#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hmx n MET 2 N 0.00 -1.80 0.00 -1.40 -0.00 -1.26 -4.92 117.12 107.74 2hmx n MET 2 Ca 0.00 0.93 0.00 0.00 -0.00 0.00 0.00 57.70 58.63 2hmx n MET 2 Cb 0.00 -5.57 0.00 0.00 -0.00 0.00 0.00 33.22 27.65 2hmx n MET 2 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2hmx n GLY 3 N -0.95 0.34 0.00 3.17 0.00 -1.26 -5.11 105.19 101.38 2hmx n GLY 3 Ca -0.22 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.00 0.00 0.00 4.61 0.00 -1.26 -5.04 120.51 115.82 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 -0.54 0.00 0.00 0.00 1.74 -1.26 -4.81 116.66 111.80 2hmx n ARG 5 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2hmx n ARG 5 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2hmx n ARG 5 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2hmx n ALA 6 N 0.00 0.00 -1.00 7.54 0.00 -1.26 -4.16 120.51 121.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 1.52 0.00 -0.08 0.00 2.88 -1.26 -5.02 113.62 111.66 2hmx n SER 7 Ca 0.00 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.46 2hmx n SER 7 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 2hmx n SER 7 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2hmx n VAL 8 N -0.09 1.47 -2.25 2.46 0.31 -1.26 -4.92 118.33 114.05 2hmx n VAL 8 Ca 0.00 0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.49 2hmx n VAL 8 Cb 0.00 -2.27 0.00 0.00 -0.91 0.00 0.00 33.84 30.66 2hmx n VAL 8 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2hmx n LEU 9 N -4.36 0.00 0.00 7.52 4.77 -1.26 -4.83 117.00 118.84 2hmx n LEU 9 Ca -0.13 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.81 2hmx n LEU 9 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2hmx n LEU 9 CO 0.19 -0.44 0.01 -1.54 -1.33 0.00 0.00 177.39 174.28 2hmx n SER 10 N -2.66 1.26 0.00 -1.43 3.41 -1.26 -4.59 113.62 108.35 2hmx n SER 10 Ca 0.00 -1.32 0.00 0.00 -0.26 0.00 0.00 58.87 57.29 2hmx n SER 10 Cb 0.00 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 2hmx n SER 10 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2hmx n GLY 11 N 3.85 -2.83 0.30 5.00 0.00 -1.26 -1.57 105.19 108.69 2hmx n GLY 11 Ca -0.00 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.18 2hmx n GLY 11 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2hmx h GLY 12 N 0.00 0.00 1.41 -0.02 0.00 -1.98 -0.61 103.07 101.87 2hmx h GLY 12 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 2hmx h GLY 12 CO 0.00 0.00 -0.37 0.83 0.00 0.00 0.00 176.54 177.00 2hmx h GLU 13 N 0.00 0.65 0.85 4.80 5.08 -1.95 -1.19 114.58 122.83 2hmx h GLU 13 Ca -0.00 -0.32 -0.04 0.00 -1.00 0.00 0.00 59.36 57.99 2hmx h GLU 13 Cb 0.08 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.34 2hmx h GLU 13 CO 0.00 0.92 -0.41 1.25 -1.00 0.00 0.00 179.01 179.78 2hmx h LEU 14 N 0.54 -0.97 0.00 1.33 7.12 -0.08 0.17 115.31 123.43 2hmx h LEU 14 Ca 0.05 0.03 0.00 0.00 0.13 0.00 0.00 57.88 58.09 2hmx h LEU 14 Cb 0.89 0.25 0.00 0.00 -0.53 0.00 0.00 40.66 41.27 2hmx h LEU 14 CO 0.08 -0.67 0.00 0.47 -0.13 0.00 0.00 178.44 178.19 2hmx n ASP 15 N -5.57 0.00 -0.02 1.25 8.00 -0.93 0.97 116.55 120.25 2hmx n ASP 15 Ca -0.15 0.49 0.05 0.00 0.71 0.00 0.00 54.79 55.89 2hmx n ASP 15 Cb 0.46 -0.49 -0.13 0.00 -0.02 0.00 0.00 41.12 40.93 2hmx n ASP 15 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2hmx n LYS 16 N -1.49 0.70 0.03 -1.24 0.00 -0.49 -3.97 118.16 111.70 2hmx n LYS 16 Ca 0.00 -0.13 0.12 0.00 0.00 0.00 0.00 58.31 58.30 2hmx n LYS 16 Cb 0.01 -1.42 0.50 0.00 0.00 0.00 0.00 35.03 34.13 2hmx n LYS 16 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.40 179.27 2hmx n TRP 17 N -2.21 0.22 0.27 5.64 -0.00 0.27 -3.97 117.44 117.65 2hmx n TRP 17 Ca -0.08 0.07 0.11 0.00 -0.00 0.00 0.00 57.50 57.60 2hmx n TRP 17 Cb 0.57 -0.61 0.74 0.00 -0.00 0.00 0.00 31.31 32.01 2hmx n TRP 17 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 177.69 179.18 2hmx h GLU 18 N 0.00 0.00 -0.17 5.87 4.81 -1.31 -3.14 114.58 120.65 2hmx h GLU 18 Ca 0.00 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 58.98 2hmx h GLU 18 Cb 0.47 0.00 -0.17 0.00 0.63 0.00 0.00 28.75 29.68 2hmx h GLU 18 CO 0.00 0.06 -0.52 1.63 -0.73 0.00 0.00 179.01 179.45 2hmx n LYS 19 N -4.03 0.91 -2.45 1.92 4.01 -0.94 -4.47 118.16 113.10 2hmx n LYS 19 Ca -0.03 -1.96 -0.42 0.00 -0.51 0.00 0.00 58.31 55.39 2hmx n LYS 19 Cb 0.15 -1.25 -0.03 0.00 -0.51 0.00 0.00 35.03 33.40 2hmx n LYS 19 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2hmx s ILE 20 N 0.27 3.86 0.25 -0.18 1.01 -0.82 -4.75 121.20 120.84 2hmx s ILE 20 Ca 0.27 0.75 -0.31 0.00 0.00 0.00 0.00 60.65 61.36 2hmx s ILE 20 Cb 0.26 -4.53 -0.11 0.00 0.01 0.00 0.00 42.46 38.09 2hmx s ILE 20 CO -0.13 -1.22 1.61 -0.13 0.00 0.00 0.00 174.94 175.06 2hmx s ARG 21 N 5.32 4.15 0.19 2.79 0.52 0.20 0.59 118.95 132.70 2hmx s ARG 21 Ca 0.49 2.53 -0.12 0.00 -0.52 0.00 0.00 55.73 58.12 2hmx s ARG 21 Cb -0.10 -3.06 0.10 0.00 0.52 0.00 0.00 34.95 32.41 2hmx s ARG 21 CO 0.25 -0.64 1.80 -0.07 0.02 0.00 0.00 175.30 176.66 2hmx h LEU 22 N 5.62 0.81 -6.00 2.53 3.38 -1.69 -1.56 115.31 118.39 2hmx h LEU 22 Ca -0.45 -0.10 0.25 0.00 0.09 0.00 0.00 57.88 57.67 2hmx h LEU 22 Cb 1.21 -0.21 -0.20 0.00 0.09 0.00 0.00 40.66 41.56 2hmx h LEU 22 CO 0.85 0.68 0.10 0.00 0.09 0.00 0.00 178.44 180.16 2hmx s ARG 23 N -5.83 0.11 -0.71 1.13 1.70 -1.26 -4.42 118.95 109.67 2hmx s ARG 23 Ca -0.13 0.14 -0.16 0.00 -0.47 0.00 0.00 55.73 55.11 2hmx s ARG 23 Cb 0.14 0.07 -0.17 0.00 -0.57 0.00 0.00 34.95 34.42 2hmx s ARG 23 CO 0.78 -0.16 1.88 -2.30 -1.08 0.00 0.00 175.30 174.41 2hmx n PRO 24 N 5.25 0.15 0.00 3.89 -0.02 -1.26 0.59 135.00 143.59 2hmx n PRO 24 Ca 0.02 -0.77 0.00 0.00 -2.02 0.00 0.00 63.50 60.74 2hmx n PRO 24 Cb 0.56 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 2hmx n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2hmx n GLY 25 N 5.72 1.89 0.00 -1.23 0.00 -1.26 -5.08 105.19 105.23 2hmx n GLY 25 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.37 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 -0.30 -0.05 2.07 -0.02 0.00 0.20 -5.09 105.19 102.00 2hmx n GLY 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2hmx n GLY 26 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2hmx n LYS 27 N 0.00 0.00 -1.11 1.61 5.02 -1.26 -5.09 118.16 117.33 2hmx n LYS 27 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2hmx n LYS 27 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2hmx n LYS 27 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2hmx n LYS 28 N -3.49 0.00 -4.32 1.97 5.02 -1.26 -5.11 118.16 110.97 2hmx n LYS 28 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.12 2hmx n LYS 28 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 34.91 2hmx n LYS 28 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2hmx s GLN 29 N -1.58 1.28 0.19 1.97 -0.21 -1.26 -1.96 119.66 118.09 2hmx s GLN 29 Ca 0.00 -1.63 -0.32 0.00 0.02 0.00 0.00 55.36 53.43 2hmx s GLN 29 Cb 0.00 -0.64 -0.11 0.00 1.00 0.00 0.00 33.01 33.25 2hmx s GLN 29 CO 0.00 -0.05 1.70 0.71 -2.12 0.00 0.00 175.29 175.53 2hmx s TYR 30 N -3.38 2.84 0.45 0.91 1.51 0.20 -4.76 117.35 115.11 2hmx s TYR 30 Ca 0.26 0.36 0.02 0.00 -1.01 0.00 0.00 57.07 56.69 2hmx s TYR 30 Cb 0.05 -4.10 0.02 0.00 -0.11 0.00 0.00 41.96 37.82 2hmx s TYR 30 CO 0.07 -4.19 0.16 1.17 -1.11 0.00 0.00 175.55 171.65 2hmx n LYS 31 N 4.22 0.89 -0.00 -0.62 4.81 -1.26 -1.94 118.16 124.25 2hmx n LYS 31 Ca 0.16 -3.03 0.07 0.00 -0.87 0.00 0.00 58.31 54.64 2hmx n LYS 31 Cb 0.36 0.59 -0.09 0.00 0.02 0.00 0.00 35.03 35.91 2hmx n LYS 31 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2hmx n LEU 32 N 0.00 0.28 0.00 3.14 7.94 -1.26 0.45 117.00 127.54 2hmx n LEU 32 Ca -0.10 -0.22 0.03 0.00 -1.11 0.00 0.00 56.01 54.60 2hmx n LEU 32 Cb 0.54 0.00 0.11 0.00 0.53 0.00 0.00 43.42 44.60 2hmx n LEU 32 CO 0.30 0.07 0.58 1.17 -1.11 0.00 0.00 177.39 178.40 2hmx n LYS 33 N -1.68 0.01 -0.00 1.96 4.81 -1.26 -2.15 118.16 119.84 2hmx n LYS 33 Ca -0.00 0.40 0.01 0.00 -0.87 0.00 0.00 58.31 57.84 2hmx n LYS 33 Cb 0.29 -1.50 -0.01 0.00 0.02 0.00 0.00 35.03 33.83 2hmx n LYS 33 CO 0.00 0.00 0.00 1.58 1.17 0.00 0.00 177.40 180.15 2hmx n HIS 34 N -1.49 0.00 0.08 5.64 -0.00 -0.83 -1.58 115.22 117.04 2hmx n HIS 34 Ca 0.01 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 58.06 2hmx n HIS 34 Cb 0.06 -0.03 -0.08 0.00 -0.12 0.00 0.00 29.99 29.82 2hmx n HIS 34 CO 0.00 0.00 0.00 0.97 0.46 0.00 0.00 176.34 177.77 2hmx h ILE 35 N 0.00 0.97 0.00 3.57 2.10 -0.07 -1.12 117.51 122.95 2hmx h ILE 35 Ca -0.00 -0.24 -0.03 0.00 1.08 0.00 0.00 64.86 65.66 2hmx h ILE 35 Cb 0.19 1.13 -0.00 0.00 -1.09 0.00 0.00 36.82 37.04 2hmx h ILE 35 CO 0.00 0.06 -0.17 0.58 -1.08 0.00 0.00 178.15 177.54 2hmx h VAL 36 N -0.25 0.90 0.59 2.19 2.07 -1.44 0.67 116.25 120.99 2hmx h VAL 36 Ca -0.01 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 66.87 2hmx h VAL 36 Cb 0.20 1.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 2hmx h VAL 36 CO 0.02 0.16 -0.33 -0.25 0.02 0.00 0.00 177.57 177.20 2hmx h TRP 37 N 0.00 -0.85 0.28 1.57 7.01 -1.23 -1.86 115.95 120.86 2hmx h TRP 37 Ca -0.00 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 60.97 2hmx h TRP 37 Cb 0.34 0.30 0.00 0.00 -2.10 0.00 0.00 29.16 27.70 2hmx h TRP 37 CO 0.00 -0.51 -0.15 0.00 -2.79 0.00 0.00 178.44 174.99 2hmx h ALA 38 N -0.48 -1.07 -0.47 2.65 0.00 0.77 -1.69 119.26 118.97 2hmx h ALA 38 Ca -0.08 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 54.83 2hmx h ALA 38 Cb 0.68 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 2hmx h ALA 38 CO 0.10 -1.05 0.32 1.03 0.00 0.00 0.00 179.25 179.66 2hmx h SER 39 N -0.39 0.26 0.41 0.00 0.87 0.07 -0.32 113.55 114.44 2hmx h SER 39 Ca -0.04 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.51 2hmx h SER 39 Cb 0.31 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 2hmx h SER 39 CO 0.05 0.16 -0.19 0.03 -0.53 0.00 0.00 176.83 176.35 2hmx h ARG 40 N 0.29 -0.52 -0.36 2.24 3.08 -1.38 -0.88 114.38 116.85 2hmx h ARG 40 Ca 0.22 0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.29 2hmx h ARG 40 Cb 0.47 0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.62 2hmx h ARG 40 CO -0.05 -0.31 0.17 1.49 -1.07 0.00 0.00 179.97 180.21 2hmx h GLU 41 N -0.62 0.50 0.37 0.04 4.22 -0.42 -2.14 114.58 116.53 2hmx h GLU 41 Ca -0.06 -0.05 -0.02 0.00 0.08 0.00 0.00 59.36 59.31 2hmx h GLU 41 Cb 0.46 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2hmx h GLU 41 CO 0.09 0.39 -0.18 1.25 -2.18 0.00 0.00 179.01 178.39 2hmx h LEU 42 N 0.50 -0.43 -2.75 1.64 5.85 -0.47 0.30 115.31 119.96 2hmx h LEU 42 Ca 0.13 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.86 2hmx h LEU 42 Cb 0.06 0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.20 2hmx h LEU 42 CO -0.02 -0.29 0.08 -0.33 -0.34 0.00 0.00 178.44 177.55 2hmx h GLU 43 N -0.53 0.00 -0.00 1.25 5.08 -0.72 0.61 114.58 120.26 2hmx h GLU 43 Ca -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2hmx h GLU 43 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2hmx h GLU 43 CO 0.08 0.00 -0.65 -2.13 -1.00 0.00 0.00 179.01 175.32 2hmx n ARG 44 N -3.04 1.74 0.45 2.33 0.63 -0.85 -1.21 116.66 116.71 2hmx n ARG 44 Ca -0.03 -0.20 -0.18 0.00 -0.92 0.00 0.00 57.85 56.52 2hmx n ARG 44 Cb 0.15 -1.26 -0.08 0.00 0.45 0.00 0.00 32.46 31.72 2hmx n ARG 44 CO 0.00 0.00 0.00 0.74 -2.51 0.00 0.00 177.63 175.86 2hmx h PHE 45 N 0.46 -1.07 0.00 -0.14 0.04 0.19 -3.45 116.94 112.97 2hmx h PHE 45 Ca 0.00 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.74 2hmx h PHE 45 Cb 0.42 0.35 0.00 0.00 2.20 0.00 0.00 35.95 38.92 2hmx h PHE 45 CO 0.00 -0.66 0.00 0.00 -0.60 0.00 0.00 178.31 177.05 2hmx n ALA 46 N -2.60 0.40 -2.43 2.45 0.00 -0.88 -5.10 120.51 112.36 2hmx n ALA 46 Ca -0.14 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.09 2hmx n ALA 46 Cb 0.45 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.80 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 1.10 0.04 0.00 1.01 -0.35 -5.01 120.40 117.18 2hmx s VAL 47 Ca 0.00 -2.00 0.07 0.00 0.00 0.00 0.00 61.98 60.05 2hmx s VAL 47 Cb 0.00 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.59 2hmx s VAL 47 CO 0.00 -0.01 -0.19 0.21 0.00 0.00 0.00 175.10 175.10 2hmx s ASN 48 N -3.46 3.70 -0.01 3.32 3.84 -1.26 -4.43 114.94 116.65 2hmx s ASN 48 Ca 0.36 -0.45 -0.25 0.00 0.21 0.00 0.00 52.86 52.74 2hmx s ASN 48 Cb 0.08 -0.56 -0.18 0.00 -0.55 0.00 0.00 41.25 40.04 2hmx s ASN 48 CO 0.15 0.26 1.21 1.55 -2.79 0.00 0.00 177.10 177.48 2hmx h PRO 49 N 4.60 -0.17 0.00 0.43 0.14 -1.91 -2.25 132.00 132.84 2hmx h PRO 49 Ca -0.47 0.01 -0.00 0.00 0.14 0.00 0.00 66.00 65.68 2hmx h PRO 49 Cb 1.15 0.04 -0.00 0.00 0.14 0.00 0.00 31.00 32.33 2hmx h PRO 49 CO 0.47 0.22 -0.01 0.78 0.14 0.00 0.00 178.00 179.61 2hmx h GLY 50 N -0.62 0.00 0.98 1.56 0.00 -1.97 0.61 103.07 103.62 2hmx h GLY 50 Ca -0.02 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.32 2hmx h GLY 50 CO 0.03 0.00 0.43 -2.00 0.00 0.00 0.00 176.54 175.00 2hmx h LEU 51 N 0.00 0.75 -0.26 3.11 6.46 -1.90 -0.27 115.31 123.19 2hmx h LEU 51 Ca -0.00 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 2hmx h LEU 51 Cb 0.02 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 39.76 2hmx h LEU 51 CO 0.00 0.54 -0.41 -0.11 -0.62 0.00 0.00 178.44 177.84 2hmx n LEU 52 N -4.64 0.82 0.09 2.25 -0.00 -0.38 -2.70 117.00 112.43 2hmx n LEU 52 Ca 0.06 -0.17 -0.12 0.00 -0.00 0.00 0.00 56.01 55.78 2hmx n LEU 52 Cb 0.03 -0.17 -0.07 0.00 -0.00 0.00 0.00 43.42 43.21 2hmx n LEU 52 CO 0.35 0.17 0.12 -0.08 -0.00 0.00 0.00 177.39 177.95 2hmx h GLU 53 N 0.64 0.24 -7.17 1.96 4.57 0.19 -3.37 114.58 111.64 2hmx h GLU 53 Ca 0.00 -0.31 -0.49 0.00 -1.18 0.00 0.00 59.36 57.38 2hmx h GLU 53 Cb 0.51 0.10 0.05 0.00 -0.16 0.00 0.00 28.75 29.26 2hmx h GLU 53 CO 0.00 1.08 0.38 0.95 -1.18 0.00 0.00 179.01 180.24 2hmx s THR 54 N -2.97 3.85 0.23 0.32 -4.23 -0.81 -4.85 115.64 107.19 2hmx s THR 54 Ca -0.03 0.94 -0.06 0.00 -1.18 0.00 0.00 61.69 61.36 2hmx s THR 54 Cb 0.09 -3.42 0.19 0.00 1.34 0.00 0.00 72.50 70.70 2hmx s THR 54 CO 0.85 -0.45 1.79 0.28 -0.54 0.00 0.00 174.62 176.55 2hmx h SER 55 N 0.75 0.56 0.12 3.99 0.02 -1.81 -0.74 113.55 116.45 2hmx h SER 55 Ca -0.47 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 60.52 2hmx h SER 55 Cb 1.22 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2hmx h SER 55 CO 0.58 0.32 -0.06 -0.08 -1.14 0.00 0.00 176.83 176.45 2hmx h GLU 56 N 0.69 -0.16 -0.18 3.45 4.22 -1.91 0.74 114.58 121.43 2hmx h GLU 56 Ca 0.37 0.01 -0.05 0.00 0.08 0.00 0.00 59.36 59.77 2hmx h GLU 56 Cb 0.37 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2hmx h GLU 56 CO -0.26 0.01 -0.12 0.78 -2.18 0.00 0.00 179.01 177.24 2hmx h GLY 57 N -0.31 0.30 2.00 1.92 0.00 -1.44 0.61 103.07 106.15 2hmx h GLY 57 Ca -0.02 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 2hmx h GLY 57 CO 0.03 0.17 -0.07 0.00 0.00 0.00 0.00 176.54 176.67 2hmx h ARG 59 N 0.00 0.02 0.00 0.00 1.12 0.43 0.56 114.38 116.50 2hmx h ARG 59 Ca -0.00 -0.03 -0.06 0.00 -1.11 0.00 0.00 59.98 58.79 2hmx h ARG 59 Cb 0.13 0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 30.09 2hmx h ARG 59 CO 0.01 0.56 -0.28 0.37 -3.11 0.00 0.00 179.97 177.52 2hmx h GLN 60 N 0.00 0.00 0.01 0.20 5.75 0.15 -2.27 115.11 118.95 2hmx h GLN 60 Ca -0.28 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.22 2hmx h GLN 60 Cb 2.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.55 2hmx h GLN 60 CO 0.08 0.28 -0.00 0.82 -2.65 0.00 0.00 178.83 177.36 2hmx h ILE 61 N 0.00 0.00 0.00 2.39 1.08 0.11 -1.91 117.51 119.18 2hmx h ILE 61 Ca -0.00 -0.01 0.00 0.00 -0.39 0.00 0.00 64.86 64.46 2hmx h ILE 61 Cb 0.52 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.27 2hmx h ILE 61 CO 0.04 0.00 0.01 -0.11 -0.69 0.00 0.00 178.15 177.39 2hmx n LEU 62 N -2.05 0.24 -0.10 1.44 7.94 0.20 0.10 117.00 124.77 2hmx n LEU 62 Ca -0.00 0.61 -0.12 0.00 -1.11 0.00 0.00 56.01 55.39 2hmx n LEU 62 Cb 0.00 -0.64 -0.13 0.00 0.53 0.00 0.00 43.42 43.19 2hmx n LEU 62 CO 0.00 -0.69 -1.16 0.61 -1.11 0.00 0.00 177.39 175.04 2hmx n GLY 63 N -1.41 -0.65 0.35 -3.96 0.00 -0.86 -2.15 105.19 96.50 2hmx n GLY 63 Ca -0.01 -0.24 0.18 0.00 0.00 0.00 0.00 46.02 45.95 2hmx n GLY 63 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2hmx h GLN 64 N 0.00 0.00 0.00 1.61 1.08 0.15 -3.28 115.11 114.68 2hmx h GLN 64 Ca -0.50 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 56.61 2hmx h GLN 64 Cb 1.98 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 29.40 2hmx h GLN 64 CO -0.02 0.00 -1.36 -0.11 -0.95 0.00 0.00 178.83 176.40 2hmx n LEU 65 N -3.49 0.00 0.32 1.46 7.94 0.21 -3.53 117.00 119.91 2hmx n LEU 65 Ca 0.01 0.00 -0.17 0.00 -1.11 0.00 0.00 56.01 54.74 2hmx n LEU 65 Cb 0.37 0.12 -0.09 0.00 0.53 0.00 0.00 43.42 44.35 2hmx n LEU 65 CO 0.23 0.12 0.68 -0.61 -1.11 0.00 0.00 177.39 176.71 2hmx h GLN 66 N 0.00 -0.73 -0.52 1.96 -0.00 -1.49 0.91 115.11 115.24 2hmx h GLN 66 Ca -0.13 0.05 0.07 0.00 -0.00 0.00 0.00 58.65 58.63 2hmx h GLN 66 Cb 1.26 0.17 -0.06 0.00 0.00 0.00 0.00 27.48 28.84 2hmx h GLN 66 CO 0.01 -0.48 0.20 -1.35 0.00 0.00 0.00 178.83 177.21 2hmx h PRO 67 N -0.77 0.38 0.00 -2.39 0.11 -1.82 -2.18 132.00 125.33 2hmx h PRO 67 Ca -0.08 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.01 2hmx h PRO 67 Cb 0.58 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.61 2hmx h PRO 67 CO 0.13 0.25 0.00 0.45 -0.21 0.00 0.00 178.00 178.62 2hmx n SER 68 N -4.98 0.00 0.09 -2.05 2.88 0.94 -1.50 113.62 109.00 2hmx n SER 68 Ca 0.06 -0.94 -0.08 0.00 -1.33 0.00 0.00 58.87 56.58 2hmx n SER 68 Cb 0.20 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.64 2hmx n SER 68 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2hmx h LEU 69 N 0.00 0.20 -1.63 2.46 3.38 0.13 0.83 115.31 120.69 2hmx h LEU 69 Ca 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2hmx h LEU 69 Cb 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2hmx h LEU 69 CO 0.00 1.00 0.00 0.06 0.09 0.00 0.00 178.44 179.59 2hmx h GLN 70 N 0.08 0.00 0.00 1.13 3.07 -1.43 -2.28 115.11 115.68 2hmx h GLN 70 Ca -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.69 2hmx h GLN 70 Cb 1.55 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 29.11 2hmx h GLN 70 CO 0.13 0.00 -1.19 0.25 0.09 0.00 0.00 178.83 178.12 2hmx n THR 71 N -2.51 0.04 0.00 1.86 -2.24 -0.54 -4.90 114.28 105.99 2hmx n THR 71 Ca -0.01 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 2hmx n THR 71 Cb 0.11 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 2hmx n THR 71 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2hmx n GLY 72 N 2.37 0.78 0.00 3.38 0.00 0.28 -5.09 105.19 106.91 2hmx n GLY 72 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2hmx n GLY 72 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2hmx n SER 73 N -0.39 0.00 0.22 1.61 3.41 -1.20 -4.79 113.62 112.49 2hmx n SER 73 Ca 0.00 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.76 2hmx n SER 73 Cb 0.00 0.00 0.76 0.00 -0.26 0.00 0.00 64.21 64.71 2hmx n SER 73 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2hmx h GLU 74 N 0.00 0.00 0.00 4.33 4.57 -1.98 0.47 114.58 121.97 2hmx h GLU 74 Ca 0.00 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 58.03 2hmx h GLU 74 Cb 0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 2hmx h GLU 74 CO 0.00 0.00 -0.70 0.93 -1.18 0.00 0.00 179.01 178.06 2hmx h GLU 75 N 0.00 0.00 0.00 1.92 5.08 -1.97 0.20 114.58 119.81 2hmx h GLU 75 Ca 0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 2hmx h GLU 75 Cb 0.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2hmx h GLU 75 CO 0.00 0.70 -0.39 1.25 -1.00 0.00 0.00 179.01 179.57 2hmx h LEU 76 N 0.00 0.00 -1.76 1.33 6.46 -0.47 -2.25 115.31 118.62 2hmx h LEU 76 Ca -0.01 0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 57.72 2hmx h LEU 76 Cb 1.36 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.28 2hmx h LEU 76 CO 0.09 0.39 -0.16 -0.09 -0.62 0.00 0.00 178.44 178.04 2hmx h ARG 77 N 0.00 0.00 0.19 1.25 2.43 0.15 0.57 114.38 118.98 2hmx h ARG 77 Ca -0.00 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 58.91 2hmx h ARG 77 Cb 1.05 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 30.63 2hmx h ARG 77 CO 0.05 0.16 -1.13 0.77 -1.51 0.00 0.00 179.97 178.32 2hmx h SER 78 N 0.00 0.63 0.15 -3.80 0.02 -0.97 -0.26 113.55 109.32 2hmx h SER 78 Ca -0.00 -0.94 -0.01 0.00 -0.84 0.00 0.00 61.79 60.00 2hmx h SER 78 Cb 0.36 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 2hmx h SER 78 CO 0.02 1.54 -0.04 -0.07 -1.14 0.00 0.00 176.83 177.15 2hmx h LEU 79 N -0.15 0.00 0.02 5.07 4.07 -1.31 -2.25 115.31 120.76 2hmx h LEU 79 Ca -0.20 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.76 2hmx h LEU 79 Cb 1.88 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.62 2hmx h LEU 79 CO 0.20 0.04 -0.01 0.22 -1.08 0.00 0.00 178.44 177.81 2hmx h TYR 80 N 0.00 -0.02 0.00 1.13 3.20 0.61 0.57 116.97 122.46 2hmx h TYR 80 Ca -0.00 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 2hmx h TYR 80 Cb 0.12 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.40 2hmx h TYR 80 CO 0.00 -0.01 -0.06 -2.95 -1.64 0.00 0.00 178.16 173.50 2hmx h ASN 81 N -1.00 0.00 -0.02 -2.11 7.08 -1.13 -1.05 115.58 117.35 2hmx h ASN 81 Ca -0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 2hmx h ASN 81 Cb 0.02 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.26 2hmx h ASN 81 CO 0.00 0.06 -0.16 0.41 -2.08 0.00 0.00 177.43 175.66 2hmx n THR 82 N -3.87 0.00 -0.00 6.14 -1.04 -0.85 0.47 114.28 115.12 2hmx n THR 82 Ca -0.03 -0.41 -0.21 0.00 -2.04 0.00 0.00 64.05 61.37 2hmx n THR 82 Cb 0.15 1.38 -0.14 0.00 -1.82 0.00 0.00 70.33 69.90 2hmx n THR 82 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 2hmx h ILE 83 N 3.85 1.10 0.00 12.58 6.09 0.35 -2.24 117.51 139.24 2hmx h ILE 83 Ca 0.00 -2.39 -0.05 0.00 -1.37 0.00 0.00 64.86 61.05 2hmx h ILE 83 Cb 0.90 2.74 -0.01 0.00 0.47 0.00 0.00 36.82 40.93 2hmx h ILE 83 CO 0.00 0.66 -0.26 0.00 -3.07 0.00 0.00 178.15 175.49 2hmx h ALA 84 N -0.07 0.94 0.66 0.18 0.00 -0.98 0.59 119.26 120.57 2hmx h ALA 84 Ca -0.28 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.36 2hmx h ALA 84 Cb 1.67 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 19.42 2hmx h ALA 84 CO 0.04 0.32 -0.32 0.28 0.00 0.00 0.00 179.25 179.57 2hmx h VAL 85 N 0.00 0.20 0.00 0.00 2.07 -0.14 -1.73 116.25 116.65 2hmx h VAL 85 Ca -0.00 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2hmx h VAL 85 Cb 0.91 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2hmx h VAL 85 CO 0.03 0.02 0.00 -0.11 0.02 0.00 0.00 177.57 177.54 2hmx n LEU 86 N -5.39 0.23 -0.03 2.57 7.94 -0.84 0.98 117.00 122.45 2hmx n LEU 86 Ca -0.12 0.56 -0.14 0.00 -1.11 0.00 0.00 56.01 55.19 2hmx n LEU 86 Cb 0.37 -0.53 -0.11 0.00 0.53 0.00 0.00 43.42 43.68 2hmx n LEU 86 CO 0.32 -0.37 0.47 0.22 -1.11 0.00 0.00 177.39 176.92 2hmx h TYR 87 N 0.00 0.16 -0.52 1.96 5.03 0.18 0.76 116.97 124.54 2hmx h TYR 87 Ca 0.00 -0.08 0.07 0.00 2.58 0.00 0.00 58.73 61.30 2hmx h TYR 87 Cb 0.28 -0.02 -0.06 0.00 1.55 0.00 0.00 36.73 38.48 2hmx h TYR 87 CO 0.00 0.82 0.20 0.00 -1.32 0.00 0.00 178.16 177.87 2hmx h VAL 89 N 0.39 1.26 0.00 0.00 2.07 0.71 0.37 116.25 121.05 2hmx h VAL 89 Ca 0.25 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 2hmx h VAL 89 Cb 0.26 1.48 -0.00 0.00 -1.52 0.00 0.00 31.29 31.50 2hmx h VAL 89 CO -0.24 0.26 -0.01 0.45 0.02 0.00 0.00 177.57 178.06 2hmx h HIS 90 N 0.07 0.00 -0.42 1.57 -0.00 0.26 -2.56 115.15 114.06 2hmx h HIS 90 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.42 2hmx h HIS 90 Cb 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.80 2hmx h HIS 90 CO 0.04 0.01 0.00 0.94 -0.00 0.00 0.00 177.93 178.91 2hmx n GLN 91 N -3.15 3.08 0.00 2.45 -0.06 0.20 -4.59 117.38 115.30 2hmx n GLN 91 Ca -0.02 -2.48 0.00 0.00 -2.00 0.00 0.00 57.00 52.49 2hmx n GLN 91 Cb 0.12 -1.58 0.00 0.00 -4.06 0.00 0.00 30.24 24.73 2hmx n GLN 91 CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 2hmx n ARG 92 N 0.47 0.00 -2.35 3.69 3.00 -0.84 -4.99 116.66 115.63 2hmx n ARG 92 Ca 0.18 0.00 -0.39 0.00 -0.00 0.00 0.00 57.85 57.64 2hmx n ARG 92 Cb 0.66 -0.43 -0.03 0.00 0.00 0.00 0.00 32.46 32.66 2hmx n ARG 92 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2hmx s ILE 93 N -1.44 3.25 0.07 5.15 1.09 -0.00 -4.97 121.20 124.35 2hmx s ILE 93 Ca 0.00 1.16 0.06 0.00 -1.10 0.00 0.00 60.65 60.77 2hmx s ILE 93 Cb 0.00 -3.70 -0.03 0.00 -1.06 0.00 0.00 42.46 37.67 2hmx s ILE 93 CO 0.00 0.20 -0.17 -1.81 -0.10 0.00 0.00 174.94 173.06 2hmx s ASP 94 N -0.96 2.07 0.46 3.58 1.11 -1.26 -2.14 116.67 119.53 2hmx s ASP 94 Ca 0.51 -0.60 0.03 0.00 0.18 0.00 0.00 52.55 52.66 2hmx s ASP 94 Cb -0.32 -0.11 -0.03 0.00 1.07 0.00 0.00 42.92 43.53 2hmx s ASP 94 CO 0.41 0.02 0.03 0.68 1.18 0.00 0.00 175.17 177.49 2hmx s VAL 95 N -1.11 1.24 -0.24 -1.27 -7.23 -1.26 -5.00 120.40 105.53 2hmx s VAL 95 Ca 0.03 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.04 2hmx s VAL 95 Cb -0.09 -2.41 -0.10 0.00 0.56 0.00 0.00 36.38 34.33 2hmx s VAL 95 CO 0.03 0.00 -0.31 1.17 -0.31 0.00 0.00 175.10 175.67 2hmx n LYS 96 N -1.10 0.56 -2.21 4.82 3.00 -1.26 -4.89 118.16 117.08 2hmx n LYS 96 Ca -0.13 0.27 -0.02 0.00 -0.00 0.00 0.00 58.31 58.43 2hmx n LYS 96 Cb 0.67 -1.49 -0.01 0.00 0.00 0.00 0.00 35.03 34.20 2hmx n LYS 96 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2hmx n ASP 97 N -4.35 1.33 -0.09 3.14 5.75 -1.26 0.58 116.55 121.67 2hmx n ASP 97 Ca -0.38 -1.18 -0.07 0.00 -0.01 0.00 0.00 54.79 53.14 2hmx n ASP 97 Cb 0.73 0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.89 2hmx n ASP 97 CO 0.00 0.00 0.00 0.74 -0.11 0.00 0.00 177.20 177.83 2hmx h THR 98 N 1.05 0.91 0.00 2.12 2.02 -1.49 -1.73 112.91 115.78 2hmx h THR 98 Ca -0.03 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 2hmx h THR 98 Cb 0.10 0.65 -0.00 0.00 -1.74 0.00 0.00 68.15 67.16 2hmx h THR 98 CO 0.05 0.04 -0.04 0.11 0.37 0.00 0.00 175.52 176.05 2hmx h LYS 99 N 0.24 0.00 0.01 6.66 1.79 -1.87 0.66 116.57 124.05 2hmx h LYS 99 Ca 0.14 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.53 2hmx h LYS 99 Cb 0.11 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.75 2hmx h LYS 99 CO -0.15 0.04 -0.43 0.93 -1.08 0.00 0.00 179.45 178.76 2hmx h GLU 100 N 0.00 0.02 0.52 3.15 5.08 -1.73 -1.48 114.58 120.14 2hmx h GLU 100 Ca -0.00 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 2hmx h GLU 100 Cb 0.12 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.39 2hmx h GLU 100 CO 0.00 1.02 -0.25 0.00 -1.00 0.00 0.00 179.01 178.78 2hmx h ALA 101 N -0.14 -0.70 0.00 3.43 0.00 -0.65 -1.94 119.26 119.28 2hmx h ALA 101 Ca -0.11 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2hmx h ALA 101 Cb 1.13 0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.19 2hmx h ALA 101 CO -0.05 -0.87 0.06 1.25 0.00 0.00 0.00 179.25 179.63 2hmx h LEU 102 N -0.73 0.00 0.00 0.00 5.85 0.22 0.93 115.31 121.58 2hmx h LEU 102 Ca -0.07 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.62 2hmx h LEU 102 Cb 0.55 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.58 2hmx h LEU 102 CO 0.12 0.00 -0.18 -0.78 -0.34 0.00 0.00 178.44 177.25 2hmx h ASP 103 N 0.00 0.00 0.00 1.25 3.58 -1.05 0.57 116.42 120.78 2hmx h ASP 103 Ca 0.00 -0.51 0.00 0.00 0.42 0.00 0.00 57.03 56.94 2hmx h ASP 103 Cb 0.11 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.16 2hmx h ASP 103 CO 0.00 0.86 0.03 1.17 -2.88 0.00 0.00 179.24 178.42 2hmx n LYS 104 N -4.65 0.07 -0.07 0.28 0.00 0.28 0.55 118.16 114.63 2hmx n LYS 104 Ca -0.09 0.56 -0.09 0.00 0.00 0.00 0.00 58.31 58.70 2hmx n LYS 104 Cb 0.32 -1.78 -0.07 0.00 0.00 0.00 0.00 35.03 33.49 2hmx n LYS 104 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2hmx n ILE 105 N -1.90 0.83 0.15 3.15 2.08 0.12 -2.28 119.36 121.51 2hmx n ILE 105 Ca -0.01 -0.37 -0.14 0.00 0.56 0.00 0.00 62.75 62.80 2hmx n ILE 105 Cb 0.05 -0.94 -0.07 0.00 -0.75 0.00 0.00 39.64 37.93 2hmx n ILE 105 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 2hmx h GLU 106 N 0.00 -0.35 0.00 0.38 4.57 0.12 1.01 114.58 120.31 2hmx h GLU 106 Ca -0.32 0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 57.87 2hmx h GLU 106 Cb 1.56 0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 30.23 2hmx h GLU 106 CO -0.03 -0.23 -0.02 1.49 -1.18 0.00 0.00 179.01 179.03 2hmx h GLU 107 N -0.36 0.00 0.00 1.92 4.57 -0.03 -3.43 114.58 117.25 2hmx h GLU 107 Ca -0.02 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 2hmx h GLU 107 Cb 0.31 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 2hmx h GLU 107 CO 0.01 0.02 0.00 -1.91 -1.18 0.00 0.00 179.01 175.95 2hmx n GLU 108 N -3.20 0.00 -1.11 1.92 4.07 -0.86 -5.00 120.64 116.46 2hmx n GLU 108 Ca -0.01 0.00 -0.26 0.00 -0.06 0.00 0.00 57.16 56.83 2hmx n GLU 108 Cb 0.19 0.00 0.06 0.00 -0.06 0.00 0.00 31.44 31.63 2hmx n GLU 108 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 2hmx n GLN 109 N -3.32 2.24 0.03 5.31 6.02 0.27 -3.59 117.38 124.35 2hmx n GLN 109 Ca 0.00 -2.44 -0.00 0.00 -0.01 0.00 0.00 57.00 54.55 2hmx n GLN 109 Cb 0.00 -1.96 -0.00 0.00 1.02 0.00 0.00 30.24 29.30 2hmx n GLN 109 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2hmx n ASN 110 N -0.32 0.64 -2.23 1.08 4.05 0.27 -4.76 115.26 114.00 2hmx n ASN 110 Ca 0.47 0.08 0.00 0.00 0.45 0.00 0.00 54.58 55.58 2hmx n ASN 110 Cb 0.65 -0.20 0.00 0.00 1.23 0.00 0.00 39.78 41.47 2hmx n ASN 110 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 177.26 175.38 2hmx n LYS 111 N -3.07 -5.06 0.00 1.20 3.00 -1.24 -4.80 118.16 108.19 2hmx n LYS 111 Ca -0.00 3.67 0.00 0.00 -0.00 0.00 0.00 58.31 61.98 2hmx n LYS 111 Cb 0.00 -4.45 0.00 0.00 0.00 0.00 0.00 35.03 30.58 2hmx n LYS 111 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2hmx n SER 112 N 1.77 0.00 -1.59 3.14 3.41 -1.26 -4.94 113.62 114.15 2hmx n SER 112 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2hmx n SER 112 Cb 0.00 0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 2hmx n SER 112 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2hmx n LYS 113 N -1.28 -4.41 -1.60 4.33 5.02 -1.26 -4.62 118.16 114.34 2hmx n LYS 113 Ca 0.00 3.19 -0.14 0.00 -2.02 0.00 0.00 58.31 59.33 2hmx n LYS 113 Cb 0.00 -3.48 -0.07 0.00 -0.02 0.00 0.00 35.03 31.46 2hmx n LYS 113 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2hmx s LYS 114 N -2.24 1.66 -0.41 1.97 -2.85 -1.26 -4.76 119.74 111.85 2hmx s LYS 114 Ca 0.00 0.43 0.04 0.00 -1.00 0.00 0.00 55.97 55.44 2hmx s LYS 114 Cb 0.00 -4.80 0.17 0.00 -2.06 0.00 0.00 37.83 31.13 2hmx s LYS 114 CO 0.00 -4.39 0.42 0.15 0.10 0.00 0.00 175.35 171.63 2hmx s LYS 115 N 8.77 0.82 0.02 1.78 -0.14 -1.26 -5.00 119.74 124.73 2hmx s LYS 115 Ca 0.91 -1.44 0.11 0.00 -1.36 0.00 0.00 55.97 54.20 2hmx s LYS 115 Cb -0.12 -0.91 -0.21 0.00 -1.68 0.00 0.00 37.83 34.91 2hmx s LYS 115 CO 0.07 -1.30 0.88 0.00 -0.76 0.00 0.00 175.35 174.24 2hmx h ALA 116 N 6.08 0.64 -0.76 5.17 0.00 -1.98 -3.47 119.26 124.94 2hmx h ALA 116 Ca 0.14 -1.22 -0.32 0.00 0.00 0.00 0.00 54.91 53.51 2hmx h ALA 116 Cb 1.00 0.27 -0.13 0.00 0.00 0.00 0.00 17.79 18.94 2hmx h ALA 116 CO 0.23 1.40 -0.29 0.00 0.00 0.00 0.00 179.25 180.60 2hmx n GLN 117 N -3.12 -1.59 0.00 0.00 0.00 -1.26 -3.49 117.38 107.92 2hmx n GLN 117 Ca -0.11 1.04 0.00 0.00 0.00 0.00 0.00 57.00 57.94 2hmx n GLN 117 Cb 0.99 -5.45 0.00 0.00 0.00 0.00 0.00 30.24 25.78 2hmx n GLN 117 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 2hmx n GLN 118 N -1.54 0.00 0.00 2.61 6.02 -1.26 -4.82 117.38 118.39 2hmx n GLN 118 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.83 2hmx n GLN 118 Cb 0.64 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.90 2hmx n GLN 118 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hmx n ALA 119 N 0.37 0.00 -1.76 -1.58 0.00 -1.23 -4.85 120.51 111.46 2hmx n ALA 119 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 2hmx n ALA 119 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 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 -0.70 3.14 -0.15 0.00 0.00 -1.26 -4.96 121.76 117.83 2hmx s ALA 120 Ca 0.00 1.41 -0.11 0.00 0.00 0.00 0.00 51.96 53.26 2hmx s ALA 120 Cb 0.00 -3.57 -0.06 0.00 0.00 0.00 0.00 23.12 19.49 2hmx s ALA 120 CO 0.00 -1.20 -0.10 0.00 0.00 0.00 0.00 175.76 174.46 2hmx h ALA 121 N 2.14 0.05 -1.09 0.00 0.00 -2.03 -3.44 119.26 114.90 2hmx h ALA 121 Ca -0.51 -0.63 -0.29 0.00 0.00 0.00 0.00 54.91 53.48 2hmx h ALA 121 Cb 1.27 0.55 -0.00 0.00 0.00 0.00 0.00 17.79 19.61 2hmx h ALA 121 CO 0.60 0.54 0.97 -0.51 0.00 0.00 0.00 179.25 180.85 2hmx s ASP 122 N -5.94 4.33 0.00 0.00 1.11 -1.26 -4.05 116.67 110.86 2hmx s ASP 122 Ca -0.17 0.54 0.00 0.00 0.18 0.00 0.00 52.55 53.10 2hmx s ASP 122 Cb 0.03 -2.52 0.00 0.00 1.07 0.00 0.00 42.92 41.49 2hmx s ASP 122 CO 0.28 -3.21 0.00 1.07 1.18 0.00 0.00 175.17 174.50 2hmx n THR 123 N 8.22 0.00 -0.41 -1.27 5.66 -1.26 -4.95 114.28 120.27 2hmx n THR 123 Ca 0.39 0.00 0.06 0.00 -3.05 0.00 0.00 64.05 61.45 2hmx n THR 123 Cb 0.50 0.00 0.31 0.00 -1.55 0.00 0.00 70.33 69.59 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 -0.96 2.56 3.46 1.09 0.00 -1.26 -4.82 105.19 105.27 2hmx n GLY 124 Ca 0.00 -0.71 -0.32 0.00 0.00 0.00 0.00 46.02 44.99 2hmx n GLY 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hmx s ASN 125 N -0.65 3.87 0.00 1.61 4.22 -1.26 -5.08 114.94 117.65 2hmx s ASN 125 Ca 0.42 -0.31 0.00 0.00 -2.14 0.00 0.00 52.86 50.83 2hmx s ASN 125 Cb 0.31 -0.72 0.00 0.00 1.28 0.00 0.00 41.25 42.13 2hmx s ASN 125 CO 0.14 0.30 0.50 0.59 -2.04 0.00 0.00 177.10 176.60 2hmx n ASN 126 N 1.98 0.00 -4.87 3.54 5.03 -1.26 -4.92 115.26 114.77 2hmx n ASN 126 Ca -0.16 0.65 -0.23 0.00 0.87 0.00 0.00 54.58 55.70 2hmx n ASN 126 Cb 0.52 -0.36 -0.04 0.00 -1.02 0.00 0.00 39.78 38.89 2hmx n ASN 126 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2hmx s SER 127 N -2.17 5.82 1.12 6.41 1.04 -1.26 -5.12 113.70 119.53 2hmx s SER 127 Ca 0.00 -0.09 -0.06 0.00 0.48 0.00 0.00 55.95 56.28 2hmx s SER 127 Cb 0.00 -1.59 0.09 0.00 0.10 0.00 0.00 66.02 64.63 2hmx s SER 127 CO 0.00 -0.01 0.23 0.00 0.98 0.00 0.00 173.24 174.44 2hmx n GLN 128 N -0.93 -2.61 -1.82 4.02 0.00 -1.26 -4.94 117.38 109.85 2hmx n GLN 128 Ca -0.08 -0.38 -0.40 0.00 0.00 0.00 0.00 57.00 56.14 2hmx n GLN 128 Cb 0.56 -0.47 0.01 0.00 0.00 0.00 0.00 30.24 30.34 2hmx n GLN 128 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 2hmx s VAL 129 N -1.30 2.10 0.00 -0.39 1.01 -1.26 -4.94 120.40 115.62 2hmx s VAL 129 Ca 0.17 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.24 2hmx s VAL 129 Cb -0.03 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.30 2hmx s VAL 129 CO 0.14 0.01 0.00 -1.20 0.00 0.00 0.00 175.10 174.06 2hmx n SER 130 N -0.09 0.00 0.00 3.32 7.64 -1.26 -5.00 113.62 118.23 2hmx n SER 130 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.92 2hmx n SER 130 Cb 0.42 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 2hmx n SER 130 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hmx n GLN 131 N -2.41 0.22 -0.81 1.43 6.02 -1.26 -5.13 117.38 115.43 2hmx n GLN 131 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2hmx n GLN 131 Cb 0.00 -0.99 0.00 0.00 1.02 0.00 0.00 30.24 30.27 2hmx n GLN 131 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2hmx n ASN 132 N -1.46 -4.46 0.00 1.08 3.02 -1.26 -5.35 115.26 106.83 2hmx n ASN 132 Ca 0.00 0.90 0.00 0.00 -0.03 0.00 0.00 54.58 55.45 2hmx n ASN 132 Cb 0.01 -2.10 0.00 0.00 -0.61 0.00 0.00 39.78 37.08 2hmx n ASN 132 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64