#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hth n GLU 8 N 0.00 0.17 0.04 -0.52 0.28 -1.26 -3.46 120.64 115.89 3hth n GLU 8 Ca 0.00 -0.09 -0.21 0.00 -0.16 0.00 0.00 57.16 56.70 3hth n GLU 8 Cb 0.00 -1.50 -0.14 0.00 1.43 0.00 0.00 31.44 31.23 3hth n GLU 8 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 177.13 176.88 3hth h ARG 9 N 0.22 0.29 -0.63 3.44 9.65 -2.04 -3.01 114.38 122.30 3hth h ARG 9 Ca 0.00 -0.50 0.03 0.00 -1.10 0.00 0.00 59.98 58.41 3hth h ARG 9 Cb 0.49 0.19 -0.04 0.00 -1.39 0.00 0.00 29.97 29.22 3hth h ARG 9 CO 0.00 1.19 0.38 -0.09 2.80 0.00 0.00 179.97 184.26 3hth h ARG 10 N 0.08 0.72 -0.37 0.20 2.43 -2.00 -1.46 114.38 113.98 3hth h ARG 10 Ca -0.36 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 58.67 3hth h ARG 10 Cb 2.06 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 31.43 3hth h ARG 10 CO 0.13 0.48 -0.15 0.37 -1.51 0.00 0.00 179.97 179.29 3hth h GLN 11 N 0.75 0.68 -0.20 0.20 5.75 -1.67 -1.60 115.11 119.02 3hth h GLN 11 Ca 0.26 -0.23 -0.12 0.00 -0.15 0.00 0.00 58.65 58.41 3hth h GLN 11 Cb 0.05 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.53 3hth h GLN 11 CO -0.12 0.80 -0.37 -0.09 -2.65 0.00 0.00 178.83 176.40 3hth h ARG 12 N 0.61 0.43 -0.26 1.69 2.43 -1.29 -0.80 114.38 117.19 3hth h ARG 12 Ca 0.10 -0.20 -0.14 0.00 -0.81 0.00 0.00 59.98 58.93 3hth h ARG 12 Cb 0.61 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 3hth h ARG 12 CO 0.04 0.75 -0.41 0.82 -1.51 0.00 0.00 179.97 179.66 3hth h ILE 13 N 0.37 1.30 0.48 1.20 2.04 -0.99 -2.60 117.51 119.30 3hth h ILE 13 Ca 0.04 -1.59 -0.02 0.00 1.00 0.00 0.00 64.86 64.29 3hth h ILE 13 Cb 0.82 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 3hth h ILE 13 CO 0.07 0.51 -0.23 0.40 0.00 0.00 0.00 178.15 178.89 3hth h ILE 14 N 0.52 0.00 -1.43 -0.67 1.08 -0.89 -2.46 117.51 113.65 3hth h ILE 14 Ca 0.04 -0.20 0.45 0.00 -0.39 0.00 0.00 64.86 64.77 3hth h ILE 14 Cb 0.93 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 34.57 3hth h ILE 14 CO 0.08 0.00 0.96 0.44 -0.69 0.00 0.00 178.15 178.94 3hth h ASP 15 N -0.84 0.18 0.10 1.72 3.45 -1.21 0.26 116.42 120.08 3hth h ASP 15 Ca -0.07 0.10 -0.01 0.00 0.43 0.00 0.00 57.03 57.49 3hth h ASP 15 Cb 0.49 0.09 0.00 0.00 -0.56 0.00 0.00 39.33 39.35 3hth h ASP 15 CO 0.11 -0.13 -0.05 0.00 -1.57 0.00 0.00 179.24 177.60 3hth h ALA 16 N 1.48 -0.14 -0.78 3.45 0.00 -1.33 -2.91 119.26 119.03 3hth h ALA 16 Ca 0.82 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.63 3hth h ALA 16 Cb 2.76 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 20.53 3hth h ALA 16 CO -0.31 -0.41 0.45 0.00 0.00 0.00 0.00 179.25 178.98 3hth h ALA 17 N 0.37 1.09 -0.25 0.00 0.00 -0.03 0.11 119.26 120.55 3hth h ALA 17 Ca -0.01 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3hth h ALA 17 Cb 0.40 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3hth h ALA 17 CO 0.02 0.11 0.17 0.82 0.00 0.00 0.00 179.25 180.37 3hth h ILE 18 N 0.78 1.06 -0.07 0.00 1.08 -1.43 -1.33 117.51 117.60 3hth h ILE 18 Ca 0.36 -0.11 -0.19 0.00 -0.39 0.00 0.00 64.86 64.53 3hth h ILE 18 Cb 0.28 0.70 0.01 0.00 -3.07 0.00 0.00 36.82 34.75 3hth h ILE 18 CO -0.22 0.06 -0.71 0.03 -0.69 0.00 0.00 178.15 176.62 3hth h ARG 19 N 0.32 0.61 -0.35 2.37 3.08 -0.66 -2.25 114.38 117.50 3hth h ARG 19 Ca 0.09 -0.56 0.03 0.00 0.07 0.00 0.00 59.98 59.61 3hth h ARG 19 Cb -0.02 0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 3hth h ARG 19 CO -0.02 1.18 0.17 0.28 -1.07 0.00 0.00 179.97 180.50 3hth h VAL 20 N 0.24 0.97 -0.23 2.04 2.07 -0.29 -2.68 116.25 118.38 3hth h VAL 20 Ca -0.07 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.29 3hth h VAL 20 Cb 1.37 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 3hth h VAL 20 CO 0.14 0.06 -0.02 0.58 0.02 0.00 0.00 177.57 178.36 3hth h VAL 21 N 0.35 1.27 -0.39 2.57 2.07 -1.35 0.41 116.25 121.18 3hth h VAL 21 Ca 0.15 -0.96 0.11 0.00 0.82 0.00 0.00 66.70 66.83 3hth h VAL 21 Cb 0.07 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 3hth h VAL 21 CO -0.11 0.30 0.47 1.23 0.02 0.00 0.00 177.57 179.47 3hth h GLY 22 N 0.16 0.00 0.00 2.17 0.00 -1.10 0.27 103.07 104.57 3hth h GLY 22 Ca 0.06 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.20 3hth h GLY 22 CO 0.02 0.00 -1.71 -1.06 0.00 0.00 0.00 176.54 173.79 3hth n GLN 23 N -3.60 0.31 -0.10 4.80 6.02 -1.04 -4.72 117.38 119.05 3hth n GLN 23 Ca 0.07 0.08 0.07 0.00 -0.01 0.00 0.00 57.00 57.21 3hth n GLN 23 Cb 0.63 -1.21 0.11 0.00 1.02 0.00 0.00 30.24 30.80 3hth n GLN 23 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3hth n LYS 24 N -2.97 1.77 -1.06 -1.09 5.02 0.14 -5.09 118.16 114.87 3hth n LYS 24 Ca -0.23 -1.69 0.14 0.00 -2.02 0.00 0.00 58.31 54.51 3hth n LYS 24 Cb 0.73 -1.29 -0.04 0.00 -0.02 0.00 0.00 35.03 34.41 3hth n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hth n GLY 25 N 0.74 -1.78 0.33 0.72 0.00 0.94 -2.83 105.19 103.30 3hth n GLY 25 Ca 0.11 -1.25 0.16 0.00 0.00 0.00 0.00 46.02 45.04 3hth n GLY 25 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3hth h ILE 26 N -0.99 0.51 -0.88 -0.61 2.04 -1.90 -1.91 117.51 113.78 3hth h ILE 26 Ca 0.02 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.87 3hth h ILE 26 Cb 0.97 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 37.88 3hth h ILE 26 CO 0.01 0.00 0.54 0.00 0.00 0.00 0.00 178.15 178.70 3hth h ALA 27 N 1.81 1.11 0.00 1.87 0.00 -1.97 -2.65 119.26 119.43 3hth h ALA 27 Ca 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3hth h ALA 27 Cb 0.41 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3hth h ALA 27 CO -0.00 0.56 0.00 0.41 0.00 0.00 0.00 179.25 180.22 3hth n GLY 28 N -1.25 -1.17 3.58 0.00 0.00 -0.72 -4.69 105.19 100.95 3hth n GLY 28 Ca 0.09 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 3hth n GLY 28 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hth s LEU 29 N -2.99 3.48 -0.06 0.99 2.96 -1.00 -4.69 118.68 117.36 3hth s LEU 29 Ca 0.10 0.41 0.23 0.00 -0.22 0.00 0.00 54.13 54.64 3hth s LEU 29 Cb 0.13 -3.24 0.43 0.00 0.50 0.00 0.00 46.19 44.01 3hth s LEU 29 CO 0.36 -1.56 1.18 -0.24 -1.32 0.00 0.00 176.35 174.76 3hth n SER 30 N 9.04 1.25 0.00 3.68 2.88 -1.26 -4.99 113.62 124.22 3hth n SER 30 Ca 0.13 -2.39 0.00 0.00 -1.33 0.00 0.00 58.87 55.27 3hth n SER 30 Cb 0.49 -0.36 0.00 0.00 -0.75 0.00 0.00 64.21 63.59 3hth n SER 30 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 3hth n HIS 31 N 0.09 0.00 -0.05 0.66 8.25 -1.26 -3.92 115.22 119.00 3hth n HIS 31 Ca 0.09 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.56 3hth n HIS 31 Cb 1.03 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 32.01 3hth n HIS 31 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 3hth n ARG 32 N 0.00 0.87 0.03 -0.41 -4.01 -1.26 -3.11 116.66 108.77 3hth n ARG 32 Ca 0.00 -0.09 -0.18 0.00 -1.04 0.00 0.00 57.85 56.54 3hth n ARG 32 Cb 0.00 -1.44 -0.08 0.00 -3.04 0.00 0.00 32.46 27.90 3hth n ARG 32 CO 0.00 0.00 0.00 1.15 -3.04 0.00 0.00 177.63 175.74 3hth h THR 33 N 0.00 1.30 0.58 8.89 2.02 -1.84 -1.21 112.91 122.66 3hth h THR 33 Ca -0.23 -2.21 -0.03 0.00 0.77 0.00 0.00 66.41 64.71 3hth h THR 33 Cb 1.44 2.28 0.01 0.00 -1.74 0.00 0.00 68.15 70.14 3hth h THR 33 CO 0.01 0.68 -0.28 0.58 0.37 0.00 0.00 175.52 176.89 3hth h VAL 34 N 0.40 0.00 -0.95 3.16 2.07 -1.87 0.13 116.25 119.19 3hth h VAL 34 Ca -0.10 -0.38 0.28 0.00 0.82 0.00 0.00 66.70 67.32 3hth h VAL 34 Cb 1.60 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 3hth h VAL 34 CO 0.18 0.00 0.75 0.00 0.02 0.00 0.00 177.57 178.53 3hth h ALA 35 N -1.26 2.85 0.18 1.67 0.00 -1.61 0.57 119.26 121.65 3hth h ALA 35 Ca -0.08 -0.03 -0.31 0.00 0.00 0.00 0.00 54.91 54.48 3hth h ALA 35 Cb 0.60 0.07 0.03 0.00 0.00 0.00 0.00 17.79 18.49 3hth h ALA 35 CO 0.13 -1.24 -1.35 0.00 0.00 0.00 0.00 179.25 176.79 3hth h ALA 36 N 1.39 -0.06 0.00 0.00 0.00 -1.03 -1.46 119.26 118.11 3hth h ALA 36 Ca 0.45 -0.82 -0.13 0.00 0.00 0.00 0.00 54.91 54.41 3hth h ALA 36 Cb 1.95 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.85 3hth h ALA 36 CO -0.00 0.73 -0.62 1.49 0.00 0.00 0.00 179.25 180.85 3hth h GLU 37 N 0.19 0.00 -0.70 0.00 4.57 0.21 -3.03 114.58 115.81 3hth h GLU 37 Ca -0.21 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.97 3hth h GLU 37 Cb 2.03 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.62 3hth h GLU 37 CO 0.25 0.62 0.00 0.00 -1.18 0.00 0.00 179.01 178.70 3hth n ALA 38 N -2.41 2.42 -3.92 2.92 0.00 0.42 -4.94 120.51 115.01 3hth n ALA 38 Ca -0.01 -1.25 -0.37 0.00 0.00 0.00 0.00 53.44 51.81 3hth n ALA 38 Cb 0.62 -0.95 0.02 0.00 0.00 0.00 0.00 19.45 19.14 3hth n ALA 38 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3hth n ASP 39 N 1.54 -4.60 -4.18 0.00 10.43 -1.09 -4.96 116.55 113.68 3hth n ASP 39 Ca 0.24 -1.14 -0.18 0.00 2.57 0.00 0.00 54.79 56.28 3hth n ASP 39 Cb 0.61 -1.98 -0.12 0.00 1.84 0.00 0.00 41.12 41.47 3hth n ASP 39 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3hth s VAL 40 N -3.35 1.12 -0.01 2.53 1.01 -0.57 -5.06 120.40 116.08 3hth s VAL 40 Ca 0.34 -1.42 -0.37 0.00 0.00 0.00 0.00 61.98 60.52 3hth s VAL 40 Cb -0.18 -1.19 -0.16 0.00 0.00 0.00 0.00 36.38 34.86 3hth s VAL 40 CO 0.93 -0.31 1.51 -2.65 0.00 0.00 0.00 175.10 174.58 3hth n PRO 41 N 1.04 1.33 -1.58 2.72 -0.02 -1.26 -4.63 135.00 132.60 3hth n PRO 41 Ca -0.19 0.48 -0.51 0.00 -2.02 0.00 0.00 63.50 61.26 3hth n PRO 41 Cb 0.55 -2.17 -0.05 0.00 -0.02 0.00 0.00 33.50 31.81 3hth n PRO 41 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3hth n LEU 42 N 3.62 1.54 0.00 2.45 7.99 -1.26 0.28 117.00 131.62 3hth n LEU 42 Ca 0.21 1.13 0.00 0.00 -0.01 0.00 0.00 56.01 57.34 3hth n LEU 42 Cb 0.19 -1.20 0.00 0.00 -0.11 0.00 0.00 43.42 42.31 3hth n LEU 42 CO 0.68 -1.19 0.00 0.61 -1.51 0.00 0.00 177.39 175.98 3hth n GLY 43 N 2.26 2.80 0.41 -0.72 0.00 -1.26 -4.78 105.19 103.90 3hth n GLY 43 Ca 0.17 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.40 3hth n GLY 43 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3hth h SER 44 N 0.00 0.00 0.29 1.61 0.87 -0.51 1.16 113.55 116.97 3hth h SER 44 Ca 0.00 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.52 3hth h SER 44 Cb 0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 3hth h SER 44 CO 0.00 0.00 -0.20 0.71 -0.53 0.00 0.00 176.83 176.81 3hth h THR 45 N 0.00 0.97 0.00 2.23 1.35 -1.87 -2.30 112.91 113.29 3hth h THR 45 Ca 0.23 -0.74 -0.03 0.00 -0.55 0.00 0.00 66.41 65.33 3hth h THR 45 Cb 1.34 1.42 -0.00 0.00 -1.73 0.00 0.00 68.15 69.17 3hth h THR 45 CO -0.00 0.20 -0.14 0.74 -0.25 0.00 0.00 175.52 176.07 3hth h THR 46 N 0.00 0.39 -0.25 6.82 2.02 0.13 -1.08 112.91 120.94 3hth h THR 46 Ca -0.00 -0.79 -0.07 0.00 0.77 0.00 0.00 66.41 66.32 3hth h THR 46 Cb 0.40 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 3hth h THR 46 CO 0.03 0.13 -0.16 0.22 0.37 0.00 0.00 175.52 176.11 3hth h TYR 47 N 0.00 0.47 0.04 3.16 3.20 -1.49 -3.28 116.97 119.07 3hth h TYR 47 Ca -0.00 -0.07 -0.38 0.00 3.14 0.00 0.00 58.73 61.42 3hth h TYR 47 Cb 0.56 -0.12 -0.05 0.00 1.54 0.00 0.00 36.73 38.66 3hth h TYR 47 CO 0.00 0.57 -2.30 0.72 -1.64 0.00 0.00 178.16 175.52 3hth n HIS 48 N -4.20 0.46 -3.91 -3.82 8.25 -1.11 -4.84 115.22 106.05 3hth n HIS 48 Ca 0.00 0.10 -0.30 0.00 -0.26 0.00 0.00 57.72 57.26 3hth n HIS 48 Cb 0.33 -1.06 -0.15 0.00 1.12 0.00 0.00 29.99 30.23 3hth n HIS 48 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3hth s PHE 49 N -2.53 2.58 0.00 4.41 0.40 -0.42 -5.02 117.98 117.39 3hth s PHE 49 Ca -0.29 -2.06 -0.03 0.00 -0.60 0.00 0.00 56.93 53.94 3hth s PHE 49 Cb 0.08 -1.95 -0.01 0.00 0.51 0.00 0.00 43.02 41.65 3hth s PHE 49 CO 0.67 -0.84 1.04 0.00 0.70 0.00 0.00 175.22 176.79 3hth h ALA 50 N 7.90 -0.98 -2.18 5.36 0.00 -1.82 -3.34 119.26 124.20 3hth h ALA 50 Ca -0.13 -0.02 -0.47 0.00 0.00 0.00 0.00 54.91 54.29 3hth h ALA 50 Cb 1.05 0.09 0.03 0.00 0.00 0.00 0.00 17.79 18.95 3hth h ALA 50 CO 0.45 -0.97 -0.07 0.95 0.00 0.00 0.00 179.25 179.62 3hth s THR 51 N -3.21 4.48 0.35 0.00 -4.23 -1.26 -4.88 115.64 106.89 3hth s THR 51 Ca -0.01 -0.32 0.04 0.00 -1.18 0.00 0.00 61.69 60.22 3hth s THR 51 Cb 0.00 -3.67 0.19 0.00 1.34 0.00 0.00 72.50 70.36 3hth s THR 51 CO 0.04 -0.51 1.92 0.25 -0.54 0.00 0.00 174.62 175.78 3hth h LEU 52 N 0.43 0.53 -0.89 4.79 5.85 -2.00 -1.72 115.31 122.30 3hth h LEU 52 Ca -0.47 -0.07 0.11 0.00 0.84 0.00 0.00 57.88 58.28 3hth h LEU 52 Cb 1.23 -0.14 -0.08 0.00 0.37 0.00 0.00 40.66 42.05 3hth h LEU 52 CO 0.60 0.53 0.52 0.44 -0.34 0.00 0.00 178.44 180.19 3hth h ASP 53 N 0.57 0.74 -0.58 1.25 3.45 -1.98 0.35 116.42 120.23 3hth h ASP 53 Ca 0.13 0.05 -0.10 0.00 0.43 0.00 0.00 57.03 57.54 3hth h ASP 53 Cb 0.21 -0.09 -0.02 0.00 -0.56 0.00 0.00 39.33 38.87 3hth h ASP 53 CO -0.00 0.41 -0.03 0.44 -1.57 0.00 0.00 179.24 178.48 3hth h ASP 54 N 0.84 1.03 0.60 6.45 3.32 -1.71 -0.64 116.42 126.32 3hth h ASP 54 Ca 0.44 -0.30 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 3hth h ASP 54 Cb 0.43 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3hth h ASP 54 CO -0.26 1.09 -0.44 0.25 -1.72 0.00 0.00 179.24 178.16 3hth h LEU 55 N 0.95 -1.15 -0.88 1.55 6.46 -0.79 -2.29 115.31 119.17 3hth h LEU 55 Ca 0.16 0.08 0.07 0.00 -0.12 0.00 0.00 57.88 58.07 3hth h LEU 55 Cb 0.58 0.36 -0.06 0.00 -0.73 0.00 0.00 40.66 40.80 3hth h LEU 55 CO 0.03 -0.65 0.55 0.24 -0.62 0.00 0.00 178.44 177.99 3hth h MET 56 N -1.01 0.95 -0.49 1.25 2.86 -0.92 -1.37 114.93 116.20 3hth h MET 56 Ca -0.07 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 3hth h MET 56 Cb 0.84 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.26 3hth h MET 56 CO 0.03 0.63 0.25 0.28 1.06 0.00 0.00 176.91 179.16 3hth h VAL 57 N 0.98 1.16 -0.07 -2.22 2.07 -0.94 0.29 116.25 117.53 3hth h VAL 57 Ca 0.39 -0.43 -0.06 0.00 0.82 0.00 0.00 66.70 67.43 3hth h VAL 57 Cb 0.21 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 3hth h VAL 57 CO -0.19 0.18 -0.19 0.00 0.02 0.00 0.00 177.57 177.40 3hth h ALA 58 N 1.60 0.11 -0.64 1.67 0.00 -0.81 -1.81 119.26 119.38 3hth h ALA 58 Ca 0.17 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.74 3hth h ALA 58 Cb 0.05 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 3hth h ALA 58 CO -0.03 0.06 0.38 0.00 0.00 0.00 0.00 179.25 179.66 3hth h ALA 59 N 0.45 0.84 -0.44 0.00 0.00 -0.84 -0.80 119.26 118.47 3hth h ALA 59 Ca -0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 3hth h ALA 59 Cb 0.80 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3hth h ALA 59 CO 0.04 0.11 -0.19 1.25 0.00 0.00 0.00 179.25 180.45 3hth h LEU 60 N 0.74 0.89 -1.31 0.00 5.85 -0.46 -0.77 115.31 120.24 3hth h LEU 60 Ca 0.27 -0.32 -0.07 0.00 0.84 0.00 0.00 57.88 58.60 3hth h LEU 60 Cb 0.08 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 3hth h LEU 60 CO -0.13 1.06 -0.28 -0.09 -0.34 0.00 0.00 178.44 178.66 3hth h ARG 61 N 0.77 0.10 0.20 1.25 2.43 -0.63 0.09 114.38 118.58 3hth h ARG 61 Ca 0.11 -0.03 -0.28 0.00 -0.81 0.00 0.00 59.98 58.96 3hth h ARG 61 Cb 0.73 -0.01 0.03 0.00 -0.42 0.00 0.00 29.97 30.30 3hth h ARG 61 CO 0.06 0.38 -1.28 0.37 -1.51 0.00 0.00 179.97 177.98 3hth h GLN 62 N 0.09 0.41 -0.54 0.20 4.15 -0.96 -3.34 115.11 115.13 3hth h GLN 62 Ca 0.01 -0.71 -0.10 0.00 0.77 0.00 0.00 58.65 58.62 3hth h GLN 62 Cb 0.55 0.26 -0.02 0.00 0.21 0.00 0.00 27.48 28.48 3hth h GLN 62 CO 0.04 1.34 -0.08 0.00 -1.93 0.00 0.00 178.83 178.20 3hth h ALA 63 N 0.10 0.84 0.00 3.38 0.00 -1.03 -2.80 119.26 119.75 3hth h ALA 63 Ca -0.23 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3hth h ALA 63 Cb 1.94 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.53 3hth h ALA 63 CO 0.20 0.66 0.08 0.09 0.00 0.00 0.00 179.25 180.27 3hth n ASN 64 N -4.16 0.34 0.19 0.00 5.03 0.01 -1.68 115.26 115.00 3hth n ASN 64 Ca 0.02 0.62 0.13 0.00 0.87 0.00 0.00 54.58 56.22 3hth n ASN 64 Cb 0.38 -0.65 0.26 0.00 -1.02 0.00 0.00 39.78 38.75 3hth n ASN 64 CO 0.00 0.00 0.00 -0.33 -1.83 0.00 0.00 177.26 175.10 3hth h GLU 65 N 0.00 0.00 -0.41 3.52 4.39 -1.61 -3.33 114.58 117.14 3hth h GLU 65 Ca 0.00 0.00 0.09 0.00 0.34 0.00 0.00 59.36 59.79 3hth h GLU 65 Cb 0.15 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 28.72 3hth h GLU 65 CO 0.00 0.00 -0.18 0.78 -1.16 0.00 0.00 179.01 178.45 3hth h GLY 66 N 4.00 0.13 0.59 -3.84 0.00 -1.51 -1.75 103.07 100.70 3hth h GLY 66 Ca 0.00 0.24 0.13 0.00 0.00 0.00 0.00 47.33 47.70 3hth h GLY 66 CO 0.00 -0.19 0.56 -2.75 0.00 0.00 0.00 176.54 174.16 3hth h PHE 67 N -0.10 0.81 -0.75 5.60 3.04 -1.80 -0.95 116.94 122.79 3hth h PHE 67 Ca 0.20 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 62.13 3hth h PHE 67 Cb 0.41 -0.26 -0.03 0.00 2.56 0.00 0.00 35.95 38.63 3hth h PHE 67 CO -0.43 0.32 0.30 0.00 -2.02 0.00 0.00 178.31 176.48 3hth h ALA 68 N 1.60 1.12 -0.21 2.41 0.00 -1.54 -2.84 119.26 119.80 3hth h ALA 68 Ca 0.43 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 3hth h ALA 68 Cb 0.66 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3hth h ALA 68 CO -0.19 0.63 0.12 0.00 0.00 0.00 0.00 179.25 179.82 3hth h ARG 69 N 1.09 0.29 0.00 0.00 3.08 -1.00 -2.49 114.38 115.35 3hth h ARG 69 Ca 0.25 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.26 3hth h ARG 69 Cb 0.20 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 3hth h ARG 69 CO -0.02 0.25 -0.05 -0.39 -1.07 0.00 0.00 179.97 178.68 3hth h VAL 70 N 0.25 0.46 0.00 2.04 -1.51 -1.26 0.17 116.25 116.40 3hth h VAL 70 Ca 0.08 -0.26 -0.17 0.00 -1.23 0.00 0.00 66.70 65.11 3hth h VAL 70 Cb 0.04 1.18 -0.02 0.00 -2.13 0.00 0.00 31.29 30.35 3hth h VAL 70 CO -0.01 0.05 -0.83 1.62 -1.23 0.00 0.00 177.57 177.17 3hth h VAL 71 N 0.00 1.51 -0.19 7.19 3.04 -1.24 -2.79 116.25 123.78 3hth h VAL 71 Ca -0.00 -2.91 -0.10 0.00 -1.01 0.00 0.00 66.70 62.67 3hth h VAL 71 Cb 0.17 2.60 -0.00 0.00 -2.01 0.00 0.00 31.29 32.05 3hth h VAL 71 CO 0.01 0.81 -0.28 0.00 -1.01 0.00 0.00 177.57 177.09 3hth h ALA 72 N 1.17 0.28 0.00 3.17 0.00 -0.60 -2.98 119.26 120.31 3hth h ALA 72 Ca -0.01 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3hth h ALA 72 Cb 1.54 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.28 3hth h ALA 72 CO 0.11 0.29 0.00 0.00 0.00 0.00 0.00 179.25 179.65 3hth n ALA 73 N -2.48 2.33 -3.55 0.00 0.00 -0.41 -3.76 120.51 112.64 3hth n ALA 73 Ca -0.06 -0.14 -0.28 0.00 0.00 0.00 0.00 53.44 52.97 3hth n ALA 73 Cb 0.46 -1.39 -0.11 0.00 0.00 0.00 0.00 19.45 18.41 3hth n ALA 73 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3hth s HIS 74 N -2.23 1.80 0.53 0.00 3.76 -1.05 -4.95 115.29 113.14 3hth s HIS 74 Ca 0.31 -2.58 0.31 0.00 -0.15 0.00 0.00 55.06 52.95 3hth s HIS 74 Cb 0.17 -1.46 1.77 0.00 1.11 0.00 0.00 32.58 34.17 3hth s HIS 74 CO 0.32 -0.75 2.20 -1.35 -0.85 0.00 0.00 174.74 174.31 3hth h PRO 75 N 5.68 0.00 0.00 8.40 0.11 -1.65 -2.41 132.00 142.13 3hth h PRO 75 Ca 0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.32 3hth h PRO 75 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 3hth h PRO 75 CO 0.47 0.04 0.23 0.00 -0.21 0.00 0.00 178.00 178.53 3hth h ALA 76 N 1.96 1.17 0.00 -0.75 0.00 -1.92 0.33 119.26 120.05 3hth h ALA 76 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hth h ALA 76 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3hth h ALA 76 CO 0.01 -0.17 -1.06 1.28 0.00 0.00 0.00 179.25 179.30 3hth n LEU 77 N -2.25 0.80 0.02 0.00 4.77 -0.91 -3.72 117.00 115.72 3hth n LEU 77 Ca -0.01 0.31 0.12 0.00 -0.03 0.00 0.00 56.01 56.39 3hth n LEU 77 Cb 0.26 -0.06 0.11 0.00 -2.33 0.00 0.00 43.42 41.40 3hth n LEU 77 CO 0.08 -0.18 0.20 -1.20 -1.33 0.00 0.00 177.39 174.96 3hth n SER 78 N -2.65 0.63 -4.57 -1.43 7.64 0.11 -4.83 113.62 108.51 3hth n SER 78 Ca -0.00 -0.21 -0.41 0.00 1.01 0.00 0.00 58.87 59.26 3hth n SER 78 Cb 0.55 0.53 -0.03 0.00 -1.01 0.00 0.00 64.21 64.25 3hth n SER 78 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3hth s ASP 79 N -3.66 5.69 0.63 6.43 3.68 -0.92 -4.86 116.67 123.66 3hth s ASP 79 Ca 0.07 0.64 0.29 0.00 2.13 0.00 0.00 52.55 55.68 3hth s ASP 79 Cb 0.15 -2.53 1.55 0.00 -1.45 0.00 0.00 42.92 40.64 3hth s ASP 79 CO 0.76 -1.99 1.92 -0.65 0.13 0.00 0.00 175.17 175.34 3hth h PRO 80 N 13.29 0.00 -1.88 4.34 0.11 -1.90 -2.13 132.00 143.83 3hth h PRO 80 Ca -0.28 0.00 -0.71 0.00 0.11 0.00 0.00 66.00 65.11 3hth h PRO 80 Cb 1.15 0.00 -0.32 0.00 0.11 0.00 0.00 31.00 31.94 3hth h PRO 80 CO 1.15 0.00 0.46 0.39 -0.21 0.00 0.00 178.00 179.79 3hth n GLU 81 N -3.31 3.13 -3.80 1.05 -0.58 -1.26 -4.96 120.64 110.91 3hth n GLU 81 Ca 0.03 -3.93 -0.12 0.00 -0.42 0.00 0.00 57.16 52.71 3hth n GLU 81 Cb 0.50 -2.27 -0.11 0.00 -0.57 0.00 0.00 31.44 28.99 3hth n GLU 81 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3hth s ALA 82 N -3.91 -0.55 -0.73 0.62 0.00 -0.80 -5.08 121.76 111.30 3hth s ALA 82 Ca 0.50 0.45 -0.25 0.00 0.00 0.00 0.00 51.96 52.66 3hth s ALA 82 Cb 0.41 -0.22 -0.13 0.00 0.00 0.00 0.00 23.12 23.17 3hth s ALA 82 CO -0.32 -0.15 2.41 -3.47 0.00 0.00 0.00 175.76 174.23 3hth n ASP 83 N 2.43 1.77 -0.19 0.00 4.64 -1.26 -4.79 116.55 119.14 3hth n ASP 83 Ca -0.16 -1.19 -0.03 0.00 -1.38 0.00 0.00 54.79 52.02 3hth n ASP 83 Cb 0.57 -1.59 0.07 0.00 -1.04 0.00 0.00 41.12 39.14 3hth n ASP 83 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 3hth h LEU 84 N 21.28 0.41 0.05 -2.67 6.46 -1.91 -1.12 115.31 137.81 3hth h LEU 84 Ca -0.06 0.03 0.01 0.00 -0.12 0.00 0.00 57.88 57.75 3hth h LEU 84 Cb 1.08 -0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 40.92 3hth h LEU 84 CO 1.07 0.28 -0.46 0.28 -0.62 0.00 0.00 178.44 178.99 3hth h SER 85 N 0.55 -1.41 -0.39 1.25 0.02 -1.91 0.60 113.55 112.26 3hth h SER 85 Ca 0.25 0.15 -0.06 0.00 -0.84 0.00 0.00 61.79 61.29 3hth h SER 85 Cb 0.16 0.53 -0.02 0.00 0.14 0.00 0.00 62.40 63.21 3hth h SER 85 CO -0.17 -0.47 0.04 1.23 -1.14 0.00 0.00 176.83 176.32 3hth h GLY 86 N -0.61 0.80 0.91 -3.77 0.00 -1.86 0.22 103.07 98.77 3hth h GLY 86 Ca 0.00 -0.50 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 3hth h GLY 86 CO -0.28 0.47 0.09 -2.09 0.00 0.00 0.00 176.54 174.73 3hth h GLU 87 N 0.71 0.53 -0.09 4.80 4.57 -0.79 -2.12 114.58 122.18 3hth h GLU 87 Ca 0.15 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 3hth h GLU 87 Cb 0.38 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.89 3hth h GLU 87 CO 0.01 0.57 0.02 -0.07 -1.18 0.00 0.00 179.01 178.36 3hth h LEU 88 N 0.38 0.15 -1.96 1.64 3.38 0.54 -2.38 115.31 117.06 3hth h LEU 88 Ca 0.11 -0.24 0.18 0.00 0.09 0.00 0.00 57.88 58.01 3hth h LEU 88 Cb 0.27 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 3hth h LEU 88 CO -0.00 0.35 0.54 0.00 0.09 0.00 0.00 178.44 179.42 3hth h ALA 89 N 0.80 2.47 0.14 1.53 0.00 -0.46 -1.15 119.26 122.60 3hth h ALA 89 Ca 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3hth h ALA 89 Cb 0.27 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3hth h ALA 89 CO 0.00 -0.86 -0.07 0.00 0.00 0.00 0.00 179.25 178.32 3hth h ARG 90 N 0.00 -0.19 -0.47 0.00 2.47 -0.95 -2.59 114.38 112.66 3hth h ARG 90 Ca 0.30 0.01 0.14 0.00 -1.26 0.00 0.00 59.98 59.17 3hth h ARG 90 Cb 1.37 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 29.71 3hth h ARG 90 CO -0.00 -0.03 0.43 0.28 0.56 0.00 0.00 179.97 181.21 3hth h VAL 91 N -1.03 0.49 0.02 2.04 2.07 -0.95 0.99 116.25 119.88 3hth h VAL 91 Ca -0.02 0.00 -0.25 0.00 0.82 0.00 0.00 66.70 67.25 3hth h VAL 91 Cb 0.25 0.68 0.01 0.00 -1.52 0.00 0.00 31.29 30.70 3hth h VAL 91 CO 0.03 0.00 -1.01 0.25 0.02 0.00 0.00 177.57 176.86 3hth h LEU 92 N 0.00 0.67 -0.85 2.57 5.85 -1.28 -2.74 115.31 119.54 3hth h LEU 92 Ca 0.22 -0.55 -0.09 0.00 0.84 0.00 0.00 57.88 58.30 3hth h LEU 92 Cb 1.07 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.88 3hth h LEU 92 CO -0.00 1.36 -0.44 1.23 -0.34 0.00 0.00 178.44 180.25 3hth h GLY 93 N 0.92 0.00 0.72 3.75 0.00 -0.43 -1.54 103.07 106.49 3hth h GLY 93 Ca -0.11 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.17 3hth h GLY 93 CO 0.18 0.00 -0.12 0.83 0.00 0.00 0.00 176.54 177.43 3hth h GLU 94 N 0.00 0.32 -0.37 4.80 5.08 -1.28 -1.69 114.58 121.44 3hth h GLU 94 Ca -0.00 -0.16 -0.10 0.00 -1.00 0.00 0.00 59.36 58.10 3hth h GLU 94 Cb 0.97 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.20 3hth h GLU 94 CO 0.06 0.70 -0.17 2.35 -1.00 0.00 0.00 179.01 180.95 3hth h TRP 95 N -0.06 0.76 -0.01 4.33 7.01 -1.35 -3.05 115.95 123.58 3hth h TRP 95 Ca 0.02 -0.15 0.00 0.00 2.11 0.00 0.00 58.89 60.87 3hth h TRP 95 Cb 0.64 -0.19 0.00 0.00 -2.10 0.00 0.00 29.16 27.51 3hth h TRP 95 CO 0.08 0.81 -0.04 1.28 -2.79 0.00 0.00 178.44 177.79 3hth n LEU 96 N -4.14 1.37 -0.00 0.65 4.77 -0.59 -4.17 117.00 114.88 3hth n LEU 96 Ca 0.01 -0.44 0.07 0.00 -0.03 0.00 0.00 56.01 55.62 3hth n LEU 96 Cb 0.39 -0.02 -0.11 0.00 -2.33 0.00 0.00 43.42 41.35 3hth n LEU 96 CO 0.43 0.23 -0.47 0.61 -1.33 0.00 0.00 177.39 176.86 3hth n GLY 97 N 1.20 -0.59 3.03 -0.72 0.00 -0.64 -4.89 105.19 102.58 3hth n GLY 97 Ca 0.18 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 3hth n GLY 97 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hth s GLY 98 N -3.31 2.06 0.02 -0.02 0.00 -1.20 -4.96 107.32 99.91 3hth s GLY 98 Ca -0.02 -2.70 0.00 0.00 0.00 0.00 0.00 44.72 42.00 3hth s GLY 98 CO 0.62 0.98 0.00 1.34 0.00 0.00 0.00 173.10 176.04 3hth n ASP 99 N 4.10 -8.90 0.00 1.64 -0.08 -1.26 -4.87 116.55 107.18 3hth n ASP 99 Ca 0.03 1.82 0.14 0.00 -1.51 0.00 0.00 54.79 55.27 3hth n ASP 99 Cb 0.40 -4.97 0.74 0.00 2.34 0.00 0.00 41.12 39.64 3hth n ASP 99 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 3hth n ARG 100 N 1.87 0.46 0.12 -0.67 5.12 -1.26 -3.87 116.66 118.43 3hth n ARG 100 Ca 0.00 0.01 0.04 0.00 -1.93 0.00 0.00 57.85 55.97 3hth n ARG 100 Cb 0.00 -1.50 0.45 0.00 -1.16 0.00 0.00 32.46 30.25 3hth n ARG 100 CO 0.00 0.00 0.00 1.15 -1.93 0.00 0.00 177.63 176.85 3hth h THR 101 N 0.00 1.12 0.04 0.55 2.02 -1.93 1.07 112.91 115.78 3hth h THR 101 Ca 0.00 -0.47 -0.00 0.00 0.77 0.00 0.00 66.41 66.71 3hth h THR 101 Cb 0.25 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 3hth h THR 101 CO 0.00 0.16 -0.02 1.23 0.37 0.00 0.00 175.52 177.25 3hth h GLY 102 N 0.53 -0.06 0.72 2.16 0.00 -1.91 -2.29 103.07 102.22 3hth h GLY 102 Ca 0.06 0.02 0.06 0.00 0.00 0.00 0.00 47.33 47.48 3hth h GLY 102 CO 0.00 -0.02 0.55 -2.08 0.00 0.00 0.00 176.54 174.99 3hth h VAL 103 N -0.72 1.05 0.14 4.60 2.07 -1.61 -2.31 116.25 119.47 3hth h VAL 103 Ca -0.01 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 3hth h VAL 103 Cb 0.62 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 3hth h VAL 103 CO 0.01 0.18 -0.07 -0.33 0.02 0.00 0.00 177.57 177.38 3hth h GLU 104 N 1.00 -0.18 -0.66 1.57 5.08 0.11 -2.48 114.58 119.02 3hth h GLU 104 Ca 0.39 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.76 3hth h GLU 104 Cb 0.18 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 3hth h GLU 104 CO -0.18 0.23 0.40 1.37 -1.00 0.00 0.00 179.01 179.83 3hth h LEU 105 N -0.66 0.78 -0.27 1.33 8.10 -1.37 0.17 115.31 123.39 3hth h LEU 105 Ca -0.02 -0.04 -0.06 0.00 0.11 0.00 0.00 57.88 57.87 3hth h LEU 105 Cb 0.49 -0.20 -0.01 0.00 -0.44 0.00 0.00 40.66 40.51 3hth h LEU 105 CO 0.03 0.60 -0.08 -0.08 -4.11 0.00 0.00 178.44 174.80 3hth h GLU 106 N 0.91 0.53 -0.25 0.17 4.81 -1.47 -2.61 114.58 116.66 3hth h GLU 106 Ca 0.24 -0.21 -0.02 0.00 -0.13 0.00 0.00 59.36 59.24 3hth h GLU 106 Cb -0.04 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 3hth h GLU 106 CO -0.05 0.75 0.09 1.88 -0.73 0.00 0.00 179.01 180.96 3hth h TYR 107 N 0.28 0.39 -0.61 0.92 -1.99 -0.92 -1.57 116.97 113.47 3hth h TYR 107 Ca 0.07 -0.03 0.09 0.00 2.00 0.00 0.00 58.73 60.86 3hth h TYR 107 Cb 0.57 -0.12 -0.07 0.00 2.00 0.00 0.00 36.73 39.11 3hth h TYR 107 CO 0.05 0.42 0.23 1.49 -0.00 0.00 0.00 178.16 180.36 3hth h GLU 108 N 0.25 0.40 -0.34 4.88 4.81 -0.68 0.53 114.58 124.44 3hth h GLU 108 Ca 0.08 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 3hth h GLU 108 Cb 0.21 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 3hth h GLU 108 CO -0.00 0.27 0.13 -0.07 -0.73 0.00 0.00 179.01 178.60 3hth h LEU 109 N 0.42 0.47 0.01 1.64 3.38 -1.27 -1.09 115.31 118.87 3hth h LEU 109 Ca 0.31 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 3hth h LEU 109 Cb 0.38 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.01 3hth h LEU 109 CO -0.31 0.51 -0.01 0.22 0.09 0.00 0.00 178.44 178.95 3hth h TYR 110 N 0.40 -0.02 0.00 1.13 3.20 -0.24 -2.49 116.97 118.95 3hth h TYR 110 Ca 0.11 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.98 3hth h TYR 110 Cb 0.19 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.47 3hth h TYR 110 CO -0.00 0.12 0.00 1.28 -1.64 0.00 0.00 178.16 177.92 3hth n LEU 111 N -5.03 0.67 0.26 2.82 4.77 0.18 -1.70 117.00 118.97 3hth n LEU 111 Ca -0.08 0.71 0.13 0.00 -0.03 0.00 0.00 56.01 56.74 3hth n LEU 111 Cb 0.10 -0.67 0.69 0.00 -2.33 0.00 0.00 43.42 41.21 3hth n LEU 111 CO 0.33 -0.71 0.95 0.00 -1.33 0.00 0.00 177.39 176.63 3hth h ALA 112 N 2.17 1.20 -0.79 -1.18 0.00 -0.71 -1.65 119.26 118.30 3hth h ALA 112 Ca 0.00 -0.12 0.18 0.00 0.00 0.00 0.00 54.91 54.98 3hth h ALA 112 Cb 0.25 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 3hth h ALA 112 CO 0.00 0.16 0.54 0.00 0.00 0.00 0.00 179.25 179.95 3hth h ALA 113 N 1.87 2.32 -0.65 0.00 0.00 -1.41 -2.82 119.26 118.56 3hth h ALA 113 Ca -0.00 -0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.08 3hth h ALA 113 Cb 0.41 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 18.07 3hth h ALA 113 CO 0.02 -0.55 -0.02 -0.11 0.00 0.00 0.00 179.25 178.59 3hth n LEU 114 N -4.44 -0.11 -0.03 0.00 7.94 -0.62 -1.53 117.00 118.20 3hth n LEU 114 Ca 0.16 1.11 0.01 0.00 -1.11 0.00 0.00 56.01 56.18 3hth n LEU 114 Cb 0.66 -0.39 0.01 0.00 0.53 0.00 0.00 43.42 44.24 3hth n LEU 114 CO 0.34 -1.11 0.42 0.54 -1.11 0.00 0.00 177.39 176.46 3hth n ARG 115 N -4.90 1.74 -3.81 1.96 1.74 -1.07 -4.88 116.66 107.44 3hth n ARG 115 Ca 0.14 -1.26 -0.28 0.00 -0.77 0.00 0.00 57.85 55.68 3hth n ARG 115 Cb 0.47 -0.86 -0.12 0.00 -1.02 0.00 0.00 32.46 30.92 3hth n ARG 115 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3hth s ARG 116 N -0.81 1.99 0.35 5.56 0.52 -0.58 -4.97 118.95 121.01 3hth s ARG 116 Ca 0.03 -2.84 0.29 0.00 -0.52 0.00 0.00 55.73 52.68 3hth s ARG 116 Cb 0.03 -2.97 1.16 0.00 0.52 0.00 0.00 34.95 33.69 3hth s ARG 116 CO 0.00 -1.25 1.15 -2.30 0.02 0.00 0.00 175.30 172.92 3hth n PRO 117 N 2.54 -0.02 -0.10 3.54 -0.02 -1.26 -0.56 135.00 139.12 3hth n PRO 117 Ca 0.17 0.88 -0.09 0.00 -2.02 0.00 0.00 63.50 62.43 3hth n PRO 117 Cb 0.36 -1.83 -0.04 0.00 -0.02 0.00 0.00 33.50 31.98 3hth n PRO 117 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hth h ALA 118 N 1.02 -0.35 0.00 3.55 0.00 -1.93 -1.57 119.26 119.98 3hth h ALA 118 Ca 0.66 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.64 3hth h ALA 118 Cb 2.34 0.80 0.00 0.00 0.00 0.00 0.00 17.79 20.92 3hth h ALA 118 CO -0.23 -0.82 0.00 -0.07 0.00 0.00 0.00 179.25 178.14 3hth h LEU 119 N -0.32 0.00 -0.13 0.00 3.38 -1.16 -3.33 115.31 113.75 3hth h LEU 119 Ca 0.14 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.16 3hth h LEU 119 Cb 0.57 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.26 3hth h LEU 119 CO -0.53 0.00 -0.39 0.03 0.09 0.00 0.00 178.44 177.64 3hth h ARG 120 N 0.00 -0.45 -0.84 1.13 2.47 -1.38 -0.27 114.38 115.04 3hth h ARG 120 Ca 0.00 0.03 0.14 0.00 -1.26 0.00 0.00 59.98 58.89 3hth h ARG 120 Cb 0.27 0.10 -0.09 0.00 -1.65 0.00 0.00 29.97 28.60 3hth h ARG 120 CO 0.00 -0.30 0.43 -1.00 0.56 0.00 0.00 179.97 179.65 3hth h PRO 121 N -0.47 0.59 0.14 0.04 0.13 -1.74 0.43 132.00 131.12 3hth h PRO 121 Ca 0.08 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.17 3hth h PRO 121 Cb 0.61 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.61 3hth h PRO 121 CO -0.38 0.39 -0.07 0.28 -0.23 0.00 0.00 178.00 177.99 3hth h VAL 122 N 0.61 0.92 -0.29 1.56 2.07 -1.58 0.11 116.25 119.66 3hth h VAL 122 Ca 0.46 -0.23 0.08 0.00 0.82 0.00 0.00 66.70 67.83 3hth h VAL 122 Cb 0.64 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 3hth h VAL 122 CO -0.36 0.06 0.22 0.00 0.02 0.00 0.00 177.57 177.51 3hth h ALA 123 N 0.56 2.19 0.02 1.67 0.00 -0.32 -1.07 119.26 122.31 3hth h ALA 123 Ca -0.02 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.64 3hth h ALA 123 Cb 0.23 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3hth h ALA 123 CO 0.03 -0.37 -1.24 0.00 0.00 0.00 0.00 179.25 177.67 3hth h ALA 124 N 1.83 0.44 0.46 0.00 0.00 -0.37 -3.12 119.26 118.49 3hth h ALA 124 Ca 0.14 -1.07 -0.02 0.00 0.00 0.00 0.00 54.91 53.96 3hth h ALA 124 Cb 0.58 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3hth h ALA 124 CO -0.00 1.31 -0.33 0.93 0.00 0.00 0.00 179.25 181.16 3hth h GLU 125 N 0.01 -0.72 -0.52 0.00 5.08 0.53 -2.09 114.58 116.87 3hth h GLU 125 Ca -0.11 0.05 0.15 0.00 -1.00 0.00 0.00 59.36 58.45 3hth h GLU 125 Cb 1.87 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 31.26 3hth h GLU 125 CO 0.12 -0.48 0.42 2.35 -1.00 0.00 0.00 179.01 180.42 3hth h TRP 126 N -0.75 0.00 -0.46 4.33 7.01 -1.63 -0.79 115.95 123.65 3hth h TRP 126 Ca -0.06 0.00 -0.09 0.00 2.11 0.00 0.00 58.89 60.85 3hth h TRP 126 Cb 0.62 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.66 3hth h TRP 126 CO -0.08 0.00 -0.08 0.00 -2.79 0.00 0.00 178.44 175.48 3hth h ALA 127 N 1.64 0.98 0.03 2.65 0.00 -1.32 -2.33 119.26 120.92 3hth h ALA 127 Ca 0.25 -0.31 -0.29 0.00 0.00 0.00 0.00 54.91 54.56 3hth h ALA 127 Cb 1.09 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 3hth h ALA 127 CO -0.00 0.61 -1.61 1.49 0.00 0.00 0.00 179.25 179.74 3hth h GLU 128 N 0.75 0.06 0.10 0.00 4.81 -0.88 -2.95 114.58 116.46 3hth h GLU 128 Ca 0.13 -0.09 0.01 0.00 -0.13 0.00 0.00 59.36 59.27 3hth h GLU 128 Cb 0.57 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.95 3hth h GLU 128 CO 0.04 0.71 -0.38 0.78 -0.73 0.00 0.00 179.01 179.42 3hth h GLY 129 N 2.98 -1.18 0.93 1.92 0.00 -1.14 0.54 103.07 107.12 3hth h GLY 129 Ca -0.25 0.61 0.13 0.00 0.00 0.00 0.00 47.33 47.82 3hth h GLY 129 CO 0.10 -0.32 0.41 -2.08 0.00 0.00 0.00 176.54 174.65 3hth h VAL 130 N -0.55 0.81 0.00 4.60 2.07 -1.57 0.50 116.25 122.11 3hth h VAL 130 Ca -0.01 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.43 3hth h VAL 130 Cb 0.55 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3hth h VAL 130 CO -0.20 0.05 0.00 0.61 0.02 0.00 0.00 177.57 178.04 3hth n GLY 131 N -1.56 -2.48 0.32 2.17 0.00 0.23 -3.41 105.19 100.46 3hth n GLY 131 Ca 0.11 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.28 3hth n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hth h ALA 132 N -2.00 1.53 0.00 4.61 0.00 0.10 1.28 119.26 124.78 3hth h ALA 132 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3hth h ALA 132 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3hth h ALA 132 CO 0.00 -0.38 0.02 -0.11 0.00 0.00 0.00 179.25 178.79 3hth n LEU 133 N -5.05 0.00 -0.66 0.00 7.94 0.17 -1.33 117.00 118.08 3hth n LEU 133 Ca 0.24 0.06 -0.03 0.00 -1.11 0.00 0.00 56.01 55.17 3hth n LEU 133 Cb 0.71 -0.06 -0.03 0.00 0.53 0.00 0.00 43.42 44.57 3hth n LEU 133 CO 0.12 -0.06 0.17 0.00 -1.11 0.00 0.00 177.39 176.50 3hth n LEU 134 N -0.95 -0.41 -0.08 -1.96 -0.00 0.75 -4.93 117.00 109.43 3hth n LEU 134 Ca 0.00 -0.90 -0.15 0.00 -0.00 0.00 0.00 56.01 54.95 3hth n LEU 134 Cb 0.02 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.38 3hth n LEU 134 CO 0.00 0.95 -1.04 0.00 -0.00 0.00 0.00 177.39 177.31 3hth n ALA 135 N 0.00 1.89 0.32 1.47 0.00 0.41 -4.38 120.51 120.22 3hth n ALA 135 Ca -0.11 -0.64 0.05 0.00 0.00 0.00 0.00 53.44 52.74 3hth n ALA 135 Cb 0.43 0.26 0.26 0.00 0.00 0.00 0.00 19.45 20.40 3hth n ALA 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hth h ALA 136 N -0.43 1.75 0.00 0.00 0.00 -1.73 0.30 119.26 119.15 3hth h ALA 136 Ca -0.39 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.41 3hth h ALA 136 Cb 1.40 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.15 3hth h ALA 136 CO -0.20 -0.75 -0.08 0.54 0.00 0.00 0.00 179.25 178.76 3hth n ARG 137 N -2.57 1.26 -1.12 0.00 1.74 -1.26 -4.84 116.66 109.88 3hth n ARG 137 Ca -0.01 -0.60 0.10 0.00 -0.77 0.00 0.00 57.85 56.57 3hth n ARG 137 Cb 0.78 -1.77 -0.05 0.00 -1.02 0.00 0.00 32.46 30.39 3hth n ARG 137 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 3hth n THR 138 N 2.58 -0.71 -1.43 0.55 5.66 0.09 -5.05 114.28 115.97 3hth n THR 138 Ca 0.26 0.63 -0.00 0.00 -3.05 0.00 0.00 64.05 61.88 3hth n THR 138 Cb 0.58 -0.96 -0.00 0.00 -1.55 0.00 0.00 70.33 68.41 3hth n THR 138 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 3hth n ASP 139 N -3.72 -3.41 -0.05 1.09 -0.08 -1.26 -4.78 116.55 104.34 3hth n ASP 139 Ca -0.05 0.44 -0.12 0.00 -1.51 0.00 0.00 54.79 53.54 3hth n ASP 139 Cb 0.41 -2.06 -0.06 0.00 2.34 0.00 0.00 41.12 41.75 3hth n ASP 139 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3hth h PRO 140 N 1.06 0.31 0.10 -0.67 0.11 -1.97 -3.04 132.00 127.90 3hth h PRO 140 Ca -0.03 -0.13 0.00 0.00 0.11 0.00 0.00 66.00 65.95 3hth h PRO 140 Cb 0.07 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 3hth h PRO 140 CO 0.00 0.61 -0.19 1.15 -0.21 0.00 0.00 178.00 179.37 3hth h THR 141 N -0.01 0.00 -1.56 -1.15 2.02 -1.98 -1.29 112.91 108.93 3hth h THR 141 Ca 0.04 0.00 0.46 0.00 0.77 0.00 0.00 66.41 67.68 3hth h THR 141 Cb 0.51 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.84 3hth h THR 141 CO 0.02 0.00 1.10 0.74 0.37 0.00 0.00 175.52 177.75 3hth h THR 142 N -0.31 0.17 0.44 3.16 2.02 -1.90 0.94 112.91 117.43 3hth h THR 142 Ca -0.01 -0.01 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 3hth h THR 142 Cb 0.29 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.83 3hth h THR 142 CO -0.07 0.01 -0.21 0.00 0.37 0.00 0.00 175.52 175.61 3hth h ALA 143 N 1.28 -0.60 0.00 6.16 0.00 -1.12 -1.34 119.26 123.65 3hth h ALA 143 Ca 0.79 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 55.42 3hth h ALA 143 Cb 2.98 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 20.98 3hth h ALA 143 CO -0.12 -0.79 -0.61 0.07 0.00 0.00 0.00 179.25 177.80 3hth h ARG 144 N -0.68 0.00 0.00 0.00 0.11 -0.57 -3.07 114.38 110.18 3hth h ARG 144 Ca -0.06 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.99 3hth h ARG 144 Cb 0.50 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.58 3hth h ARG 144 CO 0.10 0.61 -0.14 0.00 0.10 0.00 0.00 179.97 180.64 3hth h ALA 145 N 1.39 0.99 -0.37 0.08 0.00 -1.22 -3.09 119.26 117.04 3hth h ALA 145 Ca -0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 3hth h ALA 145 Cb 1.35 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 3hth h ALA 145 CO 0.08 0.18 0.14 1.25 0.00 0.00 0.00 179.25 180.89 3hth h LEU 146 N 0.00 0.52 -0.10 0.00 7.12 -1.14 -0.50 115.31 121.22 3hth h LEU 146 Ca -0.00 -0.18 -0.00 0.00 0.13 0.00 0.00 57.88 57.83 3hth h LEU 146 Cb 0.74 -0.13 -0.00 0.00 -0.53 0.00 0.00 40.66 40.73 3hth h LEU 146 CO 0.02 0.55 0.04 0.58 -0.13 0.00 0.00 178.44 179.51 3hth h VAL 147 N 0.45 1.13 -0.59 1.05 2.07 -1.64 -1.91 116.25 116.79 3hth h VAL 147 Ca 0.12 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.27 3hth h VAL 147 Cb 0.21 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 3hth h VAL 147 CO -0.01 0.11 0.38 0.00 0.02 0.00 0.00 177.57 178.07 3hth h ALA 148 N 0.91 0.75 -0.09 1.67 0.00 -1.50 -1.53 119.26 119.47 3hth h ALA 148 Ca 0.03 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3hth h ALA 148 Cb 0.14 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3hth h ALA 148 CO -0.00 0.21 -0.20 0.28 0.00 0.00 0.00 179.25 179.54 3hth h VAL 149 N 0.80 1.19 0.17 0.00 2.07 -1.00 -1.21 116.25 118.28 3hth h VAL 149 Ca 0.22 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 3hth h VAL 149 Cb -0.06 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 3hth h VAL 149 CO -0.04 0.26 -0.08 -0.07 0.02 0.00 0.00 177.57 177.65 3hth h LEU 150 N 0.13 -0.20 -0.39 2.57 4.07 -0.87 -0.30 115.31 120.33 3hth h LEU 150 Ca 0.02 -0.28 0.08 0.00 0.08 0.00 0.00 57.88 57.79 3hth h LEU 150 Cb 0.43 0.05 -0.07 0.00 1.08 0.00 0.00 40.66 42.15 3hth h LEU 150 CO 0.03 0.20 -0.10 0.44 -1.08 0.00 0.00 178.44 177.93 3hth h ASP 151 N -0.63 -0.36 0.21 -0.43 3.45 -1.12 0.73 116.42 118.27 3hth h ASP 151 Ca -0.02 0.12 -0.00 0.00 0.43 0.00 0.00 57.03 57.55 3hth h ASP 151 Cb 0.46 0.24 -0.01 0.00 -0.56 0.00 0.00 39.33 39.47 3hth h ASP 151 CO 0.04 -0.13 -0.15 1.23 -1.57 0.00 0.00 179.24 178.66 3hth h GLY 152 N 0.00 -0.36 0.60 2.75 0.00 -1.19 0.14 103.07 105.00 3hth h GLY 152 Ca 0.19 0.17 0.13 0.00 0.00 0.00 0.00 47.33 47.81 3hth h GLY 152 CO -0.40 -0.15 0.57 -2.22 0.00 0.00 0.00 176.54 174.33 3hth h ILE 153 N -0.36 0.88 0.44 2.60 2.04 -0.54 -0.63 117.51 121.95 3hth h ILE 153 Ca -0.02 -0.26 -0.02 0.00 1.00 0.00 0.00 64.86 65.56 3hth h ILE 153 Cb 0.31 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.45 3hth h ILE 153 CO 0.00 0.14 -0.21 0.00 0.00 0.00 0.00 178.15 178.08 3hth h LEU 155 N -1.13 0.00 -1.99 0.00 3.38 -0.64 0.32 115.31 115.25 3hth h LEU 155 Ca -0.06 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3hth h LEU 155 Cb 0.46 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 3hth h LEU 155 CO 0.10 0.00 -0.09 -0.61 0.09 0.00 0.00 178.44 177.93 3hth h GLN 156 N 0.00 0.00 0.00 1.13 4.15 -1.15 0.22 115.11 119.46 3hth h GLN 156 Ca 0.19 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.61 3hth h GLN 156 Cb 0.79 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.48 3hth h GLN 156 CO -0.00 0.09 -0.33 0.28 -1.93 0.00 0.00 178.83 176.94 3hth h VAL 157 N 0.00 0.00 -0.67 2.39 2.07 -0.49 -3.32 116.25 116.23 3hth h VAL 157 Ca -0.00 -0.84 0.16 0.00 0.82 0.00 0.00 66.70 66.84 3hth h VAL 157 Cb 0.19 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 29.93 3hth h VAL 157 CO 0.01 0.00 0.46 -0.07 0.02 0.00 0.00 177.57 177.99 3hth h LEU 158 N -0.84 0.18 0.01 2.57 3.38 -0.84 -1.86 115.31 117.91 3hth h LEU 158 Ca 0.00 0.01 -0.31 0.00 0.09 0.00 0.00 57.88 57.67 3hth h LEU 158 Cb 0.33 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 3hth h LEU 158 CO 0.00 0.09 -1.87 0.18 0.09 0.00 0.00 178.44 176.94 3hth n LEU 159 N -4.42 0.82 0.00 1.67 4.32 0.75 -4.32 117.00 115.82 3hth n LEU 159 Ca 0.13 0.32 0.11 0.00 -0.02 0.00 0.00 56.01 56.54 3hth n LEU 159 Cb 0.60 0.16 0.01 0.00 -1.62 0.00 0.00 43.42 42.58 3hth n LEU 159 CO 0.35 0.44 0.11 0.35 -1.22 0.00 0.00 177.39 177.42 3hth n THR 160 N -3.01 0.01 -3.24 -5.08 -2.24 -1.18 -4.98 114.28 94.56 3hth n THR 160 Ca -0.21 -0.03 -0.15 0.00 -2.27 0.00 0.00 64.05 61.39 3hth n THR 160 Cb 1.07 0.67 0.08 0.00 -2.10 0.00 0.00 70.33 70.05 3hth n THR 160 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3hth n ASP 161 N -1.55 -2.10 -4.07 3.42 4.64 -0.71 -5.02 116.55 111.17 3hth n ASP 161 Ca 0.04 -0.54 -0.25 0.00 -1.38 0.00 0.00 54.79 52.66 3hth n ASP 161 Cb 0.34 -4.51 -0.16 0.00 -1.04 0.00 0.00 41.12 35.75 3hth n ASP 161 CO 0.00 0.00 0.00 0.42 -0.82 0.00 0.00 177.20 176.80 3hth s THR 162 N -3.31 1.25 0.52 5.18 -4.23 -1.23 -5.10 115.64 108.72 3hth s THR 162 Ca 0.01 -0.57 -0.18 0.00 -1.18 0.00 0.00 61.69 59.76 3hth s THR 162 Cb -0.00 -1.11 -0.12 0.00 1.34 0.00 0.00 72.50 72.60 3hth s THR 162 CO 0.63 0.38 0.15 -2.65 -0.54 0.00 0.00 174.62 172.59 3hth n PRO 163 N 3.55 0.21 -2.45 3.99 -0.02 -1.26 -4.55 135.00 134.46 3hth n PRO 163 Ca -0.21 0.08 -0.42 0.00 -2.02 0.00 0.00 63.50 60.94 3hth n PRO 163 Cb 0.52 -1.28 -0.03 0.00 -0.02 0.00 0.00 33.50 32.70 3hth n PRO 163 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3hth s TYR 164 N -1.87 2.38 -0.67 6.00 5.04 -1.26 -4.95 117.35 122.02 3hth s TYR 164 Ca 0.62 0.44 -0.25 0.00 -2.44 0.00 0.00 57.07 55.43 3hth s TYR 164 Cb -0.48 -4.44 0.05 0.00 0.35 0.00 0.00 41.96 37.43 3hth s TYR 164 CO 0.61 -1.87 1.11 0.34 -1.34 0.00 0.00 175.55 174.41 3hth s ASP 165 N 3.95 6.22 0.09 4.32 -1.08 -1.26 -4.93 116.67 123.98 3hth s ASP 165 Ca 0.49 -0.58 -0.24 0.00 -0.52 0.00 0.00 52.55 51.71 3hth s ASP 165 Cb -0.10 -2.49 -0.14 0.00 -1.46 0.00 0.00 42.92 38.73 3hth s ASP 165 CO 0.25 -1.58 1.73 -0.08 0.52 0.00 0.00 175.17 176.01 3hth h GLU 166 N 9.72 -0.08 0.00 4.34 4.81 -1.93 -0.60 114.58 130.84 3hth h GLU 166 Ca -0.28 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 58.94 3hth h GLU 166 Cb 1.06 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.46 3hth h GLU 166 CO 1.21 -0.05 -0.11 0.93 -0.73 0.00 0.00 179.01 180.26 3hth h GLU 167 N -0.08 0.00 -0.11 1.92 4.39 -1.95 0.14 114.58 118.88 3hth h GLU 167 Ca -0.00 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 3hth h GLU 167 Cb 0.08 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 3hth h GLU 167 CO -0.00 0.11 -0.12 -0.92 -1.16 0.00 0.00 179.01 176.91 3hth h TYR 168 N 0.00 0.34 -0.37 4.33 3.20 -1.87 -0.56 116.97 122.03 3hth h TYR 168 Ca -0.00 -0.10 0.02 0.00 3.14 0.00 0.00 58.73 61.79 3hth h TYR 168 Cb 0.22 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.39 3hth h TYR 168 CO 0.00 0.70 0.20 0.00 -1.64 0.00 0.00 178.16 177.42 3hth h ALA 169 N 0.58 0.46 -0.55 1.82 0.00 -0.13 -1.00 119.26 120.45 3hth h ALA 169 Ca 0.02 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.99 3hth h ALA 169 Cb 0.65 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 3hth h ALA 169 CO 0.03 -0.16 0.27 -0.09 0.00 0.00 0.00 179.25 179.30 3hth h ARG 170 N 0.41 0.50 0.26 0.00 2.43 -0.70 0.17 114.38 117.44 3hth h ARG 170 Ca 0.15 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 3hth h ARG 170 Cb 0.04 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 3hth h ARG 170 CO -0.09 0.33 -0.26 1.49 -1.51 0.00 0.00 179.97 179.92 3hth h GLU 171 N 0.51 -0.53 -0.26 0.20 4.22 -0.40 0.46 114.58 118.78 3hth h GLU 171 Ca 0.25 0.04 0.05 0.00 0.08 0.00 0.00 59.36 59.77 3hth h GLU 171 Cb 0.18 0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.51 3hth h GLU 171 CO -0.19 -0.35 -0.04 0.28 -2.18 0.00 0.00 179.01 176.53 3hth h VAL 172 N -0.55 0.76 -0.29 0.32 2.07 -0.79 0.28 116.25 118.06 3hth h VAL 172 Ca -0.01 -0.01 0.01 0.00 0.82 0.00 0.00 66.70 67.52 3hth h VAL 172 Cb 0.51 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 3hth h VAL 172 CO -0.06 0.00 0.17 -0.07 0.02 0.00 0.00 177.57 177.64 3hth h LEU 173 N 0.03 0.27 -1.28 2.57 3.38 -0.32 -1.89 115.31 118.07 3hth h LEU 173 Ca 0.12 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.15 3hth h LEU 173 Cb 0.18 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 3hth h LEU 173 CO -0.25 0.20 0.51 0.74 0.09 0.00 0.00 178.44 179.73 3hth h THR 174 N 0.35 1.08 0.00 0.22 2.02 0.38 0.09 112.91 117.04 3hth h THR 174 Ca 0.11 -0.31 -0.07 0.00 0.77 0.00 0.00 66.41 66.92 3hth h THR 174 Cb -0.00 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.50 3hth h THR 174 CO -0.05 0.16 -0.32 0.03 0.37 0.00 0.00 175.52 175.71 3hth h ARG 175 N 0.90 0.00 0.05 6.66 3.08 -0.19 -3.19 114.38 121.69 3hth h ARG 175 Ca 0.32 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.29 3hth h ARG 175 Cb 0.14 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.20 3hth h ARG 175 CO -0.10 0.32 -0.36 1.25 -1.07 0.00 0.00 179.97 180.01 3hth h LEU 176 N 0.00 0.22 0.00 3.04 7.12 -0.39 -3.51 115.31 121.79 3hth h LEU 176 Ca -0.00 -0.93 0.00 0.00 0.13 0.00 0.00 57.88 57.07 3hth h LEU 176 Cb 0.59 -0.07 0.00 0.00 -0.53 0.00 0.00 40.66 40.65 3hth h LEU 176 CO 0.04 1.14 0.00 -0.38 -0.13 0.00 0.00 178.44 179.11