#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oho s LEU 3 N 0.00 4.00 0.33 1.20 2.96 -1.23 -4.04 118.68 121.91 1oho s LEU 3 Ca 0.00 2.32 -0.27 0.00 -0.22 0.00 0.00 54.13 55.95 1oho s LEU 3 Cb 0.00 -3.52 -0.13 0.00 0.50 0.00 0.00 46.19 43.04 1oho s LEU 3 CO 0.00 -1.45 1.13 -0.81 -1.32 0.00 0.00 176.35 173.90 1oho n PRO 4 N 8.07 1.68 -1.66 0.98 -0.04 -1.26 -4.94 135.00 137.82 1oho n PRO 4 Ca 0.24 0.59 -0.29 0.00 -0.04 0.00 0.00 63.50 64.00 1oho n PRO 4 Cb 0.43 -2.08 0.16 0.00 -0.04 0.00 0.00 33.50 31.96 1oho n PRO 4 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1oho s THR 5 N -1.11 1.94 0.23 0.52 -4.23 -1.26 -4.11 115.64 107.62 1oho s THR 5 Ca 0.58 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 61.01 1oho s THR 5 Cb -0.62 -2.84 0.19 0.00 1.34 0.00 0.00 72.50 70.57 1oho s THR 5 CO 0.60 0.00 1.86 0.00 -0.54 0.00 0.00 174.62 176.55 1oho h ALA 6 N -1.61 1.08 -0.56 3.99 0.00 -1.91 0.23 119.26 120.48 1oho h ALA 6 Ca -0.47 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.34 1oho h ALA 6 Cb 1.30 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 1oho h ALA 6 CO 0.52 0.31 0.06 1.96 0.00 0.00 0.00 179.25 182.10 1oho h GLN 7 N 0.98 0.91 -0.23 0.00 4.20 -1.92 -2.14 115.11 116.92 1oho h GLN 7 Ca 0.33 -0.24 -0.14 0.00 0.06 0.00 0.00 58.65 58.67 1oho h GLN 7 Cb 0.05 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 1oho h GLN 7 CO -0.13 0.87 -0.44 0.93 -0.67 0.00 0.00 178.83 179.39 1oho h GLU 8 N 0.86 0.56 -0.73 1.46 5.08 -1.71 -2.50 114.58 117.60 1oho h GLU 8 Ca 0.17 -0.30 -0.06 0.00 -1.00 0.00 0.00 59.36 58.17 1oho h GLU 8 Cb 0.42 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 1oho h GLU 8 CO 0.01 0.90 0.23 0.28 -1.00 0.00 0.00 179.01 179.43 1oho h VAL 9 N 0.46 1.26 -0.90 3.13 2.07 -0.70 -0.08 116.25 121.49 1oho h VAL 9 Ca 0.03 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.63 1oho h VAL 9 Cb 0.96 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 1oho h VAL 9 CO 0.09 0.35 0.50 1.56 0.02 0.00 0.00 177.57 180.09 1oho h GLN 10 N 1.09 1.24 -0.21 1.57 4.20 -1.18 -1.23 115.11 120.60 1oho h GLN 10 Ca 0.24 -0.14 -0.11 0.00 0.06 0.00 0.00 58.65 58.70 1oho h GLN 10 Cb 0.31 -0.25 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 1oho h GLN 10 CO -0.01 0.90 -0.28 0.78 -0.67 0.00 0.00 178.83 179.56 1oho h GLY 11 N 1.26 0.61 0.96 3.46 0.00 -0.99 -2.52 103.07 105.85 1oho h GLY 11 Ca 0.32 -0.66 -0.02 0.00 0.00 0.00 0.00 47.33 46.96 1oho h GLY 11 CO -0.05 0.60 0.21 1.41 0.00 0.00 0.00 176.54 178.70 1oho h LEU 12 N 0.23 0.61 -0.88 3.11 3.38 -0.83 -1.09 115.31 119.84 1oho h LEU 12 Ca 0.02 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 1oho h LEU 12 Cb 0.85 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1oho h LEU 12 CO 0.07 0.58 -0.32 0.24 0.09 0.00 0.00 178.44 179.09 1oho h MET 13 N 0.59 0.44 -0.38 1.13 2.86 -1.29 -1.22 114.93 117.06 1oho h MET 13 Ca 0.15 -0.19 -0.14 0.00 -2.06 0.00 0.00 59.70 57.47 1oho h MET 13 Cb 0.15 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 1oho h MET 13 CO -0.02 0.72 -0.31 0.00 1.06 0.00 0.00 176.91 178.36 1oho h ALA 14 N 1.27 0.73 -0.71 6.32 0.00 -1.25 -2.84 119.26 122.78 1oho h ALA 14 Ca 0.05 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 1oho h ALA 14 Cb 0.76 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1oho h ALA 14 CO 0.06 0.66 0.18 -0.09 0.00 0.00 0.00 179.25 180.06 1oho h ARG 15 N 0.71 1.12 -0.42 0.00 2.43 -0.86 -2.68 114.38 114.69 1oho h ARG 15 Ca 0.08 -0.26 0.08 0.00 -0.81 0.00 0.00 59.98 59.06 1oho h ARG 15 Cb 0.86 -0.15 -0.07 0.00 -0.42 0.00 0.00 29.97 30.19 1oho h ARG 15 CO 0.08 0.98 0.02 0.35 -1.51 0.00 0.00 179.97 179.89 1oho h PHE 16 N 1.07 0.02 -0.71 2.20 3.57 -1.00 -0.67 116.94 121.41 1oho h PHE 16 Ca 0.23 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.71 1oho h PHE 16 Cb 0.35 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.12 1oho h PHE 16 CO 0.03 -0.06 0.28 0.82 -2.23 0.00 0.00 178.31 177.15 1oho h ILE 17 N 0.13 1.24 -0.77 1.41 1.08 -1.33 -1.12 117.51 118.16 1oho h ILE 17 Ca 0.21 -0.76 -0.04 0.00 -0.39 0.00 0.00 64.86 63.88 1oho h ILE 17 Cb 0.29 0.39 -0.03 0.00 -3.07 0.00 0.00 36.82 34.39 1oho h ILE 17 CO -0.33 0.31 0.31 -0.33 -0.69 0.00 0.00 178.15 177.42 1oho h GLU 18 N 1.03 1.14 -0.56 2.37 5.08 -1.02 0.11 114.58 122.73 1oho h GLU 18 Ca 0.24 -0.20 -0.10 0.00 -1.00 0.00 0.00 59.36 58.30 1oho h GLU 18 Cb 0.19 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1oho h GLU 18 CO -0.02 0.93 -0.04 -0.07 -1.00 0.00 0.00 179.01 178.80 1oho h LEU 19 N 1.11 0.98 -0.56 1.33 3.38 -0.67 -1.65 115.31 119.23 1oho h LEU 19 Ca 0.26 -0.29 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 1oho h LEU 19 Cb 0.21 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1oho h LEU 19 CO -0.02 1.05 0.06 0.58 0.09 0.00 0.00 178.44 180.20 1oho h VAL 20 N 0.90 1.26 -0.23 1.22 2.07 -0.81 0.68 116.25 121.33 1oho h VAL 20 Ca 0.16 -1.03 0.00 0.00 0.82 0.00 0.00 66.70 66.65 1oho h VAL 20 Cb 0.58 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 1oho h VAL 20 CO 0.04 0.37 0.15 -0.78 0.02 0.00 0.00 177.57 177.37 1oho h ASP 21 N 0.83 0.27 1.33 0.57 3.58 -0.48 -2.61 116.42 119.92 1oho h ASP 21 Ca 0.16 -0.02 -0.07 0.00 0.42 0.00 0.00 57.03 57.52 1oho h ASP 21 Cb 0.46 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.43 1oho h ASP 21 CO 0.02 0.22 -0.32 -0.37 -2.88 0.00 0.00 179.24 175.91 1oho h VAL 22 N 0.30 0.61 -0.42 2.25 -1.51 -1.25 -3.44 116.25 112.79 1oho h VAL 22 Ca 0.08 -1.59 0.00 0.00 -1.23 0.00 0.00 66.70 63.96 1oho h VAL 22 Cb -0.01 2.09 0.00 0.00 -2.13 0.00 0.00 31.29 31.24 1oho h VAL 22 CO -0.02 0.31 0.00 0.61 -1.23 0.00 0.00 177.57 177.24 1oho n GLY 23 N 0.77 0.76 3.49 5.19 0.00 0.20 -4.99 105.19 110.60 1oho n GLY 23 Ca 0.02 -0.69 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 1oho n GLY 23 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1oho s ASP 24 N -2.87 6.69 0.21 1.61 -1.08 -1.01 -4.88 116.67 115.33 1oho s ASP 24 Ca 0.00 -2.10 -0.10 0.00 -0.52 0.00 0.00 52.55 49.83 1oho s ASP 24 Cb 0.00 -2.45 0.28 0.00 -1.46 0.00 0.00 42.92 39.29 1oho s ASP 24 CO 0.00 -1.11 1.73 0.40 0.52 0.00 0.00 175.17 176.71 1oho h ILE 25 N 5.83 0.73 -0.73 4.11 2.04 -1.94 -1.24 117.51 126.30 1oho h ILE 25 Ca 0.21 -0.12 -0.04 0.00 1.00 0.00 0.00 64.86 65.91 1oho h ILE 25 Cb 0.99 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 1oho h ILE 25 CO 1.22 0.06 0.30 -0.33 0.00 0.00 0.00 178.15 179.41 1oho h GLU 26 N 0.35 1.08 -0.16 2.37 5.08 -2.00 -1.36 114.58 119.94 1oho h GLU 26 Ca 0.31 -0.18 -0.13 0.00 -1.00 0.00 0.00 59.36 58.36 1oho h GLU 26 Cb 0.41 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1oho h GLU 26 CO -0.34 0.87 -0.46 0.00 -1.00 0.00 0.00 179.01 178.08 1oho h ALA 27 N 1.27 0.91 -0.12 3.43 0.00 -1.83 -2.36 119.26 120.56 1oho h ALA 27 Ca 0.25 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1oho h ALA 27 Cb 0.19 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1oho h ALA 27 CO -0.02 0.65 0.00 0.82 0.00 0.00 0.00 179.25 180.70 1oho h ILE 28 N 0.33 1.25 -0.71 0.00 2.04 -0.85 -3.08 117.51 116.49 1oho h ILE 28 Ca 0.02 -0.80 -0.00 0.00 1.00 0.00 0.00 64.86 65.08 1oho h ILE 28 Cb 0.94 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 38.53 1oho h ILE 28 CO 0.08 0.23 0.43 0.58 0.00 0.00 0.00 178.15 179.47 1oho h VAL 29 N -0.06 1.20 0.00 1.67 2.07 -1.20 -2.08 116.25 117.84 1oho h VAL 29 Ca 0.03 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.13 1oho h VAL 29 Cb 0.35 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1oho h VAL 29 CO 0.01 0.20 0.00 1.56 0.02 0.00 0.00 177.57 179.36 1oho h GLN 30 N 0.97 0.00 0.00 1.57 4.20 -1.34 -1.97 115.11 118.54 1oho h GLN 30 Ca 0.26 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.97 1oho h GLN 30 Cb -0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.73 1oho h GLN 30 CO -0.05 0.00 0.00 0.52 -0.67 0.00 0.00 178.83 178.63 1oho h MET 31 N 0.00 0.00 -6.36 1.46 2.86 -1.32 -3.45 114.93 108.12 1oho h MET 31 Ca 0.00 0.00 -0.55 0.00 -2.06 0.00 0.00 59.70 57.09 1oho h MET 31 Cb 0.29 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 1oho h MET 31 CO 0.00 0.00 -0.16 0.71 1.06 0.00 0.00 176.91 178.52 1oho s TYR 32 N -3.19 3.46 0.72 -0.22 1.51 -0.74 -0.65 117.35 118.23 1oho s TYR 32 Ca 0.08 0.82 -0.13 0.00 -1.01 0.00 0.00 57.07 56.83 1oho s TYR 32 Cb 0.10 -2.21 0.03 0.00 -0.11 0.00 0.00 41.96 39.76 1oho s TYR 32 CO 0.59 0.33 1.12 0.00 -1.11 0.00 0.00 175.55 176.48 1oho s ALA 33 N -1.73 2.29 0.52 3.71 0.00 -0.21 -4.75 121.76 121.59 1oho s ALA 33 Ca 0.45 0.51 0.17 0.00 0.00 0.00 0.00 51.96 53.09 1oho s ALA 33 Cb -0.12 -3.33 1.31 0.00 0.00 0.00 0.00 23.12 20.98 1oho s ALA 33 CO 0.21 -1.60 2.15 0.38 0.00 0.00 0.00 175.76 176.91 1oho h ASP 34 N -0.48 0.00 -0.29 0.00 2.03 -1.94 -2.26 116.42 113.49 1oho h ASP 34 Ca -0.46 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 55.73 1oho h ASP 34 Cb 1.25 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 39.68 1oho h ASP 34 CO 0.52 0.00 -0.06 -0.90 -1.03 0.00 0.00 179.24 177.77 1oho n ASP 35 N -4.49 2.85 -4.69 4.15 5.75 -1.26 -2.09 116.55 116.76 1oho n ASP 35 Ca -0.03 -3.52 -0.33 0.00 -0.01 0.00 0.00 54.79 50.91 1oho n ASP 35 Cb 0.11 -0.59 0.13 0.00 -1.03 0.00 0.00 41.12 39.74 1oho n ASP 35 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1oho s ALA 36 N -3.10 1.79 -0.01 2.12 0.00 -0.85 -4.34 121.76 117.36 1oho s ALA 36 Ca 0.43 0.79 0.07 0.00 0.00 0.00 0.00 51.96 53.25 1oho s ALA 36 Cb 0.38 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 20.00 1oho s ALA 36 CO 0.02 -2.36 -0.23 0.95 0.00 0.00 0.00 175.76 174.14 1oho s THR 37 N -2.25 2.31 -0.06 0.00 -4.23 -0.83 -0.91 115.64 109.66 1oho s THR 37 Ca 0.72 -1.11 0.02 0.00 -1.18 0.00 0.00 61.69 60.14 1oho s THR 37 Cb -0.27 -1.85 0.01 0.00 1.34 0.00 0.00 72.50 71.72 1oho s THR 37 CO 0.52 0.52 -0.13 -0.69 -0.54 0.00 0.00 174.62 174.29 1oho s VAL 38 N -0.70 1.19 -0.32 2.29 1.01 -0.35 -1.84 120.40 121.67 1oho s VAL 38 Ca 0.11 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.58 1oho s VAL 38 Cb -0.10 -1.08 0.08 0.00 0.00 0.00 0.00 36.38 35.28 1oho s VAL 38 CO 0.00 0.37 0.03 -1.61 0.00 0.00 0.00 175.10 173.89 1oho s GLU 39 N 0.58 1.99 -0.21 2.72 2.02 -0.01 -0.78 118.70 125.02 1oho s GLU 39 Ca -0.14 -1.60 -0.04 0.00 0.02 0.00 0.00 54.97 53.22 1oho s GLU 39 Cb -0.15 -3.20 0.09 0.00 0.10 0.00 0.00 34.13 30.97 1oho s GLU 39 CO 0.04 -0.80 0.20 1.21 0.02 0.00 0.00 175.26 175.93 1oho s ASN 40 N 1.21 1.68 0.62 -0.19 3.84 -1.26 -0.90 114.94 119.94 1oho s ASN 40 Ca 0.02 -0.39 -0.10 0.00 0.21 0.00 0.00 52.86 52.60 1oho s ASN 40 Cb -0.20 0.25 -0.02 0.00 -0.55 0.00 0.00 41.25 40.72 1oho s ASN 40 CO -0.05 -0.34 1.00 -2.16 -2.79 0.00 0.00 177.10 172.75 1oho s PRO 41 N 2.28 3.34 0.18 0.43 0.04 -1.26 -4.93 135.00 135.08 1oho s PRO 41 Ca 0.06 0.52 -0.33 0.00 0.04 0.00 0.00 61.00 61.29 1oho s PRO 41 Cb -0.16 -2.13 -0.14 0.00 0.04 0.00 0.00 34.50 32.11 1oho s PRO 41 CO -0.14 -0.64 1.54 0.34 0.04 0.00 0.00 177.00 178.13 1oho n PHE 42 N -2.72 2.25 0.00 0.56 7.35 0.15 -1.94 117.46 123.11 1oho n PHE 42 Ca 0.05 0.31 0.00 0.00 -0.76 0.00 0.00 57.45 57.05 1oho n PHE 42 Cb 0.55 -2.52 0.00 0.00 0.35 0.00 0.00 39.48 37.86 1oho n PHE 42 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1oho n GLY 43 N 3.11 1.19 3.94 7.13 0.00 -1.26 -4.89 105.19 114.41 1oho n GLY 43 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 1oho n GLY 43 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1oho s GLN 44 N -0.03 3.49 0.23 1.61 -0.21 -0.82 -5.03 119.66 118.90 1oho s GLN 44 Ca 0.00 -0.39 -0.32 0.00 0.02 0.00 0.00 55.36 54.67 1oho s GLN 44 Cb 0.00 -2.74 -0.14 0.00 1.00 0.00 0.00 33.01 31.13 1oho s GLN 44 CO 0.00 0.25 1.38 -0.35 -2.12 0.00 0.00 175.29 174.45 1oho n PRO 45 N -1.43 1.91 -2.19 2.91 -0.04 -1.26 -4.71 135.00 130.19 1oho n PRO 45 Ca -0.05 0.68 -0.33 0.00 -0.04 0.00 0.00 63.50 63.76 1oho n PRO 45 Cb 0.56 -2.32 -0.00 0.00 -0.04 0.00 0.00 33.50 31.69 1oho n PRO 45 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1oho s PRO 46 N -0.34 3.44 0.08 0.54 0.04 -1.26 -4.77 135.00 132.72 1oho s PRO 46 Ca 0.69 1.27 0.01 0.00 0.04 0.00 0.00 61.00 63.02 1oho s PRO 46 Cb -0.68 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 31.77 1oho s PRO 46 CO 0.49 -0.72 0.17 0.96 0.04 0.00 0.00 177.00 177.95 1oho s ILE 47 N -2.29 5.07 -0.02 0.56 -4.36 0.04 -4.91 121.20 115.29 1oho s ILE 47 Ca 0.65 -0.56 0.03 0.00 -0.26 0.00 0.00 60.65 60.51 1oho s ILE 47 Cb -0.17 -3.48 -0.00 0.00 1.25 0.00 0.00 42.46 40.06 1oho s ILE 47 CO 0.32 0.11 -0.12 -2.28 0.24 0.00 0.00 174.94 173.21 1oho s HIS 48 N -1.50 1.12 0.00 1.37 2.46 -1.26 -1.21 115.29 116.27 1oho s HIS 48 Ca 0.33 -0.25 0.00 0.00 0.47 0.00 0.00 55.06 55.61 1oho s HIS 48 Cb -0.12 -0.75 0.00 0.00 -0.13 0.00 0.00 32.58 31.57 1oho s HIS 48 CO 0.26 -0.07 0.00 0.41 -2.47 0.00 0.00 174.74 172.87 1oho n GLY 49 N 3.03 -0.75 0.31 1.59 0.00 -0.09 -4.27 105.19 105.01 1oho n GLY 49 Ca -0.16 -1.51 0.05 0.00 0.00 0.00 0.00 46.02 44.41 1oho n GLY 49 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1oho h ARG 50 N 0.00 0.51 -0.07 1.61 3.08 -1.66 -1.30 114.38 116.55 1oho h ARG 50 Ca 0.00 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 1oho h ARG 50 Cb 0.00 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 29.93 1oho h ARG 50 CO 0.00 0.34 0.03 1.49 -1.07 0.00 0.00 179.97 180.76 1oho h GLU 51 N 0.53 0.11 -0.52 0.04 4.81 -1.87 0.97 114.58 118.64 1oho h GLU 51 Ca 0.17 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.29 1oho h GLU 51 Cb 0.03 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1oho h GLU 51 CO -0.04 0.20 -0.03 1.96 -0.73 0.00 0.00 179.01 180.37 1oho h GLN 52 N -0.01 0.91 -0.49 1.92 4.20 -1.68 -1.89 115.11 118.07 1oho h GLN 52 Ca 0.03 -0.28 -0.07 0.00 0.06 0.00 0.00 58.65 58.39 1oho h GLN 52 Cb 0.13 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 1oho h GLN 52 CO -0.00 0.92 0.04 0.82 -0.67 0.00 0.00 178.83 179.94 1oho h ILE 53 N 0.83 1.26 -0.57 2.54 2.04 -1.08 -1.33 117.51 121.21 1oho h ILE 53 Ca 0.15 -1.00 -0.03 0.00 1.00 0.00 0.00 64.86 64.98 1oho h ILE 53 Cb 0.53 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.53 1oho h ILE 53 CO 0.03 0.35 0.23 0.00 0.00 0.00 0.00 178.15 178.76 1oho h ALA 54 N 0.95 0.73 -0.92 1.87 0.00 -0.66 -1.46 119.26 119.77 1oho h ALA 54 Ca 0.14 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1oho h ALA 54 Cb 0.45 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1oho h ALA 54 CO 0.02 0.34 0.61 0.00 0.00 0.00 0.00 179.25 180.22 1oho h ALA 55 N 1.08 1.17 -0.02 0.00 0.00 -1.15 -0.51 119.26 119.83 1oho h ALA 55 Ca 0.19 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1oho h ALA 55 Cb 0.19 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1oho h ALA 55 CO -0.02 0.57 0.01 0.35 0.00 0.00 0.00 179.25 180.16 1oho h PHE 56 N 1.25 0.03 -0.24 0.00 3.57 -0.80 -2.24 116.94 118.51 1oho h PHE 56 Ca 0.34 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.73 1oho h PHE 56 Cb -0.15 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 1oho h PHE 56 CO -0.01 0.11 -0.32 1.88 -2.23 0.00 0.00 178.31 177.74 1oho h TYR 57 N -0.06 0.56 -0.50 0.41 -1.99 -0.98 -0.46 116.97 113.96 1oho h TYR 57 Ca 0.01 -0.14 -0.08 0.00 2.00 0.00 0.00 58.73 60.52 1oho h TYR 57 Cb 0.09 -0.13 -0.02 0.00 2.00 0.00 0.00 36.73 38.67 1oho h TYR 57 CO -0.05 0.75 -0.01 0.00 -0.00 0.00 0.00 178.16 178.85 1oho h ARG 58 N 0.42 0.85 -0.20 4.88 3.08 -1.03 0.18 114.38 122.56 1oho h ARG 58 Ca 0.05 -0.24 -0.20 0.00 0.07 0.00 0.00 59.98 59.66 1oho h ARG 58 Cb 0.77 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.73 1oho h ARG 58 CO 0.06 0.86 -0.67 0.37 -1.07 0.00 0.00 179.97 179.52 1oho h GLN 59 N 0.78 0.78 0.09 0.04 5.75 -1.21 -3.33 115.11 118.01 1oho h GLN 59 Ca 0.15 -0.57 -0.28 0.00 -0.15 0.00 0.00 58.65 57.80 1oho h GLN 59 Cb 0.49 0.10 0.02 0.00 1.07 0.00 0.00 27.48 29.16 1oho h GLN 59 CO 0.02 1.19 -1.18 0.78 -2.65 0.00 0.00 178.83 176.99 1oho h GLY 60 N 0.71 0.65 -5.58 2.39 0.00 -0.80 -3.52 103.07 96.92 1oho h GLY 60 Ca -0.02 -1.31 -0.61 0.00 0.00 0.00 0.00 47.33 45.39 1oho h GLY 60 CO 0.14 1.16 -0.30 1.08 0.00 0.00 0.00 176.54 178.61 1oho s LEU 61 N -7.82 4.34 -0.61 3.11 1.43 0.61 -4.99 118.68 114.75 1oho s LEU 61 Ca -0.08 0.65 -0.14 0.00 -1.03 0.00 0.00 54.13 53.53 1oho s LEU 61 Cb 0.06 -2.40 -0.14 0.00 0.03 0.00 0.00 46.19 43.74 1oho s LEU 61 CO 0.92 0.21 1.70 0.29 0.23 0.00 0.00 176.35 179.70 1oho n LYS 65 N 2.81 0.09 -5.01 1.70 4.76 -1.26 -4.78 118.16 116.47 1oho n LYS 65 Ca -0.14 -0.75 -0.30 0.00 -2.87 0.00 0.00 58.31 54.26 1oho n LYS 65 Cb 0.52 -2.42 -0.15 0.00 -1.84 0.00 0.00 35.03 31.14 1oho n LYS 65 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1oho s VAL 66 N 8.32 2.03 0.01 -0.18 1.01 -1.26 -4.40 120.40 125.93 1oho s VAL 66 Ca 0.55 -1.25 0.07 0.00 0.00 0.00 0.00 61.98 61.36 1oho s VAL 66 Cb -0.12 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.52 1oho s VAL 66 CO 0.14 0.42 -0.23 -0.13 0.00 0.00 0.00 175.10 175.31 1oho s ARG 67 N -0.99 1.74 0.00 2.72 0.52 -0.31 -4.80 118.95 117.83 1oho s ARG 67 Ca 0.11 -0.89 0.01 0.00 -0.52 0.00 0.00 55.73 54.43 1oho s ARG 67 Cb -0.10 -1.76 -0.00 0.00 0.52 0.00 0.00 34.95 33.61 1oho s ARG 67 CO 0.01 0.47 -0.03 0.00 0.02 0.00 0.00 175.30 175.77 1oho s ALA 68 N -0.63 0.21 -0.10 2.13 0.00 -1.26 -0.75 121.76 121.35 1oho s ALA 68 Ca 0.09 -0.16 -0.18 0.00 0.00 0.00 0.00 51.96 51.71 1oho s ALA 68 Cb -0.09 -0.03 0.04 0.00 0.00 0.00 0.00 23.12 23.04 1oho s ALA 68 CO 0.00 0.03 0.44 0.00 0.00 0.00 0.00 175.76 176.23 1oho s LEU 70 N -0.47 4.47 -0.03 0.00 1.43 -1.26 -1.49 118.68 121.34 1oho s LEU 70 Ca -0.06 2.48 0.07 0.00 -1.03 0.00 0.00 54.13 55.58 1oho s LEU 70 Cb -0.03 -3.66 0.16 0.00 0.03 0.00 0.00 46.19 42.69 1oho s LEU 70 CO 0.03 -0.36 1.13 0.35 0.23 0.00 0.00 176.35 177.73 1oho n THR 71 N 0.94 1.18 -3.61 5.49 -2.24 -0.82 -4.89 114.28 110.34 1oho n THR 71 Ca -0.00 -1.19 0.02 0.00 -2.27 0.00 0.00 64.05 60.61 1oho n THR 71 Cb 0.43 0.37 -0.00 0.00 -2.10 0.00 0.00 70.33 69.03 1oho n THR 71 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1oho s GLY 72 N -1.26 -0.43 0.70 3.38 0.00 -1.25 -4.97 107.32 103.49 1oho s GLY 72 Ca 0.14 0.75 -0.13 0.00 0.00 0.00 0.00 44.72 45.48 1oho s GLY 72 CO 0.06 0.13 1.09 2.56 0.00 0.00 0.00 173.10 176.94 1oho s PRO 73 N -2.35 2.65 0.02 2.90 0.04 -1.26 -4.64 135.00 132.35 1oho s PRO 73 Ca 0.14 1.24 -0.30 0.00 0.04 0.00 0.00 61.00 62.12 1oho s PRO 73 Cb 0.05 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 1oho s PRO 73 CO -0.04 -1.35 1.01 0.08 0.04 0.00 0.00 177.00 176.74 1oho s VAL 74 N -2.65 4.71 -0.24 -0.36 1.01 -1.26 -4.56 120.40 117.05 1oho s VAL 74 Ca 0.63 1.96 -0.13 0.00 0.00 0.00 0.00 61.98 64.44 1oho s VAL 74 Cb -0.18 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 31.90 1oho s VAL 74 CO 0.48 0.16 0.29 -0.13 0.00 0.00 0.00 175.10 175.90 1oho s ARG 75 N 0.94 4.07 0.06 2.72 3.00 0.08 -4.94 118.95 124.89 1oho s ARG 75 Ca 0.53 -0.06 0.08 0.00 0.00 0.00 0.00 55.73 56.28 1oho s ARG 75 Cb -0.23 -3.58 -0.03 0.00 0.00 0.00 0.00 34.95 31.11 1oho s ARG 75 CO 0.28 -0.09 -0.22 0.00 0.00 0.00 0.00 175.30 175.28 1oho s ALA 76 N 1.48 1.85 0.54 2.13 0.00 -1.26 -0.37 121.76 126.12 1oho s ALA 76 Ca 0.13 -1.15 0.07 0.00 0.00 0.00 0.00 51.96 51.01 1oho s ALA 76 Cb -0.15 -0.33 0.07 0.00 0.00 0.00 0.00 23.12 22.71 1oho s ALA 76 CO 0.08 0.41 0.59 -1.13 0.00 0.00 0.00 175.76 175.70 1oho n SER 77 N 1.58 2.32 -1.11 0.00 3.41 -0.12 -4.96 113.62 114.74 1oho n SER 77 Ca -0.18 -2.62 0.11 0.00 -0.26 0.00 0.00 58.87 55.92 1oho n SER 77 Cb 0.53 -0.23 0.27 0.00 -0.26 0.00 0.00 64.21 64.52 1oho n SER 77 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1oho n HIS 78 N -1.97 0.66 -1.84 7.33 8.25 -1.26 -3.98 115.22 122.41 1oho n HIS 78 Ca 0.07 -0.33 -0.15 0.00 -0.26 0.00 0.00 57.72 57.05 1oho n HIS 78 Cb 0.58 0.00 0.09 0.00 1.12 0.00 0.00 29.99 31.78 1oho n HIS 78 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1oho n ASN 79 N 1.31 3.98 -0.50 0.41 2.04 -1.26 -4.91 115.26 116.33 1oho n ASN 79 Ca 0.20 -3.80 -0.07 0.00 -0.44 0.00 0.00 54.58 50.48 1oho n ASN 79 Cb 0.54 -0.43 -0.03 0.00 -2.53 0.00 0.00 39.78 37.33 1oho n ASN 79 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1oho n GLY 80 N -0.86 0.88 3.40 4.83 0.00 -1.26 -4.88 105.19 107.31 1oho n GLY 80 Ca 0.37 -0.76 -0.23 0.00 0.00 0.00 0.00 46.02 45.40 1oho n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oho s GLY 82 N -3.04 -0.13 0.00 0.00 0.00 -0.57 -0.94 107.32 102.64 1oho s GLY 82 Ca 0.23 -0.17 -0.01 0.00 0.00 0.00 0.00 44.72 44.76 1oho s GLY 82 CO 0.10 -0.20 0.01 0.00 0.00 0.00 0.00 173.10 173.02 1oho s ALA 83 N -3.87 -0.01 -0.06 3.20 0.00 0.50 -1.05 121.76 120.47 1oho s ALA 83 Ca 0.09 -0.20 -0.12 0.00 0.00 0.00 0.00 51.96 51.73 1oho s ALA 83 Cb -0.02 0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.17 1oho s ALA 83 CO -0.02 -0.08 0.28 0.00 0.00 0.00 0.00 175.76 175.93 1oho s MET 84 N -0.66 0.50 -0.11 0.00 0.23 -0.43 -0.74 119.30 118.08 1oho s MET 84 Ca -0.07 0.05 -0.09 0.00 -1.03 0.00 0.00 55.69 54.54 1oho s MET 84 Cb -0.05 0.22 -0.04 0.00 -1.53 0.00 0.00 34.83 33.43 1oho s MET 84 CO -0.00 -0.11 0.20 -1.25 -2.03 0.00 0.00 175.02 171.83 1oho s PRO 85 N -0.67 3.70 0.25 3.16 0.04 -1.26 -1.75 135.00 138.47 1oho s PRO 85 Ca -0.08 -0.02 -0.20 0.00 0.04 0.00 0.00 61.00 60.75 1oho s PRO 85 Cb -0.04 -3.25 0.02 0.00 0.04 0.00 0.00 34.50 31.27 1oho s PRO 85 CO 0.02 0.65 0.65 -0.59 0.04 0.00 0.00 177.00 177.77 1oho s PHE 86 N -0.72 -0.14 0.04 0.56 -0.12 -0.57 -1.93 117.98 115.10 1oho s PHE 86 Ca 0.16 -0.26 0.07 0.00 -0.05 0.00 0.00 56.93 56.84 1oho s PHE 86 Cb -0.13 0.58 -0.02 0.00 -0.63 0.00 0.00 43.02 42.82 1oho s PHE 86 CO 0.05 -1.12 -0.19 0.50 -0.05 0.00 0.00 175.22 174.41 1oho s ARG 87 N -3.91 1.23 -0.10 1.99 3.52 -0.56 -1.20 118.95 119.93 1oho s ARG 87 Ca 0.11 -0.89 0.03 0.00 -0.13 0.00 0.00 55.73 54.86 1oho s ARG 87 Cb -0.04 -1.32 0.00 0.00 -1.56 0.00 0.00 34.95 32.03 1oho s ARG 87 CO 0.04 0.33 -0.21 0.08 -0.81 0.00 0.00 175.30 174.73 1oho s VAL 88 N -0.83 1.88 -0.12 7.11 1.01 -0.26 -2.02 120.40 127.17 1oho s VAL 88 Ca 0.06 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.15 1oho s VAL 88 Cb -0.09 -1.64 0.00 0.00 0.00 0.00 0.00 36.38 34.65 1oho s VAL 88 CO 0.02 0.52 -0.21 -1.61 0.00 0.00 0.00 175.10 173.81 1oho s GLU 89 N 0.47 3.09 0.04 2.72 2.02 0.07 -0.37 118.70 126.74 1oho s GLU 89 Ca -0.16 -0.84 0.00 0.00 0.02 0.00 0.00 54.97 53.99 1oho s GLU 89 Cb -0.17 -2.41 -0.00 0.00 0.10 0.00 0.00 34.13 31.64 1oho s GLU 89 CO 0.07 0.10 0.05 0.00 0.02 0.00 0.00 175.26 175.49 1oho n MET 90 N 3.76 0.07 -4.85 1.61 0.00 -0.35 -1.16 117.12 116.20 1oho n MET 90 Ca -0.19 -0.34 -0.30 0.00 0.00 0.00 0.00 57.70 56.87 1oho n MET 90 Cb 0.52 0.31 -0.17 0.00 0.00 0.00 0.00 33.22 33.88 1oho n MET 90 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1oho s VAL 91 N -2.37 1.72 -0.35 3.17 1.01 -1.26 0.09 120.40 122.41 1oho s VAL 91 Ca 0.04 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.21 1oho s VAL 91 Cb 0.00 -1.52 0.09 0.00 0.00 0.00 0.00 36.38 34.95 1oho s VAL 91 CO 0.03 0.48 0.08 0.86 0.00 0.00 0.00 175.10 176.55 1oho s TRP 92 N 0.60 3.55 -1.64 5.22 -0.00 0.04 -4.68 118.94 122.03 1oho s TRP 92 Ca -0.14 -2.50 -0.02 0.00 -0.00 0.00 0.00 56.10 53.44 1oho s TRP 92 Cb -0.17 -2.77 0.00 0.00 -0.00 0.00 0.00 33.47 30.53 1oho s TRP 92 CO 0.04 -0.92 0.21 0.09 -0.00 0.00 0.00 176.95 176.37 1oho n ASN 93 N 4.47 -5.76 0.00 5.86 5.03 -1.26 -2.75 115.26 120.85 1oho n ASN 93 Ca -0.03 -0.10 0.00 0.00 0.87 0.00 0.00 54.58 55.32 1oho n ASN 93 Cb 0.42 -4.75 0.00 0.00 -1.02 0.00 0.00 39.78 34.43 1oho n ASN 93 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1oho n GLY 94 N -1.16 3.14 3.73 7.41 0.00 -1.26 -5.07 105.19 111.98 1oho n GLY 94 Ca -0.19 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.46 1oho n GLY 94 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1oho s GLN 95 N 0.00 4.71 0.37 1.61 -0.21 -1.11 -5.00 119.66 120.03 1oho s GLN 95 Ca 0.00 1.43 -0.26 0.00 0.02 0.00 0.00 55.36 56.55 1oho s GLN 95 Cb 0.00 -3.36 -0.09 0.00 1.00 0.00 0.00 33.01 30.56 1oho s GLN 95 CO 0.00 0.27 1.19 -1.25 -2.12 0.00 0.00 175.29 173.38 1oho s PRO 96 N -0.20 4.17 0.07 2.91 0.04 -1.26 -0.78 135.00 139.95 1oho s PRO 96 Ca 0.45 1.91 0.01 0.00 0.04 0.00 0.00 61.00 63.42 1oho s PRO 96 Cb -0.24 -2.81 -0.04 0.00 0.04 0.00 0.00 34.50 31.46 1oho s PRO 96 CO 0.30 -0.24 -0.06 0.00 0.04 0.00 0.00 177.00 177.04 1oho s ALA 98 N -3.18 0.63 -0.05 0.00 0.00 0.12 -1.21 121.76 118.06 1oho s ALA 98 Ca 0.05 -0.49 -0.01 0.00 0.00 0.00 0.00 51.96 51.52 1oho s ALA 98 Cb 0.02 -0.09 0.03 0.00 0.00 0.00 0.00 23.12 23.08 1oho s ALA 98 CO -0.05 0.10 0.01 -1.17 0.00 0.00 0.00 175.76 174.65 1oho s LEU 99 N -0.68 0.66 -0.16 0.00 2.96 0.50 -0.74 118.68 121.22 1oho s LEU 99 Ca -0.01 -0.04 -0.18 0.00 -0.22 0.00 0.00 54.13 53.68 1oho s LEU 99 Cb -0.05 -0.34 -0.04 0.00 0.50 0.00 0.00 46.19 46.26 1oho s LEU 99 CO 0.00 -0.18 0.48 -1.81 -1.32 0.00 0.00 176.35 173.52 1oho s ASP 100 N 1.75 6.60 0.11 3.68 1.01 -0.80 -1.10 116.67 127.92 1oho s ASP 100 Ca 0.01 0.71 0.04 0.00 0.71 0.00 0.00 52.55 54.02 1oho s ASP 100 Cb -0.13 -2.28 -0.04 0.00 1.01 0.00 0.00 42.92 41.49 1oho s ASP 100 CO -0.04 -0.07 -0.10 -0.69 0.21 0.00 0.00 175.17 174.48 1oho s VAL 101 N 1.09 0.95 -0.08 -1.27 1.01 -0.34 -4.77 120.40 116.99 1oho s VAL 101 Ca 0.24 -1.78 0.00 0.00 0.00 0.00 0.00 61.98 60.45 1oho s VAL 101 Cb -0.15 -1.52 0.02 0.00 0.00 0.00 0.00 36.38 34.74 1oho s VAL 101 CO 0.09 -0.65 -0.07 -0.63 0.00 0.00 0.00 175.10 173.85 1oho s ILE 102 N -2.82 0.86 -0.10 2.22 1.01 -1.03 -1.51 121.20 119.82 1oho s ILE 102 Ca 0.09 -0.24 -0.03 0.00 0.00 0.00 0.00 60.65 60.47 1oho s ILE 102 Cb -0.00 -0.87 -0.03 0.00 0.01 0.00 0.00 42.46 41.56 1oho s ILE 102 CO -0.01 0.32 0.03 -1.81 0.00 0.00 0.00 174.94 173.48 1oho s ASP 103 N 1.34 5.49 -0.13 3.58 1.01 -0.72 -0.28 116.67 126.96 1oho s ASP 103 Ca -0.03 0.20 0.02 0.00 0.71 0.00 0.00 52.55 53.45 1oho s ASP 103 Cb -0.14 -1.65 0.00 0.00 1.01 0.00 0.00 42.92 42.15 1oho s ASP 103 CO -0.03 0.36 -0.19 -0.69 0.21 0.00 0.00 175.17 174.82 1oho s VAL 104 N -0.76 2.37 0.05 -1.27 1.01 -0.25 -1.31 120.40 120.23 1oho s VAL 104 Ca 0.12 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.27 1oho s VAL 104 Cb -0.12 -1.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 1oho s VAL 104 CO 0.02 0.54 -0.17 -0.04 0.00 0.00 0.00 175.10 175.46 1oho s MET 105 N 0.61 1.09 -0.13 2.72 -1.94 -0.22 -1.33 119.30 120.11 1oho s MET 105 Ca -0.11 -0.85 0.03 0.00 -1.71 0.00 0.00 55.69 53.05 1oho s MET 105 Cb -0.16 -1.15 0.01 0.00 2.01 0.00 0.00 34.83 35.53 1oho s MET 105 CO 0.03 0.29 -0.22 0.50 -0.01 0.00 0.00 175.02 175.61 1oho s ARG 106 N -1.21 2.99 0.15 2.03 3.52 -0.52 -1.52 118.95 124.39 1oho s ARG 106 Ca 0.04 -0.84 0.03 0.00 -0.13 0.00 0.00 55.73 54.82 1oho s ARG 106 Cb -0.08 -2.39 -0.03 0.00 -1.56 0.00 0.00 34.95 30.88 1oho s ARG 106 CO 0.02 0.01 0.29 -0.06 -0.81 0.00 0.00 175.30 174.74 1oho s PHE 107 N 0.77 3.48 0.40 5.12 0.40 0.48 -0.18 117.98 128.45 1oho s PHE 107 Ca -0.08 0.11 0.06 0.00 -0.60 0.00 0.00 56.93 56.41 1oho s PHE 107 Cb -0.16 -1.66 0.07 0.00 0.51 0.00 0.00 43.02 41.79 1oho s PHE 107 CO -0.01 0.51 0.56 -0.40 0.70 0.00 0.00 175.22 176.58 1oho n ASP 108 N -0.60 1.35 0.03 1.36 3.85 0.01 -4.80 116.55 117.75 1oho n ASP 108 Ca -0.07 -2.00 0.05 0.00 -0.71 0.00 0.00 54.79 52.06 1oho n ASP 108 Cb 0.54 -0.31 0.21 0.00 -1.35 0.00 0.00 41.12 40.21 1oho n ASP 108 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 1oho n GLU 109 N -1.91 0.03 -0.14 0.11 0.00 -1.26 -1.52 120.64 115.95 1oho n GLU 109 Ca 0.11 0.42 0.11 0.00 0.00 0.00 0.00 57.16 57.80 1oho n GLU 109 Cb 0.40 -1.58 0.18 0.00 0.00 0.00 0.00 31.44 30.44 1oho n GLU 109 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1oho n HIS 110 N -1.64 0.38 -1.18 -1.84 8.25 -1.26 -2.31 115.22 115.63 1oho n HIS 110 Ca 0.01 -0.20 -0.02 0.00 -0.26 0.00 0.00 57.72 57.25 1oho n HIS 110 Cb 0.08 -0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.18 1oho n HIS 110 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1oho n GLY 111 N 1.37 0.50 3.71 -1.41 0.00 -0.58 -4.84 105.19 103.94 1oho n GLY 111 Ca 0.17 -0.98 -0.28 0.00 0.00 0.00 0.00 46.02 44.93 1oho n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oho s ARG 112 N -2.40 2.61 -0.17 1.61 0.52 -1.26 -4.86 118.95 115.00 1oho s ARG 112 Ca 0.00 -0.92 -0.29 0.00 -0.52 0.00 0.00 55.73 53.99 1oho s ARG 112 Cb 0.00 -2.52 -0.03 0.00 0.52 0.00 0.00 34.95 32.92 1oho s ARG 112 CO 0.00 0.50 1.52 0.42 0.02 0.00 0.00 175.30 177.76 1oho s ILE 113 N -1.57 3.83 -0.16 1.52 1.01 0.17 -0.81 121.20 125.21 1oho s ILE 113 Ca 0.28 0.97 -0.13 0.00 0.00 0.00 0.00 60.65 61.77 1oho s ILE 113 Cb -0.11 -3.74 -0.23 0.00 0.01 0.00 0.00 42.46 38.39 1oho s ILE 113 CO 0.20 -0.21 0.30 1.67 0.00 0.00 0.00 174.94 176.90 1oho n GLN 114 N 7.26 0.68 -3.91 2.79 7.27 0.75 -1.05 117.38 131.17 1oho n GLN 114 Ca 0.17 0.40 -0.13 0.00 0.07 0.00 0.00 57.00 57.50 1oho n GLN 114 Cb 0.45 -1.73 -0.14 0.00 2.41 0.00 0.00 30.24 31.23 1oho n GLN 114 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1oho s THR 115 N -2.48 0.07 -0.04 1.69 2.01 -1.06 -1.97 115.64 113.86 1oho s THR 115 Ca -0.25 -0.01 0.01 0.00 0.31 0.00 0.00 61.69 61.75 1oho s THR 115 Cb 0.06 -0.09 0.02 0.00 0.01 0.00 0.00 72.50 72.51 1oho s THR 115 CO 0.69 0.04 -0.06 -0.32 -0.69 0.00 0.00 174.62 174.28 1oho s MET 116 N 0.14 0.87 -0.11 4.92 1.75 -0.77 -1.44 119.30 124.66 1oho s MET 116 Ca -0.01 -0.15 0.02 0.00 -1.25 0.00 0.00 55.69 54.29 1oho s MET 116 Cb -0.02 -0.84 0.02 0.00 2.84 0.00 0.00 34.83 36.82 1oho s MET 116 CO -0.00 -0.04 -0.15 -0.65 -0.65 0.00 0.00 175.02 173.53 1oho s GLN 117 N 0.73 2.24 -0.27 4.11 -0.21 -0.44 -0.83 119.66 124.99 1oho s GLN 117 Ca -0.10 -0.56 -0.07 0.00 0.02 0.00 0.00 55.36 54.64 1oho s GLN 117 Cb -0.13 -1.91 -0.02 0.00 1.00 0.00 0.00 33.01 31.95 1oho s GLN 117 CO 0.01 -0.08 0.07 0.00 -2.12 0.00 0.00 175.29 173.17 1oho s ALA 118 N 1.02 3.13 -0.31 6.09 0.00 -0.08 -1.09 121.76 130.52 1oho s ALA 118 Ca -0.06 -1.24 -0.17 0.00 0.00 0.00 0.00 51.96 50.50 1oho s ALA 118 Cb -0.15 -2.11 -0.02 0.00 0.00 0.00 0.00 23.12 20.85 1oho s ALA 118 CO -0.02 -0.64 0.44 0.71 0.00 0.00 0.00 175.76 176.25 1oho s TYR 119 N 1.58 3.22 -0.20 0.00 1.51 0.61 0.33 117.35 124.40 1oho s TYR 119 Ca 0.05 0.27 -0.36 0.00 -1.01 0.00 0.00 57.07 56.03 1oho s TYR 119 Cb -0.16 -2.74 0.15 0.00 -0.11 0.00 0.00 41.96 39.09 1oho s TYR 119 CO 0.03 -0.39 1.32 1.67 -1.11 0.00 0.00 175.55 177.07 1oho s TRP 120 N 2.22 -0.05 0.22 2.71 1.48 -1.26 -2.48 118.94 121.77 1oho s TRP 120 Ca 0.17 0.02 -0.08 0.00 -1.06 0.00 0.00 56.10 55.15 1oho s TRP 120 Cb -0.16 0.51 0.03 0.00 -1.16 0.00 0.00 33.47 32.70 1oho s TRP 120 CO 0.11 -0.11 0.43 -1.13 -4.06 0.00 0.00 176.95 172.19 1oho n SER 121 N -0.16 -1.26 0.19 -2.66 3.41 -1.26 -4.68 113.62 107.20 1oho n SER 121 Ca 0.00 -1.89 0.16 0.00 -0.26 0.00 0.00 58.87 56.88 1oho n SER 121 Cb 0.59 2.11 0.79 0.00 -0.26 0.00 0.00 64.21 67.44 1oho n SER 121 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1oho h GLU 122 N 0.00 0.00 0.00 4.33 3.07 -2.01 -0.89 114.58 119.09 1oho h GLU 122 Ca -0.19 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.67 1oho h GLU 122 Cb 0.69 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 1oho h GLU 122 CO 0.24 0.00 0.00 -0.39 -1.40 0.00 0.00 179.01 177.46 1oho h VAL 123 N 0.00 0.00 -0.56 3.13 -1.51 -2.01 -2.08 116.25 113.22 1oho h VAL 123 Ca 0.09 -0.23 0.00 0.00 -1.23 0.00 0.00 66.70 65.33 1oho h VAL 123 Cb 0.44 0.98 0.00 0.00 -2.13 0.00 0.00 31.29 30.58 1oho h VAL 123 CO -0.00 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 176.93 1oho n ASN 124 N -2.47 3.64 -4.88 4.19 4.13 -0.34 -4.94 115.26 114.60 1oho n ASN 124 Ca 0.01 -1.98 -0.37 0.00 1.68 0.00 0.00 54.58 53.92 1oho n ASN 124 Cb 0.20 -0.37 -0.06 0.00 -1.54 0.00 0.00 39.78 38.01 1oho n ASN 124 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1oho s LEU 125 N -1.18 4.40 -0.07 3.41 2.96 -0.79 -1.90 118.68 125.52 1oho s LEU 125 Ca 0.42 0.52 -0.00 0.00 -0.22 0.00 0.00 54.13 54.85 1oho s LEU 125 Cb 0.23 -2.18 0.02 0.00 0.50 0.00 0.00 46.19 44.76 1oho s LEU 125 CO 0.31 0.39 -0.03 -0.44 -1.32 0.00 0.00 176.35 175.25 1oho s SER 126 N -1.12 1.44 0.00 3.68 0.01 0.09 -5.00 113.70 112.80 1oho s SER 126 Ca 0.17 -0.14 0.03 0.00 1.31 0.00 0.00 55.95 57.33 1oho s SER 126 Cb -0.13 -0.51 0.02 0.00 0.21 0.00 0.00 66.02 65.62 1oho s SER 126 CO 0.06 -0.13 0.60 0.55 0.41 0.00 0.00 173.24 174.74