#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u7r s LEU 2 N 0.00 3.63 0.76 1.34 1.02 -1.26 -5.05 118.68 119.12 1u7r s LEU 2 Ca 0.00 -0.42 -0.12 0.00 0.02 0.00 0.00 54.13 53.61 1u7r s LEU 2 Cb 0.00 -1.91 0.05 0.00 0.02 0.00 0.00 46.19 44.35 1u7r s LEU 2 CO 0.00 -0.11 1.13 -0.94 0.02 0.00 0.00 176.35 176.46 1u7r s SER 3 N 1.57 4.91 0.28 2.29 1.04 -1.26 -4.89 113.70 117.64 1u7r s SER 3 Ca 0.05 0.99 -0.03 0.00 0.48 0.00 0.00 55.95 57.44 1u7r s SER 3 Cb -0.16 -1.65 0.40 0.00 0.10 0.00 0.00 66.02 64.71 1u7r s SER 3 CO 0.03 -1.67 1.94 -0.08 0.98 0.00 0.00 173.24 174.44 1u7r h GLU 4 N -0.89 1.15 -0.97 4.02 4.57 -2.00 -1.07 114.58 119.39 1u7r h GLU 4 Ca -0.46 -0.07 0.05 0.00 -1.18 0.00 0.00 59.36 57.70 1u7r h GLU 4 Cb 1.29 -0.26 -0.06 0.00 -0.16 0.00 0.00 28.75 29.56 1u7r h GLU 4 CO 0.64 0.76 0.63 0.78 -1.18 0.00 0.00 179.01 180.64 1u7r h GLY 5 N 1.18 1.44 1.22 1.92 0.00 -1.99 -0.53 103.07 106.32 1u7r h GLY 5 Ca 0.35 -0.47 -0.15 0.00 0.00 0.00 0.00 47.33 47.05 1u7r h GLY 5 CO -0.09 0.38 -0.37 0.83 0.00 0.00 0.00 176.54 177.29 1u7r h GLU 6 N 1.19 0.86 -0.55 4.80 5.08 -1.71 -1.32 114.58 122.92 1u7r h GLU 6 Ca 0.40 -0.44 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1u7r h GLU 6 Cb 0.06 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 1u7r h GLU 6 CO -0.14 1.08 0.26 -1.49 -1.00 0.00 0.00 179.01 177.72 1u7r h TRP 7 N 0.70 0.76 -0.42 4.33 4.06 -0.80 -1.39 115.95 123.19 1u7r h TRP 7 Ca 0.06 -0.02 -0.08 0.00 2.06 0.00 0.00 58.89 60.91 1u7r h TRP 7 Cb 0.94 -0.24 -0.02 0.00 -1.00 0.00 0.00 29.16 28.84 1u7r h TRP 7 CO 0.06 0.56 -0.07 1.96 -3.56 0.00 0.00 178.44 177.38 1u7r h GLN 8 N 0.77 0.73 -0.67 0.49 4.20 -0.60 -0.34 115.11 119.69 1u7r h GLN 8 Ca 0.19 -0.22 -0.08 0.00 0.06 0.00 0.00 58.65 58.60 1u7r h GLN 8 Cb 0.08 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 1u7r h GLN 8 CO -0.03 0.79 0.10 -0.07 -0.67 0.00 0.00 178.83 178.96 1u7r h LEU 9 N 0.67 1.06 -0.17 1.46 3.38 -0.38 0.87 115.31 122.19 1u7r h LEU 9 Ca 0.12 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.85 1u7r h LEU 9 Cb 0.52 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1u7r h LEU 9 CO 0.03 1.06 0.05 0.58 0.09 0.00 0.00 178.44 180.25 1u7r h VAL 10 N 1.03 0.94 0.00 1.22 2.07 -0.79 -2.44 116.25 118.28 1u7r h VAL 10 Ca 0.20 -0.04 -0.13 0.00 0.82 0.00 0.00 66.70 67.55 1u7r h VAL 10 Cb 0.45 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1u7r h VAL 10 CO 0.01 0.02 -0.60 -0.07 0.02 0.00 0.00 177.57 176.95 1u7r h LEU 11 N 0.13 0.00 -0.05 2.57 3.38 -0.89 -1.18 115.31 119.27 1u7r h LEU 11 Ca 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1u7r h LEU 11 Cb 0.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1u7r h LEU 11 CO -0.09 0.60 0.02 -0.74 0.09 0.00 0.00 178.44 178.33 1u7r h HIS 12 N 0.00 0.08 -0.12 1.13 2.76 -0.71 -0.87 115.15 117.42 1u7r h HIS 12 Ca -0.01 -0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.05 1u7r h HIS 12 Cb 1.16 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 30.08 1u7r h HIS 12 CO 0.00 0.22 -0.40 -0.24 -1.30 0.00 0.00 177.93 176.22 1u7r h VAL 13 N -0.08 1.30 -0.72 5.26 3.04 -1.34 -2.74 116.25 120.97 1u7r h VAL 13 Ca 0.02 -1.50 -0.00 0.00 -1.01 0.00 0.00 66.70 64.21 1u7r h VAL 13 Cb 0.18 1.65 -0.04 0.00 -2.01 0.00 0.00 31.29 31.07 1u7r h VAL 13 CO -0.00 0.45 0.44 -0.25 -1.01 0.00 0.00 177.57 177.20 1u7r h TRP 14 N 0.23 0.94 -0.42 3.17 2.91 -1.02 -0.55 115.95 121.21 1u7r h TRP 14 Ca 0.02 0.00 0.02 0.00 1.13 0.00 0.00 58.89 60.06 1u7r h TRP 14 Cb 0.81 -0.31 -0.02 0.00 -0.51 0.00 0.00 29.16 29.12 1u7r h TRP 14 CO 0.02 0.62 0.28 0.00 -1.03 0.00 0.00 178.44 178.32 1u7r h ALA 15 N 1.50 1.76 -0.50 2.65 0.00 -0.85 -0.76 119.26 123.06 1u7r h ALA 15 Ca 0.26 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 1u7r h ALA 15 Cb -0.05 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1u7r h ALA 15 CO -0.05 0.20 -0.11 0.87 0.00 0.00 0.00 179.25 180.16 1u7r h LYS 16 N 0.51 0.96 -0.72 0.00 1.79 -1.03 -2.86 116.57 115.22 1u7r h LYS 16 Ca 0.16 -0.36 0.09 0.00 -2.18 0.00 0.00 60.65 58.35 1u7r h LYS 16 Cb 0.02 -0.06 -0.07 0.00 -1.58 0.00 0.00 32.23 30.54 1u7r h LYS 16 CO -0.04 1.03 0.38 0.28 -1.08 0.00 0.00 179.45 180.02 1u7r h VAL 17 N 0.82 0.88 0.00 0.50 2.07 -0.74 -2.41 116.25 117.37 1u7r h VAL 17 Ca 0.13 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1u7r h VAL 17 Cb 0.67 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 1u7r h VAL 17 CO 0.05 0.12 0.00 -0.62 0.02 0.00 0.00 177.57 177.14 1u7r n GLU 18 N -4.82 0.04 0.26 1.57 1.02 -0.37 -1.32 120.64 117.01 1u7r n GLU 18 Ca 0.11 0.36 0.14 0.00 -0.02 0.00 0.00 57.16 57.75 1u7r n GLU 18 Cb 0.25 -1.58 0.70 0.00 -0.02 0.00 0.00 31.44 30.79 1u7r n GLU 18 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1u7r h ALA 19 N 2.31 1.14 -1.10 0.62 0.00 -1.40 -3.37 119.26 117.47 1u7r h ALA 19 Ca 0.00 -0.11 -0.23 0.00 0.00 0.00 0.00 54.91 54.58 1u7r h ALA 19 Cb 0.19 -0.02 -0.19 0.00 0.00 0.00 0.00 17.79 17.77 1u7r h ALA 19 CO 0.00 0.15 -0.57 -3.47 0.00 0.00 0.00 179.25 175.35 1u7r n ASP 20 N -3.43 -2.92 -0.12 0.00 4.64 -0.43 -5.03 116.55 109.26 1u7r n ASP 20 Ca -0.01 -2.88 -0.09 0.00 -1.38 0.00 0.00 54.79 50.42 1u7r n ASP 20 Cb 0.28 1.40 -0.01 0.00 -1.04 0.00 0.00 41.12 41.75 1u7r n ASP 20 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 1u7r h VAL 21 N 4.66 1.18 -0.49 5.18 2.07 -1.70 -2.09 116.25 125.06 1u7r h VAL 21 Ca 0.07 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1u7r h VAL 21 Cb 1.07 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 1u7r h VAL 21 CO 0.11 0.20 0.31 0.00 0.02 0.00 0.00 177.57 178.21 1u7r h ALA 22 N 1.00 0.63 -0.51 1.67 0.00 -1.89 0.66 119.26 120.81 1u7r h ALA 22 Ca 0.12 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1u7r h ALA 22 Cb 0.17 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1u7r h ALA 22 CO -0.01 0.09 -0.09 0.78 0.00 0.00 0.00 179.25 180.02 1u7r h GLY 23 N 0.66 1.05 1.01 0.00 0.00 -1.91 0.32 103.07 104.20 1u7r h GLY 23 Ca 0.18 -0.84 -0.02 0.00 0.00 0.00 0.00 47.33 46.64 1u7r h GLY 23 CO -0.04 0.77 0.34 0.45 0.00 0.00 0.00 176.54 178.06 1u7r h HIS 24 N 0.84 0.97 -0.48 5.60 3.86 -1.17 -1.78 115.15 122.99 1u7r h HIS 24 Ca 0.13 -0.04 -0.14 0.00 -1.16 0.00 0.00 60.37 59.17 1u7r h HIS 24 Cb 0.65 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.80 1u7r h HIS 24 CO 0.05 0.72 -0.23 0.78 0.86 0.00 0.00 177.93 180.10 1u7r h GLY 25 N 0.94 1.09 0.67 2.45 0.00 -0.61 -0.05 103.07 107.56 1u7r h GLY 25 Ca 0.23 -0.98 0.04 0.00 0.00 0.00 0.00 47.33 46.62 1u7r h GLY 25 CO -0.03 0.89 0.00 1.46 0.00 0.00 0.00 176.54 178.86 1u7r h GLN 26 N 0.86 0.07 -0.34 4.80 4.20 -0.83 -1.48 115.11 122.39 1u7r h GLN 26 Ca 0.11 -0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.72 1u7r h GLN 26 Cb 0.82 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.56 1u7r h GLN 26 CO 0.07 0.05 -0.18 -0.44 -0.67 0.00 0.00 178.83 177.66 1u7r h ASP 27 N 0.08 0.61 -0.28 1.46 3.45 -1.01 0.24 116.42 120.97 1u7r h ASP 27 Ca 0.10 -0.19 -0.03 0.00 0.43 0.00 0.00 57.03 57.34 1u7r h ASP 27 Cb 0.13 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 38.72 1u7r h ASP 27 CO -0.17 0.80 0.07 0.40 -1.57 0.00 0.00 179.24 178.77 1u7r h ILE 28 N 0.55 1.22 -0.47 0.35 2.04 -0.81 -0.44 117.51 119.94 1u7r h ILE 28 Ca 0.09 -0.71 -0.13 0.00 1.00 0.00 0.00 64.86 65.10 1u7r h ILE 28 Cb 0.62 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.84 1u7r h ILE 28 CO 0.04 0.23 -0.23 -0.07 0.00 0.00 0.00 178.15 178.12 1u7r h LEU 29 N 0.28 1.01 -0.66 1.44 3.38 -1.00 0.05 115.31 119.82 1u7r h LEU 29 Ca 0.09 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 1u7r h LEU 29 Cb 0.29 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 1u7r h LEU 29 CO 0.00 1.18 0.38 0.40 0.09 0.00 0.00 178.44 180.50 1u7r h ILE 30 N 0.84 1.20 -0.47 1.22 2.04 -0.88 -0.32 117.51 121.14 1u7r h ILE 30 Ca 0.10 -0.47 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 1u7r h ILE 30 Cb 0.81 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1u7r h ILE 30 CO 0.07 0.21 0.28 -0.09 0.00 0.00 0.00 178.15 178.62 1u7r h ARG 31 N 0.89 0.64 -0.36 2.37 9.65 -0.81 -0.58 114.38 126.19 1u7r h ARG 31 Ca 0.23 -0.06 0.03 0.00 -1.10 0.00 0.00 59.98 59.08 1u7r h ARG 31 Cb 0.00 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 28.42 1u7r h ARG 31 CO -0.04 0.48 0.17 1.25 2.80 0.00 0.00 179.97 184.63 1u7r h LEU 32 N 0.63 0.25 -0.97 3.80 5.85 -0.59 0.80 115.31 125.07 1u7r h LEU 32 Ca 0.17 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.81 1u7r h LEU 32 Cb 0.00 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1u7r h LEU 32 CO -0.03 0.19 -0.46 -0.26 -0.34 0.00 0.00 178.44 177.54 1u7r h PHE 33 N 0.36 0.00 0.17 1.25 0.04 -0.74 0.80 116.94 118.82 1u7r h PHE 33 Ca 0.15 0.00 -0.32 0.00 2.80 0.00 0.00 57.97 60.61 1u7r h PHE 33 Cb 0.07 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.23 1u7r h PHE 33 CO -0.10 0.46 -1.51 1.57 -0.60 0.00 0.00 178.31 178.12 1u7r h LYS 34 N 0.00 0.36 0.00 1.51 -0.00 -0.80 -3.00 116.57 114.64 1u7r h LYS 34 Ca -0.00 -0.61 -0.20 0.00 -0.00 0.00 0.00 60.65 59.83 1u7r h LYS 34 Cb 0.90 0.23 -0.01 0.00 -0.00 0.00 0.00 32.23 33.35 1u7r h LYS 34 CO 0.06 1.26 -0.89 0.77 -0.00 0.00 0.00 179.45 180.65 1u7r h SER 35 N 0.10 0.32 -2.19 7.07 0.02 -0.70 -3.39 113.55 114.77 1u7r h SER 35 Ca -0.25 -0.26 -0.58 0.00 -0.84 0.00 0.00 61.79 59.87 1u7r h SER 35 Cb 2.06 -0.10 -0.39 0.00 0.14 0.00 0.00 62.40 64.11 1u7r h SER 35 CO 0.20 1.06 -0.98 1.41 -1.14 0.00 0.00 176.83 177.38 1u7r n HIS 36 N -3.68 0.09 0.34 3.45 8.25 0.26 -4.99 115.22 118.94 1u7r n HIS 36 Ca -0.04 -3.59 0.23 0.00 -0.26 0.00 0.00 57.72 54.06 1u7r n HIS 36 Cb 0.81 -0.20 1.21 0.00 1.12 0.00 0.00 29.99 32.93 1u7r n HIS 36 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1u7r h PRO 37 N 4.59 0.00 0.00 -0.41 0.11 -1.72 -1.15 132.00 133.42 1u7r h PRO 37 Ca 0.15 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.25 1u7r h PRO 37 Cb 0.86 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.97 1u7r h PRO 37 CO 0.49 0.00 -0.04 1.05 -0.21 0.00 0.00 178.00 179.28 1u7r h GLU 38 N 0.00 0.00 0.00 1.05 9.09 -1.93 -1.53 114.58 121.26 1u7r h GLU 38 Ca 0.00 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.38 1u7r h GLU 38 Cb 0.01 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.11 1u7r h GLU 38 CO 0.00 0.04 -0.13 1.79 0.05 0.00 0.00 179.01 180.77 1u7r h THR 39 N 0.00 0.56 0.00 -1.06 1.35 -1.54 -1.69 112.91 110.53 1u7r h THR 39 Ca -0.00 -0.57 -0.02 0.00 -0.55 0.00 0.00 66.41 65.27 1u7r h THR 39 Cb 0.12 1.37 -0.00 0.00 -1.73 0.00 0.00 68.15 67.91 1u7r h THR 39 CO 0.01 0.12 -0.08 0.25 -0.25 0.00 0.00 175.52 175.57 1u7r h LEU 40 N 0.00 0.00 -1.83 3.87 5.85 -1.47 -2.15 115.31 119.58 1u7r h LEU 40 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1u7r h LEU 40 Cb 0.36 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.39 1u7r h LEU 40 CO 0.02 0.08 0.00 -0.33 -0.34 0.00 0.00 178.44 177.86 1u7r h GLU 41 N 0.00 0.00 0.00 1.25 5.08 -1.44 -0.80 114.58 118.67 1u7r h GLU 41 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1u7r h GLU 41 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1u7r h GLU 41 CO 0.01 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.65 1u7r n LYS 42 N -2.81 0.37 -3.97 2.33 4.76 -0.81 -4.66 118.16 113.37 1u7r n LYS 42 Ca -0.01 0.03 -0.30 0.00 -2.87 0.00 0.00 58.31 55.16 1u7r n LYS 42 Cb 0.17 -1.50 -0.14 0.00 -1.84 0.00 0.00 35.03 31.72 1u7r n LYS 42 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1u7r s PHE 43 N -2.58 3.35 0.56 2.13 0.40 -0.30 -4.98 117.98 116.56 1u7r s PHE 43 Ca 0.25 -3.02 0.25 0.00 -0.60 0.00 0.00 56.93 53.81 1u7r s PHE 43 Cb 0.18 -2.80 1.56 0.00 0.51 0.00 0.00 43.02 42.47 1u7r s PHE 43 CO 0.41 -0.84 2.14 -0.44 0.70 0.00 0.00 175.22 177.19 1u7r h ASP 44 N 7.07 0.00 -0.12 1.36 3.45 -1.83 -1.10 116.42 125.25 1u7r h ASP 44 Ca -0.06 0.00 -0.09 0.00 0.43 0.00 0.00 57.03 57.31 1u7r h ASP 44 Cb 0.96 0.00 -0.08 0.00 -0.56 0.00 0.00 39.33 39.64 1u7r h ASP 44 CO 0.60 0.00 -0.57 0.54 -1.57 0.00 0.00 179.24 178.23 1u7r n ARG 45 N -4.09 1.84 -0.01 3.56 1.74 -1.26 -4.22 116.66 114.23 1u7r n ARG 45 Ca 0.00 -3.39 0.03 0.00 -0.77 0.00 0.00 57.85 53.72 1u7r n ARG 45 Cb 0.24 -1.66 -0.05 0.00 -1.02 0.00 0.00 32.46 29.97 1u7r n ARG 45 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1u7r n PHE 46 N -0.99 0.00 0.33 -1.55 3.72 -0.53 -4.76 117.46 113.68 1u7r n PHE 46 Ca 0.22 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.77 1u7r n PHE 46 Cb 0.75 -0.17 0.62 0.00 -0.94 0.00 0.00 39.48 39.74 1u7r n PHE 46 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1u7r h LYS 47 N 0.00 0.00 -0.33 -1.08 2.10 -1.43 -1.18 116.57 114.66 1u7r h LYS 47 Ca -0.02 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 1u7r h LYS 47 Cb 0.41 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.74 1u7r h LYS 47 CO 0.00 0.00 0.00 0.72 -2.00 0.00 0.00 179.45 178.17 1u7r n HIS 48 N -2.56 0.42 -2.56 0.07 8.25 -1.26 -4.90 115.22 112.68 1u7r n HIS 48 Ca 0.01 -0.21 -0.42 0.00 -0.26 0.00 0.00 57.72 56.84 1u7r n HIS 48 Cb 0.21 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.30 1u7r n HIS 48 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1u7r s LEU 49 N -1.49 4.34 0.05 2.41 1.43 -0.45 -4.94 118.68 120.04 1u7r s LEU 49 Ca 0.36 1.81 0.21 0.00 -1.03 0.00 0.00 54.13 55.49 1u7r s LEU 49 Cb 0.21 -3.57 -0.20 0.00 0.03 0.00 0.00 46.19 42.66 1u7r s LEU 49 CO 0.29 -0.41 0.68 0.29 0.23 0.00 0.00 176.35 177.44 1u7r n LYS 50 N 4.21 0.64 -3.87 1.70 4.01 -1.26 -4.96 118.16 118.63 1u7r n LYS 50 Ca 0.08 -0.04 -0.10 0.00 -0.51 0.00 0.00 58.31 57.75 1u7r n LYS 50 Cb 0.48 -1.65 -0.08 0.00 -0.51 0.00 0.00 35.03 33.27 1u7r n LYS 50 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 1u7r s THR 51 N -3.35 0.13 0.27 -0.18 -4.23 -1.26 -5.04 115.64 101.98 1u7r s THR 51 Ca -0.05 -1.07 -0.03 0.00 -1.18 0.00 0.00 61.69 59.36 1u7r s THR 51 Cb 0.11 -1.09 0.27 0.00 1.34 0.00 0.00 72.50 73.13 1u7r s THR 51 CO 0.85 -0.59 1.91 -0.08 -0.54 0.00 0.00 174.62 176.18 1u7r h GLU 52 N 3.21 1.19 -0.58 3.99 4.81 -1.99 -1.28 114.58 123.94 1u7r h GLU 52 Ca -0.33 -0.07 -0.07 0.00 -0.13 0.00 0.00 59.36 58.76 1u7r h GLU 52 Cb 1.19 -0.27 -0.02 0.00 0.63 0.00 0.00 28.75 30.28 1u7r h GLU 52 CO 0.52 0.79 0.09 0.00 -0.73 0.00 0.00 179.01 179.67 1u7r h ALA 53 N 1.43 1.06 -0.70 2.92 0.00 -1.98 0.33 119.26 122.33 1u7r h ALA 53 Ca 0.39 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1u7r h ALA 53 Cb 0.02 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1u7r h ALA 53 CO -0.12 0.61 0.25 0.93 0.00 0.00 0.00 179.25 180.91 1u7r h GLU 54 N 0.88 1.06 -0.51 0.00 5.08 -1.81 -0.60 114.58 118.68 1u7r h GLU 54 Ca 0.18 -0.20 -0.08 0.00 -1.00 0.00 0.00 59.36 58.26 1u7r h GLU 54 Cb 0.40 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1u7r h GLU 54 CO 0.01 0.88 -0.02 0.52 -1.00 0.00 0.00 179.01 179.41 1u7r h MET 55 N 1.03 0.86 0.00 2.33 2.86 -0.56 -1.98 114.93 119.47 1u7r h MET 55 Ca 0.23 -0.25 -0.09 0.00 -2.06 0.00 0.00 59.70 57.53 1u7r h MET 55 Cb 0.25 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1u7r h MET 55 CO -0.01 0.87 -0.43 -0.22 1.06 0.00 0.00 176.91 178.17 1u7r h LYS 56 N 0.80 0.00 -0.01 1.72 1.63 -0.54 -2.57 116.57 117.60 1u7r h LYS 56 Ca 0.15 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.95 1u7r h LYS 56 Cb 0.50 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 1u7r h LYS 56 CO 0.02 0.43 -0.14 0.00 -3.45 0.00 0.00 179.45 176.32 1u7r n ALA 57 N -2.33 2.84 -2.55 5.00 0.00 -0.27 -4.86 120.51 118.35 1u7r n ALA 57 Ca -0.00 -0.41 -0.43 0.00 0.00 0.00 0.00 53.44 52.59 1u7r n ALA 57 Cb 0.54 -1.16 -0.02 0.00 0.00 0.00 0.00 19.45 18.80 1u7r n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1u7r s SER 58 N -2.28 6.82 0.31 0.00 0.15 -0.78 -4.89 113.70 113.03 1u7r s SER 58 Ca 0.31 1.11 0.02 0.00 0.70 0.00 0.00 55.95 58.09 1u7r s SER 58 Cb 0.20 -2.54 0.50 0.00 -1.71 0.00 0.00 66.02 62.47 1u7r s SER 58 CO 0.44 -0.97 1.83 -0.08 1.20 0.00 0.00 173.24 175.66 1u7r h GLU 59 N 8.60 0.60 -0.53 5.44 4.81 -1.89 -1.94 114.58 129.67 1u7r h GLU 59 Ca -0.23 -0.15 -0.03 0.00 -0.13 0.00 0.00 59.36 58.82 1u7r h GLU 59 Cb 1.08 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.35 1u7r h GLU 59 CO 1.04 0.64 0.19 0.22 -0.73 0.00 0.00 179.01 180.37 1u7r h ASP 60 N 0.57 0.74 -0.54 1.04 -0.00 -1.97 -0.04 116.42 116.22 1u7r h ASP 60 Ca 0.12 -0.18 -0.09 0.00 -0.00 0.00 0.00 57.03 56.87 1u7r h ASP 60 Cb 0.39 -0.19 -0.02 0.00 -0.00 0.00 0.00 39.33 39.51 1u7r h ASP 60 CO 0.02 0.73 -0.00 0.25 -0.00 0.00 0.00 179.24 180.23 1u7r h LEU 61 N 0.72 0.96 -0.86 2.28 6.46 -1.81 -0.42 115.31 122.64 1u7r h LEU 61 Ca 0.17 -0.26 -0.02 0.00 -0.12 0.00 0.00 57.88 57.65 1u7r h LEU 61 Cb 0.23 -0.26 -0.04 0.00 -0.73 0.00 0.00 40.66 39.86 1u7r h LEU 61 CO -0.01 1.02 0.47 0.50 -0.62 0.00 0.00 178.44 179.80 1u7r h LYS 62 N 0.90 1.20 -0.64 1.25 3.64 -0.96 -0.05 116.57 121.90 1u7r h LYS 62 Ca 0.16 -0.14 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 1u7r h LYS 62 Cb 0.53 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 32.09 1u7r h LYS 62 CO 0.03 0.88 0.30 0.87 -2.27 0.00 0.00 179.45 179.26 1u7r h LYS 63 N 1.20 0.93 -0.84 1.90 1.57 -0.57 -1.77 116.57 118.99 1u7r h LYS 63 Ca 0.30 -0.14 0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1u7r h LYS 63 Cb 0.03 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.13 1u7r h LYS 63 CO -0.05 0.75 0.55 0.45 -0.57 0.00 0.00 179.45 180.58 1u7r h HIS 64 N 0.89 1.05 -0.73 -1.35 3.86 -0.62 -0.92 115.15 117.33 1u7r h HIS 64 Ca 0.22 0.03 0.07 0.00 -1.16 0.00 0.00 60.37 59.52 1u7r h HIS 64 Cb 0.13 -0.35 -0.06 0.00 1.06 0.00 0.00 27.41 28.19 1u7r h HIS 64 CO 0.00 0.65 0.41 0.78 0.86 0.00 0.00 177.93 180.63 1u7r h GLY 65 N 1.12 1.09 0.98 2.45 0.00 -0.44 0.04 103.07 108.31 1u7r h GLY 65 Ca 0.31 -0.28 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 1u7r h GLY 65 CO -0.08 0.16 0.11 -2.08 0.00 0.00 0.00 176.54 174.65 1u7r h VAL 66 N 0.74 1.25 -0.49 4.60 2.07 -0.93 -1.57 116.25 121.93 1u7r h VAL 66 Ca 0.33 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.98 1u7r h VAL 66 Cb 0.23 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1u7r h VAL 66 CO -0.20 0.32 0.31 0.74 0.02 0.00 0.00 177.57 178.76 1u7r h THR 67 N 0.71 1.09 -0.18 2.57 2.02 -0.48 0.76 112.91 119.40 1u7r h THR 67 Ca 0.16 -0.22 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 1u7r h THR 67 Cb 0.36 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1u7r h THR 67 CO 0.00 0.11 0.05 0.58 0.37 0.00 0.00 175.52 176.64 1u7r h VAL 68 N 0.63 1.19 0.00 3.16 2.07 -0.91 -2.12 116.25 120.27 1u7r h VAL 68 Ca 0.19 -0.61 -0.12 0.00 0.82 0.00 0.00 66.70 66.98 1u7r h VAL 68 Cb -0.04 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1u7r h VAL 68 CO -0.06 0.19 -0.56 -0.07 0.02 0.00 0.00 177.57 177.09 1u7r h LEU 69 N 0.10 0.00 -0.25 2.57 3.38 -1.16 -0.81 115.31 119.14 1u7r h LEU 69 Ca 0.06 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1u7r h LEU 69 Cb 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1u7r h LEU 69 CO -0.00 0.56 0.01 0.74 0.09 0.00 0.00 178.44 179.84 1u7r h THR 70 N 0.00 1.25 -0.33 0.22 2.02 -0.75 0.10 112.91 115.43 1u7r h THR 70 Ca -0.01 -0.88 -0.05 0.00 0.77 0.00 0.00 66.41 66.25 1u7r h THR 70 Cb 1.09 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.83 1u7r h THR 70 CO 0.07 0.28 0.03 0.00 0.37 0.00 0.00 175.52 176.26 1u7r h ALA 71 N 0.82 0.44 -0.54 6.16 0.00 -1.16 -1.72 119.26 123.27 1u7r h ALA 71 Ca 0.07 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1u7r h ALA 71 Cb 0.40 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1u7r h ALA 71 CO 0.01 0.16 0.13 1.25 0.00 0.00 0.00 179.25 180.80 1u7r h LEU 72 N 0.37 0.82 -0.67 0.00 5.85 -1.11 -2.33 115.31 118.25 1u7r h LEU 72 Ca 0.10 -0.24 0.02 0.00 0.84 0.00 0.00 57.88 58.60 1u7r h LEU 72 Cb 0.40 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 1u7r h LEU 72 CO 0.01 0.85 0.43 1.23 -0.34 0.00 0.00 178.44 180.62 1u7r h GLY 73 N 0.76 0.95 1.26 3.75 0.00 -0.70 0.75 103.07 109.85 1u7r h GLY 73 Ca 0.17 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 1u7r h GLY 73 CO 0.00 0.30 0.38 0.00 0.00 0.00 0.00 176.54 177.22 1u7r h ALA 74 N 1.27 1.35 0.02 3.60 0.00 -1.09 -1.21 119.26 123.20 1u7r h ALA 74 Ca 0.26 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1u7r h ALA 74 Cb -0.04 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.47 1u7r h ALA 74 CO -0.08 0.53 -0.01 0.82 0.00 0.00 0.00 179.25 180.51 1u7r h ILE 75 N 0.98 1.25 -0.63 0.00 2.04 -0.85 -3.24 117.51 117.06 1u7r h ILE 75 Ca 0.25 -0.83 -0.01 0.00 1.00 0.00 0.00 64.86 65.27 1u7r h ILE 75 Cb 0.03 1.81 -0.03 0.00 -0.74 0.00 0.00 36.82 37.89 1u7r h ILE 75 CO -0.04 0.21 0.33 -0.07 0.00 0.00 0.00 178.15 178.58 1u7r h LEU 76 N -0.38 0.78 -1.80 1.44 3.38 -0.57 -1.65 115.31 116.51 1u7r h LEU 76 Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1u7r h LEU 76 Cb 0.37 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1u7r h LEU 76 CO 0.00 0.64 0.00 0.11 0.09 0.00 0.00 178.44 179.28 1u7r h LYS 77 N 0.88 0.00 -0.00 1.13 1.57 -1.25 -1.15 116.57 117.74 1u7r h LYS 77 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1u7r h LYS 77 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1u7r h LYS 77 CO -0.03 0.00 -0.07 1.63 -0.57 0.00 0.00 179.45 180.41 1u7r n LYS 78 N -2.79 0.42 -3.87 3.15 4.76 -0.62 -4.94 118.16 114.27 1u7r n LYS 78 Ca -0.01 -0.07 -0.26 0.00 -2.87 0.00 0.00 58.31 55.10 1u7r n LYS 78 Cb 0.17 -1.50 0.01 0.00 -1.84 0.00 0.00 35.03 31.88 1u7r n LYS 78 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1u7r n LYS 79 N -1.23 -4.60 0.00 1.97 5.02 -0.44 -1.35 118.16 117.55 1u7r n LYS 79 Ca 0.13 0.54 0.00 0.00 -2.02 0.00 0.00 58.31 56.96 1u7r n LYS 79 Cb 0.27 -5.13 0.00 0.00 -0.02 0.00 0.00 35.03 30.16 1u7r n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1u7r n GLY 80 N -1.69 3.49 2.72 0.72 0.00 -1.26 -4.96 105.19 104.22 1u7r n GLY 80 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1u7r n GLY 80 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1u7r n HIS 81 N -2.00 2.62 -0.98 1.61 8.25 -0.45 -4.66 115.22 119.61 1u7r n HIS 81 Ca 0.00 -2.69 0.09 0.00 -0.26 0.00 0.00 57.72 54.86 1u7r n HIS 81 Cb 0.00 -1.57 0.13 0.00 1.12 0.00 0.00 29.99 29.67 1u7r n HIS 81 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1u7r n HIS 82 N 1.65 0.00 -0.20 4.41 1.44 -1.26 -4.76 115.22 116.50 1u7r n HIS 82 Ca 0.45 -0.94 0.01 0.00 -2.01 0.00 0.00 57.72 55.22 1u7r n HIS 82 Cb 0.29 -0.14 0.11 0.00 0.12 0.00 0.00 29.99 30.37 1u7r n HIS 82 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 1u7r h GLU 83 N 0.00 0.25 0.00 -1.40 4.57 -1.99 0.59 114.58 116.60 1u7r h GLU 83 Ca 0.00 -0.02 -0.08 0.00 -1.18 0.00 0.00 59.36 58.09 1u7r h GLU 83 Cb 0.96 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.48 1u7r h GLU 83 CO 0.00 0.17 -0.37 0.00 -1.18 0.00 0.00 179.01 177.63 1u7r h ALA 84 N 1.48 1.01 0.14 2.92 0.00 -2.01 -0.23 119.26 122.56 1u7r h ALA 84 Ca 0.31 -0.33 -0.31 0.00 0.00 0.00 0.00 54.91 54.58 1u7r h ALA 84 Cb 0.46 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1u7r h ALA 84 CO -0.40 0.46 -1.47 0.93 0.00 0.00 0.00 179.25 178.77 1u7r h GLU 85 N 0.00 0.30 0.02 0.00 3.07 -1.75 -3.38 114.58 112.84 1u7r h GLU 85 Ca -0.00 -0.52 -0.23 0.00 -0.50 0.00 0.00 59.36 58.10 1u7r h GLU 85 Cb 0.88 0.19 -0.03 0.00 -0.84 0.00 0.00 28.75 28.96 1u7r h GLU 85 CO 0.05 1.20 -1.16 1.25 -1.40 0.00 0.00 179.01 178.94 1u7r h LEU 86 N 0.08 0.06 -0.25 1.33 7.12 -0.72 -3.35 115.31 119.59 1u7r h LEU 86 Ca -0.22 -0.07 0.01 0.00 0.13 0.00 0.00 57.88 57.72 1u7r h LEU 86 Cb 2.03 -0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 42.12 1u7r h LEU 86 CO 0.19 1.06 0.14 0.50 -0.13 0.00 0.00 178.44 180.20 1u7r h LYS 87 N 0.01 0.28 -0.06 1.25 3.64 -1.21 -0.44 116.57 120.05 1u7r h LYS 87 Ca -0.08 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.22 1u7r h LYS 87 Cb 1.84 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.59 1u7r h LYS 87 CO 0.13 0.19 -0.27 -1.35 -2.27 0.00 0.00 179.45 175.88 1u7r h PRO 88 N 0.29 0.10 -0.32 1.90 0.11 -1.78 -0.87 132.00 131.43 1u7r h PRO 88 Ca 0.10 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.07 1u7r h PRO 88 Cb 0.00 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 1u7r h PRO 88 CO -0.05 0.36 -0.20 1.25 -0.21 0.00 0.00 178.00 179.15 1u7r h LEU 89 N 0.09 0.74 -0.57 2.35 5.85 -1.49 -1.79 115.31 120.48 1u7r h LEU 89 Ca 0.01 -0.43 0.02 0.00 0.84 0.00 0.00 57.88 58.32 1u7r h LEU 89 Cb 0.53 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 1u7r h LEU 89 CO 0.04 1.00 0.36 0.00 -0.34 0.00 0.00 178.44 179.50 1u7r h ALA 90 N 0.75 0.73 -0.36 1.25 0.00 -0.72 -0.79 119.26 120.12 1u7r h ALA 90 Ca 0.07 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1u7r h ALA 90 Cb 0.75 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1u7r h ALA 90 CO 0.06 0.11 0.16 0.37 0.00 0.00 0.00 179.25 179.95 1u7r h GLN 91 N 0.72 0.33 -0.30 0.00 4.15 -0.89 0.10 115.11 119.22 1u7r h GLN 91 Ca 0.22 -0.02 -0.15 0.00 0.77 0.00 0.00 58.65 59.47 1u7r h GLN 91 Cb -0.03 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.58 1u7r h GLN 91 CO -0.07 0.22 -0.40 0.66 -1.93 0.00 0.00 178.83 177.30 1u7r h SER 92 N 0.34 0.87 0.98 -0.69 4.64 -1.13 -1.07 113.55 117.48 1u7r h SER 92 Ca 0.16 -0.50 -0.10 0.00 -0.47 0.00 0.00 61.79 60.88 1u7r h SER 92 Cb 0.09 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.92 1u7r h SER 92 CO -0.13 1.20 -0.47 0.45 -0.87 0.00 0.00 176.83 177.01 1u7r h HIS 93 N 0.57 0.00 0.07 4.77 3.86 -0.95 0.30 115.15 123.76 1u7r h HIS 93 Ca 0.04 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.12 1u7r h HIS 93 Cb 0.99 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.47 1u7r h HIS 93 CO 0.07 0.47 -0.58 0.00 0.86 0.00 0.00 177.93 178.75 1u7r h ALA 94 N 1.53 0.01 0.00 2.45 0.00 -0.79 0.97 119.26 123.42 1u7r h ALA 94 Ca -0.00 -0.70 -0.29 0.00 0.00 0.00 0.00 54.91 53.91 1u7r h ALA 94 Cb 1.09 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.98 1u7r h ALA 94 CO 0.06 0.30 -2.20 0.25 0.00 0.00 0.00 179.25 177.67 1u7r n THR 95 N -4.33 1.16 -0.08 0.00 -2.24 -0.41 -3.78 114.28 104.59 1u7r n THR 95 Ca -0.15 -0.78 -0.13 0.00 -2.27 0.00 0.00 64.05 60.72 1u7r n THR 95 Cb 0.68 -0.45 -0.04 0.00 -2.10 0.00 0.00 70.33 68.41 1u7r n THR 95 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1u7r n LYS 96 N -2.70 0.46 0.14 -0.78 4.81 -0.36 -4.76 118.16 114.96 1u7r n LYS 96 Ca -0.25 0.19 0.06 0.00 -0.87 0.00 0.00 58.31 57.44 1u7r n LYS 96 Cb 1.03 -1.29 0.04 0.00 0.02 0.00 0.00 35.03 34.83 1u7r n LYS 96 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1u7r h HIS 97 N -0.83 0.00 -5.52 5.64 3.86 -1.13 -3.49 115.15 113.67 1u7r h HIS 97 Ca -0.17 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 58.85 1u7r h HIS 97 Cb 1.03 0.00 0.12 0.00 1.06 0.00 0.00 27.41 29.62 1u7r h HIS 97 CO -0.27 0.29 -0.59 1.63 0.86 0.00 0.00 177.93 179.85 1u7r n LYS 98 N -3.03 -1.84 -3.51 2.45 4.76 -0.16 -4.98 118.16 111.85 1u7r n LYS 98 Ca 0.00 1.04 -0.42 0.00 -2.87 0.00 0.00 58.31 56.06 1u7r n LYS 98 Cb 0.67 -5.58 -0.10 0.00 -1.84 0.00 0.00 35.03 28.17 1u7r n LYS 98 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1u7r s ILE 99 N -3.26 5.00 0.69 -0.18 -1.09 0.15 -5.02 121.20 117.49 1u7r s ILE 99 Ca 0.30 -0.78 -0.15 0.00 -2.23 0.00 0.00 60.65 57.79 1u7r s ILE 99 Cb -0.05 -3.81 0.02 0.00 -1.58 0.00 0.00 42.46 37.04 1u7r s ILE 99 CO 0.76 -0.31 1.16 -2.16 -1.23 0.00 0.00 174.94 173.16 1u7r s PRO 100 N 1.63 2.47 0.38 2.79 0.04 -1.26 -4.80 135.00 136.25 1u7r s PRO 100 Ca 0.04 1.57 0.09 0.00 0.04 0.00 0.00 61.00 62.74 1u7r s PRO 100 Cb -0.19 -1.89 0.86 0.00 0.04 0.00 0.00 34.50 33.31 1u7r s PRO 100 CO 0.08 -1.54 1.94 0.82 0.04 0.00 0.00 177.00 178.34 1u7r h ILE 101 N -0.13 0.93 -0.40 0.56 1.08 -1.30 0.36 117.51 118.61 1u7r h ILE 101 Ca -0.47 -0.21 0.04 0.00 -0.39 0.00 0.00 64.86 63.82 1u7r h ILE 101 Cb 1.27 0.25 -0.02 0.00 -3.07 0.00 0.00 36.82 35.25 1u7r h ILE 101 CO 0.52 0.11 0.27 0.07 -0.69 0.00 0.00 178.15 178.43 1u7r h LYS 102 N 0.63 0.37 -0.04 2.37 2.10 -1.91 -0.10 116.57 119.99 1u7r h LYS 102 Ca 0.34 -0.02 -0.11 0.00 -2.00 0.00 0.00 60.65 58.86 1u7r h LYS 102 Cb 0.48 -0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 31.72 1u7r h LYS 102 CO -0.12 0.24 -0.47 1.88 -2.00 0.00 0.00 179.45 178.98 1u7r h TYR 103 N 0.38 0.11 -0.27 0.07 -1.99 -1.27 -0.71 116.97 113.29 1u7r h TYR 103 Ca 0.17 -0.03 -0.07 0.00 2.00 0.00 0.00 58.73 60.79 1u7r h TYR 103 Cb 0.19 -0.02 -0.02 0.00 2.00 0.00 0.00 36.73 38.88 1u7r h TYR 103 CO -0.00 0.55 -0.14 -0.07 -0.00 0.00 0.00 178.16 178.49 1u7r h LEU 104 N 0.08 0.44 -0.29 3.88 3.38 -0.92 -0.90 115.31 120.98 1u7r h LEU 104 Ca 0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1u7r h LEU 104 Cb 0.86 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1u7r h LEU 104 CO 0.07 0.62 0.16 -0.33 0.09 0.00 0.00 178.44 179.04 1u7r h GLU 105 N 0.42 0.40 -0.71 1.13 5.08 -0.56 -1.37 114.58 118.98 1u7r h GLU 105 Ca 0.08 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1u7r h GLU 105 Cb 0.50 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.64 1u7r h GLU 105 CO 0.03 0.34 0.47 0.74 -1.00 0.00 0.00 179.01 179.59 1u7r h PHE 106 N 0.35 0.88 -0.00 4.33 0.04 -0.78 -0.46 116.94 121.30 1u7r h PHE 106 Ca 0.10 0.02 -0.12 0.00 2.80 0.00 0.00 57.97 60.78 1u7r h PHE 106 Cb 0.06 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 37.89 1u7r h PHE 106 CO -0.03 0.55 -0.56 0.97 -0.60 0.00 0.00 178.31 178.64 1u7r h ILE 107 N 0.95 1.40 -0.59 -0.55 2.10 -1.12 -1.59 117.51 118.12 1u7r h ILE 107 Ca 0.26 -1.92 -0.00 0.00 1.08 0.00 0.00 64.86 64.28 1u7r h ILE 107 Cb -0.10 2.03 -0.03 0.00 -1.09 0.00 0.00 36.82 37.64 1u7r h ILE 107 CO -0.06 0.55 0.36 0.28 -1.08 0.00 0.00 178.15 178.19 1u7r h SER 108 N 0.01 0.71 -0.86 2.19 0.02 -0.68 -0.36 113.55 114.58 1u7r h SER 108 Ca -0.01 -0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 60.86 1u7r h SER 108 Cb 0.99 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 63.32 1u7r h SER 108 CO 0.07 0.55 0.43 -0.33 -1.14 0.00 0.00 176.83 176.41 1u7r h GLU 109 N 0.80 1.22 -0.77 3.45 5.08 -0.70 -1.29 114.58 122.37 1u7r h GLU 109 Ca 0.21 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1u7r h GLU 109 Cb -0.02 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 28.97 1u7r h GLU 109 CO -0.04 0.93 0.33 0.00 -1.00 0.00 0.00 179.01 179.23 1u7r h ALA 110 N 1.23 0.99 -0.07 3.43 0.00 -0.75 -0.66 119.26 123.43 1u7r h ALA 110 Ca 0.30 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1u7r h ALA 110 Cb 0.10 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1u7r h ALA 110 CO -0.04 0.59 -0.03 0.82 0.00 0.00 0.00 179.25 180.59 1u7r h ILE 111 N 1.10 0.90 -0.64 0.00 2.04 -0.71 -0.95 117.51 119.25 1u7r h ILE 111 Ca 0.26 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.09 1u7r h ILE 111 Cb 0.18 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 1u7r h ILE 111 CO -0.03 0.00 0.30 0.40 0.00 0.00 0.00 178.15 178.82 1u7r h ILE 112 N -0.03 1.22 -0.11 -0.67 1.08 -0.97 -0.62 117.51 117.42 1u7r h ILE 112 Ca 0.04 -0.64 0.03 0.00 -0.39 0.00 0.00 64.86 63.89 1u7r h ILE 112 Cb 0.08 0.47 -0.03 0.00 -3.07 0.00 0.00 36.82 34.27 1u7r h ILE 112 CO -0.08 0.26 -0.05 -0.74 -0.69 0.00 0.00 178.15 176.84 1u7r h HIS 113 N 0.88 -0.12 -0.48 1.37 2.76 -0.89 -0.71 115.15 117.96 1u7r h HIS 113 Ca 0.22 0.01 -0.14 0.00 -2.20 0.00 0.00 60.37 58.26 1u7r h HIS 113 Cb 0.14 0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.15 1u7r h HIS 113 CO 0.00 -0.09 -0.24 0.28 -1.30 0.00 0.00 177.93 176.59 1u7r h VAL 114 N -0.04 1.27 -0.83 5.26 2.07 -0.95 -0.49 116.25 122.54 1u7r h VAL 114 Ca 0.06 -1.41 -0.04 0.00 0.82 0.00 0.00 66.70 66.13 1u7r h VAL 114 Cb 0.14 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 1u7r h VAL 114 CO -0.14 0.49 0.37 -0.07 0.02 0.00 0.00 177.57 178.24 1u7r h LEU 115 N 0.86 1.12 -0.48 2.57 4.07 -0.98 -1.06 115.31 121.40 1u7r h LEU 115 Ca 0.10 -0.15 -0.16 0.00 0.08 0.00 0.00 57.88 57.75 1u7r h LEU 115 Cb 0.83 -0.29 -0.01 0.00 1.08 0.00 0.00 40.66 42.27 1u7r h LEU 115 CO 0.07 0.96 -0.52 -0.74 -1.08 0.00 0.00 178.44 177.13 1u7r h HIS 116 N 1.20 0.81 -0.65 1.13 2.76 -0.98 -0.01 115.15 119.41 1u7r h HIS 116 Ca 0.28 -0.28 -0.04 0.00 -2.20 0.00 0.00 60.37 58.13 1u7r h HIS 116 Cb 0.16 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 28.94 1u7r h HIS 116 CO 0.02 1.03 0.24 1.03 -1.30 0.00 0.00 177.93 178.95 1u7r h SER 117 N 0.50 0.91 0.84 3.26 0.87 -0.80 -2.87 113.55 116.26 1u7r h SER 117 Ca 0.02 -0.18 -0.17 0.00 -1.23 0.00 0.00 61.79 60.22 1u7r h SER 117 Cb 1.08 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.77 1u7r h SER 117 CO 0.10 0.84 -1.26 0.03 -0.53 0.00 0.00 176.83 176.02 1u7r h ARG 118 N 0.92 0.00 -1.03 2.24 3.08 -1.16 -3.41 114.38 115.02 1u7r h ARG 118 Ca 0.21 0.00 -0.42 0.00 0.07 0.00 0.00 59.98 59.85 1u7r h ARG 118 Cb 0.23 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 29.88 1u7r h ARG 118 CO -0.01 0.39 -1.04 0.72 -1.07 0.00 0.00 179.97 178.96 1u7r n HIS 119 N -3.00 1.87 0.14 3.04 8.25 -0.02 -4.93 115.22 120.57 1u7r n HIS 119 Ca -0.08 -2.74 0.06 0.00 -0.26 0.00 0.00 57.72 54.70 1u7r n HIS 119 Cb 0.85 -0.28 0.52 0.00 1.12 0.00 0.00 29.99 32.20 1u7r n HIS 119 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1u7r h PRO 120 N 2.77 0.24 0.00 -0.41 0.13 -1.68 -0.82 132.00 132.23 1u7r h PRO 120 Ca 0.03 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1u7r h PRO 120 Cb 1.15 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1u7r h PRO 120 CO 0.56 0.19 0.00 0.41 -0.23 0.00 0.00 178.00 178.94 1u7r n GLY 121 N -1.41 -1.14 0.11 1.56 0.00 -1.26 -2.15 105.19 100.91 1u7r n GLY 121 Ca -0.00 -0.08 0.02 0.00 0.00 0.00 0.00 46.02 45.96 1u7r n GLY 121 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1u7r n ASP 122 N -1.43 2.19 -2.83 1.61 8.00 -0.39 -4.79 116.55 118.90 1u7r n ASP 122 Ca 0.06 -2.14 -0.11 0.00 0.71 0.00 0.00 54.79 53.31 1u7r n ASP 122 Cb 0.22 -0.09 0.03 0.00 -0.02 0.00 0.00 41.12 41.26 1u7r n ASP 122 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1u7r n PHE 123 N -0.48 0.01 -0.62 1.24 7.35 -0.73 -4.65 117.46 119.59 1u7r n PHE 123 Ca 0.04 -2.93 0.00 0.00 -0.76 0.00 0.00 57.45 53.80 1u7r n PHE 123 Cb 0.33 0.05 0.00 0.00 0.35 0.00 0.00 39.48 40.21 1u7r n PHE 123 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1u7r n GLY 124 N 0.01 -1.08 0.18 7.13 0.00 -1.24 -4.57 105.19 105.61 1u7r n GLY 124 Ca 0.12 -1.64 -0.04 0.00 0.00 0.00 0.00 46.02 44.46 1u7r n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u7r h ALA 125 N -2.00 0.50 -0.42 4.61 0.00 -1.98 0.90 119.26 120.87 1u7r h ALA 125 Ca 0.00 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1u7r h ALA 125 Cb 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1u7r h ALA 125 CO 0.00 -0.27 -0.09 -0.44 0.00 0.00 0.00 179.25 178.45 1u7r h ASP 126 N 0.28 0.81 -0.50 0.00 3.32 -1.99 0.53 116.42 118.87 1u7r h ASP 126 Ca 0.21 -0.36 -0.07 0.00 0.02 0.00 0.00 57.03 56.83 1u7r h ASP 126 Cb 0.22 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1u7r h ASP 126 CO -0.23 0.98 0.06 0.00 -1.72 0.00 0.00 179.24 178.33 1u7r h ALA 127 N 0.86 1.08 -0.62 3.45 0.00 -1.81 -1.31 119.26 120.90 1u7r h ALA 127 Ca 0.11 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1u7r h ALA 127 Cb 0.62 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1u7r h ALA 127 CO 0.04 0.59 0.26 1.96 0.00 0.00 0.00 179.25 182.10 1u7r h GLN 128 N 0.84 0.92 -0.68 0.00 4.20 -0.62 -0.38 115.11 119.39 1u7r h GLN 128 Ca 0.17 -0.16 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 1u7r h GLN 128 Cb 0.41 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.00 1u7r h GLN 128 CO 0.01 0.77 0.32 0.78 -0.67 0.00 0.00 178.83 180.04 1u7r h GLY 129 N 0.86 1.06 0.91 3.46 0.00 -0.64 0.18 103.07 108.90 1u7r h GLY 129 Ca 0.21 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 1u7r h GLY 129 CO -0.02 0.51 0.10 0.00 0.00 0.00 0.00 176.54 177.13 1u7r h ALA 130 N 1.15 0.28 -0.71 3.60 0.00 -0.99 -1.22 119.26 121.37 1u7r h ALA 130 Ca 0.23 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1u7r h ALA 130 Cb 0.14 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1u7r h ALA 130 CO -0.03 -0.14 0.18 1.98 0.00 0.00 0.00 179.25 181.24 1u7r h MET 131 N 0.21 1.13 -0.77 0.00 -1.53 -0.85 -0.43 114.93 112.70 1u7r h MET 131 Ca 0.07 -0.27 0.02 0.00 -3.44 0.00 0.00 59.70 56.09 1u7r h MET 131 Cb 0.14 -0.15 -0.04 0.00 -0.55 0.00 0.00 31.60 31.00 1u7r h MET 131 CO -0.01 0.99 0.50 -0.91 0.14 0.00 0.00 176.91 177.63 1u7r h ASN 132 N 1.07 0.86 -0.60 1.39 2.35 -0.49 -0.04 115.58 120.12 1u7r h ASN 132 Ca 0.23 -0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.87 1u7r h ASN 132 Cb 0.36 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 1u7r h ASN 132 CO 0.00 0.61 0.02 0.11 -1.65 0.00 0.00 177.43 176.52 1u7r h LYS 133 N 1.01 1.05 -0.75 0.81 1.57 -0.83 0.51 116.57 119.94 1u7r h LYS 133 Ca 0.29 -0.33 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 1u7r h LYS 133 Cb -0.07 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.11 1u7r h LYS 133 CO -0.08 1.02 0.30 0.00 -0.57 0.00 0.00 179.45 180.13 1u7r h ALA 134 N 0.99 0.97 -0.15 3.86 0.00 -0.59 0.34 119.26 124.68 1u7r h ALA 134 Ca 0.17 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 1u7r h ALA 134 Cb 0.54 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1u7r h ALA 134 CO 0.03 0.59 -0.55 -0.07 0.00 0.00 0.00 179.25 179.25 1u7r h LEU 135 N 1.08 0.51 -0.54 0.00 3.38 -0.85 -1.64 115.31 117.25 1u7r h LEU 135 Ca 0.25 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 1u7r h LEU 135 Cb 0.21 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1u7r h LEU 135 CO -0.02 0.95 0.09 -0.33 0.09 0.00 0.00 178.44 179.23 1u7r h GLU 136 N 0.35 0.89 -0.44 1.13 5.08 -0.61 -0.62 114.58 120.36 1u7r h GLU 136 Ca 0.01 -0.24 0.01 0.00 -1.00 0.00 0.00 59.36 58.14 1u7r h GLU 136 Cb 1.07 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.19 1u7r h GLU 136 CO 0.10 0.86 0.28 1.25 -1.00 0.00 0.00 179.01 180.50 1u7r h LEU 137 N 0.78 0.48 -0.26 1.33 5.85 -0.74 0.14 115.31 122.90 1u7r h LEU 137 Ca 0.16 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.94 1u7r h LEU 137 Cb 0.40 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.25 1u7r h LEU 137 CO 0.01 0.35 -0.14 0.15 -0.34 0.00 0.00 178.44 178.47 1u7r h PHE 138 N 0.58 -0.35 -0.56 1.25 3.04 -1.11 -0.43 116.94 119.35 1u7r h PHE 138 Ca 0.17 0.03 -0.11 0.00 3.98 0.00 0.00 57.97 62.04 1u7r h PHE 138 Cb -0.05 0.20 -0.02 0.00 2.56 0.00 0.00 35.95 38.64 1u7r h PHE 138 CO -0.05 -0.21 -0.07 0.00 -2.02 0.00 0.00 178.31 175.96 1u7r h ARG 139 N -0.12 1.03 -0.33 1.11 3.08 -0.75 -0.62 114.38 117.79 1u7r h ARG 139 Ca 0.14 -0.36 0.00 0.00 0.07 0.00 0.00 59.98 59.83 1u7r h ARG 139 Cb 0.33 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 1u7r h ARG 139 CO -0.33 1.06 0.21 -0.22 -1.07 0.00 0.00 179.97 179.62 1u7r h LYS 140 N 0.92 0.44 -0.25 0.04 3.64 -0.45 0.30 116.57 121.20 1u7r h LYS 140 Ca 0.15 -0.03 -0.16 0.00 -1.27 0.00 0.00 60.65 59.34 1u7r h LYS 140 Cb 0.63 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1u7r h LYS 140 CO 0.04 0.31 -0.49 -0.44 -2.27 0.00 0.00 179.45 176.60 1u7r h ASP 141 N 0.44 0.75 -0.53 4.20 3.32 -0.94 -1.61 116.42 122.05 1u7r h ASP 141 Ca 0.12 -0.38 -0.10 0.00 0.02 0.00 0.00 57.03 56.69 1u7r h ASP 141 Cb -0.03 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 1u7r h ASP 141 CO -0.02 1.11 -0.06 -0.29 -1.72 0.00 0.00 179.24 178.26 1u7r h ILE 142 N 0.54 1.26 -0.84 0.35 2.10 -0.99 -2.20 117.51 117.74 1u7r h ILE 142 Ca 0.02 -1.20 -0.01 0.00 1.08 0.00 0.00 64.86 64.76 1u7r h ILE 142 Cb 1.05 0.90 -0.04 0.00 -1.09 0.00 0.00 36.82 37.64 1u7r h ILE 142 CO 0.10 0.43 0.50 0.00 -1.08 0.00 0.00 178.15 178.10 1u7r h ALA 143 N 1.01 1.30 -0.63 0.18 0.00 -0.67 1.00 119.26 121.45 1u7r h ALA 143 Ca 0.15 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1u7r h ALA 143 Cb 0.61 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1u7r h ALA 143 CO 0.04 0.60 0.28 0.00 0.00 0.00 0.00 179.25 180.16 1u7r h ALA 144 N 1.39 0.82 -0.57 0.00 0.00 -1.02 -1.76 119.26 118.13 1u7r h ALA 144 Ca 0.30 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 1u7r h ALA 144 Cb -0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1u7r h ALA 144 CO -0.06 0.41 -0.00 0.87 0.00 0.00 0.00 179.25 180.48 1u7r h LYS 145 N 0.88 1.00 -0.58 0.00 1.57 -0.77 -2.06 116.57 116.62 1u7r h LYS 145 Ca 0.21 -0.32 0.12 0.00 -1.87 0.00 0.00 60.65 58.79 1u7r h LYS 145 Cb 0.17 -0.09 -0.11 0.00 0.08 0.00 0.00 32.23 32.28 1u7r h LYS 145 CO -0.02 1.00 -0.12 1.88 -0.57 0.00 0.00 179.45 181.61 1u7r h TYR 146 N 0.89 -0.27 -0.78 -1.35 -1.99 -0.55 -1.44 116.97 111.48 1u7r h TYR 146 Ca 0.16 0.05 -0.05 0.00 2.00 0.00 0.00 58.73 60.89 1u7r h TYR 146 Cb 0.55 0.21 -0.03 0.00 2.00 0.00 0.00 36.73 39.45 1u7r h TYR 146 CO 0.04 -0.24 0.30 0.87 -0.00 0.00 0.00 178.16 179.13 1u7r h LYS 147 N 0.01 1.17 -0.10 4.88 1.57 -1.04 -0.24 116.57 122.82 1u7r h LYS 147 Ca 0.28 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1u7r h LYS 147 Cb 0.44 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 1u7r h LYS 147 CO -0.58 0.96 -0.01 0.93 -0.57 0.00 0.00 179.45 180.17 1u7r h GLU 148 N 1.13 0.13 -0.01 3.15 5.08 -0.65 -0.26 114.58 123.16 1u7r h GLU 148 Ca 0.26 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 1u7r h GLU 148 Cb 0.23 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1u7r h GLU 148 CO -0.02 0.16 -0.03 1.28 -1.00 0.00 0.00 179.01 179.39 1u7r n LEU 149 N -4.44 0.64 0.00 1.33 4.77 -0.61 -4.93 117.00 113.75 1u7r n LEU 149 Ca -0.01 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1u7r n LEU 149 Cb 0.14 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1u7r n LEU 149 CO 0.35 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1u7r n GLY 150 N 1.14 0.66 3.53 -0.72 0.00 -0.11 -5.05 105.19 104.65 1u7r n GLY 150 Ca 0.19 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 1u7r n GLY 150 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1u7r s TYR 151 N -2.00 3.16 -0.38 1.61 5.04 -0.18 -4.99 117.35 119.61 1u7r s TYR 151 Ca 0.00 -0.16 0.06 0.00 -2.44 0.00 0.00 57.07 54.53 1u7r s TYR 151 Cb 0.00 -2.21 0.54 0.00 0.35 0.00 0.00 41.96 40.63 1u7r s TYR 151 CO 0.00 -0.16 1.62 1.04 -1.34 0.00 0.00 175.55 176.71 1u7r n GLN 152 N 4.51 2.20 0.00 4.97 1.13 -1.26 -3.20 117.38 125.72 1u7r n GLN 152 Ca -0.16 -3.25 0.14 0.00 -1.94 0.00 0.00 57.00 51.79 1u7r n GLN 152 Cb 0.52 -2.01 0.58 0.00 0.11 0.00 0.00 30.24 29.45 1u7r n GLN 152 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03