00 179.45 180.21 1mbi h VAL 17 N 0.39 1.25 0.00 0.50 2.07 -0.29 -2.45 116.25 117.72 1mbi h VAL 17 Ca -0.11 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.65 1mbi h VAL 17 Cb 1.62 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1mbi h VAL 17 CO 0.19 0.31 0.00 -0.62 0.02 0.00 0.00 177.57 177.47 1mbi n GLU 18 N -4.29 0.14 0.05 1.57 1.02 -0.19 -1.51 120.64 117.41 1mbi n GLU 18 Ca 0.07 0.52 0.11 0.00 -0.02 0.00 0.00 57.16 57.84 1mbi n GLU 18 Cb 0.18 -1.85 0.44 0.00 -0.02 0.00 0.00 31.44 30.19 1mbi n GLU 18 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1mbi n ALA 19 N -1.73 1.91 -2.72 0.62 0.00 -0.92 -4.14 120.51 113.53 1mbi n ALA 19 Ca 0.00 -0.03 -0.07 0.00 0.00 0.00 0.00 53.44 53.35 1mbi n ALA 19 Cb 0.11 -1.36 0.07 0.00 0.00 0.00 0.00 19.45 18.27 1mbi n ALA 19 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1mbi n ASP 20 N -1.79 -2.31 -0.12 0.00 4.64 -0.57 -5.02 116.55 111.37 1mbi n ASP 20 Ca 0.04 -2.97 -0.08 0.00 -1.38 0.00 0.00 54.79 50.40 1mbi n ASP 20 Cb 0.26 1.58 -0.00 0.00 -1.04 0.00 0.00 41.12 41.92 1mbi n ASP 20 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 1mbi h VAL 21 N 2.44 1.11 -0.34 5.18 2.07 -1.66 -2.14 116.25 122.92 1mbi h VAL 21 Ca -0.17 -0.23 0.05 0.00 0.82 0.00 0.00 66.70 67.17 1mbi h VAL 21 Cb 1.10 0.57 -0.05 0.00 -1.52 0.00 0.00 31.29 31.39 1mbi h VAL 21 CO 0.15 0.11 0.05 0.00 0.02 0.00 0.00 177.57 177.90 1mbi h ALA 22 N 1.12 0.35 -0.40 1.67 0.00 -1.90 0.31 119.26 120.41 1mbi h ALA 22 Ca 0.14 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1mbi h ALA 22 Cb -0.03 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1mbi h ALA 22 CO -0.03 -0.35 0.16 0.78 0.00 0.00 0.00 179.25 179.81 1mbi h GLY 23 N 0.17 0.63 1.00 0.00 0.00 -1.93 0.12 103.07 103.06 1mbi h GLY 23 Ca 0.16 -0.34 -0.07 0.00 0.00 0.00 0.00 47.33 47.08 1mbi h GLY 23 CO -0.22 0.32 0.05 0.45 0.00 0.00 0.00 176.54 177.14 1mbi h HIS 24 N 0.49 0.93 -0.52 5.60 3.86 -1.15 -2.43 115.15 121.94 1mbi h HIS 24 Ca 0.13 -0.14 -0.02 0.00 -1.16 0.00 0.00 60.37 59.18 1mbi h HIS 24 Cb 0.18 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 1mbi h HIS 24 CO -0.00 0.85 0.24 0.78 0.86 0.00 0.00 177.93 180.66 1mbi h GLY 25 N 0.74 0.81 0.94 2.45 0.00 -0.14 -1.72 103.07 106.15 1mbi h GLY 25 Ca 0.15 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.05 1mbi h GLY 25 CO 0.02 0.39 -0.21 -1.61 0.00 0.00 0.00 176.54 175.12 1mbi h GLN 26 N 0.70 -0.57 -0.98 4.80 4.15 -0.89 -2.64 115.11 119.67 1mbi h GLN 26 Ca 0.18 0.04 0.06 0.00 0.77 0.00 0.00 58.65 59.70 1mbi h GLN 26 Cb 0.13 0.13 -0.07 0.00 0.21 0.00 0.00 27.48 27.89 1mbi h GLN 26 CO -0.02 -0.34 0.64 -0.44 -1.93 0.00 0.00 178.83 176.73 1mbi h ASP 27 N -0.66 1.01 -0.48 -0.69 3.32 -1.32 -1.64 116.42 115.97 1mbi h ASP 27 Ca -0.06 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.88 1mbi h ASP 27 Cb 0.49 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 1mbi h ASP 27 CO 0.10 0.65 -0.15 0.40 -1.72 0.00 0.00 179.24 178.52 1mbi h ILE 28 N 1.15 1.27 -0.33 0.35 2.04 -1.24 -1.53 117.51 119.22 1mbi h ILE 28 Ca 0.42 -1.29 -0.17 0.00 1.00 0.00 0.00 64.86 64.82 1mbi h ILE 28 Cb 0.17 1.10 -0.00 0.00 -0.74 0.00 0.00 36.82 37.35 1mbi h ILE 28 CO -0.17 0.45 -0.47 -0.07 0.00 0.00 0.00 178.15 177.89 1mbi h LEU 29 N 0.80 0.99 -0.63 1.44 3.38 -1.26 -0.34 115.31 119.70 1mbi h LEU 29 Ca 0.12 -0.50 -0.04 0.00 0.09 0.00 0.00 57.88 57.54 1mbi h LEU 29 Cb 0.71 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1mbi h LEU 29 CO 0.05 1.30 0.22 0.40 0.09 0.00 0.00 178.44 180.50 1mbi h ILE 30 N 0.71 1.24 -0.58 1.22 2.04 -1.32 0.45 117.51 121.27 1mbi h ILE 30 Ca 0.03 -0.80 -0.00 0.00 1.00 0.00 0.00 64.86 65.09 1mbi h ILE 30 Cb 1.08 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 1mbi h ILE 30 CO 0.11 0.31 0.35 -0.09 0.00 0.00 0.00 178.15 178.82 1mbi h ARG 31 N 0.89 0.80 0.05 2.37 9.65 -1.09 -0.29 114.38 126.75 1mbi h ARG 31 Ca 0.20 -0.08 -0.00 0.00 -1.10 0.00 0.00 59.98 59.01 1mbi h ARG 31 Cb 0.26 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.67 1mbi h ARG 31 CO -0.01 0.58 -0.02 1.25 2.80 0.00 0.00 179.97 184.57 1mbi h LEU 32 N 0.79 -0.05 -1.41 3.80 5.85 -0.75 -1.41 115.31 122.13 1mbi h LEU 32 Ca 0.21 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.86 1mbi h LEU 32 Cb -0.01 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1mbi h LEU 32 CO -0.04 -0.02 -0.15 -0.26 -0.34 0.00 0.00 178.44 177.63 1mbi h PHE 33 N -0.08 0.21 0.16 1.25 0.04 0.20 -1.80 116.94 116.91 1mbi h PHE 33 Ca -0.01 -0.02 -0.21 0.00 2.80 0.00 0.00 57.97 60.53 1mbi h PHE 33 Cb 0.06 -0.06 0.02 0.00 2.20 0.00 0.00 35.95 38.18 1mbi h PHE 33 CO -0.07 0.35 -0.90 0.87 -0.60 0.00 0.00 178.31 177.96 1mbi h LYS 34 N 0.19 0.33 -0.29 1.51 1.57 -0.98 -3.14 116.57 115.76 1mbi h LYS 34 Ca 0.04 -0.57 -0.12 0.00 -1.87 0.00 0.00 60.65 58.12 1mbi h LYS 34 Cb 0.39 0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 1mbi h LYS 34 CO 0.02 1.27 -0.33 0.77 -0.57 0.00 0.00 179.45 180.61 1mbi h SER 35 N -0.30 0.65 -2.56 0.86 0.02 -1.21 -3.38 113.55 107.63 1mbi h SER 35 Ca -0.16 -0.26 -0.59 0.00 -0.84 0.00 0.00 61.79 59.94 1mbi h SER 35 Cb 1.71 -0.18 -0.39 0.00 0.14 0.00 0.00 62.40 63.68 1mbi h SER 35 CO 0.17 0.93 -0.89 -1.00 -1.14 0.00 0.00 176.83 174.90 1mbi s HIS 36 N -4.39 1.44 0.66 3.45 3.76 -0.68 -4.99 115.29 114.54 1mbi s HIS 36 Ca -0.08 -2.38 0.45 0.00 -0.15 0.00 0.00 55.06 52.89 1mbi s HIS 36 Cb 0.13 -1.22 2.43 0.00 1.11 0.00 0.00 32.58 35.02 1mbi s HIS 36 CO 0.82 -0.79 2.37 -1.35 -0.85 0.00 0.00 174.74 174.95 1mbi h PRO 37 N 5.85 0.00 0.00 8.40 0.11 -1.73 0.20 132.00 144.83 1mbi h PRO 37 Ca 0.21 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.29 1mbi h PRO 37 Cb 0.90 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 1mbi h PRO 37 CO 0.41 0.00 -0.11 1.05 -0.21 0.00 0.00 178.00 179.14 1mbi h GLU 38 N 0.00 0.00 -0.17 1.05 9.09 -1.93 -2.69 114.58 119.94 1mbi h GLU 38 Ca -0.00 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.30 1mbi h GLU 38 Cb 0.01 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.09 1mbi h GLU 38 CO 0.00 0.11 -0.38 1.79 0.05 0.00 0.00 179.01 180.58 1mbi h THR 39 N 0.00 1.30 0.00 -1.06 1.35 -1.28 -2.84 112.91 110.38 1mbi h THR 39 Ca -0.00 -1.48 -0.01 0.00 -0.55 0.00 0.00 66.41 64.36 1mbi h THR 39 Cb 0.46 1.59 -0.00 0.00 -1.73 0.00 0.00 68.15 68.47 1mbi h THR 39 CO 0.01 0.45 -0.05 0.25 -0.25 0.00 0.00 175.52 175.93 1mbi h LEU 40 N 0.30 0.00 -2.22 3.87 5.85 -1.63 -2.45 115.31 119.03 1mbi h LEU 40 Ca 0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1mbi h LEU 40 Cb 0.81 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.84 1mbi h LEU 40 CO 0.06 0.05 0.00 -0.08 -0.34 0.00 0.00 178.44 178.14 1mbi h GLU 41 N 0.00 0.00 0.00 1.25 4.57 -1.60 -2.44 114.58 116.37 1mbi h GLU 41 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1mbi h GLU 41 Cb 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 1mbi h GLU 41 CO 0.01 0.00 0.00 1.63 -1.18 0.00 0.00 179.01 179.47 1mbi n LYS 42 N -2.93 0.19 -3.72 1.92 4.76 -0.92 -4.65 118.16 112.81 1mbi n LYS 42 Ca -0.01 0.16 -0.38 0.00 -2.87 0.00 0.00 58.31 55.21 1mbi n LYS 42 Cb 0.14 -1.73 -0.11 0.00 -1.84 0.00 0.00 35.03 31.50 1mbi n LYS 42 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1mbi s PHE 43 N -3.08 3.47 0.44 2.13 0.08 -0.92 -4.92 117.98 115.18 1mbi s PHE 43 Ca 0.11 -2.06 0.11 0.00 0.12 0.00 0.00 56.93 55.21 1mbi s PHE 43 Cb 0.14 -3.08 0.96 0.00 -0.57 0.00 0.00 43.02 40.48 1mbi s PHE 43 CO 0.58 -0.93 2.03 -0.44 -0.10 0.00 0.00 175.22 176.36 1mbi h ASP 44 N 8.19 0.22 0.79 1.36 3.32 -1.83 -1.65 116.42 126.81 1mbi h ASP 44 Ca -0.17 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.85 1mbi h ASP 44 Cb 1.06 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.56 1mbi h ASP 44 CO 0.72 0.24 0.00 -2.11 -1.72 0.00 0.00 179.24 176.37 1mbi n ARG 45 N -4.41 0.04 0.00 3.56 1.85 -1.26 -3.22 116.66 113.21 1mbi n ARG 45 Ca -0.00 0.08 0.00 0.00 -1.00 0.00 0.00 57.85 56.93 1mbi n ARG 45 Cb 0.15 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.06 1mbi n ARG 45 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1mbi n PHE 46 N -1.48 0.00 0.18 2.89 3.72 -0.70 -4.76 117.46 117.31 1mbi n PHE 46 Ca 0.06 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.54 1mbi n PHE 46 Cb 0.27 0.00 0.38 0.00 -0.94 0.00 0.00 39.48 39.20 1mbi n PHE 46 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1mbi n LYS 47 N -0.01 0.10 0.00 -1.08 2.85 -0.71 -1.92 118.16 117.39 1mbi n LYS 47 Ca 0.00 0.53 0.13 0.00 -1.05 0.00 0.00 58.31 57.92 1mbi n LYS 47 Cb 0.05 -1.78 0.45 0.00 -0.65 0.00 0.00 35.03 33.11 1mbi n LYS 47 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 177.40 174.96 1mbi n HIS 48 N -1.98 0.00 -3.07 5.58 1.44 -1.26 -4.86 115.22 111.08 1mbi n HIS 48 Ca -0.00 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.30 1mbi n HIS 48 Cb 0.07 -0.23 -0.06 0.00 0.12 0.00 0.00 29.99 29.89 1mbi n HIS 48 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1mbi s LEU 49 N -2.70 4.08 -0.11 2.39 1.43 -0.81 -4.92 118.68 118.03 1mbi s LEU 49 Ca 0.21 0.80 0.08 0.00 -1.03 0.00 0.00 54.13 54.18 1mbi s LEU 49 Cb 0.19 -2.93 -0.12 0.00 0.03 0.00 0.00 46.19 43.36 1mbi s LEU 49 CO 0.56 -0.38 0.00 0.29 0.23 0.00 0.00 176.35 177.05 1mbi n LYS 50 N 5.64 1.83 -4.47 1.70 5.02 -1.26 -4.99 118.16 121.63 1mbi n LYS 50 Ca 0.01 0.01 -0.25 0.00 -2.02 0.00 0.00 58.31 56.06 1mbi n LYS 50 Cb 0.49 -1.27 -0.10 0.00 -0.02 0.00 0.00 35.03 34.13 1mbi n LYS 50 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1mbi s THR 51 N -2.26 2.45 0.21 -0.18 -4.23 -1.26 -5.01 115.64 105.35 1mbi s THR 51 Ca -0.08 -2.20 -0.09 0.00 -1.18 0.00 0.00 61.69 58.13 1mbi s THR 51 Cb 0.04 -2.59 0.15 0.00 1.34 0.00 0.00 72.50 71.44 1mbi s THR 51 CO 0.41 -0.26 1.83 -0.08 -0.54 0.00 0.00 174.62 175.98 1mbi h GLU 52 N 2.04 1.07 -0.92 3.99 4.81 -1.98 -0.90 114.58 122.68 1mbi h GLU 52 Ca -0.42 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 58.69 1mbi h GLU 52 Cb 1.25 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 30.38 1mbi h GLU 52 CO 0.66 0.78 0.55 0.00 -0.73 0.00 0.00 179.01 180.28 1mbi h ALA 53 N 1.22 1.17 -0.36 2.92 0.00 -1.98 0.34 119.26 122.57 1mbi h ALA 53 Ca 0.27 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 1mbi h ALA 53 Cb 0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 1mbi h ALA 53 CO -0.05 0.64 -0.29 0.93 0.00 0.00 0.00 179.25 180.48 1mbi h GLU 54 N 1.27 0.77 -0.29 0.00 5.08 -1.77 -2.57 114.58 117.08 1mbi h GLU 54 Ca 0.33 -0.34 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1mbi h GLU 54 Cb -0.05 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1mbi h GLU 54 CO -0.06 0.96 0.16 0.52 -1.00 0.00 0.00 179.01 179.59 1mbi h MET 55 N 0.66 0.40 0.00 2.33 2.86 -0.50 -2.30 114.93 118.38 1mbi h MET 55 Ca 0.08 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 1mbi h MET 55 Cb 0.82 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.40 1mbi h MET 55 CO 0.07 0.35 -0.04 0.87 1.06 0.00 0.00 176.91 179.22 1mbi h LYS 56 N 0.35 0.00 -0.00 1.72 1.57 -0.23 -2.91 116.57 117.07 1mbi h LYS 56 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1mbi h LYS 56 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1mbi h LYS 56 CO -0.02 0.04 -0.50 0.00 -0.57 0.00 0.00 179.45 178.40 1mbi n ALA 57 N -2.19 3.59 -2.49 3.86 0.00 -0.89 -4.88 120.51 117.51 1mbi n ALA 57 Ca -0.02 -0.44 -0.43 0.00 0.00 0.00 0.00 53.44 52.55 1mbi n ALA 57 Cb 0.16 -1.03 -0.02 0.00 0.00 0.00 0.00 19.45 18.55 1mbi n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1mbi s SER 58 N -2.78 6.74 0.15 0.00 0.15 -1.07 -4.92 113.70 111.97 1mbi s SER 58 Ca 0.16 1.13 -0.01 0.00 0.70 0.00 0.00 55.95 57.94 1mbi s SER 58 Cb 0.18 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.91 1mbi s SER 58 CO 0.65 -1.03 1.35 -0.08 1.20 0.00 0.00 173.24 175.33 1mbi h GLU 59 N 8.97 0.29 -0.50 5.44 4.57 -1.89 -2.59 114.58 128.87 1mbi h GLU 59 Ca -0.25 -0.31 -0.07 0.00 -1.18 0.00 0.00 59.36 57.55 1mbi h GLU 59 Cb 1.09 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.74 1mbi h GLU 59 CO 1.04 1.02 0.01 0.22 -1.18 0.00 0.00 179.01 180.11 1mbi h ASP 60 N 0.17 0.79 -0.20 1.04 -0.00 -1.98 -0.82 116.42 115.42 1mbi h ASP 60 Ca -0.06 -0.19 -0.00 0.00 -0.00 0.00 0.00 57.03 56.78 1mbi h ASP 60 Cb 1.52 -0.21 -0.01 0.00 -0.00 0.00 0.00 39.33 40.63 1mbi h ASP 60 CO 0.15 0.85 0.11 0.25 -0.00 0.00 0.00 179.24 180.60 1mbi h LEU 61 N 0.77 0.25 -0.15 2.28 5.85 -1.88 -1.49 115.31 120.93 1mbi h LEU 61 Ca 0.15 -0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.85 1mbi h LEU 61 Cb 0.46 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.37 1mbi h LEU 61 CO 0.02 0.25 -0.21 0.50 -0.34 0.00 0.00 178.44 178.66 1mbi h LYS 62 N 0.23 -0.24 -0.98 1.25 3.64 -1.15 -0.88 116.57 118.43 1mbi h LYS 62 Ca 0.07 0.02 0.15 0.00 -1.27 0.00 0.00 60.65 59.62 1mbi h LYS 62 Cb 0.05 0.06 -0.09 0.00 -0.41 0.00 0.00 32.23 31.83 1mbi h LYS 62 CO -0.01 -0.16 0.60 0.87 -2.27 0.00 0.00 179.45 178.47 1mbi h LYS 63 N -0.25 0.84 -0.00 1.90 1.57 -1.01 -0.87 116.57 118.75 1mbi h LYS 63 Ca 0.11 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.74 1mbi h LYS 63 Cb 0.41 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1mbi h LYS 63 CO -0.30 0.56 -0.46 0.45 -0.57 0.00 0.00 179.45 179.13 1mbi h HIS 64 N 0.86 0.00 -0.48 -1.35 3.86 -0.13 -2.50 115.15 115.42 1mbi h HIS 64 Ca 0.52 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.70 1mbi h HIS 64 Cb 0.65 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.10 1mbi h HIS 64 CO -0.02 0.46 0.19 0.78 0.86 0.00 0.00 177.93 180.20 1mbi h GLY 65 N 1.38 0.77 1.67 2.45 0.00 0.09 -1.92 103.07 107.52 1mbi h GLY 65 Ca -0.00 -0.42 -0.08 0.00 0.00 0.00 0.00 47.33 46.82 1mbi h GLY 65 CO 0.06 0.40 -0.22 -2.08 0.00 0.00 0.00 176.54 174.70 1mbi h VAL 66 N 0.63 1.24 -0.43 4.60 2.07 -1.16 -2.15 116.25 121.05 1mbi h VAL 66 Ca 0.16 -1.14 -0.06 0.00 0.82 0.00 0.00 66.70 66.49 1mbi h VAL 66 Cb 0.20 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1mbi h VAL 66 CO -0.01 0.36 0.05 0.74 0.02 0.00 0.00 177.57 178.73 1mbi h THR 67 N 0.35 1.25 -0.14 2.57 2.02 -1.06 -1.40 112.91 116.50 1mbi h THR 67 Ca 0.06 -0.92 -0.04 0.00 0.77 0.00 0.00 66.41 66.27 1mbi h THR 67 Cb 0.58 1.01 -0.00 0.00 -1.74 0.00 0.00 68.15 68.00 1mbi h THR 67 CO 0.04 0.32 -0.08 0.58 0.37 0.00 0.00 175.52 176.75 1mbi h VAL 68 N 0.58 1.32 -0.23 3.16 2.07 -1.21 -2.75 116.25 119.20 1mbi h VAL 68 Ca 0.13 -1.14 -0.09 0.00 0.82 0.00 0.00 66.70 66.42 1mbi h VAL 68 Cb 0.40 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1mbi h VAL 68 CO 0.01 0.33 -0.24 -0.07 0.02 0.00 0.00 177.57 177.63 1mbi h LEU 69 N -0.05 0.41 -0.20 2.57 3.38 -1.38 -1.62 115.31 118.43 1mbi h LEU 69 Ca 0.03 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 1mbi h LEU 69 Cb 0.56 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1mbi h LEU 69 CO 0.02 0.66 0.03 0.74 0.09 0.00 0.00 178.44 179.97 1mbi h THR 70 N 0.37 1.23 -0.40 0.22 2.02 -1.26 0.57 112.91 115.66 1mbi h THR 70 Ca 0.06 -0.76 -0.06 0.00 0.77 0.00 0.00 66.41 66.41 1mbi h THR 70 Cb 0.62 1.36 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 1mbi h THR 70 CO 0.04 0.23 0.00 0.00 0.37 0.00 0.00 175.52 176.17 1mbi h ALA 71 N 0.82 0.54 -0.63 6.16 0.00 -1.45 -2.24 119.26 122.46 1mbi h ALA 71 Ca 0.06 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 1mbi h ALA 71 Cb 0.33 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1mbi h ALA 71 CO 0.01 0.31 0.18 1.25 0.00 0.00 0.00 179.25 181.00 1mbi h LEU 72 N 0.53 0.94 -1.08 0.00 5.85 -1.25 -2.57 115.31 117.73 1mbi h LEU 72 Ca 0.11 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 1mbi h LEU 72 Cb 0.47 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 1mbi h LEU 72 CO 0.02 0.91 0.52 1.23 -0.34 0.00 0.00 178.44 180.78 1mbi h GLY 73 N 0.92 1.22 1.61 3.75 0.00 -0.72 -0.59 103.07 109.27 1mbi h GLY 73 Ca 0.20 -0.50 -0.04 0.00 0.00 0.00 0.00 47.33 47.00 1mbi h GLY 73 CO -0.00 0.48 0.04 0.00 0.00 0.00 0.00 176.54 177.06 1mbi h ALA 74 N 1.41 1.45 0.00 3.60 0.00 -1.17 -1.98 119.26 122.56 1mbi h ALA 74 Ca 0.31 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1mbi h ALA 74 Cb -0.06 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1mbi h ALA 74 CO -0.06 0.40 -0.00 0.82 0.00 0.00 0.00 179.25 180.41 1mbi h ILE 75 N 0.48 1.49 -0.87 0.00 2.04 -0.87 -3.32 117.51 116.46 1mbi h ILE 75 Ca 0.11 -1.45 0.07 0.00 1.00 0.00 0.00 64.86 64.59 1mbi h ILE 75 Cb 0.26 2.48 -0.07 0.00 -0.74 0.00 0.00 36.82 38.75 1mbi h ILE 75 CO 0.00 0.38 0.54 -0.07 0.00 0.00 0.00 178.15 179.00 1mbi h LEU 76 N -0.62 0.83 0.00 1.44 3.38 -0.98 -1.82 115.31 117.54 1mbi h LEU 76 Ca -0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1mbi h LEU 76 Cb 0.62 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1mbi h LEU 76 CO 0.00 0.52 0.00 0.29 0.09 0.00 0.00 178.44 179.34 1mbi n LYS 77 N -4.63 0.48 0.00 1.13 5.02 -0.76 -1.38 118.16 118.02 1mbi n LYS 77 Ca 0.13 0.04 0.12 0.00 -2.02 0.00 0.00 58.31 56.58 1mbi n LYS 77 Cb 0.21 -1.50 0.15 0.00 -0.02 0.00 0.00 35.03 33.86 1mbi n LYS 77 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1mbi n LYS 78 N -1.12 0.99 -3.99 1.97 4.76 -0.68 -4.97 118.16 115.12 1mbi n LYS 78 Ca 0.13 -0.74 -0.34 0.00 -2.87 0.00 0.00 58.31 54.49 1mbi n LYS 78 Cb 0.10 -1.48 -0.01 0.00 -1.84 0.00 0.00 35.03 31.80 1mbi n LYS 78 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1mbi n LYS 79 N -0.36 -1.55 0.00 1.97 5.02 -0.48 -0.73 118.16 122.02 1mbi n LYS 79 Ca 0.10 0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.66 1mbi n LYS 79 Cb 0.41 -3.73 0.00 0.00 -0.02 0.00 0.00 35.03 31.69 1mbi n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mbi n GLY 80 N -2.05 3.15 2.68 0.72 0.00 -1.26 -4.92 105.19 103.50 1mbi n GLY 80 Ca -0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 1mbi n GLY 80 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1mbi n HIS 81 N -1.18 2.64 -1.23 1.61 8.25 0.09 -4.61 115.22 120.78 1mbi n HIS 81 Ca 0.00 -2.70 0.00 0.00 -0.26 0.00 0.00 57.72 54.76 1mbi n HIS 81 Cb 0.00 -1.58 0.23 0.00 1.12 0.00 0.00 29.99 29.75 1mbi n HIS 81 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1mbi n HIS 82 N 1.57 1.14 -0.13 4.41 1.44 -1.26 -4.76 115.22 117.62 1mbi n HIS 82 Ca 0.48 -1.29 -0.04 0.00 -2.01 0.00 0.00 57.72 54.85 1mbi n HIS 82 Cb 0.29 -0.44 0.04 0.00 0.12 0.00 0.00 29.99 29.99 1mbi n HIS 82 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 1mbi h GLU 83 N 1.35 0.17 0.00 -1.40 3.07 -1.99 -0.59 114.58 115.19 1mbi h GLU 83 Ca 0.15 -0.01 -0.10 0.00 -0.50 0.00 0.00 59.36 58.90 1mbi h GLU 83 Cb 1.64 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 29.50 1mbi h GLU 83 CO 0.36 0.11 -0.48 0.00 -1.40 0.00 0.00 179.01 177.60 1mbi h ALA 84 N 1.34 1.13 0.02 3.43 0.00 -2.00 -2.49 119.26 120.68 1mbi h ALA 84 Ca 0.21 -0.43 -0.27 0.00 0.00 0.00 0.00 54.91 54.41 1mbi h ALA 84 Cb 0.27 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1mbi h ALA 84 CO -0.30 0.60 -1.44 0.93 0.00 0.00 0.00 179.25 179.04 1mbi h GLU 85 N 0.00 0.04 0.09 0.00 3.07 -1.85 -3.36 114.58 112.57 1mbi h GLU 85 Ca -0.00 -0.07 -0.26 0.00 -0.50 0.00 0.00 59.36 58.53 1mbi h GLU 85 Cb 0.89 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.82 1mbi h GLU 85 CO 0.06 0.77 -1.20 1.25 -1.40 0.00 0.00 179.01 178.49 1mbi h LEU 86 N 0.01 0.30 0.24 1.33 6.46 -1.05 -3.35 115.31 119.24 1mbi h LEU 86 Ca -0.19 -0.33 -0.00 0.00 -0.12 0.00 0.00 57.88 57.24 1mbi h LEU 86 Cb 1.93 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 41.75 1mbi h LEU 86 CO 0.11 1.26 -0.17 0.50 -0.62 0.00 0.00 178.44 179.52 1mbi h LYS 87 N 0.05 -0.39 0.00 1.25 3.64 -1.59 -0.60 116.57 118.94 1mbi h LYS 87 Ca -0.11 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 1mbi h LYS 87 Cb 1.92 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 33.82 1mbi h LYS 87 CO 0.18 -0.26 -0.11 -1.35 -2.27 0.00 0.00 179.45 175.64 1mbi h PRO 88 N -0.40 0.00 0.10 1.90 0.11 -1.76 -2.11 132.00 129.84 1mbi h PRO 88 Ca -0.02 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 1mbi h PRO 88 Cb 0.35 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.46 1mbi h PRO 88 CO 0.00 0.11 -0.05 1.25 -0.21 0.00 0.00 178.00 179.10 1mbi h LEU 89 N 0.00 -0.12 -0.54 2.35 6.46 -1.54 -2.12 115.31 119.80 1mbi h LEU 89 Ca -0.00 -0.33 0.01 0.00 -0.12 0.00 0.00 57.88 57.44 1mbi h LEU 89 Cb 0.19 0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 40.13 1mbi h LEU 89 CO 0.01 0.29 0.35 0.00 -0.62 0.00 0.00 178.44 178.47 1mbi h ALA 90 N 0.28 0.69 -0.39 1.25 0.00 -0.90 -1.74 119.26 118.44 1mbi h ALA 90 Ca -0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1mbi h ALA 90 Cb 0.45 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1mbi h ALA 90 CO 0.02 0.10 0.19 1.96 0.00 0.00 0.00 179.25 181.53 1mbi h GLN 91 N 0.71 0.56 -0.34 0.00 4.20 -1.33 0.03 115.11 118.94 1mbi h GLN 91 Ca 0.20 -0.08 -0.11 0.00 0.06 0.00 0.00 58.65 58.72 1mbi h GLN 91 Cb -0.06 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 1mbi h GLN 91 CO -0.06 0.49 -0.21 0.66 -0.67 0.00 0.00 178.83 179.05 1mbi h SER 92 N 0.50 0.78 0.46 1.46 4.64 -1.24 -2.60 113.55 117.54 1mbi h SER 92 Ca 0.14 -0.42 -0.12 0.00 -0.47 0.00 0.00 61.79 60.91 1mbi h SER 92 Cb 0.11 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 61.97 1mbi h SER 92 CO -0.02 1.03 -0.53 0.45 -0.87 0.00 0.00 176.83 176.89 1mbi h HIS 93 N 0.52 0.10 0.19 4.77 3.86 -1.15 0.31 115.15 123.74 1mbi h HIS 93 Ca 0.07 -0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.24 1mbi h HIS 93 Cb 0.76 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.21 1mbi h HIS 93 CO 0.06 0.59 -0.09 0.00 0.86 0.00 0.00 177.93 179.36 1mbi h ALA 94 N 1.40 -0.25 0.00 2.45 0.00 -1.05 0.45 119.26 122.27 1mbi h ALA 94 Ca -0.00 -0.12 -0.24 0.00 0.00 0.00 0.00 54.91 54.54 1mbi h ALA 94 Cb 0.96 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 1mbi h ALA 94 CO 0.07 -0.25 -1.45 1.79 0.00 0.00 0.00 179.25 179.41 1mbi h THR 95 N -1.03 0.95 0.00 0.00 1.35 -1.53 -3.22 112.91 109.43 1mbi h THR 95 Ca -0.03 -2.68 0.00 0.00 -0.55 0.00 0.00 66.41 63.15 1mbi h THR 95 Cb 0.32 2.43 0.00 0.00 -1.73 0.00 0.00 68.15 69.17 1mbi h THR 95 CO 0.04 0.54 -0.19 0.29 -0.25 0.00 0.00 175.52 175.95 1mbi n LYS 96 N -3.08 0.11 0.22 4.72 4.76 0.38 -4.67 118.16 120.59 1mbi n LYS 96 Ca -0.11 0.10 0.12 0.00 -2.87 0.00 0.00 58.31 55.54 1mbi n LYS 96 Cb 0.97 -0.74 0.22 0.00 -1.84 0.00 0.00 35.03 33.64 1mbi n LYS 96 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1mbi h HIS 97 N -0.21 0.00 -5.64 2.13 3.86 -0.68 -3.48 115.15 111.13 1mbi h HIS 97 Ca 0.00 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 58.96 1mbi h HIS 97 Cb 0.19 0.00 0.13 0.00 1.06 0.00 0.00 27.41 28.79 1mbi h HIS 97 CO -0.08 0.05 -0.72 1.63 0.86 0.00 0.00 177.93 179.67 1mbi n LYS 98 N -3.12 -1.83 -3.56 2.45 5.02 -0.41 -5.00 118.16 111.71 1mbi n LYS 98 Ca 0.03 0.90 -0.40 0.00 -2.02 0.00 0.00 58.31 56.83 1mbi n LYS 98 Cb 0.52 -5.36 -0.11 0.00 -0.02 0.00 0.00 35.03 30.07 1mbi n LYS 98 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1mbi s ILE 99 N -3.32 5.15 0.63 -0.18 -1.09 0.15 -5.01 121.20 117.53 1mbi s ILE 99 Ca 0.36 -0.24 -0.18 0.00 -2.23 0.00 0.00 60.65 58.37 1mbi s ILE 99 Cb -0.07 -3.63 -0.02 0.00 -1.58 0.00 0.00 42.46 37.16 1mbi s ILE 99 CO 0.77 0.02 1.20 -2.84 -1.23 0.00 0.00 174.94 172.86 1mbi s PRO 100 N 1.70 2.77 0.40 2.79 0.02 -1.26 -4.68 135.00 136.74 1mbi s PRO 100 Ca 0.06 1.77 0.15 0.00 0.02 0.00 0.00 61.00 63.00 1mbi s PRO 100 Cb -0.17 -1.91 1.01 0.00 0.02 0.00 0.00 34.50 33.45 1mbi s PRO 100 CO 0.10 -1.35 1.85 0.82 -0.33 0.00 0.00 177.00 178.08 1mbi h ILE 101 N 0.54 0.70 -0.88 2.83 1.08 -1.33 -1.87 117.51 118.58 1mbi h ILE 101 Ca -0.49 -0.17 0.15 0.00 -0.39 0.00 0.00 64.86 63.96 1mbi h ILE 101 Cb 1.29 0.17 -0.07 0.00 -3.07 0.00 0.00 36.82 35.15 1mbi h ILE 101 CO 0.54 0.09 0.57 0.50 -0.69 0.00 0.00 178.15 179.16 1mbi h LYS 102 N 0.49 0.62 0.00 2.37 1.63 -1.90 0.16 116.57 119.93 1mbi h LYS 102 Ca 0.48 -0.04 -0.08 0.00 -0.85 0.00 0.00 60.65 60.17 1mbi h LYS 102 Cb 1.08 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 32.56 1mbi h LYS 102 CO -0.20 0.41 -0.36 1.88 -3.45 0.00 0.00 179.45 177.72 1mbi h TYR 103 N 0.64 0.00 -0.06 1.91 0.99 -1.70 -0.81 116.97 117.94 1mbi h TYR 103 Ca 0.45 0.00 -0.16 0.00 2.00 0.00 0.00 58.73 61.02 1mbi h TYR 103 Cb 0.78 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 38.50 1mbi h TYR 103 CO -0.00 0.36 -0.65 -0.07 -0.00 0.00 0.00 178.16 177.80 1mbi h LEU 104 N 0.00 0.29 -0.45 3.88 3.38 -0.77 -0.88 115.31 120.76 1mbi h LEU 104 Ca -0.00 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 1mbi h LEU 104 Cb 0.93 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 1mbi h LEU 104 CO 0.05 0.87 0.10 -0.08 0.09 0.00 0.00 178.44 179.46 1mbi h GLU 105 N 0.18 0.73 -0.10 1.13 4.81 -0.73 -1.79 114.58 118.81 1mbi h GLU 105 Ca -0.01 -0.18 0.01 0.00 -0.13 0.00 0.00 59.36 59.04 1mbi h GLU 105 Cb 1.18 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 1mbi h GLU 105 CO 0.10 0.73 0.03 0.74 -0.73 0.00 0.00 179.01 179.89 1mbi h PHE 106 N 0.60 0.05 -0.20 0.92 0.05 -0.87 -2.55 116.94 114.95 1mbi h PHE 106 Ca 0.14 0.01 -0.08 0.00 3.82 0.00 0.00 57.97 61.86 1mbi h PHE 106 Cb 0.34 -0.01 -0.01 0.00 2.00 0.00 0.00 35.95 38.27 1mbi h PHE 106 CO 0.02 0.03 -0.22 0.97 -0.18 0.00 0.00 178.31 178.93 1mbi h ILE 107 N 0.08 1.24 -0.63 -0.55 2.10 -1.10 -1.99 117.51 116.66 1mbi h ILE 107 Ca 0.04 -1.13 0.05 0.00 1.08 0.00 0.00 64.86 64.90 1mbi h ILE 107 Cb 0.02 1.34 -0.05 0.00 -1.09 0.00 0.00 36.82 37.05 1mbi h ILE 107 CO -0.04 0.35 0.36 0.28 -1.08 0.00 0.00 178.15 178.02 1mbi h SER 108 N 0.32 0.56 -0.28 2.19 0.02 -1.20 -0.66 113.55 114.50 1mbi h SER 108 Ca 0.05 0.02 -0.08 0.00 -0.84 0.00 0.00 61.79 60.94 1mbi h SER 108 Cb 0.57 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 1mbi h SER 108 CO 0.04 0.37 -0.09 -0.33 -1.14 0.00 0.00 176.83 175.68 1mbi h GLU 109 N 0.69 0.67 -0.54 3.45 4.39 -1.02 -1.84 114.58 120.39 1mbi h GLU 109 Ca 0.27 -0.20 -0.07 0.00 0.34 0.00 0.00 59.36 59.70 1mbi h GLU 109 Cb 0.12 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 1mbi h GLU 109 CO -0.15 0.75 0.05 0.00 -1.16 0.00 0.00 179.01 178.50 1mbi h ALA 110 N 1.28 1.07 -0.15 3.43 0.00 -0.64 -0.79 119.26 123.46 1mbi h ALA 110 Ca 0.11 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1mbi h ALA 110 Cb 0.52 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1mbi h ALA 110 CO 0.03 0.59 0.01 0.82 0.00 0.00 0.00 179.25 180.71 1mbi h ILE 111 N 0.83 1.24 -0.54 0.00 2.04 -0.80 -2.10 117.51 118.18 1mbi h ILE 111 Ca 0.16 -0.78 -0.03 0.00 1.00 0.00 0.00 64.86 65.22 1mbi h ILE 111 Cb 0.43 1.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 1mbi h ILE 111 CO 0.01 0.23 0.23 0.40 0.00 0.00 0.00 178.15 179.03 1mbi h ILE 112 N 0.02 1.21 -0.19 -0.67 2.04 -1.26 -1.49 117.51 117.18 1mbi h ILE 112 Ca 0.04 -0.64 0.03 0.00 1.00 0.00 0.00 64.86 65.30 1mbi h ILE 112 Cb 0.34 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 1mbi h ILE 112 CO 0.01 0.25 -0.02 -0.74 0.00 0.00 0.00 178.15 177.64 1mbi h HIS 113 N 0.73 -0.05 -0.21 1.37 2.76 -1.01 -2.56 115.15 116.16 1mbi h HIS 113 Ca 0.18 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.35 1mbi h HIS 113 Cb 0.17 0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.18 1mbi h HIS 113 CO 0.00 -0.05 0.08 0.28 -1.30 0.00 0.00 177.93 176.94 1mbi h VAL 114 N 0.03 1.18 -0.95 5.26 2.07 -1.24 -2.86 116.25 119.74 1mbi h VAL 114 Ca 0.09 -0.55 0.13 0.00 0.82 0.00 0.00 66.70 67.18 1mbi h VAL 114 Cb 0.13 1.14 -0.08 0.00 -1.52 0.00 0.00 31.29 30.96 1mbi h VAL 114 CO -0.17 0.18 0.60 -0.07 0.02 0.00 0.00 177.57 178.13 1mbi h LEU 115 N 0.18 0.82 -1.33 2.57 3.38 -1.17 0.17 115.31 119.93 1mbi h LEU 115 Ca 0.07 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 1mbi h LEU 115 Cb 0.21 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1mbi h LEU 115 CO -0.00 0.43 -0.33 -0.74 0.09 0.00 0.00 178.44 177.89 1mbi h HIS 116 N 0.87 0.00 0.02 1.13 2.76 -1.36 -0.95 115.15 117.62 1mbi h HIS 116 Ca 0.47 0.00 -0.20 0.00 -2.20 0.00 0.00 60.37 58.43 1mbi h HIS 116 Cb 0.56 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.50 1mbi h HIS 116 CO -0.00 0.33 -0.94 0.77 -1.30 0.00 0.00 177.93 176.79 1mbi h SER 117 N 0.00 0.17 -0.00 3.26 0.02 -0.77 -3.23 113.55 112.99 1mbi h SER 117 Ca -0.00 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1mbi h SER 117 Cb 0.61 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.10 1mbi h SER 117 CO 0.04 1.01 -0.57 0.54 -1.14 0.00 0.00 176.83 176.71 1mbi n ARG 118 N -3.56 1.94 -2.92 3.45 1.74 -0.68 -4.67 116.66 111.96 1mbi n ARG 118 Ca -0.03 -0.28 -0.13 0.00 -0.77 0.00 0.00 57.85 56.64 1mbi n ARG 118 Cb 0.86 -1.23 0.02 0.00 -1.02 0.00 0.00 32.46 31.09 1mbi n ARG 118 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1mbi n HIS 119 N -0.92 -0.18 0.25 -1.55 8.25 -0.37 -4.95 115.22 115.75 1mbi n HIS 119 Ca 0.04 -3.11 0.17 0.00 -0.26 0.00 0.00 57.72 54.57 1mbi n HIS 119 Cb 0.27 0.05 0.89 0.00 1.12 0.00 0.00 29.99 32.33 1mbi n HIS 119 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1mbi h PRO 120 N 2.91 0.00 0.02 -0.41 0.13 -1.75 -1.50 132.00 131.41 1mbi h PRO 120 Ca -0.02 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.06 1mbi h PRO 120 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1mbi h PRO 120 CO 0.40 0.00 -0.19 0.78 -0.23 0.00 0.00 178.00 178.76 1mbi h GLY 121 N 0.00 0.10 -0.45 1.56 0.00 -1.92 -3.33 103.07 99.03 1mbi h GLY 121 Ca 0.05 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1mbi h GLY 121 CO -0.00 0.19 0.00 1.22 0.00 0.00 0.00 176.54 177.95 1mbi n ASP 122 N -4.52 1.43 -3.23 0.19 9.92 -1.16 -4.38 116.55 114.79 1mbi n ASP 122 Ca -0.10 -1.52 -0.26 0.00 -0.53 0.00 0.00 54.79 52.38 1mbi n ASP 122 Cb 0.53 -0.03 -0.06 0.00 -0.64 0.00 0.00 41.12 40.92 1mbi n ASP 122 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 1mbi n PHE 123 N 0.12 2.96 -2.01 1.24 7.35 -0.57 -4.78 117.46 121.77 1mbi n PHE 123 Ca 0.19 -4.01 -0.29 0.00 -0.76 0.00 0.00 57.45 52.58 1mbi n PHE 123 Cb 0.33 -0.50 0.17 0.00 0.35 0.00 0.00 39.48 39.83 1mbi n PHE 123 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1mbi s GLY 124 N -2.59 1.76 0.27 7.13 0.00 -1.26 -4.73 107.32 107.89 1mbi s GLY 124 Ca 0.42 -1.21 -0.00 0.00 0.00 0.00 0.00 44.72 43.92 1mbi s GLY 124 CO -0.07 -0.50 1.79 0.00 0.00 0.00 0.00 173.10 174.33 1mbi h ALA 125 N -1.44 1.37 -0.51 3.20 0.00 -1.97 0.23 119.26 120.14 1mbi h ALA 125 Ca -0.44 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.43 1mbi h ALA 125 Cb 1.25 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 1mbi h ALA 125 CO 0.41 0.04 -0.06 0.38 0.00 0.00 0.00 179.25 180.02 1mbi h ASP 126 N 0.78 0.89 0.44 0.00 -0.00 -1.99 -0.44 116.42 116.10 1mbi h ASP 126 Ca 0.47 -0.26 -0.19 0.00 -0.00 0.00 0.00 57.03 57.05 1mbi h ASP 126 Cb 0.57 -0.24 -0.01 0.00 -0.00 0.00 0.00 39.33 39.65 1mbi h ASP 126 CO -0.31 0.99 -0.80 0.00 -0.00 0.00 0.00 179.24 179.12 1mbi h ALA 127 N 1.10 0.59 -0.53 4.15 0.00 -1.55 -2.39 119.26 120.62 1mbi h ALA 127 Ca 0.14 -0.66 -0.11 0.00 0.00 0.00 0.00 54.91 54.28 1mbi h ALA 127 Cb 0.58 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1mbi h ALA 127 CO 0.04 0.83 -0.12 0.37 0.00 0.00 0.00 179.25 180.37 1mbi h GLN 128 N 0.17 1.01 -0.56 0.00 4.15 -0.37 -1.10 115.11 118.40 1mbi h GLN 128 Ca -0.04 -0.37 -0.06 0.00 0.77 0.00 0.00 58.65 58.94 1mbi h GLN 128 Cb 1.39 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.99 1mbi h GLN 128 CO 0.13 1.06 0.10 0.78 -1.93 0.00 0.00 178.83 178.96 1mbi h GLY 129 N 0.94 1.00 0.90 2.39 0.00 -1.04 -0.72 103.07 106.53 1mbi h GLY 129 Ca 0.14 -0.66 -0.06 0.00 0.00 0.00 0.00 47.33 46.75 1mbi h GLY 129 CO 0.05 0.61 -0.02 0.00 0.00 0.00 0.00 176.54 177.18 1mbi h ALA 130 N 1.00 0.44 -0.74 3.60 0.00 -1.32 -2.20 119.26 120.04 1mbi h ALA 130 Ca 0.17 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.85 1mbi h ALA 130 Cb 0.40 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1mbi h ALA 130 CO 0.01 0.22 0.47 1.98 0.00 0.00 0.00 179.25 181.93 1mbi h MET 131 N 0.38 0.90 0.04 0.00 -1.53 -1.12 -1.15 114.93 112.45 1mbi h MET 131 Ca 0.09 -0.05 -0.00 0.00 -3.44 0.00 0.00 59.70 56.29 1mbi h MET 131 Cb 0.48 -0.20 0.00 0.00 -0.55 0.00 0.00 31.60 31.33 1mbi h MET 131 CO 0.02 0.60 -0.02 -0.91 0.14 0.00 0.00 176.91 176.74 1mbi h ASN 132 N 0.93 -0.04 -0.89 1.39 4.21 -1.02 -1.66 115.58 118.50 1mbi h ASN 132 Ca 0.29 -0.01 0.04 0.00 1.21 0.00 0.00 56.30 57.84 1mbi h ASN 132 Cb -0.01 0.01 -0.05 0.00 -1.12 0.00 0.00 38.32 37.15 1mbi h ASN 132 CO -0.10 -0.02 0.58 0.11 -1.29 0.00 0.00 177.43 176.71 1mbi h LYS 133 N -0.06 1.04 -0.34 0.81 1.57 -1.05 -0.65 116.57 117.89 1mbi h LYS 133 Ca -0.01 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1mbi h LYS 133 Cb 0.05 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1mbi h LYS 133 CO 0.01 0.69 0.09 0.00 -0.57 0.00 0.00 179.45 179.67 1mbi h ALA 134 N 1.49 0.45 -0.00 3.86 0.00 -0.95 -1.88 119.26 122.23 1mbi h ALA 134 Ca 0.36 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 1mbi h ALA 134 Cb 0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1mbi h ALA 134 CO -0.12 0.11 -0.52 -0.07 0.00 0.00 0.00 179.25 178.66 1mbi h LEU 135 N 0.40 0.01 -0.58 0.00 3.38 -1.03 -2.51 115.31 114.97 1mbi h LEU 135 Ca 0.11 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.94 1mbi h LEU 135 Cb 0.28 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1mbi h LEU 135 CO -0.00 0.52 -0.34 -0.33 0.09 0.00 0.00 178.44 178.38 1mbi h GLU 136 N 0.00 0.75 -0.19 1.13 5.08 -0.99 -1.96 114.58 118.41 1mbi h GLU 136 Ca -0.00 -0.36 -0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1mbi h GLU 136 Cb 0.91 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 1mbi h GLU 136 CO 0.07 0.98 0.11 1.25 -1.00 0.00 0.00 179.01 180.42 1mbi h LEU 137 N 0.63 0.24 -0.28 1.33 5.85 -1.12 0.24 115.31 122.20 1mbi h LEU 137 Ca 0.06 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.77 1mbi h LEU 137 Cb 0.88 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.80 1mbi h LEU 137 CO 0.08 0.24 -0.08 0.15 -0.34 0.00 0.00 178.44 178.49 1mbi h PHE 138 N 0.22 -0.17 -0.52 1.25 3.04 -1.40 0.03 116.94 119.38 1mbi h PHE 138 Ca 0.07 0.03 -0.08 0.00 3.98 0.00 0.00 57.97 61.96 1mbi h PHE 138 Cb 0.05 0.12 -0.02 0.00 2.56 0.00 0.00 35.95 38.66 1mbi h PHE 138 CO -0.04 -0.13 -0.01 0.00 -2.02 0.00 0.00 178.31 176.11 1mbi h ARG 139 N -0.01 0.88 -0.25 1.11 3.08 -1.12 -1.45 114.38 116.62 1mbi h ARG 139 Ca 0.14 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.89 1mbi h ARG 139 Cb 0.22 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 1mbi h ARG 139 CO -0.29 0.88 -0.01 -0.22 -1.07 0.00 0.00 179.97 179.26 1mbi h LYS 140 N 0.81 0.46 -0.47 0.04 3.64 -0.66 -0.23 116.57 120.16 1mbi h LYS 140 Ca 0.15 -0.15 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 1mbi h LYS 140 Cb 0.50 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 1mbi h LYS 140 CO 0.02 0.64 0.08 -0.44 -2.27 0.00 0.00 179.45 177.48 1mbi h ASP 141 N 0.23 0.69 -0.17 4.20 3.32 -0.86 -2.59 116.42 121.23 1mbi h ASP 141 Ca 0.07 -0.13 -0.07 0.00 0.02 0.00 0.00 57.03 56.92 1mbi h ASP 141 Cb 0.44 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 1mbi h ASP 141 CO 0.02 0.71 -0.16 0.40 -1.72 0.00 0.00 179.24 178.49 1mbi h ILE 142 N 0.71 1.34 -0.85 0.35 1.08 -1.11 -3.08 117.51 115.94 1mbi h ILE 142 Ca 0.15 -1.31 0.18 0.00 -0.39 0.00 0.00 64.86 63.49 1mbi h ILE 142 Cb 0.32 1.81 -0.06 0.00 -3.07 0.00 0.00 36.82 35.83 1mbi h ILE 142 CO 0.00 0.39 0.56 0.00 -0.69 0.00 0.00 178.15 178.42 1mbi h ALA 143 N 0.63 2.16 -0.05 1.87 0.00 -0.91 0.41 119.26 123.37 1mbi h ALA 143 Ca 0.03 0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 1mbi h ALA 143 Cb 0.69 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1mbi h ALA 143 CO 0.04 -0.41 -0.76 0.00 0.00 0.00 0.00 179.25 178.11 1mbi h ALA 144 N 1.62 0.60 -0.37 0.00 0.00 -1.38 0.02 119.26 119.75 1mbi h ALA 144 Ca 0.43 -0.64 -0.14 0.00 0.00 0.00 0.00 54.91 54.56 1mbi h ALA 144 Cb 1.03 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1mbi h ALA 144 CO -0.16 0.80 -0.33 0.87 0.00 0.00 0.00 179.25 180.43 1mbi h LYS 145 N 0.20 0.85 -0.42 0.00 1.79 -1.10 -2.63 116.57 115.26 1mbi h LYS 145 Ca -0.03 -0.41 -0.02 0.00 -2.18 0.00 0.00 60.65 58.00 1mbi h LYS 145 Cb 1.35 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.97 1mbi h LYS 145 CO 0.12 1.05 0.18 1.88 -1.08 0.00 0.00 179.45 181.61 1mbi h TYR 146 N 0.71 0.62 -0.90 -1.35 0.99 -0.59 -2.28 116.97 114.16 1mbi h TYR 146 Ca 0.07 -0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.76 1mbi h TYR 146 Cb 0.90 -0.19 -0.04 0.00 1.00 0.00 0.00 36.73 38.39 1mbi h TYR 146 CO 0.05 0.53 0.57 -0.22 -0.00 0.00 0.00 178.16 179.09 1mbi h LYS 147 N 0.53 1.21 -0.91 4.88 3.64 -0.95 0.92 116.57 125.89 1mbi h LYS 147 Ca 0.14 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1mbi h LYS 147 Cb 0.15 -0.26 -0.04 0.00 -0.41 0.00 0.00 32.23 31.67 1mbi h LYS 147 CO -0.01 0.82 0.56 1.49 -2.27 0.00 0.00 179.45 180.03 1mbi h GLU 148 N 1.23 1.22 0.00 1.90 4.81 -1.24 -1.96 114.58 120.54 1mbi h GLU 148 Ca 0.33 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 1mbi h GLU 148 Cb -0.10 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.02 1mbi h GLU 148 CO -0.07 0.85 0.00 1.28 -0.73 0.00 0.00 179.01 180.34 1mbi n LEU 149 N -4.37 0.00 0.00 1.64 4.77 -0.84 -4.91 117.00 113.30 1mbi n LEU 149 Ca 0.10 0.42 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 1mbi n LEU 149 Cb 0.05 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 1mbi n LEU 149 CO 0.38 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1mbi n GLY 150 N 1.21 0.87 0.00 -0.72 0.00 -0.62 -4.98 105.19 100.95 1mbi n GLY 150 Ca 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1mbi n GLY 150 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1mbi n TYR 151 N -2.22 0.00 -0.25 1.61 4.01 0.22 -5.01 117.16 115.52 1mbi n TYR 151 Ca 0.00 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.63 1mbi n TYR 151 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.01 1mbi n TYR 151 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1mbi n GLN 152 N -0.63 0.00 -0.08 -0.72 7.27 -1.10 -4.83 117.38 117.29 1mbi n GLN 152 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1mbi n GLN 152 Cb 0.00 -0.29 0.00 0.00 2.41 0.00 0.00 30.24 32.36 1mbi n GLN 152 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54