#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jhp h HIS 5 N 0.00 0.42 0.50 1.96 3.86 -2.03 -0.51 115.15 119.35 1jhp h HIS 5 Ca 0.00 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.17 1jhp h HIS 5 Cb 0.00 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.34 1jhp h HIS 5 CO 0.00 0.38 -0.24 0.00 0.86 0.00 0.00 177.93 178.93 1jhp h ALA 6 N 1.66 -1.18 -0.67 2.45 0.00 -2.05 0.19 119.26 119.66 1jhp h ALA 6 Ca 0.10 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1jhp h ALA 6 Cb 0.18 0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.16 1jhp h ALA 6 CO -0.00 -1.13 -0.40 -0.11 0.00 0.00 0.00 179.25 177.61 1jhp n LEU 7 N -3.82 -0.71 -0.34 0.00 7.94 -1.03 -0.39 117.00 118.64 1jhp n LEU 7 Ca -0.08 1.44 0.09 0.00 -1.11 0.00 0.00 56.01 56.35 1jhp n LEU 7 Cb 0.27 -0.28 0.27 0.00 0.53 0.00 0.00 43.42 44.21 1jhp n LEU 7 CO 0.20 -1.09 1.18 -0.07 -1.11 0.00 0.00 177.39 176.50 1jhp h LEU 8 N 0.00 0.77 -0.53 -1.96 3.38 -1.06 -1.49 115.31 114.42 1jhp h LEU 8 Ca 0.11 0.08 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 1jhp h LEU 8 Cb 0.27 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1jhp h LEU 8 CO -0.63 0.34 -0.06 -0.09 0.09 0.00 0.00 178.44 178.09 1jhp h ARG 9 N 0.81 0.98 0.00 1.13 2.43 0.14 -3.12 114.38 116.76 1jhp h ARG 9 Ca 0.52 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 1jhp h ARG 9 Cb 0.69 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 1jhp h ARG 9 CO -0.33 1.02 0.00 -0.25 -1.51 0.00 0.00 179.97 178.89 1jhp n ASP 10 N -4.22 0.00 -4.65 -3.80 10.43 -0.10 -4.82 116.55 109.40 1jhp n ASP 10 Ca 0.01 -1.33 -0.43 0.00 2.57 0.00 0.00 54.79 55.62 1jhp n ASP 10 Cb 0.37 0.00 -0.02 0.00 1.84 0.00 0.00 41.12 43.30 1jhp n ASP 10 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1jhp s ILE 11 N -2.00 3.96 0.46 0.53 1.01 -1.18 -4.87 121.20 119.10 1jhp s ILE 11 Ca 0.05 1.12 -0.23 0.00 0.00 0.00 0.00 60.65 61.60 1jhp s ILE 11 Cb 0.02 -3.83 -0.07 0.00 0.01 0.00 0.00 42.46 38.59 1jhp s ILE 11 CO 0.04 -0.22 1.18 -2.16 0.00 0.00 0.00 174.94 173.78 1jhp s PRO 12 N 4.04 3.73 0.51 2.79 0.04 -1.26 -5.03 135.00 139.82 1jhp s PRO 12 Ca 0.63 1.81 -0.12 0.00 0.04 0.00 0.00 61.00 63.36 1jhp s PRO 12 Cb -0.24 -2.41 -0.06 0.00 0.04 0.00 0.00 34.50 31.83 1jhp s PRO 12 CO 0.23 -0.59 0.92 0.00 0.04 0.00 0.00 177.00 177.60 1jhp s ALA 13 N -1.52 3.19 0.55 8.56 0.00 -1.26 -4.99 121.76 126.28 1jhp s ALA 13 Ca 0.64 -0.07 -0.20 0.00 0.00 0.00 0.00 51.96 52.33 1jhp s ALA 13 Cb -0.29 -2.93 -0.05 0.00 0.00 0.00 0.00 23.12 19.84 1jhp s ALA 13 CO 0.36 -0.30 1.17 -1.25 0.00 0.00 0.00 175.76 175.73 1jhp s PRO 14 N -4.37 3.29 -0.87 0.00 0.04 -1.26 -4.81 135.00 127.01 1jhp s PRO 14 Ca 0.54 1.72 -0.23 0.00 0.04 0.00 0.00 61.00 63.07 1jhp s PRO 14 Cb -0.10 -2.04 0.06 0.00 0.04 0.00 0.00 34.50 32.45 1jhp s PRO 14 CO 0.39 -0.93 1.28 0.34 0.04 0.00 0.00 177.00 178.12 1jhp s ASP 15 N -1.63 6.37 0.47 6.66 3.68 0.93 -4.86 116.67 128.29 1jhp s ASP 15 Ca 0.73 -1.17 0.13 0.00 2.13 0.00 0.00 52.55 54.37 1jhp s ASP 15 Cb -0.27 -2.52 1.11 0.00 -1.45 0.00 0.00 42.92 39.79 1jhp s ASP 15 CO 0.30 -1.53 2.09 0.00 0.13 0.00 0.00 175.17 176.17 1jhp h ALA 16 N 9.69 1.93 -0.17 3.66 0.00 -1.92 -1.88 119.26 130.57 1jhp h ALA 16 Ca -0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1jhp h ALA 16 Cb 1.03 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1jhp h ALA 16 CO 1.30 0.04 0.04 1.49 0.00 0.00 0.00 179.25 182.12 1jhp h GLU 17 N 0.23 0.27 -0.56 0.00 4.22 -1.97 -0.29 114.58 116.48 1jhp h GLU 17 Ca 0.09 -0.07 0.02 0.00 0.08 0.00 0.00 59.36 59.48 1jhp h GLU 17 Cb 0.09 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1jhp h GLU 17 CO -0.02 0.42 0.36 0.00 -2.18 0.00 0.00 179.01 177.59 1jhp h ALA 18 N 0.84 0.72 -0.74 2.92 0.00 -1.74 -2.18 119.26 119.08 1jhp h ALA 18 Ca 0.05 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1jhp h ALA 18 Cb 0.28 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1jhp h ALA 18 CO 0.00 0.11 0.47 0.52 0.00 0.00 0.00 179.25 180.35 1jhp h MET 19 N 0.72 0.89 -0.53 0.00 2.86 -1.09 -0.77 114.93 117.02 1jhp h MET 19 Ca 0.22 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.74 1jhp h MET 19 Cb -0.03 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.40 1jhp h MET 19 CO -0.07 0.59 0.07 0.00 1.06 0.00 0.00 176.91 178.55 1jhp h ALA 20 N 1.31 1.11 -0.20 6.32 0.00 -0.69 -1.41 119.26 125.71 1jhp h ALA 20 Ca 0.29 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1jhp h ALA 20 Cb 0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1jhp h ALA 20 CO -0.10 0.58 -0.31 0.00 0.00 0.00 0.00 179.25 179.41 1jhp h ARG 21 N 0.81 0.40 -0.19 0.00 3.08 -0.76 -2.46 114.38 115.26 1jhp h ARG 21 Ca 0.17 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 1jhp h ARG 21 Cb 0.39 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 1jhp h ARG 21 CO 0.01 0.67 -0.01 1.15 -1.07 0.00 0.00 179.97 180.72 1jhp h THR 22 N 0.34 1.26 -0.34 2.04 2.02 -0.46 -1.75 112.91 116.03 1jhp h THR 22 Ca 0.04 -0.90 0.02 0.00 0.77 0.00 0.00 66.41 66.35 1jhp h THR 22 Cb 0.72 1.47 -0.03 0.00 -1.74 0.00 0.00 68.15 68.58 1jhp h THR 22 CO 0.06 0.27 0.17 -0.61 0.37 0.00 0.00 175.52 175.78 1jhp h GLN 23 N 0.09 0.34 -0.28 6.66 5.75 -1.22 0.22 115.11 126.68 1jhp h GLN 23 Ca 0.05 -0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.58 1jhp h GLN 23 Cb 0.41 -0.08 -0.05 0.00 1.07 0.00 0.00 27.48 28.84 1jhp h GLN 23 CO 0.01 0.22 -0.01 1.96 -2.65 0.00 0.00 178.83 178.36 1jhp h GLN 24 N 0.35 0.06 -0.77 1.69 7.50 -1.36 0.91 115.11 123.49 1jhp h GLN 24 Ca 0.14 -0.00 -0.02 0.00 0.50 0.00 0.00 58.65 59.27 1jhp h GLN 24 Cb 0.05 -0.01 -0.04 0.00 0.05 0.00 0.00 27.48 27.53 1jhp h GLN 24 CO -0.10 0.04 0.41 1.25 -1.50 0.00 0.00 178.83 178.94 1jhp h HIS 25 N 0.07 1.07 -0.47 2.96 -0.00 -0.73 -2.69 115.15 115.36 1jhp h HIS 25 Ca 0.13 -0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.46 1jhp h HIS 25 Cb 0.18 -0.34 -0.02 0.00 -0.00 0.00 0.00 27.41 27.23 1jhp h HIS 25 CO -0.23 0.75 0.23 0.82 -0.00 0.00 0.00 177.93 179.51 1jhp h ILE 26 N 1.07 1.18 -0.04 6.26 2.04 0.16 -2.34 117.51 125.84 1jhp h ILE 26 Ca 0.27 -0.51 0.01 0.00 1.00 0.00 0.00 64.86 65.63 1jhp h ILE 26 Cb 0.05 0.66 -0.00 0.00 -0.74 0.00 0.00 36.82 36.79 1jhp h ILE 26 CO -0.04 0.20 0.06 0.44 0.00 0.00 0.00 178.15 178.81 1jhp h ASP 27 N 0.61 0.00 -0.16 1.72 3.45 -0.52 -2.08 116.42 119.45 1jhp h ASP 27 Ca 0.16 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.62 1jhp h ASP 27 Cb 0.11 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.88 1jhp h ASP 27 CO -0.02 0.00 0.00 0.61 -1.57 0.00 0.00 179.24 178.26 1jhp n GLY 28 N -1.28 0.70 3.77 2.75 0.00 -0.88 -4.75 105.19 105.50 1jhp n GLY 28 Ca -0.02 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.14 1jhp n GLY 28 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jhp s LEU 29 N -1.73 2.73 0.00 0.99 1.02 -0.79 -1.09 118.68 119.81 1jhp s LEU 29 Ca 0.34 1.55 -0.18 0.00 0.02 0.00 0.00 54.13 55.87 1jhp s LEU 29 Cb 0.20 -4.19 -0.22 0.00 0.02 0.00 0.00 46.19 42.00 1jhp s LEU 29 CO 0.30 -2.07 1.30 0.18 0.02 0.00 0.00 176.35 176.08 1jhp n LEU 30 N -3.52 0.55 -3.61 1.79 4.77 0.85 -4.27 117.00 113.56 1jhp n LEU 30 Ca 0.08 -1.26 -0.01 0.00 -0.03 0.00 0.00 56.01 54.79 1jhp n LEU 30 Cb 0.55 -0.47 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 1jhp n LEU 30 CO 0.55 -1.66 1.12 -1.59 -1.33 0.00 0.00 177.39 174.48 1jhp s LYS 31 N 6.00 0.18 0.12 3.23 -2.85 -1.26 -5.00 119.74 120.15 1jhp s LYS 31 Ca 0.40 -0.08 -0.31 0.00 -1.00 0.00 0.00 55.97 54.98 1jhp s LYS 31 Cb 0.09 0.07 -0.09 0.00 -2.06 0.00 0.00 37.83 35.84 1jhp s LYS 31 CO 0.20 -0.08 1.58 -2.14 0.10 0.00 0.00 175.35 175.02 1jhp s PRO 32 N -2.22 4.22 0.17 1.78 0.02 -1.26 -4.87 135.00 132.84 1jhp s PRO 32 Ca 0.12 2.31 -0.33 0.00 0.02 0.00 0.00 61.00 63.12 1jhp s PRO 32 Cb 0.02 -3.36 -0.15 0.00 0.02 0.00 0.00 34.50 31.03 1jhp s PRO 32 CO -0.04 -0.64 1.30 -2.30 -0.33 0.00 0.00 177.00 174.99 1jhp n PRO 33 N 4.68 1.48 -0.85 5.54 -0.02 -1.26 -0.79 135.00 143.78 1jhp n PRO 33 Ca 0.14 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1jhp n PRO 33 Cb 0.40 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1jhp n PRO 33 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jhp n GLY 34 N 2.29 0.64 0.33 -1.23 0.00 -1.26 -4.88 105.19 101.09 1jhp n GLY 34 Ca 0.15 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.39 1jhp n GLY 34 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1jhp h SER 35 N 0.00 0.00 -0.50 1.61 4.64 -1.33 -2.23 113.55 115.74 1jhp h SER 35 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1jhp h SER 35 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1jhp h SER 35 CO 0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 1jhp n LEU 36 N -3.19 2.76 0.00 5.97 4.32 -1.26 -5.01 117.00 120.58 1jhp n LEU 36 Ca -0.03 -1.38 0.00 0.00 -0.02 0.00 0.00 56.01 54.58 1jhp n LEU 36 Cb 0.08 -0.35 0.00 0.00 -1.62 0.00 0.00 43.42 41.53 1jhp n LEU 36 CO 0.21 0.66 0.00 0.61 -1.22 0.00 0.00 177.39 177.66 1jhp n GLY 37 N 1.26 2.54 0.32 -0.72 0.00 -0.84 -1.59 105.19 106.16 1jhp n GLY 37 Ca 0.17 0.19 0.20 0.00 0.00 0.00 0.00 46.02 46.58 1jhp n GLY 37 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1jhp h ARG 38 N 0.00 0.00 -0.24 1.61 3.08 -1.95 -1.01 114.38 115.87 1jhp h ARG 38 Ca 0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 1jhp h ARG 38 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1jhp h ARG 38 CO 0.00 0.00 -0.30 1.25 -1.07 0.00 0.00 179.97 179.85 1jhp h LEU 39 N 0.00 0.50 -0.04 3.04 5.85 -1.73 0.26 115.31 123.19 1jhp h LEU 39 Ca -0.00 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 1jhp h LEU 39 Cb 0.00 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 40.90 1jhp h LEU 39 CO 0.00 0.78 -0.03 -0.33 -0.34 0.00 0.00 178.44 178.52 1jhp h GLU 40 N 0.43 0.09 -0.08 1.25 5.08 -1.22 -2.01 114.58 118.12 1jhp h GLU 40 Ca 0.06 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.39 1jhp h GLU 40 Cb 0.74 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 1jhp h GLU 40 CO 0.06 0.53 -0.04 1.15 -1.00 0.00 0.00 179.01 179.71 1jhp h THR 41 N -0.35 0.86 -0.22 1.13 2.02 -1.43 -0.87 112.91 114.05 1jhp h THR 41 Ca 0.01 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.25 1jhp h THR 41 Cb 0.51 0.86 -0.07 0.00 -1.74 0.00 0.00 68.15 67.71 1jhp h THR 41 CO 0.01 0.00 -0.31 0.25 0.37 0.00 0.00 175.52 175.84 1jhp h LEU 42 N -0.04 -0.97 -1.13 2.58 5.85 -0.48 0.11 115.31 121.23 1jhp h LEU 42 Ca 0.05 0.16 0.12 0.00 0.84 0.00 0.00 57.88 59.05 1jhp h LEU 42 Cb 0.11 0.43 -0.08 0.00 0.37 0.00 0.00 40.66 41.50 1jhp h LEU 42 CO -0.11 -0.33 0.60 0.00 -0.34 0.00 0.00 178.44 178.26 1jhp h ALA 43 N 0.58 1.64 -0.39 1.25 0.00 -0.83 -0.32 119.26 121.19 1jhp h ALA 43 Ca 0.12 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 1jhp h ALA 43 Cb 0.53 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1jhp h ALA 43 CO -0.40 0.13 -0.33 0.28 0.00 0.00 0.00 179.25 178.92 1jhp h VAL 44 N 0.88 1.28 -0.70 0.00 2.07 0.06 -2.15 116.25 117.68 1jhp h VAL 44 Ca 0.47 -1.50 0.05 0.00 0.82 0.00 0.00 66.70 66.54 1jhp h VAL 44 Cb 0.55 1.33 -0.05 0.00 -1.52 0.00 0.00 31.29 31.59 1jhp h VAL 44 CO -0.23 0.50 0.41 -0.61 0.02 0.00 0.00 177.57 177.66 1jhp h GLN 45 N 0.73 0.74 -0.57 1.57 4.15 0.76 -1.98 115.11 120.52 1jhp h GLN 45 Ca 0.07 -0.04 -0.08 0.00 0.77 0.00 0.00 58.65 59.37 1jhp h GLN 45 Cb 0.90 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 28.40 1jhp h GLN 45 CO 0.08 0.49 0.05 -0.07 -1.93 0.00 0.00 178.83 177.45 1jhp h LEU 46 N 0.77 0.91 -2.23 -2.39 3.38 -0.97 -2.64 115.31 112.14 1jhp h LEU 46 Ca 0.31 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1jhp h LEU 46 Cb 0.15 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 1jhp h LEU 46 CO -0.16 0.94 -0.05 0.00 0.09 0.00 0.00 178.44 179.26 1jhp h ALA 47 N 1.16 1.48 0.00 1.53 0.00 -0.70 -2.14 119.26 120.59 1jhp h ALA 47 Ca 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1jhp h ALA 47 Cb 0.46 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1jhp h ALA 47 CO 0.02 0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.74 1jhp n GLY 48 N -1.11 -1.61 3.63 0.00 0.00 -0.99 -4.30 105.19 100.81 1jhp n GLY 48 Ca -0.03 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 1jhp n GLY 48 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1jhp s MET 49 N -3.06 4.04 0.36 1.61 1.00 -0.81 -0.05 119.30 122.40 1jhp s MET 49 Ca 0.12 1.01 0.08 0.00 0.00 0.00 0.00 55.69 56.90 1jhp s MET 49 Cb 0.15 -3.74 0.80 0.00 0.00 0.00 0.00 34.83 32.03 1jhp s MET 49 CO 0.56 -0.91 1.91 -1.35 0.00 0.00 0.00 175.02 175.24 1jhp h PRO 50 N 8.14 0.68 0.00 2.03 0.11 -1.86 0.03 132.00 141.13 1jhp h PRO 50 Ca -0.21 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1jhp h PRO 50 Cb 1.06 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1jhp h PRO 50 CO 1.03 0.45 0.00 0.41 -0.21 0.00 0.00 178.00 179.68 1jhp n GLY 51 N -1.45 -0.88 0.65 -0.55 0.00 -0.46 -2.57 105.19 99.94 1jhp n GLY 51 Ca 0.14 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.23 1jhp n GLY 51 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jhp n LEU 52 N -1.40 2.07 -3.34 0.99 4.77 -0.00 -4.98 117.00 115.11 1jhp n LEU 52 Ca 0.05 -0.69 -0.17 0.00 -0.03 0.00 0.00 56.01 55.17 1jhp n LEU 52 Cb 0.14 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.31 1jhp n LEU 52 CO 0.12 0.35 0.13 0.59 -1.33 0.00 0.00 177.39 177.24 1jhp n ASN 53 N 0.58 -2.70 -0.62 -1.43 3.02 -1.06 -3.10 115.26 109.96 1jhp n ASN 53 Ca 0.17 -0.58 -0.08 0.00 -0.03 0.00 0.00 54.58 54.06 1jhp n ASN 53 Cb 0.45 -4.90 -0.03 0.00 -0.61 0.00 0.00 39.78 34.69 1jhp n ASN 53 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jhp n GLY 54 N -1.25 0.81 3.23 7.41 0.00 -1.26 -4.96 105.19 109.17 1jhp n GLY 54 Ca -0.23 -0.05 -0.11 0.00 0.00 0.00 0.00 46.02 45.63 1jhp n GLY 54 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1jhp s THR 55 N -1.78 0.09 -0.25 2.61 -1.32 -1.18 -4.89 115.64 108.91 1jhp s THR 55 Ca 0.00 -0.72 -0.29 0.00 -1.21 0.00 0.00 61.69 59.47 1jhp s THR 55 Cb 0.00 -0.92 -0.01 0.00 -1.51 0.00 0.00 72.50 70.06 1jhp s THR 55 CO 0.00 -0.40 1.42 -2.16 -2.21 0.00 0.00 174.62 171.27 1jhp s PRO 56 N -2.50 3.91 -0.02 7.08 0.04 -1.26 -4.53 135.00 137.72 1jhp s PRO 56 Ca -0.05 1.46 -0.21 0.00 0.04 0.00 0.00 61.00 62.24 1jhp s PRO 56 Cb -0.01 -3.93 0.04 0.00 0.04 0.00 0.00 34.50 30.64 1jhp s PRO 56 CO -0.03 -1.14 0.45 1.14 0.04 0.00 0.00 177.00 177.46 1jhp s GLN 57 N 4.28 0.83 -0.14 4.56 -2.07 -1.26 -4.79 119.66 121.08 1jhp s GLN 57 Ca 0.62 -0.07 -0.01 0.00 -1.82 0.00 0.00 55.36 54.08 1jhp s GLN 57 Cb -0.20 0.38 0.04 0.00 -1.09 0.00 0.00 33.01 32.13 1jhp s GLN 57 CO 0.25 -0.25 -0.03 0.08 -1.32 0.00 0.00 175.29 174.01 1jhp s VAL 58 N -1.46 0.87 0.00 3.63 1.01 -1.26 -4.98 120.40 118.21 1jhp s VAL 58 Ca -0.11 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1jhp s VAL 58 Cb -0.03 -1.06 0.00 0.00 0.00 0.00 0.00 36.38 35.29 1jhp s VAL 58 CO 0.05 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.91 1jhp n GLY 59 N 4.96 0.90 3.90 4.51 0.00 -1.26 -5.03 105.19 113.17 1jhp n GLY 59 Ca -0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 1jhp n GLY 59 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jhp s GLU 60 N 1.19 3.65 -0.05 1.61 0.41 -0.52 -4.84 118.70 120.16 1jhp s GLU 60 Ca 0.00 0.12 0.05 0.00 -0.41 0.00 0.00 54.97 54.73 1jhp s GLU 60 Cb 0.00 -2.56 -0.01 0.00 -1.78 0.00 0.00 34.13 29.78 1jhp s GLU 60 CO 0.00 0.12 -0.20 0.15 -0.49 0.00 0.00 175.26 174.83 1jhp s LYS 61 N -3.76 2.06 0.02 1.61 1.02 -1.26 -0.53 119.74 118.90 1jhp s LYS 61 Ca 0.46 -0.72 0.02 0.00 0.02 0.00 0.00 55.97 55.75 1jhp s LYS 61 Cb -0.10 -1.77 -0.02 0.00 -0.52 0.00 0.00 37.83 35.42 1jhp s LYS 61 CO 0.32 0.30 -0.07 0.00 -0.92 0.00 0.00 175.35 174.97 1jhp s ALA 62 N -0.04 0.58 -0.20 5.17 0.00 -0.71 -0.16 121.76 126.41 1jhp s ALA 62 Ca -0.04 -0.57 -0.01 0.00 0.00 0.00 0.00 51.96 51.34 1jhp s ALA 62 Cb -0.12 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 22.97 1jhp s ALA 62 CO 0.03 0.05 -0.12 0.08 0.00 0.00 0.00 175.76 175.80 1jhp s VAL 63 N -0.86 2.73 -0.29 0.00 1.01 0.21 -0.68 120.40 122.52 1jhp s VAL 63 Ca -0.04 -0.71 -0.12 0.00 0.00 0.00 0.00 61.98 61.10 1jhp s VAL 63 Cb -0.07 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 1jhp s VAL 63 CO 0.00 0.48 0.22 -0.76 0.00 0.00 0.00 175.10 175.04 1jhp s LEU 64 N 1.31 4.14 -0.30 3.92 1.02 -0.18 0.83 118.68 129.42 1jhp s LEU 64 Ca 0.04 -0.09 -0.06 0.00 0.02 0.00 0.00 54.13 54.04 1jhp s LEU 64 Cb -0.14 -2.15 0.01 0.00 0.02 0.00 0.00 46.19 43.94 1jhp s LEU 64 CO -0.07 -0.11 0.07 -0.69 0.02 0.00 0.00 176.35 175.57 1jhp s VAL 65 N 1.77 3.84 -0.33 -1.59 1.01 0.11 -0.18 120.40 125.02 1jhp s VAL 65 Ca 0.07 -0.78 -0.20 0.00 0.00 0.00 0.00 61.98 61.08 1jhp s VAL 65 Cb -0.16 -3.00 -0.00 0.00 0.00 0.00 0.00 36.38 33.21 1jhp s VAL 65 CO 0.11 0.06 0.59 -0.04 0.00 0.00 0.00 175.10 175.82 1jhp s MET 66 N 1.47 3.75 -0.11 2.72 1.00 -0.36 -0.50 119.30 127.28 1jhp s MET 66 Ca 0.02 0.08 -0.01 0.00 0.00 0.00 0.00 55.69 55.78 1jhp s MET 66 Cb -0.17 -3.78 -0.03 0.00 0.00 0.00 0.00 34.83 30.85 1jhp s MET 66 CO 0.02 -0.64 -0.08 0.00 0.00 0.00 0.00 175.02 174.32 1jhp s ALA 68 N -0.16 -1.86 0.28 0.00 0.00 -0.29 -1.30 121.76 118.43 1jhp s ALA 68 Ca 0.01 1.42 0.02 0.00 0.00 0.00 0.00 51.96 53.42 1jhp s ALA 68 Cb -0.13 -0.35 -0.03 0.00 0.00 0.00 0.00 23.12 22.61 1jhp s ALA 68 CO 0.03 -0.37 0.44 -0.51 0.00 0.00 0.00 175.76 175.35 1jhp s ASP 69 N -1.29 6.32 -0.03 0.00 1.11 -0.53 -3.97 116.67 118.28 1jhp s ASP 69 Ca -0.04 0.28 0.03 0.00 0.18 0.00 0.00 52.55 53.00 1jhp s ASP 69 Cb -0.00 -1.95 0.00 0.00 1.07 0.00 0.00 42.92 42.03 1jhp s ASP 69 CO 0.03 -0.16 -0.12 -1.00 1.18 0.00 0.00 175.17 175.10 1jhp s HIS 70 N -2.10 1.26 0.30 4.23 3.76 -1.26 -1.94 115.29 119.54 1jhp s HIS 70 Ca 0.37 -0.34 -0.01 0.00 -0.15 0.00 0.00 55.06 54.93 1jhp s HIS 70 Cb -0.10 -0.87 0.48 0.00 1.11 0.00 0.00 32.58 33.20 1jhp s HIS 70 CO 0.32 -0.13 1.95 0.78 -0.85 0.00 0.00 174.74 176.81 1jhp h GLY 71 N 6.34 1.22 1.18 -2.22 0.00 -1.37 -2.22 103.07 105.99 1jhp h GLY 71 Ca -0.33 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.57 1jhp h GLY 71 CO 0.48 0.38 0.26 1.55 0.00 0.00 0.00 176.54 179.22 1jhp n VAL 72 N -4.44 0.85 0.05 4.60 3.14 -1.26 -1.43 118.33 119.84 1jhp n VAL 72 Ca 0.11 0.64 0.14 0.00 -2.96 0.00 0.00 64.34 62.26 1jhp n VAL 72 Cb 0.09 -1.64 0.61 0.00 -1.06 0.00 0.00 33.84 31.84 1jhp n VAL 72 CO 0.00 0.00 0.00 -0.25 -6.46 0.00 0.00 176.83 170.12 1jhp h TRP 73 N 0.00 0.15 0.00 1.45 7.01 -1.73 -0.81 115.95 122.02 1jhp h TRP 73 Ca 0.00 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1jhp h TRP 73 Cb 0.53 -0.05 0.00 0.00 -2.10 0.00 0.00 29.16 27.54 1jhp h TRP 73 CO 0.00 0.07 0.00 -0.25 -2.79 0.00 0.00 178.44 175.47 1jhp n ASP 74 N -4.45 0.00 -0.64 2.65 8.00 -0.52 -2.65 116.55 118.94 1jhp n ASP 74 Ca 0.06 0.33 0.05 0.00 0.71 0.00 0.00 54.79 55.94 1jhp n ASP 74 Cb 0.37 -0.41 0.14 0.00 -0.02 0.00 0.00 41.12 41.20 1jhp n ASP 74 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1jhp n GLU 75 N -1.41 1.84 -2.03 -1.24 -0.58 -0.31 -4.91 120.64 111.99 1jhp n GLU 75 Ca 0.05 -1.17 -0.13 0.00 -0.42 0.00 0.00 57.16 55.49 1jhp n GLU 75 Cb 0.14 -1.31 -0.02 0.00 -0.57 0.00 0.00 31.44 29.69 1jhp n GLU 75 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1jhp n GLY 76 N 0.94 0.21 0.07 0.62 0.00 -1.08 -4.93 105.19 101.02 1jhp n GLY 76 Ca 0.11 -0.38 0.12 0.00 0.00 0.00 0.00 46.02 45.87 1jhp n GLY 76 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1jhp n VAL 77 N -3.68 0.40 -4.14 1.61 0.24 -1.26 -4.86 118.33 106.64 1jhp n VAL 77 Ca -0.14 -0.27 -0.25 0.00 -2.04 0.00 0.00 64.34 61.64 1jhp n VAL 77 Cb 0.57 -0.22 -0.17 0.00 -1.47 0.00 0.00 33.84 32.55 1jhp n VAL 77 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jhp s ALA 78 N -3.15 1.13 -0.95 2.33 0.00 -1.26 -4.96 121.76 114.90 1jhp s ALA 78 Ca 0.07 -0.38 0.28 0.00 0.00 0.00 0.00 51.96 51.94 1jhp s ALA 78 Cb 0.13 -0.71 1.10 0.00 0.00 0.00 0.00 23.12 23.65 1jhp s ALA 78 CO 0.69 -0.19 1.86 1.55 0.00 0.00 0.00 175.76 179.67 1jhp n VAL 79 N 4.47 0.10 -2.68 0.00 3.14 -1.26 -4.76 118.33 117.33 1jhp n VAL 79 Ca -0.17 -0.05 -0.39 0.00 -2.96 0.00 0.00 64.34 60.77 1jhp n VAL 79 Cb 0.51 -0.45 -0.06 0.00 -1.06 0.00 0.00 33.84 32.78 1jhp n VAL 79 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 1jhp s SER 80 N -3.25 7.41 0.31 6.55 0.01 -1.26 -4.99 113.70 118.47 1jhp s SER 80 Ca 0.13 1.99 -0.29 0.00 1.31 0.00 0.00 55.95 59.09 1jhp s SER 80 Cb 0.18 -2.60 -0.10 0.00 0.21 0.00 0.00 66.02 63.70 1jhp s SER 80 CO 0.56 -0.02 1.27 -2.84 0.41 0.00 0.00 173.24 172.62 1jhp s PRO 81 N -1.59 4.41 0.31 12.44 0.02 -1.26 -4.90 135.00 144.42 1jhp s PRO 81 Ca 0.46 2.13 0.06 0.00 0.02 0.00 0.00 61.00 63.67 1jhp s PRO 81 Cb -0.25 -3.11 0.84 0.00 0.02 0.00 0.00 34.50 32.01 1jhp s PRO 81 CO 0.31 -0.13 1.64 -0.22 -0.33 0.00 0.00 177.00 178.27 1jhp h LYS 82 N 3.71 0.21 0.00 5.54 3.64 -1.94 -0.52 116.57 127.21 1jhp h LYS 82 Ca -0.48 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1jhp h LYS 82 Cb 1.22 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1jhp h LYS 82 CO 0.67 0.14 0.04 -0.84 -2.27 0.00 0.00 179.45 177.19 1jhp h ILE 83 N 0.22 0.00 -0.41 2.00 -0.00 -1.95 -2.74 117.51 114.63 1jhp h ILE 83 Ca 0.62 0.00 0.05 0.00 -0.00 0.00 0.00 64.86 65.52 1jhp h ILE 83 Cb 1.32 0.67 -0.02 0.00 -0.00 0.00 0.00 36.82 38.79 1jhp h ILE 83 CO -0.67 0.00 0.27 0.58 -0.00 0.00 0.00 178.15 178.34 1jhp h VAL 84 N 0.00 0.98 -0.11 0.16 2.07 -1.46 -1.28 116.25 116.62 1jhp h VAL 84 Ca 0.00 -0.12 0.04 0.00 0.82 0.00 0.00 66.70 67.43 1jhp h VAL 84 Cb 0.07 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 1jhp h VAL 84 CO 0.00 0.07 -0.12 0.74 0.02 0.00 0.00 177.57 178.27 1jhp h THR 85 N 0.36 0.66 -0.36 2.57 2.02 -1.71 0.18 112.91 116.63 1jhp h THR 85 Ca 0.17 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.34 1jhp h THR 85 Cb 0.24 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 1jhp h THR 85 CO -0.04 0.00 0.15 0.00 0.37 0.00 0.00 175.52 176.00 1jhp h ALA 86 N 0.91 0.46 0.67 6.16 0.00 -1.62 0.07 119.26 125.91 1jhp h ALA 86 Ca 0.08 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1jhp h ALA 86 Cb 0.27 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1jhp h ALA 86 CO -0.20 0.05 -0.33 0.82 0.00 0.00 0.00 179.25 179.59 1jhp h ILE 87 N 0.43 0.32 -0.92 0.00 5.03 -0.94 -2.00 117.51 119.44 1jhp h ILE 87 Ca 0.12 0.00 0.05 0.00 -0.12 0.00 0.00 64.86 64.91 1jhp h ILE 87 Cb 0.17 0.32 -0.06 0.00 -3.03 0.00 0.00 36.82 34.22 1jhp h ILE 87 CO -0.01 0.00 0.60 1.56 -0.68 0.00 0.00 178.15 179.62 1jhp h GLN 88 N -0.92 1.06 -0.79 2.37 1.08 -0.67 -0.34 115.11 116.90 1jhp h GLN 88 Ca -0.09 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.05 1jhp h GLN 88 Cb 0.71 -0.24 -0.04 0.00 -0.05 0.00 0.00 27.48 27.86 1jhp h GLN 88 CO 0.14 0.70 0.50 0.00 -0.95 0.00 0.00 178.83 179.22 1jhp h ALA 89 N 1.49 1.01 -0.64 3.87 0.00 -0.82 0.13 119.26 124.30 1jhp h ALA 89 Ca 0.39 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 1jhp h ALA 89 Cb 0.13 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 1jhp h ALA 89 CO -0.14 0.45 0.26 0.00 0.00 0.00 0.00 179.25 179.83 1jhp h ALA 90 N 1.27 0.82 -0.52 0.00 0.00 -0.47 -2.29 119.26 118.08 1jhp h ALA 90 Ca 0.29 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1jhp h ALA 90 Cb -0.08 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1jhp h ALA 90 CO -0.06 0.43 0.34 -0.91 0.00 0.00 0.00 179.25 179.06 1jhp h ASN 91 N 0.89 0.59 -0.85 0.00 2.35 -0.02 -0.08 115.58 118.45 1jhp h ASN 91 Ca 0.21 -0.02 0.16 0.00 -0.55 0.00 0.00 56.30 56.10 1jhp h ASN 91 Cb 0.19 -0.15 -0.06 0.00 0.05 0.00 0.00 38.32 38.35 1jhp h ASN 91 CO -0.02 0.43 0.56 0.24 -1.65 0.00 0.00 177.43 176.99 1jhp h MET 92 N 0.70 0.55 0.00 0.81 2.86 -0.42 0.43 114.93 119.86 1jhp h MET 92 Ca 0.19 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 1jhp h MET 92 Cb -0.08 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.46 1jhp h MET 92 CO -0.04 0.36 0.00 0.25 1.06 0.00 0.00 176.91 178.54 1jhp n THR 93 N -4.53 0.76 0.65 2.22 -2.24 -0.05 -3.04 114.28 108.05 1jhp n THR 93 Ca 0.17 0.17 0.07 0.00 -2.27 0.00 0.00 64.05 62.19 1jhp n THR 93 Cb 0.53 -0.91 0.01 0.00 -2.10 0.00 0.00 70.33 67.85 1jhp n THR 93 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1jhp n ARG 94 N -1.68 1.70 -2.03 -0.78 1.74 0.15 -4.99 116.66 110.76 1jhp n ARG 94 Ca 0.04 -0.84 -0.09 0.00 -0.77 0.00 0.00 57.85 56.20 1jhp n ARG 94 Cb 0.23 -1.24 -0.01 0.00 -1.02 0.00 0.00 32.46 30.42 1jhp n ARG 94 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jhp n GLY 95 N 1.06 0.17 0.28 -0.13 0.00 -0.98 -4.93 105.19 100.66 1jhp n GLY 95 Ca 0.06 -0.54 0.08 0.00 0.00 0.00 0.00 46.02 45.62 1jhp n GLY 95 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jhp n THR 96 N -3.81 0.00 -1.99 2.61 -2.24 -1.23 -4.45 114.28 103.16 1jhp n THR 96 Ca -0.10 -0.28 -0.28 0.00 -2.27 0.00 0.00 64.05 61.12 1jhp n THR 96 Cb 0.53 1.15 0.09 0.00 -2.10 0.00 0.00 70.33 70.00 1jhp n THR 96 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1jhp s THR 97 N -2.06 2.08 0.18 4.28 -4.23 -1.26 -4.89 115.64 109.74 1jhp s THR 97 Ca 0.12 -0.08 -0.13 0.00 -1.18 0.00 0.00 61.69 60.41 1jhp s THR 97 Cb 0.13 -3.00 0.08 0.00 1.34 0.00 0.00 72.50 71.05 1jhp s THR 97 CO 0.47 0.00 1.84 1.23 -0.54 0.00 0.00 174.62 177.61 1jhp h GLY 98 N -0.94 0.78 0.98 3.99 0.00 -1.97 -1.92 103.07 103.99 1jhp h GLY 98 Ca -0.45 -0.28 -0.03 0.00 0.00 0.00 0.00 47.33 46.57 1jhp h GLY 98 CO 0.63 0.26 0.21 -2.08 0.00 0.00 0.00 176.54 175.57 1jhp h VAL 99 N 0.72 1.22 -0.18 4.60 2.07 -1.88 -2.05 116.25 120.74 1jhp h VAL 99 Ca 0.21 -0.69 0.05 0.00 0.82 0.00 0.00 66.70 67.09 1jhp h VAL 99 Cb -0.05 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 30.33 1jhp h VAL 99 CO -0.06 0.26 -0.14 0.00 0.02 0.00 0.00 177.57 177.65 1jhp h VAL 101 N -0.15 1.16 -0.40 0.00 2.07 -1.26 -0.64 116.25 117.03 1jhp h VAL 101 Ca 0.11 -0.42 -0.12 0.00 0.82 0.00 0.00 66.70 67.09 1jhp h VAL 101 Cb 0.31 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1jhp h VAL 101 CO -0.27 0.16 -0.24 -0.07 0.02 0.00 0.00 177.57 177.17 1jhp h LEU 102 N 0.47 0.90 -0.03 2.57 3.38 -1.13 -2.47 115.31 118.99 1jhp h LEU 102 Ca 0.13 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 57.68 1jhp h LEU 102 Cb 0.09 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 1jhp h LEU 102 CO -0.02 1.12 0.02 0.00 0.09 0.00 0.00 178.44 179.65 1jhp h ALA 103 N 0.80 0.04 -0.96 1.53 0.00 0.29 -1.42 119.26 119.55 1jhp h ALA 103 Ca 0.08 -0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.09 1jhp h ALA 103 Cb 0.81 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.50 1jhp h ALA 103 CO 0.07 -0.43 0.59 0.00 0.00 0.00 0.00 179.25 179.47 1jhp h ALA 104 N 0.96 1.46 -0.30 0.00 0.00 -1.11 0.42 119.26 120.69 1jhp h ALA 104 Ca 0.01 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1jhp h ALA 104 Cb 0.05 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1jhp h ALA 104 CO -0.00 0.14 -0.03 0.37 0.00 0.00 0.00 179.25 179.72 1jhp h GLN 105 N 0.90 0.47 -0.01 0.00 5.75 -0.98 -2.15 115.11 119.08 1jhp h GLN 105 Ca 0.49 -0.10 0.00 0.00 -0.15 0.00 0.00 58.65 58.89 1jhp h GLN 105 Cb 0.55 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.03 1jhp h GLN 105 CO -0.29 0.52 -0.06 0.00 -2.65 0.00 0.00 178.83 176.36 1jhp n ALA 106 N -2.48 2.70 -1.50 3.38 0.00 0.11 -4.92 120.51 117.79 1jhp n ALA 106 Ca 0.01 -0.38 -0.10 0.00 0.00 0.00 0.00 53.44 52.97 1jhp n ALA 106 Cb 0.25 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.43 1jhp n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jhp n GLY 107 N 1.19 0.87 3.95 0.00 0.00 0.74 -4.94 105.19 106.99 1jhp n GLY 107 Ca 0.18 -0.55 -0.25 0.00 0.00 0.00 0.00 46.02 45.41 1jhp n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jhp s ALA 108 N -2.40 3.85 -0.12 4.61 0.00 -0.22 -4.62 121.76 122.86 1jhp s ALA 108 Ca 0.00 -0.99 -0.03 0.00 0.00 0.00 0.00 51.96 50.94 1jhp s ALA 108 Cb 0.00 -1.91 -0.03 0.00 0.00 0.00 0.00 23.12 21.18 1jhp s ALA 108 CO 0.00 0.30 -0.02 0.15 0.00 0.00 0.00 175.76 176.19 1jhp s LYS 109 N -3.71 3.30 -0.14 0.00 1.02 0.78 -4.16 119.74 116.82 1jhp s LYS 109 Ca 0.37 -0.46 -0.16 0.00 0.02 0.00 0.00 55.97 55.74 1jhp s LYS 109 Cb -0.10 -2.85 -0.04 0.00 -0.52 0.00 0.00 37.83 34.31 1jhp s LYS 109 CO 0.30 0.49 0.39 0.08 -0.92 0.00 0.00 175.35 175.69 1jhp s VAL 110 N -0.31 5.24 -0.23 3.17 1.01 -1.26 0.64 120.40 128.66 1jhp s VAL 110 Ca 0.06 0.76 -0.01 0.00 0.00 0.00 0.00 61.98 62.79 1jhp s VAL 110 Cb -0.12 -3.73 0.02 0.00 0.00 0.00 0.00 36.38 32.55 1jhp s VAL 110 CO 0.02 0.35 -0.10 -1.00 0.00 0.00 0.00 175.10 174.38 1jhp s HIS 111 N 0.59 3.01 -0.24 5.22 3.76 0.24 -4.92 115.29 122.94 1jhp s HIS 111 Ca 0.21 -1.58 -0.17 0.00 -0.15 0.00 0.00 55.06 53.38 1jhp s HIS 111 Cb -0.14 -2.02 -0.03 0.00 1.11 0.00 0.00 32.58 31.50 1jhp s HIS 111 CO 0.07 -0.74 0.45 0.08 -0.85 0.00 0.00 174.74 173.74 1jhp s VAL 112 N 1.31 5.13 -0.12 -0.90 1.01 -1.26 0.04 120.40 125.62 1jhp s VAL 112 Ca 0.01 0.75 0.02 0.00 0.00 0.00 0.00 61.98 62.77 1jhp s VAL 112 Cb -0.16 -3.77 0.01 0.00 0.00 0.00 0.00 36.38 32.47 1jhp s VAL 112 CO -0.06 0.15 -0.19 -0.63 0.00 0.00 0.00 175.10 174.37 1jhp s ILE 113 N 1.95 1.78 -0.45 2.22 1.09 0.35 -0.59 121.20 127.55 1jhp s ILE 113 Ca 0.19 -0.82 -0.20 0.00 -1.10 0.00 0.00 60.65 58.72 1jhp s ILE 113 Cb -0.15 -1.59 0.03 0.00 -1.06 0.00 0.00 42.46 39.69 1jhp s ILE 113 CO 0.09 0.50 0.60 -0.62 -0.10 0.00 0.00 174.94 175.41 1jhp s ASP 114 N 0.79 6.28 0.00 3.58 3.68 0.81 -0.76 116.67 131.04 1jhp s ASP 114 Ca -0.09 -0.52 0.14 0.00 2.13 0.00 0.00 52.55 54.20 1jhp s ASP 114 Cb -0.16 -2.30 0.05 0.00 -1.45 0.00 0.00 42.92 39.07 1jhp s ASP 114 CO 0.00 -0.77 0.85 1.33 0.13 0.00 0.00 175.17 176.72 1jhp n VAL 115 N 5.73 0.00 0.00 1.11 0.24 -0.42 -0.61 118.33 124.39 1jhp n VAL 115 Ca -0.04 -0.42 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 1jhp n VAL 115 Cb 0.47 1.23 0.00 0.00 -1.47 0.00 0.00 33.84 34.07 1jhp n VAL 115 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jhp n GLY 116 N 0.93 0.00 3.74 7.63 0.00 -1.12 -1.44 105.19 114.94 1jhp n GLY 116 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1jhp n GLY 116 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jhp s ILE 117 N 0.00 3.69 -1.31 -0.61 1.01 -1.26 -0.77 121.20 121.96 1jhp s ILE 117 Ca 0.00 1.46 -0.11 0.00 0.00 0.00 0.00 60.65 62.00 1jhp s ILE 117 Cb 0.00 -3.93 0.14 0.00 0.01 0.00 0.00 42.46 38.68 1jhp s ILE 117 CO 0.00 0.25 1.89 -0.67 0.00 0.00 0.00 174.94 176.41 1jhp n ASP 118 N 2.35 4.87 -3.62 3.58 4.64 -1.26 -4.18 116.55 122.92 1jhp n ASP 118 Ca 0.03 -3.04 -0.02 0.00 -1.38 0.00 0.00 54.79 50.38 1jhp n ASP 118 Cb 0.45 -1.53 -0.00 0.00 -1.04 0.00 0.00 41.12 39.00 1jhp n ASP 118 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1jhp s ALA 119 N 1.18 -1.74 0.59 -1.67 0.00 -1.26 -4.99 121.76 113.87 1jhp s ALA 119 Ca 0.42 0.08 -0.18 0.00 0.00 0.00 0.00 51.96 52.28 1jhp s ALA 119 Cb 0.09 0.63 -0.03 0.00 0.00 0.00 0.00 23.12 23.81 1jhp s ALA 119 CO -0.01 -1.05 1.16 -1.21 0.00 0.00 0.00 175.76 174.64 1jhp s GLU 120 N -2.81 3.05 0.56 0.00 2.02 -1.26 -4.93 118.70 115.33 1jhp s GLU 120 Ca 0.16 1.65 -0.19 0.00 0.02 0.00 0.00 54.97 56.60 1jhp s GLU 120 Cb -0.01 -1.96 -0.07 0.00 0.10 0.00 0.00 34.13 32.20 1jhp s GLU 120 CO 0.02 -1.10 0.87 -2.30 0.02 0.00 0.00 175.26 172.77 1jhp n PRO 121 N -1.70 0.89 -3.86 0.39 -0.02 -1.26 -4.97 135.00 124.48 1jhp n PRO 121 Ca 0.12 0.34 -0.36 0.00 -2.02 0.00 0.00 63.50 61.58 1jhp n PRO 121 Cb 0.51 -2.04 -0.14 0.00 -0.02 0.00 0.00 33.50 31.81 1jhp n PRO 121 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1jhp s ILE 122 N -1.52 3.54 0.48 4.25 1.01 -1.26 -5.08 121.20 122.62 1jhp s ILE 122 Ca 0.72 -0.60 -0.24 0.00 0.00 0.00 0.00 60.65 60.53 1jhp s ILE 122 Cb -0.45 -2.70 -0.07 0.00 0.01 0.00 0.00 42.46 39.25 1jhp s ILE 122 CO 0.50 0.29 1.42 -2.65 0.00 0.00 0.00 174.94 174.51 1jhp n PRO 123 N 4.81 2.10 0.00 2.79 -0.02 -1.26 -1.88 135.00 141.53 1jhp n PRO 123 Ca -0.17 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1jhp n PRO 123 Cb 0.50 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 1jhp n PRO 123 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jhp n GLY 124 N 0.62 2.89 3.79 -1.23 0.00 -1.26 -5.01 105.19 104.99 1jhp n GLY 124 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 1jhp n GLY 124 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jhp s VAL 125 N -2.40 5.19 0.08 1.61 1.01 -0.79 -4.88 120.40 120.23 1jhp s VAL 125 Ca 0.00 0.71 -0.31 0.00 0.00 0.00 0.00 61.98 62.38 1jhp s VAL 125 Cb 0.00 -3.68 -0.07 0.00 0.00 0.00 0.00 36.38 32.63 1jhp s VAL 125 CO 0.00 0.48 1.42 0.54 0.00 0.00 0.00 175.10 177.54 1jhp s VAL 126 N -0.30 3.36 -0.46 2.92 0.11 0.25 -4.85 120.40 121.43 1jhp s VAL 126 Ca 0.21 0.92 -0.20 0.00 -2.93 0.00 0.00 61.98 59.98 1jhp s VAL 126 Cb -0.15 -3.59 0.03 0.00 -1.53 0.00 0.00 36.38 31.15 1jhp s VAL 126 CO 0.09 0.05 0.61 0.21 -3.33 0.00 0.00 175.10 172.73 1jhp s ASN 127 N 1.43 6.27 -0.06 3.54 3.84 -1.26 -0.14 114.94 128.57 1jhp s ASN 127 Ca 0.65 -0.58 0.18 0.00 0.21 0.00 0.00 52.86 53.33 1jhp s ASN 127 Cb -0.36 -2.30 0.35 0.00 -0.55 0.00 0.00 41.25 38.40 1jhp s ASN 127 CO 0.29 -0.80 1.15 0.23 -2.79 0.00 0.00 177.10 175.19 1jhp n MET 128 N 6.17 0.44 -1.67 0.43 2.81 0.22 -4.98 117.12 120.55 1jhp n MET 128 Ca -0.04 -2.18 -0.46 0.00 -1.81 0.00 0.00 57.70 53.21 1jhp n MET 128 Cb 0.47 -0.54 -0.04 0.00 -0.71 0.00 0.00 33.22 32.40 1jhp n MET 128 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 1jhp n ARG 129 N -0.07 2.46 0.05 0.03 1.85 0.00 -4.40 116.66 116.58 1jhp n ARG 129 Ca 0.09 0.90 -0.20 0.00 -1.00 0.00 0.00 57.85 57.63 1jhp n ARG 129 Cb 0.94 -2.81 -0.15 0.00 -1.05 0.00 0.00 32.46 29.40 1jhp n ARG 129 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1jhp h VAL 130 N 5.60 1.50 -2.62 8.89 2.07 -1.53 -3.47 116.25 126.68 1jhp h VAL 130 Ca -0.49 -2.54 0.12 0.00 0.82 0.00 0.00 66.70 64.61 1jhp h VAL 130 Cb 1.26 3.19 -0.06 0.00 -1.52 0.00 0.00 31.29 34.16 1jhp h VAL 130 CO 0.95 0.72 0.40 0.00 0.02 0.00 0.00 177.57 179.66 1jhp s ALA 131 N -2.43 -1.41 -1.33 1.67 0.00 -1.26 -5.06 121.76 111.94 1jhp s ALA 131 Ca -0.14 -0.17 -0.15 0.00 0.00 0.00 0.00 51.96 51.51 1jhp s ALA 131 Cb 0.01 0.72 0.09 0.00 0.00 0.00 0.00 23.12 23.94 1jhp s ALA 131 CO 0.83 -1.04 1.85 0.54 0.00 0.00 0.00 175.76 177.94 1jhp n ARG 132 N -0.51 3.19 0.00 0.00 1.74 -1.26 -4.03 116.66 115.79 1jhp n ARG 132 Ca -0.05 -3.22 0.00 0.00 -0.77 0.00 0.00 57.85 53.80 1jhp n ARG 132 Cb 0.60 -3.28 0.00 0.00 -1.02 0.00 0.00 32.46 28.76 1jhp n ARG 132 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jhp n GLY 133 N 4.42 -0.53 3.97 -0.13 0.00 0.05 -4.56 105.19 108.41 1jhp n GLY 133 Ca 0.46 -1.56 -0.22 0.00 0.00 0.00 0.00 46.02 44.70 1jhp n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jhp s GLY 135 N -4.43 1.88 -0.49 0.00 0.00 0.16 -1.45 107.32 102.99 1jhp s GLY 135 Ca 0.57 0.47 -0.29 0.00 0.00 0.00 0.00 44.72 45.48 1jhp s GLY 135 CO 0.39 0.84 1.30 0.21 0.00 0.00 0.00 173.10 175.85 1jhp s ASN 136 N -2.89 6.39 0.59 1.64 3.84 -1.26 -3.93 114.94 119.32 1jhp s ASN 136 Ca 0.65 0.51 0.39 0.00 0.21 0.00 0.00 52.86 54.62 1jhp s ASN 136 Cb -0.20 -2.55 2.06 0.00 -0.55 0.00 0.00 41.25 40.01 1jhp s ASN 136 CO 0.51 -1.45 2.20 0.16 -2.79 0.00 0.00 177.10 175.73 1jhp h ILE 137 N 6.34 0.00 0.00 -5.21 3.07 -1.84 -2.13 117.51 117.75 1jhp h ILE 137 Ca -0.26 -0.09 -0.04 0.00 1.55 0.00 0.00 64.86 66.02 1jhp h ILE 137 Cb 1.08 1.02 -0.01 0.00 -0.27 0.00 0.00 36.82 38.65 1jhp h ILE 137 CO 1.13 0.00 -0.17 0.00 -1.05 0.00 0.00 178.15 178.06 1jhp h ALA 138 N 2.01 1.15 0.00 0.16 0.00 -1.90 -3.26 119.26 117.42 1jhp h ALA 138 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1jhp h ALA 138 Cb 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1jhp h ALA 138 CO 0.00 0.21 0.00 1.33 0.00 0.00 0.00 179.25 180.79 1jhp n VAL 139 N -3.51 0.34 -0.64 0.00 0.24 -0.85 -4.44 118.33 109.47 1jhp n VAL 139 Ca -0.01 -0.54 0.00 0.00 -2.04 0.00 0.00 64.34 61.75 1jhp n VAL 139 Cb 0.32 0.97 0.00 0.00 -1.47 0.00 0.00 33.84 33.66 1jhp n VAL 139 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jhp n GLY 140 N -0.17 -1.58 3.77 7.63 0.00 -0.92 -5.05 105.19 108.86 1jhp n GLY 140 Ca 0.00 -1.07 -0.34 0.00 0.00 0.00 0.00 46.02 44.61 1jhp n GLY 140 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1jhp s PRO 141 N -1.73 3.03 0.32 1.61 0.04 -1.26 -3.48 135.00 133.52 1jhp s PRO 141 Ca 0.00 1.52 0.08 0.00 0.04 0.00 0.00 61.00 62.65 1jhp s PRO 141 Cb 0.00 -1.97 0.53 0.00 0.04 0.00 0.00 34.50 33.10 1jhp s PRO 141 CO 0.00 -1.09 1.74 0.00 0.04 0.00 0.00 177.00 177.68 1jhp h ALA 142 N 0.57 1.19 -2.06 8.56 0.00 -0.36 -3.39 119.26 123.77 1jhp h ALA 142 Ca -0.48 -0.39 0.15 0.00 0.00 0.00 0.00 54.91 54.18 1jhp h ALA 142 Cb 1.26 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1jhp h ALA 142 CO 0.55 0.56 0.45 0.00 0.00 0.00 0.00 179.25 180.81 1jhp n MET 143 N -4.04 0.31 -3.11 0.00 0.00 -0.74 -0.67 117.12 108.86 1jhp n MET 143 Ca -0.01 -0.78 -0.29 0.00 0.00 0.00 0.00 57.70 56.61 1jhp n MET 143 Cb 0.46 1.12 -0.03 0.00 0.00 0.00 0.00 33.22 34.76 1jhp n MET 143 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 1jhp s SER 144 N -2.65 6.48 0.18 3.17 1.04 -1.26 -4.58 113.70 116.08 1jhp s SER 144 Ca 0.16 0.92 -0.14 0.00 0.48 0.00 0.00 55.95 57.37 1jhp s SER 144 Cb -0.01 -2.23 0.15 0.00 0.10 0.00 0.00 66.02 64.03 1jhp s SER 144 CO 0.02 -0.29 1.73 -0.09 0.98 0.00 0.00 173.24 175.59 1jhp h ARG 145 N 1.49 0.25 -0.36 4.02 2.43 -1.94 -1.01 114.38 119.27 1jhp h ARG 145 Ca -0.47 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 58.75 1jhp h ARG 145 Cb 1.19 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 30.62 1jhp h ARG 145 CO 0.65 0.17 -0.05 -0.07 -1.51 0.00 0.00 179.97 179.16 1jhp h LEU 146 N 0.26 -0.24 -1.22 3.80 4.07 -1.99 0.03 115.31 120.01 1jhp h LEU 146 Ca 0.22 0.10 0.10 0.00 0.08 0.00 0.00 57.88 58.37 1jhp h LEU 146 Cb 0.27 0.19 -0.06 0.00 1.08 0.00 0.00 40.66 42.13 1jhp h LEU 146 CO -0.27 -0.08 0.57 1.56 -1.08 0.00 0.00 178.44 179.14 1jhp h GLN 147 N 0.04 0.84 0.15 1.13 4.20 -1.73 -0.27 115.11 119.47 1jhp h GLN 147 Ca 0.17 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 1jhp h GLN 147 Cb 0.26 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1jhp h GLN 147 CO -0.33 0.55 -0.07 0.00 -0.67 0.00 0.00 178.83 178.31 1jhp h ALA 148 N 1.56 -0.20 -0.86 3.87 0.00 0.12 -2.68 119.26 121.07 1jhp h ALA 148 Ca 0.41 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 55.20 1jhp h ALA 148 Cb 0.41 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.20 1jhp h ALA 148 CO -0.17 -0.38 0.50 0.93 0.00 0.00 0.00 179.25 180.13 1jhp h GLU 149 N -0.67 0.82 0.13 0.00 5.08 -0.71 -0.72 114.58 118.52 1jhp h GLU 149 Ca -0.02 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1jhp h GLU 149 Cb 0.49 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1jhp h GLU 149 CO 0.03 0.54 -0.06 0.00 -1.00 0.00 0.00 179.01 178.52 1jhp h ALA 150 N 1.46 -0.18 -0.94 3.43 0.00 -1.09 -0.84 119.26 121.11 1jhp h ALA 150 Ca 0.41 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.29 1jhp h ALA 150 Cb 0.36 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 1jhp h ALA 150 CO -0.24 -0.60 0.62 1.25 0.00 0.00 0.00 179.25 180.28 1jhp h LEU 151 N -0.19 1.06 -0.45 0.00 5.85 -1.14 0.17 115.31 120.61 1jhp h LEU 151 Ca -0.02 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.77 1jhp h LEU 151 Cb 0.15 -0.26 -0.09 0.00 0.37 0.00 0.00 40.66 40.83 1jhp h LEU 151 CO 0.03 0.76 -0.11 -0.07 -0.34 0.00 0.00 178.44 178.71 1jhp h LEU 152 N 1.25 -0.41 0.45 2.25 3.38 -0.66 0.26 115.31 121.83 1jhp h LEU 152 Ca 0.35 0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.43 1jhp h LEU 152 Cb -0.11 0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1jhp h LEU 152 CO -0.09 -0.14 -0.22 -0.07 0.09 0.00 0.00 178.44 178.01 1jhp h LEU 153 N 0.01 -0.52 -0.38 1.67 4.07 -0.33 -1.35 115.31 118.47 1jhp h LEU 153 Ca 0.22 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.20 1jhp h LEU 153 Cb 0.33 0.14 -0.02 0.00 1.08 0.00 0.00 40.66 42.19 1jhp h LEU 153 CO -0.46 -0.37 0.25 -0.08 -1.08 0.00 0.00 178.44 176.69 1jhp h GLU 154 N -0.61 0.50 -0.45 1.13 4.81 -0.56 -1.80 114.58 117.60 1jhp h GLU 154 Ca -0.06 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.06 1jhp h GLU 154 Cb 0.47 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1jhp h GLU 154 CO 0.10 0.34 -0.00 0.28 -0.73 0.00 0.00 179.01 179.00 1jhp h VAL 155 N 0.51 1.26 -0.24 0.32 2.07 -0.49 -2.37 116.25 117.31 1jhp h VAL 155 Ca 0.14 -1.05 0.05 0.00 0.82 0.00 0.00 66.70 66.66 1jhp h VAL 155 Cb -0.05 1.05 -0.08 0.00 -1.52 0.00 0.00 31.29 30.70 1jhp h VAL 155 CO -0.03 0.36 -0.43 0.28 0.02 0.00 0.00 177.57 177.77 1jhp h SER 156 N 0.64 -1.38 0.24 0.57 0.02 -1.09 0.01 113.55 112.56 1jhp h SER 156 Ca 0.13 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 1jhp h SER 156 Cb 0.50 0.58 -0.02 0.00 0.14 0.00 0.00 62.40 63.60 1jhp h SER 156 CO 0.02 -0.41 -0.25 0.03 -1.14 0.00 0.00 176.83 175.09 1jhp h ARG 157 N -0.43 -0.51 -0.88 3.45 -0.00 -1.31 -1.21 114.38 113.49 1jhp h ARG 157 Ca 0.10 0.03 0.17 0.00 -0.50 0.00 0.00 59.98 59.79 1jhp h ARG 157 Cb 0.61 0.12 -0.10 0.00 0.00 0.00 0.00 29.97 30.59 1jhp h ARG 157 CO -0.47 -0.34 0.44 -0.92 0.00 0.00 0.00 179.97 178.68 1jhp h TYR 158 N -0.53 0.76 0.28 3.04 3.20 -1.07 0.16 116.97 122.81 1jhp h TYR 158 Ca -0.00 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1jhp h TYR 158 Cb 0.50 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.57 1jhp h TYR 158 CO -0.18 0.11 -0.14 1.15 -1.64 0.00 0.00 178.16 177.47 1jhp h THR 159 N 0.56 0.73 -0.12 1.81 2.02 -0.32 -2.42 112.91 115.18 1jhp h THR 159 Ca 0.51 -0.06 -0.07 0.00 0.77 0.00 0.00 66.41 67.55 1jhp h THR 159 Cb 0.81 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 1jhp h THR 159 CO -0.42 0.01 -0.25 0.00 0.37 0.00 0.00 175.52 175.24 1jhp h ASP 161 N 0.19 0.58 -0.37 0.00 2.03 -0.50 -0.57 116.42 117.78 1jhp h ASP 161 Ca 0.03 -0.07 -0.05 0.00 -0.73 0.00 0.00 57.03 56.21 1jhp h ASP 161 Cb 0.55 -0.15 -0.02 0.00 -0.83 0.00 0.00 39.33 38.88 1jhp h ASP 161 CO 0.04 0.55 0.09 -0.07 -1.03 0.00 0.00 179.24 178.82 1jhp h LEU 162 N 0.63 0.63 -1.17 0.15 -0.00 -1.00 -1.94 115.31 112.61 1jhp h LEU 162 Ca 0.15 -0.11 0.25 0.00 -0.00 0.00 0.00 57.88 58.17 1jhp h LEU 162 Cb 0.17 -0.16 -0.11 0.00 -0.00 0.00 0.00 40.66 40.56 1jhp h LEU 162 CO -0.01 0.65 0.63 0.00 -0.00 0.00 0.00 178.44 179.71 1jhp h ALA 163 N 1.44 1.99 -0.35 1.53 0.00 -1.07 0.49 119.26 123.29 1jhp h ALA 163 Ca 0.15 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 1jhp h ALA 163 Cb 0.28 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1jhp h ALA 163 CO 0.00 -0.42 -0.06 1.96 0.00 0.00 0.00 179.25 180.72 1jhp h GLN 164 N 0.51 0.58 0.00 0.00 4.20 -1.32 -2.37 115.11 116.71 1jhp h GLN 164 Ca 0.62 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 59.17 1jhp h GLN 164 Cb 1.33 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.04 1jhp h GLN 164 CO -0.38 0.65 0.00 0.54 -0.67 0.00 0.00 178.83 178.97 1jhp n ARG 165 N -4.22 0.69 -0.12 1.46 1.74 0.17 -4.80 116.66 111.58 1jhp n ARG 165 Ca 0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 1jhp n ARG 165 Cb 0.30 -1.16 0.00 0.00 -1.02 0.00 0.00 32.46 30.58 1jhp n ARG 165 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jhp n GLY 166 N 0.25 0.94 3.73 -0.13 0.00 -0.89 -4.99 105.19 104.10 1jhp n GLY 166 Ca 0.05 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 1jhp n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jhp s VAL 167 N -2.00 4.64 0.00 1.61 1.01 -1.14 -1.44 120.40 123.08 1jhp s VAL 167 Ca 0.00 1.90 0.00 0.00 0.00 0.00 0.00 61.98 63.88 1jhp s VAL 167 Cb 0.00 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 32.13 1jhp s VAL 167 CO 0.00 0.31 0.00 0.35 0.00 0.00 0.00 175.10 175.76 1jhp n THR 168 N 2.97 0.00 -3.85 3.92 -2.24 0.31 -4.41 114.28 110.99 1jhp n THR 168 Ca 0.01 -0.37 -0.22 0.00 -2.27 0.00 0.00 64.05 61.20 1jhp n THR 168 Cb 0.50 0.90 -0.17 0.00 -2.10 0.00 0.00 70.33 69.45 1jhp n THR 168 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1jhp s LEU 169 N -2.03 0.77 0.10 3.22 2.96 -1.15 -4.10 118.68 118.45 1jhp s LEU 169 Ca 0.00 -0.09 0.06 0.00 -0.22 0.00 0.00 54.13 53.87 1jhp s LEU 169 Cb 0.00 -0.44 -0.04 0.00 0.50 0.00 0.00 46.19 46.21 1jhp s LEU 169 CO 0.00 -0.16 -0.03 -0.36 -1.32 0.00 0.00 176.35 174.48 1jhp s PHE 170 N 1.72 2.90 -0.01 5.38 0.40 -0.77 -1.73 117.98 125.87 1jhp s PHE 170 Ca 0.01 -0.08 0.04 0.00 -0.60 0.00 0.00 56.93 56.31 1jhp s PHE 170 Cb -0.13 -1.49 -0.01 0.00 0.51 0.00 0.00 43.02 41.90 1jhp s PHE 170 CO -0.04 0.47 -0.14 0.20 0.70 0.00 0.00 175.22 176.40 1jhp s GLY 171 N -2.34 0.70 0.01 4.36 0.00 0.15 -0.06 107.32 110.15 1jhp s GLY 171 Ca 0.25 -0.61 0.05 0.00 0.00 0.00 0.00 44.72 44.41 1jhp s GLY 171 CO 0.17 -0.49 -0.15 0.54 0.00 0.00 0.00 173.10 173.17 1jhp s VAL 172 N -0.30 3.03 0.29 1.40 0.11 -0.92 -1.01 120.40 122.99 1jhp s VAL 172 Ca 0.05 -0.99 -0.11 0.00 -2.93 0.00 0.00 61.98 58.00 1jhp s VAL 172 Cb -0.06 -2.26 0.01 0.00 -1.53 0.00 0.00 36.38 32.53 1jhp s VAL 172 CO -0.00 0.41 0.52 -0.83 -3.33 0.00 0.00 175.10 171.87 1jhp s GLY 173 N -1.27 0.72 0.21 6.54 0.00 0.75 -4.26 107.32 110.01 1jhp s GLY 173 Ca 0.14 -0.99 -0.06 0.00 0.00 0.00 0.00 44.72 43.81 1jhp s GLY 173 CO 0.05 -0.66 0.26 -1.83 0.00 0.00 0.00 173.10 170.92 1jhp s GLU 174 N -3.58 1.30 -0.28 2.90 4.04 -1.26 -1.22 118.70 120.60 1jhp s GLU 174 Ca 0.23 -1.44 -0.03 0.00 0.04 0.00 0.00 54.97 53.77 1jhp s GLU 174 Cb -0.01 0.35 0.16 0.00 0.02 0.00 0.00 34.13 34.65 1jhp s GLU 174 CO 0.12 -0.47 0.54 -1.17 -1.84 0.00 0.00 175.26 172.44 1jhp s LEU 175 N -3.08 -1.12 -0.30 1.83 2.96 0.02 -2.03 118.68 116.96 1jhp s LEU 175 Ca 0.30 0.84 -0.17 0.00 -0.22 0.00 0.00 54.13 54.87 1jhp s LEU 175 Cb 0.04 1.88 0.18 0.00 0.50 0.00 0.00 46.19 48.79 1jhp s LEU 175 CO 0.09 -0.26 1.20 -0.83 -1.32 0.00 0.00 176.35 175.23 1jhp s GLY 176 N 2.77 0.01 0.27 7.98 0.00 -1.25 -1.13 107.32 115.97 1jhp s GLY 176 Ca 0.13 3.29 -0.30 0.00 0.00 0.00 0.00 44.72 47.84 1jhp s GLY 176 CO -0.19 3.65 1.46 1.03 0.00 0.00 0.00 173.10 179.06 1jhp n MET 177 N 5.08 2.29 -1.00 2.90 2.81 -1.26 -2.01 117.12 125.92 1jhp n MET 177 Ca -0.08 0.81 -0.00 0.00 -1.81 0.00 0.00 57.70 56.63 1jhp n MET 177 Cb 0.55 -2.51 -0.00 0.00 -0.71 0.00 0.00 33.22 30.55 1jhp n MET 177 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1jhp n ALA 178 N 1.76 -0.00 0.31 3.04 0.00 -1.26 -4.32 120.51 120.03 1jhp n ALA 178 Ca 0.09 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.69 1jhp n ALA 178 Cb 0.34 -0.10 0.61 0.00 0.00 0.00 0.00 19.45 20.30 1jhp n ALA 178 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 1jhp h ASN 179 N 0.00 0.00 0.52 0.00 7.08 -1.79 -2.99 115.58 118.39 1jhp h ASN 179 Ca -0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1jhp h ASN 179 Cb 0.03 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.27 1jhp h ASN 179 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 177.43 175.70 1jhp n THR 180 N -2.89 0.90 -0.02 6.14 -2.24 -1.26 -2.47 114.28 112.43 1jhp n THR 180 Ca 0.01 0.22 -0.06 0.00 -2.27 0.00 0.00 64.05 61.96 1jhp n THR 180 Cb 0.30 -0.96 -0.05 0.00 -2.10 0.00 0.00 70.33 67.53 1jhp n THR 180 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1jhp h THR 181 N 0.00 0.55 -0.41 4.28 2.02 -1.92 -1.77 112.91 115.66 1jhp h THR 181 Ca 0.00 -1.31 0.01 0.00 0.77 0.00 0.00 66.41 65.88 1jhp h THR 181 Cb 0.26 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.66 1jhp h THR 181 CO 0.00 0.18 0.27 1.55 0.37 0.00 0.00 175.52 177.89 1jhp h PRO 182 N -0.99 0.51 -0.49 6.66 0.13 -1.73 -0.84 132.00 135.24 1jhp h PRO 182 Ca -0.01 -0.03 0.02 0.00 -0.87 0.00 0.00 66.00 65.12 1jhp h PRO 182 Cb 0.35 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 31.33 1jhp h PRO 182 CO 0.01 0.33 0.29 0.00 -0.23 0.00 0.00 178.00 178.40 1jhp h ALA 183 N 1.75 0.62 -0.83 -0.56 0.00 -1.56 -0.36 119.26 118.32 1jhp h ALA 183 Ca 0.15 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1jhp h ALA 183 Cb -0.01 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 1jhp h ALA 183 CO -0.03 -0.02 0.37 0.00 0.00 0.00 0.00 179.25 179.57 1jhp h ALA 184 N 1.22 1.09 -0.28 0.00 0.00 -0.26 -1.71 119.26 119.31 1jhp h ALA 184 Ca 0.20 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1jhp h ALA 184 Cb 0.02 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1jhp h ALA 184 CO -0.09 0.67 0.18 0.00 0.00 0.00 0.00 179.25 180.00 1jhp h ALA 185 N 1.21 0.35 -0.27 0.00 0.00 -0.34 -0.55 119.26 119.66 1jhp h ALA 185 Ca 0.28 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1jhp h ALA 185 Cb 0.16 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1jhp h ALA 185 CO -0.03 -0.19 0.16 0.52 0.00 0.00 0.00 179.25 179.70 1jhp h MET 186 N 0.36 0.37 -0.09 0.00 2.86 -0.85 -1.41 114.93 116.17 1jhp h MET 186 Ca 0.11 -0.04 0.03 0.00 -2.06 0.00 0.00 59.70 57.74 1jhp h MET 186 Cb -0.02 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.53 1jhp h MET 186 CO -0.04 0.31 -0.09 0.28 1.06 0.00 0.00 176.91 178.43 1jhp h VAL 187 N 0.33 0.75 -0.40 -2.22 2.07 -1.04 0.66 116.25 116.40 1jhp h VAL 187 Ca 0.10 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.70 1jhp h VAL 187 Cb 0.04 0.75 -0.08 0.00 -1.52 0.00 0.00 31.29 30.47 1jhp h VAL 187 CO -0.02 0.00 -0.16 -1.28 0.02 0.00 0.00 177.57 176.14 1jhp h SER 188 N -0.11 -0.55 0.07 0.57 0.87 -0.96 0.82 113.55 114.27 1jhp h SER 188 Ca 0.07 0.14 -0.00 0.00 -1.23 0.00 0.00 61.79 60.76 1jhp h SER 188 Cb 0.20 0.32 0.00 0.00 -0.44 0.00 0.00 62.40 62.48 1jhp h SER 188 CO -0.16 -0.19 -0.03 0.58 -0.53 0.00 0.00 176.83 176.50 1jhp h VAL 189 N -0.07 1.01 -0.01 2.23 2.07 -0.66 0.49 116.25 121.30 1jhp h VAL 189 Ca 0.20 -0.26 -0.10 0.00 0.82 0.00 0.00 66.70 67.36 1jhp h VAL 189 Cb 0.38 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1jhp h VAL 189 CO -0.45 0.06 -0.45 -0.26 0.02 0.00 0.00 177.57 176.49 1jhp h PHE 190 N -0.21 0.03 0.00 1.57 0.04 -0.63 -3.27 116.94 114.47 1jhp h PHE 190 Ca -0.01 -0.01 -0.15 0.00 2.80 0.00 0.00 57.97 60.60 1jhp h PHE 190 Cb 0.18 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 38.29 1jhp h PHE 190 CO -0.04 0.47 -1.61 2.41 -0.60 0.00 0.00 178.31 178.94 1jhp n THR 191 N -4.01 0.95 -1.37 -1.55 -1.04 0.26 -4.99 114.28 102.54 1jhp n THR 191 Ca -0.02 -0.67 -0.05 0.00 -2.04 0.00 0.00 64.05 61.28 1jhp n THR 191 Cb 0.47 -0.52 -0.02 0.00 -1.82 0.00 0.00 70.33 68.44 1jhp n THR 191 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1jhp n GLY 192 N 1.40 0.62 3.90 3.41 0.00 0.17 -5.03 105.19 109.66 1jhp n GLY 192 Ca -0.11 -0.81 -0.31 0.00 0.00 0.00 0.00 46.02 44.79 1jhp n GLY 192 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jhp s SER 193 N -2.91 6.50 0.40 1.61 0.01 -1.11 -5.05 113.70 113.15 1jhp s SER 193 Ca 0.00 0.63 -0.24 0.00 1.31 0.00 0.00 55.95 57.65 1jhp s SER 193 Cb 0.00 -2.11 -0.09 0.00 0.21 0.00 0.00 66.02 64.03 1jhp s SER 193 CO 0.00 0.02 1.04 -0.62 0.41 0.00 0.00 173.24 174.09 1jhp s ASP 194 N -2.50 6.78 0.38 2.44 2.15 -1.26 -4.60 116.67 120.05 1jhp s ASP 194 Ca 0.42 2.00 0.17 0.00 0.43 0.00 0.00 52.55 55.57 1jhp s ASP 194 Cb -0.12 -2.58 1.09 0.00 -0.30 0.00 0.00 42.92 41.01 1jhp s ASP 194 CO 0.25 -0.48 1.73 0.00 -0.17 0.00 0.00 175.17 176.50 1jhp h ALA 195 N 2.45 2.15 -0.91 3.66 0.00 -1.94 0.12 119.26 124.80 1jhp h ALA 195 Ca -0.48 0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.58 1jhp h ALA 195 Cb 1.21 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 19.01 1jhp h ALA 195 CO 0.62 -0.63 0.59 1.57 0.00 0.00 0.00 179.25 181.41 1jhp h LYS 196 N 0.39 1.07 -0.07 0.00 -0.00 -1.93 -0.71 116.57 115.32 1jhp h LYS 196 Ca 0.65 -0.06 -0.06 0.00 -0.00 0.00 0.00 60.65 61.18 1jhp h LYS 196 Cb 1.59 -0.24 -0.01 0.00 -0.00 0.00 0.00 32.23 33.57 1jhp h LYS 196 CO -0.40 0.70 -0.22 1.05 -0.00 0.00 0.00 179.45 180.59 1jhp h GLU 197 N 1.10 0.12 0.00 0.07 -0.00 -1.12 -3.28 114.58 111.47 1jhp h GLU 197 Ca 0.37 -0.03 0.00 0.00 -0.00 0.00 0.00 59.36 59.70 1jhp h GLU 197 Cb 0.09 -0.01 0.00 0.00 -0.00 0.00 0.00 28.75 28.83 1jhp h GLU 197 CO -0.12 0.35 -1.01 0.28 -0.00 0.00 0.00 179.01 178.50 1jhp n VAL 198 N -4.23 0.00 -2.60 -1.06 0.31 -0.86 -4.20 118.33 105.69 1jhp n VAL 198 Ca -0.01 -0.22 -0.43 0.00 -0.01 0.00 0.00 64.34 63.67 1jhp n VAL 198 Cb 0.31 0.72 -0.02 0.00 -0.91 0.00 0.00 33.84 33.94 1jhp n VAL 198 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1jhp s VAL 199 N -2.58 4.59 0.51 2.52 1.01 -0.33 -3.43 120.40 122.69 1jhp s VAL 199 Ca 0.02 1.90 0.05 0.00 0.00 0.00 0.00 61.98 63.95 1jhp s VAL 199 Cb 0.10 -4.22 0.05 0.00 0.00 0.00 0.00 36.38 32.32 1jhp s VAL 199 CO 0.60 -0.08 0.46 0.61 0.00 0.00 0.00 175.10 176.68 1jhp n GLY 200 N 3.29 2.59 0.02 4.51 0.00 -1.26 -4.80 105.19 109.54 1jhp n GLY 200 Ca 0.11 -2.27 0.14 0.00 0.00 0.00 0.00 46.02 44.00 1jhp n GLY 200 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1jhp n ILE 201 N -1.78 0.00 -2.00 -0.61 5.41 -1.26 -4.95 119.36 114.16 1jhp n ILE 201 Ca 0.02 -0.01 0.00 0.00 1.00 0.00 0.00 62.75 63.76 1jhp n ILE 201 Cb 0.56 -0.40 0.00 0.00 -0.71 0.00 0.00 39.64 39.09 1jhp n ILE 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1jhp n GLY 202 N 1.33 2.46 3.48 7.39 0.00 -1.26 0.64 105.19 119.23 1jhp n GLY 202 Ca 0.13 -0.25 -0.43 0.00 0.00 0.00 0.00 46.02 45.46 1jhp n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jhp n ALA 203 N 7.89 3.81 -3.55 4.61 0.00 -1.26 -4.41 120.51 127.61 1jhp n ALA 203 Ca 0.00 -3.98 -0.20 0.00 0.00 0.00 0.00 53.44 49.26 1jhp n ALA 203 Cb 0.00 -3.43 0.06 0.00 0.00 0.00 0.00 19.45 16.07 1jhp n ALA 203 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1jhp n ASN 204 N 7.36 -2.91 -4.69 0.00 3.02 -1.17 -4.73 115.26 112.13 1jhp n ASN 204 Ca 0.45 -0.77 -0.42 0.00 -0.03 0.00 0.00 54.58 53.81 1jhp n ASN 204 Cb 0.44 -4.46 -0.03 0.00 -0.61 0.00 0.00 39.78 35.12 1jhp n ASN 204 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1jhp s LEU 205 N -6.33 4.27 0.32 3.41 2.96 0.21 -4.90 118.68 118.61 1jhp s LEU 205 Ca 0.14 1.54 -0.29 0.00 -0.22 0.00 0.00 54.13 55.30 1jhp s LEU 205 Cb -0.03 -3.54 -0.12 0.00 0.50 0.00 0.00 46.19 43.00 1jhp s LEU 205 CO 0.78 -0.41 1.43 -2.65 -1.32 0.00 0.00 176.35 174.18 1jhp n PRO 206 N 4.81 2.37 -0.26 0.98 -0.02 -1.26 -4.83 135.00 136.79 1jhp n PRO 206 Ca 0.08 0.84 0.26 0.00 -2.02 0.00 0.00 63.50 62.66 1jhp n PRO 206 Cb 0.49 -2.51 0.62 0.00 -0.02 0.00 0.00 33.50 32.08 1jhp n PRO 206 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1jhp h PRO 207 N 3.48 0.20 -0.13 0.52 0.13 -1.99 0.25 132.00 134.46 1jhp h PRO 207 Ca -0.47 -0.01 -0.08 0.00 -0.87 0.00 0.00 66.00 64.56 1jhp h PRO 207 Cb 1.26 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1jhp h PRO 207 CO 0.69 0.13 -0.29 0.66 -0.23 0.00 0.00 178.00 178.97 1jhp h SER 208 N 0.21 0.25 0.14 1.44 4.64 -2.04 -2.90 113.55 115.29 1jhp h SER 208 Ca 0.51 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1jhp h SER 208 Cb 1.63 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.65 1jhp h SER 208 CO -0.13 0.54 -0.02 0.54 -0.87 0.00 0.00 176.83 176.89 1jhp n ARG 209 N -4.13 0.99 0.33 4.77 1.74 0.88 -4.12 116.66 117.12 1jhp n ARG 209 Ca -0.01 -0.22 -0.17 0.00 -0.77 0.00 0.00 57.85 56.68 1jhp n ARG 209 Cb 0.39 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.25 1jhp n ARG 209 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1jhp h ILE 210 N 0.54 0.37 -0.99 0.55 1.08 -1.47 -2.89 117.51 114.69 1jhp h ILE 210 Ca 0.00 0.00 0.21 0.00 -0.39 0.00 0.00 64.86 64.68 1jhp h ILE 210 Cb 0.19 0.37 -0.19 0.00 -3.07 0.00 0.00 36.82 34.12 1jhp h ILE 210 CO 0.00 0.00 -0.21 0.47 -0.69 0.00 0.00 178.15 177.72 1jhp n ASP 211 N -5.45 -0.32 -0.23 1.72 10.43 -1.26 0.61 116.55 122.04 1jhp n ASP 211 Ca -0.13 1.71 -0.06 0.00 2.57 0.00 0.00 54.79 58.88 1jhp n ASP 211 Cb 0.35 -0.53 0.04 0.00 1.84 0.00 0.00 41.12 42.82 1jhp n ASP 211 CO 0.00 0.00 0.00 -1.13 -1.07 0.00 0.00 177.20 175.00 1jhp h ASN 212 N 0.00 0.82 -0.84 -2.24 -1.24 -1.79 -2.31 115.58 107.98 1jhp h ASN 212 Ca 0.49 -0.10 0.11 0.00 0.71 0.00 0.00 56.30 57.51 1jhp h ASN 212 Cb 0.80 -0.21 -0.08 0.00 0.73 0.00 0.00 38.32 39.56 1jhp h ASN 212 CO -1.01 0.69 0.47 0.50 -1.29 0.00 0.00 177.43 176.79 1jhp h LYS 213 N 0.88 0.74 -0.50 6.67 3.64 0.37 -1.16 116.57 127.21 1jhp h LYS 213 Ca 0.23 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.51 1jhp h LYS 213 Cb 0.06 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1jhp h LYS 213 CO -0.03 0.49 0.12 0.28 -2.27 0.00 0.00 179.45 178.03 1jhp h VAL 214 N 0.76 1.24 -0.49 2.00 2.07 -0.98 -1.79 116.25 119.07 1jhp h VAL 214 Ca 0.41 -0.86 0.02 0.00 0.82 0.00 0.00 66.70 67.09 1jhp h VAL 214 Cb 0.43 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1jhp h VAL 214 CO -0.27 0.31 0.30 0.44 0.02 0.00 0.00 177.57 178.36 1jhp h ASP 215 N 0.70 0.48 -0.41 0.57 3.32 -0.84 0.13 116.42 120.38 1jhp h ASP 215 Ca 0.16 0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.27 1jhp h ASP 215 Cb 0.34 -0.10 -0.06 0.00 0.22 0.00 0.00 39.33 39.73 1jhp h ASP 215 CO 0.00 0.34 0.08 0.58 -1.72 0.00 0.00 179.24 178.53 1jhp h VAL 216 N 0.59 0.79 0.25 -1.35 2.07 -1.02 0.70 116.25 118.28 1jhp h VAL 216 Ca 0.19 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 1jhp h VAL 216 Cb 0.00 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1jhp h VAL 216 CO -0.08 0.04 -0.12 0.58 0.02 0.00 0.00 177.57 178.01 1jhp h VAL 217 N 0.21 0.76 -0.94 2.57 2.07 -0.71 -0.59 116.25 119.61 1jhp h VAL 217 Ca 0.20 -0.02 0.12 0.00 0.82 0.00 0.00 66.70 67.82 1jhp h VAL 217 Cb 0.24 0.77 -0.08 0.00 -1.52 0.00 0.00 31.29 30.70 1jhp h VAL 217 CO -0.26 0.00 0.57 0.03 0.02 0.00 0.00 177.57 177.93 1jhp h ARG 218 N -0.34 0.88 0.01 1.57 3.08 -0.63 -2.00 114.38 116.95 1jhp h ARG 218 Ca -0.03 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 1jhp h ARG 218 Cb 0.26 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1jhp h ARG 218 CO 0.06 0.58 -0.00 0.00 -1.07 0.00 0.00 179.97 179.53 1jhp h ARG 219 N 0.91 -0.01 -0.82 0.04 3.08 -0.47 -1.51 114.38 115.60 1jhp h ARG 219 Ca 0.47 0.00 0.18 0.00 0.07 0.00 0.00 59.98 60.70 1jhp h ARG 219 Cb 0.47 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.41 1jhp h ARG 219 CO -0.27 0.09 0.32 0.00 -1.07 0.00 0.00 179.97 179.03 1jhp h ALA 220 N 0.88 1.20 0.59 0.04 0.00 -0.40 0.73 119.26 122.30 1jhp h ALA 220 Ca -0.00 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1jhp h ALA 220 Cb 0.10 0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.04 1jhp h ALA 220 CO 0.00 -0.29 -0.28 0.82 0.00 0.00 0.00 179.25 179.50 1jhp h ILE 221 N 0.39 0.30 -0.41 0.00 2.04 -1.24 -1.73 117.51 116.87 1jhp h ILE 221 Ca 0.48 -0.31 0.04 0.00 1.00 0.00 0.00 64.86 66.07 1jhp h ILE 221 Cb 0.83 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 37.26 1jhp h ILE 221 CO -0.48 0.04 0.18 0.00 0.00 0.00 0.00 178.15 177.89 1jhp h ALA 222 N -0.76 0.50 -0.48 1.87 0.00 -0.71 0.33 119.26 120.01 1jhp h ALA 222 Ca -0.08 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1jhp h ALA 222 Cb 0.66 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1jhp h ALA 222 CO 0.13 -0.19 0.12 0.82 0.00 0.00 0.00 179.25 180.14 1jhp h ILE 223 N 0.38 1.23 0.00 0.00 2.04 -0.94 -3.30 117.51 116.93 1jhp h ILE 223 Ca 0.18 -0.81 -0.21 0.00 1.00 0.00 0.00 64.86 65.01 1jhp h ILE 223 Cb 0.11 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 1jhp h ILE 223 CO -0.14 0.29 -1.29 0.78 0.00 0.00 0.00 178.15 177.79 1jhp h ASN 224 N 0.65 0.00 -6.18 1.72 2.35 -1.10 -3.49 115.58 109.52 1jhp h ASN 224 Ca 0.15 0.00 -0.43 0.00 -0.55 0.00 0.00 56.30 55.47 1jhp h ASN 224 Cb 0.31 0.00 0.04 0.00 0.05 0.00 0.00 38.32 38.73 1jhp h ASN 224 CO 0.00 0.81 -0.87 0.00 -1.65 0.00 0.00 177.43 175.72 1jhp n GLN 225 N -3.10 -3.63 -2.11 0.81 1.13 0.11 -4.89 117.38 105.71 1jhp n GLN 225 Ca -0.08 0.55 -0.41 0.00 -1.94 0.00 0.00 57.00 55.12 1jhp n GLN 225 Cb 0.92 -4.84 -0.02 0.00 0.11 0.00 0.00 30.24 26.41 1jhp n GLN 225 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 1jhp s PRO 226 N -6.03 4.35 -0.33 -1.09 0.04 -1.26 -4.97 135.00 125.70 1jhp s PRO 226 Ca 0.12 2.22 -0.19 0.00 0.04 0.00 0.00 61.00 63.19 1jhp s PRO 226 Cb -0.04 -3.07 -0.01 0.00 0.04 0.00 0.00 34.50 31.42 1jhp s PRO 226 CO 0.84 -0.20 0.57 1.21 0.04 0.00 0.00 177.00 179.46 1jhp s ASN 227 N -0.44 6.40 0.60 6.66 2.47 -1.26 -4.94 114.94 124.44 1jhp s ASN 227 Ca 0.49 0.21 0.35 0.00 0.42 0.00 0.00 52.86 54.34 1jhp s ASN 227 Cb -0.40 -2.30 1.95 0.00 -1.45 0.00 0.00 41.25 39.05 1jhp s ASN 227 CO 0.53 -0.48 2.24 1.55 -3.72 0.00 0.00 177.10 177.22 1jhp h PRO 228 N 8.33 0.00 -0.16 0.43 0.13 -1.93 0.02 132.00 138.81 1jhp h PRO 228 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1jhp h PRO 228 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1jhp h PRO 228 CO 0.79 0.02 0.00 0.54 -0.23 0.00 0.00 178.00 179.12 1jhp n ARG 229 N -3.45 1.62 -3.67 0.86 3.00 -1.26 -4.53 116.66 109.22 1jhp n ARG 229 Ca -0.02 -0.93 -0.30 0.00 -0.01 0.00 0.00 57.85 56.59 1jhp n ARG 229 Cb 0.13 -1.35 -0.14 0.00 0.00 0.00 0.00 32.46 31.09 1jhp n ARG 229 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1jhp s ASP 230 N -1.49 3.69 0.26 0.55 -1.08 -0.01 -4.99 116.67 113.61 1jhp s ASP 230 Ca 0.30 -2.02 -0.03 0.00 -0.52 0.00 0.00 52.55 50.27 1jhp s ASP 230 Cb 0.16 -0.80 0.37 0.00 -1.46 0.00 0.00 42.92 41.19 1jhp s ASP 230 CO 0.24 -0.35 1.88 1.23 0.52 0.00 0.00 175.17 178.69 1jhp h GLY 231 N 7.50 1.47 1.29 2.66 0.00 -1.80 -0.50 103.07 113.69 1jhp h GLY 231 Ca -0.07 -0.47 -0.08 0.00 0.00 0.00 0.00 47.33 46.72 1jhp h GLY 231 CO 0.44 0.35 -0.00 -2.22 0.00 0.00 0.00 176.54 175.10 1jhp h ILE 232 N 1.16 1.25 -0.01 2.60 2.04 -1.92 -0.71 117.51 121.92 1jhp h ILE 232 Ca 0.41 -1.05 -0.00 0.00 1.00 0.00 0.00 64.86 65.23 1jhp h ILE 232 Cb 0.13 0.86 -0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1jhp h ILE 232 CO -0.16 0.37 0.01 -0.78 0.00 0.00 0.00 178.15 177.59 1jhp h ASP 233 N 0.80 0.02 0.03 1.72 1.82 -1.55 -2.20 116.42 117.06 1jhp h ASP 233 Ca 0.15 -0.08 0.02 0.00 -0.39 0.00 0.00 57.03 56.73 1jhp h ASP 233 Cb 0.48 -0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.46 1jhp h ASP 233 CO 0.02 0.09 -0.12 0.58 -1.61 0.00 0.00 179.24 178.21 1jhp h VAL 234 N -0.06 0.72 -0.43 2.25 2.07 -0.91 -1.89 116.25 118.00 1jhp h VAL 234 Ca 0.01 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.61 1jhp h VAL 234 Cb 0.08 0.72 -0.07 0.00 -1.52 0.00 0.00 31.29 30.49 1jhp h VAL 234 CO -0.00 0.00 -0.03 -0.07 0.02 0.00 0.00 177.57 177.49 1jhp h LEU 235 N -0.21 -0.24 -0.85 2.57 3.38 -1.05 -1.20 115.31 117.70 1jhp h LEU 235 Ca 0.03 0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.99 1jhp h LEU 235 Cb 0.25 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1jhp h LEU 235 CO -0.09 -0.08 -0.42 0.77 0.09 0.00 0.00 178.44 178.70 1jhp h SER 236 N 0.08 0.34 0.00 -0.43 4.64 -1.23 0.13 113.55 117.09 1jhp h SER 236 Ca 0.21 -0.15 -0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1jhp h SER 236 Cb 0.31 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1jhp h SER 236 CO -0.38 0.73 -0.00 0.11 -0.87 0.00 0.00 176.83 176.42 1jhp h LYS 237 N 0.27 -0.00 -0.04 4.77 1.57 -1.02 -1.80 116.57 120.32 1jhp h LYS 237 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1jhp h LYS 237 Cb 0.86 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.17 1jhp h LYS 237 CO 0.07 0.18 0.00 1.33 -0.57 0.00 0.00 179.45 180.46 1jhp n VAL 238 N -4.75 1.88 0.00 0.50 0.24 -0.48 -0.96 118.33 114.76 1jhp n VAL 238 Ca -0.02 -2.12 0.00 0.00 -2.04 0.00 0.00 64.34 60.16 1jhp n VAL 238 Cb 0.09 -0.19 0.00 0.00 -1.47 0.00 0.00 33.84 32.27 1jhp n VAL 238 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jhp n GLY 239 N -1.22 1.49 3.71 7.63 0.00 0.46 -4.62 105.19 112.64 1jhp n GLY 239 Ca 0.16 -1.36 -0.03 0.00 0.00 0.00 0.00 46.02 44.80 1jhp n GLY 239 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jhp s GLY 240 N 0.00 -0.29 0.20 -0.02 0.00 -1.23 -4.79 107.32 101.20 1jhp s GLY 240 Ca 0.00 0.32 -0.10 0.00 0.00 0.00 0.00 44.72 44.93 1jhp s GLY 240 CO 0.00 0.05 1.85 0.74 0.00 0.00 0.00 173.10 175.74 1jhp h PHE 241 N 2.00 0.83 -0.65 1.90 0.05 -1.89 -0.70 116.94 118.48 1jhp h PHE 241 Ca -0.25 0.02 -0.09 0.00 3.82 0.00 0.00 57.97 61.47 1jhp h PHE 241 Cb 1.22 -0.27 -0.02 0.00 2.00 0.00 0.00 35.95 38.88 1jhp h PHE 241 CO 0.36 0.48 0.06 0.38 -0.18 0.00 0.00 178.31 179.42 1jhp h ASP 242 N 0.87 1.06 -0.18 2.17 -0.00 -1.87 -0.77 116.42 117.71 1jhp h ASP 242 Ca 0.27 -0.27 -0.01 0.00 -0.00 0.00 0.00 57.03 57.02 1jhp h ASP 242 Cb -0.01 -0.28 -0.01 0.00 -0.00 0.00 0.00 39.33 39.03 1jhp h ASP 242 CO -0.10 1.07 0.09 -0.07 -0.00 0.00 0.00 179.24 180.24 1jhp h LEU 243 N 1.02 0.23 -0.09 0.15 -0.00 -1.82 -1.85 115.31 112.94 1jhp h LEU 243 Ca 0.19 -0.11 0.04 0.00 -0.00 0.00 0.00 57.88 58.01 1jhp h LEU 243 Cb 0.49 -0.06 -0.05 0.00 -0.00 0.00 0.00 40.66 41.04 1jhp h LEU 243 CO 0.02 0.27 -0.22 0.58 -0.00 0.00 0.00 178.44 179.09 1jhp h VAL 244 N 0.17 0.47 -0.85 1.22 2.07 -0.88 -1.63 116.25 116.82 1jhp h VAL 244 Ca 0.06 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.70 1jhp h VAL 244 Cb 0.10 0.47 -0.06 0.00 -1.52 0.00 0.00 31.29 30.27 1jhp h VAL 244 CO -0.01 0.00 0.55 1.23 0.02 0.00 0.00 177.57 179.36 1jhp h GLY 245 N -0.30 1.14 0.77 2.17 0.00 -0.95 -0.71 103.07 105.19 1jhp h GLY 245 Ca 0.09 -0.31 -0.03 0.00 0.00 0.00 0.00 47.33 47.08 1jhp h GLY 245 CO -0.26 0.14 -0.04 -0.33 0.00 0.00 0.00 176.54 176.05 1jhp h MET 246 N 0.73 0.30 -0.92 4.80 2.07 -0.80 -1.61 114.93 119.50 1jhp h MET 246 Ca 0.41 -0.11 0.09 0.00 -2.07 0.00 0.00 59.70 58.02 1jhp h MET 246 Cb 0.57 -0.02 -0.07 0.00 -1.87 0.00 0.00 31.60 30.21 1jhp h MET 246 CO -0.17 0.57 0.56 1.15 1.07 0.00 0.00 176.91 180.09 1jhp h THR 247 N 0.00 0.96 -0.81 2.22 2.02 -0.58 -2.14 112.91 114.59 1jhp h THR 247 Ca 0.04 -0.33 0.01 0.00 0.77 0.00 0.00 66.41 66.91 1jhp h THR 247 Cb 0.46 -0.07 -0.04 0.00 -1.74 0.00 0.00 68.15 66.76 1jhp h THR 247 CO 0.01 0.17 0.54 1.23 0.37 0.00 0.00 175.52 177.85 1jhp h GLY 248 N 0.95 1.15 0.99 2.16 0.00 -0.82 -0.36 103.07 107.14 1jhp h GLY 248 Ca 0.43 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 1jhp h GLY 248 CO -0.23 0.41 0.34 -2.08 0.00 0.00 0.00 176.54 174.98 1jhp h VAL 249 N 1.09 1.18 -0.67 4.60 2.07 -0.68 -0.50 116.25 123.34 1jhp h VAL 249 Ca 0.30 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.41 1jhp h VAL 249 Cb -0.11 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.03 1jhp h VAL 249 CO -0.07 0.18 0.40 0.24 0.02 0.00 0.00 177.57 178.34 1jhp h MET 250 N 0.78 0.91 -0.32 1.57 2.07 -0.87 0.36 114.93 119.43 1jhp h MET 250 Ca 0.21 -0.09 -0.13 0.00 -2.07 0.00 0.00 59.70 57.62 1jhp h MET 250 Cb -0.00 -0.19 -0.01 0.00 -1.87 0.00 0.00 31.60 29.53 1jhp h MET 250 CO -0.04 0.66 -0.32 -0.07 1.07 0.00 0.00 176.91 178.21 1jhp h LEU 251 N 0.91 0.72 -0.36 1.22 3.38 -0.65 -2.62 115.31 117.92 1jhp h LEU 251 Ca 0.24 -0.29 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 1jhp h LEU 251 Cb -0.02 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1jhp h LEU 251 CO -0.04 0.99 -0.22 1.23 0.09 0.00 0.00 178.44 180.48 1jhp h GLY 252 N 0.98 0.85 1.43 0.83 0.00 -0.69 -1.07 103.07 105.39 1jhp h GLY 252 Ca 0.07 -0.79 -0.07 0.00 0.00 0.00 0.00 47.33 46.53 1jhp h GLY 252 CO 0.07 0.72 -0.01 0.00 0.00 0.00 0.00 176.54 177.32 1jhp h ALA 253 N 0.77 1.18 -0.29 3.60 0.00 -0.93 -0.60 119.26 122.98 1jhp h ALA 253 Ca 0.07 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1jhp h ALA 253 Cb 0.78 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1jhp h ALA 253 CO 0.06 0.54 -0.22 0.00 0.00 0.00 0.00 179.25 179.63 1jhp h ALA 254 N 1.33 0.42 -0.83 0.00 0.00 -1.36 0.93 119.26 119.74 1jhp h ALA 254 Ca 0.13 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1jhp h ALA 254 Cb 0.43 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1jhp h ALA 254 CO 0.02 0.38 0.41 -0.09 0.00 0.00 0.00 179.25 179.97 1jhp h ARG 255 N 0.41 1.19 0.00 0.00 9.65 -0.98 -0.62 114.38 124.03 1jhp h ARG 255 Ca 0.06 -0.16 0.00 0.00 -1.10 0.00 0.00 59.98 58.77 1jhp h ARG 255 Cb 0.77 -0.22 0.00 0.00 -1.39 0.00 0.00 29.97 29.13 1jhp h ARG 255 CO 0.06 0.90 0.00 0.00 2.80 0.00 0.00 179.97 183.73 1jhp n GLY 257 N 0.60 0.37 3.53 0.00 0.00 -0.24 -4.13 105.19 105.32 1jhp n GLY 257 Ca 0.07 -0.67 -0.24 0.00 0.00 0.00 0.00 46.02 45.18 1jhp n GLY 257 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jhp s LEU 258 N -1.71 2.81 0.27 0.99 1.43 0.31 -1.35 118.68 121.43 1jhp s LEU 258 Ca 0.00 -0.85 -0.23 0.00 -1.03 0.00 0.00 54.13 52.02 1jhp s LEU 258 Cb 0.00 -1.36 -0.09 0.00 0.03 0.00 0.00 46.19 44.77 1jhp s LEU 258 CO 0.00 0.04 0.84 -2.16 0.23 0.00 0.00 176.35 175.30 1jhp s PRO 259 N -3.44 4.44 -0.07 1.29 0.04 -1.26 -3.97 135.00 132.04 1jhp s PRO 259 Ca 0.29 1.12 0.03 0.00 0.04 0.00 0.00 61.00 62.48 1jhp s PRO 259 Cb -0.06 -2.87 0.01 0.00 0.04 0.00 0.00 34.50 31.62 1jhp s PRO 259 CO 0.16 0.35 -0.14 0.08 0.04 0.00 0.00 177.00 177.49 1jhp s VAL 260 N -1.54 1.26 -0.17 -0.36 1.01 -0.42 -1.84 120.40 118.35 1jhp s VAL 260 Ca 0.46 -0.56 -0.17 0.00 0.00 0.00 0.00 61.98 61.72 1jhp s VAL 260 Cb -0.18 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 1jhp s VAL 260 CO 0.23 0.38 0.42 -0.76 0.00 0.00 0.00 175.10 175.37 1jhp s LEU 261 N 0.59 4.21 0.76 3.92 1.43 0.92 -0.71 118.68 129.80 1jhp s LEU 261 Ca -0.15 0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 53.47 1jhp s LEU 261 Cb -0.16 -2.57 0.05 0.00 0.03 0.00 0.00 46.19 43.54 1jhp s LEU 261 CO 0.04 -0.03 1.14 -0.76 0.23 0.00 0.00 176.35 176.97 1jhp s LEU 262 N 0.96 2.68 0.00 1.79 1.02 0.25 -2.17 118.68 123.21 1jhp s LEU 262 Ca 0.21 0.91 0.00 0.00 0.02 0.00 0.00 54.13 55.27 1jhp s LEU 262 Cb -0.15 -3.53 0.00 0.00 0.02 0.00 0.00 46.19 42.53 1jhp s LEU 262 CO 0.08 -1.66 0.00 -0.67 0.02 0.00 0.00 176.35 174.12 1jhp n ASP 263 N -3.17 0.00 0.00 2.29 2.03 -1.26 -3.87 116.55 112.57 1jhp n ASP 263 Ca 0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.38 1jhp n ASP 263 Cb 0.59 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.99 1jhp n ASP 263 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1jhp n GLY 264 N 5.00 3.33 0.24 0.27 0.00 -1.26 -4.20 105.19 108.57 1jhp n GLY 264 Ca 0.00 -1.83 -0.04 0.00 0.00 0.00 0.00 46.02 44.14 1jhp n GLY 264 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1jhp h PHE 265 N 0.00 -0.45 -0.27 1.61 3.04 -1.94 0.61 116.94 119.53 1jhp h PHE 265 Ca 0.00 0.05 0.05 0.00 3.98 0.00 0.00 57.97 62.04 1jhp h PHE 265 Cb 0.00 0.27 -0.04 0.00 2.56 0.00 0.00 35.95 38.74 1jhp h PHE 265 CO 0.00 -0.27 0.00 -0.07 -2.02 0.00 0.00 178.31 175.95 1jhp h LEU 266 N -0.09 -0.10 -1.25 0.59 -0.00 -1.96 -1.83 115.31 110.68 1jhp h LEU 266 Ca 0.22 0.06 0.02 0.00 -0.00 0.00 0.00 57.88 58.18 1jhp h LEU 266 Cb 0.43 0.10 -0.04 0.00 -0.00 0.00 0.00 40.66 41.15 1jhp h LEU 266 CO -0.52 -0.02 0.52 0.77 -0.00 0.00 0.00 178.44 179.19 1jhp h SER 267 N 0.08 0.87 -0.67 -0.43 4.64 -1.65 -1.57 113.55 114.82 1jhp h SER 267 Ca 0.13 -0.02 0.03 0.00 -0.47 0.00 0.00 61.79 61.46 1jhp h SER 267 Cb 0.16 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 62.00 1jhp h SER 267 CO -0.21 0.61 0.42 1.88 -0.87 0.00 0.00 176.83 178.66 1jhp h TYR 268 N 1.01 0.78 -0.39 4.77 0.99 -0.14 -0.98 116.97 123.02 1jhp h TYR 268 Ca 0.30 0.02 0.06 0.00 2.00 0.00 0.00 58.73 61.11 1jhp h TYR 268 Cb -0.05 -0.25 -0.05 0.00 1.00 0.00 0.00 36.73 37.37 1jhp h TYR 268 CO -0.00 0.44 0.06 0.77 -0.00 0.00 0.00 178.16 179.44 1jhp h SER 269 N 0.82 -0.02 0.07 3.88 0.02 -0.55 -0.80 113.55 116.96 1jhp h SER 269 Ca 0.27 0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 61.22 1jhp h SER 269 Cb 0.02 0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 1jhp h SER 269 CO -0.11 0.02 -0.21 0.00 -1.14 0.00 0.00 176.83 175.39 1jhp h ALA 270 N 1.31 1.36 -0.06 3.77 0.00 -1.07 -2.65 119.26 121.91 1jhp h ALA 270 Ca 0.19 -0.27 -0.16 0.00 0.00 0.00 0.00 54.91 54.67 1jhp h ALA 270 Cb 0.24 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1jhp h ALA 270 CO -0.26 0.44 -0.66 0.00 0.00 0.00 0.00 179.25 178.77 1jhp h ALA 271 N 1.54 0.78 -0.64 0.00 0.00 -0.24 -1.25 119.26 119.45 1jhp h ALA 271 Ca 0.04 -0.58 -0.07 0.00 0.00 0.00 0.00 54.91 54.31 1jhp h ALA 271 Cb 0.52 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1jhp h ALA 271 CO 0.03 0.77 0.14 -0.07 0.00 0.00 0.00 179.25 180.12 1jhp h LEU 272 N 0.17 0.98 -0.23 0.00 3.38 -0.86 -1.30 115.31 117.44 1jhp h LEU 272 Ca -0.01 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.68 1jhp h LEU 272 Cb 1.19 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 1jhp h LEU 272 CO 0.10 0.97 -0.01 0.00 0.09 0.00 0.00 178.44 179.59 1jhp h ALA 273 N 1.05 0.32 -0.87 1.53 0.00 -1.31 0.17 119.26 120.15 1jhp h ALA 273 Ca 0.20 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1jhp h ALA 273 Cb 0.38 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 1jhp h ALA 273 CO 0.00 0.05 0.43 0.00 0.00 0.00 0.00 179.25 179.74 1jhp h ALA 274 N 0.80 1.12 -0.02 0.00 0.00 -1.10 0.17 119.26 120.23 1jhp h ALA 274 Ca 0.07 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 1jhp h ALA 274 Cb 0.42 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1jhp h ALA 274 CO 0.01 0.67 -0.48 0.00 0.00 0.00 0.00 179.25 179.46 1jhp h GLN 276 N 0.04 0.57 -0.11 0.00 5.75 -0.14 -2.44 115.11 118.78 1jhp h GLN 276 Ca -0.00 -0.26 -0.19 0.00 -0.15 0.00 0.00 58.65 58.05 1jhp h GLN 276 Cb 0.86 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.40 1jhp h GLN 276 CO 0.06 0.83 -0.71 0.82 -2.65 0.00 0.00 178.83 177.19 1jhp h ILE 277 N 0.30 1.35 -1.44 2.39 2.04 -0.41 -3.43 117.51 118.31 1jhp h ILE 277 Ca 0.05 -2.05 -0.13 0.00 1.00 0.00 0.00 64.86 63.73 1jhp h ILE 277 Cb 0.68 2.03 -0.25 0.00 -0.74 0.00 0.00 36.82 38.54 1jhp h ILE 277 CO 0.04 0.63 -0.49 0.00 0.00 0.00 0.00 178.15 178.33 1jhp s ALA 278 N -3.70 -1.62 0.48 1.87 0.00 0.25 -5.01 121.76 114.03 1jhp s ALA 278 Ca -0.07 0.36 0.18 0.00 0.00 0.00 0.00 51.96 52.43 1jhp s ALA 278 Cb 0.10 -2.29 1.18 0.00 0.00 0.00 0.00 23.12 22.11 1jhp s ALA 278 CO 0.85 -1.86 2.02 -1.35 0.00 0.00 0.00 175.76 175.41 1jhp h PRO 279 N 7.89 0.21 0.00 0.00 0.11 -1.63 0.80 132.00 139.38 1jhp h PRO 279 Ca -0.04 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1jhp h PRO 279 Cb 1.14 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1jhp h PRO 279 CO 0.21 0.14 0.11 0.00 -0.21 0.00 0.00 178.00 178.25 1jhp n ALA 280 N -2.56 0.81 0.10 -0.75 0.00 -1.26 -1.27 120.51 115.58 1jhp n ALA 280 Ca 0.07 0.05 -0.04 0.00 0.00 0.00 0.00 53.44 53.52 1jhp n ALA 280 Cb 0.39 -0.88 0.01 0.00 0.00 0.00 0.00 19.45 18.97 1jhp n ALA 280 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1jhp h VAL 281 N 0.00 1.55 -0.76 0.00 2.07 -1.14 -3.39 116.25 114.59 1jhp h VAL 281 Ca 0.00 -2.84 0.11 0.00 0.82 0.00 0.00 66.70 64.79 1jhp h VAL 281 Cb 0.22 2.55 -0.13 0.00 -1.52 0.00 0.00 31.29 32.42 1jhp h VAL 281 CO 0.00 0.80 -0.42 -0.09 0.02 0.00 0.00 177.57 177.88 1jhp h ARG 282 N 0.00 -0.12 0.00 1.57 9.65 -1.38 -1.70 114.38 122.41 1jhp h ARG 282 Ca -0.01 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1jhp h ARG 282 Cb 1.48 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 30.09 1jhp h ARG 282 CO 0.11 -0.08 0.07 -2.30 2.80 0.00 0.00 179.97 180.57 1jhp n PRO 283 N -5.41 0.13 0.02 0.20 -0.02 -1.26 -1.34 135.00 127.31 1jhp n PRO 283 Ca 0.05 0.62 0.11 0.00 -2.02 0.00 0.00 63.50 62.26 1jhp n PRO 283 Cb 0.36 -1.98 0.04 0.00 -0.02 0.00 0.00 33.50 31.89 1jhp n PRO 283 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1jhp n TYR 284 N -2.19 0.21 -2.75 6.00 4.01 -0.64 -4.93 117.16 116.86 1jhp n TYR 284 Ca -0.01 0.06 -0.40 0.00 -0.16 0.00 0.00 57.90 57.39 1jhp n TYR 284 Cb 0.10 -0.37 -0.06 0.00 -0.31 0.00 0.00 39.34 38.70 1jhp n TYR 284 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1jhp s LEU 285 N -3.72 4.63 -0.11 7.72 1.02 -0.45 -1.30 118.68 126.48 1jhp s LEU 285 Ca 0.05 1.94 -0.02 0.00 0.02 0.00 0.00 54.13 56.13 1jhp s LEU 285 Cb 0.15 -3.64 0.04 0.00 0.02 0.00 0.00 46.19 42.76 1jhp s LEU 285 CO 0.79 0.14 0.01 -0.63 0.02 0.00 0.00 176.35 176.69 1jhp s ILE 286 N -1.21 0.41 0.77 -0.59 1.01 0.11 -4.93 121.20 116.78 1jhp s ILE 286 Ca 0.42 -0.07 -0.13 0.00 0.00 0.00 0.00 60.65 60.86 1jhp s ILE 286 Cb -0.26 -0.67 0.06 0.00 0.01 0.00 0.00 42.46 41.60 1jhp s ILE 286 CO 0.32 0.12 1.16 -2.16 0.00 0.00 0.00 174.94 174.38 1jhp s PRO 287 N 1.94 1.98 0.00 2.79 0.04 -1.26 -0.58 135.00 139.91 1jhp s PRO 287 Ca 0.03 1.57 0.00 0.00 0.04 0.00 0.00 61.00 62.65 1jhp s PRO 287 Cb -0.14 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.57 1jhp s PRO 287 CO -0.06 -1.92 0.00 -1.13 0.04 0.00 0.00 177.00 173.93 1jhp n SER 288 N -3.16 0.00 -4.64 6.66 3.41 -1.25 -4.62 113.62 110.02 1jhp n SER 288 Ca 0.12 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.44 1jhp n SER 288 Cb 0.51 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.36 1jhp n SER 288 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 1jhp s HIS 289 N 0.00 2.34 -0.54 7.33 -3.43 -1.26 -1.56 115.29 118.17 1jhp s HIS 289 Ca 0.00 -0.75 -0.12 0.00 -0.80 0.00 0.00 55.06 53.39 1jhp s HIS 289 Cb 0.00 -1.72 0.13 0.00 -1.43 0.00 0.00 32.58 29.57 1jhp s HIS 289 CO 0.00 0.37 0.44 0.12 -2.00 0.00 0.00 174.74 173.68 1jhp s PHE 290 N -2.78 3.40 0.39 0.38 2.19 0.92 -4.79 117.98 117.68 1jhp s PHE 290 Ca 0.28 -1.72 -0.26 0.00 0.33 0.00 0.00 56.93 55.56 1jhp s PHE 290 Cb 0.08 -3.62 -0.11 0.00 -1.31 0.00 0.00 43.02 38.06 1jhp s PHE 290 CO 0.14 -1.00 1.15 0.45 1.83 0.00 0.00 175.22 177.80 1jhp n SER 291 N 4.87 2.00 0.00 6.13 2.88 -1.26 -4.35 113.62 123.89 1jhp n SER 291 Ca -0.07 1.11 0.11 0.00 -1.33 0.00 0.00 58.87 58.69 1jhp n SER 291 Cb 0.41 -1.42 0.61 0.00 -0.75 0.00 0.00 64.21 63.06 1jhp n SER 291 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1jhp n ALA 292 N -0.14 2.23 -1.79 -1.46 0.00 -0.25 -4.73 120.51 114.37 1jhp n ALA 292 Ca 0.08 -0.12 -0.41 0.00 0.00 0.00 0.00 53.44 52.99 1jhp n ALA 292 Cb 0.38 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.43 1jhp n ALA 292 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1jhp s GLU 293 N -2.43 4.29 0.24 0.00 2.56 -1.26 -4.93 118.70 117.16 1jhp s GLU 293 Ca 0.25 2.31 -0.06 0.00 0.00 0.00 0.00 54.97 57.48 1jhp s GLU 293 Cb 0.16 -3.05 0.44 0.00 2.00 0.00 0.00 34.13 33.67 1jhp s GLU 293 CO 0.33 -0.30 1.68 -0.22 -0.56 0.00 0.00 175.26 176.19 1jhp h LYS 294 N 3.56 0.23 0.00 4.30 3.64 -1.87 -2.00 116.57 124.43 1jhp h LYS 294 Ca -0.49 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 1jhp h LYS 294 Cb 1.23 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1jhp h LYS 294 CO 0.67 0.15 0.00 0.41 -2.27 0.00 0.00 179.45 178.41 1jhp n GLY 295 N -1.36 -0.93 0.34 5.01 0.00 -1.22 -4.29 105.19 102.75 1jhp n GLY 295 Ca 0.13 -0.14 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1jhp n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jhp h ALA 296 N 3.59 -0.42 -0.89 4.61 0.00 -1.65 -1.85 119.26 122.65 1jhp h ALA 296 Ca 0.00 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.00 1jhp h ALA 296 Cb 0.00 0.62 -0.07 0.00 0.00 0.00 0.00 17.79 18.34 1jhp h ALA 296 CO 0.00 -0.82 0.55 0.07 0.00 0.00 0.00 179.25 179.05 1jhp h ARG 297 N -0.43 0.91 0.06 0.00 0.11 -1.82 -0.57 114.38 112.65 1jhp h ARG 297 Ca 0.08 -0.06 -0.00 0.00 0.10 0.00 0.00 59.98 60.11 1jhp h ARG 297 Cb 0.56 -0.21 0.00 0.00 1.11 0.00 0.00 29.97 31.43 1jhp h ARG 297 CO -0.34 0.61 -0.03 0.82 0.10 0.00 0.00 179.97 181.13 1jhp h ILE 298 N 0.94 1.22 -0.77 0.08 2.04 -1.82 -1.69 117.51 117.51 1jhp h ILE 298 Ca 0.41 -0.98 0.11 0.00 1.00 0.00 0.00 64.86 65.41 1jhp h ILE 298 Cb 0.30 1.85 -0.08 0.00 -0.74 0.00 0.00 36.82 38.15 1jhp h ILE 298 CO -0.22 0.24 0.38 0.00 0.00 0.00 0.00 178.15 178.56 1jhp h ALA 299 N 0.38 1.09 -0.49 1.87 0.00 -1.11 -1.00 119.26 120.01 1jhp h ALA 299 Ca -0.01 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1jhp h ALA 299 Cb 0.46 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1jhp h ALA 299 CO 0.01 -0.06 -0.15 -0.07 0.00 0.00 0.00 179.25 178.98 1jhp h LEU 300 N 0.61 0.94 -0.80 0.00 3.38 -1.08 -2.22 115.31 116.14 1jhp h LEU 300 Ca 0.39 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1jhp h LEU 300 Cb 0.47 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1jhp h LEU 300 CO -0.31 1.08 0.27 0.00 0.09 0.00 0.00 178.44 179.57 1jhp h ALA 301 N 0.99 1.03 0.00 1.53 0.00 -0.65 0.42 119.26 122.59 1jhp h ALA 301 Ca 0.12 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 1jhp h ALA 301 Cb 0.70 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1jhp h ALA 301 CO 0.05 0.66 -0.29 0.45 0.00 0.00 0.00 179.25 180.13 1jhp h HIS 302 N 1.12 0.00 0.00 0.00 3.86 -0.98 -1.67 115.15 117.48 1jhp h HIS 302 Ca 0.25 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.46 1jhp h HIS 302 Cb 0.27 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.74 1jhp h HIS 302 CO 0.02 0.29 -0.48 -0.07 0.86 0.00 0.00 177.93 178.55 1jhp h LEU 303 N 0.00 0.00 -1.12 2.43 4.07 -0.68 -3.48 115.31 116.53 1jhp h LEU 303 Ca -0.00 -0.15 -0.32 0.00 0.08 0.00 0.00 57.88 57.49 1jhp h LEU 303 Cb 0.66 0.00 0.12 0.00 1.08 0.00 0.00 40.66 42.53 1jhp h LEU 303 CO 0.04 0.07 -0.59 -1.20 -1.08 0.00 0.00 178.44 175.68 1jhp n SER 304 N -2.21 -4.60 -4.27 -0.43 7.64 0.14 -5.01 113.62 104.87 1jhp n SER 304 Ca 0.04 -0.47 -0.30 0.00 1.01 0.00 0.00 58.87 59.15 1jhp n SER 304 Cb 0.45 -4.33 -0.16 0.00 -1.01 0.00 0.00 64.21 59.16 1jhp n SER 304 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1jhp s MET 305 N -5.82 1.97 -0.27 1.43 -1.94 -0.43 -5.03 119.30 109.22 1jhp s MET 305 Ca 0.35 -0.86 0.01 0.00 -1.71 0.00 0.00 55.69 53.48 1jhp s MET 305 Cb -0.15 -1.89 0.05 0.00 2.01 0.00 0.00 34.83 34.85 1jhp s MET 305 CO 0.61 0.51 -0.08 -1.83 -0.01 0.00 0.00 175.02 174.22 1jhp s GLU 306 N -0.54 2.37 0.82 2.03 1.03 -1.26 -4.65 118.70 118.50 1jhp s GLU 306 Ca 0.09 -1.28 -0.11 0.00 0.03 0.00 0.00 54.97 53.69 1jhp s GLU 306 Cb -0.09 -2.97 0.09 0.00 -0.80 0.00 0.00 34.13 30.35 1jhp s GLU 306 CO -0.01 -0.56 1.14 -2.14 -1.33 0.00 0.00 175.26 172.36 1jhp s PRO 307 N 1.17 1.73 -0.02 -4.83 0.02 -1.26 -4.89 135.00 126.91 1jhp s PRO 307 Ca -0.07 1.45 -0.16 0.00 0.02 0.00 0.00 61.00 62.24 1jhp s PRO 307 Cb -0.19 -1.82 -0.33 0.00 0.02 0.00 0.00 34.50 32.18 1jhp s PRO 307 CO -0.04 -2.09 0.85 1.88 -0.33 0.00 0.00 177.00 177.27 1jhp h TYR 308 N -1.25 0.79 -3.20 6.54 0.05 -1.54 -3.47 116.97 114.89 1jhp h TYR 308 Ca -0.44 -0.57 -0.61 0.00 0.05 0.00 0.00 58.73 57.15 1jhp h TYR 308 Cb 1.26 -0.03 -0.12 0.00 1.01 0.00 0.00 36.73 38.84 1jhp h TYR 308 CO 0.53 1.55 -0.51 -0.51 -1.05 0.00 0.00 178.16 178.17 1jhp s LEU 309 N -7.57 4.14 -0.54 3.88 1.02 -0.85 -5.02 118.68 113.74 1jhp s LEU 309 Ca -0.13 0.23 0.01 0.00 0.02 0.00 0.00 54.13 54.26 1jhp s LEU 309 Cb 0.04 -2.06 0.14 0.00 0.02 0.00 0.00 46.19 44.33 1jhp s LEU 309 CO 0.88 0.21 0.31 -1.00 0.02 0.00 0.00 176.35 176.77 1jhp s HIS 310 N 0.17 3.31 -0.48 0.29 3.76 -1.26 -0.06 115.29 121.02 1jhp s HIS 310 Ca 0.08 -2.99 0.04 0.00 -0.15 0.00 0.00 55.06 52.05 1jhp s HIS 310 Cb -0.11 -2.97 0.02 0.00 1.11 0.00 0.00 32.58 30.62 1jhp s HIS 310 CO -0.01 -0.80 0.53 -1.33 -0.85 0.00 0.00 174.74 172.29 1jhp n MET 311 N 3.35 1.04 -2.54 1.40 2.81 -1.26 -5.00 117.12 116.92 1jhp n MET 311 Ca 0.06 -0.59 -0.20 0.00 -1.81 0.00 0.00 57.70 55.15 1jhp n MET 311 Cb 0.35 -0.99 0.00 0.00 -0.71 0.00 0.00 33.22 31.87 1jhp n MET 311 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1jhp n ALA 312 N -0.06 -0.68 -1.86 3.04 0.00 -1.26 -4.97 120.51 114.72 1jhp n ALA 312 Ca 0.02 0.19 -0.34 0.00 0.00 0.00 0.00 53.44 53.32 1jhp n ALA 312 Cb 0.10 -2.56 -0.07 0.00 0.00 0.00 0.00 19.45 16.93 1jhp n ALA 312 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1jhp s MET 313 N -5.17 4.26 -0.15 0.00 -1.94 -1.26 -4.57 119.30 110.47 1jhp s MET 313 Ca 0.07 1.09 0.08 0.00 -1.71 0.00 0.00 55.69 55.23 1jhp s MET 313 Cb -0.03 -2.34 0.22 0.00 2.01 0.00 0.00 34.83 34.69 1jhp s MET 313 CO 0.09 0.06 1.24 2.89 -0.01 0.00 0.00 175.02 179.29 1jhp n ARG 314 N -0.36 0.64 0.01 2.03 1.85 -1.26 -1.09 116.66 118.48 1jhp n ARG 314 Ca 0.05 -1.27 -0.22 0.00 -1.00 0.00 0.00 57.85 55.42 1jhp n ARG 314 Cb 0.53 0.34 -0.14 0.00 -1.05 0.00 0.00 32.46 32.14 1jhp n ARG 314 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 1jhp h LEU 315 N 0.60 0.43 0.00 2.89 5.85 -1.98 -3.46 115.31 119.63 1jhp h LEU 315 Ca -0.48 -0.95 0.00 0.00 0.84 0.00 0.00 57.88 57.29 1jhp h LEU 315 Cb 1.39 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.28 1jhp h LEU 315 CO -0.20 1.85 0.00 0.61 -0.34 0.00 0.00 178.44 180.36 1jhp n GLY 316 N 1.98 -0.04 4.05 3.75 0.00 -1.26 -4.93 105.19 108.73 1jhp n GLY 316 Ca -0.31 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1jhp n GLY 316 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jhp n GLU 317 N 2.47 0.00 -0.32 1.61 1.02 -0.86 -1.11 120.64 123.45 1jhp n GLU 317 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1jhp n GLU 317 Cb 0.00 -3.17 0.00 0.00 -0.02 0.00 0.00 31.44 28.25 1jhp n GLU 317 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1jhp n GLY 318 N -2.00 0.81 0.29 0.62 0.00 -1.26 -4.27 105.19 99.38 1jhp n GLY 318 Ca 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 46.02 45.69 1jhp n GLY 318 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1jhp h SER 319 N 0.00 0.77 -0.45 1.61 4.64 -1.45 -2.62 113.55 116.06 1jhp h SER 319 Ca 0.00 -0.18 -0.07 0.00 -0.47 0.00 0.00 61.79 61.07 1jhp h SER 319 Cb 0.00 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 61.87 1jhp h SER 319 CO 0.00 0.83 0.01 1.23 -0.87 0.00 0.00 176.83 178.04 1jhp h GLY 320 N 0.97 0.84 0.41 -0.77 0.00 -1.91 -2.35 103.07 100.27 1jhp h GLY 320 Ca 0.15 -0.61 0.04 0.00 0.00 0.00 0.00 47.33 46.91 1jhp h GLY 320 CO 0.02 0.56 -0.18 0.00 0.00 0.00 0.00 176.54 176.95 1jhp h ALA 321 N 0.91 -0.11 -0.75 3.60 0.00 -1.62 -1.52 119.26 119.77 1jhp h ALA 321 Ca 0.13 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.11 1jhp h ALA 321 Cb 0.48 0.35 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 1jhp h ALA 321 CO 0.02 -0.63 0.48 0.00 0.00 0.00 0.00 179.25 179.12 1jhp h ALA 322 N 0.81 0.98 -0.38 0.00 0.00 -1.44 -1.77 119.26 117.47 1jhp h ALA 322 Ca 0.10 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1jhp h ALA 322 Cb 0.36 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1jhp h ALA 322 CO -0.26 0.29 0.25 1.25 0.00 0.00 0.00 179.25 180.78 1jhp h LEU 323 N 0.94 0.27 0.00 0.00 5.85 -0.80 -2.56 115.31 119.01 1jhp h LEU 323 Ca 0.30 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.02 1jhp h LEU 323 Cb -0.00 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 40.97 1jhp h LEU 323 CO -0.10 0.18 -0.32 0.00 -0.34 0.00 0.00 178.44 177.85 1jhp n ALA 324 N -2.52 2.94 -0.27 1.25 0.00 -0.65 -4.33 120.51 116.92 1jhp n ALA 324 Ca 0.04 -0.22 0.05 0.00 0.00 0.00 0.00 53.44 53.31 1jhp n ALA 324 Cb 0.22 -1.27 0.19 0.00 0.00 0.00 0.00 19.45 18.59 1jhp n ALA 324 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1jhp h MET 325 N 0.00 0.53 -0.13 0.00 2.86 -1.32 -1.05 114.93 115.82 1jhp h MET 325 Ca 0.00 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 1jhp h MET 325 Cb 0.57 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 1jhp h MET 325 CO 0.00 0.35 -0.03 -1.35 1.06 0.00 0.00 176.91 176.95 1jhp h PRO 326 N 0.55 0.18 -0.49 -0.22 0.11 -1.79 -0.14 132.00 130.20 1jhp h PRO 326 Ca 0.42 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.47 1jhp h PRO 326 Cb 0.58 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.64 1jhp h PRO 326 CO -0.36 0.23 0.18 0.82 -0.21 0.00 0.00 178.00 178.66 1jhp h ILE 327 N 0.18 1.22 -0.69 4.15 2.04 -1.47 0.31 117.51 123.24 1jhp h ILE 327 Ca 0.04 -0.69 -0.05 0.00 1.00 0.00 0.00 64.86 65.17 1jhp h ILE 327 Cb 0.17 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1jhp h ILE 327 CO 0.01 0.26 0.25 0.58 0.00 0.00 0.00 178.15 179.24 1jhp h VAL 328 N 0.65 1.24 -0.43 1.67 2.07 -0.92 -1.95 116.25 118.59 1jhp h VAL 328 Ca 0.16 -0.79 -0.10 0.00 0.82 0.00 0.00 66.70 66.79 1jhp h VAL 328 Cb 0.22 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 1jhp h VAL 328 CO -0.01 0.32 -0.13 -0.33 0.02 0.00 0.00 177.57 177.44 1jhp h GLU 329 N 1.00 0.77 -0.83 1.57 5.08 -0.41 -3.01 114.58 118.76 1jhp h GLU 329 Ca 0.23 -0.26 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1jhp h GLU 329 Cb 0.23 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.37 1jhp h GLU 329 CO -0.02 0.87 0.54 0.00 -1.00 0.00 0.00 179.01 179.40 1jhp h ALA 330 N 1.16 1.07 -0.20 3.43 0.00 0.31 -1.62 119.26 123.42 1jhp h ALA 330 Ca 0.12 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1jhp h ALA 330 Cb 0.61 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1jhp h ALA 330 CO 0.04 0.39 -0.01 0.00 0.00 0.00 0.00 179.25 179.67 1jhp h ALA 331 N 1.33 1.61 -0.14 0.00 0.00 -1.27 0.57 119.26 121.36 1jhp h ALA 331 Ca 0.32 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 1jhp h ALA 331 Cb -0.04 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1jhp h ALA 331 CO -0.10 0.29 -0.39 0.00 0.00 0.00 0.00 179.25 179.05 1jhp h ALA 333 N 0.53 0.65 0.37 0.00 0.00 -0.99 0.41 119.26 120.22 1jhp h ALA 333 Ca -0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1jhp h ALA 333 Cb 1.01 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1jhp h ALA 333 CO 0.08 0.08 -0.46 1.98 0.00 0.00 0.00 179.25 180.93 1jhp h MET 334 N 0.68 -0.83 -0.91 0.00 1.85 -0.88 0.71 114.93 115.54 1jhp h MET 334 Ca 0.19 0.06 0.21 0.00 -0.61 0.00 0.00 59.70 59.54 1jhp h MET 334 Cb -0.07 0.19 -0.12 0.00 0.43 0.00 0.00 31.60 32.04 1jhp h MET 334 CO -0.05 -0.56 0.46 0.35 -0.40 0.00 0.00 176.91 176.71 1jhp h PHE 335 N -0.87 0.77 0.02 1.39 3.57 -0.86 -2.59 116.94 118.37 1jhp h PHE 335 Ca -0.03 0.04 -0.37 0.00 3.53 0.00 0.00 57.97 61.14 1jhp h PHE 335 Cb 0.79 -0.20 -0.06 0.00 2.79 0.00 0.00 35.95 39.27 1jhp h PHE 335 CO -0.28 0.05 -2.27 0.72 -2.23 0.00 0.00 178.31 174.30 1jhp n HIS 336 N -4.96 0.33 0.83 0.41 8.25 0.09 -4.63 115.22 115.54 1jhp n HIS 336 Ca 0.22 0.09 0.11 0.00 -0.26 0.00 0.00 57.72 57.88 1jhp n HIS 336 Cb 0.62 -1.05 -0.02 0.00 1.12 0.00 0.00 29.99 30.65 1jhp n HIS 336 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1jhp n ASN 337 N -3.08 0.74 -4.79 0.41 5.03 0.25 -4.95 115.26 108.87 1jhp n ASN 337 Ca -0.35 -0.60 -0.35 0.00 0.87 0.00 0.00 54.58 54.15 1jhp n ASN 337 Cb 1.07 0.89 -0.03 0.00 -1.02 0.00 0.00 39.78 40.69 1jhp n ASN 337 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 1jhp s MET 338 N -3.08 3.75 0.85 3.52 -1.94 -0.98 -5.04 119.30 116.37 1jhp s MET 338 Ca 0.06 1.46 -0.12 0.00 -1.71 0.00 0.00 55.69 55.38 1jhp s MET 338 Cb 0.16 -2.14 0.10 0.00 2.01 0.00 0.00 34.83 34.96 1jhp s MET 338 CO 0.82 -0.49 1.18 0.20 -0.01 0.00 0.00 175.02 176.72 1jhp s GLY 339 N -1.85 1.60 -0.03 -0.03 0.00 -1.26 -4.86 107.32 100.89 1jhp s GLY 339 Ca 0.67 -0.67 0.00 0.00 0.00 0.00 0.00 44.72 44.72 1jhp s GLY 339 CO 0.23 -0.14 -0.01 -0.54 0.00 0.00 0.00 173.10 172.64 1jhp s GLU 340 N -5.55 2.83 0.21 2.90 2.02 -1.26 -0.11 118.70 119.75 1jhp s GLU 340 Ca 0.63 -0.55 -0.10 0.00 0.02 0.00 0.00 54.97 54.98 1jhp s GLU 340 Cb -0.11 -2.69 0.31 0.00 0.10 0.00 0.00 34.13 31.74 1jhp s GLU 340 CO 0.50 0.65 1.69 -0.07 0.02 0.00 0.00 175.26 178.05 1jhp h LEU 341 N 4.69 -0.08 -1.27 1.80 3.38 -1.29 -1.79 115.31 120.74 1jhp h LEU 341 Ca -0.49 0.13 0.06 0.00 0.09 0.00 0.00 57.88 57.67 1jhp h LEU 341 Cb 1.18 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 42.07 1jhp h LEU 341 CO 0.56 -0.04 0.53 0.00 0.09 0.00 0.00 178.44 179.58 1jhp h ALA 342 N 1.52 1.61 0.00 1.53 0.00 -1.79 0.18 119.26 122.31 1jhp h ALA 342 Ca 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1jhp h ALA 342 Cb 0.51 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1jhp h ALA 342 CO -0.45 0.26 0.00 0.00 0.00 0.00 0.00 179.25 179.06 1jhp n ALA 343 N -2.42 1.59 0.69 0.00 0.00 -0.68 -1.61 120.51 118.09 1jhp n ALA 343 Ca 0.12 0.03 0.07 0.00 0.00 0.00 0.00 53.44 53.67 1jhp n ALA 343 Cb 0.21 -1.30 -0.03 0.00 0.00 0.00 0.00 19.45 18.33 1jhp n ALA 343 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1jhp n SER 344 N -1.91 1.27 -0.76 0.00 7.64 -0.02 -4.95 113.62 114.88 1jhp n SER 344 Ca 0.02 -1.13 -0.09 0.00 1.01 0.00 0.00 58.87 58.68 1jhp n SER 344 Cb 0.18 0.66 -0.03 0.00 -1.01 0.00 0.00 64.21 64.01 1jhp n SER 344 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1jhp n ASN 345 N -0.57 -3.97 -4.78 6.43 5.03 -0.63 -4.99 115.26 111.77 1jhp n ASN 345 Ca 0.05 0.19 -0.38 0.00 0.87 0.00 0.00 54.58 55.31 1jhp n ASN 345 Cb 0.29 -2.44 -0.06 0.00 -1.02 0.00 0.00 39.78 36.56 1jhp n ASN 345 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1jhp s ILE 346 N -2.36 4.97 -0.11 2.41 1.01 -0.86 -5.02 121.20 121.24 1jhp s ILE 346 Ca 0.00 1.07 0.01 0.00 0.00 0.00 0.00 60.65 61.73 1jhp s ILE 346 Cb 0.00 -3.84 0.02 0.00 0.01 0.00 0.00 42.46 38.65 1jhp s ILE 346 CO 0.00 0.47 -0.14 -0.69 0.00 0.00 0.00 174.94 174.58 1jhp s VAL 347 N -0.42 1.42 0.00 2.92 1.01 -1.26 -4.37 120.40 119.70 1jhp s VAL 347 Ca 0.27 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 61.73 1jhp s VAL 347 Cb -0.17 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 34.87 1jhp s VAL 347 CO 0.15 0.43 -0.19 -0.76 0.00 0.00 0.00 175.10 174.73 1jhp s LEU 348 N 1.09 2.08 0.00 3.92 1.43 -1.26 -5.22 118.68 120.72 1jhp s LEU 348 Ca -0.05 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.66 1jhp s LEU 348 Cb -0.14 -0.95 0.00 0.00 0.03 0.00 0.00 46.19 45.13 1jhp s LEU 348 CO -0.03 0.20 0.24 -2.65 0.23 0.00 0.00 176.35 174.34