#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hho n TYR 3 N 0.00 0.73 0.04 1.20 4.01 -1.26 -0.79 117.16 121.10 3hho n TYR 3 Ca 0.00 0.37 -0.21 0.00 -0.16 0.00 0.00 57.90 57.90 3hho n TYR 3 Cb 0.00 -1.09 -0.14 0.00 -0.31 0.00 0.00 39.34 37.80 3hho n TYR 3 CO 0.00 0.00 0.00 0.74 -0.46 0.00 0.00 176.86 177.14 3hho h PHE 4 N 0.00 0.58 -0.71 -0.72 0.04 -1.93 -3.22 116.94 110.98 3hho h PHE 4 Ca 0.00 -0.42 0.06 0.00 2.80 0.00 0.00 57.97 60.41 3hho h PHE 4 Cb 0.06 -0.02 -0.06 0.00 2.20 0.00 0.00 35.95 38.13 3hho h PHE 4 CO 0.00 1.66 0.41 0.93 -0.60 0.00 0.00 178.31 180.71 3hho h GLU 5 N 0.09 0.73 0.00 1.51 5.08 -1.21 0.36 114.58 121.14 3hho h GLU 5 Ca -0.36 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 3hho h GLU 5 Cb 2.07 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 31.15 3hho h GLU 5 CO 0.14 0.49 0.00 -0.11 -1.00 0.00 0.00 179.01 178.53 3hho n LEU 6 N -4.74 0.00 0.00 1.33 7.94 -0.25 -1.24 117.00 120.04 3hho n LEU 6 Ca 0.09 0.97 0.09 0.00 -1.11 0.00 0.00 56.01 56.06 3hho n LEU 6 Cb 0.17 -0.47 0.56 0.00 0.53 0.00 0.00 43.42 44.21 3hho n LEU 6 CO 0.30 -0.47 0.77 0.49 -1.11 0.00 0.00 177.39 177.36 3hho n PHE 7 N -2.26 0.00 -2.61 1.96 0.99 -1.22 -4.87 117.46 109.46 3hho n PHE 7 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.45 57.24 3hho n PHE 7 Cb 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 39.48 38.49 3hho n PHE 7 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3hho n GLY 8 N 0.32 -0.51 4.00 1.37 0.00 -0.01 -5.01 105.19 105.36 3hho n GLY 8 Ca 0.14 0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 3hho n GLY 8 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hho s LEU 9 N -6.27 3.11 0.60 0.99 1.02 -0.48 -4.98 118.68 112.66 3hho s LEU 9 Ca 0.10 -0.47 -0.16 0.00 0.02 0.00 0.00 54.13 53.62 3hho s LEU 9 Cb -0.05 -2.04 -0.03 0.00 0.02 0.00 0.00 46.19 44.09 3hho s LEU 9 CO 0.13 -1.53 1.07 -2.84 0.02 0.00 0.00 176.35 173.20 3hho s PRO 10 N -4.89 3.24 -0.72 1.29 0.02 -1.26 -4.59 135.00 128.09 3hho s PRO 10 Ca 0.63 1.29 -0.07 0.00 0.02 0.00 0.00 61.00 62.88 3hho s PRO 10 Cb -0.06 -2.02 -0.13 0.00 0.02 0.00 0.00 34.50 32.31 3hho s PRO 10 CO 0.41 -0.89 2.74 -0.89 -0.33 0.00 0.00 177.00 178.05 3hho n ILE 11 N -1.98 2.96 -4.45 2.83 2.08 -1.26 -4.87 119.36 114.68 3hho n ILE 11 Ca 0.09 -1.66 -0.26 0.00 0.56 0.00 0.00 62.75 61.49 3hho n ILE 11 Cb 0.52 -2.17 -0.10 0.00 -0.75 0.00 0.00 39.64 37.15 3hho n ILE 11 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3hho s GLN 12 N 2.16 1.96 -0.02 0.38 -2.07 -1.26 -5.06 119.66 115.76 3hho s GLN 12 Ca 0.54 -1.88 -0.01 0.00 -1.82 0.00 0.00 55.36 52.20 3hho s GLN 12 Cb 0.19 -1.80 -0.26 0.00 -1.09 0.00 0.00 33.01 30.05 3hho s GLN 12 CO -0.03 0.10 0.77 0.35 -1.32 0.00 0.00 175.29 175.17 3hho h PHE 13 N 1.87 0.36 -3.99 9.60 3.57 -1.97 -3.46 116.94 122.93 3hho h PHE 13 Ca -0.43 -0.26 -0.54 0.00 3.53 0.00 0.00 57.97 60.27 3hho h PHE 13 Cb 1.25 -0.01 0.12 0.00 2.79 0.00 0.00 35.95 40.09 3hho h PHE 13 CO 0.73 1.36 0.68 -1.21 -2.23 0.00 0.00 178.31 177.64 3hho s GLU 14 N -2.61 3.63 -0.06 1.11 8.01 -1.26 -5.01 118.70 122.51 3hho s GLU 14 Ca -0.10 2.36 -0.18 0.00 0.01 0.00 0.00 54.97 57.06 3hho s GLU 14 Cb 0.07 -2.60 0.04 0.00 -4.31 0.00 0.00 34.13 27.32 3hho s GLU 14 CO 0.83 -0.84 0.41 -1.17 0.01 0.00 0.00 175.26 174.51 3hho s LEU 15 N -2.81 0.45 -0.19 1.80 2.96 -1.26 -5.04 118.68 114.58 3hho s LEU 15 Ca 0.62 0.43 -0.05 0.00 -0.22 0.00 0.00 54.13 54.91 3hho s LEU 15 Cb -0.42 1.55 -0.03 0.00 0.50 0.00 0.00 46.19 47.79 3hho s LEU 15 CO 0.54 -0.38 -0.00 -0.62 -1.32 0.00 0.00 176.35 174.56 3hho s ASP 16 N -0.83 4.85 0.28 3.68 3.68 -1.26 -5.03 116.67 122.04 3hho s ASP 16 Ca -0.09 -0.18 0.02 0.00 2.13 0.00 0.00 52.55 54.43 3hho s ASP 16 Cb -0.04 -1.82 0.60 0.00 -1.45 0.00 0.00 42.92 40.21 3hho s ASP 16 CO 0.04 0.08 1.79 1.23 0.13 0.00 0.00 175.17 178.44 3hho h GLY 17 N 7.35 1.59 0.28 2.66 0.00 -2.00 -2.67 103.07 110.29 3hho h GLY 17 Ca -0.35 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 46.63 3hho h GLY 17 CO 0.62 0.01 -0.14 1.76 0.00 0.00 0.00 176.54 178.79 3hho h SER 18 N 0.78 -0.32 -0.85 0.19 0.02 -1.96 0.32 113.55 111.73 3hho h SER 18 Ca 0.51 0.01 0.25 0.00 -0.84 0.00 0.00 61.79 61.72 3hho h SER 18 Cb 0.69 0.08 -0.03 0.00 0.14 0.00 0.00 62.40 63.27 3hho h SER 18 CO -0.34 -0.16 0.62 -0.11 -1.14 0.00 0.00 176.83 175.70 3hho n LEU 19 N -3.43 0.00 -0.04 5.07 -0.00 -1.09 0.13 117.00 117.63 3hho n LEU 19 Ca -0.05 0.43 -0.08 0.00 -0.00 0.00 0.00 56.01 56.31 3hho n LEU 19 Cb 0.15 -0.21 -0.03 0.00 -0.00 0.00 0.00 43.42 43.33 3hho n LEU 19 CO 0.11 -0.43 -0.54 -0.11 -0.00 0.00 0.00 177.39 176.42 3hho n LEU 20 N -2.81 1.52 -0.10 -1.96 7.94 -1.03 -4.02 117.00 116.55 3hho n LEU 20 Ca 0.19 0.24 -0.07 0.00 -1.11 0.00 0.00 56.01 55.26 3hho n LEU 20 Cb 0.87 -0.56 -0.01 0.00 0.53 0.00 0.00 43.42 44.25 3hho n LEU 20 CO 0.19 -0.30 0.67 0.28 -1.11 0.00 0.00 177.39 177.13 3hho h SER 21 N -0.60 -0.90 -0.36 1.96 0.02 0.58 0.74 113.55 114.99 3hho h SER 21 Ca -0.09 0.17 0.03 0.00 -0.84 0.00 0.00 61.79 61.07 3hho h SER 21 Cb 0.76 0.44 -0.05 0.00 0.14 0.00 0.00 62.40 63.69 3hho h SER 21 CO -0.05 -0.29 -0.25 -1.28 -1.14 0.00 0.00 176.83 173.82 3hho h SER 22 N -0.22 -0.89 -0.41 3.07 0.87 -0.48 -1.84 113.55 113.65 3hho h SER 22 Ca 0.17 0.13 0.11 0.00 -1.23 0.00 0.00 61.79 60.97 3hho h SER 22 Cb 0.50 0.39 -0.02 0.00 -0.44 0.00 0.00 62.40 62.82 3hho h SER 22 CO -0.49 -0.12 0.29 1.56 -0.53 0.00 0.00 176.83 177.55 3hho h GLN 23 N -0.04 0.05 -0.29 2.24 1.08 -1.22 -2.29 115.11 114.64 3hho h GLN 23 Ca 0.06 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 3hho h GLN 23 Cb 0.19 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 3hho h GLN 23 CO -0.36 0.04 0.15 0.35 -0.95 0.00 0.00 178.83 178.05 3hho h PHE 24 N 0.05 0.41 -0.00 2.96 3.57 0.12 -2.92 116.94 121.13 3hho h PHE 24 Ca 0.19 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.68 3hho h PHE 24 Cb 0.71 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.32 3hho h PHE 24 CO -0.00 0.35 -0.08 0.54 -2.23 0.00 0.00 178.31 176.89 3hho n ARG 25 N -4.80 0.75 0.03 1.11 1.74 -0.87 -0.99 116.66 113.63 3hho n ARG 25 Ca -0.02 -0.23 -0.21 0.00 -0.77 0.00 0.00 57.85 56.63 3hho n ARG 25 Cb 0.09 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 29.89 3hho n ARG 25 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hho h ALA 26 N 3.68 0.37 0.04 7.54 0.00 -1.47 -3.35 119.26 126.06 3hho h ALA 26 Ca 0.00 -1.31 -0.23 0.00 0.00 0.00 0.00 54.91 53.38 3hho h ALA 26 Cb 0.32 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 3hho h ALA 26 CO 0.00 1.24 -1.07 -0.07 0.00 0.00 0.00 179.25 179.35 3hho h LEU 27 N 0.08 0.14 -2.39 0.00 3.38 -1.40 -2.95 115.31 112.17 3hho h LEU 27 Ca -0.38 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.47 3hho h LEU 27 Cb 2.05 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 42.75 3hho h LEU 27 CO 0.12 1.11 0.13 -0.61 0.09 0.00 0.00 178.44 179.27 3hho h GLN 28 N 0.03 0.00 0.03 1.13 4.15 -1.22 0.30 115.11 119.52 3hho h GLN 28 Ca -0.05 0.00 -0.37 0.00 0.77 0.00 0.00 58.65 59.00 3hho h GLN 28 Cb 1.82 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 29.45 3hho h GLN 28 CO 0.15 0.00 -2.28 1.63 -1.93 0.00 0.00 178.83 176.40 3hho n LYS 29 N -3.65 0.68 -0.11 1.69 5.02 -1.22 -2.33 118.16 118.24 3hho n LYS 29 Ca -0.01 0.16 -0.05 0.00 -2.02 0.00 0.00 58.31 56.39 3hho n LYS 29 Cb 0.22 -1.59 0.01 0.00 -0.02 0.00 0.00 35.03 33.66 3hho n LYS 29 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3hho h ARG 30 N 0.02 0.03 -0.63 1.97 1.12 -1.23 -2.79 114.38 112.87 3hho h ARG 30 Ca -0.51 -0.00 -0.41 0.00 -1.11 0.00 0.00 59.98 57.95 3hho h ARG 30 Cb 2.01 -0.01 -0.25 0.00 -0.01 0.00 0.00 29.97 31.71 3hho h ARG 30 CO -0.01 0.02 -0.09 1.19 -3.11 0.00 0.00 179.97 177.97 3hho n PHE 31 N -5.26 2.11 -2.36 2.20 3.01 0.04 -4.98 117.46 112.23 3hho n PHE 31 Ca 0.02 -2.10 -0.42 0.00 1.01 0.00 0.00 57.45 55.95 3hho n PHE 31 Cb 0.20 -0.66 -0.03 0.00 -0.01 0.00 0.00 39.48 38.98 3hho n PHE 31 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 3hho s HIS 32 N -3.48 3.39 0.36 1.38 2.46 -0.99 -3.87 115.29 114.54 3hho s HIS 32 Ca 0.51 1.23 0.37 0.00 0.47 0.00 0.00 55.06 57.65 3hho s HIS 32 Cb 0.43 -3.48 1.79 0.00 -0.13 0.00 0.00 32.58 31.19 3hho s HIS 32 CO 0.01 -1.53 2.14 -1.35 -2.47 0.00 0.00 174.74 171.55 3hho h PRO 33 N 6.59 0.00 -0.77 2.88 0.11 -1.87 -2.96 132.00 135.98 3hho h PRO 33 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3hho h PRO 33 Cb 1.21 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 3hho h PRO 33 CO 0.81 0.02 0.48 0.22 -0.21 0.00 0.00 178.00 179.33 3hho h ASP 34 N 0.00 0.90 0.00 -2.05 1.82 -1.96 0.21 116.42 115.33 3hho h ASP 34 Ca -0.00 -0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.60 3hho h ASP 34 Cb 0.30 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 40.08 3hho h ASP 34 CO 0.00 0.67 0.20 0.78 -1.61 0.00 0.00 179.24 179.28 3hho h ASN 35 N 1.05 0.00 -0.28 2.28 2.35 -1.89 0.16 115.58 119.25 3hho h ASN 35 Ca 0.28 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 3hho h ASN 35 Cb -0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.29 3hho h ASN 35 CO -0.06 0.00 0.00 0.49 -1.65 0.00 0.00 177.43 176.21 3hho n PHE 36 N -2.46 0.68 -0.33 1.19 3.72 0.73 -4.74 117.46 116.25 3hho n PHE 36 Ca -0.02 -0.71 0.12 0.00 -0.05 0.00 0.00 57.45 56.79 3hho n PHE 36 Cb 0.24 -0.18 0.30 0.00 -0.94 0.00 0.00 39.48 38.90 3hho n PHE 36 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3hho h ALA 37 N 1.77 1.57 -0.37 4.37 0.00 -0.84 -0.26 119.26 125.49 3hho h ALA 37 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3hho h ALA 37 Cb 1.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3hho h ALA 37 CO 0.12 -0.11 0.00 0.25 0.00 0.00 0.00 179.25 179.51 3hho n THR 38 N -4.83 1.00 -1.15 0.00 -2.24 -1.26 -5.00 114.28 100.80 3hho n THR 38 Ca 0.22 -1.00 -0.30 0.00 -2.27 0.00 0.00 64.05 60.70 3hho n THR 38 Cb 0.56 0.50 0.24 0.00 -2.10 0.00 0.00 70.33 69.53 3hho n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hho s ALA 39 N -1.00 0.71 0.68 6.98 0.00 -0.11 -5.01 121.76 124.01 3hho s ALA 39 Ca 0.25 -1.04 -0.14 0.00 0.00 0.00 0.00 51.96 51.03 3hho s ALA 39 Cb 0.13 -2.85 0.01 0.00 0.00 0.00 0.00 23.12 20.41 3hho s ALA 39 CO 0.17 -3.58 1.11 -1.54 0.00 0.00 0.00 175.76 171.93 3hho s SER 40 N -4.03 4.95 0.11 0.00 1.04 -1.26 -4.83 113.70 109.67 3hho s SER 40 Ca 0.72 2.01 -0.25 0.00 0.48 0.00 0.00 55.95 58.91 3hho s SER 40 Cb -0.08 -2.55 -0.09 0.00 0.10 0.00 0.00 66.02 63.40 3hho s SER 40 CO 0.56 -1.74 1.67 -0.08 0.98 0.00 0.00 173.24 174.63 3hho h GLU 41 N -0.15 -0.29 -0.96 4.02 4.81 -1.94 -1.21 114.58 118.85 3hho h GLU 41 Ca -0.46 0.02 0.30 0.00 -0.13 0.00 0.00 59.36 59.09 3hho h GLU 41 Cb 1.25 0.07 -0.15 0.00 0.63 0.00 0.00 28.75 30.54 3hho h GLU 41 CO 0.53 -0.19 0.40 -0.09 -0.73 0.00 0.00 179.01 178.93 3hho h ARG 42 N -0.30 0.20 0.08 1.92 2.43 -1.99 0.13 114.38 116.86 3hho h ARG 42 Ca 0.03 -0.01 -0.26 0.00 -0.81 0.00 0.00 59.98 58.93 3hho h ARG 42 Cb 0.34 -0.05 0.01 0.00 -0.42 0.00 0.00 29.97 29.85 3hho h ARG 42 CO -0.12 0.13 -1.14 -0.44 -1.51 0.00 0.00 179.97 176.90 3hho h ASP 43 N 0.21 0.58 -0.10 -3.80 3.32 -1.74 -3.33 116.42 111.56 3hho h ASP 43 Ca 0.68 -0.54 -0.04 0.00 0.02 0.00 0.00 57.03 57.14 3hho h ASP 43 Cb 1.53 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 40.90 3hho h ASP 43 CO -0.68 1.38 -0.11 -0.09 -1.72 0.00 0.00 179.24 178.02 3hho h ARG 44 N 0.18 0.24 -1.76 3.56 2.43 -0.05 -1.75 114.38 117.23 3hho h ARG 44 Ca -0.13 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 3hho h ARG 44 Cb 1.82 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.37 3hho h ARG 44 CO 0.20 0.67 0.00 1.28 -1.51 0.00 0.00 179.97 180.61 3hho n LEU 45 N -4.64 1.00 0.00 3.80 4.77 0.34 -0.99 117.00 121.28 3hho n LEU 45 Ca -0.07 -0.49 0.00 0.00 -0.03 0.00 0.00 56.01 55.42 3hho n LEU 45 Cb 0.34 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 3hho n LEU 45 CO 0.38 0.17 0.00 0.00 -1.33 0.00 0.00 177.39 176.61 3hho n ALA 47 N 1.02 0.00 0.05 -1.18 0.00 -0.66 -1.39 120.51 118.35 3hho n ALA 47 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 3hho n ALA 47 Cb 0.15 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.54 3hho n ALA 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3hho h VAL 48 N 0.00 0.88 -0.85 0.00 2.07 -1.34 0.24 116.25 117.25 3hho h VAL 48 Ca 0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 3hho h VAL 48 Cb 0.00 0.88 -0.09 0.00 -1.52 0.00 0.00 31.29 30.56 3hho h VAL 48 CO 0.00 0.00 0.46 1.56 0.02 0.00 0.00 177.57 179.61 3hho h GLN 49 N -0.09 0.69 -0.28 1.57 4.20 -1.50 0.26 115.11 119.96 3hho h GLN 49 Ca 0.02 -0.04 -0.12 0.00 0.06 0.00 0.00 58.65 58.57 3hho h GLN 49 Cb 0.11 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.73 3hho h GLN 49 CO -0.05 0.45 -0.29 0.37 -0.67 0.00 0.00 178.83 178.65 3hho h GLN 50 N 0.71 0.68 0.00 1.46 5.75 -1.54 0.45 115.11 122.62 3hho h GLN 50 Ca 0.44 -0.36 -0.01 0.00 -0.15 0.00 0.00 58.65 58.57 3hho h GLN 50 Cb 0.54 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.10 3hho h GLN 50 CO -0.31 0.97 -0.04 0.00 -2.65 0.00 0.00 178.83 176.80 3hho h ALA 51 N 0.70 1.23 0.02 3.38 0.00 -0.12 -1.22 119.26 123.25 3hho h ALA 51 Ca 0.04 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3hho h ALA 51 Cb 0.85 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3hho h ALA 51 CO 0.07 0.05 -0.01 0.00 0.00 0.00 0.00 179.25 179.36 3hho h ALA 52 N 1.96 -0.03 -0.03 0.00 0.00 0.20 -2.14 119.26 119.23 3hho h ALA 52 Ca -0.00 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.55 3hho h ALA 52 Cb 0.15 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3hho h ALA 52 CO 0.00 -0.06 0.02 0.37 0.00 0.00 0.00 179.25 179.59 3hho h GLN 53 N -0.94 0.00 -0.18 0.00 4.15 0.13 0.82 115.11 119.09 3hho h GLN 53 Ca -0.00 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.32 3hho h GLN 53 Cb 0.73 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.42 3hho h GLN 53 CO 0.00 0.00 -0.28 0.82 -1.93 0.00 0.00 178.83 177.44 3hho h ILE 54 N 0.00 1.34 0.44 2.39 2.04 -1.30 -2.47 117.51 119.96 3hho h ILE 54 Ca 0.01 -1.50 -0.01 0.00 1.00 0.00 0.00 64.86 64.36 3hho h ILE 54 Cb 0.05 1.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 3hho h ILE 54 CO -0.00 0.46 -0.47 0.78 0.00 0.00 0.00 178.15 178.92 3hho h ASN 55 N 0.16 -1.29 -0.91 1.72 2.35 -0.20 0.54 115.58 117.95 3hho h ASN 55 Ca 0.02 0.11 0.25 0.00 -0.55 0.00 0.00 56.30 56.12 3hho h ASN 55 Cb 0.86 0.43 -0.14 0.00 0.05 0.00 0.00 38.32 39.52 3hho h ASN 55 CO 0.06 -0.61 0.34 0.44 -1.65 0.00 0.00 177.43 176.01 3hho h ASP 56 N -0.91 0.18 0.02 5.81 3.32 -1.29 -0.73 116.42 122.82 3hho h ASP 56 Ca -0.05 0.18 -0.12 0.00 0.02 0.00 0.00 57.03 57.06 3hho h ASP 56 Cb 0.80 0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.54 3hho h ASP 56 CO -0.07 -0.11 -0.39 0.00 -1.72 0.00 0.00 179.24 176.95 3hho h ALA 57 N 1.78 0.93 0.30 3.45 0.00 -0.90 0.35 119.26 125.17 3hho h ALA 57 Ca 0.59 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3hho h ALA 57 Cb 1.20 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3hho h ALA 57 CO -0.61 0.63 -0.14 -0.92 0.00 0.00 0.00 179.25 178.20 3hho h TYR 58 N 0.40 -0.37 -0.56 0.00 3.20 0.49 -2.27 116.97 117.86 3hho h TYR 58 Ca 0.04 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.99 3hho h TYR 58 Cb 0.86 0.12 -0.07 0.00 1.54 0.00 0.00 36.73 39.18 3hho h TYR 58 CO 0.03 -0.10 0.17 1.96 -1.64 0.00 0.00 178.16 178.58 3hho h GLN 59 N -0.61 0.33 -0.56 1.82 1.08 -1.15 0.22 115.11 116.24 3hho h GLN 59 Ca -0.04 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.13 3hho h GLN 59 Cb 0.44 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.77 3hho h GLN 59 CO 0.07 0.22 0.31 1.15 -0.95 0.00 0.00 178.83 179.62 3hho h THR 60 N 0.34 1.17 0.00 -0.54 2.02 -0.92 -2.44 112.91 112.55 3hho h THR 60 Ca 0.28 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 67.04 3hho h THR 60 Cb 0.36 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 3hho h THR 60 CO -0.32 0.19 -0.77 -0.07 0.37 0.00 0.00 175.52 174.93 3hho h LEU 61 N 0.77 0.00 0.01 2.58 4.07 -0.91 -2.17 115.31 119.66 3hho h LEU 61 Ca 0.20 -0.02 -0.27 0.00 0.08 0.00 0.00 57.88 57.87 3hho h LEU 61 Cb 0.02 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.78 3hho h LEU 61 CO -0.03 0.01 -1.09 0.50 -1.08 0.00 0.00 178.44 176.75 3hho h LYS 62 N 0.00 0.63 -5.92 1.13 3.64 -0.13 -3.44 116.57 112.48 3hho h LYS 62 Ca 0.00 -0.72 -0.57 0.00 -1.27 0.00 0.00 60.65 58.09 3hho h LYS 62 Cb 0.98 0.22 -0.06 0.00 -0.41 0.00 0.00 32.23 32.95 3hho h LYS 62 CO 0.00 1.31 0.06 0.34 -2.27 0.00 0.00 179.45 178.89 3hho s ASP 63 N -7.30 6.89 0.20 4.20 3.68 -0.97 -4.98 116.67 118.39 3hho s ASP 63 Ca -0.09 1.07 -0.09 0.00 2.13 0.00 0.00 52.55 55.56 3hho s ASP 63 Cb 0.07 -2.38 0.12 0.00 -1.45 0.00 0.00 42.92 39.28 3hho s ASP 63 CO 0.92 -0.13 1.75 -0.65 0.13 0.00 0.00 175.17 177.19 3hho h PRO 64 N 6.88 1.07 -0.06 4.34 0.11 -1.89 -1.26 132.00 141.18 3hho h PRO 64 Ca -0.39 -0.20 -0.04 0.00 0.11 0.00 0.00 66.00 65.48 3hho h PRO 64 Cb 1.18 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 3hho h PRO 64 CO 0.76 0.89 -0.10 -0.07 -0.21 0.00 0.00 178.00 179.27 3hho h LEU 65 N 1.02 0.20 -1.20 2.35 4.07 -1.93 -2.76 115.31 117.05 3hho h LEU 65 Ca 0.23 -0.53 0.12 0.00 0.08 0.00 0.00 57.88 57.79 3hho h LEU 65 Cb 0.23 -0.06 -0.07 0.00 1.08 0.00 0.00 40.66 41.84 3hho h LEU 65 CO -0.02 0.69 0.59 0.03 -1.08 0.00 0.00 178.44 178.65 3hho h ARG 66 N -0.29 0.79 0.11 1.13 3.08 -1.79 -0.60 114.38 116.82 3hho h ARG 66 Ca 0.01 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 3hho h ARG 66 Cb 0.65 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.52 3hho h ARG 66 CO 0.02 0.53 -0.05 -0.09 -1.07 0.00 0.00 179.97 179.31 3hho h ARG 67 N 0.82 -0.14 -0.38 0.04 2.43 -0.54 -2.35 114.38 114.25 3hho h ARG 67 Ca 0.45 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.59 3hho h ARG 67 Cb 0.57 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.13 3hho h ARG 67 CO -0.21 -0.02 0.07 0.00 -1.51 0.00 0.00 179.97 178.29 3hho h ALA 68 N 0.65 1.41 -0.15 2.80 0.00 -1.04 -1.83 119.26 121.10 3hho h ALA 68 Ca -0.02 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 3hho h ALA 68 Cb 0.19 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3hho h ALA 68 CO 0.02 0.43 -0.23 1.49 0.00 0.00 0.00 179.25 180.96 3hho h GLU 69 N 0.56 0.26 -0.21 0.00 4.81 -1.05 -2.15 114.58 116.80 3hho h GLU 69 Ca 0.13 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 3hho h GLU 69 Cb 0.26 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 3hho h GLU 69 CO 0.00 0.49 -0.06 -0.92 -0.73 0.00 0.00 179.01 177.79 3hho h TYR 70 N 0.24 0.46 0.00 0.92 3.20 -0.80 0.26 116.97 121.26 3hho h TYR 70 Ca 0.04 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.80 3hho h TYR 70 Cb 0.55 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.71 3hho h TYR 70 CO 0.01 0.67 -0.04 -0.07 -1.64 0.00 0.00 178.16 177.09 3hho h LEU 71 N 0.12 0.00 0.07 2.82 3.38 -1.13 0.61 115.31 121.18 3hho h LEU 71 Ca 0.05 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.74 3hho h LEU 71 Cb 0.53 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 3hho h LEU 71 CO 0.02 0.04 -1.43 -0.07 0.09 0.00 0.00 178.44 177.09 3hho h LEU 72 N 0.00 0.23 -0.43 1.67 4.07 -1.31 -3.30 115.31 116.26 3hho h LEU 72 Ca -0.00 -0.32 0.01 0.00 0.08 0.00 0.00 57.88 57.65 3hho h LEU 72 Cb 0.08 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 41.72 3hho h LEU 72 CO 0.01 1.27 0.27 -1.28 -1.08 0.00 0.00 178.44 177.62 3hho h SER 73 N 0.04 0.45 -0.91 -0.43 0.87 0.20 -1.90 113.55 111.87 3hho h SER 73 Ca -0.19 -0.01 0.09 0.00 -1.23 0.00 0.00 61.79 60.45 3hho h SER 73 Cb 1.96 -0.11 -0.07 0.00 -0.44 0.00 0.00 62.40 63.74 3hho h SER 73 CO 0.14 0.33 0.55 -0.07 -0.53 0.00 0.00 176.83 177.25 3hho h LEU 74 N 0.55 0.83 0.00 2.23 3.38 -0.03 -0.32 115.31 121.94 3hho h LEU 74 Ca 0.16 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3hho h LEU 74 Cb -0.03 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.59 3hho h LEU 74 CO -0.05 0.48 0.00 0.00 0.09 0.00 0.00 178.44 178.96 3hho n GLN 75 N -4.65 0.48 -1.07 1.13 1.13 -0.75 -4.80 117.38 108.85 3hho n GLN 75 Ca 0.15 0.00 -0.02 0.00 -1.94 0.00 0.00 57.00 55.19 3hho n GLN 75 Cb 0.27 -1.16 -0.01 0.00 0.11 0.00 0.00 30.24 29.45 3hho n GLN 75 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hho n GLY 76 N -0.02 0.56 3.42 1.08 0.00 -0.13 -5.02 105.19 105.08 3hho n GLY 76 Ca 0.04 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.28 3hho n GLY 76 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hho s ILE 77 N -1.98 3.61 0.00 -0.61 -1.09 -0.98 -5.03 121.20 115.12 3hho s ILE 77 Ca 0.00 -0.44 0.00 0.00 -2.23 0.00 0.00 60.65 57.98 3hho s ILE 77 Cb 0.00 -2.59 0.00 0.00 -1.58 0.00 0.00 42.46 38.29 3hho s ILE 77 CO 0.00 0.47 0.00 -0.62 -1.23 0.00 0.00 174.94 173.56 3hho n GLU 78 N 3.96 2.43 -2.66 2.79 4.71 -1.26 -3.69 120.64 126.92 3hho n GLU 78 Ca -0.18 0.00 -0.03 0.00 -0.01 0.00 0.00 57.16 56.94 3hho n GLU 78 Cb 0.52 0.00 0.04 0.00 -1.01 0.00 0.00 31.44 30.99 3hho n GLU 78 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 3hho n ASN 80 N -1.04 -1.26 -0.06 1.62 4.05 -1.26 -5.12 115.26 112.19 3hho n ASN 80 Ca 0.00 -0.89 0.00 0.00 0.45 0.00 0.00 54.58 54.14 3hho n ASN 80 Cb 0.00 0.64 0.00 0.00 1.23 0.00 0.00 39.78 41.65 3hho n ASN 80 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3hho n ALA 81 N 2.41 1.47 -0.04 5.20 0.00 -1.26 -0.55 120.51 127.75 3hho n ALA 81 Ca 0.10 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.47 3hho n ALA 81 Cb 0.66 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.09 3hho n ALA 81 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3hho n GLU 82 N -0.38 0.16 -0.07 0.00 0.00 -1.26 -4.55 120.64 114.54 3hho n GLU 82 Ca 0.00 0.06 -0.09 0.00 0.00 0.00 0.00 57.16 57.13 3hho n GLU 82 Cb 0.00 -0.90 -0.15 0.00 0.00 0.00 0.00 31.44 30.39 3hho n GLU 82 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 3hho n GLN 83 N -3.09 0.67 -0.08 5.31 6.02 -0.88 -3.67 117.38 121.66 3hho n GLN 83 Ca -0.13 0.09 -0.12 0.00 -0.01 0.00 0.00 57.00 56.82 3hho n GLN 83 Cb 0.61 -1.61 -0.05 0.00 1.02 0.00 0.00 30.24 30.21 3hho n GLN 83 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 3hho h GLN 84 N 0.00 0.51 -0.36 -1.09 4.15 -1.14 -2.52 115.11 114.66 3hho h GLN 84 Ca -0.44 -0.23 -0.04 0.00 0.77 0.00 0.00 58.65 58.70 3hho h GLN 84 Cb 2.13 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 29.80 3hho h GLN 84 CO 0.05 0.79 0.08 1.79 -1.93 0.00 0.00 178.83 179.61 3hho h THR 85 N 0.21 1.23 0.00 2.39 1.35 -1.78 -2.05 112.91 114.27 3hho h THR 85 Ca 0.05 -0.79 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 3hho h THR 85 Cb 0.66 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.14 3hho h THR 85 CO 0.04 0.27 0.10 -0.07 -0.25 0.00 0.00 175.52 175.61 3hho h LEU 86 N 0.43 0.00 -0.83 3.87 3.38 -1.62 -2.37 115.31 118.18 3hho h LEU 86 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3hho h LEU 86 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3hho h LEU 86 CO 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 178.44 178.43 3hho n GLN 87 N -2.27 1.38 -3.42 1.13 1.13 -0.77 -4.62 117.38 109.94 3hho n GLN 87 Ca -0.01 -0.83 -0.26 0.00 -1.94 0.00 0.00 57.00 53.95 3hho n GLN 87 Cb 0.14 -1.48 -0.09 0.00 0.11 0.00 0.00 30.24 28.91 3hho n GLN 87 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 3hho n ASP 88 N -0.08 0.70 -2.42 1.08 4.64 -0.89 -5.10 116.55 114.48 3hho n ASP 88 Ca 0.16 -2.71 -0.11 0.00 -1.38 0.00 0.00 54.79 50.75 3hho n ASP 88 Cb 0.36 -0.62 -0.09 0.00 -1.04 0.00 0.00 41.12 39.74 3hho n ASP 88 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 3hho n PRO 89 N 2.09 1.47 0.00 -0.67 -0.02 -1.26 -2.99 135.00 133.61 3hho n PRO 89 Ca 0.26 -0.83 0.00 0.00 -2.02 0.00 0.00 63.50 60.91 3hho n PRO 89 Cb 0.47 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 3hho n PRO 89 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3hho n PHE 91 N 3.02 0.00 0.00 6.00 7.35 -1.26 -4.73 117.46 127.84 3hho n PHE 91 Ca 0.32 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.01 3hho n PHE 91 Cb 0.47 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.30 3hho n PHE 91 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 3hho n LEU 92 N 0.00 0.00 0.00 -2.13 4.77 -1.16 -1.37 117.00 117.11 3hho n LEU 92 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3hho n LEU 92 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3hho n LEU 92 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.39 177.27 3hho n GLU 94 N 1.13 0.00 0.00 3.23 2.13 -1.26 -4.70 120.64 121.18 3hho n GLU 94 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3hho n GLU 94 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 3hho n GLU 94 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 3hho n GLN 95 N 0.00 0.01 0.00 5.31 6.02 -0.47 -0.96 117.38 127.29 3hho n GLN 95 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3hho n GLN 95 Cb 0.00 -1.00 0.00 0.00 1.02 0.00 0.00 30.24 30.26 3hho n GLN 95 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 3hho n GLU 97 N -0.04 0.00 -0.08 -1.09 4.71 -1.26 -2.20 120.64 120.69 3hho n GLU 97 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.16 57.04 3hho n GLU 97 Cb 0.00 0.00 0.02 0.00 -1.01 0.00 0.00 31.44 30.45 3hho n GLU 97 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 3hho h LEU 98 N 0.00 0.87 0.27 -4.62 3.38 -1.46 0.13 115.31 113.88 3hho h LEU 98 Ca 0.00 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.56 3hho h LEU 98 Cb 0.00 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3hho h LEU 98 CO 0.00 1.17 -0.18 0.03 0.09 0.00 0.00 178.44 179.55 3hho h ARG 99 N 0.65 -0.42 -0.27 1.13 3.08 -1.69 -0.94 114.38 115.92 3hho h ARG 99 Ca 0.05 0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.18 3hho h ARG 99 Cb 0.99 0.10 -0.05 0.00 0.08 0.00 0.00 29.97 31.08 3hho h ARG 99 CO 0.09 -0.28 -0.07 1.49 -1.07 0.00 0.00 179.97 180.14 3hho h GLU 100 N -0.44 0.00 -0.71 0.04 4.81 -1.81 0.25 114.58 116.72 3hho h GLU 100 Ca -0.02 -0.00 0.21 0.00 -0.13 0.00 0.00 59.36 59.41 3hho h GLU 100 Cb 0.37 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 3hho h GLU 100 CO 0.02 0.00 0.54 1.49 -0.73 0.00 0.00 179.01 180.33 3hho h GLU 101 N 0.00 0.00 0.14 1.92 4.81 -0.64 -1.35 114.58 119.46 3hho h GLU 101 Ca 0.13 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 59.05 3hho h GLU 101 Cb 0.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.58 3hho h GLU 101 CO -0.28 0.00 -1.52 1.25 -0.73 0.00 0.00 179.01 177.73 3hho h LEU 102 N 0.00 0.46 -1.51 1.64 5.85 0.83 -3.31 115.31 119.27 3hho h LEU 102 Ca 0.34 -0.61 -0.00 0.00 0.84 0.00 0.00 57.88 58.44 3hho h LEU 102 Cb 1.41 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.27 3hho h LEU 102 CO -0.00 1.51 0.27 -0.33 -0.34 0.00 0.00 178.44 179.54 3hho h GLU 103 N 0.08 0.59 -0.27 1.25 4.39 0.19 -3.20 114.58 117.61 3hho h GLU 103 Ca -0.25 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.41 3hho h GLU 103 Cb 2.04 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 30.54 3hho h GLU 103 CO 0.18 0.42 0.17 0.77 -1.16 0.00 0.00 179.01 179.39 3hho h SER 104 N 0.60 0.32 -0.67 1.42 0.02 -1.48 -3.36 113.55 110.41 3hho h SER 104 Ca 0.16 -0.03 0.11 0.00 -0.84 0.00 0.00 61.79 61.19 3hho h SER 104 Cb -0.02 -0.08 -0.11 0.00 0.14 0.00 0.00 62.40 62.33 3hho h SER 104 CO -0.03 0.25 -0.24 0.55 -1.14 0.00 0.00 176.83 176.22 3hho n VAL 105 N -4.89 -0.33 0.21 2.27 3.14 -1.21 0.20 118.33 117.72 3hho n VAL 105 Ca -0.02 1.55 0.18 0.00 -2.96 0.00 0.00 64.34 63.09 3hho n VAL 105 Cb 0.04 -2.07 0.84 0.00 -1.06 0.00 0.00 33.84 31.59 3hho n VAL 105 CO 0.00 0.00 0.00 0.74 -6.46 0.00 0.00 176.83 171.11 3hho h THR 106 N 0.00 0.42 -0.07 1.55 2.02 -1.83 -1.97 112.91 113.02 3hho h THR 106 Ca 0.25 0.00 -0.23 0.00 0.77 0.00 0.00 66.41 67.21 3hho h THR 106 Cb 0.42 0.82 0.01 0.00 -1.74 0.00 0.00 68.15 67.66 3hho h THR 106 CO -0.67 0.00 -0.87 0.00 0.37 0.00 0.00 175.52 174.35 3hho h ALA 107 N 1.73 0.34 -2.41 6.16 0.00 0.19 -3.44 119.26 121.84 3hho h ALA 107 Ca 0.09 -0.65 -0.54 0.00 0.00 0.00 0.00 54.91 53.81 3hho h ALA 107 Cb 0.52 -0.01 0.20 0.00 0.00 0.00 0.00 17.79 18.50 3hho h ALA 107 CO -0.00 0.73 -0.04 0.00 0.00 0.00 0.00 179.25 179.94 3hho n ALA 109 N -3.41 7.03 0.00 0.00 0.00 -1.26 -3.96 120.51 118.90 3hho n ALA 109 Ca 0.11 -3.44 0.00 0.00 0.00 0.00 0.00 53.44 50.11 3hho n ALA 109 Cb 0.51 -2.89 0.00 0.00 0.00 0.00 0.00 19.45 17.08 3hho n ALA 109 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3hho n ASP 110 N 2.48 0.00 0.00 0.00 4.64 -1.26 -5.04 116.55 117.36 3hho n ASP 110 Ca 0.65 0.00 0.04 0.00 -1.38 0.00 0.00 54.79 54.11 3hho n ASP 110 Cb 0.36 0.00 0.20 0.00 -1.04 0.00 0.00 41.12 40.64 3hho n ASP 110 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 3hho n PRO 111 N 0.00 0.00 0.03 -0.67 -0.02 -1.24 -3.04 135.00 130.06 3hho n PRO 111 Ca 0.00 0.34 -0.01 0.00 -2.02 0.00 0.00 63.50 61.80 3hho n PRO 111 Cb 0.00 -1.50 -0.01 0.00 -0.02 0.00 0.00 33.50 31.97 3hho n PRO 111 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3hho h GLU 112 N 0.00 -0.08 0.00 -0.52 5.08 -1.95 -3.06 114.58 114.06 3hho h GLU 112 Ca 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3hho h GLU 112 Cb 0.16 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3hho h GLU 112 CO 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 179.01 177.96 3hho h ALA 113 N -1.87 1.00 0.23 3.43 0.00 -2.00 -2.46 119.26 117.59 3hho h ALA 113 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3hho h ALA 113 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3hho h ALA 113 CO 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 179.25 179.15 3hho h ALA 114 N 2.03 -0.93 -0.66 0.00 0.00 -1.63 -1.91 119.26 116.16 3hho h ALA 114 Ca 0.00 -0.07 0.13 0.00 0.00 0.00 0.00 54.91 54.97 3hho h ALA 114 Cb 0.21 0.12 -0.13 0.00 0.00 0.00 0.00 17.79 17.99 3hho h ALA 114 CO 0.00 -0.91 -0.19 1.25 0.00 0.00 0.00 179.25 179.40 3hho h LEU 115 N -0.35 -0.70 -0.41 0.00 5.85 -1.39 -1.01 115.31 117.30 3hho h LEU 115 Ca -0.03 0.21 0.08 0.00 0.84 0.00 0.00 57.88 58.98 3hho h LEU 115 Cb 0.24 0.44 -0.08 0.00 0.37 0.00 0.00 40.66 41.63 3hho h LEU 115 CO 0.05 -0.23 -0.10 0.58 -0.34 0.00 0.00 178.44 178.39 3hho h VAL 116 N -0.02 0.59 -0.29 1.05 2.07 -1.48 0.59 116.25 118.76 3hho h VAL 116 Ca 0.31 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.66 3hho h VAL 116 Cb 0.50 0.59 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3hho h VAL 116 CO -0.69 0.00 -0.48 0.00 0.02 0.00 0.00 177.57 176.42 3hho h ALA 117 N 1.41 0.59 -0.60 1.67 0.00 -0.59 0.03 119.26 121.77 3hho h ALA 117 Ca 0.20 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3hho h ALA 117 Cb 0.30 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3hho h ALA 117 CO -0.42 0.68 0.39 0.35 0.00 0.00 0.00 179.25 180.25 3hho h PHE 118 N 0.63 0.76 -0.61 0.00 3.57 -0.81 0.22 116.94 120.69 3hho h PHE 118 Ca 0.03 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 3hho h PHE 118 Cb 1.06 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 39.52 3hho h PHE 118 CO 0.06 0.49 0.26 0.22 -2.23 0.00 0.00 178.31 177.10 3hho h ASP 119 N 0.81 0.80 -0.00 0.41 3.58 0.60 0.27 116.42 122.88 3hho h ASP 119 Ca 0.22 -0.10 -0.12 0.00 0.42 0.00 0.00 57.03 57.45 3hho h ASP 119 Cb -0.08 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 40.76 3hho h ASP 119 CO -0.05 0.71 -0.37 0.74 -2.88 0.00 0.00 179.24 177.39 3hho h THR 120 N 0.87 1.30 -0.37 2.25 2.02 -0.69 -2.28 112.91 116.01 3hho h THR 120 Ca 0.21 -1.50 -0.01 0.00 0.77 0.00 0.00 66.41 65.88 3hho h THR 120 Cb 0.15 1.53 -0.02 0.00 -1.74 0.00 0.00 68.15 68.07 3hho h THR 120 CO -0.02 0.47 0.20 0.50 0.37 0.00 0.00 175.52 177.04 3hho h LYS 121 N 0.42 0.52 -0.43 6.66 3.64 0.21 -2.78 116.57 124.81 3hho h LYS 121 Ca 0.04 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.28 3hho h LYS 121 Cb 0.84 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 3hho h LYS 121 CO 0.07 0.43 -0.04 0.28 -2.27 0.00 0.00 179.45 177.92 3hho h VAL 122 N 0.47 1.27 -0.72 2.00 2.07 -0.53 -3.04 116.25 117.77 3hho h VAL 122 Ca 0.13 -1.10 0.09 0.00 0.82 0.00 0.00 66.70 66.64 3hho h VAL 122 Cb 0.06 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 3hho h VAL 122 CO -0.02 0.38 0.48 0.74 0.02 0.00 0.00 177.57 179.16 3hho h THR 123 N 0.62 0.95 0.00 2.57 2.02 -1.36 -1.55 112.91 116.16 3hho h THR 123 Ca 0.12 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.07 3hho h THR 123 Cb 0.55 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 3hho h THR 123 CO 0.03 0.12 0.00 0.00 0.37 0.00 0.00 175.52 176.04 3hho n ALA 124 N -2.46 1.90 0.00 6.16 0.00 -1.05 -2.14 120.51 122.92 3hho n ALA 124 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 3hho n ALA 124 Cb 0.31 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.76 3hho n ALA 124 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 3hho n GLN 126 N 0.54 0.00 0.30 0.00 7.27 -0.58 -1.07 117.38 123.85 3hho n GLN 126 Ca 0.00 0.00 0.19 0.00 0.07 0.00 0.00 57.00 57.26 3hho n GLN 126 Cb 0.20 0.00 0.95 0.00 2.41 0.00 0.00 30.24 33.80 3hho n GLN 126 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3hho h ARG 127 N 0.00 0.00 0.07 3.69 3.08 -1.69 -1.79 114.38 117.74 3hho h ARG 127 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 3hho h ARG 127 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3hho h ARG 127 CO 0.00 0.02 -0.03 1.25 -1.07 0.00 0.00 179.97 180.14 3hho h HIS 128 N 0.00 -0.08 0.00 3.04 2.76 -1.36 -3.32 115.15 116.19 3hho h HIS 128 Ca -0.00 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.16 3hho h HIS 128 Cb 0.22 0.03 -0.00 0.00 1.55 0.00 0.00 27.41 29.21 3hho h HIS 128 CO 0.00 0.45 -0.05 1.88 -1.30 0.00 0.00 177.93 178.91 3hho h TYR 129 N -0.92 0.00 -0.03 5.26 0.05 -1.73 -3.09 116.97 116.50 3hho h TYR 129 Ca -0.01 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.60 3hho h TYR 129 Cb 0.57 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.32 3hho h TYR 129 CO 0.13 0.05 -0.63 -0.07 -1.05 0.00 0.00 178.16 176.59 3hho h LEU 130 N 0.00 0.62 -1.60 3.88 3.38 -1.47 -3.00 115.31 117.11 3hho h LEU 130 Ca -0.00 -0.72 -0.05 0.00 0.09 0.00 0.00 57.88 57.20 3hho h LEU 130 Cb 0.22 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 3hho h LEU 130 CO 0.01 1.25 -0.22 0.00 0.09 0.00 0.00 178.44 179.57 3hho h ALA 131 N 0.38 1.45 0.86 1.53 0.00 -1.63 0.72 119.26 122.57 3hho h ALA 131 Ca -0.07 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 3hho h ALA 131 Cb 1.32 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3hho h ALA 131 CO 0.13 0.27 -0.49 1.96 0.00 0.00 0.00 179.25 181.12 3hho h GLN 132 N 0.00 -1.20 -0.04 0.00 1.08 -1.53 -1.06 115.11 112.36 3hho h GLN 132 Ca -0.00 0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 3hho h GLN 132 Cb 0.44 0.27 -0.00 0.00 -0.05 0.00 0.00 27.48 28.14 3hho h GLN 132 CO 0.03 -0.80 0.02 1.25 -0.95 0.00 0.00 178.83 178.38 3hho h LEU 133 N -1.25 0.04 -1.18 1.46 5.85 -1.34 2.11 115.31 121.00 3hho h LEU 133 Ca -0.12 -0.00 0.19 0.00 0.84 0.00 0.00 57.88 58.79 3hho h LEU 133 Cb 0.99 -0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.92 3hho h LEU 133 CO 0.14 0.03 0.61 -0.61 -0.34 0.00 0.00 178.44 178.28 3hho h GLN 134 N 0.05 0.65 0.02 1.25 4.15 -0.87 1.32 115.11 121.69 3hho h GLN 134 Ca 0.01 -0.04 -0.10 0.00 0.77 0.00 0.00 58.65 59.29 3hho h GLN 134 Cb -0.00 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.53 3hho h GLN 134 CO -0.00 0.43 -0.53 0.78 -1.93 0.00 0.00 178.83 177.57 3hho h GLY 135 N 0.67 0.06 -0.61 2.39 0.00 -0.65 -3.12 103.07 101.80 3hho h GLY 135 Ca 0.54 -0.15 0.10 0.00 0.00 0.00 0.00 47.33 47.82 3hho h GLY 135 CO -0.30 0.13 -0.42 -1.61 0.00 0.00 0.00 176.54 174.34 3hho h GLN 136 N -0.88 -0.15 -0.43 4.80 4.15 0.45 0.11 115.11 123.17 3hho h GLN 136 Ca -0.13 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.29 3hho h GLN 136 Cb 1.21 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.91 3hho h GLN 136 CO -0.03 -0.10 0.24 -0.07 -1.93 0.00 0.00 178.83 176.94 3hho h LEU 137 N -0.16 0.51 -1.39 -2.39 3.38 0.15 -1.33 115.31 114.08 3hho h LEU 137 Ca 0.22 -0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.25 3hho h LEU 137 Cb 0.56 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 3hho h LEU 137 CO -0.76 0.40 0.50 0.00 0.09 0.00 0.00 178.44 178.67 3hho h ALA 138 N 1.68 1.79 -0.04 1.53 0.00 -0.73 -1.86 119.26 121.63 3hho h ALA 138 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3hho h ALA 138 Cb -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.63 3hho h ALA 138 CO -0.03 0.06 0.00 1.04 0.00 0.00 0.00 179.25 180.33 3hho n GLN 139 N -4.50 1.79 -1.42 0.00 6.02 -0.53 -4.94 117.38 113.81 3hho n GLN 139 Ca 0.12 -1.16 -0.13 0.00 -0.01 0.00 0.00 57.00 55.82 3hho n GLN 139 Cb 0.31 -1.47 -0.06 0.00 1.02 0.00 0.00 30.24 30.05 3hho n GLN 139 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 3hho n SER 140 N 0.40 -4.59 -4.56 1.08 7.64 -0.70 -4.94 113.62 107.95 3hho n SER 140 Ca 0.18 0.32 -0.35 0.00 1.01 0.00 0.00 58.87 60.03 3hho n SER 140 Cb 0.40 -3.28 -0.04 0.00 -1.01 0.00 0.00 64.21 60.28 3hho n SER 140 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3hho s GLU 141 N -3.18 2.90 0.02 1.43 2.56 -1.20 -4.88 118.70 116.34 3hho s GLU 141 Ca 0.00 -0.27 -0.26 0.00 0.00 0.00 0.00 54.97 54.44 3hho s GLU 141 Cb 0.00 -4.86 -0.16 0.00 2.00 0.00 0.00 34.13 31.11 3hho s GLU 141 CO 0.00 -2.79 1.21 -1.49 -0.56 0.00 0.00 175.26 171.63 3hho h TRP 142 N 11.62 -0.63 0.00 5.30 -0.00 -1.92 -2.66 115.95 127.67 3hho h TRP 142 Ca -0.01 -0.01 -0.07 0.00 -0.00 0.00 0.00 58.89 58.79 3hho h TRP 142 Cb 1.05 0.21 -0.01 0.00 -0.00 0.00 0.00 29.16 30.41 3hho h TRP 142 CO 1.18 -0.31 -0.33 -0.07 -0.00 0.00 0.00 178.44 178.91 3hho h LEU 143 N -0.97 0.00 -1.65 -4.49 3.38 -1.97 0.19 115.31 109.79 3hho h LEU 143 Ca -0.07 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 3hho h LEU 143 Cb 0.61 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 3hho h LEU 143 CO 0.11 0.33 0.03 0.00 0.09 0.00 0.00 178.44 179.01 3hho h ALA 144 N 1.67 1.73 0.01 1.53 0.00 -1.96 -2.81 119.26 119.42 3hho h ALA 144 Ca -0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3hho h ALA 144 Cb 0.65 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3hho h ALA 144 CO 0.04 0.21 -0.01 0.00 0.00 0.00 0.00 179.25 179.50 3hho h ALA 145 N 1.79 -0.02 0.00 0.00 0.00 -0.48 -2.78 119.26 117.77 3hho h ALA 145 Ca 0.06 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3hho h ALA 145 Cb 0.12 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3hho h ALA 145 CO -0.00 -0.08 0.17 0.00 0.00 0.00 0.00 179.25 179.34 3hho n ALA 146 N -2.57 0.65 -0.04 0.00 0.00 0.43 -0.46 120.51 118.52 3hho n ALA 146 Ca -0.09 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.31 3hho n ALA 146 Cb 0.38 -0.61 -0.06 0.00 0.00 0.00 0.00 19.45 19.16 3hho n ALA 146 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3hho n ASP 147 N -1.24 3.13 0.17 0.00 10.43 -1.08 -3.94 116.55 124.01 3hho n ASP 147 Ca 0.00 -0.01 0.06 0.00 2.57 0.00 0.00 54.79 57.41 3hho n ASP 147 Cb 0.17 0.58 0.53 0.00 1.84 0.00 0.00 41.12 44.23 3hho n ASP 147 CO 0.00 0.00 0.00 1.56 -1.07 0.00 0.00 177.20 177.69 3hho h GLN 148 N 0.00 0.16 -0.21 -1.24 7.50 -0.47 -2.70 115.11 118.15 3hho h GLN 148 Ca -0.21 -0.02 -0.13 0.00 0.50 0.00 0.00 58.65 58.79 3hho h GLN 148 Cb 1.45 -0.03 -0.01 0.00 0.05 0.00 0.00 27.48 28.94 3hho h GLN 148 CO 0.01 0.17 -0.43 0.82 -1.50 0.00 0.00 178.83 177.89 3hho h ILE 149 N 0.16 1.31 0.69 2.54 2.04 -1.23 -2.40 117.51 120.61 3hho h ILE 149 Ca 0.04 -1.61 -0.03 0.00 1.00 0.00 0.00 64.86 64.26 3hho h ILE 149 Cb 0.10 1.62 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 3hho h ILE 149 CO 0.00 0.50 -0.35 0.03 0.00 0.00 0.00 178.15 178.33 3hho h ARG 150 N 0.41 -0.92 -0.48 2.37 3.08 -1.60 -0.64 114.38 116.60 3hho h ARG 150 Ca 0.03 0.06 0.06 0.00 0.07 0.00 0.00 59.98 60.21 3hho h ARG 150 Cb 0.93 0.21 -0.05 0.00 0.08 0.00 0.00 29.97 31.13 3hho h ARG 150 CO 0.08 -0.61 0.18 0.87 -1.07 0.00 0.00 179.97 179.42 3hho h LYS 151 N -0.95 0.34 -0.94 0.04 1.57 -1.56 -1.66 116.57 113.42 3hho h LYS 151 Ca -0.09 -0.02 0.10 0.00 -1.87 0.00 0.00 60.65 58.77 3hho h LYS 151 Cb 0.74 -0.08 -0.08 0.00 0.08 0.00 0.00 32.23 32.90 3hho h LYS 151 CO 0.14 0.23 0.58 -0.07 -0.57 0.00 0.00 179.45 179.75 3hho h LEU 152 N 0.35 0.86 -2.19 2.94 3.38 -1.36 0.30 115.31 119.60 3hho h LEU 152 Ca 0.23 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 3hho h LEU 152 Cb 0.23 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 3hho h LEU 152 CO -0.23 0.49 -0.06 0.11 0.09 0.00 0.00 178.44 178.84 3hho h LYS 153 N 0.96 0.00 0.12 1.13 1.57 -0.19 -2.59 116.57 117.57 3hho h LYS 153 Ca 0.45 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.95 3hho h LYS 153 Cb 0.37 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.69 3hho h LYS 153 CO -0.24 0.06 -1.22 0.35 -0.57 0.00 0.00 179.45 177.84 3hho h PHE 154 N 0.00 0.66 -0.29 -1.35 3.57 0.12 -3.04 116.94 116.62 3hho h PHE 154 Ca -0.00 -0.45 -0.14 0.00 3.53 0.00 0.00 57.97 60.92 3hho h PHE 154 Cb 0.17 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 3hho h PHE 154 CO 0.00 1.32 -0.37 0.82 -2.23 0.00 0.00 178.31 177.85 3hho h ILE 155 N 0.15 1.29 0.13 1.41 1.08 -1.18 0.39 117.51 120.78 3hho h ILE 155 Ca -0.15 -1.53 -0.01 0.00 -0.39 0.00 0.00 64.86 62.78 3hho h ILE 155 Cb 1.91 1.47 0.00 0.00 -3.07 0.00 0.00 36.82 37.13 3hho h ILE 155 CO 0.21 0.49 -0.07 0.00 -0.69 0.00 0.00 178.15 178.10 3hho h ALA 156 N 1.03 -0.18 -0.03 1.87 0.00 -1.56 0.52 119.26 120.90 3hho h ALA 156 Ca 0.05 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.96 3hho h ALA 156 Cb 0.89 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 3hho h ALA 156 CO 0.08 -0.60 -0.22 0.87 0.00 0.00 0.00 179.25 179.38 3hho h LYS 157 N -0.19 -0.31 -0.98 0.00 1.79 -1.40 -0.78 116.57 114.71 3hho h LYS 157 Ca -0.02 0.02 0.13 0.00 -2.18 0.00 0.00 60.65 58.60 3hho h LYS 157 Cb 0.15 0.07 -0.08 0.00 -1.58 0.00 0.00 32.23 30.79 3hho h LYS 157 CO 0.02 -0.21 0.62 1.25 -1.08 0.00 0.00 179.45 180.05 3hho h LEU 158 N -0.33 0.86 -0.20 2.94 5.85 0.21 -0.53 115.31 124.11 3hho h LEU 158 Ca 0.07 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3hho h LEU 158 Cb 0.42 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 3hho h LEU 158 CO -0.22 0.44 0.08 0.11 -0.34 0.00 0.00 178.44 178.51 3hho h LYS 159 N 0.91 0.30 0.00 1.25 1.57 0.51 -0.55 116.57 120.57 3hho h LYS 159 Ca 0.49 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.22 3hho h LYS 159 Cb 0.56 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.82 3hho h LYS 159 CO -0.26 0.36 0.00 0.09 -0.57 0.00 0.00 179.45 179.07 3hho n ASN 160 N -4.83 0.50 -0.02 0.86 5.03 -0.26 -1.08 115.26 115.46 3hho n ASN 160 Ca -0.04 0.70 0.08 0.00 0.87 0.00 0.00 54.58 56.19 3hho n ASN 160 Cb 0.12 -0.78 -0.15 0.00 -1.02 0.00 0.00 39.78 37.96 3hho n ASN 160 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3hho n GLU 161 N -2.13 0.62 -0.07 3.52 1.02 -0.84 -2.98 120.64 119.77 3hho n GLU 161 Ca -0.00 -0.16 -0.13 0.00 -0.02 0.00 0.00 57.16 56.85 3hho n GLU 161 Cb 0.09 -1.45 -0.06 0.00 -0.02 0.00 0.00 31.44 30.00 3hho n GLU 161 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3hho h VAL 162 N 0.00 1.32 -0.41 2.62 2.07 0.01 -2.73 116.25 119.13 3hho h VAL 162 Ca -0.04 -1.30 -0.00 0.00 0.82 0.00 0.00 66.70 66.18 3hho h VAL 162 Cb 0.96 1.71 -0.02 0.00 -1.52 0.00 0.00 31.29 32.42 3hho h VAL 162 CO 0.00 0.40 0.24 -0.33 0.02 0.00 0.00 177.57 177.90 3hho h GLU 163 N 0.17 0.57 -0.72 1.57 4.39 -1.26 0.24 114.58 119.54 3hho h GLU 163 Ca 0.04 -0.06 0.13 0.00 0.34 0.00 0.00 59.36 59.82 3hho h GLU 163 Cb 0.70 -0.12 -0.09 0.00 -0.10 0.00 0.00 28.75 29.14 3hho h GLU 163 CO 0.04 0.43 0.26 -0.09 -1.16 0.00 0.00 179.01 178.50 3hho h ARG 164 N 0.54 0.40 0.00 2.33 2.43 -1.53 0.62 114.38 119.17 3hho h ARG 164 Ca 0.15 -0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.17 3hho h ARG 164 Cb 0.01 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 3hho h ARG 164 CO -0.03 0.26 -0.58 0.28 -1.51 0.00 0.00 179.97 178.40 3hho h VAL 165 N 0.41 1.26 0.58 0.20 2.07 -1.19 -2.38 116.25 117.20 3hho h VAL 165 Ca 0.39 -2.07 -0.03 0.00 0.82 0.00 0.00 66.70 65.81 3hho h VAL 165 Cb 0.58 2.17 0.01 0.00 -1.52 0.00 0.00 31.29 32.53 3hho h VAL 165 CO -0.40 0.56 -0.28 -0.08 0.02 0.00 0.00 177.57 177.40 3hho h GLU 166 N 0.00 -0.75 -0.05 1.57 4.81 0.24 -2.54 114.58 117.87 3hho h GLU 166 Ca -0.01 0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 3hho h GLU 166 Cb 1.12 0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.67 3hho h GLU 166 CO 0.07 -0.44 0.27 -0.44 -0.73 0.00 0.00 179.01 177.75 3hho h ASP 167 N -1.02 0.00 0.00 1.04 3.32 0.05 1.36 116.42 121.17 3hho h ASP 167 Ca -0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.97 3hho h ASP 167 Cb 0.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 3hho h ASP 167 CO 0.13 0.00 0.00 1.67 -1.72 0.00 0.00 179.24 179.32 3hho n GLN 168 N -3.07 0.86 0.00 3.56 7.27 -0.90 -2.96 117.38 122.15 3hho n GLN 168 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.06 3hho n GLN 168 Cb 0.34 -1.39 0.00 0.00 2.41 0.00 0.00 30.24 31.60 3hho n GLN 168 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 3hho n LEU 169 N -0.89 1.32 -0.38 1.69 4.77 0.44 -5.05 117.00 118.90 3hho n LEU 169 Ca 0.16 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.19 3hho n LEU 169 Cb 0.07 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.20 3hho n LEU 169 CO 0.12 0.22 0.40 0.00 -1.33 0.00 0.00 177.39 176.80