#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hmx s MET 2 N 0.00 1.29 0.00 -0.41 1.00 -1.26 -4.92 119.30 115.00 2hmx s MET 2 Ca 0.00 -1.69 0.00 0.00 0.00 0.00 0.00 55.69 54.00 2hmx s MET 2 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 34.83 34.81 2hmx s MET 2 CO 0.00 -0.33 0.00 0.41 0.00 0.00 0.00 175.02 175.10 2hmx n GLY 3 N -0.36 2.62 5.08 -0.03 0.00 -1.26 -4.90 105.19 106.33 2hmx n GLY 3 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.43 2hmx n GLY 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hmx n ALA 4 N 0.00 0.00 -1.33 4.61 0.00 -1.26 -4.88 120.51 117.64 2hmx n ALA 4 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hmx n ALA 4 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2hmx n ALA 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2hmx n ARG 5 N 0.00 -3.75 0.00 0.00 3.00 -1.26 -5.05 116.66 109.60 2hmx n ARG 5 Ca 0.00 2.82 0.00 0.00 -0.01 0.00 0.00 57.85 60.66 2hmx n ARG 5 Cb 0.00 -3.26 0.00 0.00 0.00 0.00 0.00 32.46 29.20 2hmx n ARG 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2hmx n ALA 6 N -1.29 0.00 -1.57 7.54 0.00 -1.26 -5.16 120.51 118.77 2hmx n ALA 6 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hmx n ALA 6 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.55 2hmx n ALA 6 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2hmx n SER 7 N -0.50 0.00 0.36 0.00 2.88 -1.26 -5.02 113.62 110.08 2hmx n SER 7 Ca 0.00 -0.18 -0.14 0.00 -1.33 0.00 0.00 58.87 57.21 2hmx n SER 7 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 2hmx n SER 7 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2hmx h VAL 8 N -0.10 0.00 -3.37 2.46 2.07 -1.97 -3.48 116.25 111.87 2hmx h VAL 8 Ca 0.00 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2hmx h VAL 8 Cb 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 2hmx h VAL 8 CO 0.00 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.77 2hmx n LEU 9 N -4.53 0.00 -4.99 2.57 4.77 -1.26 -4.88 117.00 108.68 2hmx n LEU 9 Ca -0.11 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.67 2hmx n LEU 9 Cb 0.36 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.45 2hmx n LEU 9 CO 0.28 -0.36 0.04 -0.55 -1.33 0.00 0.00 177.39 175.47 2hmx s SER 10 N -1.00 6.02 0.09 -1.43 0.15 -1.26 -4.77 113.70 111.49 2hmx s SER 10 Ca 0.00 -0.15 -0.21 0.00 0.70 0.00 0.00 55.95 56.29 2hmx s SER 10 Cb 0.00 -1.32 -0.10 0.00 -1.71 0.00 0.00 66.02 62.89 2hmx s SER 10 CO 0.00 -0.38 1.65 1.23 1.20 0.00 0.00 173.24 176.94 2hmx h GLY 11 N 0.93 0.24 0.98 9.45 0.00 -1.99 0.57 103.07 113.25 2hmx h GLY 11 Ca -0.47 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 46.74 2hmx h GLY 11 CO 0.54 0.11 -0.08 -1.33 0.00 0.00 0.00 176.54 175.78 2hmx h GLY 12 N 0.12 -0.25 2.00 4.60 0.00 -2.00 -2.24 103.07 105.30 2hmx h GLY 12 Ca 0.05 0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.47 2hmx h GLY 12 CO -0.01 -0.09 -0.01 0.83 0.00 0.00 0.00 176.54 177.27 2hmx h GLU 13 N -0.26 0.00 0.92 4.80 5.08 -1.90 0.19 114.58 123.41 2hmx h GLU 13 Ca -0.02 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 2hmx h GLU 13 Cb 0.20 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.46 2hmx h GLU 13 CO 0.04 0.01 -0.44 -0.07 -1.00 0.00 0.00 179.01 177.54 2hmx h LEU 14 N 0.00 -1.05 -2.55 1.33 -0.00 0.70 0.56 115.31 114.31 2hmx h LEU 14 Ca -0.00 0.03 -0.00 0.00 -0.00 0.00 0.00 57.88 57.91 2hmx h LEU 14 Cb 0.41 0.27 -0.00 0.00 -0.00 0.00 0.00 40.66 41.34 2hmx h LEU 14 CO 0.00 -0.72 -0.01 -0.78 -0.00 0.00 0.00 178.44 176.92 2hmx h ASP 15 N -1.29 0.00 0.73 -0.43 1.82 -0.09 0.83 116.42 117.99 2hmx h ASP 15 Ca -0.13 0.00 -0.24 0.00 -0.39 0.00 0.00 57.03 56.27 2hmx h ASP 15 Cb 0.95 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 40.92 2hmx h ASP 15 CO 0.21 0.01 -1.39 0.50 -1.61 0.00 0.00 179.24 176.96 2hmx h LYS 16 N 0.00 0.00 0.00 0.28 1.63 -1.39 -3.27 116.57 113.82 2hmx h LYS 16 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2hmx h LYS 16 Cb 0.06 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.69 2hmx h LYS 16 CO 0.00 0.61 0.00 1.87 -3.45 0.00 0.00 179.45 178.48 2hmx n TRP 17 N -3.12 0.00 -0.43 1.91 -0.00 0.27 -3.34 117.44 112.73 2hmx n TRP 17 Ca -0.10 0.00 -0.07 0.00 -0.00 0.00 0.00 57.50 57.33 2hmx n TRP 17 Cb 0.97 -0.45 0.19 0.00 -0.00 0.00 0.00 31.31 32.03 2hmx n TRP 17 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 177.69 175.78 2hmx n GLU 18 N -1.45 2.69 0.00 5.87 2.13 -0.17 -3.91 120.64 125.80 2hmx n GLU 18 Ca 0.04 -2.12 0.00 0.00 0.66 0.00 0.00 57.16 55.74 2hmx n GLU 18 Cb 0.15 -1.91 0.00 0.00 0.27 0.00 0.00 31.44 29.95 2hmx n GLU 18 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2hmx n LYS 19 N -0.15 0.00 -1.17 5.31 5.02 -1.21 -4.83 118.16 121.12 2hmx n LYS 19 Ca 0.31 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.31 2hmx n LYS 19 Cb 1.13 0.00 0.21 0.00 -0.02 0.00 0.00 35.03 36.35 2hmx n LYS 19 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2hmx s ILE 20 N 0.00 1.81 -0.13 -0.18 -1.09 -0.94 -4.69 121.20 115.98 2hmx s ILE 20 Ca 0.00 0.00 -0.02 0.00 -2.23 0.00 0.00 60.65 58.40 2hmx s ILE 20 Cb 0.00 -2.52 -0.03 0.00 -1.58 0.00 0.00 42.46 38.33 2hmx s ILE 20 CO 0.00 0.00 -0.06 -0.60 -1.23 0.00 0.00 174.94 173.05 2hmx s ARG 21 N -5.23 3.39 -0.30 2.79 3.52 0.20 -1.91 118.95 121.41 2hmx s ARG 21 Ca 0.68 -0.55 -0.10 0.00 -0.13 0.00 0.00 55.73 55.63 2hmx s ARG 21 Cb -0.14 -2.78 0.17 0.00 -1.56 0.00 0.00 34.95 30.64 2hmx s ARG 21 CO 0.56 0.35 0.85 -0.48 -0.81 0.00 0.00 175.30 175.78 2hmx s LEU 22 N 0.05 -0.84 -0.47 -0.88 0.05 -0.94 -2.10 118.68 113.54 2hmx s LEU 22 Ca -0.01 0.77 0.08 0.00 0.05 0.00 0.00 54.13 55.02 2hmx s LEU 22 Cb -0.14 1.80 0.36 0.00 -2.05 0.00 0.00 46.19 46.17 2hmx s LEU 22 CO 0.03 -0.16 0.89 -2.11 -0.55 0.00 0.00 176.35 174.46 2hmx n ARG 23 N 5.31 2.33 0.32 1.48 1.85 -1.26 -0.22 116.66 126.47 2hmx n ARG 23 Ca -0.07 -4.19 0.20 0.00 -1.00 0.00 0.00 57.85 52.79 2hmx n ARG 23 Cb 0.52 -1.98 1.08 0.00 -1.05 0.00 0.00 32.46 31.03 2hmx n ARG 23 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 2hmx h PRO 24 N 2.94 0.00 -0.09 2.89 0.14 -1.97 -2.56 132.00 133.35 2hmx h PRO 24 Ca 0.12 0.00 -0.19 0.00 0.14 0.00 0.00 66.00 66.07 2hmx h PRO 24 Cb 0.76 0.00 -0.19 0.00 0.14 0.00 0.00 31.00 31.71 2hmx h PRO 24 CO 0.69 0.00 -0.43 0.41 0.14 0.00 0.00 178.00 178.81 2hmx n GLY 25 N -1.17 1.89 2.33 1.56 0.00 -1.26 -5.00 105.19 103.53 2hmx n GLY 25 Ca -0.02 -0.33 -0.03 0.00 0.00 0.00 0.00 46.02 45.64 2hmx n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hmx n GLY 26 N -1.23 0.59 0.22 -0.02 0.00 -0.97 -4.78 105.19 99.00 2hmx n GLY 26 Ca -0.11 -0.27 -0.01 0.00 0.00 0.00 0.00 46.02 45.63 2hmx n GLY 26 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2hmx h LYS 27 N 0.37 0.33 -5.80 1.61 1.57 -1.85 -3.47 116.57 109.31 2hmx h LYS 27 Ca -0.07 -0.12 -0.38 0.00 -1.87 0.00 0.00 60.65 58.21 2hmx h LYS 27 Cb 0.45 -0.02 0.14 0.00 0.08 0.00 0.00 32.23 32.88 2hmx h LYS 27 CO 0.10 0.59 -0.72 0.36 -0.57 0.00 0.00 179.45 179.20 2hmx n LYS 28 N -4.12 -7.25 -3.63 3.15 2.85 -0.28 -4.91 118.16 103.96 2hmx n LYS 28 Ca -0.01 0.82 0.01 0.00 -1.05 0.00 0.00 58.31 58.08 2hmx n LYS 28 Cb 0.40 -5.84 -0.01 0.00 -0.65 0.00 0.00 35.03 28.94 2hmx n LYS 28 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 2hmx s GLN 29 N -5.96 0.48 0.34 -1.58 1.11 0.69 -2.20 119.66 112.54 2hmx s GLN 29 Ca 0.35 -0.27 0.09 0.00 0.01 0.00 0.00 55.36 55.54 2hmx s GLN 29 Cb -0.16 0.16 -0.05 0.00 -1.01 0.00 0.00 33.01 31.96 2hmx s GLN 29 CO 0.74 -0.22 0.02 1.52 0.01 0.00 0.00 175.29 177.36 2hmx s TYR 30 N -2.52 2.56 0.00 0.91 1.13 -0.80 -4.24 117.35 114.39 2hmx s TYR 30 Ca 0.14 -0.43 0.00 0.00 -1.41 0.00 0.00 57.07 55.37 2hmx s TYR 30 Cb 0.04 -1.49 0.00 0.00 -1.10 0.00 0.00 41.96 39.41 2hmx s TYR 30 CO -0.03 0.47 0.00 1.63 -2.51 0.00 0.00 175.55 175.11 2hmx n LYS 31 N -0.97 0.64 0.12 -3.49 4.01 -1.26 -2.20 118.16 115.00 2hmx n LYS 31 Ca -0.04 0.00 0.12 0.00 -0.51 0.00 0.00 58.31 57.88 2hmx n LYS 31 Cb 0.62 0.00 0.46 0.00 -0.51 0.00 0.00 35.03 35.60 2hmx n LYS 31 CO 0.00 0.00 0.00 -0.11 -1.11 0.00 0.00 177.40 176.18 2hmx n LEU 32 N 0.00 0.71 0.17 -0.35 7.94 -1.26 -1.10 117.00 123.11 2hmx n LEU 32 Ca 0.00 0.63 0.13 0.00 -1.11 0.00 0.00 56.01 55.67 2hmx n LEU 32 Cb 0.00 -0.48 0.55 0.00 0.53 0.00 0.00 43.42 44.01 2hmx n LEU 32 CO 0.00 -0.42 0.90 0.50 -1.11 0.00 0.00 177.39 177.26 2hmx h LYS 33 N 0.00 0.00 0.02 1.96 1.63 -1.97 0.12 116.57 118.32 2hmx h LYS 33 Ca 0.00 0.00 -0.36 0.00 -0.85 0.00 0.00 60.65 59.44 2hmx h LYS 33 Cb 0.50 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 32.07 2hmx h LYS 33 CO 0.00 0.00 -2.19 0.72 -3.45 0.00 0.00 179.45 174.53 2hmx n HIS 34 N -2.48 0.45 0.05 1.91 8.25 -0.26 -2.00 115.22 121.14 2hmx n HIS 34 Ca 0.02 0.13 -0.12 0.00 -0.26 0.00 0.00 57.72 57.48 2hmx n HIS 34 Cb 0.25 -1.07 -0.08 0.00 1.12 0.00 0.00 29.99 30.22 2hmx n HIS 34 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 2hmx h ILE 35 N 0.01 1.04 -0.67 1.59 2.10 -1.13 0.56 117.51 121.02 2hmx h ILE 35 Ca -0.48 -0.25 -0.06 0.00 1.08 0.00 0.00 64.86 65.16 2hmx h ILE 35 Cb 2.07 1.21 -0.03 0.00 -1.09 0.00 0.00 36.82 38.97 2hmx h ILE 35 CO 0.02 0.06 0.20 0.58 -1.08 0.00 0.00 178.15 177.93 2hmx h VAL 36 N -0.15 1.25 0.21 2.19 2.07 -0.87 0.58 116.25 121.52 2hmx h VAL 36 Ca -0.00 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 2hmx h VAL 36 Cb 0.14 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 2hmx h VAL 36 CO 0.01 0.34 -0.16 -0.25 0.02 0.00 0.00 177.57 177.53 2hmx h TRP 37 N 0.99 -0.41 0.70 1.57 7.01 -1.45 0.23 115.95 124.59 2hmx h TRP 37 Ca 0.22 -0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.18 2hmx h TRP 37 Cb 0.30 0.16 0.00 0.00 -2.10 0.00 0.00 29.16 27.52 2hmx h TRP 37 CO 0.02 -0.25 -0.37 0.00 -2.79 0.00 0.00 178.44 175.06 2hmx h ALA 38 N 0.39 -1.24 -0.32 2.65 0.00 0.54 0.19 119.26 121.47 2hmx h ALA 38 Ca -0.01 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.75 2hmx h ALA 38 Cb 0.33 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 2hmx h ALA 38 CO -0.01 -1.18 0.22 0.66 0.00 0.00 0.00 179.25 178.94 2hmx h SER 39 N -0.98 0.14 0.76 0.00 4.64 0.14 0.46 113.55 118.71 2hmx h SER 39 Ca -0.10 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.19 2hmx h SER 39 Cb 0.76 -0.03 0.01 0.00 -0.31 0.00 0.00 62.40 62.83 2hmx h SER 39 CO 0.14 0.09 -0.37 -0.09 -0.87 0.00 0.00 176.83 175.73 2hmx h ARG 40 N 0.16 -0.98 -0.39 4.77 2.43 -0.44 0.12 114.38 120.05 2hmx h ARG 40 Ca 0.14 0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.35 2hmx h ARG 40 Cb 0.37 0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 30.13 2hmx h ARG 40 CO -0.02 -0.64 0.12 1.49 -1.51 0.00 0.00 179.97 179.40 2hmx h GLU 41 N -1.08 0.56 0.04 0.20 4.57 0.29 -2.28 114.58 116.88 2hmx h GLU 41 Ca -0.10 -0.08 -0.00 0.00 -1.18 0.00 0.00 59.36 57.99 2hmx h GLU 41 Cb 0.79 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.29 2hmx h GLU 41 CO 0.17 0.49 -0.02 1.25 -1.18 0.00 0.00 179.01 179.73 2hmx h LEU 42 N 0.55 -0.04 -2.86 1.64 5.85 0.13 0.37 115.31 120.95 2hmx h LEU 42 Ca 0.13 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.85 2hmx h LEU 42 Cb 0.17 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.21 2hmx h LEU 42 CO -0.01 -0.03 0.02 -0.33 -0.34 0.00 0.00 178.44 177.75 2hmx h GLU 43 N -0.06 0.00 -0.00 1.25 3.07 -0.67 0.61 114.58 118.78 2hmx h GLU 43 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 2hmx h GLU 43 Cb 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 2hmx h GLU 43 CO 0.01 0.00 -0.72 0.54 -1.40 0.00 0.00 179.01 177.44 2hmx n ARG 44 N -3.02 1.29 0.40 2.33 1.74 -0.87 -1.20 116.66 117.32 2hmx n ARG 44 Ca -0.03 -0.22 -0.16 0.00 -0.77 0.00 0.00 57.85 56.67 2hmx n ARG 44 Cb 0.09 -1.33 -0.08 0.00 -1.02 0.00 0.00 32.46 30.12 2hmx n ARG 44 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 2hmx h PHE 45 N 0.51 -0.95 0.00 -1.55 -1.00 0.21 -3.46 116.94 110.70 2hmx h PHE 45 Ca 0.00 -0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.76 2hmx h PHE 45 Cb 0.47 0.32 0.00 0.00 3.61 0.00 0.00 35.95 40.34 2hmx h PHE 45 CO 0.00 -0.59 0.00 0.00 -1.61 0.00 0.00 178.31 176.11 2hmx n ALA 46 N -2.56 0.35 -2.43 2.45 0.00 -0.85 -5.09 120.51 112.38 2hmx n ALA 46 Ca -0.13 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.09 2hmx n ALA 46 Cb 0.41 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.76 2hmx n ALA 46 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2hmx s VAL 47 N 0.00 2.13 -0.01 0.00 1.01 -0.34 -5.00 120.40 118.18 2hmx s VAL 47 Ca 0.00 -2.30 0.01 0.00 0.00 0.00 0.00 61.98 59.68 2hmx s VAL 47 Cb 0.00 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 2hmx s VAL 47 CO 0.00 -0.45 0.02 0.21 0.00 0.00 0.00 175.10 174.88 2hmx s ASN 48 N -3.44 5.27 0.01 3.32 3.84 -1.26 -4.28 114.94 118.40 2hmx s ASN 48 Ca 0.27 0.04 -0.23 0.00 0.21 0.00 0.00 52.86 53.16 2hmx s ASN 48 Cb -0.02 -1.42 -0.17 0.00 -0.55 0.00 0.00 41.25 39.09 2hmx s ASN 48 CO 0.12 0.29 1.32 1.55 -2.79 0.00 0.00 177.10 177.59 2hmx h PRO 49 N 4.34 0.19 -0.11 0.43 0.13 -1.92 -2.46 132.00 132.61 2hmx h PRO 49 Ca -0.49 -0.10 0.03 0.00 -0.87 0.00 0.00 66.00 64.57 2hmx h PRO 49 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2hmx h PRO 49 CO 0.58 0.61 0.08 0.78 -0.23 0.00 0.00 178.00 179.82 2hmx h GLY 50 N -0.22 0.00 0.99 1.56 0.00 -1.97 0.62 103.07 104.05 2hmx h GLY 50 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.34 2hmx h GLY 50 CO 0.02 0.00 -0.01 -2.00 0.00 0.00 0.00 176.54 174.55 2hmx h LEU 51 N 0.00 -0.02 0.00 3.11 6.46 -1.89 0.47 115.31 123.44 2hmx h LEU 51 Ca 0.05 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.80 2hmx h LEU 51 Cb 0.21 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.14 2hmx h LEU 51 CO -0.00 -0.00 -0.21 -0.11 -0.62 0.00 0.00 178.44 177.50 2hmx n LEU 52 N -5.09 0.24 -0.05 2.25 -0.00 -0.22 -2.58 117.00 111.55 2hmx n LEU 52 Ca -0.07 0.30 -0.07 0.00 -0.00 0.00 0.00 56.01 56.17 2hmx n LEU 52 Cb 0.04 -0.39 0.11 0.00 -0.00 0.00 0.00 43.42 43.18 2hmx n LEU 52 CO 0.33 0.04 0.68 -0.08 -0.00 0.00 0.00 177.39 178.36 2hmx h GLU 53 N 0.00 0.67 -7.45 1.96 4.81 0.24 -3.36 114.58 111.46 2hmx h GLU 53 Ca 0.00 -0.29 -0.49 0.00 -0.13 0.00 0.00 59.36 58.45 2hmx h GLU 53 Cb 0.51 -0.02 0.09 0.00 0.63 0.00 0.00 28.75 29.97 2hmx h GLU 53 CO 0.00 0.88 0.38 0.95 -0.73 0.00 0.00 179.01 180.49 2hmx s THR 54 N -4.49 3.27 0.14 0.32 -4.23 -0.82 -4.91 115.64 104.93 2hmx s THR 54 Ca -0.08 0.41 -0.17 0.00 -1.18 0.00 0.00 61.69 60.66 2hmx s THR 54 Cb 0.13 -3.29 -0.01 0.00 1.34 0.00 0.00 72.50 70.68 2hmx s THR 54 CO 0.83 -0.54 1.75 0.28 -0.54 0.00 0.00 174.62 176.40 2hmx h SER 55 N -0.86 0.13 -0.33 3.99 0.02 -1.84 -2.04 113.55 112.62 2hmx h SER 55 Ca -0.46 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.50 2hmx h SER 55 Cb 1.26 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.80 2hmx h SER 55 CO 0.62 0.11 0.14 -0.33 -1.14 0.00 0.00 176.83 176.23 2hmx h GLU 56 N 0.25 0.48 0.00 3.45 5.08 -1.91 0.71 114.58 122.64 2hmx h GLU 56 Ca 0.13 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2hmx h GLU 56 Cb 0.10 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 2hmx h GLU 56 CO -0.13 0.47 -0.05 0.78 -1.00 0.00 0.00 179.01 179.08 2hmx h GLY 57 N 0.38 0.00 2.00 -3.84 0.00 -1.58 0.59 103.07 100.61 2hmx h GLY 57 Ca 0.11 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.40 2hmx h GLY 57 CO -0.01 0.00 -0.21 0.00 0.00 0.00 0.00 176.54 176.32 2hmx h ARG 59 N 0.00 0.09 0.00 0.00 1.12 0.46 0.57 114.38 116.63 2hmx h ARG 59 Ca -0.00 -0.16 -0.03 0.00 -1.11 0.00 0.00 59.98 58.68 2hmx h ARG 59 Cb 0.75 0.06 -0.00 0.00 -0.01 0.00 0.00 29.97 30.77 2hmx h ARG 59 CO 0.03 0.88 -0.15 0.37 -3.11 0.00 0.00 179.97 178.00 2hmx h GLN 60 N 0.03 0.00 0.00 0.20 -0.00 0.12 -1.85 115.11 113.61 2hmx h GLN 60 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.46 2hmx h GLN 60 Cb 1.94 0.00 0.00 0.00 0.00 0.00 0.00 27.48 29.42 2hmx h GLN 60 CO 0.12 0.15 -0.20 0.82 0.00 0.00 0.00 178.83 179.72 2hmx h ILE 61 N 0.00 0.00 0.00 2.39 1.08 -0.51 -2.41 117.51 118.06 2hmx h ILE 61 Ca -0.00 -0.85 0.00 0.00 -0.39 0.00 0.00 64.86 63.62 2hmx h ILE 61 Cb 0.35 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.10 2hmx h ILE 61 CO 0.02 0.00 0.00 0.25 -0.69 0.00 0.00 178.15 177.73 2hmx h LEU 62 N -0.85 0.00 0.00 1.44 5.85 0.10 0.98 115.31 122.83 2hmx h LEU 62 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2hmx h LEU 62 Cb 0.20 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.23 2hmx h LEU 62 CO 0.00 0.00 -0.20 1.23 -0.34 0.00 0.00 178.44 179.13 2hmx h GLY 63 N 0.30 0.00 2.00 3.75 0.00 -1.45 -2.51 103.07 105.16 2hmx h GLY 63 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2hmx h GLY 63 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.54 174.93 2hmx h GLN 64 N -1.00 0.00 0.00 4.80 4.15 0.12 -3.21 115.11 119.96 2hmx h GLN 64 Ca -0.03 0.00 -0.30 0.00 0.77 0.00 0.00 58.65 59.09 2hmx h GLN 64 Cb 0.51 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.15 2hmx h GLN 64 CO -0.02 0.00 -2.12 -0.11 -1.93 0.00 0.00 178.83 174.65 2hmx n LEU 65 N -2.36 0.23 0.19 -2.39 7.94 0.21 -3.01 117.00 117.81 2hmx n LEU 65 Ca -0.00 -0.01 -0.15 0.00 -1.11 0.00 0.00 56.01 54.74 2hmx n LEU 65 Cb 0.12 0.31 -0.08 0.00 0.53 0.00 0.00 43.42 44.30 2hmx n LEU 65 CO 0.15 0.43 0.77 -0.61 -1.11 0.00 0.00 177.39 177.02 2hmx h GLN 66 N 0.00 -0.40 -0.36 1.96 -0.00 -1.45 0.91 115.11 115.78 2hmx h GLN 66 Ca -0.44 0.03 0.08 0.00 -0.00 0.00 0.00 58.65 58.31 2hmx h GLN 66 Cb 1.98 0.09 -0.08 0.00 0.00 0.00 0.00 27.48 29.46 2hmx h GLN 66 CO 0.02 -0.27 -0.26 -1.35 0.00 0.00 0.00 178.83 176.97 2hmx h PRO 67 N -0.42 -0.20 0.00 -2.39 0.11 -1.77 -2.27 132.00 125.06 2hmx h PRO 67 Ca -0.04 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 2hmx h PRO 67 Cb 0.32 0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.48 2hmx h PRO 67 CO 0.07 -0.14 -0.03 0.77 -0.21 0.00 0.00 178.00 178.47 2hmx h SER 68 N -0.21 0.00 -0.24 -2.05 0.02 0.02 -1.83 113.55 109.26 2hmx h SER 68 Ca 0.17 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.09 2hmx h SER 68 Cb 0.48 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 2hmx h SER 68 CO -0.48 0.03 0.05 -0.07 -1.14 0.00 0.00 176.83 175.22 2hmx h LEU 69 N 0.00 0.44 -0.68 5.07 3.38 0.12 0.82 115.31 124.46 2hmx h LEU 69 Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2hmx h LEU 69 Cb 0.24 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2hmx h LEU 69 CO 0.00 0.47 0.00 0.00 0.09 0.00 0.00 178.44 179.01 2hmx n GLN 70 N -4.33 0.07 -0.86 1.13 10.64 -0.69 -2.13 117.38 121.21 2hmx n GLN 70 Ca 0.01 0.57 -0.04 0.00 -1.83 0.00 0.00 57.00 55.71 2hmx n GLN 70 Cb 0.20 -1.72 -0.04 0.00 -0.86 0.00 0.00 30.24 27.82 2hmx n GLN 70 CO 0.00 0.00 0.00 -2.37 -1.83 0.00 0.00 177.06 172.86 2hmx n THR 71 N -1.86 0.00 0.00 -0.39 5.66 -0.73 -4.91 114.28 112.05 2hmx n THR 71 Ca -0.01 -0.08 0.00 0.00 -3.05 0.00 0.00 64.05 60.92 2hmx n THR 71 Cb 0.02 0.38 0.00 0.00 -1.55 0.00 0.00 70.33 69.18 2hmx n THR 71 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2hmx n GLY 72 N 0.04 -0.34 3.81 1.09 0.00 0.28 -5.05 105.19 105.01 2hmx n GLY 72 Ca -0.15 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.91 2hmx n GLY 72 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2hmx s SER 73 N -1.72 -0.00 0.12 1.61 1.04 -1.24 -4.83 113.70 108.68 2hmx s SER 73 Ca 0.00 -0.03 0.10 0.00 0.48 0.00 0.00 55.95 56.50 2hmx s SER 73 Cb 0.00 0.03 0.51 0.00 0.10 0.00 0.00 66.02 66.66 2hmx s SER 73 CO 0.00 -0.05 1.31 -1.84 0.98 0.00 0.00 173.24 173.64 2hmx n GLU 74 N -0.76 0.06 0.00 4.02 -0.00 -1.26 -1.43 120.64 121.27 2hmx n GLU 74 Ca -0.01 0.52 -0.11 0.00 -0.00 0.00 0.00 57.16 57.56 2hmx n GLU 74 Cb 0.61 -1.68 -0.14 0.00 -0.00 0.00 0.00 31.44 30.23 2hmx n GLU 74 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 2hmx h GLU 75 N 0.00 0.05 -0.59 3.44 4.57 -1.97 -2.12 114.58 117.97 2hmx h GLU 75 Ca 0.00 -0.09 -0.03 0.00 -1.18 0.00 0.00 59.36 58.06 2hmx h GLU 75 Cb 0.05 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 2hmx h GLU 75 CO 0.00 0.70 0.25 1.25 -1.18 0.00 0.00 179.01 180.04 2hmx h LEU 76 N 0.01 0.79 -1.40 1.64 6.46 -1.56 -2.27 115.31 118.98 2hmx h LEU 76 Ca -0.26 -0.15 -0.01 0.00 -0.12 0.00 0.00 57.88 57.33 2hmx h LEU 76 Cb 1.99 -0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 41.69 2hmx h LEU 76 CO 0.10 0.73 0.22 -0.09 -0.62 0.00 0.00 178.44 178.77 2hmx h ARG 77 N 0.80 0.62 -0.84 1.25 1.12 -1.14 0.63 114.38 116.83 2hmx h ARG 77 Ca 0.20 -0.07 0.00 0.00 -1.11 0.00 0.00 59.98 59.00 2hmx h ARG 77 Cb 0.17 -0.12 -0.04 0.00 -0.01 0.00 0.00 29.97 29.96 2hmx h ARG 77 CO -0.02 0.48 0.54 1.03 -3.11 0.00 0.00 179.97 178.90 2hmx h SER 78 N 0.63 0.98 -0.11 -3.80 0.87 -1.33 0.44 113.55 111.23 2hmx h SER 78 Ca 0.16 -0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.68 2hmx h SER 78 Cb 0.07 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.78 2hmx h SER 78 CO -0.02 0.72 0.07 -0.07 -0.53 0.00 0.00 176.83 177.00 2hmx h LEU 79 N 1.14 0.14 0.00 2.23 -0.00 -0.33 -2.32 115.31 116.17 2hmx h LEU 79 Ca 0.31 -0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 58.16 2hmx h LEU 79 Cb -0.11 -0.03 -0.00 0.00 -0.00 0.00 0.00 40.66 40.51 2hmx h LEU 79 CO -0.06 0.11 -0.60 0.22 -0.00 0.00 0.00 178.44 178.10 2hmx h TYR 80 N 0.16 0.00 -0.16 1.13 3.20 0.48 0.25 116.97 122.03 2hmx h TYR 80 Ca 0.04 0.00 -0.19 0.00 3.14 0.00 0.00 58.73 61.72 2hmx h TYR 80 Cb -0.01 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.27 2hmx h TYR 80 CO 0.00 0.11 -0.65 -2.95 -1.64 0.00 0.00 178.16 173.03 2hmx h ASN 81 N 0.00 0.85 0.92 -2.11 7.08 -0.71 -2.25 115.58 119.35 2hmx h ASN 81 Ca -0.02 -0.61 -0.13 0.00 -3.08 0.00 0.00 56.30 52.46 2hmx h ASN 81 Cb 1.09 -0.25 -0.02 0.00 -2.08 0.00 0.00 38.32 37.07 2hmx h ASN 81 CO 0.01 1.32 -0.62 0.74 -2.08 0.00 0.00 177.43 176.80 2hmx h THR 82 N 0.43 1.25 0.04 6.14 2.02 -1.13 0.55 112.91 122.21 2hmx h THR 82 Ca -0.04 -2.27 -0.06 0.00 0.77 0.00 0.00 66.41 64.81 2hmx h THR 82 Cb 1.28 2.29 0.00 0.00 -1.74 0.00 0.00 68.15 69.98 2hmx h THR 82 CO 0.14 0.61 -0.28 0.40 0.37 0.00 0.00 175.52 176.75 2hmx h ILE 83 N 0.00 1.68 -0.72 3.11 1.08 -0.60 0.58 117.51 122.64 2hmx h ILE 83 Ca -0.01 -2.39 -0.03 0.00 -0.39 0.00 0.00 64.86 62.04 2hmx h ILE 83 Cb 1.24 3.29 -0.03 0.00 -3.07 0.00 0.00 36.82 38.25 2hmx h ILE 83 CO 0.08 0.63 0.33 0.00 -0.69 0.00 0.00 178.15 178.50 2hmx h ALA 84 N 0.00 1.23 0.89 1.87 0.00 -1.04 0.49 119.26 122.70 2hmx h ALA 84 Ca -0.06 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 2hmx h ALA 84 Cb 1.19 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.70 2hmx h ALA 84 CO 0.03 0.58 -0.43 0.28 0.00 0.00 0.00 179.25 179.72 2hmx h VAL 85 N 1.02 0.04 0.00 0.00 2.07 0.20 0.37 116.25 119.95 2hmx h VAL 85 Ca 0.25 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.66 2hmx h VAL 85 Cb 0.12 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 29.93 2hmx h VAL 85 CO -0.03 0.00 0.00 0.25 0.02 0.00 0.00 177.57 177.81 2hmx h LEU 86 N -1.29 0.00 -0.09 2.57 5.85 0.10 0.99 115.31 123.44 2hmx h LEU 86 Ca -0.12 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 2hmx h LEU 86 Cb 0.92 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.95 2hmx h LEU 86 CO 0.20 0.00 -0.26 0.22 -0.34 0.00 0.00 178.44 178.26 2hmx h TYR 87 N 0.00 0.43 -0.32 1.25 5.03 0.12 0.54 116.97 124.03 2hmx h TYR 87 Ca 0.00 -0.17 0.08 0.00 2.58 0.00 0.00 58.73 61.22 2hmx h TYR 87 Cb 0.07 -0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.26 2hmx h TYR 87 CO 0.00 0.87 0.22 0.00 -1.32 0.00 0.00 178.16 177.94 2hmx h VAL 89 N 0.08 0.97 -0.28 0.00 2.07 0.53 0.30 116.25 119.91 2hmx h VAL 89 Ca 0.15 -2.30 -0.04 0.00 0.82 0.00 0.00 66.70 65.33 2hmx h VAL 89 Cb 0.49 2.54 -0.02 0.00 -1.52 0.00 0.00 31.29 32.78 2hmx h VAL 89 CO -0.01 0.59 0.01 0.45 0.02 0.00 0.00 177.57 178.63 2hmx h HIS 90 N -0.54 0.42 0.65 1.57 3.86 0.35 -1.03 115.15 120.44 2hmx h HIS 90 Ca -0.32 -0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 58.83 2hmx h HIS 90 Cb 1.59 -0.13 0.01 0.00 1.06 0.00 0.00 27.41 29.94 2hmx h HIS 90 CO 0.12 0.41 -0.31 0.37 0.86 0.00 0.00 177.93 179.38 2hmx h GLN 91 N 0.40 -0.84 0.00 2.45 -0.00 -0.99 -3.44 115.11 112.69 2hmx h GLN 91 Ca 0.09 0.06 0.00 0.00 -0.00 0.00 0.00 58.65 58.80 2hmx h GLN 91 Cb 0.24 0.19 0.00 0.00 0.00 0.00 0.00 27.48 27.92 2hmx h GLN 91 CO 0.00 -0.56 0.00 -2.13 0.00 0.00 0.00 178.83 176.14 2hmx n ARG 92 N -4.48 0.00 -1.52 1.69 0.63 -0.39 -5.11 116.66 107.48 2hmx n ARG 92 Ca -0.11 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.47 2hmx n ARG 92 Cb 0.34 0.00 0.09 0.00 0.45 0.00 0.00 32.46 33.34 2hmx n ARG 92 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 2hmx s ILE 93 N 0.00 2.22 0.12 5.15 1.09 0.10 -4.93 121.20 124.95 2hmx s ILE 93 Ca 0.00 0.11 0.06 0.00 -1.10 0.00 0.00 60.65 59.72 2hmx s ILE 93 Cb 0.00 -2.80 -0.04 0.00 -1.06 0.00 0.00 42.46 38.57 2hmx s ILE 93 CO 0.00 -0.05 -0.15 1.51 -0.10 0.00 0.00 174.94 176.16 2hmx s ASP 94 N -1.83 2.02 0.30 3.58 1.47 -1.26 -3.39 116.67 117.56 2hmx s ASP 94 Ca 0.77 -0.79 0.03 0.00 1.18 0.00 0.00 52.55 53.73 2hmx s ASP 94 Cb -0.32 -0.07 -0.05 0.00 -0.34 0.00 0.00 42.92 42.14 2hmx s ASP 94 CO 0.43 -0.12 0.09 0.68 0.68 0.00 0.00 175.17 176.93 2hmx s VAL 95 N -2.01 0.75 0.00 2.11 -7.23 -1.26 -5.01 120.40 107.75 2hmx s VAL 95 Ca 0.08 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.25 2hmx s VAL 95 Cb -0.06 -2.65 0.00 0.00 0.56 0.00 0.00 36.38 34.23 2hmx s VAL 95 CO 0.03 0.00 0.00 1.17 -0.31 0.00 0.00 175.10 175.99 2hmx n LYS 96 N -0.59 0.94 -4.50 4.82 4.81 -1.26 -4.77 118.16 117.61 2hmx n LYS 96 Ca -0.01 0.00 -0.25 0.00 -0.87 0.00 0.00 58.31 57.18 2hmx n LYS 96 Cb 0.66 -0.48 -0.10 0.00 0.02 0.00 0.00 35.03 35.13 2hmx n LYS 96 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2hmx s ASP 97 N -0.84 3.64 0.00 3.14 2.15 -1.26 0.61 116.67 124.11 2hmx s ASP 97 Ca 0.00 -1.10 0.00 0.00 0.43 0.00 0.00 52.55 51.88 2hmx s ASP 97 Cb 0.00 -0.32 0.00 0.00 -0.30 0.00 0.00 42.92 42.30 2hmx s ASP 97 CO 0.00 -0.06 0.62 0.41 -0.17 0.00 0.00 175.17 175.96 2hmx n THR 98 N -0.69 0.00 0.06 1.71 -1.04 -0.89 -1.29 114.28 112.13 2hmx n THR 98 Ca -0.05 1.12 0.01 0.00 -2.04 0.00 0.00 64.05 63.09 2hmx n THR 98 Cb 0.61 -2.03 0.06 0.00 -1.82 0.00 0.00 70.33 67.15 2hmx n THR 98 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 2hmx n LYS 99 N -0.95 0.01 0.05 -2.82 0.00 -1.26 0.10 118.16 113.28 2hmx n LYS 99 Ca 0.00 0.48 -0.21 0.00 -0.00 0.00 0.00 58.31 58.58 2hmx n LYS 99 Cb 0.00 -1.52 -0.14 0.00 -0.00 0.00 0.00 35.03 33.36 2hmx n LYS 99 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 2hmx h GLU 100 N 0.00 0.30 0.82 -1.58 4.57 -1.94 0.35 114.58 117.11 2hmx h GLU 100 Ca 0.00 -0.52 -0.04 0.00 -1.18 0.00 0.00 59.36 57.62 2hmx h GLU 100 Cb 0.03 0.19 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 2hmx h GLU 100 CO 0.00 1.25 -0.43 0.00 -1.18 0.00 0.00 179.01 178.65 2hmx h ALA 101 N 0.05 -1.16 0.00 2.92 0.00 0.20 -2.49 119.26 118.79 2hmx h ALA 101 Ca -0.20 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2hmx h ALA 101 Cb 1.72 0.48 0.00 0.00 0.00 0.00 0.00 17.79 19.99 2hmx h ALA 101 CO 0.13 -1.16 0.00 1.25 0.00 0.00 0.00 179.25 179.48 2hmx h LEU 102 N -1.15 0.00 0.20 0.00 5.85 0.27 1.01 115.31 121.49 2hmx h LEU 102 Ca -0.11 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 2hmx h LEU 102 Cb 0.89 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.92 2hmx h LEU 102 CO 0.16 0.00 -0.09 -0.78 -0.34 0.00 0.00 178.44 177.39 2hmx h ASP 103 N 0.00 -0.22 0.00 1.25 3.58 -0.19 0.57 116.42 121.40 2hmx h ASP 103 Ca 0.00 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2hmx h ASP 103 Cb 0.06 0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.17 2hmx h ASP 103 CO 0.00 0.04 0.15 1.17 -2.88 0.00 0.00 179.24 177.72 2hmx n LYS 104 N -3.83 0.09 -0.08 0.28 0.00 0.29 0.98 118.16 115.88 2hmx n LYS 104 Ca -0.03 0.55 -0.22 0.00 0.00 0.00 0.00 58.31 58.61 2hmx n LYS 104 Cb 0.10 -1.94 -0.12 0.00 0.00 0.00 0.00 35.03 33.07 2hmx n LYS 104 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 2hmx h ILE 105 N 0.00 0.88 0.00 3.15 1.08 0.24 -0.01 117.51 122.85 2hmx h ILE 105 Ca 0.00 -2.21 -0.03 0.00 -0.39 0.00 0.00 64.86 62.22 2hmx h ILE 105 Cb 0.31 2.29 -0.00 0.00 -3.07 0.00 0.00 36.82 36.35 2hmx h ILE 105 CO 0.00 0.42 -0.15 -0.08 -0.69 0.00 0.00 178.15 177.65 2hmx h GLU 106 N -0.80 0.00 0.00 2.37 4.81 0.62 0.80 114.58 122.37 2hmx h GLU 106 Ca -0.36 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 58.72 2hmx h GLU 106 Cb 1.44 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.79 2hmx h GLU 106 CO -0.15 0.15 -1.79 -1.91 -0.73 0.00 0.00 179.01 174.58 2hmx n GLU 107 N -3.78 1.44 0.00 1.92 2.13 0.20 -3.63 120.64 118.91 2hmx n GLU 107 Ca -0.02 -0.04 0.00 0.00 0.66 0.00 0.00 57.16 57.76 2hmx n GLU 107 Cb 0.26 -1.33 0.00 0.00 0.27 0.00 0.00 31.44 30.64 2hmx n GLU 107 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2hmx n GLU 108 N -2.31 0.00 0.00 5.31 0.00 -0.07 -5.01 120.64 118.56 2hmx n GLU 108 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.01 2hmx n GLU 108 Cb 0.73 -0.91 0.00 0.00 0.00 0.00 0.00 31.44 31.26 2hmx n GLU 108 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 2hmx n GLN 109 N -2.42 0.12 -2.41 5.31 0.00 0.27 -4.98 117.38 113.28 2hmx n GLN 109 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.00 56.59 2hmx n GLN 109 Cb 0.44 0.00 -0.03 0.00 0.00 0.00 0.00 30.24 30.65 2hmx n GLN 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 2hmx s ASN 110 N -1.34 7.12 0.00 1.69 4.22 -1.19 -4.63 114.94 120.81 2hmx s ASN 110 Ca 0.00 2.19 0.00 0.00 -2.14 0.00 0.00 52.86 52.91 2hmx s ASN 110 Cb 0.00 -2.60 0.00 0.00 1.28 0.00 0.00 41.25 39.93 2hmx s ASN 110 CO 0.00 -0.35 0.00 1.17 -2.04 0.00 0.00 177.10 175.88 2hmx n LYS 111 N 2.59 0.00 -0.27 3.55 4.81 -1.24 -4.37 118.16 123.23 2hmx n LYS 111 Ca 0.04 0.00 0.04 0.00 -0.87 0.00 0.00 58.31 57.52 2hmx n LYS 111 Cb 0.45 -0.13 -0.01 0.00 0.02 0.00 0.00 35.03 35.36 2hmx n LYS 111 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2hmx n SER 112 N -1.75 -6.11 -4.90 3.14 7.64 -1.26 -4.78 113.62 105.59 2hmx n SER 112 Ca 0.00 0.29 -0.28 0.00 1.01 0.00 0.00 58.87 59.89 2hmx n SER 112 Cb 0.00 -0.81 -0.01 0.00 -1.01 0.00 0.00 64.21 62.38 2hmx n SER 112 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2hmx s LYS 113 N -0.42 3.61 -0.42 1.43 2.20 -1.26 -5.07 119.74 119.81 2hmx s LYS 113 Ca 0.00 0.22 0.02 0.00 -0.36 0.00 0.00 55.97 55.85 2hmx s LYS 113 Cb 0.00 -2.43 0.14 0.00 -1.51 0.00 0.00 37.83 34.03 2hmx s LYS 113 CO 0.00 -0.09 0.25 0.15 -0.36 0.00 0.00 175.35 175.30 2hmx s LYS 114 N -4.33 1.12 1.79 4.03 -0.14 -1.26 -5.02 119.74 115.92 2hmx s LYS 114 Ca 0.48 -1.89 0.00 0.00 -1.36 0.00 0.00 55.97 53.20 2hmx s LYS 114 Cb -0.10 -2.05 0.00 0.00 -1.68 0.00 0.00 37.83 34.00 2hmx s LYS 114 CO 0.39 -1.19 0.00 1.63 -0.76 0.00 0.00 175.35 175.42 2hmx n LYS 115 N 3.57 -0.22 -0.02 1.68 5.02 -1.26 -4.81 118.16 122.12 2hmx n LYS 115 Ca 0.11 0.15 -0.03 0.00 -2.02 0.00 0.00 58.31 56.52 2hmx n LYS 115 Cb 0.36 -0.27 -0.01 0.00 -0.02 0.00 0.00 35.03 35.09 2hmx n LYS 115 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2hmx n ALA 116 N -0.18 1.48 -3.69 7.82 0.00 -1.26 -5.08 120.51 119.60 2hmx n ALA 116 Ca 0.00 -0.36 -0.11 0.00 0.00 0.00 0.00 53.44 52.98 2hmx n ALA 116 Cb 0.05 0.07 -0.11 0.00 0.00 0.00 0.00 19.45 19.46 2hmx n ALA 116 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2hmx s GLN 117 N -1.91 0.33 -0.13 0.00 -0.44 -1.26 -5.14 119.66 111.13 2hmx s GLN 117 Ca -0.10 0.79 -0.05 0.00 -2.50 0.00 0.00 55.36 53.49 2hmx s GLN 117 Cb 0.01 0.02 0.06 0.00 -1.64 0.00 0.00 33.01 31.46 2hmx s GLN 117 CO 0.15 -0.18 0.27 -0.65 0.50 0.00 0.00 175.29 175.38 2hmx s GLN 118 N 1.66 0.19 -0.18 1.67 -1.52 -1.26 -5.03 119.66 115.19 2hmx s GLN 118 Ca -0.07 0.68 0.10 0.00 -1.95 0.00 0.00 55.36 54.12 2hmx s GLN 118 Cb -0.10 -0.05 0.27 0.00 -0.22 0.00 0.00 33.01 32.91 2hmx s GLN 118 CO -0.12 -0.23 1.27 0.00 -0.25 0.00 0.00 175.29 175.97 2hmx n ALA 119 N 4.85 3.16 -3.71 6.09 0.00 -1.26 -5.07 120.51 124.57 2hmx n ALA 119 Ca -0.15 -1.14 -0.20 0.00 0.00 0.00 0.00 53.44 51.95 2hmx n ALA 119 Cb 0.51 -0.63 -0.17 0.00 0.00 0.00 0.00 19.45 19.16 2hmx n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hmx s ALA 120 N -0.28 0.50 0.00 0.00 0.00 -1.26 -5.05 121.76 115.66 2hmx s ALA 120 Ca 0.09 0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.08 2hmx s ALA 120 Cb 0.26 -0.53 0.00 0.00 0.00 0.00 0.00 23.12 22.85 2hmx s ALA 120 CO -0.08 -0.26 0.00 0.00 0.00 0.00 0.00 175.76 175.42 2hmx n ALA 121 N 4.65 0.00 -1.47 0.00 0.00 -1.26 -5.10 120.51 117.34 2hmx n ALA 121 Ca -0.16 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2hmx n ALA 121 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 2hmx n ALA 121 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2hmx n ASP 122 N -1.44 -6.06 0.00 0.00 8.00 -1.26 -5.04 116.55 110.74 2hmx n ASP 122 Ca 0.00 0.84 0.00 0.00 0.71 0.00 0.00 54.79 56.34 2hmx n ASP 122 Cb 0.00 -3.35 0.00 0.00 -0.02 0.00 0.00 41.12 37.75 2hmx n ASP 122 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2hmx n THR 123 N 1.09 0.00 -3.22 -3.53 5.66 -1.26 -4.99 114.28 108.03 2hmx n THR 123 Ca 0.00 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.85 2hmx n THR 123 Cb 0.00 -0.14 0.07 0.00 -1.55 0.00 0.00 70.33 68.71 2hmx n THR 123 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2hmx n GLY 124 N 3.07 -0.98 3.71 1.09 0.00 -1.26 -4.95 105.19 105.86 2hmx n GLY 124 Ca 0.00 0.48 -0.30 0.00 0.00 0.00 0.00 46.02 46.21 2hmx n GLY 124 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2hmx s ASN 125 N -3.52 3.41 -0.38 1.61 2.47 -1.26 -5.01 114.94 112.26 2hmx s ASN 125 Ca 0.37 1.57 0.11 0.00 0.42 0.00 0.00 52.86 55.33 2hmx s ASN 125 Cb -0.05 -2.24 0.40 0.00 -1.45 0.00 0.00 41.25 37.91 2hmx s ASN 125 CO 0.71 -2.69 1.32 -0.46 -3.72 0.00 0.00 177.10 172.27 2hmx n ASN 126 N -3.92 -1.41 -0.41 -4.21 6.94 -1.26 -4.93 115.26 106.06 2hmx n ASN 126 Ca 0.07 -2.46 0.06 0.00 -0.02 0.00 0.00 54.58 52.23 2hmx n ASN 126 Cb 0.55 0.78 0.12 0.00 -2.36 0.00 0.00 39.78 38.86 2hmx n ASN 126 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2hmx n SER 127 N -0.62 1.60 -2.74 0.53 7.64 -1.26 -4.81 113.62 113.96 2hmx n SER 127 Ca -0.03 -2.94 -0.06 0.00 1.01 0.00 0.00 58.87 56.84 2hmx n SER 127 Cb 0.85 -0.39 0.04 0.00 -1.01 0.00 0.00 64.21 63.70 2hmx n SER 127 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hmx n GLN 128 N -0.89 0.61 -1.05 1.43 0.00 -1.26 -4.89 117.38 111.33 2hmx n GLN 128 Ca 0.12 -1.64 -0.11 0.00 0.00 0.00 0.00 57.00 55.38 2hmx n GLN 128 Cb 0.71 -1.25 0.26 0.00 0.00 0.00 0.00 30.24 29.96 2hmx n GLN 128 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 2hmx n VAL 129 N 1.98 2.97 0.00 -0.39 0.31 -1.26 -4.62 118.33 117.33 2hmx n VAL 129 Ca 0.10 -1.83 0.00 0.00 -0.01 0.00 0.00 64.34 62.60 2hmx n VAL 129 Cb 0.62 -0.39 0.00 0.00 -0.91 0.00 0.00 33.84 33.17 2hmx n VAL 129 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2hmx n SER 130 N -0.55 0.00 -1.26 4.52 3.41 -1.26 -5.16 113.62 113.32 2hmx n SER 130 Ca 0.45 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 59.10 2hmx n SER 130 Cb 1.43 0.04 -0.02 0.00 -0.26 0.00 0.00 64.21 65.40 2hmx n SER 130 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2hmx n GLN 131 N -1.15 -3.21 0.00 4.33 7.27 -1.26 -5.01 117.38 118.34 2hmx n GLN 131 Ca 0.00 2.52 0.00 0.00 0.07 0.00 0.00 57.00 59.59 2hmx n GLN 131 Cb 0.00 -3.25 0.00 0.00 2.41 0.00 0.00 30.24 29.40 2hmx n GLN 131 CO 0.00 0.00 0.00 -1.71 0.07 0.00 0.00 177.06 175.42 2hmx n ASN 132 N -2.76 0.00 0.00 1.69 2.85 -1.26 -5.15 115.26 110.62 2hmx n ASN 132 Ca -0.02 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.45 2hmx n ASN 132 Cb 0.43 -0.18 0.00 0.00 1.24 0.00 0.00 39.78 41.28 2hmx n ASN 132 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15