#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rhg s PRO 10 N 0.00 2.87 0.55 3.23 0.04 -1.26 -4.55 135.00 135.88 1rhg s PRO 10 Ca 0.00 1.79 0.22 0.00 0.04 0.00 0.00 61.00 63.06 1rhg s PRO 10 Cb 0.00 -1.92 1.49 0.00 0.04 0.00 0.00 34.50 34.11 1rhg s PRO 10 CO 0.00 -1.28 2.16 0.37 0.04 0.00 0.00 177.00 178.29 1rhg h GLN 11 N 0.71 0.00 -0.34 4.56 4.15 -1.99 0.16 115.11 122.36 1rhg h GLN 11 Ca -0.50 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 58.81 1rhg h GLN 11 Cb 1.29 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.97 1rhg h GLN 11 CO 0.54 0.00 -0.25 0.66 -1.93 0.00 0.00 178.83 177.85 1rhg h SER 12 N 0.00 0.69 -0.01 -0.69 4.64 -1.99 -1.89 113.55 114.30 1rhg h SER 12 Ca 0.04 -0.25 -0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1rhg h SER 12 Cb 0.16 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.06 1rhg h SER 12 CO -0.00 0.92 -0.00 0.15 -0.87 0.00 0.00 176.83 177.03 1rhg h PHE 13 N 0.59 0.01 -0.59 4.77 3.57 -1.10 -2.00 116.94 122.19 1rhg h PHE 13 Ca 0.08 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 1rhg h PHE 13 Cb 0.74 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.45 1rhg h PHE 13 CO 0.03 0.35 0.25 1.25 -2.23 0.00 0.00 178.31 177.97 1rhg h LEU 14 N -0.32 0.77 -0.68 0.59 5.85 -1.04 0.17 115.31 120.65 1rhg h LEU 14 Ca 0.00 -0.09 -0.14 0.00 0.84 0.00 0.00 57.88 58.49 1rhg h LEU 14 Cb 0.34 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 1rhg h LEU 14 CO 0.00 0.68 -0.60 -0.07 -0.34 0.00 0.00 178.44 178.11 1rhg h LEU 15 N 0.84 0.24 -0.06 2.25 3.38 -1.31 -0.51 115.31 120.14 1rhg h LEU 15 Ca 0.20 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1rhg h LEU 15 Cb 0.14 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 1rhg h LEU 15 CO -0.02 0.78 0.01 0.50 0.09 0.00 0.00 178.44 179.80 1rhg h LYS 16 N 0.16 0.10 -0.60 1.13 3.64 -0.48 -2.06 116.57 118.46 1rhg h LYS 16 Ca -0.01 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.39 1rhg h LYS 16 Cb 1.09 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.85 1rhg h LYS 16 CO 0.09 0.33 0.34 0.00 -2.27 0.00 0.00 179.45 177.94 1rhg h LEU 18 N 0.65 0.48 -0.48 0.00 5.85 -0.92 -0.43 115.31 120.46 1rhg h LEU 18 Ca 0.26 0.03 0.03 0.00 0.84 0.00 0.00 57.88 59.04 1rhg h LEU 18 Cb 0.11 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1rhg h LEU 18 CO -0.15 0.32 0.26 -0.08 -0.34 0.00 0.00 178.44 178.46 1rhg h GLU 19 N 0.62 0.51 0.32 1.25 4.81 -1.07 -1.19 114.58 119.83 1rhg h GLU 19 Ca 0.28 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.46 1rhg h GLU 19 Cb 0.17 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1rhg h GLU 19 CO -0.18 0.34 -0.15 1.96 -0.73 0.00 0.00 179.01 180.25 1rhg h GLN 20 N 0.53 -0.41 -0.93 1.92 4.20 -1.17 -1.94 115.11 117.30 1rhg h GLN 20 Ca 0.20 0.03 0.18 0.00 0.06 0.00 0.00 58.65 59.12 1rhg h GLN 20 Cb 0.06 0.09 -0.08 0.00 0.30 0.00 0.00 27.48 27.86 1rhg h GLN 20 CO -0.11 -0.11 0.60 0.28 -0.67 0.00 0.00 178.83 178.81 1rhg h VAL 21 N -0.72 0.73 0.00 -0.54 2.07 -0.98 -1.02 116.25 115.79 1rhg h VAL 21 Ca -0.04 -0.20 -0.14 0.00 0.82 0.00 0.00 66.70 67.13 1rhg h VAL 21 Cb 0.49 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1rhg h VAL 21 CO 0.07 0.11 -0.66 -0.09 0.02 0.00 0.00 177.57 177.02 1rhg h ARG 22 N 0.60 0.00 -0.00 1.57 1.12 -1.05 0.30 114.38 116.92 1rhg h ARG 22 Ca 0.49 0.00 -0.02 0.00 -1.11 0.00 0.00 59.98 59.34 1rhg h ARG 22 Cb 0.96 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.92 1rhg h ARG 22 CO -0.24 0.66 -0.09 -0.22 -3.11 0.00 0.00 179.97 176.97 1rhg h LYS 23 N 0.00 0.07 -0.57 0.20 3.64 -0.48 -1.33 116.57 118.10 1rhg h LYS 23 Ca -0.01 -0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.36 1rhg h LYS 23 Cb 1.31 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 33.09 1rhg h LYS 23 CO 0.09 0.81 0.29 0.82 -2.27 0.00 0.00 179.45 179.18 1rhg h ILE 24 N -0.64 0.95 -0.93 2.00 2.04 -1.15 -0.55 117.51 119.23 1rhg h ILE 24 Ca -0.01 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 1rhg h ILE 24 Cb 0.83 0.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 1rhg h ILE 24 CO 0.02 0.10 0.57 1.56 0.00 0.00 0.00 178.15 180.40 1rhg h GLN 25 N 0.56 1.25 -0.23 2.37 4.20 -0.96 -0.65 115.11 121.65 1rhg h GLN 25 Ca 0.25 -0.11 -0.05 0.00 0.06 0.00 0.00 58.65 58.80 1rhg h GLN 25 Cb 0.16 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 1rhg h GLN 25 CO -0.17 0.87 -0.10 0.78 -0.67 0.00 0.00 178.83 179.53 1rhg h GLY 26 N 1.27 0.39 0.87 3.46 0.00 -0.61 -1.82 103.07 106.64 1rhg h GLY 26 Ca 0.33 -0.24 -0.06 0.00 0.00 0.00 0.00 47.33 47.36 1rhg h GLY 26 CO -0.06 0.23 -0.07 -0.55 0.00 0.00 0.00 176.54 176.08 1rhg h ASP 27 N 0.34 0.55 -0.36 0.19 3.32 0.11 -2.06 116.42 118.51 1rhg h ASP 27 Ca 0.07 -0.37 0.01 0.00 0.02 0.00 0.00 57.03 56.76 1rhg h ASP 27 Cb 0.39 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1rhg h ASP 27 CO 0.02 0.79 0.24 1.23 -1.72 0.00 0.00 179.24 179.80 1rhg h GLY 28 N 0.29 0.50 1.87 2.75 0.00 -1.06 -1.02 103.07 106.41 1rhg h GLY 28 Ca 0.07 -0.19 -0.19 0.00 0.00 0.00 0.00 47.33 47.02 1rhg h GLY 28 CO 0.03 0.18 -0.88 0.00 0.00 0.00 0.00 176.54 175.86 1rhg h ALA 29 N 1.78 0.53 -0.47 3.60 0.00 -1.09 -1.20 119.26 122.40 1rhg h ALA 29 Ca 0.13 -0.75 -0.04 0.00 0.00 0.00 0.00 54.91 54.25 1rhg h ALA 29 Cb -0.04 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1rhg h ALA 29 CO -0.03 0.98 0.14 0.00 0.00 0.00 0.00 179.25 180.35 1rhg h ALA 30 N 1.03 0.62 0.51 0.00 0.00 -0.50 -0.52 119.26 120.40 1rhg h ALA 30 Ca -0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1rhg h ALA 30 Cb 1.53 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1rhg h ALA 30 CO 0.13 0.28 -0.39 1.25 0.00 0.00 0.00 179.25 180.52 1rhg h LEU 31 N 0.63 -1.03 -0.90 0.00 5.85 -1.23 -2.19 115.31 116.43 1rhg h LEU 31 Ca 0.15 0.07 0.18 0.00 0.84 0.00 0.00 57.88 59.13 1rhg h LEU 31 Cb 0.28 0.32 -0.11 0.00 0.37 0.00 0.00 40.66 41.52 1rhg h LEU 31 CO -0.00 -0.56 0.47 1.56 -0.34 0.00 0.00 178.44 179.57 1rhg h GLN 32 N -0.86 0.57 -0.69 1.25 4.20 -1.23 0.14 115.11 118.49 1rhg h GLN 32 Ca -0.07 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.55 1rhg h GLN 32 Cb 0.72 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.34 1rhg h GLN 32 CO 0.02 0.37 0.19 1.49 -0.67 0.00 0.00 178.83 180.23 1rhg h GLU 33 N 0.58 1.07 0.28 1.46 4.81 -1.01 -1.22 114.58 120.56 1rhg h GLU 33 Ca 0.53 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.51 1rhg h GLU 33 Cb 0.87 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.10 1rhg h GLU 33 CO -0.42 0.93 -0.13 0.87 -0.73 0.00 0.00 179.01 179.53 1rhg h LYS 34 N 1.03 -0.36 -0.97 1.92 1.79 -0.14 -0.75 116.57 119.08 1rhg h LYS 34 Ca 0.22 0.02 0.13 0.00 -2.18 0.00 0.00 60.65 58.84 1rhg h LYS 34 Cb 0.33 0.08 -0.09 0.00 -1.58 0.00 0.00 32.23 30.97 1rhg h LYS 34 CO -0.00 -0.11 0.60 -0.07 -1.08 0.00 0.00 179.45 178.79 1rhg h LEU 35 N -0.58 0.86 -0.05 2.94 3.38 -0.99 0.22 115.31 121.09 1rhg h LEU 35 Ca -0.04 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1rhg h LEU 35 Cb 0.42 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1rhg h LEU 35 CO 0.06 0.44 -0.13 0.00 0.09 0.00 0.00 178.44 178.90 1rhg h ALA 37 N 0.45 -0.07 -0.00 0.00 0.00 -0.57 0.13 119.26 119.19 1rhg h ALA 37 Ca -0.00 -0.09 -0.25 0.00 0.00 0.00 0.00 54.91 54.57 1rhg h ALA 37 Cb 0.73 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.56 1rhg h ALA 37 CO 0.03 -0.46 -0.99 1.15 0.00 0.00 0.00 179.25 178.97 1rhg h THR 38 N -0.23 1.34 -0.05 0.00 2.02 -0.69 -3.37 112.91 111.93 1rhg h THR 38 Ca -0.01 -2.34 0.00 0.00 0.77 0.00 0.00 66.41 64.83 1rhg h THR 38 Cb 0.20 2.39 0.00 0.00 -1.74 0.00 0.00 68.15 69.00 1rhg h THR 38 CO 0.01 0.71 0.00 -1.22 0.37 0.00 0.00 175.52 175.39 1rhg n TYR 39 N -3.80 0.06 -1.51 3.16 4.01 -0.68 -5.00 117.16 113.39 1rhg n TYR 39 Ca -0.09 -0.09 -0.17 0.00 -0.16 0.00 0.00 57.90 57.39 1rhg n TYR 39 Cb 0.86 -0.01 -0.07 0.00 -0.31 0.00 0.00 39.34 39.81 1rhg n TYR 39 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1rhg n LYS 40 N 0.35 -1.38 -2.86 -0.72 4.76 0.44 -4.91 118.16 113.84 1rhg n LYS 40 Ca 0.05 0.97 -0.43 0.00 -2.87 0.00 0.00 58.31 56.03 1rhg n LYS 40 Cb 0.21 -5.29 -0.01 0.00 -1.84 0.00 0.00 35.03 28.10 1rhg n LYS 40 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1rhg s LEU 41 N -4.24 4.75 0.00 -0.35 1.43 -1.20 -4.80 118.68 114.27 1rhg s LEU 41 Ca 0.00 -2.40 0.13 0.00 -1.03 0.00 0.00 54.13 50.83 1rhg s LEU 41 Cb 0.00 -2.44 0.26 0.00 0.03 0.00 0.00 46.19 44.05 1rhg s LEU 41 CO 0.00 -1.00 1.16 0.00 0.23 0.00 0.00 176.35 176.74 1rhg s HIS 43 N -1.04 0.14 0.46 0.00 3.76 -1.26 -4.97 115.29 112.39 1rhg s HIS 43 Ca 0.23 -0.94 0.29 0.00 -0.15 0.00 0.00 55.06 54.49 1rhg s HIS 43 Cb 0.13 -0.71 1.36 0.00 1.11 0.00 0.00 32.58 34.47 1rhg s HIS 43 CO 0.18 -0.88 1.74 -1.35 -0.85 0.00 0.00 174.74 173.58 1rhg h PRO 44 N 7.69 0.17 -0.22 8.40 0.11 -1.92 -0.92 132.00 145.31 1rhg h PRO 44 Ca -0.06 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 66.10 1rhg h PRO 44 Cb 1.02 -0.04 -0.07 0.00 0.11 0.00 0.00 31.00 32.02 1rhg h PRO 44 CO 0.32 0.11 -0.31 0.93 -0.21 0.00 0.00 178.00 178.84 1rhg h GLU 45 N 0.17 -0.32 -0.06 1.05 3.07 -2.00 -0.92 114.58 115.57 1rhg h GLU 45 Ca 0.65 0.02 0.02 0.00 -0.50 0.00 0.00 59.36 59.55 1rhg h GLU 45 Cb 2.12 0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 30.10 1rhg h GLU 45 CO -0.21 -0.22 0.09 0.93 -1.40 0.00 0.00 179.01 178.20 1rhg h GLU 46 N -0.34 0.00 -0.06 2.33 5.08 -1.59 -2.13 114.58 117.87 1rhg h GLU 46 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1rhg h GLU 46 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1rhg h GLU 46 CO -0.41 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 178.88 1rhg n LEU 47 N -3.69 2.71 -0.19 1.33 4.77 -0.36 -4.57 117.00 117.00 1rhg n LEU 47 Ca -0.01 -0.93 0.21 0.00 -0.03 0.00 0.00 56.01 55.24 1rhg n LEU 47 Cb 0.18 -0.02 0.57 0.00 -2.33 0.00 0.00 43.42 41.82 1rhg n LEU 47 CO 0.26 0.47 1.23 1.62 -1.33 0.00 0.00 177.39 179.63 1rhg h VAL 48 N 4.17 0.67 0.00 4.08 3.04 -1.23 0.86 116.25 127.84 1rhg h VAL 48 Ca 0.00 -0.10 -0.10 0.00 -1.01 0.00 0.00 66.70 65.50 1rhg h VAL 48 Cb 0.89 0.37 -0.01 0.00 -2.01 0.00 0.00 31.29 30.52 1rhg h VAL 48 CO 0.00 0.05 -0.46 -0.07 -1.01 0.00 0.00 177.57 176.08 1rhg h LEU 49 N 0.28 0.00 -1.05 3.16 4.07 -1.83 -3.14 115.31 116.80 1rhg h LEU 49 Ca 0.43 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 58.30 1rhg h LEU 49 Cb 1.22 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.95 1rhg h LEU 49 CO -0.12 0.46 -0.40 -0.07 -1.08 0.00 0.00 178.44 177.24 1rhg h LEU 50 N 0.00 0.00 -2.20 1.67 4.07 -1.15 -2.70 115.31 115.00 1rhg h LEU 50 Ca -0.00 0.00 0.04 0.00 0.08 0.00 0.00 57.88 58.00 1rhg h LEU 50 Cb 1.26 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.00 1rhg h LEU 50 CO 0.06 0.40 0.27 1.23 -1.08 0.00 0.00 178.44 179.32 1rhg h GLY 51 N 1.74 0.00 0.69 0.83 0.00 -1.50 0.11 103.07 104.94 1rhg h GLY 51 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 1rhg h GLY 51 CO 0.05 0.00 -0.22 0.84 0.00 0.00 0.00 176.54 177.22 1rhg h HIS 52 N 0.00 -0.56 -0.46 5.60 -0.00 -1.68 -1.09 115.15 116.96 1rhg h HIS 52 Ca 0.07 -0.01 -0.03 0.00 -0.00 0.00 0.00 60.37 60.39 1rhg h HIS 52 Cb 0.60 0.19 -0.02 0.00 -0.00 0.00 0.00 27.41 28.18 1rhg h HIS 52 CO 0.00 -0.24 0.15 0.77 -0.00 0.00 0.00 177.93 178.61 1rhg h SER 53 N -0.92 0.66 0.92 3.26 0.02 -1.18 -2.65 113.55 113.65 1rhg h SER 53 Ca -0.06 -0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 1rhg h SER 53 Cb 0.58 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1rhg h SER 53 CO 0.10 0.68 0.00 -0.07 -1.14 0.00 0.00 176.83 176.40 1rhg h LEU 54 N 0.60 0.00 1.90 5.07 3.38 -0.91 -3.46 115.31 121.88 1rhg h LEU 54 Ca 0.15 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.80 1rhg h LEU 54 Cb 0.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1rhg h LEU 54 CO -0.01 0.00 -0.42 0.61 0.09 0.00 0.00 178.44 178.72 1rhg n GLY 55 N 0.12 -0.27 3.67 0.83 0.00 -0.47 -4.64 105.19 104.43 1rhg n GLY 55 Ca 0.02 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1rhg n GLY 55 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rhg s ILE 56 N -2.84 3.55 0.75 -0.61 1.01 -0.87 -4.71 121.20 117.48 1rhg s ILE 56 Ca 0.05 0.75 -0.11 0.00 0.00 0.00 0.00 60.65 61.34 1rhg s ILE 56 Cb -0.02 -3.49 0.04 0.00 0.01 0.00 0.00 42.46 39.00 1rhg s ILE 56 CO 0.06 -0.05 1.08 -2.16 0.00 0.00 0.00 174.94 173.87 1rhg s PRO 57 N 3.64 2.52 -0.07 2.79 0.04 -1.26 -4.92 135.00 137.74 1rhg s PRO 57 Ca 0.72 0.85 0.02 0.00 0.04 0.00 0.00 61.00 62.63 1rhg s PRO 57 Cb -0.33 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.23 1rhg s PRO 57 CO 0.29 -1.37 -0.11 -0.46 0.04 0.00 0.00 177.00 175.39 1rhg s TRP 58 N -3.07 2.80 -0.35 0.56 -0.11 -1.26 -5.09 118.94 112.42 1rhg s TRP 58 Ca 0.59 -0.15 -0.11 0.00 1.22 0.00 0.00 56.10 57.66 1rhg s TRP 58 Cb -0.15 -1.69 0.01 0.00 -1.50 0.00 0.00 33.47 30.15 1rhg s TRP 58 CO 0.55 0.19 0.19 0.00 -4.62 0.00 0.00 176.95 173.26 1rhg s ALA 59 N -0.60 3.29 0.22 5.86 0.00 -1.26 -5.08 121.76 124.18 1rhg s ALA 59 Ca 0.09 -1.60 -0.30 0.00 0.00 0.00 0.00 51.96 50.15 1rhg s ALA 59 Cb -0.11 -2.53 -0.09 0.00 0.00 0.00 0.00 23.12 20.39 1rhg s ALA 59 CO 0.01 -1.22 0.99 -1.25 0.00 0.00 0.00 175.76 174.30 1rhg s PRO 60 N 1.58 4.77 0.00 0.00 0.04 -1.26 -4.91 135.00 135.22 1rhg s PRO 60 Ca 0.03 1.57 0.00 0.00 0.04 0.00 0.00 61.00 62.64 1rhg s PRO 60 Cb -0.18 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 31.08 1rhg s PRO 60 CO 0.07 0.38 0.00 -0.11 0.04 0.00 0.00 177.00 177.37 1rhg n LEU 61 N 1.70 0.00 -0.35 -3.56 7.94 -1.26 -4.90 117.00 116.57 1rhg n LEU 61 Ca -0.01 0.00 -0.09 0.00 -1.11 0.00 0.00 56.01 54.80 1rhg n LEU 61 Cb 0.47 0.13 -0.08 0.00 0.53 0.00 0.00 43.42 44.47 1rhg n LEU 61 CO 0.51 -0.21 0.47 -1.20 -1.11 0.00 0.00 177.39 175.85 1rhg n SER 62 N -1.92 -0.87 -0.11 1.96 7.64 -1.26 0.16 113.62 119.22 1rhg n SER 62 Ca 0.00 1.62 0.00 0.00 1.01 0.00 0.00 58.87 61.50 1rhg n SER 62 Cb 0.00 -0.26 0.00 0.00 -1.01 0.00 0.00 64.21 62.94 1rhg n SER 62 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1rhg n SER 63 N -4.88 0.10 -3.34 6.43 3.41 -1.26 -5.06 113.62 109.02 1rhg n SER 63 Ca 0.02 -0.90 0.00 0.00 -0.26 0.00 0.00 58.87 57.73 1rhg n SER 63 Cb 0.21 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 1rhg n SER 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rhg n LEU 71 N 0.00 0.00 0.00 0.00 -0.00 -1.26 -5.07 117.00 110.67 1rhg n LEU 71 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1rhg n LEU 71 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1rhg n LEU 71 CO 0.00 -0.41 0.00 0.00 -0.00 0.00 0.00 177.39 176.98 1rhg n ALA 72 N -3.00 0.00 -0.03 1.47 0.00 -1.26 0.18 120.51 117.87 1rhg n ALA 72 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1rhg n ALA 72 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1rhg n ALA 72 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1rhg h GLY 73 N 0.00 0.23 0.99 0.00 0.00 -2.05 0.80 103.07 103.04 1rhg h GLY 73 Ca 0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.18 1rhg h GLY 73 CO 0.00 0.11 0.19 0.00 0.00 0.00 0.00 176.54 176.84 1rhg h LEU 75 N 0.77 0.26 -0.63 0.00 3.38 -1.31 0.53 115.31 118.32 1rhg h LEU 75 Ca 0.18 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.92 1rhg h LEU 75 Cb 0.25 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1rhg h LEU 75 CO -0.01 0.60 -0.41 -1.28 0.09 0.00 0.00 178.44 177.43 1rhg h SER 76 N 0.22 0.65 -0.22 -0.43 0.87 0.18 -1.66 113.55 113.16 1rhg h SER 76 Ca 0.03 -0.29 -0.09 0.00 -1.23 0.00 0.00 61.79 60.20 1rhg h SER 76 Cb 0.73 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.49 1rhg h SER 76 CO 0.06 0.98 -0.17 -0.61 -0.53 0.00 0.00 176.83 176.56 1rhg h GLN 77 N 0.50 0.65 -0.03 2.24 4.15 0.12 0.26 115.11 123.00 1rhg h GLN 77 Ca 0.04 -0.22 -0.00 0.00 0.77 0.00 0.00 58.65 59.23 1rhg h GLN 77 Cb 0.93 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.57 1rhg h GLN 77 CO 0.08 0.78 0.01 1.25 -1.93 0.00 0.00 178.83 179.02 1rhg h LEU 78 N 0.58 0.04 -0.47 -2.39 6.46 -0.91 -1.29 115.31 117.32 1rhg h LEU 78 Ca 0.09 -0.21 0.06 0.00 -0.12 0.00 0.00 57.88 57.70 1rhg h LEU 78 Cb 0.62 -0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 40.49 1rhg h LEU 78 CO 0.04 0.23 0.18 -0.74 -0.62 0.00 0.00 178.44 177.54 1rhg h HIS 79 N -0.16 0.33 0.32 1.25 2.76 -0.83 -0.02 115.15 118.79 1rhg h HIS 79 Ca 0.01 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.19 1rhg h HIS 79 Cb 0.21 -0.08 0.00 0.00 1.55 0.00 0.00 27.41 29.10 1rhg h HIS 79 CO -0.00 0.13 -0.15 0.77 -1.30 0.00 0.00 177.93 177.37 1rhg h SER 80 N 0.37 -0.36 -0.98 3.26 0.02 -0.88 -0.05 113.55 114.92 1rhg h SER 80 Ca 0.22 -0.07 0.17 0.00 -0.84 0.00 0.00 61.79 61.27 1rhg h SER 80 Cb 0.21 0.09 -0.09 0.00 0.14 0.00 0.00 62.40 62.75 1rhg h SER 80 CO -0.21 -0.16 0.61 1.23 -1.14 0.00 0.00 176.83 177.17 1rhg h GLY 81 N -0.56 1.56 0.77 -3.77 0.00 -0.90 0.18 103.07 100.36 1rhg h GLY 81 Ca -0.04 -0.35 -0.07 0.00 0.00 0.00 0.00 47.33 46.87 1rhg h GLY 81 CO 0.07 0.01 -0.17 1.41 0.00 0.00 0.00 176.54 177.86 1rhg h LEU 82 N 0.76 0.43 -1.79 3.11 3.38 -0.92 -1.40 115.31 118.88 1rhg h LEU 82 Ca 0.53 -0.49 0.05 0.00 0.09 0.00 0.00 57.88 58.07 1rhg h LEU 82 Cb 0.82 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 1rhg h LEU 82 CO -0.31 0.83 0.25 0.15 0.09 0.00 0.00 178.44 179.45 1rhg h PHE 83 N 0.04 0.26 -0.10 1.13 3.04 0.75 -0.78 116.94 121.28 1rhg h PHE 83 Ca 0.02 0.01 -0.07 0.00 3.98 0.00 0.00 57.97 61.91 1rhg h PHE 83 Cb 0.71 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 39.14 1rhg h PHE 83 CO 0.08 0.15 -0.23 1.25 -2.02 0.00 0.00 178.31 177.54 1rhg h LEU 84 N 0.27 0.37 -0.82 0.59 5.85 -0.37 -2.97 115.31 118.22 1rhg h LEU 84 Ca 0.16 -0.58 -0.10 0.00 0.84 0.00 0.00 57.88 58.20 1rhg h LEU 84 Cb 0.30 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 1rhg h LEU 84 CO -0.03 0.89 -0.17 1.88 -0.34 0.00 0.00 178.44 180.67 1rhg h TYR 85 N -0.13 0.78 -0.73 1.25 0.05 -0.53 -1.71 116.97 115.95 1rhg h TYR 85 Ca -0.00 -0.15 -0.02 0.00 0.05 0.00 0.00 58.73 58.60 1rhg h TYR 85 Cb 0.84 -0.20 -0.03 0.00 1.01 0.00 0.00 36.73 38.35 1rhg h TYR 85 CO 0.11 0.82 0.36 1.96 -1.05 0.00 0.00 178.16 180.37 1rhg h GLN 86 N 0.63 1.04 0.12 4.88 1.08 -1.20 -1.84 115.11 119.82 1rhg h GLN 86 Ca 0.10 -0.14 0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1rhg h GLN 86 Cb 0.64 -0.20 -0.04 0.00 -0.05 0.00 0.00 27.48 27.83 1rhg h GLN 86 CO 0.04 0.79 -0.28 0.78 -0.95 0.00 0.00 178.83 179.22 1rhg h GLY 87 N 1.09 -0.53 1.39 3.46 0.00 -1.34 -1.50 103.07 105.63 1rhg h GLY 87 Ca 0.25 0.33 -0.03 0.00 0.00 0.00 0.00 47.33 47.89 1rhg h GLY 87 CO -0.03 -0.23 0.21 1.41 0.00 0.00 0.00 176.54 177.89 1rhg h LEU 88 N -0.50 0.71 -0.18 3.11 3.38 -1.13 0.41 115.31 121.12 1rhg h LEU 88 Ca 0.03 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1rhg h LEU 88 Cb 0.53 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1rhg h LEU 88 CO -0.16 0.65 -0.02 -0.07 0.09 0.00 0.00 178.44 178.93 1rhg h LEU 89 N 0.77 0.32 0.19 1.67 3.38 -1.27 -1.95 115.31 118.43 1rhg h LEU 89 Ca 0.18 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.83 1rhg h LEU 89 Cb 0.16 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1rhg h LEU 89 CO -0.02 0.57 -0.25 -0.61 0.09 0.00 0.00 178.44 178.22 1rhg h GLN 90 N 0.05 -0.48 -1.33 1.13 4.15 -0.83 -2.48 115.11 115.32 1rhg h GLN 90 Ca 0.05 0.03 0.39 0.00 0.77 0.00 0.00 58.65 59.89 1rhg h GLN 90 Cb 0.42 0.11 -0.08 0.00 0.21 0.00 0.00 27.48 28.14 1rhg h GLN 90 CO 0.01 -0.32 0.92 0.00 -1.93 0.00 0.00 178.83 177.51 1rhg h ALA 91 N 0.19 2.98 0.00 3.38 0.00 -0.85 0.03 119.26 124.98 1rhg h ALA 91 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1rhg h ALA 91 Cb 0.49 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1rhg h ALA 91 CO -0.09 -1.44 0.00 1.28 0.00 0.00 0.00 179.25 178.99 1rhg n LEU 92 N -4.36 0.00 -4.49 0.00 4.77 -0.74 -4.59 117.00 107.59 1rhg n LEU 92 Ca 0.32 0.41 -0.40 0.00 -0.03 0.00 0.00 56.01 56.31 1rhg n LEU 92 Cb 1.35 -0.41 -0.08 0.00 -2.33 0.00 0.00 43.42 41.95 1rhg n LEU 92 CO 0.33 -0.23 -0.22 -0.62 -1.33 0.00 0.00 177.39 175.32 1rhg n GLU 93 N -1.41 -0.75 -0.98 3.23 1.02 -0.00 -0.31 120.64 121.42 1rhg n GLU 93 Ca 0.04 0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 1rhg n GLU 93 Cb 0.13 -4.48 0.00 0.00 -0.02 0.00 0.00 31.44 27.08 1rhg n GLU 93 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rhg n GLY 94 N -1.35 0.70 5.01 0.62 0.00 -1.26 -4.69 105.19 104.22 1rhg n GLY 94 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1rhg n GLY 94 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1rhg n ILE 95 N -2.46 0.00 -4.16 -0.61 5.41 0.57 -3.28 119.36 114.83 1rhg n ILE 95 Ca 0.00 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.65 1rhg n ILE 95 Cb 0.02 0.00 -0.10 0.00 -0.71 0.00 0.00 39.64 38.85 1rhg n ILE 95 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1rhg s SER 96 N -0.07 0.25 0.22 4.38 1.04 -1.26 -4.88 113.70 113.38 1rhg s SER 96 Ca 0.00 -1.25 -0.09 0.00 0.48 0.00 0.00 55.95 55.09 1rhg s SER 96 Cb 0.00 0.32 0.33 0.00 0.10 0.00 0.00 66.02 66.77 1rhg s SER 96 CO 0.00 -0.77 1.69 1.55 0.98 0.00 0.00 173.24 176.70 1rhg h PRO 97 N 2.79 0.22 0.00 4.02 0.13 -1.95 -1.39 132.00 135.82 1rhg h PRO 97 Ca -0.35 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.72 1rhg h PRO 97 Cb 1.21 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 1rhg h PRO 97 CO 0.57 0.15 -0.23 0.93 -0.23 0.00 0.00 178.00 179.19 1rhg h GLU 98 N 0.23 0.00 0.00 0.86 3.07 -1.96 -2.87 114.58 113.91 1rhg h GLU 98 Ca 0.34 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.20 1rhg h GLU 98 Cb 0.53 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.44 1rhg h GLU 98 CO -0.45 0.23 -0.63 1.28 -1.40 0.00 0.00 179.01 178.04 1rhg n LEU 99 N -4.18 0.59 0.09 1.33 4.32 -0.72 -4.65 117.00 113.79 1rhg n LEU 99 Ca -0.02 -0.06 -0.14 0.00 -0.02 0.00 0.00 56.01 55.77 1rhg n LEU 99 Cb 0.29 -0.20 -0.07 0.00 -1.62 0.00 0.00 43.42 41.82 1rhg n LEU 99 CO 0.36 0.12 0.58 1.23 -1.22 0.00 0.00 177.39 178.47 1rhg h GLY 100 N 4.93 -0.83 -0.67 -0.72 0.00 -1.05 -1.08 103.07 103.65 1rhg h GLY 100 Ca 0.00 0.51 0.14 0.00 0.00 0.00 0.00 47.33 47.98 1rhg h GLY 100 CO 0.00 -0.26 -0.32 -0.56 0.00 0.00 0.00 176.54 175.40 1rhg h PRO 101 N -0.62 -0.06 -0.70 4.80 0.13 -1.82 -1.00 132.00 132.73 1rhg h PRO 101 Ca 0.03 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.27 1rhg h PRO 101 Cb 0.67 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 31.74 1rhg h PRO 101 CO -0.28 -0.04 0.32 1.15 -0.23 0.00 0.00 178.00 178.91 1rhg h THR 102 N -0.07 0.79 -0.11 1.56 2.02 -1.74 -0.61 112.91 114.76 1rhg h THR 102 Ca 0.31 -0.18 -0.17 0.00 0.77 0.00 0.00 66.41 67.14 1rhg h THR 102 Cb 0.58 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 1rhg h THR 102 CO -0.83 0.10 -0.65 0.25 0.37 0.00 0.00 175.52 174.76 1rhg h LEU 103 N 0.53 0.49 -0.38 2.58 5.85 -0.56 -2.47 115.31 121.34 1rhg h LEU 103 Ca 0.35 -0.29 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 1rhg h LEU 103 Cb 0.43 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1rhg h LEU 103 CO -0.30 1.01 0.07 0.44 -0.34 0.00 0.00 178.44 179.31 1rhg h ASP 104 N 0.31 0.60 -0.01 1.25 3.32 0.15 -2.42 116.42 119.61 1rhg h ASP 104 Ca -0.01 -0.26 0.03 0.00 0.02 0.00 0.00 57.03 56.81 1rhg h ASP 104 Cb 1.20 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 40.54 1rhg h ASP 104 CO 0.11 0.70 -0.29 0.74 -1.72 0.00 0.00 179.24 178.79 1rhg h THR 105 N 0.47 0.36 -0.38 0.35 2.02 -1.08 -1.65 112.91 113.01 1rhg h THR 105 Ca 0.12 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.41 1rhg h THR 105 Cb 0.35 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 1rhg h THR 105 CO 0.01 0.00 0.27 0.25 0.37 0.00 0.00 175.52 176.42 1rhg h LEU 106 N -0.43 0.00 0.05 2.58 5.85 -1.30 -2.01 115.31 120.06 1rhg h LEU 106 Ca 0.07 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.58 1rhg h LEU 106 Cb 0.52 -0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.57 1rhg h LEU 106 CO -0.26 0.00 -0.82 -0.61 -0.34 0.00 0.00 178.44 176.41 1rhg h GLN 107 N 0.00 0.47 -0.27 1.25 4.15 -0.93 -1.33 115.11 118.46 1rhg h GLN 107 Ca 0.18 -0.57 -0.02 0.00 0.77 0.00 0.00 58.65 59.01 1rhg h GLN 107 Cb 0.72 0.18 -0.01 0.00 0.21 0.00 0.00 27.48 28.58 1rhg h GLN 107 CO -0.00 1.21 0.11 -0.07 -1.93 0.00 0.00 178.83 178.15 1rhg h LEU 108 N -0.01 0.37 -0.36 -2.39 3.38 -1.01 -1.19 115.31 114.10 1rhg h LEU 108 Ca -0.12 -0.16 0.07 0.00 0.09 0.00 0.00 57.88 57.76 1rhg h LEU 108 Cb 1.54 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 42.13 1rhg h LEU 108 CO 0.16 0.43 -0.03 0.44 0.09 0.00 0.00 178.44 179.53 1rhg h ASP 109 N 0.29 -0.21 -0.52 -0.43 5.19 -1.44 -1.10 116.42 118.19 1rhg h ASP 109 Ca 0.09 0.09 -0.01 0.00 -0.62 0.00 0.00 57.03 56.58 1rhg h ASP 109 Cb 0.18 0.18 -0.02 0.00 0.18 0.00 0.00 39.33 39.84 1rhg h ASP 109 CO -0.01 -0.07 0.29 0.58 -3.12 0.00 0.00 179.24 176.91 1rhg h VAL 110 N 0.06 1.17 -0.96 -1.35 2.07 -1.22 -2.49 116.25 113.54 1rhg h VAL 110 Ca 0.18 -0.44 0.08 0.00 0.82 0.00 0.00 66.70 67.33 1rhg h VAL 110 Cb 0.26 0.52 -0.07 0.00 -1.52 0.00 0.00 31.29 30.48 1rhg h VAL 110 CO -0.32 0.19 0.61 0.00 0.02 0.00 0.00 177.57 178.06 1rhg h ALA 111 N 1.12 1.36 0.20 1.67 0.00 -0.98 -0.68 119.26 121.95 1rhg h ALA 111 Ca 0.18 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1rhg h ALA 111 Cb 0.04 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1rhg h ALA 111 CO -0.03 0.34 -0.14 -0.44 0.00 0.00 0.00 179.25 178.98 1rhg h ASP 112 N 1.07 -0.36 -0.81 0.00 3.32 -1.01 -2.58 116.42 116.05 1rhg h ASP 112 Ca 0.43 0.03 0.07 0.00 0.02 0.00 0.00 57.03 57.58 1rhg h ASP 112 Cb 0.25 0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.87 1rhg h ASP 112 CO -0.20 -0.22 0.53 0.15 -1.72 0.00 0.00 179.24 177.78 1rhg h PHE 113 N -0.34 0.88 -0.07 4.55 3.57 -0.99 0.10 116.94 124.63 1rhg h PHE 113 Ca -0.01 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 1rhg h PHE 113 Cb 0.30 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 1rhg h PHE 113 CO -0.10 0.45 -0.07 0.00 -2.23 0.00 0.00 178.31 176.37 1rhg h ALA 114 N 1.57 1.76 0.16 2.41 0.00 -0.92 -2.40 119.26 121.83 1rhg h ALA 114 Ca 0.35 -0.11 -0.33 0.00 0.00 0.00 0.00 54.91 54.82 1rhg h ALA 114 Cb 0.27 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1rhg h ALA 114 CO -0.13 0.19 -1.66 1.15 0.00 0.00 0.00 179.25 178.80 1rhg h THR 115 N 0.11 1.03 -0.82 0.00 2.02 -0.48 -2.78 112.91 111.98 1rhg h THR 115 Ca 0.02 -2.63 0.20 0.00 0.77 0.00 0.00 66.41 64.77 1rhg h THR 115 Cb 0.19 2.76 -0.14 0.00 -1.74 0.00 0.00 68.15 69.23 1rhg h THR 115 CO 0.01 0.83 0.14 0.74 0.37 0.00 0.00 175.52 177.61 1rhg h THR 116 N 0.09 0.34 0.44 3.16 2.02 -0.70 -0.69 112.91 117.57 1rhg h THR 116 Ca -0.30 -0.06 -0.02 0.00 0.77 0.00 0.00 66.41 66.80 1rhg h THR 116 Cb 2.07 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.63 1rhg h THR 116 CO 0.17 0.03 -0.21 0.40 0.37 0.00 0.00 175.52 176.28 1rhg h ILE 117 N 0.17 0.56 -0.65 3.11 1.08 -1.43 -1.48 117.51 118.88 1rhg h ILE 117 Ca 0.49 -0.18 -0.03 0.00 -0.39 0.00 0.00 64.86 64.75 1rhg h ILE 117 Cb 0.92 0.65 -0.03 0.00 -3.07 0.00 0.00 36.82 35.29 1rhg h ILE 117 CO -0.65 0.03 0.29 -0.25 -0.69 0.00 0.00 178.15 176.89 1rhg h TRP 118 N -0.70 0.92 -0.47 1.37 2.91 -1.13 -0.78 115.95 118.08 1rhg h TRP 118 Ca -0.06 -0.04 0.02 0.00 1.13 0.00 0.00 58.89 59.94 1rhg h TRP 118 Cb 0.51 -0.29 -0.03 0.00 -0.51 0.00 0.00 29.16 28.84 1rhg h TRP 118 CO -0.02 0.69 0.28 1.96 -1.03 0.00 0.00 178.44 180.32 1rhg h GLN 119 N 0.92 0.54 0.00 2.65 4.20 -0.92 0.35 115.11 122.85 1rhg h GLN 119 Ca 0.22 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.87 1rhg h GLN 119 Cb 0.13 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.78 1rhg h GLN 119 CO -0.03 0.36 -0.13 0.37 -0.67 0.00 0.00 178.83 178.73 1rhg h GLN 120 N 0.56 0.00 -0.59 1.46 5.75 -0.18 -0.54 115.11 121.57 1rhg h GLN 120 Ca 0.19 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.60 1rhg h GLN 120 Cb 0.01 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.54 1rhg h GLN 120 CO -0.09 0.13 0.01 0.52 -2.65 0.00 0.00 178.83 176.76 1rhg h MET 121 N 0.00 1.03 0.00 1.69 2.86 0.10 -3.51 114.93 117.10 1rhg h MET 121 Ca -0.00 -0.31 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 1rhg h MET 121 Cb 0.30 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.85 1rhg h MET 121 CO 0.02 1.00 0.00 0.39 1.06 0.00 0.00 176.91 179.38 1rhg n GLU 122 N -4.19 0.00 -3.90 1.72 1.02 -0.21 -5.10 120.64 109.98 1rhg n GLU 122 Ca 0.03 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.19 1rhg n GLU 122 Cb 0.33 -0.99 0.01 0.00 -0.02 0.00 0.00 31.44 30.77 1rhg n GLU 122 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 1rhg s MET 137 N -1.32 0.49 1.06 3.49 1.75 -1.26 -5.13 119.30 118.37 1rhg s MET 137 Ca 0.00 -0.31 -0.23 0.00 -1.25 0.00 0.00 55.69 53.90 1rhg s MET 137 Cb 0.00 0.14 -0.05 0.00 2.84 0.00 0.00 34.83 37.77 1rhg s MET 137 CO 0.00 -0.23 -0.72 -0.35 -0.65 0.00 0.00 175.02 173.06 1rhg n PRO 138 N -0.80 -0.77 -4.00 4.11 -0.04 -1.26 -5.01 135.00 127.24 1rhg n PRO 138 Ca 0.00 -0.21 -0.31 0.00 -0.04 0.00 0.00 63.50 62.94 1rhg n PRO 138 Cb 0.60 -1.36 -0.15 0.00 -0.04 0.00 0.00 33.50 32.55 1rhg n PRO 138 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rhg s ALA 139 N -2.12 2.70 -1.32 0.55 0.00 -1.26 -5.00 121.76 115.31 1rhg s ALA 139 Ca 0.46 -2.33 -0.11 0.00 0.00 0.00 0.00 51.96 49.98 1rhg s ALA 139 Cb -0.02 -1.87 0.13 0.00 0.00 0.00 0.00 23.12 21.36 1rhg s ALA 139 CO 0.67 -1.61 1.93 1.19 0.00 0.00 0.00 175.76 177.94 1rhg n PHE 140 N 4.34 3.30 0.00 0.00 3.72 -1.26 -4.85 117.46 122.71 1rhg n PHE 140 Ca 0.01 -2.88 0.00 0.00 -0.05 0.00 0.00 57.45 54.53 1rhg n PHE 140 Cb 0.42 -2.14 0.00 0.00 -0.94 0.00 0.00 39.48 36.82 1rhg n PHE 140 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1rhg n ALA 141 N 4.72 0.67 -3.68 4.37 0.00 -1.26 -3.98 120.51 121.35 1rhg n ALA 141 Ca 0.43 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.87 1rhg n ALA 141 Cb 0.38 -0.54 -0.01 0.00 0.00 0.00 0.00 19.45 19.28 1rhg n ALA 141 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1rhg s SER 142 N -0.03 -0.10 0.05 0.00 1.04 -1.26 -4.86 113.70 108.54 1rhg s SER 142 Ca 0.00 -0.24 -0.16 0.00 0.48 0.00 0.00 55.95 56.03 1rhg s SER 142 Cb 0.00 0.28 -0.07 0.00 0.10 0.00 0.00 66.02 66.33 1rhg s SER 142 CO 0.00 -0.52 1.26 0.00 0.98 0.00 0.00 173.24 174.96 1rhg h ALA 143 N 2.00 -0.77 -0.81 5.32 0.00 -1.96 0.13 119.26 123.17 1rhg h ALA 143 Ca -0.28 -0.05 0.18 0.00 0.00 0.00 0.00 54.91 54.76 1rhg h ALA 143 Cb 1.21 0.65 -0.15 0.00 0.00 0.00 0.00 17.79 19.51 1rhg h ALA 143 CO 0.28 -0.83 -0.08 0.35 0.00 0.00 0.00 179.25 178.97 1rhg h PHE 144 N -0.36 -0.20 -0.58 0.00 3.57 -1.96 -0.76 116.94 116.65 1rhg h PHE 144 Ca -0.00 0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.51 1rhg h PHE 144 Cb 0.36 0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 1rhg h PHE 144 CO -0.36 -0.31 0.15 1.96 -2.23 0.00 0.00 178.31 177.52 1rhg h GLN 145 N 0.05 0.89 -0.37 1.11 4.20 -1.61 -2.16 115.11 117.22 1rhg h GLN 145 Ca 0.43 -0.18 -0.09 0.00 0.06 0.00 0.00 58.65 58.86 1rhg h GLN 145 Cb 0.74 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.38 1rhg h GLN 145 CO -0.77 0.79 -0.12 0.00 -0.67 0.00 0.00 178.83 178.06 1rhg h ARG 146 N 0.86 0.74 0.58 1.46 3.08 -0.09 -1.38 114.38 119.62 1rhg h ARG 146 Ca 0.19 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 59.91 1rhg h ARG 146 Cb 0.30 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.32 1rhg h ARG 146 CO -0.00 0.90 -0.28 0.00 -1.07 0.00 0.00 179.97 179.52 1rhg h ARG 147 N 0.53 -0.75 0.00 0.04 3.08 -0.99 0.48 114.38 116.77 1rhg h ARG 147 Ca 0.09 0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.13 1rhg h ARG 147 Cb 0.65 0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 1rhg h ARG 147 CO 0.04 -0.45 -0.30 0.00 -1.07 0.00 0.00 179.97 178.19 1rhg h ALA 148 N -0.58 1.33 -0.00 0.04 0.00 -1.46 0.17 119.26 118.76 1rhg h ALA 148 Ca -0.08 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.41 1rhg h ALA 148 Cb 0.64 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1rhg h ALA 148 CO 0.13 0.38 -0.66 0.78 0.00 0.00 0.00 179.25 179.88 1rhg h GLY 149 N 1.16 0.00 0.65 0.00 0.00 -1.16 -2.70 103.07 101.02 1rhg h GLY 149 Ca -0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.29 1rhg h GLY 149 CO 0.04 0.00 -0.31 -1.33 0.00 0.00 0.00 176.54 174.94 1rhg h GLY 150 N 1.99 -0.92 -0.35 4.60 0.00 0.16 -1.40 103.07 107.16 1rhg h GLY 150 Ca -0.01 0.34 0.10 0.00 0.00 0.00 0.00 47.33 47.76 1rhg h GLY 150 CO 0.09 -0.33 -0.31 -2.08 0.00 0.00 0.00 176.54 173.90 1rhg h VAL 151 N -1.21 0.20 -0.68 4.60 2.07 -1.34 -1.63 116.25 118.26 1rhg h VAL 151 Ca -0.09 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 1rhg h VAL 151 Cb 0.67 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 1rhg h VAL 151 CO 0.15 0.00 0.31 -0.07 0.02 0.00 0.00 177.57 177.98 1rhg h LEU 152 N -0.16 0.90 -0.63 2.57 3.38 -1.51 -0.64 115.31 119.23 1rhg h LEU 152 Ca 0.23 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 1rhg h LEU 152 Cb 0.54 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1rhg h LEU 152 CO -0.65 0.80 -0.05 0.58 0.09 0.00 0.00 178.44 179.21 1rhg h VAL 153 N 0.95 1.27 -0.18 1.22 2.07 -1.11 -0.06 116.25 120.41 1rhg h VAL 153 Ca 0.23 -1.20 -0.00 0.00 0.82 0.00 0.00 66.70 66.55 1rhg h VAL 153 Cb 0.15 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1rhg h VAL 153 CO -0.03 0.43 0.10 0.00 0.02 0.00 0.00 177.57 178.09 1rhg h ALA 154 N 1.00 0.23 -0.30 1.67 0.00 -1.14 -0.27 119.26 120.46 1rhg h ALA 154 Ca 0.16 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1rhg h ALA 154 Cb 0.61 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1rhg h ALA 154 CO 0.04 -0.23 -0.27 1.03 0.00 0.00 0.00 179.25 179.82 1rhg h SER 155 N 0.18 0.60 0.21 0.00 0.87 -1.00 -2.06 113.55 112.36 1rhg h SER 155 Ca 0.06 -0.22 -0.18 0.00 -1.23 0.00 0.00 61.79 60.23 1rhg h SER 155 Cb 0.08 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 1rhg h SER 155 CO -0.01 0.85 -0.68 0.45 -0.53 0.00 0.00 176.83 176.92 1rhg h HIS 156 N 0.52 0.56 -0.35 2.24 3.86 -0.83 -2.86 115.15 118.28 1rhg h HIS 156 Ca 0.07 -0.23 -0.11 0.00 -1.16 0.00 0.00 60.37 58.93 1rhg h HIS 156 Cb 0.74 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 29.11 1rhg h HIS 156 CO 0.03 0.98 -0.22 1.25 0.86 0.00 0.00 177.93 180.82 1rhg h LEU 157 N 0.30 0.81 -0.27 2.43 5.85 -0.75 -1.96 115.31 121.72 1rhg h LEU 157 Ca -0.02 -0.43 0.05 0.00 0.84 0.00 0.00 57.88 58.33 1rhg h LEU 157 Cb 1.24 -0.23 -0.08 0.00 0.37 0.00 0.00 40.66 41.97 1rhg h LEU 157 CO 0.12 1.06 -0.44 1.56 -0.34 0.00 0.00 178.44 180.40 1rhg h GLN 158 N 0.56 -0.40 -0.41 1.25 1.08 -1.24 -1.79 115.11 114.16 1rhg h GLN 158 Ca 0.07 0.03 0.06 0.00 -1.45 0.00 0.00 58.65 57.36 1rhg h GLN 158 Cb 0.78 0.09 -0.05 0.00 -0.05 0.00 0.00 27.48 28.25 1rhg h GLN 158 CO 0.06 -0.27 0.13 0.77 -0.95 0.00 0.00 178.83 178.57 1rhg h SER 159 N -0.42 0.11 -0.95 1.46 0.02 -1.49 -0.40 113.55 111.89 1rhg h SER 159 Ca 0.10 0.05 0.03 0.00 -0.84 0.00 0.00 61.79 61.14 1rhg h SER 159 Cb 0.61 0.05 -0.05 0.00 0.14 0.00 0.00 62.40 63.15 1rhg h SER 159 CO -0.49 0.10 0.62 0.15 -1.14 0.00 0.00 176.83 176.06 1rhg h PHE 160 N 0.28 1.16 0.00 3.45 3.57 -1.06 -0.64 116.94 123.70 1rhg h PHE 160 Ca 0.19 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.57 1rhg h PHE 160 Cb 0.20 -0.39 -0.02 0.00 2.79 0.00 0.00 35.95 38.53 1rhg h PHE 160 CO -0.17 0.68 -0.72 -0.07 -2.23 0.00 0.00 178.31 175.80 1rhg h LEU 161 N 1.21 0.00 -0.60 0.59 3.38 -0.59 0.21 115.31 119.51 1rhg h LEU 161 Ca 0.37 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.28 1rhg h LEU 161 Cb -0.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1rhg h LEU 161 CO -0.11 0.72 0.15 -0.33 0.09 0.00 0.00 178.44 178.96 1rhg h GLU 162 N 0.00 0.95 -0.29 1.13 4.39 -0.64 -1.92 114.58 118.20 1rhg h GLU 162 Ca -0.01 -0.23 -0.17 0.00 0.34 0.00 0.00 59.36 59.30 1rhg h GLU 162 Cb 1.30 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 29.82 1rhg h GLU 162 CO 0.09 0.87 -0.48 0.28 -1.16 0.00 0.00 179.01 178.62 1rhg h VAL 163 N 0.86 1.29 -0.23 3.13 2.07 -1.00 -3.01 116.25 119.36 1rhg h VAL 163 Ca 0.19 -1.68 -0.06 0.00 0.82 0.00 0.00 66.70 65.97 1rhg h VAL 163 Cb 0.35 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 1rhg h VAL 163 CO 0.00 0.54 -0.13 0.28 0.02 0.00 0.00 177.57 178.28 1rhg h SER 164 N 0.61 0.37 0.27 0.57 0.02 -0.36 -1.93 113.55 113.10 1rhg h SER 164 Ca 0.03 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 1rhg h SER 164 Cb 1.06 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.50 1rhg h SER 164 CO 0.10 0.53 -0.13 0.22 -1.14 0.00 0.00 176.83 176.42 1rhg h TYR 165 N 0.36 -0.33 -0.66 3.45 3.20 -1.35 -0.85 116.97 120.78 1rhg h TYR 165 Ca 0.07 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.05 1rhg h TYR 165 Cb 0.45 0.11 -0.09 0.00 1.54 0.00 0.00 36.73 38.75 1rhg h TYR 165 CO 0.01 0.02 0.22 -0.09 -1.64 0.00 0.00 178.16 176.68 1rhg h ARG 166 N -0.77 0.36 0.42 1.82 2.43 -1.46 0.27 114.38 117.45 1rhg h ARG 166 Ca -0.04 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 1rhg h ARG 166 Cb 0.50 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1rhg h ARG 166 CO 0.06 0.24 -0.29 0.28 -1.51 0.00 0.00 179.97 178.75 1rhg h VAL 167 N 0.37 0.39 -0.23 0.20 2.07 -1.39 -0.81 116.25 116.86 1rhg h VAL 167 Ca 0.35 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.83 1rhg h VAL 167 Cb 0.50 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1rhg h VAL 167 CO -0.38 0.00 -0.01 -0.07 0.02 0.00 0.00 177.57 177.13 1rhg h LEU 168 N -0.70 0.31 -0.52 2.57 3.38 -0.21 -0.90 115.31 119.24 1rhg h LEU 168 Ca -0.04 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1rhg h LEU 168 Cb 0.59 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1rhg h LEU 168 CO 0.02 0.38 -0.02 -0.09 0.09 0.00 0.00 178.44 178.82 1rhg h ARG 169 N 0.33 0.93 0.00 1.13 9.65 -0.38 -0.32 114.38 125.73 1rhg h ARG 169 Ca 0.08 -0.31 0.00 0.00 -1.10 0.00 0.00 59.98 58.65 1rhg h ARG 169 Cb 0.25 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 28.75 1rhg h ARG 169 CO 0.01 0.97 0.00 0.72 2.80 0.00 0.00 179.97 184.46 1rhg n HIS 170 N -4.27 0.82 -0.52 2.20 8.25 -0.32 -2.17 115.22 119.21 1rhg n HIS 170 Ca 0.01 0.36 0.08 0.00 -0.26 0.00 0.00 57.72 57.91 1rhg n HIS 170 Cb 0.34 -1.07 0.26 0.00 1.12 0.00 0.00 29.99 30.63 1rhg n HIS 170 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1rhg n LEU 171 N -2.28 3.82 -0.10 2.41 4.32 -0.20 -5.05 117.00 119.92 1rhg n LEU 171 Ca 0.01 -2.37 0.01 0.00 -0.02 0.00 0.00 56.01 53.64 1rhg n LEU 171 Cb 0.16 -0.43 0.01 0.00 -1.62 0.00 0.00 43.42 41.54 1rhg n LEU 171 CO 0.16 0.77 0.29 0.00 -1.22 0.00 0.00 177.39 177.39