#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h6y n LYS 3 N 0.00 0.32 -3.27 -0.67 4.76 -1.26 -4.96 118.16 113.08 2h6y n LYS 3 Ca 0.00 -0.23 -0.39 0.00 -2.87 0.00 0.00 58.31 54.83 2h6y n LYS 3 Cb 0.00 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 31.63 2h6y n LYS 3 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2h6y s ILE 4 N -2.84 4.75 -0.16 -0.18 1.01 -1.26 -4.54 121.20 117.98 2h6y s ILE 4 Ca 0.14 1.22 -0.22 0.00 0.00 0.00 0.00 60.65 61.78 2h6y s ILE 4 Cb 0.17 -3.90 -0.03 0.00 0.01 0.00 0.00 42.46 38.72 2h6y s ILE 4 CO 0.70 0.55 0.66 -0.63 0.00 0.00 0.00 174.94 176.22 2h6y s ILE 5 N -1.05 5.02 -0.56 2.92 1.01 -0.22 -4.99 121.20 123.34 2h6y s ILE 5 Ca 0.29 1.29 -0.18 0.00 0.00 0.00 0.00 60.65 62.05 2h6y s ILE 5 Cb -0.19 -3.98 0.10 0.00 0.01 0.00 0.00 42.46 38.40 2h6y s ILE 5 CO 0.19 0.15 0.61 -1.00 0.00 0.00 0.00 174.94 174.88 2h6y s HIS 6 N 1.58 3.10 0.51 3.97 3.76 -1.26 -0.40 115.29 126.55 2h6y s HIS 6 Ca 0.32 -1.02 -0.17 0.00 -0.15 0.00 0.00 55.06 54.04 2h6y s HIS 6 Cb -0.16 -3.83 -0.08 0.00 1.11 0.00 0.00 32.58 29.62 2h6y s HIS 6 CO 0.12 -1.14 0.99 -0.51 -0.85 0.00 0.00 174.74 173.35 2h6y s LEU 7 N 2.26 3.66 0.43 0.89 1.43 -0.25 -4.97 118.68 122.13 2h6y s LEU 7 Ca 0.09 1.61 0.04 0.00 -1.03 0.00 0.00 54.13 54.83 2h6y s LEU 7 Cb -0.25 -4.52 -0.04 0.00 0.03 0.00 0.00 46.19 41.41 2h6y s LEU 7 CO 0.06 -0.59 0.05 0.42 0.23 0.00 0.00 176.35 176.51 2h6y s THR 8 N -2.54 1.21 0.30 5.49 -4.23 -1.26 -4.68 115.64 109.92 2h6y s THR 8 Ca 0.60 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 59.16 2h6y s THR 8 Cb -0.10 -2.51 0.07 0.00 1.34 0.00 0.00 72.50 71.30 2h6y s THR 8 CO 0.29 0.00 1.74 0.44 -0.54 0.00 0.00 174.62 176.55 2h6y h ASP 9 N 1.70 0.35 0.42 3.99 3.32 -1.92 -2.49 116.42 121.79 2h6y h ASP 9 Ca -0.41 -0.12 -0.18 0.00 0.02 0.00 0.00 57.03 56.34 2h6y h ASP 9 Cb 1.28 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.72 2h6y h ASP 9 CO 0.70 0.64 -0.76 0.44 -1.72 0.00 0.00 179.24 178.55 2h6y h ASP 10 N 0.31 0.32 0.58 6.45 3.32 -2.01 -3.32 116.42 122.07 2h6y h ASP 10 Ca 0.04 -0.22 0.00 0.00 0.02 0.00 0.00 57.03 56.87 2h6y h ASP 10 Cb 0.68 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.14 2h6y h ASP 10 CO 0.05 0.96 -0.59 -1.54 -1.72 0.00 0.00 179.24 176.41 2h6y n SER 11 N -3.77 0.56 -0.04 6.45 3.41 -1.19 -4.52 113.62 114.52 2h6y n SER 11 Ca -0.03 -0.15 -0.09 0.00 -0.26 0.00 0.00 58.87 58.34 2h6y n SER 11 Cb 0.72 0.29 -0.02 0.00 -0.26 0.00 0.00 64.21 64.94 2h6y n SER 11 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 2h6y h PHE 12 N 0.00 -0.67 -0.55 7.33 3.57 -1.55 0.29 116.94 125.36 2h6y h PHE 12 Ca 0.00 0.04 0.11 0.00 3.53 0.00 0.00 57.97 61.65 2h6y h PHE 12 Cb 0.59 0.33 -0.11 0.00 2.79 0.00 0.00 35.95 39.55 2h6y h PHE 12 CO 0.00 -0.33 -0.17 0.22 -2.23 0.00 0.00 178.31 175.80 2h6y h ASP 13 N -0.27 -0.63 -0.08 0.41 3.58 -1.82 0.24 116.42 117.84 2h6y h ASP 13 Ca 0.13 0.18 -0.17 0.00 0.42 0.00 0.00 57.03 57.58 2h6y h ASP 13 Cb 0.47 0.39 0.01 0.00 1.72 0.00 0.00 39.33 41.91 2h6y h ASP 13 CO -0.37 -0.21 -0.62 0.74 -2.88 0.00 0.00 179.24 175.89 2h6y h THR 14 N -0.04 1.35 -0.06 2.25 2.02 -1.76 0.34 112.91 117.02 2h6y h THR 14 Ca 0.26 -1.94 -0.18 0.00 0.77 0.00 0.00 66.41 65.32 2h6y h THR 14 Cb 0.44 2.25 -0.01 0.00 -1.74 0.00 0.00 68.15 69.10 2h6y h THR 14 CO -0.59 0.59 -0.75 0.44 0.37 0.00 0.00 175.52 175.57 2h6y h ASP 15 N 0.18 0.42 0.00 4.18 3.32 -0.71 -3.31 116.42 120.51 2h6y h ASP 15 Ca -0.05 -0.28 -0.09 0.00 0.02 0.00 0.00 57.03 56.62 2h6y h ASP 15 Cb 1.28 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 2h6y h ASP 15 CO 0.13 1.03 -0.98 0.52 -1.72 0.00 0.00 179.24 178.22 2h6y n VAL 16 N -3.81 1.09 0.18 -1.35 0.31 0.81 -4.34 118.33 111.23 2h6y n VAL 16 Ca -0.04 0.10 0.06 0.00 -0.01 0.00 0.00 64.34 64.44 2h6y n VAL 16 Cb 0.72 -1.83 0.29 0.00 -0.91 0.00 0.00 33.84 32.11 2h6y n VAL 16 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2h6y h LEU 17 N -0.46 0.00 -0.91 7.52 3.38 -1.33 -3.17 115.31 120.34 2h6y h LEU 17 Ca -0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2h6y h LEU 17 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2h6y h LEU 17 CO -0.08 0.37 -0.45 0.29 0.09 0.00 0.00 178.44 178.67 2h6y n LYS 18 N -3.44 1.37 -2.40 1.13 4.76 0.04 -4.19 118.16 115.43 2h6y n LYS 18 Ca 0.00 -0.88 -0.40 0.00 -2.87 0.00 0.00 58.31 54.16 2h6y n LYS 18 Cb 0.54 -1.40 -0.04 0.00 -1.84 0.00 0.00 35.03 32.30 2h6y n LYS 18 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2h6y s ALA 19 N -2.27 3.40 -1.24 7.82 0.00 -1.20 -4.95 121.76 123.31 2h6y s ALA 19 Ca 0.16 0.96 -0.12 0.00 0.00 0.00 0.00 51.96 52.96 2h6y s ALA 19 Cb 0.16 -3.36 0.17 0.00 0.00 0.00 0.00 23.12 20.10 2h6y s ALA 19 CO 0.52 -0.27 1.62 -3.47 0.00 0.00 0.00 175.76 174.16 2h6y n ASP 20 N 1.00 5.19 0.00 0.00 2.03 -1.26 -4.37 116.55 119.14 2h6y n ASP 20 Ca -0.00 -3.04 0.00 0.00 0.52 0.00 0.00 54.79 52.27 2h6y n ASP 20 Cb 0.44 -1.53 0.00 0.00 -0.72 0.00 0.00 41.12 39.32 2h6y n ASP 20 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2h6y n GLY 21 N 3.50 -0.07 3.68 0.27 0.00 -1.26 -5.02 105.19 106.28 2h6y n GLY 21 Ca 0.38 -1.27 -0.38 0.00 0.00 0.00 0.00 46.02 44.75 2h6y n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h6y s ALA 22 N -1.00 3.55 -0.14 4.61 0.00 -1.26 -2.13 121.76 125.39 2h6y s ALA 22 Ca 0.00 -0.48 0.02 0.00 0.00 0.00 0.00 51.96 51.50 2h6y s ALA 22 Cb 0.00 -2.65 0.01 0.00 0.00 0.00 0.00 23.12 20.48 2h6y s ALA 22 CO 0.00 -0.28 -0.22 0.42 0.00 0.00 0.00 175.76 175.68 2h6y s ILE 23 N 1.27 2.03 -0.49 0.00 -1.09 -0.02 -1.57 121.20 121.34 2h6y s ILE 23 Ca 0.20 -0.96 -0.21 0.00 -2.23 0.00 0.00 60.65 57.45 2h6y s ILE 23 Cb -0.15 -1.79 0.04 0.00 -1.58 0.00 0.00 42.46 38.98 2h6y s ILE 23 CO 0.08 0.54 0.69 -0.22 -1.23 0.00 0.00 174.94 174.81 2h6y s LEU 24 N 0.82 4.65 -0.17 2.97 2.96 0.16 0.25 118.68 130.31 2h6y s LEU 24 Ca -0.07 -0.62 -0.14 0.00 -0.22 0.00 0.00 54.13 53.08 2h6y s LEU 24 Cb -0.16 -2.61 -0.05 0.00 0.50 0.00 0.00 46.19 43.88 2h6y s LEU 24 CO -0.02 -0.92 0.31 -0.69 -1.32 0.00 0.00 176.35 173.71 2h6y s VAL 25 N 2.94 5.29 -0.31 1.68 1.01 0.44 -0.57 120.40 130.88 2h6y s VAL 25 Ca 0.20 0.57 -0.08 0.00 0.00 0.00 0.00 61.98 62.67 2h6y s VAL 25 Cb -0.16 -3.65 0.01 0.00 0.00 0.00 0.00 36.38 32.57 2h6y s VAL 25 CO 0.16 0.36 0.13 -0.62 0.00 0.00 0.00 175.10 175.12 2h6y s ASP 26 N 0.60 5.38 -0.36 3.32 2.15 0.19 -0.79 116.67 127.17 2h6y s ASP 26 Ca 0.17 -0.68 -0.18 0.00 0.43 0.00 0.00 52.55 52.29 2h6y s ASP 26 Cb -0.13 -1.95 -0.00 0.00 -0.30 0.00 0.00 42.92 40.54 2h6y s ASP 26 CO 0.05 -0.22 0.48 -0.36 -0.17 0.00 0.00 175.17 174.95 2h6y s PHE 27 N 1.55 3.18 0.25 -5.34 0.08 -0.14 -0.30 117.98 117.27 2h6y s PHE 27 Ca 0.03 0.10 -0.04 0.00 0.12 0.00 0.00 56.93 57.14 2h6y s PHE 27 Cb -0.17 -2.89 -0.02 0.00 -0.57 0.00 0.00 43.02 39.37 2h6y s PHE 27 CO 0.04 -0.54 0.31 1.67 -0.10 0.00 0.00 175.22 176.61 2h6y s TRP 28 N 2.32 0.95 0.02 0.36 1.48 -0.72 -2.55 118.94 120.80 2h6y s TRP 28 Ca 0.17 -1.19 -0.08 0.00 -1.06 0.00 0.00 56.10 53.95 2h6y s TRP 28 Cb -0.16 -0.26 -0.00 0.00 -1.16 0.00 0.00 33.47 31.90 2h6y s TRP 28 CO 0.13 -0.86 0.14 0.00 -4.06 0.00 0.00 176.95 172.31 2h6y s ALA 29 N -3.85 -0.28 0.31 2.67 0.00 -1.26 -0.82 121.76 118.52 2h6y s ALA 29 Ca 0.33 -0.25 0.05 0.00 0.00 0.00 0.00 51.96 52.09 2h6y s ALA 29 Cb 0.03 0.18 0.50 0.00 0.00 0.00 0.00 23.12 23.83 2h6y s ALA 29 CO 0.14 -0.27 1.75 1.49 0.00 0.00 0.00 175.76 178.88 2h6y h GLU 30 N 3.95 0.34 0.00 0.00 4.57 -2.00 -2.47 114.58 118.97 2h6y h GLU 30 Ca -0.31 -0.13 0.00 0.00 -1.18 0.00 0.00 59.36 57.74 2h6y h GLU 30 Cb 1.19 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.76 2h6y h GLU 30 CO 0.44 0.60 0.00 -2.67 -1.18 0.00 0.00 179.01 176.20 2h6y n TRP 31 N -4.12 0.00 -3.02 0.92 4.27 -1.26 -4.77 117.44 109.47 2h6y n TRP 31 Ca -0.01 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.17 2h6y n TRP 31 Cb 0.40 -0.23 -0.06 0.00 -1.36 0.00 0.00 31.31 30.06 2h6y n TRP 31 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2h6y h GLY 33 N 9.97 -0.75 1.68 0.00 0.00 -1.87 -1.98 103.07 110.12 2h6y h GLY 33 Ca -0.25 0.32 0.03 0.00 0.00 0.00 0.00 47.33 47.43 2h6y h GLY 33 CO 0.93 -0.28 0.15 -0.56 0.00 0.00 0.00 176.54 176.78 2h6y h PRO 34 N -0.71 0.14 -0.78 4.80 0.13 -1.93 -1.84 132.00 131.81 2h6y h PRO 34 Ca -0.05 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.05 2h6y h PRO 34 Cb 0.58 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 31.64 2h6y h PRO 34 CO 0.05 0.09 0.40 0.00 -0.23 0.00 0.00 178.00 178.31 2h6y h LYS 36 N 1.09 0.00 -0.25 0.00 1.57 -0.62 -3.03 116.57 115.33 2h6y h LYS 36 Ca 0.27 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.00 2h6y h LYS 36 Cb 0.08 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 2h6y h LYS 36 CO -0.04 0.14 -0.06 0.52 -0.57 0.00 0.00 179.45 179.45 2h6y h MET 37 N 0.00 0.47 0.00 3.15 2.86 -1.09 -3.19 114.93 117.13 2h6y h MET 37 Ca -0.00 -0.18 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 2h6y h MET 37 Cb 0.91 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.54 2h6y h MET 37 CO 0.02 0.70 -0.11 0.44 1.06 0.00 0.00 176.91 179.01 2h6y n ILE 38 N -4.56 0.05 0.13 -1.22 -5.35 -1.07 -4.29 119.36 103.05 2h6y n ILE 38 Ca -0.04 -0.03 -0.13 0.00 -0.27 0.00 0.00 62.75 62.28 2h6y n ILE 38 Cb 0.30 -0.35 -0.06 0.00 -1.74 0.00 0.00 39.64 37.78 2h6y n ILE 38 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2h6y h ALA 39 N 2.95 -0.54 0.00 -1.28 0.00 -1.51 -0.71 119.26 118.17 2h6y h ALA 39 Ca 0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2h6y h ALA 39 Cb 0.52 0.50 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2h6y h ALA 39 CO 0.00 -0.86 -0.09 -1.00 0.00 0.00 0.00 179.25 177.30 2h6y h PRO 40 N -0.54 0.00 -0.22 0.00 0.13 -1.77 -2.61 132.00 126.98 2h6y h PRO 40 Ca 0.02 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.07 2h6y h PRO 40 Cb 0.56 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.69 2h6y h PRO 40 CO -0.16 0.09 -0.18 0.82 -0.23 0.00 0.00 178.00 178.34 2h6y h ILE 41 N 0.00 1.32 -0.81 -3.56 2.04 -1.67 -2.78 117.51 112.05 2h6y h ILE 41 Ca -0.00 -1.31 0.02 0.00 1.00 0.00 0.00 64.86 64.56 2h6y h ILE 41 Cb 0.29 1.67 -0.04 0.00 -0.74 0.00 0.00 36.82 38.00 2h6y h ILE 41 CO 0.01 0.40 0.53 -0.07 0.00 0.00 0.00 178.15 179.03 2h6y h LEU 42 N 0.21 0.91 -0.18 1.44 3.38 -0.85 -0.14 115.31 120.09 2h6y h LEU 42 Ca 0.04 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.02 2h6y h LEU 42 Cb 0.71 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 2h6y h LEU 42 CO 0.05 0.64 -0.00 0.44 0.09 0.00 0.00 178.44 179.66 2h6y h ASP 43 N 1.06 -0.07 -0.63 -0.43 3.32 -1.40 0.96 116.42 119.23 2h6y h ASP 43 Ca 0.31 0.04 -0.07 0.00 0.02 0.00 0.00 57.03 57.32 2h6y h ASP 43 Cb -0.07 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 2h6y h ASP 43 CO -0.07 -0.01 0.12 -0.33 -1.72 0.00 0.00 179.24 177.22 2h6y h GLU 44 N 0.05 1.05 -0.35 3.56 5.08 -1.16 -2.52 114.58 120.30 2h6y h GLU 44 Ca 0.08 -0.27 -0.11 0.00 -1.00 0.00 0.00 59.36 58.07 2h6y h GLU 44 Cb 0.10 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2h6y h GLU 44 CO -0.14 0.96 -0.19 0.82 -1.00 0.00 0.00 179.01 179.45 2h6y h ILE 45 N 0.99 1.29 -0.65 3.13 1.08 -0.88 -0.21 117.51 122.26 2h6y h ILE 45 Ca 0.20 -1.32 0.14 0.00 -0.39 0.00 0.00 64.86 63.48 2h6y h ILE 45 Cb 0.41 1.39 -0.11 0.00 -3.07 0.00 0.00 36.82 35.44 2h6y h ILE 45 CO 0.01 0.43 0.06 0.00 -0.69 0.00 0.00 178.15 177.96 2h6y h ALA 46 N 0.78 0.71 0.04 1.87 0.00 -0.66 0.49 119.26 122.49 2h6y h ALA 46 Ca 0.08 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 2h6y h ALA 46 Cb 0.74 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2h6y h ALA 46 CO 0.06 -0.37 -0.02 -0.44 0.00 0.00 0.00 179.25 178.47 2h6y h ASP 47 N 0.17 -0.05 -0.48 0.00 3.32 -1.15 -2.86 116.42 115.37 2h6y h ASP 47 Ca 0.35 -0.16 -0.03 0.00 0.02 0.00 0.00 57.03 57.21 2h6y h ASP 47 Cb 0.57 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.11 2h6y h ASP 47 CO -0.52 0.13 0.22 0.44 -1.72 0.00 0.00 179.24 177.79 2h6y h ASP 48 N -0.23 0.67 -0.57 6.45 5.19 -0.45 -3.08 116.42 124.40 2h6y h ASP 48 Ca -0.01 -0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.33 2h6y h ASP 48 Cb 0.21 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 39.54 2h6y h ASP 48 CO 0.01 0.60 0.00 -1.22 -3.12 0.00 0.00 179.24 175.51 2h6y n TYR 49 N -4.35 0.85 -1.67 4.55 4.01 0.11 -4.97 117.16 115.69 2h6y n TYR 49 Ca 0.04 -0.52 -0.66 0.00 -0.16 0.00 0.00 57.90 56.60 2h6y n TYR 49 Cb 0.15 -0.05 -0.10 0.00 -0.31 0.00 0.00 39.34 39.03 2h6y n TYR 49 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 2h6y n GLN 50 N 1.13 0.13 -0.08 -0.72 7.27 -1.08 -0.20 117.38 123.83 2h6y n GLN 50 Ca 0.20 0.05 0.00 0.00 0.07 0.00 0.00 57.00 57.32 2h6y n GLN 50 Cb 0.59 -1.57 0.00 0.00 2.41 0.00 0.00 30.24 31.67 2h6y n GLN 50 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2h6y n GLY 51 N 4.58 1.24 0.05 1.69 0.00 -1.26 -4.82 105.19 106.66 2h6y n GLY 51 Ca 0.34 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.30 2h6y n GLY 51 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2h6y n LYS 52 N -2.00 0.85 -3.84 1.61 4.81 0.72 -5.08 118.16 115.24 2h6y n LYS 52 Ca 0.00 0.04 -0.09 0.00 -0.87 0.00 0.00 58.31 57.39 2h6y n LYS 52 Cb 0.00 -1.20 -0.05 0.00 0.02 0.00 0.00 35.03 33.81 2h6y n LYS 52 CO 0.00 0.00 0.00 -0.48 1.17 0.00 0.00 177.40 178.09 2h6y s LEU 53 N -5.33 0.29 -0.06 3.14 0.05 -0.49 -4.48 118.68 111.80 2h6y s LEU 53 Ca -0.11 -0.65 0.03 0.00 0.05 0.00 0.00 54.13 53.45 2h6y s LEU 53 Cb 0.03 1.91 -0.02 0.00 -2.05 0.00 0.00 46.19 46.05 2h6y s LEU 53 CO 0.25 -1.05 -0.14 -0.89 -0.55 0.00 0.00 176.35 173.97 2h6y s THR 54 N -3.92 3.08 0.01 5.48 2.01 -0.61 -4.37 115.64 117.31 2h6y s THR 54 Ca 0.13 -0.71 -0.17 0.00 0.31 0.00 0.00 61.69 61.26 2h6y s THR 54 Cb -0.00 -2.22 -0.06 0.00 0.01 0.00 0.00 72.50 70.23 2h6y s THR 54 CO 0.00 0.58 0.48 -0.69 -0.69 0.00 0.00 174.62 174.30 2h6y s VAL 55 N -0.57 4.96 0.01 3.82 1.01 -1.26 -0.66 120.40 127.70 2h6y s VAL 55 Ca 0.08 0.99 0.01 0.00 0.00 0.00 0.00 61.98 63.06 2h6y s VAL 55 Cb -0.11 -3.80 -0.01 0.00 0.00 0.00 0.00 36.38 32.46 2h6y s VAL 55 CO 0.01 0.53 -0.04 0.00 0.00 0.00 0.00 175.10 175.60 2h6y s ALA 56 N -0.79 0.30 -0.06 5.51 0.00 0.27 -1.05 121.76 125.93 2h6y s ALA 56 Ca 0.26 -0.37 0.04 0.00 0.00 0.00 0.00 51.96 51.89 2h6y s ALA 56 Cb -0.17 0.01 0.00 0.00 0.00 0.00 0.00 23.12 22.95 2h6y s ALA 56 CO 0.15 -0.00 -0.18 0.15 0.00 0.00 0.00 175.76 175.87 2h6y s LYS 57 N -0.70 2.09 -0.23 0.00 1.02 0.47 -0.63 119.74 121.75 2h6y s LYS 57 Ca -0.05 -0.65 0.02 0.00 0.02 0.00 0.00 55.97 55.32 2h6y s LYS 57 Cb -0.05 -1.73 0.05 0.00 -0.52 0.00 0.00 37.83 35.58 2h6y s LYS 57 CO -0.00 0.19 -0.13 -1.17 -0.92 0.00 0.00 175.35 173.32 2h6y s LEU 58 N 0.23 2.97 -0.18 3.17 2.96 0.59 -1.09 118.68 127.33 2h6y s LEU 58 Ca -0.09 -1.15 -0.29 0.00 -0.22 0.00 0.00 54.13 52.37 2h6y s LEU 58 Cb -0.14 -1.49 -0.01 0.00 0.50 0.00 0.00 46.19 45.06 2h6y s LEU 58 CO 0.04 -0.14 1.16 0.21 -1.32 0.00 0.00 176.35 176.30 2h6y s ASN 59 N 1.19 7.02 0.00 3.68 3.84 -1.26 -1.75 114.94 127.66 2h6y s ASN 59 Ca -0.05 1.57 0.29 0.00 0.21 0.00 0.00 52.86 54.89 2h6y s ASN 59 Cb -0.18 -2.54 1.28 0.00 -0.55 0.00 0.00 41.25 39.26 2h6y s ASN 59 CO -0.07 -0.70 1.94 2.30 -2.79 0.00 0.00 177.10 177.78 2h6y n ILE 60 N 5.27 0.00 -0.04 -5.21 -6.64 0.00 -0.71 119.36 112.03 2h6y n ILE 60 Ca 0.13 -0.00 -0.22 0.00 -1.77 0.00 0.00 62.75 60.89 2h6y n ILE 60 Cb 0.46 -0.46 -0.13 0.00 -1.44 0.00 0.00 39.64 38.07 2h6y n ILE 60 CO 0.00 0.00 0.00 0.47 -1.77 0.00 0.00 176.55 175.25 2h6y n ASP 61 N -1.43 2.04 0.15 7.28 8.00 -1.26 -3.50 116.55 127.82 2h6y n ASP 61 Ca 0.09 0.25 0.02 0.00 0.71 0.00 0.00 54.79 55.86 2h6y n ASP 61 Cb 0.31 -0.86 0.20 0.00 -0.02 0.00 0.00 41.12 40.75 2h6y n ASP 61 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 2h6y h GLN 62 N -0.28 0.00 -2.63 -1.24 4.20 -1.93 -3.37 115.11 109.86 2h6y h GLN 62 Ca -0.43 0.00 -0.60 0.00 0.06 0.00 0.00 58.65 57.68 2h6y h GLN 62 Cb 1.80 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 29.18 2h6y h GLN 62 CO -0.03 0.53 -0.80 0.09 -0.67 0.00 0.00 178.83 177.95 2h6y n ASN 63 N -3.57 1.23 0.09 1.46 3.02 0.11 -4.95 115.26 112.66 2h6y n ASN 63 Ca -0.00 -2.80 0.13 0.00 -0.03 0.00 0.00 54.58 51.88 2h6y n ASN 63 Cb 0.61 -0.65 0.45 0.00 -0.61 0.00 0.00 39.78 39.58 2h6y n ASN 63 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2h6y n PRO 64 N 2.28 0.20 0.10 3.52 -0.04 -1.23 -4.05 135.00 135.78 2h6y n PRO 64 Ca 0.25 0.24 -0.03 0.00 -0.04 0.00 0.00 63.50 63.92 2h6y n PRO 64 Cb 0.43 -1.77 0.01 0.00 -0.04 0.00 0.00 33.50 32.13 2h6y n PRO 64 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2h6y h GLY 65 N 3.98 0.00 0.69 0.55 0.00 -1.94 -3.40 103.07 102.94 2h6y h GLY 65 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.00 2h6y h GLY 65 CO 0.00 0.00 -1.70 -0.84 0.00 0.00 0.00 176.54 174.00 2h6y h THR 66 N 0.00 0.88 -0.46 4.70 2.02 -1.95 -3.39 112.91 114.71 2h6y h THR 66 Ca -0.01 -2.42 0.09 0.00 0.77 0.00 0.00 66.41 64.84 2h6y h THR 66 Cb 1.48 2.66 -0.08 0.00 -1.74 0.00 0.00 68.15 70.47 2h6y h THR 66 CO 0.10 0.80 -0.00 0.00 0.37 0.00 0.00 175.52 176.79 2h6y h ALA 67 N 0.03 0.43 -0.27 6.16 0.00 -1.82 -2.18 119.26 121.61 2h6y h ALA 67 Ca -0.36 0.14 0.08 0.00 0.00 0.00 0.00 54.91 54.77 2h6y h ALA 67 Cb 1.95 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.96 2h6y h ALA 67 CO 0.10 -0.39 0.25 -1.35 0.00 0.00 0.00 179.25 177.86 2h6y h PRO 68 N 0.11 0.00 0.00 0.00 0.11 -1.82 0.83 132.00 131.23 2h6y h PRO 68 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 2h6y h PRO 68 Cb 0.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.45 2h6y h PRO 68 CO -0.39 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.03 2h6y n LYS 69 N -3.99 0.20 -0.05 1.05 5.02 -0.82 -2.43 118.16 117.15 2h6y n LYS 69 Ca 0.04 0.44 0.06 0.00 -2.02 0.00 0.00 58.31 56.83 2h6y n LYS 69 Cb 0.40 -1.90 0.09 0.00 -0.02 0.00 0.00 35.03 33.60 2h6y n LYS 69 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2h6y n TYR 70 N -2.29 0.00 -2.27 2.13 4.01 0.26 -4.99 117.16 114.01 2h6y n TYR 70 Ca 0.02 -0.82 -0.20 0.00 -0.16 0.00 0.00 57.90 56.74 2h6y n TYR 70 Cb 0.22 -0.11 -0.02 0.00 -0.31 0.00 0.00 39.34 39.12 2h6y n TYR 70 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2h6y n GLY 71 N -1.10 -0.12 3.68 2.72 0.00 -1.02 -4.92 105.19 104.43 2h6y n GLY 71 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2h6y n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h6y s ILE 72 N -2.95 3.28 0.00 -0.61 -1.09 -1.08 -4.92 121.20 113.83 2h6y s ILE 72 Ca 0.00 0.66 0.00 0.00 -2.23 0.00 0.00 60.65 59.08 2h6y s ILE 72 Cb 0.00 -3.42 0.00 0.00 -1.58 0.00 0.00 42.46 37.46 2h6y s ILE 72 CO 0.00 -0.01 0.00 0.54 -1.23 0.00 0.00 174.94 174.24 2h6y n ARG 73 N 5.83 0.00 -1.97 2.79 5.12 -1.26 -4.72 116.66 122.45 2h6y n ARG 73 Ca 0.15 0.00 -0.37 0.00 -1.93 0.00 0.00 57.85 55.71 2h6y n ARG 73 Cb 0.42 0.00 0.03 0.00 -1.16 0.00 0.00 32.46 31.75 2h6y n ARG 73 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2h6y s GLY 74 N -1.39 2.80 0.11 -0.13 0.00 -1.26 -5.05 107.32 102.40 2h6y s GLY 74 Ca 0.00 1.10 0.06 0.00 0.00 0.00 0.00 44.72 45.88 2h6y s GLY 74 CO 0.00 1.54 -0.15 -0.26 0.00 0.00 0.00 173.10 174.23 2h6y s ILE 75 N -1.49 1.36 0.42 0.90 -4.36 -1.26 -4.03 121.20 112.74 2h6y s ILE 75 Ca 0.74 -1.62 -0.24 0.00 -0.26 0.00 0.00 60.65 59.27 2h6y s ILE 75 Cb -0.33 -1.45 -0.08 0.00 1.25 0.00 0.00 42.46 41.84 2h6y s ILE 75 CO 0.38 -0.32 1.19 -2.16 0.24 0.00 0.00 174.94 174.26 2h6y s PRO 76 N -2.38 3.93 -0.16 0.37 0.04 -1.26 -4.69 135.00 130.85 2h6y s PRO 76 Ca 0.07 1.86 0.01 0.00 0.04 0.00 0.00 61.00 62.97 2h6y s PRO 76 Cb -0.07 -2.59 0.01 0.00 0.04 0.00 0.00 34.50 31.90 2h6y s PRO 76 CO 0.03 -0.43 -0.19 0.99 0.04 0.00 0.00 177.00 177.44 2h6y s THR 77 N -1.44 2.30 -0.30 1.26 2.01 -1.06 0.44 115.64 118.84 2h6y s THR 77 Ca 0.59 -0.89 -0.11 0.00 0.31 0.00 0.00 61.69 61.59 2h6y s THR 77 Cb -0.31 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 2h6y s THR 77 CO 0.38 0.53 0.20 -0.76 -0.69 0.00 0.00 174.62 174.29 2h6y s LEU 78 N 0.97 4.19 -0.19 4.42 1.43 1.00 -0.96 118.68 129.54 2h6y s LEU 78 Ca -0.03 -0.22 -0.05 0.00 -1.03 0.00 0.00 54.13 52.80 2h6y s LEU 78 Cb -0.15 -2.11 -0.03 0.00 0.03 0.00 0.00 46.19 43.94 2h6y s LEU 78 CO -0.04 -0.13 -0.00 -0.76 0.23 0.00 0.00 176.35 175.64 2h6y s LEU 79 N 1.73 3.28 -0.35 1.79 1.43 0.03 -1.12 118.68 125.47 2h6y s LEU 79 Ca 0.06 -0.18 -0.18 0.00 -1.03 0.00 0.00 54.13 52.80 2h6y s LEU 79 Cb -0.17 -1.83 -0.00 0.00 0.03 0.00 0.00 46.19 44.23 2h6y s LEU 79 CO 0.10 0.08 0.52 -0.22 0.23 0.00 0.00 176.35 177.06 2h6y s LEU 80 N 0.89 4.35 -0.04 1.79 2.96 -0.44 -0.42 118.68 127.77 2h6y s LEU 80 Ca 0.01 -0.02 -0.13 0.00 -0.22 0.00 0.00 54.13 53.77 2h6y s LEU 80 Cb -0.14 -2.59 -0.05 0.00 0.50 0.00 0.00 46.19 43.91 2h6y s LEU 80 CO 0.02 -0.48 0.34 -0.36 -1.32 0.00 0.00 176.35 174.55 2h6y s PHE 81 N 2.40 3.67 -0.31 5.38 0.08 0.14 -0.37 117.98 128.97 2h6y s PHE 81 Ca 0.19 0.85 0.04 0.00 0.12 0.00 0.00 56.93 58.13 2h6y s PHE 81 Cb -0.15 -2.22 0.09 0.00 -0.57 0.00 0.00 43.02 40.16 2h6y s PHE 81 CO 0.13 0.62 -0.00 0.15 -0.10 0.00 0.00 175.22 176.02 2h6y s LYS 82 N -0.90 1.72 -1.49 0.44 1.02 0.84 -0.84 119.74 120.54 2h6y s LYS 82 Ca 0.21 -1.68 -0.12 0.00 0.02 0.00 0.00 55.97 54.40 2h6y s LYS 82 Cb -0.15 -3.08 0.07 0.00 -0.52 0.00 0.00 37.83 34.14 2h6y s LYS 82 CO 0.10 -0.82 0.95 0.09 -0.92 0.00 0.00 175.35 174.75 2h6y n ASN 83 N 4.32 -5.09 0.00 2.83 3.02 -0.91 -1.89 115.26 117.54 2h6y n ASN 83 Ca -0.02 -0.67 0.00 0.00 -0.03 0.00 0.00 54.58 53.86 2h6y n ASN 83 Cb 0.42 -4.07 0.00 0.00 -0.61 0.00 0.00 39.78 35.52 2h6y n ASN 83 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2h6y n GLY 84 N -1.68 0.71 3.14 7.41 0.00 -1.24 -4.88 105.19 108.65 2h6y n GLY 84 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 2h6y n GLY 84 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2h6y s GLU 85 N -0.60 2.82 0.14 1.61 2.02 -0.80 -4.89 118.70 119.01 2h6y s GLU 85 Ca 0.00 -0.96 -0.31 0.00 0.02 0.00 0.00 54.97 53.71 2h6y s GLU 85 Cb 0.00 -2.78 -0.10 0.00 0.10 0.00 0.00 34.13 31.35 2h6y s GLU 85 CO 0.00 -0.34 1.69 0.08 0.02 0.00 0.00 175.26 176.71 2h6y s VAL 86 N 1.27 2.56 -0.14 2.63 1.01 -1.26 -0.11 120.40 126.35 2h6y s VAL 86 Ca 0.01 0.26 0.12 0.00 0.00 0.00 0.00 61.98 62.37 2h6y s VAL 86 Cb -0.16 -3.17 -0.17 0.00 0.00 0.00 0.00 36.38 32.88 2h6y s VAL 86 CO -0.08 0.01 0.04 0.00 0.00 0.00 0.00 175.10 175.07 2h6y n ALA 87 N 4.75 1.65 -3.38 5.51 0.00 0.50 -4.89 120.51 124.65 2h6y n ALA 87 Ca 0.16 -0.94 -0.15 0.00 0.00 0.00 0.00 53.44 52.50 2h6y n ALA 87 Cb 0.38 -0.05 -0.07 0.00 0.00 0.00 0.00 19.45 19.71 2h6y n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h6y s ALA 88 N -2.35 -1.27 -0.05 0.00 0.00 -1.20 -5.00 121.76 111.88 2h6y s ALA 88 Ca -0.07 0.87 0.02 0.00 0.00 0.00 0.00 51.96 52.77 2h6y s ALA 88 Cb 0.04 -0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.15 2h6y s ALA 88 CO 0.58 -0.31 -0.08 0.99 0.00 0.00 0.00 175.76 176.94 2h6y s THR 89 N -1.14 0.79 -0.07 0.00 2.01 -1.26 -1.32 115.64 114.65 2h6y s THR 89 Ca -0.11 -0.27 -0.01 0.00 0.31 0.00 0.00 61.69 61.60 2h6y s THR 89 Cb -0.03 -0.76 0.03 0.00 0.01 0.00 0.00 72.50 71.75 2h6y s THR 89 CO 0.07 0.28 -0.01 -0.75 -0.69 0.00 0.00 174.62 173.51 2h6y s LYS 90 N 0.79 0.69 -0.18 4.92 2.47 -0.28 -5.01 119.74 123.14 2h6y s LYS 90 Ca -0.13 0.05 -0.03 0.00 -1.56 0.00 0.00 55.97 54.30 2h6y s LYS 90 Cb -0.15 -0.97 -0.01 0.00 -1.46 0.00 0.00 37.83 35.24 2h6y s LYS 90 CO 0.02 -0.26 -0.07 0.08 0.16 0.00 0.00 175.35 175.28 2h6y s VAL 91 N 1.75 3.35 0.00 4.02 1.01 -1.26 -0.00 120.40 129.26 2h6y s VAL 91 Ca 0.02 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.47 2h6y s VAL 91 Cb -0.13 -2.48 0.00 0.00 0.00 0.00 0.00 36.38 33.77 2h6y s VAL 91 CO -0.04 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.13 2h6y n GLY 92 N 4.23 -3.18 3.87 4.51 0.00 0.17 -5.00 105.19 109.79 2h6y n GLY 92 Ca -0.18 -2.16 -0.31 0.00 0.00 0.00 0.00 46.02 43.37 2h6y n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h6y s ALA 93 N -1.04 3.14 0.03 4.61 0.00 -1.26 -4.64 121.76 122.60 2h6y s ALA 93 Ca 0.00 -0.13 -0.25 0.00 0.00 0.00 0.00 51.96 51.58 2h6y s ALA 93 Cb 0.00 -3.01 0.06 0.00 0.00 0.00 0.00 23.12 20.17 2h6y s ALA 93 CO 0.00 -0.59 0.59 -0.48 0.00 0.00 0.00 175.76 175.28 2h6y s LEU 94 N -5.00 -0.35 1.03 0.00 2.34 -1.26 -5.13 118.68 110.30 2h6y s LEU 94 Ca 0.54 0.35 -0.15 0.00 0.06 0.00 0.00 54.13 54.93 2h6y s LEU 94 Cb -0.11 2.34 0.20 0.00 -0.56 0.00 0.00 46.19 48.07 2h6y s LEU 94 CO 0.50 -0.71 1.16 -0.94 -1.06 0.00 0.00 176.35 175.30 2h6y s SER 95 N -1.79 2.47 0.22 1.48 1.04 -1.26 -4.82 113.70 111.04 2h6y s SER 95 Ca -0.07 0.75 -0.06 0.00 0.48 0.00 0.00 55.95 57.05 2h6y s SER 95 Cb -0.01 -1.13 0.18 0.00 0.10 0.00 0.00 66.02 65.16 2h6y s SER 95 CO 0.01 -3.17 1.71 0.50 0.98 0.00 0.00 173.24 173.27 2h6y h LYS 96 N -1.93 1.01 -0.79 4.02 3.64 -1.99 -1.02 116.57 119.52 2h6y h LYS 96 Ca -0.48 -0.27 -0.02 0.00 -1.27 0.00 0.00 60.65 58.60 2h6y h LYS 96 Cb 1.30 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.97 2h6y h LYS 96 CO 0.48 0.95 0.40 0.78 -2.27 0.00 0.00 179.45 179.79 2h6y h GLY 97 N 1.03 1.21 1.22 5.01 0.00 -1.99 -0.26 103.07 109.28 2h6y h GLY 97 Ca 0.19 -0.58 -0.14 0.00 0.00 0.00 0.00 47.33 46.80 2h6y h GLY 97 CO 0.02 0.55 -0.29 1.46 0.00 0.00 0.00 176.54 178.28 2h6y h GLN 98 N 1.11 0.88 -0.30 4.80 4.20 -1.84 -2.74 115.11 121.21 2h6y h GLN 98 Ca 0.27 -0.40 -0.12 0.00 0.06 0.00 0.00 58.65 58.46 2h6y h GLN 98 Cb 0.09 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 2h6y h GLN 98 CO -0.04 1.05 -0.28 1.25 -0.67 0.00 0.00 178.83 180.14 2h6y h LEU 99 N 0.74 0.77 0.02 1.46 5.85 -0.98 -2.32 115.31 120.86 2h6y h LEU 99 Ca 0.09 -0.46 0.03 0.00 0.84 0.00 0.00 57.88 58.37 2h6y h LEU 99 Cb 0.84 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.61 2h6y h LEU 99 CO 0.07 1.07 -0.30 0.50 -0.34 0.00 0.00 178.44 179.45 2h6y h LYS 100 N 0.48 -0.44 -0.43 1.25 3.64 -1.05 0.14 116.57 120.15 2h6y h LYS 100 Ca 0.05 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.51 2h6y h LYS 100 Cb 0.85 0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.72 2h6y h LYS 100 CO 0.07 -0.29 0.16 0.93 -2.27 0.00 0.00 179.45 178.04 2h6y h GLU 101 N -0.46 0.32 -0.73 1.90 5.08 -1.50 0.34 114.58 119.53 2h6y h GLU 101 Ca 0.06 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2h6y h GLU 101 Cb 0.53 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.66 2h6y h GLU 101 CO -0.24 0.21 0.45 0.35 -1.00 0.00 0.00 179.01 178.78 2h6y h PHE 102 N 0.33 0.83 -0.03 4.33 3.57 -1.09 -0.43 116.94 124.44 2h6y h PHE 102 Ca 0.20 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.69 2h6y h PHE 102 Cb 0.19 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.66 2h6y h PHE 102 CO -0.15 0.45 -0.13 -0.07 -2.23 0.00 0.00 178.31 176.18 2h6y h LEU 103 N 0.85 0.17 -0.97 0.59 3.38 -0.03 -2.47 115.31 116.84 2h6y h LEU 103 Ca 0.31 -0.64 0.06 0.00 0.09 0.00 0.00 57.88 57.70 2h6y h LEU 103 Cb 0.09 -0.05 -0.07 0.00 0.09 0.00 0.00 40.66 40.72 2h6y h LEU 103 CO -0.14 0.78 0.62 0.44 0.09 0.00 0.00 178.44 180.23 2h6y h ASP 104 N -0.43 1.00 0.69 -0.43 5.19 -0.28 0.25 116.42 122.40 2h6y h ASP 104 Ca -0.01 0.01 -0.14 0.00 -0.62 0.00 0.00 57.03 56.27 2h6y h ASP 104 Cb 0.77 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 40.05 2h6y h ASP 104 CO 0.03 0.64 -0.69 0.00 -3.12 0.00 0.00 179.24 176.10 2h6y h ALA 105 N 1.44 0.87 0.00 3.45 0.00 -1.09 -3.30 119.26 120.63 2h6y h ALA 105 Ca 0.42 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2h6y h ALA 105 Cb 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2h6y h ALA 105 CO -0.17 0.86 -1.31 0.09 0.00 0.00 0.00 179.25 178.72 2h6y n ASN 106 N -3.72 0.74 0.10 0.00 3.02 -0.93 -4.23 115.26 110.24 2h6y n ASN 106 Ca -0.01 -0.57 -0.05 0.00 -0.03 0.00 0.00 54.58 53.92 2h6y n ASN 106 Cb 0.67 1.36 0.05 0.00 -0.61 0.00 0.00 39.78 41.26 2h6y n ASN 106 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2h6y h LEU 107 N 0.00 0.12 0.00 3.41 3.38 -0.62 -3.49 115.31 118.11 2h6y h LEU 107 Ca 0.00 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2h6y h LEU 107 Cb 0.63 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2h6y h LEU 107 CO 0.00 0.84 0.00 0.00 0.09 0.00 0.00 178.44 179.37