#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jhm h HIS 5 N 0.00 0.50 0.39 1.96 -0.00 -2.03 -0.10 115.15 115.87 1jhm h HIS 5 Ca 0.00 -0.13 -0.01 0.00 -0.00 0.00 0.00 60.37 60.23 1jhm h HIS 5 Cb 0.00 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 27.28 1jhm h HIS 5 CO 0.00 0.73 -0.28 0.00 -0.00 0.00 0.00 177.93 178.37 1jhm h ALA 6 N 1.27 -0.66 -0.32 2.45 0.00 -2.05 0.40 119.26 120.35 1jhm h ALA 6 Ca 0.04 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.88 1jhm h ALA 6 Cb 0.78 0.37 -0.08 0.00 0.00 0.00 0.00 17.79 18.86 1jhm h ALA 6 CO 0.06 -0.89 -0.51 1.25 0.00 0.00 0.00 179.25 179.15 1jhm h LEU 7 N -0.66 -1.69 -1.17 0.00 5.85 -1.93 0.18 115.31 115.89 1jhm h LEU 7 Ca -0.04 0.22 0.12 0.00 0.84 0.00 0.00 57.88 59.03 1jhm h LEU 7 Cb 0.57 0.69 -0.07 0.00 0.37 0.00 0.00 40.66 42.22 1jhm h LEU 7 CO 0.01 -0.42 0.59 -0.07 -0.34 0.00 0.00 178.44 178.21 1jhm h LEU 8 N -0.44 0.79 -0.41 2.25 3.38 -0.68 -1.89 115.31 118.31 1jhm h LEU 8 Ca 0.08 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.12 1jhm h LEU 8 Cb 0.62 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 1jhm h LEU 8 CO -0.54 0.43 0.21 -0.09 0.09 0.00 0.00 178.44 178.54 1jhm h ARG 9 N 0.85 0.41 0.00 1.13 2.43 0.17 -2.98 114.38 116.39 1jhm h ARG 9 Ca 0.45 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.59 1jhm h ARG 9 Cb 0.53 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1jhm h ARG 9 CO -0.21 0.27 0.00 -0.25 -1.51 0.00 0.00 179.97 178.27 1jhm n ASP 10 N -4.92 0.00 -4.66 -3.80 10.43 -0.38 -4.84 116.55 108.38 1jhm n ASP 10 Ca 0.02 -1.09 -0.42 0.00 2.57 0.00 0.00 54.79 55.87 1jhm n ASP 10 Cb 0.10 0.00 -0.03 0.00 1.84 0.00 0.00 41.12 43.03 1jhm n ASP 10 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1jhm s ILE 11 N -2.00 3.34 0.41 0.53 1.01 -1.13 -4.92 121.20 118.44 1jhm s ILE 11 Ca 0.33 0.40 -0.24 0.00 0.00 0.00 0.00 60.65 61.14 1jhm s ILE 11 Cb 0.15 -3.27 -0.09 0.00 0.01 0.00 0.00 42.46 39.27 1jhm s ILE 11 CO 0.25 -0.04 1.08 -2.16 0.00 0.00 0.00 174.94 174.07 1jhm s PRO 12 N 4.31 4.08 0.67 2.79 0.04 -1.26 -5.04 135.00 140.59 1jhm s PRO 12 Ca 0.80 1.59 -0.11 0.00 0.04 0.00 0.00 61.00 63.32 1jhm s PRO 12 Cb -0.37 -2.53 -0.01 0.00 0.04 0.00 0.00 34.50 31.64 1jhm s PRO 12 CO 0.35 -0.24 1.06 0.00 0.04 0.00 0.00 177.00 178.21 1jhm s ALA 13 N -1.62 2.88 0.74 8.56 0.00 -1.26 -4.99 121.76 126.07 1jhm s ALA 13 Ca 0.59 -0.12 -0.12 0.00 0.00 0.00 0.00 51.96 52.31 1jhm s ALA 13 Cb -0.24 -3.09 0.04 0.00 0.00 0.00 0.00 23.12 19.83 1jhm s ALA 13 CO 0.30 -1.01 1.10 -2.14 0.00 0.00 0.00 175.76 174.01 1jhm s PRO 14 N -5.19 2.39 -0.63 0.00 0.02 -1.26 -4.81 135.00 125.53 1jhm s PRO 14 Ca 0.57 1.26 -0.20 0.00 0.02 0.00 0.00 61.00 62.65 1jhm s PRO 14 Cb -0.12 -1.91 0.09 0.00 0.02 0.00 0.00 34.50 32.59 1jhm s PRO 14 CO 0.54 -1.55 0.81 0.34 -0.33 0.00 0.00 177.00 176.80 1jhm s ASP 15 N -3.09 6.19 0.46 2.53 3.68 0.78 -4.89 116.67 122.34 1jhm s ASP 15 Ca 0.63 -1.31 0.16 0.00 2.13 0.00 0.00 52.55 54.17 1jhm s ASP 15 Cb -0.19 -2.34 1.09 0.00 -1.45 0.00 0.00 42.92 40.03 1jhm s ASP 15 CO 0.51 -1.23 2.02 0.00 0.13 0.00 0.00 175.17 176.60 1jhm h ALA 16 N 9.30 1.67 -0.30 3.66 0.00 -1.93 -1.43 119.26 130.23 1jhm h ALA 16 Ca -0.28 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.39 1jhm h ALA 16 Cb 1.08 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1jhm h ALA 16 CO 1.13 0.20 -0.19 1.49 0.00 0.00 0.00 179.25 181.88 1jhm h GLU 17 N 0.00 0.66 -0.75 0.00 4.22 -1.97 -0.92 114.58 115.81 1jhm h GLU 17 Ca -0.00 -0.31 -0.00 0.00 0.08 0.00 0.00 59.36 59.13 1jhm h GLU 17 Cb 0.29 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 1jhm h GLU 17 CO 0.02 0.90 0.47 0.00 -2.18 0.00 0.00 179.01 178.22 1jhm h ALA 18 N 0.74 0.96 -0.38 2.92 0.00 -1.70 -2.14 119.26 119.66 1jhm h ALA 18 Ca 0.06 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1jhm h ALA 18 Cb 0.72 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1jhm h ALA 18 CO 0.05 0.41 0.01 0.52 0.00 0.00 0.00 179.25 180.24 1jhm h MET 19 N 1.03 0.60 -0.39 0.00 2.86 -1.04 -0.16 114.93 117.82 1jhm h MET 19 Ca 0.27 -0.14 -0.15 0.00 -2.06 0.00 0.00 59.70 57.63 1jhm h MET 19 Cb -0.06 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.51 1jhm h MET 19 CO -0.05 0.62 -0.32 0.00 1.06 0.00 0.00 176.91 178.21 1jhm h ALA 20 N 1.44 0.57 -0.25 6.32 0.00 -0.79 -1.74 119.26 124.80 1jhm h ALA 20 Ca 0.12 -0.43 -0.11 0.00 0.00 0.00 0.00 54.91 54.49 1jhm h ALA 20 Cb 0.36 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1jhm h ALA 20 CO 0.01 0.63 -0.32 0.00 0.00 0.00 0.00 179.25 179.57 1jhm h ARG 21 N 0.73 0.53 -0.21 0.00 3.08 -0.91 -2.42 114.38 115.17 1jhm h ARG 21 Ca 0.07 -0.23 -0.03 0.00 0.07 0.00 0.00 59.98 59.86 1jhm h ARG 21 Cb 0.91 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.94 1jhm h ARG 21 CO 0.08 0.78 0.03 1.15 -1.07 0.00 0.00 179.97 180.95 1jhm h THR 22 N 0.45 1.23 0.14 2.04 2.02 -0.89 -2.44 112.91 115.46 1jhm h THR 22 Ca 0.05 -0.77 0.02 0.00 0.77 0.00 0.00 66.41 66.48 1jhm h THR 22 Cb 0.78 1.33 -0.03 0.00 -1.74 0.00 0.00 68.15 68.49 1jhm h THR 22 CO 0.06 0.24 -0.26 -0.61 0.37 0.00 0.00 175.52 175.33 1jhm h GLN 23 N 0.15 -0.46 -0.63 6.66 5.75 -1.20 -0.01 115.11 125.37 1jhm h GLN 23 Ca 0.06 0.03 0.13 0.00 -0.15 0.00 0.00 58.65 58.72 1jhm h GLN 23 Cb 0.33 0.10 -0.10 0.00 1.07 0.00 0.00 27.48 28.89 1jhm h GLN 23 CO 0.01 -0.30 0.07 1.96 -2.65 0.00 0.00 178.83 177.91 1jhm h GLN 24 N -0.47 0.18 -0.24 1.69 7.50 -1.42 0.63 115.11 122.97 1jhm h GLN 24 Ca 0.02 -0.01 0.01 0.00 0.50 0.00 0.00 58.65 59.17 1jhm h GLN 24 Cb 0.49 -0.04 -0.01 0.00 0.05 0.00 0.00 27.48 27.97 1jhm h GLN 24 CO -0.13 0.12 0.15 1.25 -1.50 0.00 0.00 178.83 178.71 1jhm h HIS 25 N 0.18 0.28 -0.35 2.96 -0.00 -0.89 -1.84 115.15 115.49 1jhm h HIS 25 Ca 0.33 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.70 1jhm h HIS 25 Cb 0.53 -0.09 -0.02 0.00 -0.00 0.00 0.00 27.41 27.83 1jhm h HIS 25 CO -0.31 0.17 0.17 0.82 -0.00 0.00 0.00 177.93 178.78 1jhm h ILE 26 N 0.30 1.12 0.00 6.26 2.04 -0.14 -1.34 117.51 125.76 1jhm h ILE 26 Ca 0.09 -0.34 -0.06 0.00 1.00 0.00 0.00 64.86 65.55 1jhm h ILE 26 Cb -0.02 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1jhm h ILE 26 CO -0.04 0.14 -0.30 0.44 0.00 0.00 0.00 178.15 178.39 1jhm h ASP 27 N 0.49 0.00 0.19 1.72 3.45 -0.07 -2.92 116.42 119.28 1jhm h ASP 27 Ca 0.13 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.59 1jhm h ASP 27 Cb 0.05 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.82 1jhm h ASP 27 CO -0.02 0.30 -0.07 0.61 -1.57 0.00 0.00 179.24 178.49 1jhm n GLY 28 N -0.39 -0.70 3.76 2.75 0.00 -0.51 -4.76 105.19 105.33 1jhm n GLY 28 Ca -0.02 -0.31 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 1jhm n GLY 28 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jhm s LEU 29 N -2.27 2.89 -0.22 0.99 1.02 -1.11 -1.10 118.68 118.89 1jhm s LEU 29 Ca 0.35 1.75 -0.26 0.00 0.02 0.00 0.00 54.13 55.99 1jhm s LEU 29 Cb 0.21 -4.40 -0.29 0.00 0.02 0.00 0.00 46.19 41.73 1jhm s LEU 29 CO 0.42 -2.13 1.65 0.18 0.02 0.00 0.00 176.35 176.49 1jhm n LEU 30 N -3.58 1.83 -3.61 1.79 4.77 0.41 -4.29 117.00 114.32 1jhm n LEU 30 Ca 0.09 -1.86 -0.04 0.00 -0.03 0.00 0.00 56.01 54.17 1jhm n LEU 30 Cb 0.53 -0.67 -0.02 0.00 -2.33 0.00 0.00 43.42 40.94 1jhm n LEU 30 CO 0.54 -1.46 0.88 -1.59 -1.33 0.00 0.00 177.39 174.43 1jhm s LYS 31 N 6.25 0.65 0.26 3.23 -2.85 -1.26 -5.01 119.74 121.01 1jhm s LYS 31 Ca 0.60 -0.30 -0.29 0.00 -1.00 0.00 0.00 55.97 54.98 1jhm s LYS 31 Cb 0.14 0.26 -0.09 0.00 -2.06 0.00 0.00 37.83 36.07 1jhm s LYS 31 CO 0.26 -0.29 1.25 -2.14 0.10 0.00 0.00 175.35 174.53 1jhm s PRO 32 N -2.78 4.44 0.23 1.78 0.02 -1.26 -4.90 135.00 132.53 1jhm s PRO 32 Ca 0.10 2.04 -0.32 0.00 0.02 0.00 0.00 61.00 62.84 1jhm s PRO 32 Cb 0.00 -3.15 -0.13 0.00 0.02 0.00 0.00 34.50 31.24 1jhm s PRO 32 CO -0.04 -0.11 1.50 -2.30 -0.33 0.00 0.00 177.00 175.72 1jhm n PRO 33 N 1.65 2.24 -0.76 5.54 -0.02 -1.26 -0.98 135.00 141.40 1jhm n PRO 33 Ca 0.02 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 1jhm n PRO 33 Cb 0.43 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 1jhm n PRO 33 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jhm n GLY 34 N 2.52 1.26 0.28 -1.23 0.00 -1.26 -4.91 105.19 101.85 1jhm n GLY 34 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.28 1jhm n GLY 34 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1jhm h SER 35 N 0.00 0.00 -0.31 1.61 4.64 -1.43 -1.78 113.55 116.28 1jhm h SER 35 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1jhm h SER 35 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1jhm h SER 35 CO 0.00 0.03 0.00 0.18 -0.87 0.00 0.00 176.83 176.17 1jhm n LEU 36 N -3.91 2.17 0.00 5.97 4.32 -1.26 -4.98 117.00 119.31 1jhm n LEU 36 Ca -0.03 -0.99 0.00 0.00 -0.02 0.00 0.00 56.01 54.97 1jhm n LEU 36 Cb 0.11 -0.20 0.00 0.00 -1.62 0.00 0.00 43.42 41.71 1jhm n LEU 36 CO 0.29 0.50 0.00 0.61 -1.22 0.00 0.00 177.39 177.57 1jhm n GLY 37 N 1.20 2.03 0.32 -0.72 0.00 -0.67 -1.40 105.19 105.95 1jhm n GLY 37 Ca 0.16 0.45 0.17 0.00 0.00 0.00 0.00 46.02 46.80 1jhm n GLY 37 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1jhm h ARG 38 N 0.00 0.00 -0.40 1.61 2.43 -1.93 -0.95 114.38 115.13 1jhm h ARG 38 Ca 0.00 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 1jhm h ARG 38 Cb 0.00 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 1jhm h ARG 38 CO 0.00 0.00 -0.11 1.25 -1.51 0.00 0.00 179.97 179.60 1jhm h LEU 39 N 0.00 0.70 0.16 3.80 5.85 -1.66 0.27 115.31 124.44 1jhm h LEU 39 Ca 0.02 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 1jhm h LEU 39 Cb 0.13 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.97 1jhm h LEU 39 CO -0.00 0.83 -0.08 -0.33 -0.34 0.00 0.00 178.44 178.52 1jhm h GLU 40 N 0.65 -0.21 -0.49 1.25 5.08 -1.25 -2.47 114.58 117.14 1jhm h GLU 40 Ca 0.11 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.58 1jhm h GLU 40 Cb 0.56 0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.77 1jhm h GLU 40 CO 0.03 0.21 -0.04 1.15 -1.00 0.00 0.00 179.01 179.37 1jhm h THR 41 N -0.77 0.58 0.00 1.13 2.02 -1.50 -0.26 112.91 114.11 1jhm h THR 41 Ca -0.02 -0.03 0.03 0.00 0.77 0.00 0.00 66.41 67.16 1jhm h THR 41 Cb 0.52 0.50 -0.05 0.00 -1.74 0.00 0.00 68.15 67.38 1jhm h THR 41 CO 0.04 0.01 -0.39 0.25 0.37 0.00 0.00 175.52 175.80 1jhm h LEU 42 N 0.07 -1.17 -0.96 2.58 5.85 -0.95 0.46 115.31 121.21 1jhm h LEU 42 Ca 0.24 0.14 0.18 0.00 0.84 0.00 0.00 57.88 59.29 1jhm h LEU 42 Cb 0.37 0.46 -0.10 0.00 0.37 0.00 0.00 40.66 41.75 1jhm h LEU 42 CO -0.44 -0.44 0.55 0.00 -0.34 0.00 0.00 178.44 177.78 1jhm h ALA 43 N 0.06 1.55 -0.16 1.25 0.00 -0.82 0.19 119.26 121.33 1jhm h ALA 43 Ca 0.05 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 1jhm h ALA 43 Cb 0.63 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1jhm h ALA 43 CO -0.30 -0.07 -0.38 0.28 0.00 0.00 0.00 179.25 178.78 1jhm h VAL 44 N 0.71 1.30 -0.28 0.00 2.07 -0.28 -1.93 116.25 117.84 1jhm h VAL 44 Ca 0.55 -1.49 -0.04 0.00 0.82 0.00 0.00 66.70 66.54 1jhm h VAL 44 Cb 0.84 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 1jhm h VAL 44 CO -0.39 0.45 0.03 -0.61 0.02 0.00 0.00 177.57 177.07 1jhm h GLN 45 N 0.30 0.48 -0.79 1.57 4.15 0.15 -2.84 115.11 118.13 1jhm h GLN 45 Ca 0.03 -0.14 0.01 0.00 0.77 0.00 0.00 58.65 59.32 1jhm h GLN 45 Cb 0.81 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 28.41 1jhm h GLN 45 CO 0.06 0.61 0.52 -0.07 -1.93 0.00 0.00 178.83 178.02 1jhm h LEU 46 N 0.28 0.89 -2.21 -2.39 3.38 -1.04 -2.38 115.31 111.83 1jhm h LEU 46 Ca 0.08 -0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.09 1jhm h LEU 46 Cb 0.38 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1jhm h LEU 46 CO 0.01 0.64 0.20 0.00 0.09 0.00 0.00 178.44 179.38 1jhm h ALA 47 N 1.30 1.83 -0.00 1.53 0.00 -1.12 0.97 119.26 123.76 1jhm h ALA 47 Ca 0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1jhm h ALA 47 Cb -0.10 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1jhm h ALA 47 CO -0.07 -0.30 -0.26 0.41 0.00 0.00 0.00 179.25 179.03 1jhm n GLY 48 N -1.41 -1.10 3.60 0.00 0.00 -0.90 -4.26 105.19 101.11 1jhm n GLY 48 Ca 0.02 -0.29 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 1jhm n GLY 48 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1jhm s MET 49 N -2.77 3.68 0.28 1.61 -1.94 0.33 -0.15 119.30 120.33 1jhm s MET 49 Ca 0.19 0.68 0.00 0.00 -1.71 0.00 0.00 55.69 54.85 1jhm s MET 49 Cb 0.19 -3.94 0.64 0.00 2.01 0.00 0.00 34.83 33.72 1jhm s MET 49 CO 0.58 -1.44 1.67 -1.35 -0.01 0.00 0.00 175.02 174.46 1jhm h PRO 50 N 9.68 0.26 0.00 2.03 0.11 -1.86 0.38 132.00 142.61 1jhm h PRO 50 Ca -0.24 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1jhm h PRO 50 Cb 1.07 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1jhm h PRO 50 CO 1.12 0.17 0.00 0.41 -0.21 0.00 0.00 178.00 179.49 1jhm n GLY 51 N -1.36 -0.52 0.62 -0.55 0.00 -0.06 -2.02 105.19 101.30 1jhm n GLY 51 Ca 0.19 -0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.31 1jhm n GLY 51 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jhm n LEU 52 N -1.31 2.06 -2.60 0.99 4.32 0.13 -4.98 117.00 115.62 1jhm n LEU 52 Ca 0.03 -0.69 -0.13 0.00 -0.02 0.00 0.00 56.01 55.20 1jhm n LEU 52 Cb 0.05 -0.02 0.06 0.00 -1.62 0.00 0.00 43.42 41.89 1jhm n LEU 52 CO 0.05 0.35 0.11 0.59 -1.22 0.00 0.00 177.39 177.28 1jhm n ASN 53 N 0.44 -3.22 -0.63 -1.43 3.02 -0.86 -3.50 115.26 109.09 1jhm n ASN 53 Ca 0.14 -0.39 -0.08 0.00 -0.03 0.00 0.00 54.58 54.22 1jhm n ASN 53 Cb 0.46 -3.56 -0.04 0.00 -0.61 0.00 0.00 39.78 36.04 1jhm n ASN 53 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jhm n GLY 54 N -1.26 0.81 3.27 7.41 0.00 -1.26 -4.95 105.19 109.22 1jhm n GLY 54 Ca -0.11 -0.03 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 1jhm n GLY 54 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1jhm s THR 55 N -1.76 0.08 -0.20 2.61 -1.32 -1.23 -4.91 115.64 108.90 1jhm s THR 55 Ca 0.00 -0.62 -0.29 0.00 -1.21 0.00 0.00 61.69 59.57 1jhm s THR 55 Cb 0.00 -0.97 -0.02 0.00 -1.51 0.00 0.00 72.50 70.00 1jhm s THR 55 CO 0.00 -0.34 1.52 -2.16 -2.21 0.00 0.00 174.62 171.43 1jhm s PRO 56 N -2.66 3.93 0.13 7.08 0.04 -1.26 -4.51 135.00 137.75 1jhm s PRO 56 Ca -0.04 1.66 -0.20 0.00 0.04 0.00 0.00 61.00 62.46 1jhm s PRO 56 Cb -0.00 -3.97 0.05 0.00 0.04 0.00 0.00 34.50 30.62 1jhm s PRO 56 CO -0.04 -1.12 0.52 1.14 0.04 0.00 0.00 177.00 177.53 1jhm s GLN 57 N 4.34 1.17 -0.13 4.56 -2.07 -1.26 -4.78 119.66 121.49 1jhm s GLN 57 Ca 0.67 -0.52 -0.02 0.00 -1.82 0.00 0.00 55.36 53.67 1jhm s GLN 57 Cb -0.24 0.53 0.04 0.00 -1.09 0.00 0.00 33.01 32.25 1jhm s GLN 57 CO 0.26 -0.48 0.01 0.08 -1.32 0.00 0.00 175.29 173.84 1jhm s VAL 58 N -3.57 0.49 0.00 3.63 1.01 -1.26 -4.98 120.40 115.72 1jhm s VAL 58 Ca 0.01 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.78 1jhm s VAL 58 Cb 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 36.38 35.59 1jhm s VAL 58 CO -0.11 0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.67 1jhm n GLY 59 N 5.09 0.75 3.89 4.51 0.00 -1.26 -5.03 105.19 113.14 1jhm n GLY 59 Ca -0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.65 1jhm n GLY 59 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jhm s GLU 60 N 1.46 3.27 -0.01 1.61 0.41 -0.51 -4.82 118.70 120.11 1jhm s GLU 60 Ca 0.00 0.35 0.03 0.00 -0.41 0.00 0.00 54.97 54.94 1jhm s GLU 60 Cb 0.00 -2.20 -0.01 0.00 -1.78 0.00 0.00 34.13 30.14 1jhm s GLU 60 CO 0.00 -0.59 -0.11 0.15 -0.49 0.00 0.00 175.26 174.23 1jhm s LYS 61 N -5.04 0.86 0.00 1.61 1.02 -1.26 -0.70 119.74 116.23 1jhm s LYS 61 Ca 0.53 -0.38 -0.01 0.00 0.02 0.00 0.00 55.97 56.13 1jhm s LYS 61 Cb -0.11 -0.83 -0.01 0.00 -0.52 0.00 0.00 37.83 36.36 1jhm s LYS 61 CO 0.49 0.23 0.02 0.00 -0.92 0.00 0.00 175.35 175.16 1jhm s ALA 62 N -0.24 -0.03 -0.25 5.17 0.00 -0.46 -0.90 121.76 125.05 1jhm s ALA 62 Ca 0.04 -0.21 -0.02 0.00 0.00 0.00 0.00 51.96 51.77 1jhm s ALA 62 Cb -0.04 0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.15 1jhm s ALA 62 CO -0.00 -0.10 -0.05 0.08 0.00 0.00 0.00 175.76 175.69 1jhm s VAL 63 N -0.76 2.94 -0.22 0.00 1.01 0.50 -0.29 120.40 123.58 1jhm s VAL 63 Ca -0.08 -1.01 -0.21 0.00 0.00 0.00 0.00 61.98 60.68 1jhm s VAL 63 Cb -0.05 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 1jhm s VAL 63 CO -0.00 0.19 0.65 -0.76 0.00 0.00 0.00 175.10 175.17 1jhm s LEU 64 N 1.33 4.11 -0.28 3.92 1.43 -0.50 -0.41 118.68 128.28 1jhm s LEU 64 Ca 0.00 0.80 -0.05 0.00 -1.03 0.00 0.00 54.13 53.86 1jhm s LEU 64 Cb -0.17 -2.90 0.01 0.00 0.03 0.00 0.00 46.19 43.16 1jhm s LEU 64 CO -0.04 -0.33 0.03 -0.69 0.23 0.00 0.00 176.35 175.55 1jhm s VAL 65 N 2.21 3.63 -0.28 -1.59 1.01 0.32 -1.22 120.40 124.48 1jhm s VAL 65 Ca 0.28 -0.76 -0.17 0.00 0.00 0.00 0.00 61.98 61.33 1jhm s VAL 65 Cb -0.16 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.35 1jhm s VAL 65 CO 0.09 0.14 0.47 -0.04 0.00 0.00 0.00 175.10 175.76 1jhm s MET 66 N 1.45 3.99 -0.07 2.72 1.00 -0.57 0.55 119.30 128.37 1jhm s MET 66 Ca 0.02 0.17 0.02 0.00 0.00 0.00 0.00 55.69 55.90 1jhm s MET 66 Cb -0.17 -3.67 -0.03 0.00 0.00 0.00 0.00 34.83 30.96 1jhm s MET 66 CO 0.00 -0.37 -0.12 0.00 0.00 0.00 0.00 175.02 174.54 1jhm s ALA 68 N -0.56 -2.01 0.31 0.00 0.00 -0.28 -0.71 121.76 118.52 1jhm s ALA 68 Ca 0.08 1.59 0.06 0.00 0.00 0.00 0.00 51.96 53.69 1jhm s ALA 68 Cb -0.12 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.42 1jhm s ALA 68 CO 0.02 -0.43 0.44 -0.51 0.00 0.00 0.00 175.76 175.28 1jhm s ASP 69 N -1.59 6.09 -0.03 0.00 -0.00 -0.42 -3.94 116.67 116.78 1jhm s ASP 69 Ca 0.05 -0.08 0.04 0.00 -0.00 0.00 0.00 52.55 52.56 1jhm s ASP 69 Cb -0.01 -1.46 -0.00 0.00 -0.00 0.00 0.00 42.92 41.45 1jhm s ASP 69 CO -0.04 -0.31 -0.13 -1.00 -0.00 0.00 0.00 175.17 173.68 1jhm s HIS 70 N -2.12 1.33 0.47 4.23 3.76 -1.26 -1.88 115.29 119.83 1jhm s HIS 70 Ca 0.41 -0.35 0.16 0.00 -0.15 0.00 0.00 55.06 55.13 1jhm s HIS 70 Cb -0.09 -0.91 1.12 0.00 1.11 0.00 0.00 32.58 33.81 1jhm s HIS 70 CO 0.31 -0.12 2.05 0.78 -0.85 0.00 0.00 174.74 176.91 1jhm h GLY 71 N 6.24 0.00 2.00 -2.22 0.00 -1.35 -2.10 103.07 105.64 1jhm h GLY 71 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1jhm h GLY 71 CO 0.48 0.00 0.00 1.55 0.00 0.00 0.00 176.54 178.57 1jhm n VAL 72 N -4.37 1.45 0.07 4.60 3.14 -1.26 -2.33 118.33 119.63 1jhm n VAL 72 Ca -0.03 0.51 0.14 0.00 -2.96 0.00 0.00 64.34 62.00 1jhm n VAL 72 Cb 0.19 -1.46 0.63 0.00 -1.06 0.00 0.00 33.84 32.14 1jhm n VAL 72 CO 0.00 0.00 0.00 -0.25 -6.46 0.00 0.00 176.83 170.12 1jhm h TRP 73 N 0.00 0.09 0.00 1.45 7.01 -1.70 -0.35 115.95 122.44 1jhm h TRP 73 Ca 0.00 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1jhm h TRP 73 Cb 0.07 -0.03 0.00 0.00 -2.10 0.00 0.00 29.16 27.11 1jhm h TRP 73 CO 0.00 0.04 0.00 -0.25 -2.79 0.00 0.00 178.44 175.44 1jhm n ASP 74 N -4.45 0.00 -0.22 2.65 8.00 -0.99 -2.24 116.55 119.30 1jhm n ASP 74 Ca 0.05 0.15 0.12 0.00 0.71 0.00 0.00 54.79 55.82 1jhm n ASP 74 Cb 0.38 -0.33 0.60 0.00 -0.02 0.00 0.00 41.12 41.74 1jhm n ASP 74 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1jhm n GLU 75 N -1.33 1.30 -2.02 -1.24 -0.58 -0.14 -4.90 120.64 111.72 1jhm n GLU 75 Ca 0.07 -0.44 -0.09 0.00 -0.42 0.00 0.00 57.16 56.28 1jhm n GLU 75 Cb 0.14 -1.40 -0.01 0.00 -0.57 0.00 0.00 31.44 29.60 1jhm n GLU 75 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1jhm n GLY 76 N 0.99 0.18 0.16 0.62 0.00 -0.95 -4.93 105.19 101.26 1jhm n GLY 76 Ca 0.18 -0.54 0.14 0.00 0.00 0.00 0.00 46.02 45.79 1jhm n GLY 76 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1jhm n VAL 77 N -3.81 0.00 -4.00 1.61 0.24 -1.26 -4.87 118.33 106.24 1jhm n VAL 77 Ca -0.10 -0.09 -0.18 0.00 -2.04 0.00 0.00 64.34 61.94 1jhm n VAL 77 Cb 0.53 0.10 -0.16 0.00 -1.47 0.00 0.00 33.84 32.84 1jhm n VAL 77 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jhm s ALA 78 N -2.50 0.40 -0.53 2.33 0.00 -1.26 -4.94 121.76 115.27 1jhm s ALA 78 Ca 0.27 0.09 0.24 0.00 0.00 0.00 0.00 51.96 52.56 1jhm s ALA 78 Cb 0.20 -0.32 0.33 0.00 0.00 0.00 0.00 23.12 23.33 1jhm s ALA 78 CO 0.50 -0.04 1.37 -0.39 0.00 0.00 0.00 175.76 177.19 1jhm h VAL 79 N 6.14 0.00 -3.65 0.00 -1.51 -1.89 -3.45 116.25 111.88 1jhm h VAL 79 Ca -0.41 -0.68 -0.51 0.00 -1.23 0.00 0.00 66.70 63.87 1jhm h VAL 79 Cb 1.14 1.37 0.02 0.00 -2.13 0.00 0.00 31.29 31.69 1jhm h VAL 79 CO 0.48 0.00 0.51 -0.44 -1.23 0.00 0.00 177.57 176.89 1jhm s SER 80 N -4.83 7.20 0.28 4.19 0.01 -1.26 -4.98 113.70 114.30 1jhm s SER 80 Ca 0.05 2.23 -0.29 0.00 1.31 0.00 0.00 55.95 59.25 1jhm s SER 80 Cb 0.11 -2.62 -0.10 0.00 0.21 0.00 0.00 66.02 63.63 1jhm s SER 80 CO 0.71 -0.24 1.35 -2.84 0.41 0.00 0.00 173.24 172.62 1jhm s PRO 81 N -0.83 4.34 0.29 12.44 0.02 -1.26 -4.91 135.00 145.09 1jhm s PRO 81 Ca 0.48 2.20 -0.00 0.00 0.02 0.00 0.00 61.00 63.70 1jhm s PRO 81 Cb -0.32 -3.11 0.67 0.00 0.02 0.00 0.00 34.50 31.77 1jhm s PRO 81 CO 0.39 -0.27 1.59 -0.22 -0.33 0.00 0.00 177.00 178.16 1jhm h LYS 82 N 4.35 0.04 0.00 5.54 3.64 -1.94 0.89 116.57 129.10 1jhm h LYS 82 Ca -0.47 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1jhm h LYS 82 Cb 1.22 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1jhm h LYS 82 CO 0.72 0.03 0.00 0.44 -2.27 0.00 0.00 179.45 178.37 1jhm n ILE 83 N -5.45 1.23 -0.04 2.00 -5.35 -1.26 -2.33 119.36 108.17 1jhm n ILE 83 Ca 0.21 0.55 0.07 0.00 -0.27 0.00 0.00 62.75 63.31 1jhm n ILE 83 Cb 0.69 -1.51 0.46 0.00 -1.74 0.00 0.00 39.64 37.53 1jhm n ILE 83 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 1jhm h VAL 84 N 0.00 1.01 0.06 7.28 2.07 -1.18 0.26 116.25 125.75 1jhm h VAL 84 Ca 0.00 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.37 1jhm h VAL 84 Cb 0.09 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 1jhm h VAL 84 CO 0.00 0.09 -0.20 0.74 0.02 0.00 0.00 177.57 178.22 1jhm h THR 85 N 0.49 0.55 -0.42 2.57 2.02 -1.67 -0.27 112.91 116.18 1jhm h THR 85 Ca 0.21 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.37 1jhm h THR 85 Cb 0.20 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 1jhm h THR 85 CO -0.05 0.00 0.19 0.00 0.37 0.00 0.00 175.52 176.02 1jhm h ALA 86 N 0.50 0.55 0.47 6.16 0.00 -1.61 -0.72 119.26 124.61 1jhm h ALA 86 Ca 0.04 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1jhm h ALA 86 Cb 0.39 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1jhm h ALA 86 CO -0.14 0.13 -0.46 0.82 0.00 0.00 0.00 179.25 179.60 1jhm h ILE 87 N 0.54 0.09 -0.87 0.00 2.04 -0.72 -2.27 117.51 116.33 1jhm h ILE 87 Ca 0.14 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.08 1jhm h ILE 87 Cb 0.16 0.09 -0.06 0.00 -0.74 0.00 0.00 36.82 36.26 1jhm h ILE 87 CO -0.01 0.00 0.56 1.56 0.00 0.00 0.00 178.15 180.26 1jhm h GLN 88 N -0.94 0.90 -0.75 2.37 1.08 -1.01 -0.65 115.11 116.11 1jhm h GLN 88 Ca -0.05 -0.05 0.03 0.00 -1.45 0.00 0.00 58.65 57.13 1jhm h GLN 88 Cb 0.82 -0.20 -0.05 0.00 -0.05 0.00 0.00 27.48 28.00 1jhm h GLN 88 CO -0.06 0.60 0.48 0.00 -0.95 0.00 0.00 178.83 178.89 1jhm h ALA 89 N 1.54 0.99 -0.65 3.87 0.00 -0.92 0.29 119.26 124.38 1jhm h ALA 89 Ca 0.38 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.18 1jhm h ALA 89 Cb 0.27 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1jhm h ALA 89 CO -0.15 0.27 0.09 0.00 0.00 0.00 0.00 179.25 179.47 1jhm h ALA 90 N 1.32 0.86 -0.82 0.00 0.00 -0.58 -2.06 119.26 117.98 1jhm h ALA 90 Ca 0.30 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 54.99 1jhm h ALA 90 Cb 0.02 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 1jhm h ALA 90 CO -0.11 0.63 0.53 -0.91 0.00 0.00 0.00 179.25 179.40 1jhm h ASN 91 N 0.99 0.82 -0.38 0.00 2.35 -0.03 0.70 115.58 120.03 1jhm h ASN 91 Ca 0.19 -0.00 0.11 0.00 -0.55 0.00 0.00 56.30 56.05 1jhm h ASN 91 Cb 0.46 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.63 1jhm h ASN 91 CO 0.02 0.54 0.33 0.24 -1.65 0.00 0.00 177.43 176.91 1jhm h MET 92 N 0.94 0.00 0.00 0.81 2.86 0.27 0.17 114.93 119.98 1jhm h MET 92 Ca 0.34 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.89 1jhm h MET 92 Cb 0.16 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1jhm h MET 92 CO -0.11 0.00 -0.45 1.79 1.06 0.00 0.00 176.91 179.19 1jhm h THR 93 N 0.00 0.86 -0.17 2.22 1.35 -0.84 -3.21 112.91 113.12 1jhm h THR 93 Ca 0.18 -1.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.09 1jhm h THR 93 Cb 0.84 2.23 0.00 0.00 -1.73 0.00 0.00 68.15 69.50 1jhm h THR 93 CO -0.00 0.44 0.00 0.54 -0.25 0.00 0.00 175.52 176.25 1jhm n ARG 94 N -3.33 2.04 -1.36 4.72 5.12 0.55 -4.95 116.66 119.45 1jhm n ARG 94 Ca 0.01 -1.54 -0.12 0.00 -1.93 0.00 0.00 57.85 54.26 1jhm n ARG 94 Cb 0.65 -1.46 -0.05 0.00 -1.16 0.00 0.00 32.46 30.44 1jhm n ARG 94 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1jhm n GLY 95 N 1.28 1.34 0.35 -0.13 0.00 -1.03 -4.92 105.19 102.08 1jhm n GLY 95 Ca 0.17 -0.45 0.12 0.00 0.00 0.00 0.00 46.02 45.86 1jhm n GLY 95 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jhm n THR 96 N -2.64 0.00 -1.79 2.61 -2.24 -1.23 -4.35 114.28 104.65 1jhm n THR 96 Ca -0.12 -0.18 -0.30 0.00 -2.27 0.00 0.00 64.05 61.17 1jhm n THR 96 Cb 0.41 0.93 0.06 0.00 -2.10 0.00 0.00 70.33 69.63 1jhm n THR 96 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1jhm s THR 97 N -2.57 3.35 0.15 4.28 -4.23 -1.26 -4.88 115.64 110.48 1jhm s THR 97 Ca 0.19 0.44 -0.17 0.00 -1.18 0.00 0.00 61.69 60.97 1jhm s THR 97 Cb 0.18 -3.36 -0.00 0.00 1.34 0.00 0.00 72.50 70.66 1jhm s THR 97 CO 0.60 -0.57 1.80 1.23 -0.54 0.00 0.00 174.62 177.13 1jhm h GLY 98 N -0.78 0.52 1.44 3.99 0.00 -1.98 0.09 103.07 106.34 1jhm h GLY 98 Ca -0.45 -0.20 -0.04 0.00 0.00 0.00 0.00 47.33 46.64 1jhm h GLY 98 CO 0.62 0.19 0.15 -0.24 0.00 0.00 0.00 176.54 177.27 1jhm h VAL 99 N 0.49 1.20 -0.45 4.60 3.04 -1.88 -1.19 116.25 122.06 1jhm h VAL 99 Ca 0.13 -0.67 -0.02 0.00 -1.01 0.00 0.00 66.70 65.13 1jhm h VAL 99 Cb -0.04 0.67 -0.02 0.00 -2.01 0.00 0.00 31.29 29.88 1jhm h VAL 99 CO -0.03 0.25 0.22 0.00 -1.01 0.00 0.00 177.57 177.00 1jhm h VAL 101 N 0.59 1.23 -0.17 0.00 2.07 -0.57 -1.83 116.25 117.56 1jhm h VAL 101 Ca 0.16 -0.80 -0.20 0.00 0.82 0.00 0.00 66.70 66.68 1jhm h VAL 101 Cb 0.12 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1jhm h VAL 101 CO -0.02 0.28 -0.70 -0.07 0.02 0.00 0.00 177.57 177.08 1jhm h LEU 102 N 0.52 0.84 -0.28 2.57 3.38 -1.06 -2.62 115.31 118.65 1jhm h LEU 102 Ca 0.13 -0.52 -0.01 0.00 0.09 0.00 0.00 57.88 57.57 1jhm h LEU 102 Cb 0.32 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1jhm h LEU 102 CO 0.00 1.30 0.14 0.00 0.09 0.00 0.00 178.44 179.97 1jhm h ALA 103 N 0.70 0.36 -0.91 1.53 0.00 -0.28 -1.85 119.26 118.81 1jhm h ALA 103 Ca -0.03 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 54.89 1jhm h ALA 103 Cb 1.30 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.91 1jhm h ALA 103 CO 0.14 -0.09 0.56 0.00 0.00 0.00 0.00 179.25 179.86 1jhm h ALA 104 N 1.01 1.31 -0.62 0.00 0.00 -1.34 0.23 119.26 119.84 1jhm h ALA 104 Ca 0.10 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1jhm h ALA 104 Cb 0.09 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1jhm h ALA 104 CO -0.01 0.23 0.39 1.96 0.00 0.00 0.00 179.25 181.81 1jhm h GLN 105 N 0.95 0.84 -0.01 0.00 1.08 -1.06 -2.19 115.11 114.72 1jhm h GLN 105 Ca 0.43 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.56 1jhm h GLN 105 Cb 0.33 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 27.58 1jhm h GLN 105 CO -0.23 0.58 -0.17 0.00 -0.95 0.00 0.00 178.83 178.06 1jhm n ALA 106 N -2.44 2.91 -1.80 3.87 0.00 -0.06 -4.95 120.51 118.05 1jhm n ALA 106 Ca 0.06 -0.36 -0.09 0.00 0.00 0.00 0.00 53.44 53.05 1jhm n ALA 106 Cb 0.06 -1.21 -0.02 0.00 0.00 0.00 0.00 19.45 18.29 1jhm n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jhm n GLY 107 N 1.30 0.46 3.92 0.00 0.00 0.60 -4.95 105.19 106.52 1jhm n GLY 107 Ca 0.14 -0.54 -0.24 0.00 0.00 0.00 0.00 46.02 45.38 1jhm n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jhm s ALA 108 N -2.42 3.87 -0.17 4.61 0.00 -0.14 -4.66 121.76 122.84 1jhm s ALA 108 Ca 0.00 -1.16 -0.07 0.00 0.00 0.00 0.00 51.96 50.73 1jhm s ALA 108 Cb 0.00 -1.66 -0.04 0.00 0.00 0.00 0.00 23.12 21.42 1jhm s ALA 108 CO 0.00 0.40 0.05 0.15 0.00 0.00 0.00 175.76 176.36 1jhm s LYS 109 N -3.53 3.90 -0.07 0.00 1.02 -0.08 -4.13 119.74 116.84 1jhm s LYS 109 Ca 0.34 -0.36 -0.20 0.00 0.02 0.00 0.00 55.97 55.77 1jhm s LYS 109 Cb -0.10 -3.16 -0.04 0.00 -0.52 0.00 0.00 37.83 34.00 1jhm s LYS 109 CO 0.28 0.30 0.58 0.08 -0.92 0.00 0.00 175.35 175.67 1jhm s VAL 110 N 0.28 5.07 -0.25 3.17 1.01 -1.26 -0.37 120.40 128.04 1jhm s VAL 110 Ca 0.03 1.18 0.02 0.00 0.00 0.00 0.00 61.98 63.21 1jhm s VAL 110 Cb -0.12 -3.92 0.05 0.00 0.00 0.00 0.00 36.38 32.39 1jhm s VAL 110 CO 0.01 0.33 -0.11 -1.00 0.00 0.00 0.00 175.10 174.33 1jhm s HIS 111 N 0.43 3.15 -0.31 5.22 3.76 0.45 -4.93 115.29 123.06 1jhm s HIS 111 Ca 0.31 -2.05 -0.20 0.00 -0.15 0.00 0.00 55.06 52.97 1jhm s HIS 111 Cb -0.17 -1.96 -0.01 0.00 1.11 0.00 0.00 32.58 31.55 1jhm s HIS 111 CO 0.15 -0.84 0.60 0.08 -0.85 0.00 0.00 174.74 173.88 1jhm s VAL 112 N 1.18 4.96 -0.13 -0.90 1.01 -1.26 0.12 120.40 125.37 1jhm s VAL 112 Ca -0.05 0.77 0.01 0.00 0.00 0.00 0.00 61.98 62.72 1jhm s VAL 112 Cb -0.18 -3.98 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 1jhm s VAL 112 CO -0.06 -0.14 -0.16 -0.63 0.00 0.00 0.00 175.10 174.11 1jhm s ILE 113 N 2.56 2.70 -0.43 2.22 1.09 0.19 -1.24 121.20 128.30 1jhm s ILE 113 Ca 0.24 -0.78 -0.19 0.00 -1.10 0.00 0.00 60.65 58.83 1jhm s ILE 113 Cb -0.15 -2.12 0.02 0.00 -1.06 0.00 0.00 42.46 39.16 1jhm s ILE 113 CO 0.12 0.53 0.51 -0.62 -0.10 0.00 0.00 174.94 175.38 1jhm s ASP 114 N 0.50 6.24 0.00 3.58 3.68 0.16 -0.59 116.67 130.24 1jhm s ASP 114 Ca -0.11 -0.54 0.15 0.00 2.13 0.00 0.00 52.55 54.18 1jhm s ASP 114 Cb -0.16 -2.26 0.06 0.00 -1.45 0.00 0.00 42.92 39.11 1jhm s ASP 114 CO 0.05 -0.65 0.89 1.33 0.13 0.00 0.00 175.17 176.91 1jhm n VAL 115 N 5.59 0.00 0.00 1.11 0.24 0.11 -0.02 118.33 125.37 1jhm n VAL 115 Ca -0.05 -0.42 0.00 0.00 -2.04 0.00 0.00 64.34 61.83 1jhm n VAL 115 Cb 0.48 1.24 0.00 0.00 -1.47 0.00 0.00 33.84 34.09 1jhm n VAL 115 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jhm n GLY 116 N 0.97 0.00 3.75 7.63 0.00 -1.06 -1.05 105.19 115.43 1jhm n GLY 116 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1jhm n GLY 116 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jhm s ILE 117 N 0.00 3.82 -1.26 -0.61 1.01 -1.25 -1.30 121.20 121.61 1jhm s ILE 117 Ca 0.00 1.70 -0.11 0.00 0.00 0.00 0.00 60.65 62.23 1jhm s ILE 117 Cb 0.00 -4.08 0.16 0.00 0.01 0.00 0.00 42.46 38.55 1jhm s ILE 117 CO 0.00 0.35 1.71 -0.67 0.00 0.00 0.00 174.94 176.33 1jhm n ASP 118 N 1.84 5.12 -3.51 3.58 4.64 -1.26 -4.16 116.55 122.79 1jhm n ASP 118 Ca 0.01 -3.05 -0.02 0.00 -1.38 0.00 0.00 54.79 50.34 1jhm n ASP 118 Cb 0.46 -1.52 0.01 0.00 -1.04 0.00 0.00 41.12 39.02 1jhm n ASP 118 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1jhm s ALA 119 N 0.99 -1.72 0.86 -1.67 0.00 -1.26 -4.98 121.76 113.98 1jhm s ALA 119 Ca 0.41 -0.11 -0.11 0.00 0.00 0.00 0.00 51.96 52.16 1jhm s ALA 119 Cb 0.05 0.70 0.11 0.00 0.00 0.00 0.00 23.12 23.98 1jhm s ALA 119 CO 0.00 -1.06 1.10 -1.21 0.00 0.00 0.00 175.76 174.59 1jhm s GLU 120 N -2.46 1.56 0.41 0.00 2.02 -1.26 -4.93 118.70 114.03 1jhm s GLU 120 Ca 0.19 1.12 -0.26 0.00 0.02 0.00 0.00 54.97 56.04 1jhm s GLU 120 Cb -0.01 -1.82 -0.09 0.00 0.10 0.00 0.00 34.13 32.31 1jhm s GLU 120 CO 0.03 -2.12 1.28 -2.14 0.02 0.00 0.00 175.26 172.34 1jhm s PRO 121 N -4.84 3.95 -0.28 0.39 0.02 -1.26 -4.98 135.00 128.00 1jhm s PRO 121 Ca 0.63 2.11 -0.11 0.00 0.02 0.00 0.00 61.00 63.66 1jhm s PRO 121 Cb -0.19 -2.73 -0.04 0.00 0.02 0.00 0.00 34.50 31.56 1jhm s PRO 121 CO 0.57 -0.49 0.18 0.42 -0.33 0.00 0.00 177.00 177.36 1jhm s ILE 122 N -1.29 5.21 0.27 2.83 1.01 -1.26 -5.05 121.20 122.93 1jhm s ILE 122 Ca 0.57 0.09 -0.30 0.00 0.00 0.00 0.00 60.65 61.02 1jhm s ILE 122 Cb -0.37 -3.50 -0.11 0.00 0.01 0.00 0.00 42.46 38.49 1jhm s ILE 122 CO 0.47 0.23 1.52 -2.84 0.00 0.00 0.00 174.94 174.32 1jhm s PRO 123 N 1.74 4.20 0.00 2.79 0.02 -1.26 -1.73 135.00 140.75 1jhm s PRO 123 Ca 0.07 2.44 0.00 0.00 0.02 0.00 0.00 61.00 63.52 1jhm s PRO 123 Cb -0.16 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.29 1jhm s PRO 123 CO 0.10 -0.52 0.00 0.41 -0.33 0.00 0.00 177.00 176.66 1jhm n GLY 124 N 2.19 1.64 3.76 0.52 0.00 -1.26 -5.04 105.19 107.01 1jhm n GLY 124 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 1jhm n GLY 124 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jhm s VAL 125 N -2.43 5.26 0.10 1.61 1.01 -0.71 -4.90 120.40 120.33 1jhm s VAL 125 Ca 0.00 0.62 -0.31 0.00 0.00 0.00 0.00 61.98 62.29 1jhm s VAL 125 Cb 0.00 -3.65 -0.09 0.00 0.00 0.00 0.00 36.38 32.64 1jhm s VAL 125 CO 0.00 0.44 1.60 -0.69 0.00 0.00 0.00 175.10 176.45 1jhm s VAL 126 N 0.07 2.96 -0.34 2.92 1.01 -0.37 -4.84 120.40 121.82 1jhm s VAL 126 Ca 0.19 0.53 -0.16 0.00 0.00 0.00 0.00 61.98 62.53 1jhm s VAL 126 Cb -0.14 -3.34 -0.01 0.00 0.00 0.00 0.00 36.38 32.89 1jhm s VAL 126 CO 0.06 0.01 0.42 0.21 0.00 0.00 0.00 175.10 175.80 1jhm s ASN 127 N 1.95 6.24 -0.09 3.32 3.84 -1.26 0.36 114.94 129.29 1jhm s ASN 127 Ca 0.72 -0.12 0.24 0.00 0.21 0.00 0.00 52.86 53.91 1jhm s ASN 127 Cb -0.40 -2.22 0.45 0.00 -0.55 0.00 0.00 41.25 38.53 1jhm s ASN 127 CO 0.32 -0.38 1.15 0.23 -2.79 0.00 0.00 177.10 175.63 1jhm n MET 128 N 5.51 0.64 -1.65 0.43 2.81 0.97 -4.95 117.12 120.88 1jhm n MET 128 Ca -0.07 -2.54 -0.45 0.00 -1.81 0.00 0.00 57.70 52.82 1jhm n MET 128 Cb 0.49 -0.58 -0.04 0.00 -0.71 0.00 0.00 33.22 32.38 1jhm n MET 128 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 1jhm n ARG 129 N 0.09 2.40 0.12 0.03 1.85 -0.27 -4.37 116.66 116.51 1jhm n ARG 129 Ca 0.07 0.85 -0.24 0.00 -1.00 0.00 0.00 57.85 57.54 1jhm n ARG 129 Cb 1.02 -2.85 -0.16 0.00 -1.05 0.00 0.00 32.46 29.42 1jhm n ARG 129 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1jhm h VAL 130 N 5.80 1.25 -2.48 8.89 2.07 -1.37 -3.47 116.25 126.94 1jhm h VAL 130 Ca -0.47 -2.64 0.18 0.00 0.82 0.00 0.00 66.70 64.59 1jhm h VAL 130 Cb 1.26 3.02 -0.03 0.00 -1.52 0.00 0.00 31.29 34.01 1jhm h VAL 130 CO 0.95 0.80 0.62 0.00 0.02 0.00 0.00 177.57 179.97 1jhm n ALA 131 N -2.74 -2.77 -2.83 1.67 0.00 -1.26 -5.05 120.51 107.53 1jhm n ALA 131 Ca -0.18 -0.97 -0.44 0.00 0.00 0.00 0.00 53.44 51.85 1jhm n ALA 131 Cb 1.06 0.50 0.00 0.00 0.00 0.00 0.00 19.45 21.01 1jhm n ALA 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1jhm n ARG 132 N -0.74 3.38 0.00 0.00 1.74 -1.26 -3.87 116.66 115.91 1jhm n ARG 132 Ca -0.01 -3.75 0.00 0.00 -0.77 0.00 0.00 57.85 53.32 1jhm n ARG 132 Cb 0.57 -3.07 0.00 0.00 -1.02 0.00 0.00 32.46 28.94 1jhm n ARG 132 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jhm n GLY 133 N 4.04 -1.52 3.97 -0.13 0.00 -0.52 -4.66 105.19 106.37 1jhm n GLY 133 Ca 0.38 -1.48 -0.22 0.00 0.00 0.00 0.00 46.02 44.71 1jhm n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jhm s GLY 135 N -4.39 2.38 -0.52 0.00 0.00 0.98 -1.35 107.32 104.42 1jhm s GLY 135 Ca 0.56 0.82 -0.28 0.00 0.00 0.00 0.00 44.72 45.82 1jhm s GLY 135 CO 0.39 1.21 1.60 0.21 0.00 0.00 0.00 173.10 176.51 1jhm s ASN 136 N -2.08 5.87 0.50 1.64 3.84 -1.26 -4.00 114.94 119.44 1jhm s ASN 136 Ca 0.73 0.52 0.30 0.00 0.21 0.00 0.00 52.86 54.61 1jhm s ASN 136 Cb -0.27 -2.54 1.62 0.00 -0.55 0.00 0.00 41.25 39.51 1jhm s ASN 136 CO 0.41 -1.87 1.90 0.16 -2.79 0.00 0.00 177.10 174.91 1jhm h ILE 137 N 6.59 0.00 -0.10 -5.21 3.07 -1.82 -2.00 117.51 118.04 1jhm h ILE 137 Ca -0.28 0.00 -0.06 0.00 1.55 0.00 0.00 64.86 66.07 1jhm h ILE 137 Cb 1.13 0.66 -0.01 0.00 -0.27 0.00 0.00 36.82 38.33 1jhm h ILE 137 CO 1.16 0.00 -0.20 0.00 -1.05 0.00 0.00 178.15 178.05 1jhm h ALA 138 N 1.78 1.48 0.00 0.16 0.00 -1.89 -3.28 119.26 117.52 1jhm h ALA 138 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1jhm h ALA 138 Cb 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1jhm h ALA 138 CO 0.00 0.37 0.00 1.33 0.00 0.00 0.00 179.25 180.95 1jhm n VAL 139 N -4.23 0.45 -2.48 0.00 0.24 -0.78 -4.31 118.33 107.22 1jhm n VAL 139 Ca -0.01 -0.70 0.00 0.00 -2.04 0.00 0.00 64.34 61.59 1jhm n VAL 139 Cb 0.31 0.81 0.00 0.00 -1.47 0.00 0.00 33.84 33.48 1jhm n VAL 139 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jhm n GLY 140 N -0.22 -1.28 3.78 7.63 0.00 -1.07 -5.04 105.19 108.99 1jhm n GLY 140 Ca 0.00 -0.90 -0.33 0.00 0.00 0.00 0.00 46.02 44.79 1jhm n GLY 140 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1jhm s PRO 141 N -0.64 2.81 0.25 1.61 0.04 -1.26 -3.56 135.00 134.25 1jhm s PRO 141 Ca 0.00 1.32 0.10 0.00 0.04 0.00 0.00 61.00 62.46 1jhm s PRO 141 Cb 0.00 -1.96 0.25 0.00 0.04 0.00 0.00 34.50 32.84 1jhm s PRO 141 CO 0.00 -1.23 1.55 0.00 0.04 0.00 0.00 177.00 177.36 1jhm h ALA 142 N -0.08 0.87 -2.36 8.56 0.00 -0.25 -3.38 119.26 122.62 1jhm h ALA 142 Ca -0.46 -0.62 0.16 0.00 0.00 0.00 0.00 54.91 53.98 1jhm h ALA 142 Cb 1.24 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 1jhm h ALA 142 CO 0.54 0.86 0.54 0.00 0.00 0.00 0.00 179.25 181.19 1jhm n MET 143 N -3.73 0.51 -2.83 0.00 0.00 -0.44 -0.01 117.12 110.62 1jhm n MET 143 Ca -0.01 -1.19 -0.28 0.00 0.00 0.00 0.00 57.70 56.22 1jhm n MET 143 Cb 0.67 1.64 -0.01 0.00 0.00 0.00 0.00 33.22 35.52 1jhm n MET 143 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 1jhm s SER 144 N -3.13 6.34 0.19 3.17 1.04 -1.26 -4.52 113.70 115.53 1jhm s SER 144 Ca 0.20 0.90 -0.12 0.00 0.48 0.00 0.00 55.95 57.42 1jhm s SER 144 Cb -0.02 -2.23 0.11 0.00 0.10 0.00 0.00 66.02 63.97 1jhm s SER 144 CO 0.04 -0.47 1.80 -0.09 0.98 0.00 0.00 173.24 175.50 1jhm h ARG 145 N 0.66 0.91 -0.84 4.02 2.43 -1.94 0.42 114.38 120.03 1jhm h ARG 145 Ca -0.47 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 58.58 1jhm h ARG 145 Cb 1.20 -0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 30.53 1jhm h ARG 145 CO 0.63 0.68 0.47 -0.07 -1.51 0.00 0.00 179.97 180.16 1jhm h LEU 146 N 0.89 1.05 -0.87 3.80 -0.00 -1.99 0.83 115.31 119.02 1jhm h LEU 146 Ca 0.23 -0.10 -0.02 0.00 -0.00 0.00 0.00 57.88 58.00 1jhm h LEU 146 Cb 0.03 -0.27 -0.04 0.00 -0.00 0.00 0.00 40.66 40.39 1jhm h LEU 146 CO -0.04 0.84 0.47 1.56 -0.00 0.00 0.00 178.44 181.27 1jhm h GLN 147 N 1.17 1.22 -0.11 1.13 4.20 -1.79 -1.19 115.11 119.74 1jhm h GLN 147 Ca 0.30 -0.15 -0.03 0.00 0.06 0.00 0.00 58.65 58.83 1jhm h GLN 147 Cb 0.02 -0.24 -0.00 0.00 0.30 0.00 0.00 27.48 27.56 1jhm h GLN 147 CO -0.05 0.90 -0.04 0.00 -0.67 0.00 0.00 178.83 178.97 1jhm h ALA 148 N 1.25 0.15 -0.37 3.87 0.00 -0.06 -2.82 119.26 121.28 1jhm h ALA 148 Ca 0.31 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1jhm h ALA 148 Cb 0.04 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1jhm h ALA 148 CO -0.05 -0.10 0.19 0.93 0.00 0.00 0.00 179.25 180.22 1jhm h GLU 149 N -0.13 0.39 -0.47 0.00 5.08 -0.67 -1.34 114.58 117.45 1jhm h GLU 149 Ca 0.03 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 1jhm h GLU 149 Cb 0.47 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 1jhm h GLU 149 CO 0.01 0.26 0.24 0.00 -1.00 0.00 0.00 179.01 178.51 1jhm h ALA 150 N 1.19 0.59 -0.59 3.43 0.00 -1.28 -0.85 119.26 121.75 1jhm h ALA 150 Ca 0.16 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1jhm h ALA 150 Cb 0.05 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1jhm h ALA 150 CO -0.10 -0.11 0.19 1.25 0.00 0.00 0.00 179.25 180.48 1jhm h LEU 151 N 0.47 0.84 -0.65 0.00 5.85 -1.25 -0.02 115.31 120.55 1jhm h LEU 151 Ca 0.20 -0.20 0.11 0.00 0.84 0.00 0.00 57.88 58.84 1jhm h LEU 151 Cb 0.11 -0.22 -0.08 0.00 0.37 0.00 0.00 40.66 40.83 1jhm h LEU 151 CO -0.14 0.82 0.22 -0.07 -0.34 0.00 0.00 178.44 178.93 1jhm h LEU 152 N 0.82 0.18 0.24 2.25 3.38 -0.65 0.87 115.31 122.39 1jhm h LEU 152 Ca 0.19 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 1jhm h LEU 152 Cb 0.27 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1jhm h LEU 152 CO -0.01 0.09 -0.11 0.25 0.09 0.00 0.00 178.44 178.75 1jhm h LEU 153 N 0.38 -0.27 -0.42 1.67 7.12 -0.71 -1.37 115.31 121.70 1jhm h LEU 153 Ca 0.34 -0.08 -0.01 0.00 0.13 0.00 0.00 57.88 58.26 1jhm h LEU 153 Cb 0.48 0.07 -0.02 0.00 -0.53 0.00 0.00 40.66 40.66 1jhm h LEU 153 CO -0.36 -0.09 0.21 -0.08 -0.13 0.00 0.00 178.44 177.99 1jhm h GLU 154 N -0.44 0.59 -0.55 1.25 4.81 -0.45 -1.99 114.58 117.80 1jhm h GLU 154 Ca -0.03 -0.08 -0.11 0.00 -0.13 0.00 0.00 59.36 59.00 1jhm h GLU 154 Cb 0.33 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 1jhm h GLU 154 CO 0.05 0.50 -0.09 0.28 -0.73 0.00 0.00 179.01 179.03 1jhm h VAL 155 N 0.53 1.27 -0.28 0.32 2.07 -0.86 -2.04 116.25 117.26 1jhm h VAL 155 Ca 0.14 -1.25 0.06 0.00 0.82 0.00 0.00 66.70 66.48 1jhm h VAL 155 Cb 0.10 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 30.75 1jhm h VAL 155 CO -0.02 0.44 -0.11 -1.28 0.02 0.00 0.00 177.57 176.62 1jhm h SER 156 N 0.91 -0.39 0.24 0.57 0.87 -1.14 -1.25 113.55 113.37 1jhm h SER 156 Ca 0.14 0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.80 1jhm h SER 156 Cb 0.65 0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.84 1jhm h SER 156 CO 0.05 -0.15 -0.11 0.03 -0.53 0.00 0.00 176.83 176.12 1jhm h ARG 157 N -0.06 -0.31 -0.88 2.24 -0.00 -1.27 -2.14 114.38 111.96 1jhm h ARG 157 Ca 0.15 0.02 0.23 0.00 -0.50 0.00 0.00 59.98 59.87 1jhm h ARG 157 Cb 0.28 0.07 -0.13 0.00 0.00 0.00 0.00 29.97 30.19 1jhm h ARG 157 CO -0.33 -0.05 0.32 -0.92 0.00 0.00 0.00 179.97 178.98 1jhm h TYR 158 N -0.54 0.51 0.32 3.04 3.20 -1.18 0.02 116.97 122.34 1jhm h TYR 158 Ca -0.03 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 1jhm h TYR 158 Cb 0.40 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.59 1jhm h TYR 158 CO -0.00 -0.13 -0.15 1.15 -1.64 0.00 0.00 178.16 177.38 1jhm h THR 159 N 0.30 0.69 -0.04 1.81 2.02 -0.96 -2.71 112.91 114.02 1jhm h THR 159 Ca 0.56 -0.02 -0.10 0.00 0.77 0.00 0.00 66.41 67.62 1jhm h THR 159 Cb 1.10 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 1jhm h THR 159 CO -0.59 0.00 -0.42 0.00 0.37 0.00 0.00 175.52 174.89 1jhm h ASP 161 N 0.08 0.73 -0.25 0.00 2.03 -0.91 -1.08 116.42 117.02 1jhm h ASP 161 Ca 0.00 -0.11 -0.03 0.00 -0.73 0.00 0.00 57.03 56.16 1jhm h ASP 161 Cb 0.78 -0.19 -0.02 0.00 -0.83 0.00 0.00 39.33 39.07 1jhm h ASP 161 CO 0.06 0.70 0.06 -0.07 -1.03 0.00 0.00 179.24 178.97 1jhm h LEU 162 N 0.77 0.45 -1.82 0.15 3.38 -1.15 -1.36 115.31 115.73 1jhm h LEU 162 Ca 0.18 -0.06 0.17 0.00 0.09 0.00 0.00 57.88 58.26 1jhm h LEU 162 Cb 0.24 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1jhm h LEU 162 CO -0.01 0.47 0.48 0.00 0.09 0.00 0.00 178.44 179.48 1jhm h ALA 163 N 1.59 2.41 0.00 1.53 0.00 -1.16 0.24 119.26 123.88 1jhm h ALA 163 Ca 0.11 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1jhm h ALA 163 Cb 0.22 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1jhm h ALA 163 CO -0.00 -0.61 -0.16 1.96 0.00 0.00 0.00 179.25 180.44 1jhm h GLN 164 N 0.17 0.00 -0.65 0.00 4.20 -1.19 -2.75 115.11 114.89 1jhm h GLN 164 Ca 0.34 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.02 1jhm h GLN 164 Cb 1.09 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.86 1jhm h GLN 164 CO -0.06 0.16 0.03 0.54 -0.67 0.00 0.00 178.83 178.84 1jhm n ARG 165 N -3.39 4.34 -0.51 1.46 1.74 0.84 -4.90 116.66 116.24 1jhm n ARG 165 Ca -0.00 -2.79 0.00 0.00 -0.77 0.00 0.00 57.85 54.29 1jhm n ARG 165 Cb 0.36 -2.18 0.00 0.00 -1.02 0.00 0.00 32.46 29.62 1jhm n ARG 165 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jhm n GLY 166 N 0.47 0.75 3.72 -0.13 0.00 -1.04 -4.99 105.19 103.97 1jhm n GLY 166 Ca 0.26 -0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 1jhm n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jhm s VAL 167 N -2.00 4.54 0.00 1.61 1.01 -1.10 -1.43 120.40 123.03 1jhm s VAL 167 Ca 0.00 2.03 0.00 0.00 0.00 0.00 0.00 61.98 64.01 1jhm s VAL 167 Cb 0.00 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 32.08 1jhm s VAL 167 CO 0.00 0.27 0.11 0.35 0.00 0.00 0.00 175.10 175.84 1jhm n THR 168 N 3.05 0.00 -3.69 3.92 -2.24 0.13 -4.37 114.28 111.08 1jhm n THR 168 Ca 0.03 -0.40 -0.15 0.00 -2.27 0.00 0.00 64.05 61.26 1jhm n THR 168 Cb 0.49 1.06 -0.15 0.00 -2.10 0.00 0.00 70.33 69.63 1jhm n THR 168 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1jhm s LEU 169 N -1.15 0.11 0.09 3.22 2.96 -1.10 -4.29 118.68 118.52 1jhm s LEU 169 Ca 0.00 0.39 0.06 0.00 -0.22 0.00 0.00 54.13 54.36 1jhm s LEU 169 Cb 0.00 0.42 -0.04 0.00 0.50 0.00 0.00 46.19 47.07 1jhm s LEU 169 CO 0.00 -0.21 -0.06 -0.36 -1.32 0.00 0.00 176.35 174.39 1jhm s PHE 170 N 1.96 2.84 -0.02 5.38 0.40 -0.98 -1.36 117.98 126.20 1jhm s PHE 170 Ca -0.01 -0.10 0.06 0.00 -0.60 0.00 0.00 56.93 56.27 1jhm s PHE 170 Cb -0.12 -1.49 -0.01 0.00 0.51 0.00 0.00 43.02 41.91 1jhm s PHE 170 CO -0.07 0.44 -0.18 0.20 0.70 0.00 0.00 175.22 176.31 1jhm s GLY 171 N -2.14 0.90 0.04 4.36 0.00 0.60 -0.09 107.32 110.99 1jhm s GLY 171 Ca 0.22 -0.78 0.07 0.00 0.00 0.00 0.00 44.72 44.23 1jhm s GLY 171 CO 0.14 -0.64 -0.17 0.54 0.00 0.00 0.00 173.10 172.98 1jhm s VAL 172 N -0.40 2.85 0.34 1.40 0.11 -0.96 -1.41 120.40 122.33 1jhm s VAL 172 Ca 0.06 -1.14 -0.14 0.00 -2.93 0.00 0.00 61.98 57.83 1jhm s VAL 172 Cb -0.07 -2.20 0.03 0.00 -1.53 0.00 0.00 36.38 32.61 1jhm s VAL 172 CO -0.01 0.35 0.67 -0.83 -3.33 0.00 0.00 175.10 171.96 1jhm s GLY 173 N -1.41 0.51 0.24 6.54 0.00 -0.36 -4.18 107.32 108.65 1jhm s GLY 173 Ca 0.15 -0.82 -0.06 0.00 0.00 0.00 0.00 44.72 43.98 1jhm s GLY 173 CO 0.05 -0.44 0.31 -1.83 0.00 0.00 0.00 173.10 171.19 1jhm s GLU 174 N -3.01 1.42 -0.27 2.90 4.04 -1.26 -1.52 118.70 121.01 1jhm s GLU 174 Ca 0.18 -1.49 -0.04 0.00 0.04 0.00 0.00 54.97 53.66 1jhm s GLU 174 Cb -0.04 0.37 0.15 0.00 0.02 0.00 0.00 34.13 34.63 1jhm s GLU 174 CO 0.12 -0.54 0.53 -1.17 -1.84 0.00 0.00 175.26 172.36 1jhm s LEU 175 N -3.11 -1.03 -0.30 1.83 2.96 -0.08 -2.45 118.68 116.51 1jhm s LEU 175 Ca 0.31 0.89 -0.16 0.00 -0.22 0.00 0.00 54.13 54.95 1jhm s LEU 175 Cb 0.03 1.80 0.17 0.00 0.50 0.00 0.00 46.19 48.70 1jhm s LEU 175 CO 0.12 -0.26 1.16 -0.83 -1.32 0.00 0.00 176.35 175.22 1jhm s GLY 176 N 2.75 -0.21 0.22 7.98 0.00 -1.25 -1.13 107.32 115.68 1jhm s GLY 176 Ca 0.09 2.97 -0.32 0.00 0.00 0.00 0.00 44.72 47.47 1jhm s GLY 176 CO -0.18 3.92 1.50 1.03 0.00 0.00 0.00 173.10 179.38 1jhm n MET 177 N 5.47 2.17 -1.00 2.90 2.81 -1.26 -1.46 117.12 126.76 1jhm n MET 177 Ca -0.08 0.78 -0.00 0.00 -1.81 0.00 0.00 57.70 56.59 1jhm n MET 177 Cb 0.54 -2.50 -0.00 0.00 -0.71 0.00 0.00 33.22 30.56 1jhm n MET 177 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1jhm n ALA 178 N 2.56 -0.00 0.38 3.04 0.00 -1.26 -4.33 120.51 120.90 1jhm n ALA 178 Ca 0.13 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.71 1jhm n ALA 178 Cb 0.31 -0.12 0.51 0.00 0.00 0.00 0.00 19.45 20.15 1jhm n ALA 178 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 1jhm h ASN 179 N 0.00 0.00 0.83 0.00 7.08 -1.65 -3.01 115.58 118.82 1jhm h ASN 179 Ca -0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1jhm h ASN 179 Cb 0.03 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.27 1jhm h ASN 179 CO 0.00 0.00 0.00 0.71 -2.08 0.00 0.00 177.43 176.06 1jhm h THR 180 N 0.00 0.00 0.61 6.14 1.35 -1.92 -2.75 112.91 116.33 1jhm h THR 180 Ca 0.00 -0.40 -0.03 0.00 -0.55 0.00 0.00 66.41 65.43 1jhm h THR 180 Cb 0.51 1.36 0.01 0.00 -1.73 0.00 0.00 68.15 68.29 1jhm h THR 180 CO 0.00 0.00 -0.29 0.74 -0.25 0.00 0.00 175.52 175.72 1jhm h THR 181 N 0.00 0.02 -0.60 6.82 2.02 -1.91 0.10 112.91 119.36 1jhm h THR 181 Ca 0.00 -0.40 0.05 0.00 0.77 0.00 0.00 66.41 66.83 1jhm h THR 181 Cb 0.41 0.03 -0.03 0.00 -1.74 0.00 0.00 68.15 66.81 1jhm h THR 181 CO 0.00 0.00 0.40 1.55 0.37 0.00 0.00 175.52 177.84 1jhm h PRO 182 N -1.21 0.59 -0.14 6.66 0.13 -1.75 -0.63 132.00 135.66 1jhm h PRO 182 Ca -0.08 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 65.01 1jhm h PRO 182 Cb 0.64 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 31.63 1jhm h PRO 182 CO 0.14 0.39 0.08 0.00 -0.23 0.00 0.00 178.00 178.38 1jhm h ALA 183 N 1.67 0.18 -0.53 -0.56 0.00 -1.47 -1.28 119.26 117.26 1jhm h ALA 183 Ca 0.25 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1jhm h ALA 183 Cb 0.22 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1jhm h ALA 183 CO -0.07 -0.30 0.33 0.00 0.00 0.00 0.00 179.25 179.21 1jhm h ALA 184 N 0.99 0.67 -0.96 0.00 0.00 0.10 -2.21 119.26 117.86 1jhm h ALA 184 Ca 0.05 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1jhm h ALA 184 Cb 0.05 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 17.56 1jhm h ALA 184 CO -0.01 0.14 0.62 0.00 0.00 0.00 0.00 179.25 180.00 1jhm h ALA 185 N 1.17 1.47 -0.40 0.00 0.00 -0.68 -0.25 119.26 120.57 1jhm h ALA 185 Ca 0.19 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1jhm h ALA 185 Cb -0.05 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1jhm h ALA 185 CO -0.04 0.38 0.14 0.52 0.00 0.00 0.00 179.25 180.25 1jhm h MET 186 N 1.09 0.62 0.05 0.00 2.86 -0.94 -1.11 114.93 117.50 1jhm h MET 186 Ca 0.42 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.93 1jhm h MET 186 Cb 0.21 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 31.77 1jhm h MET 186 CO -0.17 0.61 -0.04 0.28 1.06 0.00 0.00 176.91 178.65 1jhm h VAL 187 N 0.51 0.92 -0.48 -2.22 2.07 -0.78 0.87 116.25 117.14 1jhm h VAL 187 Ca 0.13 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.72 1jhm h VAL 187 Cb 0.24 0.92 -0.06 0.00 -1.52 0.00 0.00 31.29 30.87 1jhm h VAL 187 CO -0.01 0.00 0.15 -1.28 0.02 0.00 0.00 177.57 176.45 1jhm h SER 188 N -0.09 0.12 0.15 0.57 0.87 -0.94 0.09 113.55 114.33 1jhm h SER 188 Ca 0.00 0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.62 1jhm h SER 188 Cb 0.08 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 1jhm h SER 188 CO -0.01 0.10 -0.07 0.58 -0.53 0.00 0.00 176.83 176.90 1jhm h VAL 189 N 0.31 0.98 0.00 2.23 2.07 -0.80 0.38 116.25 121.41 1jhm h VAL 189 Ca 0.23 -0.58 -0.07 0.00 0.82 0.00 0.00 66.70 67.11 1jhm h VAL 189 Cb 0.26 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 1jhm h VAL 189 CO -0.26 0.14 -0.32 -0.26 0.02 0.00 0.00 177.57 176.89 1jhm h PHE 190 N -0.48 0.00 0.00 1.57 0.04 -0.69 -3.21 116.94 114.18 1jhm h PHE 190 Ca -0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.75 1jhm h PHE 190 Cb 0.38 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.53 1jhm h PHE 190 CO 0.02 0.32 -1.47 2.41 -0.60 0.00 0.00 178.31 178.98 1jhm n THR 191 N -4.05 0.32 -1.97 -1.55 -1.04 0.01 -4.96 114.28 101.04 1jhm n THR 191 Ca -0.02 -0.52 -0.11 0.00 -2.04 0.00 0.00 64.05 61.36 1jhm n THR 191 Cb 0.37 -0.16 -0.02 0.00 -1.82 0.00 0.00 70.33 68.70 1jhm n THR 191 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1jhm n GLY 192 N 1.22 0.27 3.87 3.41 0.00 0.13 -5.00 105.19 109.09 1jhm n GLY 192 Ca -0.02 -0.45 -0.36 0.00 0.00 0.00 0.00 46.02 45.19 1jhm n GLY 192 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jhm s SER 193 N -2.61 6.60 0.64 1.61 0.01 -0.82 -5.03 113.70 114.09 1jhm s SER 193 Ca 0.00 0.71 -0.17 0.00 1.31 0.00 0.00 55.95 57.79 1jhm s SER 193 Cb 0.00 -2.15 -0.01 0.00 0.21 0.00 0.00 66.02 64.07 1jhm s SER 193 CO 0.00 0.28 1.20 -0.62 0.41 0.00 0.00 173.24 174.51 1jhm s ASP 194 N -1.45 4.88 0.17 2.44 2.15 -1.26 -4.51 116.67 119.09 1jhm s ASP 194 Ca 0.26 2.36 -0.15 0.00 0.43 0.00 0.00 52.55 55.45 1jhm s ASP 194 Cb -0.14 -2.59 0.13 0.00 -0.30 0.00 0.00 42.92 40.01 1jhm s ASP 194 CO 0.14 -1.80 1.70 0.00 -0.17 0.00 0.00 175.17 175.04 1jhm h ALA 195 N 0.47 0.40 -0.55 3.66 0.00 -1.94 -1.18 119.26 120.12 1jhm h ALA 195 Ca -0.49 0.11 0.10 0.00 0.00 0.00 0.00 54.91 54.63 1jhm h ALA 195 Cb 1.30 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.24 1jhm h ALA 195 CO 0.53 -0.38 0.37 1.57 0.00 0.00 0.00 179.25 181.35 1jhm h LYS 196 N 0.13 0.30 0.00 0.00 -0.00 -1.91 -1.46 116.57 113.63 1jhm h LYS 196 Ca 0.21 -0.02 -0.05 0.00 -0.00 0.00 0.00 60.65 60.79 1jhm h LYS 196 Cb 0.29 -0.07 -0.01 0.00 -0.00 0.00 0.00 32.23 32.44 1jhm h LYS 196 CO -0.33 0.20 -0.24 1.05 -0.00 0.00 0.00 179.45 180.14 1jhm h GLU 197 N 0.31 0.00 0.00 0.07 -0.00 -1.57 -3.25 114.58 110.14 1jhm h GLU 197 Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.62 1jhm h GLU 197 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.35 1jhm h GLU 197 CO -0.06 0.24 -0.00 1.33 -0.00 0.00 0.00 179.01 180.51 1jhm n VAL 198 N -3.68 1.12 -3.40 -1.06 0.24 -0.64 -4.46 118.33 106.46 1jhm n VAL 198 Ca -0.01 -1.18 -0.38 0.00 -2.04 0.00 0.00 64.34 60.72 1jhm n VAL 198 Cb 0.36 0.39 -0.08 0.00 -1.47 0.00 0.00 33.84 33.03 1jhm n VAL 198 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1jhm s VAL 199 N -1.28 5.19 0.57 3.34 1.01 -0.68 -3.95 120.40 124.60 1jhm s VAL 199 Ca 0.05 0.64 0.07 0.00 0.00 0.00 0.00 61.98 62.75 1jhm s VAL 199 Cb 0.05 -3.71 0.07 0.00 0.00 0.00 0.00 36.38 32.79 1jhm s VAL 199 CO 0.00 0.22 0.58 0.61 0.00 0.00 0.00 175.10 176.52 1jhm n GLY 200 N 4.19 2.42 0.03 4.51 0.00 -1.26 -4.83 105.19 110.24 1jhm n GLY 200 Ca -0.09 -2.27 0.11 0.00 0.00 0.00 0.00 46.02 43.77 1jhm n GLY 200 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1jhm n ILE 201 N -2.00 0.57 -3.07 -0.61 5.41 -1.26 -4.93 119.36 113.46 1jhm n ILE 201 Ca 0.06 0.10 0.00 0.00 1.00 0.00 0.00 62.75 63.90 1jhm n ILE 201 Cb 0.62 -0.79 0.00 0.00 -0.71 0.00 0.00 39.64 38.76 1jhm n ILE 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1jhm n GLY 202 N 0.69 2.08 3.19 7.39 0.00 -1.26 0.14 105.19 117.42 1jhm n GLY 202 Ca 0.05 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.28 1jhm n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jhm n ALA 203 N 6.89 3.96 -3.63 4.61 0.00 -1.26 -4.36 120.51 126.72 1jhm n ALA 203 Ca 0.00 -3.64 -0.23 0.00 0.00 0.00 0.00 53.44 49.57 1jhm n ALA 203 Cb 0.00 -3.57 0.04 0.00 0.00 0.00 0.00 19.45 15.92 1jhm n ALA 203 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1jhm n ASN 204 N 8.29 -2.85 -4.73 0.00 3.02 -1.16 -4.70 115.26 113.14 1jhm n ASN 204 Ca 0.50 -0.85 -0.41 0.00 -0.03 0.00 0.00 54.58 53.78 1jhm n ASN 204 Cb 0.43 -4.06 -0.03 0.00 -0.61 0.00 0.00 39.78 35.50 1jhm n ASN 204 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1jhm s LEU 205 N -6.45 4.44 0.51 3.41 2.96 0.37 -4.91 118.68 119.02 1jhm s LEU 205 Ca 0.17 2.13 -0.23 0.00 -0.22 0.00 0.00 54.13 55.99 1jhm s LEU 205 Cb -0.05 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 42.99 1jhm s LEU 205 CO 0.81 -0.36 1.37 -2.84 -1.32 0.00 0.00 176.35 174.01 1jhm s PRO 206 N 0.10 3.33 0.46 0.98 0.02 -1.26 -4.85 135.00 133.78 1jhm s PRO 206 Ca 0.54 2.26 0.22 0.00 0.02 0.00 0.00 61.00 64.03 1jhm s PRO 206 Cb -0.31 -2.38 1.20 0.00 0.02 0.00 0.00 34.50 33.04 1jhm s PRO 206 CO 0.34 -1.05 1.88 -1.00 -0.33 0.00 0.00 177.00 176.84 1jhm h PRO 207 N 1.74 0.27 -0.61 5.54 0.13 -1.99 -1.33 132.00 135.75 1jhm h PRO 207 Ca -0.51 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.58 1jhm h PRO 207 Cb 1.29 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 32.33 1jhm h PRO 207 CO 0.58 0.18 0.29 0.66 -0.23 0.00 0.00 178.00 179.48 1jhm h SER 208 N 0.28 0.80 0.64 1.44 4.64 -2.03 -2.95 113.55 116.35 1jhm h SER 208 Ca 0.44 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 1jhm h SER 208 Cb 1.28 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1jhm h SER 208 CO -0.12 0.70 0.00 0.54 -0.87 0.00 0.00 176.83 177.08 1jhm n ARG 209 N -4.51 0.13 0.11 4.77 1.74 -0.51 -3.99 116.66 114.40 1jhm n ARG 209 Ca 0.04 0.37 -0.13 0.00 -0.77 0.00 0.00 57.85 57.36 1jhm n ARG 209 Cb 0.12 -1.74 -0.06 0.00 -1.02 0.00 0.00 32.46 29.76 1jhm n ARG 209 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1jhm h ILE 210 N 0.00 0.36 -0.92 0.55 1.08 -1.51 -2.73 117.51 114.33 1jhm h ILE 210 Ca 0.00 0.00 0.26 0.00 -0.39 0.00 0.00 64.86 64.73 1jhm h ILE 210 Cb 0.32 0.36 -0.16 0.00 -3.07 0.00 0.00 36.82 34.27 1jhm h ILE 210 CO 0.00 0.00 0.19 0.44 -0.69 0.00 0.00 178.15 178.09 1jhm h ASP 211 N -0.52 -0.14 -0.83 1.72 3.45 -1.80 0.53 116.42 118.83 1jhm h ASP 211 Ca 0.03 0.23 -0.04 0.00 0.43 0.00 0.00 57.03 57.68 1jhm h ASP 211 Cb 0.55 0.34 -0.04 0.00 -0.56 0.00 0.00 39.33 39.62 1jhm h ASP 211 CO -0.18 -0.25 0.37 -1.13 -1.57 0.00 0.00 179.24 176.49 1jhm h ASN 212 N 0.12 1.11 -0.94 6.45 -1.24 -1.75 -2.26 115.58 117.07 1jhm h ASN 212 Ca 0.59 -0.15 0.07 0.00 0.71 0.00 0.00 56.30 57.52 1jhm h ASN 212 Cb 1.24 -0.29 -0.06 0.00 0.73 0.00 0.00 38.32 39.93 1jhm h ASN 212 CO -0.75 0.96 0.61 0.50 -1.29 0.00 0.00 177.43 177.45 1jhm h LYS 213 N 1.20 1.02 -0.36 6.67 3.64 0.16 -1.27 116.57 127.63 1jhm h LYS 213 Ca 0.28 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.49 1jhm h LYS 213 Cb 0.16 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1jhm h LYS 213 CO -0.03 0.68 -0.19 0.28 -2.27 0.00 0.00 179.45 177.91 1jhm h VAL 214 N 1.05 1.29 -0.58 2.00 2.07 -1.11 -2.29 116.25 118.68 1jhm h VAL 214 Ca 0.41 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.62 1jhm h VAL 214 Cb 0.24 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 1jhm h VAL 214 CO -0.17 0.44 0.38 0.44 0.02 0.00 0.00 177.57 178.68 1jhm h ASP 215 N 0.55 0.67 -0.07 0.57 3.32 -0.81 -0.70 116.42 119.95 1jhm h ASP 215 Ca 0.08 -0.03 0.04 0.00 0.02 0.00 0.00 57.03 57.14 1jhm h ASP 215 Cb 0.74 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 40.07 1jhm h ASP 215 CO 0.06 0.50 -0.26 0.58 -1.72 0.00 0.00 179.24 178.39 1jhm h VAL 216 N 0.79 0.40 -0.04 -1.35 2.07 -1.08 0.17 116.25 117.20 1jhm h VAL 216 Ca 0.21 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.77 1jhm h VAL 216 Cb -0.08 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 30.04 1jhm h VAL 216 CO -0.04 0.00 -0.26 0.58 0.02 0.00 0.00 177.57 177.86 1jhm h VAL 217 N -0.36 0.39 -0.69 2.57 2.07 -1.13 0.25 116.25 119.36 1jhm h VAL 217 Ca 0.08 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.69 1jhm h VAL 217 Cb 0.48 0.39 -0.07 0.00 -1.52 0.00 0.00 31.29 30.58 1jhm h VAL 217 CO -0.28 0.00 0.35 0.03 0.02 0.00 0.00 177.57 177.69 1jhm h ARG 218 N -0.38 0.59 -0.19 1.57 3.08 -0.67 -1.46 114.38 116.92 1jhm h ARG 218 Ca 0.08 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.11 1jhm h ARG 218 Cb 0.49 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 1jhm h ARG 218 CO -0.26 0.39 0.03 0.00 -1.07 0.00 0.00 179.97 179.06 1jhm h ARG 219 N 0.61 0.11 -0.74 0.04 3.08 0.35 -0.04 114.38 117.78 1jhm h ARG 219 Ca 0.33 -0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.52 1jhm h ARG 219 Cb 0.32 -0.02 -0.10 0.00 0.08 0.00 0.00 29.97 30.25 1jhm h ARG 219 CO -0.25 0.07 0.27 0.00 -1.07 0.00 0.00 179.97 179.00 1jhm h ALA 220 N 1.14 1.03 0.19 0.04 0.00 0.45 -0.56 119.26 121.56 1jhm h ALA 220 Ca 0.09 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1jhm h ALA 220 Cb 0.08 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1jhm h ALA 220 CO -0.12 -0.24 -0.09 0.82 0.00 0.00 0.00 179.25 179.62 1jhm h ILE 221 N 0.40 0.91 -0.44 0.00 2.04 -0.76 -1.98 117.51 117.68 1jhm h ILE 221 Ca 0.41 -0.71 0.08 0.00 1.00 0.00 0.00 64.86 65.64 1jhm h ILE 221 Cb 0.64 1.32 -0.07 0.00 -0.74 0.00 0.00 36.82 37.97 1jhm h ILE 221 CO -0.42 0.16 0.04 0.00 0.00 0.00 0.00 178.15 177.93 1jhm h ALA 222 N 0.08 0.45 -0.26 1.87 0.00 -0.60 0.51 119.26 121.32 1jhm h ALA 222 Ca -0.03 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1jhm h ALA 222 Cb 0.45 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1jhm h ALA 222 CO 0.04 -0.36 0.06 0.82 0.00 0.00 0.00 179.25 179.82 1jhm h ILE 223 N 0.16 1.21 0.07 0.00 2.04 -1.16 -3.31 117.51 116.52 1jhm h ILE 223 Ca 0.22 -0.70 -0.28 0.00 1.00 0.00 0.00 64.86 65.09 1jhm h ILE 223 Cb 0.30 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 1jhm h ILE 223 CO -0.33 0.23 -1.43 0.78 0.00 0.00 0.00 178.15 177.39 1jhm h ASN 224 N 0.24 0.25 -5.92 1.72 2.35 -1.12 -3.49 115.58 109.61 1jhm h ASN 224 Ca 0.08 -0.34 -0.38 0.00 -0.55 0.00 0.00 56.30 55.11 1jhm h ASN 224 Cb 0.29 -0.08 0.10 0.00 0.05 0.00 0.00 38.32 38.68 1jhm h ASN 224 CO 0.00 1.28 -0.82 0.00 -1.65 0.00 0.00 177.43 176.24 1jhm n GLN 225 N -3.37 -5.13 -2.07 0.81 1.13 0.18 -4.88 117.38 104.04 1jhm n GLN 225 Ca -0.13 0.70 -0.38 0.00 -1.94 0.00 0.00 57.00 55.25 1jhm n GLN 225 Cb 1.02 -5.39 0.00 0.00 0.11 0.00 0.00 30.24 25.98 1jhm n GLN 225 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 1jhm s PRO 226 N -5.69 3.75 -0.32 -1.09 0.04 -1.26 -4.95 135.00 125.48 1jhm s PRO 226 Ca 0.05 2.05 -0.20 0.00 0.04 0.00 0.00 61.00 62.94 1jhm s PRO 226 Cb -0.01 -2.56 -0.01 0.00 0.04 0.00 0.00 34.50 31.97 1jhm s PRO 226 CO 0.78 -0.64 0.61 1.21 0.04 0.00 0.00 177.00 179.01 1jhm s ASN 227 N -0.97 6.45 0.61 6.66 2.47 -1.26 -4.92 114.94 123.98 1jhm s ASN 227 Ca 0.62 0.30 0.37 0.00 0.42 0.00 0.00 52.86 54.57 1jhm s ASN 227 Cb -0.36 -2.32 2.01 0.00 -1.45 0.00 0.00 41.25 39.13 1jhm s ASN 227 CO 0.44 -0.50 2.26 1.55 -3.72 0.00 0.00 177.10 177.12 1jhm h PRO 228 N 8.29 0.00 -0.01 0.43 0.14 -1.92 0.18 132.00 139.11 1jhm h PRO 228 Ca -0.27 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.87 1jhm h PRO 228 Cb 1.12 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.26 1jhm h PRO 228 CO 0.80 0.02 -0.12 0.54 0.14 0.00 0.00 178.00 179.39 1jhm n ARG 229 N -3.38 1.01 -3.84 0.86 3.00 -1.26 -4.45 116.66 108.60 1jhm n ARG 229 Ca -0.02 -0.48 -0.29 0.00 -0.01 0.00 0.00 57.85 57.04 1jhm n ARG 229 Cb 0.12 -1.49 -0.13 0.00 0.00 0.00 0.00 32.46 30.96 1jhm n ARG 229 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1jhm s ASP 230 N -2.32 4.05 0.25 0.55 -1.08 0.05 -4.98 116.67 113.19 1jhm s ASP 230 Ca 0.31 -3.02 -0.05 0.00 -0.52 0.00 0.00 52.55 49.27 1jhm s ASP 230 Cb 0.20 -1.38 0.47 0.00 -1.46 0.00 0.00 42.92 40.75 1jhm s ASP 230 CO 0.44 -0.22 1.69 1.23 0.52 0.00 0.00 175.17 178.84 1jhm h GLY 231 N 6.36 1.06 1.00 2.66 0.00 -1.78 0.14 103.07 112.50 1jhm h GLY 231 Ca -0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 1jhm h GLY 231 CO 0.61 -0.19 0.33 -2.22 0.00 0.00 0.00 176.54 175.06 1jhm h ILE 232 N 0.29 1.21 -0.32 2.60 2.04 -1.93 -0.05 117.51 121.35 1jhm h ILE 232 Ca 0.42 -0.56 0.05 0.00 1.00 0.00 0.00 64.86 65.77 1jhm h ILE 232 Cb 0.72 0.42 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 1jhm h ILE 232 CO -0.50 0.24 0.04 -0.78 0.00 0.00 0.00 178.15 177.14 1jhm h ASP 233 N 0.87 -0.04 -0.14 1.72 1.82 -1.11 -0.36 116.42 119.18 1jhm h ASP 233 Ca 0.22 0.06 0.02 0.00 -0.39 0.00 0.00 57.03 56.94 1jhm h ASP 233 Cb 0.08 0.09 -0.02 0.00 0.68 0.00 0.00 39.33 40.16 1jhm h ASP 233 CO -0.03 0.01 0.00 0.58 -1.61 0.00 0.00 179.24 178.19 1jhm h VAL 234 N 0.14 0.91 -0.53 2.25 2.07 -0.69 -2.30 116.25 118.11 1jhm h VAL 234 Ca 0.15 -0.02 0.04 0.00 0.82 0.00 0.00 66.70 67.70 1jhm h VAL 234 Cb 0.18 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 1jhm h VAL 234 CO -0.22 0.01 0.28 -0.07 0.02 0.00 0.00 177.57 177.59 1jhm h LEU 235 N 0.05 0.42 -0.95 2.57 3.38 -0.43 -0.43 115.31 119.91 1jhm h LEU 235 Ca 0.06 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 1jhm h LEU 235 Cb 0.07 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1jhm h LEU 235 CO -0.11 0.29 -0.18 0.77 0.09 0.00 0.00 178.44 179.30 1jhm h SER 236 N 0.55 0.55 0.00 -0.43 4.64 -0.90 -1.34 113.55 116.62 1jhm h SER 236 Ca 0.23 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1jhm h SER 236 Cb 0.12 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 1jhm h SER 236 CO -0.15 0.75 -0.07 0.11 -0.87 0.00 0.00 176.83 176.60 1jhm h LYS 237 N 0.50 0.00 -0.23 4.77 1.57 -1.15 -0.94 116.57 121.09 1jhm h LYS 237 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1jhm h LYS 237 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.91 1jhm h LYS 237 CO 0.04 0.00 0.00 1.33 -0.57 0.00 0.00 179.45 180.25 1jhm n VAL 238 N -3.81 1.60 -0.16 0.50 0.24 -0.19 -1.03 118.33 115.48 1jhm n VAL 238 Ca -0.01 -1.49 0.00 0.00 -2.04 0.00 0.00 64.34 60.80 1jhm n VAL 238 Cb 0.04 0.12 0.00 0.00 -1.47 0.00 0.00 33.84 32.53 1jhm n VAL 238 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jhm n GLY 239 N -0.25 1.67 3.61 7.63 0.00 -0.51 -4.58 105.19 112.76 1jhm n GLY 239 Ca 0.14 -1.68 -0.06 0.00 0.00 0.00 0.00 46.02 44.42 1jhm n GLY 239 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jhm s GLY 240 N 0.00 -0.37 0.23 -0.02 0.00 -1.23 -4.78 107.32 101.15 1jhm s GLY 240 Ca 0.00 0.66 -0.06 0.00 0.00 0.00 0.00 44.72 45.32 1jhm s GLY 240 CO 0.00 0.20 1.79 0.74 0.00 0.00 0.00 173.10 175.83 1jhm h PHE 241 N 2.00 0.73 -0.43 1.90 0.05 -1.90 0.12 116.94 119.42 1jhm h PHE 241 Ca -0.23 0.03 -0.12 0.00 3.82 0.00 0.00 57.97 61.46 1jhm h PHE 241 Cb 1.24 -0.21 -0.01 0.00 2.00 0.00 0.00 35.95 38.96 1jhm h PHE 241 CO 0.31 0.29 -0.23 0.38 -0.18 0.00 0.00 178.31 178.88 1jhm h ASP 242 N 0.69 0.90 -0.56 2.17 -0.00 -1.88 -0.33 116.42 117.40 1jhm h ASP 242 Ca 0.36 -0.33 -0.03 0.00 -0.00 0.00 0.00 57.03 57.03 1jhm h ASP 242 Cb 0.35 -0.25 -0.03 0.00 -0.00 0.00 0.00 39.33 39.41 1jhm h ASP 242 CO -0.25 1.08 0.24 -0.07 -0.00 0.00 0.00 179.24 180.24 1jhm h LEU 243 N 0.76 0.77 -0.09 0.15 -0.00 -1.71 -1.58 115.31 113.60 1jhm h LEU 243 Ca 0.10 -0.16 0.00 0.00 -0.00 0.00 0.00 57.88 57.82 1jhm h LEU 243 Cb 0.77 -0.20 -0.00 0.00 -0.00 0.00 0.00 40.66 41.23 1jhm h LEU 243 CO 0.06 0.71 0.06 0.58 -0.00 0.00 0.00 178.44 179.86 1jhm h VAL 244 N 0.77 1.04 -0.68 1.22 2.07 -0.62 -2.07 116.25 117.98 1jhm h VAL 244 Ca 0.19 -0.09 0.06 0.00 0.82 0.00 0.00 66.70 67.67 1jhm h VAL 244 Cb 0.18 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 1jhm h VAL 244 CO -0.02 0.04 0.39 1.23 0.02 0.00 0.00 177.57 179.22 1jhm h GLY 245 N 0.11 1.00 0.81 2.17 0.00 -0.73 -1.19 103.07 105.23 1jhm h GLY 245 Ca 0.03 -0.27 0.01 0.00 0.00 0.00 0.00 47.33 47.10 1jhm h GLY 245 CO -0.01 0.17 -0.11 -0.33 0.00 0.00 0.00 176.54 176.26 1jhm h MET 246 N 0.71 -0.22 -0.96 4.80 2.07 -1.10 -0.30 114.93 119.92 1jhm h MET 246 Ca 0.30 0.01 0.16 0.00 -2.07 0.00 0.00 59.70 58.11 1jhm h MET 246 Cb 0.18 0.05 -0.10 0.00 -1.87 0.00 0.00 31.60 29.86 1jhm h MET 246 CO -0.18 -0.14 0.57 1.15 1.07 0.00 0.00 176.91 179.38 1jhm h THR 247 N -0.23 0.76 -0.53 2.22 2.02 -1.02 -1.36 112.91 114.78 1jhm h THR 247 Ca 0.02 -0.27 0.04 0.00 0.77 0.00 0.00 66.41 66.97 1jhm h THR 247 Cb 0.24 -0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 66.52 1jhm h THR 247 CO -0.06 0.14 0.28 1.23 0.37 0.00 0.00 175.52 177.48 1jhm h GLY 248 N 0.78 0.75 0.92 2.16 0.00 0.04 0.14 103.07 107.86 1jhm h GLY 248 Ca 0.53 -0.20 0.02 0.00 0.00 0.00 0.00 47.33 47.68 1jhm h GLY 248 CO -0.35 0.13 0.27 -2.08 0.00 0.00 0.00 176.54 174.52 1jhm h VAL 249 N 0.55 1.06 -0.36 4.60 2.07 -0.01 0.16 116.25 124.32 1jhm h VAL 249 Ca 0.23 -0.19 0.04 0.00 0.82 0.00 0.00 66.70 67.59 1jhm h VAL 249 Cb 0.12 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.31 1jhm h VAL 249 CO -0.15 0.10 0.15 0.24 0.02 0.00 0.00 177.57 177.93 1jhm h MET 250 N 0.55 0.30 -0.32 1.57 2.07 -0.79 0.14 114.93 118.45 1jhm h MET 250 Ca 0.18 -0.02 -0.14 0.00 -2.07 0.00 0.00 59.70 57.65 1jhm h MET 250 Cb -0.01 -0.07 -0.01 0.00 -1.87 0.00 0.00 31.60 29.65 1jhm h MET 250 CO -0.07 0.20 -0.36 -0.07 1.07 0.00 0.00 176.91 177.68 1jhm h LEU 251 N 0.31 0.78 -0.03 1.22 3.38 -0.59 -2.48 115.31 117.90 1jhm h LEU 251 Ca 0.16 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 1jhm h LEU 251 Cb 0.11 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1jhm h LEU 251 CO -0.14 1.06 0.01 1.23 0.09 0.00 0.00 178.44 180.69 1jhm h GLY 252 N 0.94 0.05 1.27 0.83 0.00 0.00 -1.49 103.07 104.68 1jhm h GLY 252 Ca 0.06 -0.03 -0.06 0.00 0.00 0.00 0.00 47.33 47.30 1jhm h GLY 252 CO 0.08 0.03 0.10 0.00 0.00 0.00 0.00 176.54 176.74 1jhm h ALA 253 N 0.86 1.11 -0.38 3.60 0.00 -0.79 -1.03 119.26 122.63 1jhm h ALA 253 Ca 0.01 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 1jhm h ALA 253 Cb 0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1jhm h ALA 253 CO -0.00 0.59 0.05 0.00 0.00 0.00 0.00 179.25 179.88 1jhm h ALA 254 N 1.25 0.50 -0.86 0.00 0.00 -1.38 1.13 119.26 119.89 1jhm h ALA 254 Ca 0.18 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1jhm h ALA 254 Cb 0.37 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1jhm h ALA 254 CO 0.01 0.22 0.43 -0.09 0.00 0.00 0.00 179.25 179.82 1jhm h ARG 255 N 0.47 1.23 0.00 0.00 9.65 -1.06 -0.09 114.38 124.59 1jhm h ARG 255 Ca 0.11 -0.17 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 1jhm h ARG 255 Cb 0.38 -0.23 0.00 0.00 -1.39 0.00 0.00 29.97 28.74 1jhm h ARG 255 CO 0.01 0.94 0.00 0.00 2.80 0.00 0.00 179.97 183.72 1jhm n GLY 257 N 0.57 0.07 3.41 0.00 0.00 -0.05 -4.10 105.19 105.10 1jhm n GLY 257 Ca 0.12 -0.32 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 1jhm n GLY 257 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jhm s LEU 258 N -3.66 2.51 0.32 0.99 1.43 0.37 -0.88 118.68 119.77 1jhm s LEU 258 Ca 0.16 -1.14 -0.19 0.00 -1.03 0.00 0.00 54.13 51.93 1jhm s LEU 258 Cb -0.07 -0.67 -0.09 0.00 0.03 0.00 0.00 46.19 45.38 1jhm s LEU 258 CO 0.19 -0.28 0.81 -2.16 0.23 0.00 0.00 176.35 175.14 1jhm s PRO 259 N -3.69 4.18 -0.05 1.29 0.04 -1.26 -4.01 135.00 131.50 1jhm s PRO 259 Ca 0.28 0.90 0.03 0.00 0.04 0.00 0.00 61.00 62.24 1jhm s PRO 259 Cb 0.02 -2.53 0.01 0.00 0.04 0.00 0.00 34.50 32.04 1jhm s PRO 259 CO 0.11 0.19 -0.11 0.08 0.04 0.00 0.00 177.00 177.30 1jhm s VAL 260 N -1.87 1.00 -0.19 -0.36 1.01 -0.90 -2.33 120.40 116.76 1jhm s VAL 260 Ca 0.53 -0.44 -0.15 0.00 0.00 0.00 0.00 61.98 61.92 1jhm s VAL 260 Cb -0.12 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.31 1jhm s VAL 260 CO 0.18 0.31 0.35 -0.76 0.00 0.00 0.00 175.10 175.18 1jhm s LEU 261 N 0.44 4.19 0.99 3.92 1.43 0.88 -0.60 118.68 129.93 1jhm s LEU 261 Ca -0.09 0.49 -0.15 0.00 -1.03 0.00 0.00 54.13 53.36 1jhm s LEU 261 Cb -0.13 -2.44 0.18 0.00 0.03 0.00 0.00 46.19 43.84 1jhm s LEU 261 CO 0.02 -0.00 1.17 -0.76 0.23 0.00 0.00 176.35 177.01 1jhm s LEU 262 N 0.97 1.86 0.00 1.79 1.02 0.27 -2.27 118.68 122.32 1jhm s LEU 262 Ca 0.17 0.75 0.00 0.00 0.02 0.00 0.00 54.13 55.08 1jhm s LEU 262 Cb -0.14 -2.89 0.00 0.00 0.02 0.00 0.00 46.19 43.18 1jhm s LEU 262 CO 0.06 -2.94 0.00 -0.67 0.02 0.00 0.00 176.35 172.82 1jhm n ASP 263 N -3.99 0.00 0.00 2.29 2.03 -1.26 -3.94 116.55 111.68 1jhm n ASP 263 Ca 0.10 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.41 1jhm n ASP 263 Cb 0.59 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.99 1jhm n ASP 263 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1jhm n GLY 264 N 4.93 4.30 0.32 0.27 0.00 -1.26 -4.20 105.19 109.56 1jhm n GLY 264 Ca 0.00 -1.93 0.05 0.00 0.00 0.00 0.00 46.02 44.14 1jhm n GLY 264 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1jhm h PHE 265 N 0.00 0.89 -0.91 1.61 3.04 -1.94 0.25 116.94 119.88 1jhm h PHE 265 Ca 0.00 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 61.97 1jhm h PHE 265 Cb 0.00 -0.27 -0.04 0.00 2.56 0.00 0.00 35.95 38.20 1jhm h PHE 265 CO 0.00 0.31 0.50 -0.07 -2.02 0.00 0.00 178.31 177.04 1jhm h LEU 266 N 0.78 1.13 -0.68 0.59 -0.00 -1.95 -1.48 115.31 113.69 1jhm h LEU 266 Ca 0.44 -0.10 -0.14 0.00 -0.00 0.00 0.00 57.88 58.09 1jhm h LEU 266 Cb 0.50 -0.29 -0.01 0.00 -0.00 0.00 0.00 40.66 40.86 1jhm h LEU 266 CO -0.29 0.90 -0.47 0.77 -0.00 0.00 0.00 178.44 179.35 1jhm h SER 267 N 1.27 0.48 -0.80 -0.43 4.64 -1.27 -2.16 113.55 115.29 1jhm h SER 267 Ca 0.32 -0.23 -0.04 0.00 -0.47 0.00 0.00 61.79 61.37 1jhm h SER 267 Cb 0.02 -0.14 -0.04 0.00 -0.31 0.00 0.00 62.40 61.94 1jhm h SER 267 CO -0.05 0.88 0.35 1.88 -0.87 0.00 0.00 176.83 179.01 1jhm h TYR 268 N 0.36 1.18 -0.28 4.77 0.99 -0.26 0.10 116.97 123.83 1jhm h TYR 268 Ca 0.02 -0.08 0.06 0.00 2.00 0.00 0.00 58.73 60.74 1jhm h TYR 268 Cb 0.97 -0.36 -0.06 0.00 1.00 0.00 0.00 36.73 38.27 1jhm h TYR 268 CO 0.03 0.88 -0.12 0.77 -0.00 0.00 0.00 178.16 179.72 1jhm h SER 269 N 1.14 -0.41 0.22 3.88 0.02 -0.74 -0.50 113.55 117.17 1jhm h SER 269 Ca 0.27 0.10 -0.07 0.00 -0.84 0.00 0.00 61.79 61.26 1jhm h SER 269 Cb 0.18 0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 1jhm h SER 269 CO -0.03 -0.15 -0.28 0.00 -1.14 0.00 0.00 176.83 175.23 1jhm h ALA 270 N 1.17 1.44 -0.43 3.77 0.00 -1.03 -2.80 119.26 121.38 1jhm h ALA 270 Ca 0.15 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1jhm h ALA 270 Cb 0.29 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1jhm h ALA 270 CO -0.33 0.40 0.06 0.00 0.00 0.00 0.00 179.25 179.38 1jhm h ALA 271 N 1.64 0.58 -0.56 0.00 0.00 0.74 0.06 119.26 121.71 1jhm h ALA 271 Ca 0.01 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1jhm h ALA 271 Cb 0.54 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1jhm h ALA 271 CO 0.04 0.31 0.31 -0.07 0.00 0.00 0.00 179.25 179.83 1jhm h LEU 272 N 0.58 0.47 -0.15 0.00 3.38 -1.06 0.25 115.31 118.77 1jhm h LEU 272 Ca 0.13 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1jhm h LEU 272 Cb 0.39 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1jhm h LEU 272 CO 0.01 0.32 0.06 0.00 0.09 0.00 0.00 178.44 178.92 1jhm h ALA 273 N 1.29 0.20 -0.72 1.53 0.00 -1.28 0.84 119.26 121.11 1jhm h ALA 273 Ca 0.24 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.09 1jhm h ALA 273 Cb 0.12 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1jhm h ALA 273 CO -0.15 -0.22 0.45 0.00 0.00 0.00 0.00 179.25 179.33 1jhm h ALA 274 N 0.91 0.95 -0.03 0.00 0.00 -0.21 0.53 119.26 121.41 1jhm h ALA 274 Ca 0.05 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1jhm h ALA 274 Cb 0.16 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1jhm h ALA 274 CO -0.00 0.23 -0.40 0.00 0.00 0.00 0.00 179.25 179.08 1jhm h GLN 276 N 0.05 0.71 -0.23 0.00 5.75 -0.18 -2.73 115.11 118.48 1jhm h GLN 276 Ca 0.00 -0.48 -0.15 0.00 -0.15 0.00 0.00 58.65 57.87 1jhm h GLN 276 Cb 0.73 0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.34 1jhm h GLN 276 CO 0.05 1.10 -0.46 0.82 -2.65 0.00 0.00 178.83 177.69 1jhm h ILE 277 N 0.53 1.31 -1.55 2.39 2.04 -0.31 -3.44 117.51 118.48 1jhm h ILE 277 Ca -0.00 -1.67 -0.14 0.00 1.00 0.00 0.00 64.86 64.05 1jhm h ILE 277 Cb 1.18 1.78 -0.27 0.00 -0.74 0.00 0.00 36.82 38.77 1jhm h ILE 277 CO 0.12 0.53 -0.50 0.00 0.00 0.00 0.00 178.15 178.30 1jhm s ALA 278 N -4.08 -1.47 0.58 1.87 0.00 0.61 -5.00 121.76 114.27 1jhm s ALA 278 Ca -0.12 0.39 0.27 0.00 0.00 0.00 0.00 51.96 52.51 1jhm s ALA 278 Cb 0.08 -2.19 1.67 0.00 0.00 0.00 0.00 23.12 22.68 1jhm s ALA 278 CO 0.85 -1.78 2.18 -1.35 0.00 0.00 0.00 175.76 175.66 1jhm h PRO 279 N 8.12 0.00 0.00 0.00 0.11 -1.68 0.15 132.00 138.69 1jhm h PRO 279 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1jhm h PRO 279 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1jhm h PRO 279 CO 0.24 0.00 0.11 0.00 -0.21 0.00 0.00 178.00 178.14 1jhm n ALA 280 N -2.37 0.87 0.06 -0.75 0.00 -1.26 -0.79 120.51 116.26 1jhm n ALA 280 Ca -0.01 0.13 -0.10 0.00 0.00 0.00 0.00 53.44 53.46 1jhm n ALA 280 Cb 0.18 -1.05 0.01 0.00 0.00 0.00 0.00 19.45 18.60 1jhm n ALA 280 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1jhm h VAL 281 N 0.00 1.40 -0.75 0.00 2.07 -1.02 -3.38 116.25 114.57 1jhm h VAL 281 Ca 0.00 -2.26 0.07 0.00 0.82 0.00 0.00 66.70 65.33 1jhm h VAL 281 Cb 0.22 2.22 -0.09 0.00 -1.52 0.00 0.00 31.29 32.12 1jhm h VAL 281 CO 0.00 0.67 -0.44 -1.14 0.02 0.00 0.00 177.57 176.68 1jhm n ARG 282 N -3.79 -0.33 0.10 1.57 3.00 0.03 -0.87 116.66 116.36 1jhm n ARG 282 Ca -0.05 1.32 0.05 0.00 -0.00 0.00 0.00 57.85 59.18 1jhm n ARG 282 Cb 0.74 -1.95 0.29 0.00 0.00 0.00 0.00 32.46 31.54 1jhm n ARG 282 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 1jhm n PRO 283 N -4.73 0.07 0.08 -0.14 -0.04 -1.26 -1.08 135.00 127.90 1jhm n PRO 283 Ca 0.02 0.53 0.11 0.00 -0.04 0.00 0.00 63.50 64.12 1jhm n PRO 283 Cb 0.20 -1.84 -0.03 0.00 -0.04 0.00 0.00 33.50 31.79 1jhm n PRO 283 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1jhm n TYR 284 N -1.86 0.76 -2.40 0.54 4.01 -0.05 -4.93 117.16 113.23 1jhm n TYR 284 Ca -0.01 0.22 -0.41 0.00 -0.16 0.00 0.00 57.90 57.55 1jhm n TYR 284 Cb 0.13 -0.85 -0.04 0.00 -0.31 0.00 0.00 39.34 38.27 1jhm n TYR 284 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1jhm s LEU 285 N -5.12 4.51 -0.13 7.72 1.02 -0.24 -2.12 118.68 124.32 1jhm s LEU 285 Ca -0.02 2.32 -0.03 0.00 0.02 0.00 0.00 54.13 56.43 1jhm s LEU 285 Cb 0.11 -3.62 0.04 0.00 0.02 0.00 0.00 46.19 42.74 1jhm s LEU 285 CO 0.81 -0.25 0.04 -0.63 0.02 0.00 0.00 176.35 176.33 1jhm s ILE 286 N -0.87 0.28 0.76 -0.59 1.01 0.24 -4.92 121.20 117.11 1jhm s ILE 286 Ca 0.47 -0.11 -0.15 0.00 0.00 0.00 0.00 60.65 60.86 1jhm s ILE 286 Cb -0.33 -0.65 0.06 0.00 0.01 0.00 0.00 42.46 41.54 1jhm s ILE 286 CO 0.42 -0.00 1.24 -2.16 0.00 0.00 0.00 174.94 174.43 1jhm s PRO 287 N 1.99 1.88 0.00 2.79 0.04 -1.26 -0.56 135.00 139.87 1jhm s PRO 287 Ca 0.03 1.86 0.00 0.00 0.04 0.00 0.00 61.00 62.93 1jhm s PRO 287 Cb -0.14 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1jhm s PRO 287 CO -0.07 -2.06 0.00 -1.13 0.04 0.00 0.00 177.00 173.78 1jhm n SER 288 N -2.90 0.00 -4.63 6.66 3.41 -1.26 -4.63 113.62 110.27 1jhm n SER 288 Ca 0.14 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.45 1jhm n SER 288 Cb 0.50 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.36 1jhm n SER 288 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 1jhm s HIS 289 N 0.00 2.02 -0.47 7.33 -3.43 -1.26 -1.98 115.29 117.50 1jhm s HIS 289 Ca 0.00 -0.93 -0.11 0.00 -0.80 0.00 0.00 55.06 53.23 1jhm s HIS 289 Cb 0.00 -1.58 0.11 0.00 -1.43 0.00 0.00 32.58 29.68 1jhm s HIS 289 CO 0.00 0.21 0.35 0.12 -2.00 0.00 0.00 174.74 173.42 1jhm s PHE 290 N -2.90 3.37 0.33 0.38 2.19 0.38 -4.76 117.98 116.97 1jhm s PHE 290 Ca 0.17 -1.66 -0.28 0.00 0.33 0.00 0.00 56.93 55.49 1jhm s PHE 290 Cb 0.04 -3.41 -0.12 0.00 -1.31 0.00 0.00 43.02 38.22 1jhm s PHE 290 CO 0.09 -0.96 1.31 0.45 1.83 0.00 0.00 175.22 177.94 1jhm n SER 291 N 4.98 2.78 0.00 6.13 2.88 -1.26 -4.30 113.62 124.83 1jhm n SER 291 Ca -0.10 1.20 0.10 0.00 -1.33 0.00 0.00 58.87 58.75 1jhm n SER 291 Cb 0.41 -1.48 0.53 0.00 -0.75 0.00 0.00 64.21 62.92 1jhm n SER 291 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1jhm n ALA 292 N 0.51 2.10 -1.85 -1.46 0.00 -0.27 -4.72 120.51 114.81 1jhm n ALA 292 Ca 0.05 -0.10 -0.42 0.00 0.00 0.00 0.00 53.44 52.98 1jhm n ALA 292 Cb 0.36 -1.33 -0.02 0.00 0.00 0.00 0.00 19.45 18.45 1jhm n ALA 292 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1jhm s GLU 293 N -2.48 4.22 0.28 0.00 2.56 -1.26 -4.93 118.70 117.08 1jhm s GLU 293 Ca 0.21 2.39 0.01 0.00 0.00 0.00 0.00 54.97 57.58 1jhm s GLU 293 Cb 0.14 -3.09 0.67 0.00 2.00 0.00 0.00 34.13 33.84 1jhm s GLU 293 CO 0.30 -0.51 1.67 -0.22 -0.56 0.00 0.00 175.26 175.93 1jhm h LYS 294 N 5.30 0.26 0.00 4.30 3.64 -1.88 -0.75 116.57 127.44 1jhm h LYS 294 Ca -0.46 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1jhm h LYS 294 Cb 1.22 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1jhm h LYS 294 CO 0.81 0.17 0.00 0.41 -2.27 0.00 0.00 179.45 178.57 1jhm n GLY 295 N -1.36 -0.90 0.22 5.01 0.00 -1.25 -4.30 105.19 102.60 1jhm n GLY 295 Ca 0.20 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 1jhm n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jhm h ALA 296 N 3.50 -0.35 -0.87 4.61 0.00 -1.42 -2.09 119.26 122.66 1jhm h ALA 296 Ca 0.00 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1jhm h ALA 296 Cb 0.00 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 1jhm h ALA 296 CO 0.00 -0.72 0.55 0.07 0.00 0.00 0.00 179.25 179.15 1jhm h ARG 297 N -0.38 0.99 -0.08 0.00 0.11 -1.82 0.23 114.38 113.42 1jhm h ARG 297 Ca 0.01 -0.06 -0.00 0.00 0.10 0.00 0.00 59.98 60.03 1jhm h ARG 297 Cb 0.37 -0.22 -0.00 0.00 1.11 0.00 0.00 29.97 31.22 1jhm h ARG 297 CO -0.06 0.65 0.05 0.82 0.10 0.00 0.00 179.97 181.54 1jhm h ILE 298 N 1.02 1.06 -0.45 0.08 2.04 -1.83 -1.40 117.51 118.03 1jhm h ILE 298 Ca 0.37 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 66.08 1jhm h ILE 298 Cb 0.12 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1jhm h ILE 298 CO -0.15 0.05 0.28 0.00 0.00 0.00 0.00 178.15 178.33 1jhm h ALA 299 N 0.98 0.57 -0.09 1.87 0.00 -0.79 -2.39 119.26 119.41 1jhm h ALA 299 Ca 0.03 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1jhm h ALA 299 Cb 0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1jhm h ALA 299 CO -0.01 0.04 -0.28 -0.07 0.00 0.00 0.00 179.25 178.94 1jhm h LEU 300 N 0.60 0.16 -0.45 0.00 3.38 -0.86 -2.16 115.31 115.98 1jhm h LEU 300 Ca 0.16 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1jhm h LEU 300 Cb -0.04 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1jhm h LEU 300 CO -0.03 0.44 0.14 0.00 0.09 0.00 0.00 178.44 179.08 1jhm h ALA 301 N 1.57 0.59 0.00 1.53 0.00 -0.85 0.70 119.26 122.80 1jhm h ALA 301 Ca 0.02 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1jhm h ALA 301 Cb 0.57 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1jhm h ALA 301 CO 0.04 0.24 -0.34 0.45 0.00 0.00 0.00 179.25 179.64 1jhm h HIS 302 N 0.59 0.00 0.00 0.00 3.86 -1.21 -0.23 115.15 118.16 1jhm h HIS 302 Ca 0.15 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.36 1jhm h HIS 302 Cb 0.26 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.73 1jhm h HIS 302 CO 0.01 0.34 -0.19 -0.07 0.86 0.00 0.00 177.93 178.88 1jhm h LEU 303 N 0.00 0.00 -0.96 2.43 4.07 -0.72 -3.47 115.31 116.65 1jhm h LEU 303 Ca -0.00 -0.04 -0.34 0.00 0.08 0.00 0.00 57.88 57.58 1jhm h LEU 303 Cb 0.64 0.00 0.12 0.00 1.08 0.00 0.00 40.66 42.50 1jhm h LEU 303 CO 0.04 0.02 -0.59 -1.20 -1.08 0.00 0.00 178.44 175.63 1jhm n SER 304 N -2.45 -5.38 -4.39 -0.43 7.64 0.22 -5.01 113.62 103.82 1jhm n SER 304 Ca 0.04 -0.47 -0.29 0.00 1.01 0.00 0.00 58.87 59.16 1jhm n SER 304 Cb 0.46 -4.41 -0.13 0.00 -1.01 0.00 0.00 64.21 59.12 1jhm n SER 304 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1jhm s MET 305 N -6.03 1.44 -0.29 1.43 -1.94 0.16 -5.01 119.30 109.05 1jhm s MET 305 Ca 0.45 -1.33 0.01 0.00 -1.71 0.00 0.00 55.69 53.12 1jhm s MET 305 Cb -0.20 -1.91 0.09 0.00 2.01 0.00 0.00 34.83 34.81 1jhm s MET 305 CO 0.63 0.46 0.03 -1.83 -0.01 0.00 0.00 175.02 174.30 1jhm s GLU 306 N -2.01 1.24 0.68 2.03 1.03 -1.26 -4.63 118.70 115.78 1jhm s GLU 306 Ca 0.14 -1.28 -0.17 0.00 0.03 0.00 0.00 54.97 53.69 1jhm s GLU 306 Cb -0.10 -2.57 -0.01 0.00 -0.80 0.00 0.00 34.13 30.66 1jhm s GLU 306 CO 0.06 -0.84 1.06 -2.30 -1.33 0.00 0.00 175.26 171.91 1jhm n PRO 307 N 4.61 0.74 0.01 -4.83 -0.02 -1.26 -4.93 135.00 129.31 1jhm n PRO 307 Ca -0.03 0.30 -0.18 0.00 -2.02 0.00 0.00 63.50 61.57 1jhm n PRO 307 Cb 0.43 -2.29 -0.11 0.00 -0.02 0.00 0.00 33.50 31.50 1jhm n PRO 307 CO 0.00 0.00 0.00 1.88 1.98 0.00 0.00 175.50 179.36 1jhm h TYR 308 N 0.09 0.65 -2.95 6.00 0.05 -1.66 -3.47 116.97 115.69 1jhm h TYR 308 Ca -0.49 -0.36 -0.64 0.00 0.05 0.00 0.00 58.73 57.30 1jhm h TYR 308 Cb 1.34 -0.07 -0.09 0.00 1.01 0.00 0.00 36.73 38.92 1jhm h TYR 308 CO 0.40 1.19 -0.49 -0.51 -1.05 0.00 0.00 178.16 177.70 1jhm s LEU 309 N -8.27 4.29 -0.58 3.88 1.02 -0.87 -5.03 118.68 113.11 1jhm s LEU 309 Ca -0.13 0.35 0.04 0.00 0.02 0.00 0.00 54.13 54.42 1jhm s LEU 309 Cb 0.04 -2.08 0.14 0.00 0.02 0.00 0.00 46.19 44.31 1jhm s LEU 309 CO 0.83 0.30 0.34 -1.00 0.02 0.00 0.00 176.35 176.84 1jhm s HIS 310 N -0.37 3.27 -0.97 0.29 3.76 -1.26 -0.47 115.29 119.55 1jhm s HIS 310 Ca 0.12 -3.21 0.09 0.00 -0.15 0.00 0.00 55.06 51.90 1jhm s HIS 310 Cb -0.12 -2.75 0.04 0.00 1.11 0.00 0.00 32.58 30.86 1jhm s HIS 310 CO 0.01 -0.67 0.69 -1.33 -0.85 0.00 0.00 174.74 172.58 1jhm n MET 311 N 2.72 1.21 -2.86 1.40 2.81 -1.26 -4.99 117.12 116.15 1jhm n MET 311 Ca 0.10 -0.81 -0.22 0.00 -1.81 0.00 0.00 57.70 54.97 1jhm n MET 311 Cb 0.33 -1.11 0.02 0.00 -0.71 0.00 0.00 33.22 31.76 1jhm n MET 311 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1jhm n ALA 312 N 0.12 -0.89 -2.03 3.04 0.00 -1.26 -4.97 120.51 114.53 1jhm n ALA 312 Ca 0.04 0.26 -0.33 0.00 0.00 0.00 0.00 53.44 53.41 1jhm n ALA 312 Cb 0.21 -3.49 -0.06 0.00 0.00 0.00 0.00 19.45 16.10 1jhm n ALA 312 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1jhm s MET 313 N -5.54 4.13 -0.34 0.00 -1.94 -1.26 -4.58 119.30 109.78 1jhm s MET 313 Ca 0.23 0.86 0.14 0.00 -1.71 0.00 0.00 55.69 55.20 1jhm s MET 313 Cb -0.10 -2.45 0.42 0.00 2.01 0.00 0.00 34.83 34.72 1jhm s MET 313 CO 0.28 0.15 1.46 2.89 -0.01 0.00 0.00 175.02 179.78 1jhm n ARG 314 N -0.24 1.39 -0.07 2.03 1.85 -1.26 -1.12 116.66 119.24 1jhm n ARG 314 Ca 0.04 -1.63 -0.15 0.00 -1.00 0.00 0.00 57.85 55.11 1jhm n ARG 314 Cb 0.53 0.07 -0.14 0.00 -1.05 0.00 0.00 32.46 31.87 1jhm n ARG 314 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 1jhm n LEU 315 N -1.29 1.69 0.00 2.89 7.94 -1.26 -4.89 117.00 122.08 1jhm n LEU 315 Ca -0.12 0.08 0.00 0.00 -1.11 0.00 0.00 56.01 54.86 1jhm n LEU 315 Cb 0.86 -0.37 0.00 0.00 0.53 0.00 0.00 43.42 44.45 1jhm n LEU 315 CO -0.11 0.70 0.00 0.61 -1.11 0.00 0.00 177.39 177.48 1jhm n GLY 316 N 1.93 -0.29 4.00 -3.96 0.00 -1.26 -4.95 105.19 100.66 1jhm n GLY 316 Ca -0.34 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.21 1jhm n GLY 316 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jhm n GLU 317 N 0.00 0.00 -0.35 1.61 1.02 -1.02 -1.49 120.64 120.41 1jhm n GLU 317 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1jhm n GLU 317 Cb 0.00 -3.53 0.00 0.00 -0.02 0.00 0.00 31.44 27.89 1jhm n GLU 317 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1jhm n GLY 318 N -2.00 0.81 0.30 0.62 0.00 -1.26 -4.34 105.19 99.33 1jhm n GLY 318 Ca 0.00 -0.13 -0.06 0.00 0.00 0.00 0.00 46.02 45.82 1jhm n GLY 318 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1jhm h SER 319 N 0.00 0.96 -0.58 1.61 4.64 -1.59 -2.00 113.55 116.59 1jhm h SER 319 Ca 0.00 -0.15 -0.05 0.00 -0.47 0.00 0.00 61.79 61.12 1jhm h SER 319 Cb 0.00 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 61.82 1jhm h SER 319 CO 0.00 0.84 0.17 1.23 -0.87 0.00 0.00 176.83 178.21 1jhm h GLY 320 N 1.01 0.98 0.46 -0.77 0.00 -1.91 -1.67 103.07 101.16 1jhm h GLY 320 Ca 0.24 -0.58 0.05 0.00 0.00 0.00 0.00 47.33 47.04 1jhm h GLY 320 CO -0.03 0.55 -0.11 0.00 0.00 0.00 0.00 176.54 176.95 1jhm h ALA 321 N 1.05 0.06 -0.76 3.60 0.00 -1.60 -0.63 119.26 120.98 1jhm h ALA 321 Ca 0.19 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1jhm h ALA 321 Cb 0.30 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 1jhm h ALA 321 CO -0.00 -0.53 0.46 0.00 0.00 0.00 0.00 179.25 179.17 1jhm h ALA 322 N 1.07 0.97 -0.32 0.00 0.00 -1.27 -1.85 119.26 117.87 1jhm h ALA 322 Ca 0.11 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1jhm h ALA 322 Cb 0.26 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1jhm h ALA 322 CO -0.26 0.43 0.18 1.25 0.00 0.00 0.00 179.25 180.86 1jhm h LEU 323 N 1.04 0.38 0.00 0.00 5.85 -0.43 -2.81 115.31 119.34 1jhm h LEU 323 Ca 0.27 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.97 1jhm h LEU 323 Cb -0.04 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 40.89 1jhm h LEU 323 CO -0.05 0.31 -0.13 0.00 -0.34 0.00 0.00 178.44 178.22 1jhm h ALA 324 N 1.76 0.92 -0.96 1.25 0.00 -0.28 -3.38 119.26 118.56 1jhm h ALA 324 Ca 0.12 0.00 0.23 0.00 0.00 0.00 0.00 54.91 55.26 1jhm h ALA 324 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 17.67 1jhm h ALA 324 CO -0.02 0.00 0.52 0.52 0.00 0.00 0.00 179.25 180.27 1jhm h MET 325 N 0.00 0.51 -0.31 0.00 2.86 -1.30 -0.56 114.93 116.14 1jhm h MET 325 Ca 0.00 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1jhm h MET 325 Cb 0.82 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.34 1jhm h MET 325 CO 0.00 0.34 0.06 -1.35 1.06 0.00 0.00 176.91 177.02 1jhm h PRO 326 N 0.53 0.44 -0.28 -0.22 0.11 -1.79 -1.33 132.00 129.46 1jhm h PRO 326 Ca 0.61 -0.07 0.01 0.00 0.11 0.00 0.00 66.00 66.66 1jhm h PRO 326 Cb 1.14 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 1jhm h PRO 326 CO -0.49 0.43 0.18 0.82 -0.21 0.00 0.00 178.00 178.73 1jhm h ILE 327 N 0.44 1.05 -0.45 4.15 2.04 -1.37 0.33 117.51 123.70 1jhm h ILE 327 Ca 0.10 -0.12 0.02 0.00 1.00 0.00 0.00 64.86 65.86 1jhm h ILE 327 Cb 0.20 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 1jhm h ILE 327 CO -0.00 0.07 0.27 0.58 0.00 0.00 0.00 178.15 179.07 1jhm h VAL 328 N 0.36 1.06 -0.58 1.67 2.07 -1.18 -0.58 116.25 119.07 1jhm h VAL 328 Ca 0.11 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.45 1jhm h VAL 328 Cb -0.03 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.18 1jhm h VAL 328 CO -0.03 0.10 0.39 -0.33 0.02 0.00 0.00 177.57 177.71 1jhm h GLU 329 N 0.55 0.75 -0.19 1.57 5.08 -0.85 -2.56 114.58 118.94 1jhm h GLU 329 Ca 0.18 -0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.53 1jhm h GLU 329 Cb -0.01 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 1jhm h GLU 329 CO -0.07 0.50 -0.04 0.00 -1.00 0.00 0.00 179.01 178.39 1jhm h ALA 330 N 1.64 0.13 -0.76 3.43 0.00 0.12 0.40 119.26 124.22 1jhm h ALA 330 Ca 0.22 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.21 1jhm h ALA 330 Cb -0.07 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1jhm h ALA 330 CO -0.05 -0.48 0.50 0.00 0.00 0.00 0.00 179.25 179.23 1jhm h ALA 331 N 1.18 1.48 0.13 0.00 0.00 -1.00 0.15 119.26 121.20 1jhm h ALA 331 Ca 0.09 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1jhm h ALA 331 Cb 0.13 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1jhm h ALA 331 CO -0.19 0.47 -0.06 0.00 0.00 0.00 0.00 179.25 179.47 1jhm h ALA 333 N 0.21 1.08 0.27 0.00 0.00 -0.57 0.78 119.26 121.03 1jhm h ALA 333 Ca -0.02 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1jhm h ALA 333 Cb 0.45 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1jhm h ALA 333 CO 0.03 -0.05 -0.37 1.98 0.00 0.00 0.00 179.25 180.84 1jhm h MET 334 N 0.62 -0.67 -0.76 0.00 1.85 -0.62 0.37 114.93 115.71 1jhm h MET 334 Ca 0.39 0.05 0.11 0.00 -0.61 0.00 0.00 59.70 59.63 1jhm h MET 334 Cb 0.46 0.15 -0.08 0.00 0.43 0.00 0.00 31.60 32.56 1jhm h MET 334 CO -0.30 -0.45 0.38 0.35 -0.40 0.00 0.00 176.91 176.49 1jhm h PHE 335 N -0.70 0.67 0.10 1.39 3.57 -0.35 -2.46 116.94 119.16 1jhm h PHE 335 Ca -0.01 0.03 -0.34 0.00 3.53 0.00 0.00 57.97 61.18 1jhm h PHE 335 Cb 0.66 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.20 1jhm h PHE 335 CO -0.25 0.21 -1.88 0.45 -2.23 0.00 0.00 178.31 174.60 1jhm h HIS 336 N 0.61 0.38 -0.00 0.41 3.86 -0.61 -3.41 115.15 116.40 1jhm h HIS 336 Ca 0.39 -0.28 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 1jhm h HIS 336 Cb 0.45 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.91 1jhm h HIS 336 CO -0.11 1.57 -0.77 0.09 0.86 0.00 0.00 177.93 179.57 1jhm n ASN 337 N -3.38 1.11 -4.81 2.45 5.03 0.13 -4.97 115.26 110.82 1jhm n ASN 337 Ca -0.27 -0.96 -0.33 0.00 0.87 0.00 0.00 54.58 53.89 1jhm n ASN 337 Cb 1.05 0.72 -0.01 0.00 -1.02 0.00 0.00 39.78 40.53 1jhm n ASN 337 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 1jhm s MET 338 N -2.87 3.56 0.84 3.52 -1.94 -0.93 -5.04 119.30 116.42 1jhm s MET 338 Ca 0.11 1.20 -0.12 0.00 -1.71 0.00 0.00 55.69 55.17 1jhm s MET 338 Cb 0.17 -2.07 0.10 0.00 2.01 0.00 0.00 34.83 35.04 1jhm s MET 338 CO 0.77 -0.62 1.19 0.20 -0.01 0.00 0.00 175.02 176.55 1jhm s GLY 339 N -2.62 1.60 -0.04 -0.03 0.00 -1.26 -4.89 107.32 100.09 1jhm s GLY 339 Ca 0.64 -0.68 0.02 0.00 0.00 0.00 0.00 44.72 44.69 1jhm s GLY 339 CO 0.31 -0.16 -0.05 -0.54 0.00 0.00 0.00 173.10 172.66 1jhm s GLU 340 N -5.56 2.70 0.15 2.90 2.02 -1.26 -0.44 118.70 119.20 1jhm s GLU 340 Ca 0.63 -0.61 -0.22 0.00 0.02 0.00 0.00 54.97 54.79 1jhm s GLU 340 Cb -0.11 -2.58 0.03 0.00 0.10 0.00 0.00 34.13 31.57 1jhm s GLU 340 CO 0.50 0.64 1.63 -0.07 0.02 0.00 0.00 175.26 177.98 1jhm h LEU 341 N 4.87 -0.76 -0.95 1.80 3.38 -1.30 -1.28 115.31 121.06 1jhm h LEU 341 Ca -0.49 0.14 0.12 0.00 0.09 0.00 0.00 57.88 57.74 1jhm h LEU 341 Cb 1.17 0.36 -0.08 0.00 0.09 0.00 0.00 40.66 42.20 1jhm h LEU 341 CO 0.54 -0.27 0.58 0.00 0.09 0.00 0.00 178.44 179.37 1jhm h ALA 342 N 0.83 1.42 0.00 1.53 0.00 -1.79 0.31 119.26 121.56 1jhm h ALA 342 Ca 0.14 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1jhm h ALA 342 Cb 0.45 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1jhm h ALA 342 CO -0.39 0.16 -0.01 0.00 0.00 0.00 0.00 179.25 179.01 1jhm h ALA 343 N 1.52 1.02 -0.19 0.00 0.00 -1.62 -0.89 119.26 119.11 1jhm h ALA 343 Ca 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.38 1jhm h ALA 343 Cb 0.48 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1jhm h ALA 343 CO -0.27 0.01 0.00 0.43 0.00 0.00 0.00 179.25 179.41 1jhm n SER 344 N -3.12 2.94 -2.38 0.00 7.64 0.10 -4.93 113.62 113.87 1jhm n SER 344 Ca -0.02 -1.88 -0.16 0.00 1.01 0.00 0.00 58.87 57.83 1jhm n SER 344 Cb 0.17 -0.11 0.04 0.00 -1.01 0.00 0.00 64.21 63.29 1jhm n SER 344 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1jhm n ASN 345 N 1.18 -4.86 -4.54 6.43 5.03 -0.34 -4.98 115.26 113.17 1jhm n ASN 345 Ca 0.14 -0.28 -0.35 0.00 0.87 0.00 0.00 54.58 54.96 1jhm n ASN 345 Cb 0.52 -3.59 -0.11 0.00 -1.02 0.00 0.00 39.78 35.58 1jhm n ASN 345 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1jhm s ILE 346 N -3.09 4.43 -0.17 2.41 1.01 -0.64 -5.02 121.20 120.12 1jhm s ILE 346 Ca 0.30 -0.15 0.01 0.00 0.00 0.00 0.00 60.65 60.80 1jhm s ILE 346 Cb -0.13 -3.01 0.01 0.00 0.01 0.00 0.00 42.46 39.34 1jhm s ILE 346 CO 0.37 0.43 -0.17 -0.69 0.00 0.00 0.00 174.94 174.88 1jhm s VAL 347 N 0.75 2.35 -0.01 2.92 1.01 -1.26 -4.40 120.40 121.76 1jhm s VAL 347 Ca 0.02 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.19 1jhm s VAL 347 Cb -0.14 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.22 1jhm s VAL 347 CO 0.02 0.52 -0.13 -0.76 0.00 0.00 0.00 175.10 174.76 1jhm s LEU 348 N 1.11 2.84 0.00 3.92 1.43 -1.26 -5.22 118.68 121.50 1jhm s LEU 348 Ca 0.00 -0.23 0.08 0.00 -1.03 0.00 0.00 54.13 52.95 1jhm s LEU 348 Cb -0.14 -1.62 0.48 0.00 0.03 0.00 0.00 46.19 44.93 1jhm s LEU 348 CO -0.07 0.31 0.93 -2.65 0.23 0.00 0.00 176.35 175.11