#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 0.00 -0.05 -0.41 -0.00 -1.26 -4.69 117.12 110.71 2hmx n MET 2 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.70 57.61 2hmx n MET 2 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 33.22 33.18 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 0.00 -0.15 7.00 3.17 0.00 -1.26 -5.12 105.19 108.83 2hmx n GLY 3 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -3.07 0.00 -2.70 4.61 0.00 -1.26 -4.89 120.51 113.20 2hmx n ALA 4 Ca -0.19 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.03 2hmx n ALA 4 Cb 0.67 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.07 2hmx n ALA 4 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2hmx s ARG 5 N 0.00 2.72 0.11 0.00 6.06 -1.26 -5.08 118.95 121.50 2hmx s ARG 5 Ca 0.00 -1.22 -0.31 0.00 -2.50 0.00 0.00 55.73 51.70 2hmx s ARG 5 Cb 0.00 -2.44 -0.09 0.00 0.06 0.00 0.00 34.95 32.49 2hmx s ARG 5 CO 0.00 0.30 1.57 0.00 -2.50 0.00 0.00 175.30 174.67 2hmx s ALA 6 N -2.23 3.71 0.00 6.12 0.00 -1.26 -4.87 121.76 123.22 2hmx s ALA 6 Ca 0.35 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.55 2hmx s ALA 6 Cb -0.07 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.41 2hmx s ALA 6 CO 0.24 -0.89 0.00 0.45 0.00 0.00 0.00 175.76 175.56 2hmx n SER 7 N 4.68 0.00 -0.09 0.00 2.88 -1.26 -5.02 113.62 114.81 2hmx n SER 7 Ca 0.14 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.58 2hmx n SER 7 Cb 0.40 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.82 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 0.00 1.50 -1.55 2.46 0.31 -1.26 -4.98 118.33 114.81 2hmx n VAL 8 Ca 0.00 0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 2hmx n VAL 8 Cb 0.00 -2.30 0.00 0.00 -0.91 0.00 0.00 33.84 30.63 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 -4.43 0.00 -4.71 7.52 4.77 -1.26 -4.74 117.00 114.14 2hmx n LEU 9 Ca -0.17 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.58 2hmx n LEU 9 Cb 0.54 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.57 2hmx n LEU 9 CO 0.19 -0.43 -0.27 -0.94 -1.33 0.00 0.00 177.39 174.61 2hmx s SER 10 N -1.00 4.91 0.29 -1.43 1.04 -1.26 -4.86 113.70 111.39 2hmx s SER 10 Ca 0.00 -0.50 -0.02 0.00 0.48 0.00 0.00 55.95 55.92 2hmx s SER 10 Cb 0.00 -1.06 0.41 0.00 0.10 0.00 0.00 66.02 65.48 2hmx s SER 10 CO 0.00 -0.01 1.87 1.23 0.98 0.00 0.00 173.24 177.31 2hmx h GLY 11 N 1.74 0.99 0.99 7.32 0.00 -1.94 0.96 103.07 113.12 2hmx h GLY 11 Ca -0.46 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 46.36 2hmx h GLY 11 CO 0.60 0.47 -0.21 -1.33 0.00 0.00 0.00 176.54 176.07 2hmx h GLY 12 N 1.00 -0.63 2.00 4.60 0.00 -1.98 -2.40 103.07 105.67 2hmx h GLY 12 Ca 0.22 0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.78 2hmx h GLY 12 CO -0.02 -0.23 -0.02 0.83 0.00 0.00 0.00 176.54 177.10 2hmx h GLU 13 N -0.62 0.00 -0.02 4.80 5.08 0.25 0.25 114.58 124.32 2hmx h GLU 13 Ca -0.06 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2hmx h GLU 13 Cb 0.47 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 2hmx h GLU 13 CO 0.10 0.02 -0.01 -0.07 -1.00 0.00 0.00 179.01 178.05 2hmx h LEU 14 N 0.00 0.04 0.00 1.33 -0.00 0.63 0.57 115.31 117.88 2hmx h LEU 14 Ca -0.00 -0.41 0.00 0.00 -0.00 0.00 0.00 57.88 57.46 2hmx h LEU 14 Cb 0.06 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 40.71 2hmx h LEU 14 CO 0.00 0.45 0.00 0.47 -0.00 0.00 0.00 178.44 179.36 2hmx n ASP 15 N -4.86 0.00 -0.00 -0.43 9.92 0.76 0.97 116.55 122.90 2hmx n ASP 15 Ca -0.08 0.48 0.06 0.00 -0.53 0.00 0.00 54.79 54.72 2hmx n ASP 15 Cb 0.23 -0.48 -0.08 0.00 -0.64 0.00 0.00 41.12 40.15 2hmx n ASP 15 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2hmx n LYS 16 N -1.48 2.17 0.02 -1.24 4.01 -0.52 -4.01 118.16 117.11 2hmx n LYS 16 Ca 0.00 -0.03 0.05 0.00 -0.51 0.00 0.00 58.31 57.82 2hmx n LYS 16 Cb 0.01 -1.16 -0.10 0.00 -0.51 0.00 0.00 35.03 33.27 2hmx n LYS 16 CO 0.00 0.00 0.00 1.87 -1.11 0.00 0.00 177.40 178.16 2hmx n TRP 17 N -1.46 0.53 0.28 2.13 -0.00 0.27 -4.54 117.44 114.65 2hmx n TRP 17 Ca 0.01 0.17 0.12 0.00 -0.00 0.00 0.00 57.50 57.80 2hmx n TRP 17 Cb 0.24 -0.86 0.79 0.00 -0.00 0.00 0.00 31.31 31.48 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 -1.07 5.87 4.81 0.02 -2.94 114.58 121.27 2hmx h GLU 18 Ca -0.13 0.00 -0.38 0.00 -0.13 0.00 0.00 59.36 58.72 2hmx h GLU 18 Cb 1.35 0.00 -0.28 0.00 0.63 0.00 0.00 28.75 30.45 2hmx h GLU 18 CO 0.02 0.02 -0.84 1.63 -0.73 0.00 0.00 179.01 179.11 2hmx n LYS 19 N -4.08 0.91 -1.62 1.92 5.02 -0.91 -4.31 118.16 115.09 2hmx n LYS 19 Ca -0.03 -2.65 -0.31 0.00 -2.02 0.00 0.00 58.31 53.31 2hmx n LYS 19 Cb 0.10 -1.37 0.06 0.00 -0.02 0.00 0.00 35.03 33.80 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 -0.89 3.76 0.30 -0.18 1.09 -0.92 -4.86 121.20 119.51 2hmx s ILE 20 Ca 0.32 0.57 0.09 0.00 -1.10 0.00 0.00 60.65 60.54 2hmx s ILE 20 Cb 0.28 -3.36 -0.04 0.00 -1.06 0.00 0.00 42.46 38.28 2hmx s ILE 20 CO -0.10 -0.75 0.05 -0.60 -0.10 0.00 0.00 174.94 173.44 2hmx s ARG 21 N -5.12 2.30 0.00 2.79 3.52 -0.31 0.59 118.95 122.72 2hmx s ARG 21 Ca 0.59 -1.49 0.00 0.00 -0.13 0.00 0.00 55.73 54.69 2hmx s ARG 21 Cb -0.14 -2.14 0.00 0.00 -1.56 0.00 0.00 34.95 31.11 2hmx s ARG 21 CO 0.54 0.26 0.00 1.47 -0.81 0.00 0.00 175.30 176.76 2hmx n LEU 22 N -0.99 0.00 -4.59 -0.88 -0.00 -0.87 0.58 117.00 110.26 2hmx n LEU 22 Ca -0.05 0.00 -0.43 0.00 -0.00 0.00 0.00 56.01 55.53 2hmx n LEU 22 Cb 0.60 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 44.00 2hmx n LEU 22 CO 0.42 0.00 1.09 0.00 -0.00 0.00 0.00 177.39 178.89 2hmx s ARG 23 N 4.20 3.58 -0.85 1.47 1.70 -1.26 -4.74 118.95 123.05 2hmx s ARG 23 Ca 0.00 0.43 -0.21 0.00 -0.47 0.00 0.00 55.73 55.48 2hmx s ARG 23 Cb 0.00 -3.98 -0.20 0.00 -0.57 0.00 0.00 34.95 30.20 2hmx s ARG 23 CO 0.00 -1.58 2.34 -0.35 -1.08 0.00 0.00 175.30 174.63 2hmx n PRO 24 N 8.22 0.39 0.00 3.89 -0.04 -1.26 -1.62 135.00 144.58 2hmx n PRO 24 Ca 0.11 -0.59 0.00 0.00 -0.04 0.00 0.00 63.50 62.98 2hmx n PRO 24 Cb 0.49 -2.88 0.00 0.00 -0.04 0.00 0.00 33.50 31.07 2hmx n PRO 24 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2hmx n GLY 25 N 6.41 -1.65 0.00 0.55 0.00 -1.26 -5.12 105.19 104.12 2hmx n GLY 25 Ca 0.53 0.54 0.00 0.00 0.00 0.00 0.00 46.02 47.09 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 0.00 -3.21 0.09 -0.02 0.00 -0.64 -4.99 105.19 96.43 2hmx n GLY 26 Ca 0.00 -0.68 -0.11 0.00 0.00 0.00 0.00 46.02 45.23 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 0.86 -1.63 1.61 4.76 -1.26 -5.05 118.16 117.45 2hmx n LYS 27 Ca 0.00 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.51 2hmx n LYS 27 Cb 0.00 -1.40 0.00 0.00 -1.84 0.00 0.00 35.03 31.79 2hmx n LYS 27 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2hmx n LYS 28 N -2.89 0.00 -4.34 1.97 4.01 -1.26 -5.00 118.16 110.65 2hmx n LYS 28 Ca -0.31 0.00 -0.29 0.00 -0.51 0.00 0.00 58.31 57.20 2hmx n LYS 28 Cb 0.92 -2.03 -0.17 0.00 -0.51 0.00 0.00 35.03 33.25 2hmx n LYS 28 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 2hmx s GLN 29 N -3.07 2.26 0.21 1.97 -0.21 -1.26 -2.05 119.66 117.51 2hmx s GLN 29 Ca 0.00 -0.57 -0.30 0.00 0.02 0.00 0.00 55.36 54.51 2hmx s GLN 29 Cb 0.00 -1.97 -0.08 0.00 1.00 0.00 0.00 33.01 31.96 2hmx s GLN 29 CO 0.00 -0.11 1.20 0.71 -2.12 0.00 0.00 175.29 174.97 2hmx s TYR 30 N 1.13 3.40 0.33 0.91 1.51 0.20 -4.92 117.35 119.91 2hmx s TYR 30 Ca -0.03 1.44 -0.10 0.00 -1.01 0.00 0.00 57.07 57.37 2hmx s TYR 30 Cb -0.14 -3.44 0.02 0.00 -0.11 0.00 0.00 41.96 38.28 2hmx s TYR 30 CO -0.04 -1.22 0.59 0.21 -1.11 0.00 0.00 175.55 173.97 2hmx s LYS 31 N -0.51 1.93 0.05 -0.62 2.20 -1.26 -2.13 119.74 119.40 2hmx s LYS 31 Ca 0.52 -1.51 0.16 0.00 -0.36 0.00 0.00 55.97 54.77 2hmx s LYS 31 Cb -0.33 0.52 -0.15 0.00 -1.51 0.00 0.00 37.83 36.35 2hmx s LYS 31 CO 0.39 -0.84 0.82 -0.07 -0.36 0.00 0.00 175.35 175.28 2hmx h LEU 32 N 2.10 0.00 -1.00 5.43 -0.00 -1.85 0.62 115.31 120.61 2hmx h LEU 32 Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.60 2hmx h LEU 32 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.91 2hmx h LEU 32 CO 0.38 0.66 0.00 0.29 -0.00 0.00 0.00 178.44 179.77 2hmx n LYS 33 N -2.94 0.16 -0.05 1.13 4.01 -1.26 -1.94 118.16 117.27 2hmx n LYS 33 Ca -0.10 0.52 -0.00 0.00 -0.51 0.00 0.00 58.31 58.21 2hmx n LYS 33 Cb 0.88 -1.89 -0.15 0.00 -0.51 0.00 0.00 35.03 33.36 2hmx n LYS 33 CO 0.00 0.00 0.00 1.58 -1.11 0.00 0.00 177.40 177.87 2hmx n HIS 34 N -2.21 0.00 -0.14 2.13 -0.00 -0.12 -1.98 115.22 112.90 2hmx n HIS 34 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.64 2hmx n HIS 34 Cb 0.13 -0.69 -0.00 0.00 -0.00 0.00 0.00 29.99 29.43 2hmx n HIS 34 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.34 177.31 2hmx h ILE 35 N 0.00 1.18 -0.15 3.57 2.10 0.19 -1.02 117.51 123.38 2hmx h ILE 35 Ca -0.27 -0.52 -0.06 0.00 1.08 0.00 0.00 64.86 65.10 2hmx h ILE 35 Cb 1.56 0.75 -0.01 0.00 -1.09 0.00 0.00 36.82 38.02 2hmx h ILE 35 CO 0.01 0.20 -0.16 0.58 -1.08 0.00 0.00 178.15 177.70 2hmx h VAL 36 N 0.54 1.19 0.29 2.19 2.07 -1.13 0.61 116.25 122.01 2hmx h VAL 36 Ca 0.14 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 2hmx h VAL 36 Cb 0.13 1.26 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2hmx h VAL 36 CO -0.02 0.27 -0.16 -0.25 0.02 0.00 0.00 177.57 177.44 2hmx h TRP 37 N 0.23 -0.40 0.33 1.57 7.01 -1.15 0.20 115.95 123.73 2hmx h TRP 37 Ca 0.04 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.02 2hmx h TRP 37 Cb 0.42 0.14 0.00 0.00 -2.10 0.00 0.00 29.16 27.62 2hmx h TRP 37 CO 0.01 -0.25 -0.16 0.00 -2.79 0.00 0.00 178.44 175.25 2hmx h ALA 38 N 0.29 -1.09 -0.01 2.65 0.00 -0.09 -0.40 119.26 120.61 2hmx h ALA 38 Ca -0.04 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2hmx h ALA 38 Cb 0.33 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2hmx h ALA 38 CO 0.05 -1.05 0.05 0.77 0.00 0.00 0.00 179.25 179.07 2hmx h SER 39 N -0.45 0.00 0.30 0.00 0.02 0.13 0.86 113.55 114.41 2hmx h SER 39 Ca -0.05 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 2hmx h SER 39 Cb 0.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.88 2hmx h SER 39 CO 0.07 0.00 -0.15 -0.09 -1.14 0.00 0.00 176.83 175.53 2hmx h ARG 40 N 0.00 -0.39 0.00 3.45 9.65 -0.59 -2.39 114.38 124.10 2hmx h ARG 40 Ca 0.01 0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 58.91 2hmx h ARG 40 Cb 0.12 0.09 -0.00 0.00 -1.39 0.00 0.00 29.97 28.78 2hmx h ARG 40 CO -0.00 -0.26 -0.03 1.49 2.80 0.00 0.00 179.97 183.97 2hmx h GLU 41 N -0.44 0.00 0.00 0.20 4.22 0.24 0.17 114.58 118.97 2hmx h GLU 41 Ca -0.04 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.40 2hmx h GLU 41 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2hmx h GLU 41 CO 0.07 0.03 0.00 -0.11 -2.18 0.00 0.00 179.01 176.82 2hmx n LEU 42 N -4.30 0.01 0.34 1.64 7.94 0.19 0.23 117.00 123.04 2hmx n LEU 42 Ca -0.03 0.94 0.23 0.00 -1.11 0.00 0.00 56.01 56.04 2hmx n LEU 42 Cb 0.12 -0.49 1.21 0.00 0.53 0.00 0.00 43.42 44.79 2hmx n LEU 42 CO 0.33 -0.49 1.18 1.05 -1.11 0.00 0.00 177.39 178.35 2hmx h GLU 43 N 0.00 0.00 0.00 1.96 -0.00 -0.68 0.54 114.58 116.39 2hmx h GLU 43 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 2hmx h GLU 43 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 2hmx h GLU 43 CO 0.00 0.00 -1.08 2.89 -0.00 0.00 0.00 179.01 180.82 2hmx n ARG 44 N -3.06 0.09 0.21 1.06 1.85 0.47 -1.54 116.66 115.74 2hmx n ARG 44 Ca -0.03 -0.02 -0.08 0.00 -1.00 0.00 0.00 57.85 56.72 2hmx n ARG 44 Cb 0.08 -1.51 -0.04 0.00 -1.05 0.00 0.00 32.46 29.94 2hmx n ARG 44 CO 0.00 0.00 0.00 0.74 -0.01 0.00 0.00 177.63 178.36 2hmx h PHE 45 N 0.00 -0.50 0.00 2.89 0.04 0.21 -3.46 116.94 116.12 2hmx h PHE 45 Ca 0.00 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.76 2hmx h PHE 45 Cb 0.57 0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.88 2hmx h PHE 45 CO 0.00 -0.31 0.00 0.00 -0.60 0.00 0.00 178.31 177.40 2hmx n ALA 46 N -2.30 0.45 -2.34 2.45 0.00 -0.87 -5.10 120.51 112.80 2hmx n ALA 46 Ca -0.07 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.19 2hmx n ALA 46 Cb 0.21 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.56 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 1.63 -0.17 0.00 1.01 -0.59 -5.00 120.40 117.28 2hmx s VAL 47 Ca 0.00 -2.18 -0.07 0.00 0.00 0.00 0.00 61.98 59.73 2hmx s VAL 47 Cb 0.00 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 2hmx s VAL 47 CO 0.00 -0.58 0.08 0.21 0.00 0.00 0.00 175.10 174.81 2hmx s ASN 48 N -3.31 5.79 0.04 3.32 3.84 -1.26 -4.19 114.94 119.17 2hmx s ASN 48 Ca 0.22 0.16 -0.26 0.00 0.21 0.00 0.00 52.86 53.19 2hmx s ASN 48 Cb 0.00 -1.96 -0.17 0.00 -0.55 0.00 0.00 41.25 38.57 2hmx s ASN 48 CO 0.06 0.22 1.45 1.55 -2.79 0.00 0.00 177.10 177.60 2hmx h PRO 49 N 6.36 -0.35 0.00 0.43 0.13 -1.90 -1.41 132.00 135.26 2hmx h PRO 49 Ca -0.41 0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 64.70 2hmx h PRO 49 Cb 1.17 0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 2hmx h PRO 49 CO 0.69 -0.10 -0.21 0.78 -0.23 0.00 0.00 178.00 178.92 2hmx h GLY 50 N -0.56 0.00 2.00 1.56 0.00 -1.96 0.87 103.07 104.98 2hmx h GLY 50 Ca -0.04 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 2hmx h GLY 50 CO 0.06 0.00 -0.04 -2.00 0.00 0.00 0.00 176.54 174.56 2hmx h LEU 51 N 0.00 0.00 0.00 3.11 6.46 -1.85 0.55 115.31 123.59 2hmx h LEU 51 Ca -0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2hmx h LEU 51 Cb 0.38 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.31 2hmx h LEU 51 CO 0.03 0.04 -1.49 -0.11 -0.62 0.00 0.00 178.44 176.29 2hmx n LEU 52 N -3.87 0.41 0.11 2.25 -0.00 0.28 -2.52 117.00 113.66 2hmx n LEU 52 Ca -0.03 -0.06 0.03 0.00 -0.00 0.00 0.00 56.01 55.95 2hmx n LEU 52 Cb 0.13 -0.03 0.43 0.00 -0.00 0.00 0.00 43.42 43.95 2hmx n LEU 52 CO 0.29 0.04 0.97 -0.08 -0.00 0.00 0.00 177.39 178.60 2hmx h GLU 53 N 0.00 0.27 -7.14 1.96 4.22 0.15 -3.40 114.58 110.64 2hmx h GLU 53 Ca 0.00 -0.05 -0.49 0.00 0.08 0.00 0.00 59.36 58.90 2hmx h GLU 53 Cb 0.85 -0.05 0.03 0.00 0.50 0.00 0.00 28.75 30.08 2hmx h GLU 53 CO 0.00 0.33 0.30 0.95 -2.18 0.00 0.00 179.01 178.41 2hmx s THR 54 N -4.92 4.68 0.24 0.32 -4.23 -0.85 -4.82 115.64 106.06 2hmx s THR 54 Ca -0.06 0.87 -0.06 0.00 -1.18 0.00 0.00 61.69 61.26 2hmx s THR 54 Cb 0.16 -3.78 0.20 0.00 1.34 0.00 0.00 72.50 70.42 2hmx s THR 54 CO 0.73 -0.81 1.83 0.77 -0.54 0.00 0.00 174.62 176.60 2hmx h SER 55 N 0.54 0.74 -0.11 3.99 4.64 -1.82 -2.43 113.55 119.09 2hmx h SER 55 Ca -0.46 0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2hmx h SER 55 Cb 1.19 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2hmx h SER 55 CO 0.62 0.46 0.05 -0.08 -0.87 0.00 0.00 176.83 177.01 2hmx h GLU 56 N 0.86 0.15 -0.65 4.77 4.22 -1.92 0.83 114.58 122.84 2hmx h GLU 56 Ca 0.37 -0.02 -0.04 0.00 0.08 0.00 0.00 59.36 59.74 2hmx h GLU 56 Cb 0.23 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 2hmx h GLU 56 CO -0.20 0.21 0.24 0.78 -2.18 0.00 0.00 179.01 177.87 2hmx h GLY 57 N 0.05 1.04 2.00 1.92 0.00 -1.47 0.60 103.07 107.21 2hmx h GLY 57 Ca 0.04 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 46.80 2hmx h GLY 57 CO -0.00 0.53 -0.04 0.00 0.00 0.00 0.00 176.54 177.02 2hmx h ARG 59 N 0.00 0.32 0.00 0.00 9.65 0.15 0.57 114.38 125.08 2hmx h ARG 59 Ca -0.00 -0.54 -0.01 0.00 -1.10 0.00 0.00 59.98 58.32 2hmx h ARG 59 Cb 0.44 0.20 -0.00 0.00 -1.39 0.00 0.00 29.97 29.22 2hmx h ARG 59 CO 0.01 1.26 -0.06 0.37 2.80 0.00 0.00 179.97 184.34 2hmx h GLN 60 N -0.17 0.00 0.00 0.20 4.15 0.14 -1.96 115.11 117.46 2hmx h GLN 60 Ca -0.28 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.14 2hmx h GLN 60 Cb 1.86 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.55 2hmx h GLN 60 CO 0.12 0.06 -0.04 0.82 -1.93 0.00 0.00 178.83 177.86 2hmx h ILE 61 N 0.00 0.00 0.00 2.39 1.08 0.04 -2.42 117.51 118.60 2hmx h ILE 61 Ca -0.00 -0.74 0.00 0.00 -0.39 0.00 0.00 64.86 63.72 2hmx h ILE 61 Cb 0.25 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.00 2hmx h ILE 61 CO 0.01 0.00 0.00 0.25 -0.69 0.00 0.00 178.15 177.72 2hmx h LEU 62 N -0.74 0.00 0.00 1.44 5.85 0.17 0.98 115.31 123.01 2hmx h LEU 62 Ca 0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 2hmx h LEU 62 Cb 0.04 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.07 2hmx h LEU 62 CO 0.00 0.00 -0.04 1.23 -0.34 0.00 0.00 178.44 179.29 2hmx h GLY 63 N 0.24 0.00 2.00 3.75 0.00 -1.47 -2.49 103.07 105.11 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 -3.25 115.11 119.93 2hmx h GLN 64 Ca -0.00 0.00 -0.34 0.00 0.77 0.00 0.00 58.65 59.07 2hmx h GLN 64 Cb 0.12 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.74 2hmx h GLN 64 CO -0.00 0.00 -2.30 -0.11 -1.93 0.00 0.00 178.83 174.49 2hmx n LEU 65 N -2.80 1.39 0.14 -2.39 7.94 0.21 -3.08 117.00 118.41 2hmx n LEU 65 Ca -0.02 -0.06 -0.14 0.00 -1.11 0.00 0.00 56.01 54.68 2hmx n LEU 65 Cb 0.07 -0.14 -0.08 0.00 0.53 0.00 0.00 43.42 43.80 2hmx n LEU 65 CO 0.17 0.66 0.76 -0.61 -1.11 0.00 0.00 177.39 177.26 2hmx h GLN 66 N 0.00 -0.28 -0.33 1.96 -0.00 -1.47 0.84 115.11 115.83 2hmx h GLN 66 Ca -0.51 0.02 0.07 0.00 -0.00 0.00 0.00 58.65 58.23 2hmx h GLN 66 Cb 1.98 0.06 -0.08 0.00 0.00 0.00 0.00 27.48 29.45 2hmx h GLN 66 CO -0.02 -0.13 -0.23 -1.35 0.00 0.00 0.00 178.83 177.09 2hmx h PRO 67 N -0.35 -0.18 0.00 -2.39 0.11 -1.79 -2.13 132.00 125.27 2hmx h PRO 67 Ca -0.03 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.09 2hmx h PRO 67 Cb 0.27 0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.42 2hmx h PRO 67 CO 0.05 -0.12 0.00 1.03 -0.21 0.00 0.00 178.00 178.75 2hmx h SER 68 N -0.19 0.00 -0.06 -2.05 0.87 0.24 -1.93 113.55 110.44 2hmx h SER 68 Ca 0.17 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.64 2hmx h SER 68 Cb 0.45 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 2hmx h SER 68 CO -0.44 0.00 -0.23 -0.07 -0.53 0.00 0.00 176.83 175.55 2hmx h LEU 69 N 0.00 0.47 -1.35 2.23 3.38 0.11 0.82 115.31 120.98 2hmx h LEU 69 Ca 0.00 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2hmx h LEU 69 Cb 0.05 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2hmx h LEU 69 CO 0.00 0.71 0.00 0.00 0.09 0.00 0.00 178.44 179.24 2hmx n GLN 70 N -4.13 0.14 -0.63 1.13 10.64 -0.72 -2.02 117.38 121.77 2hmx n GLN 70 Ca -0.00 0.62 -0.00 0.00 -1.83 0.00 0.00 57.00 55.79 2hmx n GLN 70 Cb 0.39 -1.94 -0.01 0.00 -0.86 0.00 0.00 30.24 27.83 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 -2.23 0.00 0.00 -0.39 5.66 -0.71 -4.87 114.28 111.74 2hmx n THR 71 Ca -0.01 -0.08 0.00 0.00 -3.05 0.00 0.00 64.05 60.91 2hmx n THR 71 Cb 0.04 0.31 0.00 0.00 -1.55 0.00 0.00 70.33 69.13 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 -0.45 3.78 1.09 0.00 0.28 -5.07 105.19 104.86 2hmx n GLY 72 Ca -0.02 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.62 -0.00 0.11 1.61 1.04 -1.21 -4.82 113.70 106.80 2hmx s SER 73 Ca 0.00 -0.01 0.09 0.00 0.48 0.00 0.00 55.95 56.50 2hmx s SER 73 Cb 0.00 0.01 0.44 0.00 0.10 0.00 0.00 66.02 66.57 2hmx s SER 73 CO 0.00 -0.02 1.27 -1.84 0.98 0.00 0.00 173.24 173.62 2hmx n GLU 74 N -0.72 0.05 0.05 4.02 -0.00 -1.26 -0.94 120.64 121.83 2hmx n GLU 74 Ca -0.02 0.52 0.10 0.00 -0.00 0.00 0.00 57.16 57.75 2hmx n GLU 74 Cb 0.61 -1.65 -0.07 0.00 -0.00 0.00 0.00 31.44 30.33 2hmx n GLU 74 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 2hmx n GLU 75 N -1.75 0.63 0.02 3.44 2.13 -1.26 -1.61 120.64 122.23 2hmx n GLU 75 Ca -0.00 0.01 -0.11 0.00 0.66 0.00 0.00 57.16 57.72 2hmx n GLU 75 Cb 0.04 -1.71 0.02 0.00 0.27 0.00 0.00 31.44 30.06 2hmx n GLU 75 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 2hmx h LEU 76 N 0.00 0.62 -1.79 4.31 6.46 -1.36 -1.88 115.31 121.68 2hmx h LEU 76 Ca -0.03 -0.38 -0.03 0.00 -0.12 0.00 0.00 57.88 57.32 2hmx h LEU 76 Cb 1.09 -0.18 -0.00 0.00 -0.73 0.00 0.00 40.66 40.83 2hmx h LEU 76 CO 0.00 1.12 -0.13 -0.09 -0.62 0.00 0.00 178.44 178.72 2hmx h ARG 77 N 0.39 0.00 -0.03 1.25 2.43 -0.90 0.58 114.38 118.10 2hmx h ARG 77 Ca -0.02 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 2hmx h ARG 77 Cb 1.24 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.79 2hmx h ARG 77 CO 0.12 0.13 -0.01 1.03 -1.51 0.00 0.00 179.97 179.73 2hmx h SER 78 N 0.00 0.07 -0.02 -3.80 0.87 -1.25 -2.41 113.55 107.02 2hmx h SER 78 Ca -0.00 -0.41 -0.01 0.00 -1.23 0.00 0.00 61.79 60.14 2hmx h SER 78 Cb 0.25 -0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.18 2hmx h SER 78 CO 0.02 0.46 -0.01 -0.07 -0.53 0.00 0.00 176.83 176.71 2hmx h LEU 79 N -0.33 0.07 -0.14 2.23 -0.00 -0.95 -1.99 115.31 114.19 2hmx h LEU 79 Ca 0.01 -0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.76 2hmx h LEU 79 Cb 0.44 -0.02 0.00 0.00 -0.00 0.00 0.00 40.66 41.08 2hmx h LEU 79 CO 0.00 0.10 -0.37 0.22 -0.00 0.00 0.00 178.44 178.39 2hmx h TYR 80 N 0.08 0.65 -0.41 1.13 3.20 0.46 0.16 116.97 122.24 2hmx h TYR 80 Ca 0.02 -0.25 -0.01 0.00 3.14 0.00 0.00 58.73 61.63 2hmx h TYR 80 Cb 0.07 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 2hmx h TYR 80 CO 0.00 0.99 0.21 -2.95 -1.64 0.00 0.00 178.16 174.77 2hmx h ASN 81 N 0.12 0.50 1.69 -2.11 7.08 -0.88 0.35 115.58 122.34 2hmx h ASN 81 Ca -0.01 -0.03 -0.06 0.00 -3.08 0.00 0.00 56.30 53.12 2hmx h ASN 81 Cb 0.99 -0.13 -0.01 0.00 -2.08 0.00 0.00 38.32 37.09 2hmx h ASN 81 CO 0.08 0.42 -0.31 0.71 -2.08 0.00 0.00 177.43 176.25 2hmx h THR 82 N 0.57 0.49 0.08 6.14 1.35 -1.31 0.64 112.91 120.87 2hmx h THR 82 Ca 0.15 -1.70 -0.21 0.00 -0.55 0.00 0.00 66.41 64.10 2hmx h THR 82 Cb 0.04 2.23 -0.00 0.00 -1.73 0.00 0.00 68.15 68.69 2hmx h THR 82 CO -0.02 0.28 -1.04 0.40 -0.25 0.00 0.00 175.52 174.89 2hmx h ILE 83 N 0.00 1.22 -0.57 6.82 1.08 0.93 0.57 117.51 127.55 2hmx h ILE 83 Ca -0.00 -2.37 0.00 0.00 -0.39 0.00 0.00 64.86 62.10 2hmx h ILE 83 Cb 1.22 2.82 -0.03 0.00 -3.07 0.00 0.00 36.82 37.77 2hmx h ILE 83 CO 0.04 0.62 0.38 0.00 -0.69 0.00 0.00 178.15 178.49 2hmx h ALA 84 N -0.10 0.73 0.05 1.87 0.00 -0.34 0.59 119.26 122.05 2hmx h ALA 84 Ca -0.23 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 2hmx h ALA 84 Cb 1.52 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2hmx h ALA 84 CO 0.01 0.17 -0.02 0.28 0.00 0.00 0.00 179.25 179.69 2hmx h VAL 85 N 0.78 0.98 0.00 0.00 2.07 -0.77 0.19 116.25 119.50 2hmx h VAL 85 Ca 0.21 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.63 2hmx h VAL 85 Cb -0.08 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 2hmx h VAL 85 CO -0.04 0.03 0.00 0.25 0.02 0.00 0.00 177.57 177.82 2hmx h LEU 86 N -0.11 0.00 -0.01 2.57 5.85 0.96 0.97 115.31 125.54 2hmx h LEU 86 Ca -0.01 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2hmx h LEU 86 Cb 0.09 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.12 2hmx h LEU 86 CO 0.01 0.00 -0.05 0.22 -0.34 0.00 0.00 178.44 178.28 2hmx h TYR 87 N 0.00 0.07 0.00 1.25 5.03 0.31 0.38 116.97 124.01 2hmx h TYR 87 Ca 0.00 -0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.28 2hmx h TYR 87 Cb 0.29 -0.01 0.00 0.00 1.55 0.00 0.00 36.73 38.56 2hmx h TYR 87 CO 0.00 0.72 -0.50 0.00 -1.32 0.00 0.00 178.16 177.06 2hmx h VAL 89 N 0.00 1.44 0.00 0.00 2.07 0.39 0.59 116.25 120.73 2hmx h VAL 89 Ca 0.00 -1.30 -0.00 0.00 0.82 0.00 0.00 66.70 66.22 2hmx h VAL 89 Cb 0.86 2.31 -0.00 0.00 -1.52 0.00 0.00 31.29 32.94 2hmx h VAL 89 CO 0.00 0.34 -0.00 0.45 0.02 0.00 0.00 177.57 178.38 2hmx h HIS 90 N -0.53 0.00 -0.29 1.57 -0.00 0.47 -2.50 115.15 113.87 2hmx h HIS 90 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 60.37 60.28 2hmx h HIS 90 Cb 0.56 0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 27.92 2hmx h HIS 90 CO 0.12 0.00 -0.02 0.94 -0.00 0.00 0.00 177.93 178.97 2hmx n GLN 91 N -3.24 2.31 0.00 2.45 -0.06 0.00 -4.75 117.38 114.10 2hmx n GLN 91 Ca -0.03 -2.98 0.00 0.00 -2.00 0.00 0.00 57.00 51.99 2hmx n GLN 91 Cb 0.09 -1.81 0.00 0.00 -4.06 0.00 0.00 30.24 24.46 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 -0.86 0.00 -1.55 3.69 0.00 -0.94 -4.97 116.66 112.04 2hmx n ARG 92 Ca 0.27 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.77 2hmx n ARG 92 Cb 0.95 0.00 0.08 0.00 0.00 0.00 0.00 32.46 33.49 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 -0.84 2.35 0.13 5.15 1.09 0.20 -4.93 121.20 124.35 2hmx s ILE 93 Ca 0.00 0.18 0.05 0.00 -1.10 0.00 0.00 60.65 59.79 2hmx s ILE 93 Cb 0.00 -2.82 -0.04 0.00 -1.06 0.00 0.00 42.46 38.54 2hmx s ILE 93 CO 0.00 -0.08 -0.13 1.51 -0.10 0.00 0.00 174.94 176.14 2hmx s ASP 94 N -1.93 1.94 0.34 3.58 1.47 -1.26 -2.74 116.67 118.06 2hmx s ASP 94 Ca 0.75 -0.87 0.04 0.00 1.18 0.00 0.00 52.55 53.65 2hmx s ASP 94 Cb -0.30 -0.05 -0.01 0.00 -0.34 0.00 0.00 42.92 42.22 2hmx s ASP 94 CO 0.43 -0.20 0.13 1.33 0.68 0.00 0.00 175.17 177.54 2hmx n VAL 95 N 0.32 0.00 0.00 2.11 0.24 -1.26 -5.04 118.33 114.70 2hmx n VAL 95 Ca -0.14 -2.00 0.00 0.00 -2.04 0.00 0.00 64.34 60.16 2hmx n VAL 95 Cb 0.58 0.73 0.00 0.00 -1.47 0.00 0.00 33.84 33.68 2hmx n VAL 95 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2hmx n LYS 96 N -0.76 0.00 -2.05 7.34 5.02 -1.26 -4.90 118.16 121.55 2hmx n LYS 96 Ca -0.04 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.18 2hmx n LYS 96 Cb 0.51 -0.03 0.00 0.00 -0.02 0.00 0.00 35.03 35.50 2hmx n LYS 96 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2hmx n ASP 97 N -2.03 1.33 0.51 4.39 5.75 -1.26 -1.17 116.55 124.07 2hmx n ASP 97 Ca 0.00 -1.52 -0.20 0.00 -0.01 0.00 0.00 54.79 53.06 2hmx n ASP 97 Cb 0.00 -0.03 -0.10 0.00 -1.03 0.00 0.00 41.12 39.96 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 0.45 0.00 0.00 2.12 2.02 -0.15 -1.36 112.91 115.99 2hmx h THR 98 Ca -0.10 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 2hmx h THR 98 Cb 0.36 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.77 2hmx h THR 98 CO 0.15 0.00 -0.01 0.50 0.37 0.00 0.00 175.52 176.52 2hmx h LYS 99 N -1.30 0.00 0.00 6.66 1.63 -1.92 0.60 116.57 122.24 2hmx h LYS 99 Ca -0.13 0.00 -0.28 0.00 -0.85 0.00 0.00 60.65 59.39 2hmx h LYS 99 Cb 1.00 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 32.58 2hmx h LYS 99 CO 0.20 0.01 -1.67 0.93 -3.45 0.00 0.00 179.45 175.48 2hmx h GLU 100 N 0.00 0.00 0.35 1.90 4.39 -1.93 -1.69 114.58 117.59 2hmx h GLU 100 Ca -0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 2hmx h GLU 100 Cb 0.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 2hmx h GLU 100 CO 0.00 0.50 -0.17 0.00 -1.16 0.00 0.00 179.01 178.19 2hmx h ALA 101 N 1.01 -0.47 0.00 3.43 0.00 -0.85 -2.30 119.26 120.09 2hmx h ALA 101 Ca -0.27 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2hmx h ALA 101 Cb 1.99 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.96 2hmx h ALA 101 CO 0.08 -0.51 0.00 1.25 0.00 0.00 0.00 179.25 180.07 2hmx h LEU 102 N -0.97 0.00 0.00 0.00 5.85 0.24 1.01 115.31 121.44 2hmx h LEU 102 Ca -0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.67 2hmx h LEU 102 Cb 0.52 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.55 2hmx h LEU 102 CO 0.08 0.00 -0.08 -0.78 -0.34 0.00 0.00 178.44 177.32 2hmx h ASP 103 N 0.00 0.00 0.00 1.25 3.58 -1.42 -2.41 116.42 117.42 2hmx h ASP 103 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2hmx h ASP 103 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2hmx h ASP 103 CO 0.00 0.39 0.10 0.50 -2.88 0.00 0.00 179.24 177.34 2hmx h LYS 104 N -0.69 0.00 0.00 0.28 1.63 0.13 0.68 116.57 118.60 2hmx h LYS 104 Ca 0.00 0.00 -0.10 0.00 -0.85 0.00 0.00 60.65 59.70 2hmx h LYS 104 Cb 0.08 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.70 2hmx h LYS 104 CO 0.00 0.00 -0.66 0.82 -3.45 0.00 0.00 179.45 176.16 2hmx h ILE 105 N 0.00 0.85 -0.56 2.00 5.03 0.13 -2.36 117.51 122.60 2hmx h ILE 105 Ca 0.00 -1.85 -0.08 0.00 -0.12 0.00 0.00 64.86 62.80 2hmx h ILE 105 Cb 0.19 1.82 -0.02 0.00 -3.03 0.00 0.00 36.82 35.78 2hmx h ILE 105 CO 0.00 0.29 0.02 -0.08 -0.68 0.00 0.00 178.15 177.70 2hmx h GLU 106 N -1.00 0.93 0.00 2.37 4.22 0.00 0.44 114.58 121.54 2hmx h GLU 106 Ca -0.16 -0.26 -0.18 0.00 0.08 0.00 0.00 59.36 58.84 2hmx h GLU 106 Cb 0.93 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.04 2hmx h GLU 106 CO -0.09 0.91 -1.25 1.49 -2.18 0.00 0.00 179.01 177.88 2hmx h GLU 107 N 0.87 0.00 0.00 1.92 4.22 0.06 -3.43 114.58 118.22 2hmx h GLU 107 Ca 0.17 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.61 2hmx h GLU 107 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2hmx h GLU 107 CO 0.02 0.41 -0.76 0.39 -2.18 0.00 0.00 179.01 176.89 2hmx n GLU 108 N -3.01 0.00 0.00 1.92 -0.58 -0.93 -4.99 120.64 113.05 2hmx n GLU 108 Ca -0.08 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 2hmx n GLU 108 Cb 0.86 -0.43 0.00 0.00 -0.57 0.00 0.00 31.44 31.29 2hmx n GLU 108 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 2hmx n GLN 109 N -2.82 -0.65 -0.33 3.49 0.00 0.15 -4.95 117.38 112.27 2hmx n GLN 109 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.00 56.70 2hmx n GLN 109 Cb 0.38 0.00 0.29 0.00 0.00 0.00 0.00 30.24 30.91 2hmx n GLN 109 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2hmx n ASN 110 N -2.65 -3.19 -2.35 1.69 4.13 -1.26 -4.68 115.26 106.95 2hmx n ASN 110 Ca 0.00 -0.58 -0.02 0.00 1.68 0.00 0.00 54.58 55.66 2hmx n ASN 110 Cb 0.00 -1.11 -0.02 0.00 -1.54 0.00 0.00 39.78 37.11 2hmx n ASN 110 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2hmx n LYS 111 N -5.50 -4.63 -0.45 3.52 4.76 -1.26 -4.86 118.16 109.73 2hmx n LYS 111 Ca 0.08 3.44 -0.30 0.00 -2.87 0.00 0.00 58.31 58.66 2hmx n LYS 111 Cb 0.58 -4.58 0.28 0.00 -1.84 0.00 0.00 35.03 29.47 2hmx n LYS 111 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2hmx s SER 112 N -0.58 -0.75 0.45 4.39 0.01 -1.26 -4.88 113.70 111.07 2hmx s SER 112 Ca -0.11 0.88 0.25 0.00 1.31 0.00 0.00 55.95 58.28 2hmx s SER 112 Cb 0.01 -1.26 0.56 0.00 0.21 0.00 0.00 66.02 65.54 2hmx s SER 112 CO 0.29 -5.18 1.69 0.11 0.41 0.00 0.00 173.24 170.56 2hmx h LYS 113 N -3.29 0.00 0.00 12.44 1.57 -1.94 -3.31 116.57 122.04 2hmx h LYS 113 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 2hmx h LYS 113 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.65 2hmx h LYS 113 CO 0.30 0.06 -0.42 0.36 -0.57 0.00 0.00 179.45 179.18 2hmx n LYS 114 N -3.13 0.00 0.00 3.15 2.85 -1.26 -5.05 118.16 114.72 2hmx n LYS 114 Ca 0.03 -0.88 0.00 0.00 -1.05 0.00 0.00 58.31 56.41 2hmx n LYS 114 Cb 0.50 -0.45 0.00 0.00 -0.65 0.00 0.00 35.03 34.42 2hmx n LYS 114 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2hmx n LYS 115 N 0.00 0.00 0.03 -1.58 5.02 -1.25 -4.03 118.16 116.36 2hmx n LYS 115 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2hmx n LYS 115 Cb 0.67 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.68 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 0.59 0.00 0.00 7.82 0.00 -1.26 -4.77 120.51 122.89 2hmx n ALA 116 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hmx n ALA 116 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2hmx n ALA 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2hmx n GLN 117 N -2.30 0.00 -2.10 0.00 1.13 -1.26 -4.74 117.38 108.12 2hmx n GLN 117 Ca 0.00 0.00 -0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2hmx n GLN 117 Cb 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 30.24 30.35 2hmx n GLN 117 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 2hmx n GLN 118 N 0.00 -1.79 -3.04 -1.09 7.27 -1.26 -4.45 117.38 113.02 2hmx n GLN 118 Ca 0.00 1.67 -0.21 0.00 0.07 0.00 0.00 57.00 58.53 2hmx n GLN 118 Cb 0.00 -3.17 0.04 0.00 2.41 0.00 0.00 30.24 29.52 2hmx n GLN 118 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2hmx n ALA 119 N 0.39 -0.94 -3.74 1.69 0.00 -1.26 -4.99 120.51 111.66 2hmx n ALA 119 Ca -0.02 0.28 -0.23 0.00 0.00 0.00 0.00 53.44 53.47 2hmx n ALA 119 Cb 0.03 -3.86 -0.17 0.00 0.00 0.00 0.00 19.45 15.44 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 -3.16 0.65 -0.12 0.00 0.00 -1.26 -5.04 121.76 112.83 2hmx s ALA 120 Ca 0.32 -0.18 -0.04 0.00 0.00 0.00 0.00 51.96 52.05 2hmx s ALA 120 Cb -0.14 -0.82 -0.01 0.00 0.00 0.00 0.00 23.12 22.15 2hmx s ALA 120 CO 0.39 -0.64 -0.08 0.00 0.00 0.00 0.00 175.76 175.44 2hmx h ALA 121 N 8.34 0.00 0.00 0.00 0.00 -1.97 -3.48 119.26 122.14 2hmx h ALA 121 Ca -0.17 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2hmx h ALA 121 Cb 1.13 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2hmx h ALA 121 CO 0.26 0.23 0.00 -3.47 0.00 0.00 0.00 179.25 176.27 2hmx n ASP 122 N -4.71 0.00 -0.82 0.00 -0.08 -1.26 -5.17 116.55 104.51 2hmx n ASP 122 Ca -0.03 0.00 0.02 0.00 -1.51 0.00 0.00 54.79 53.27 2hmx n ASP 122 Cb 0.12 0.10 -0.01 0.00 2.34 0.00 0.00 41.12 43.67 2hmx n ASP 122 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2hmx n THR 123 N -1.52 -1.32 -2.49 5.18 -1.04 -1.26 -4.56 114.28 107.27 2hmx n THR 123 Ca 0.00 0.72 -0.40 0.00 -2.04 0.00 0.00 64.05 62.32 2hmx n THR 123 Cb 0.00 -1.18 -0.01 0.00 -1.82 0.00 0.00 70.33 67.32 2hmx n THR 123 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2hmx s GLY 124 N -4.59 1.34 -0.70 3.41 0.00 -1.26 -4.91 107.32 100.61 2hmx s GLY 124 Ca 0.00 -2.66 -0.08 0.00 0.00 0.00 0.00 44.72 41.98 2hmx s GLY 124 CO 0.00 2.85 0.58 0.21 0.00 0.00 0.00 173.10 176.74 2hmx s ASN 125 N 4.77 5.94 -0.39 1.64 2.47 -1.26 -4.92 114.94 123.18 2hmx s ASN 125 Ca 0.55 -2.72 0.10 0.00 0.42 0.00 0.00 52.86 51.21 2hmx s ASN 125 Cb 0.02 -2.02 0.31 0.00 -1.45 0.00 0.00 41.25 38.11 2hmx s ASN 125 CO 0.05 -0.48 0.68 -0.46 -3.72 0.00 0.00 177.10 173.17 2hmx n ASN 126 N 3.80 0.25 -1.72 -4.21 6.94 -1.26 -5.07 115.26 113.99 2hmx n ASN 126 Ca 0.09 -2.94 0.00 0.00 -0.02 0.00 0.00 54.58 51.71 2hmx n ASN 126 Cb 0.42 -0.39 0.00 0.00 -2.36 0.00 0.00 39.78 37.45 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 0.76 -7.22 -4.56 0.53 7.64 -1.26 -4.84 113.62 104.68 2hmx n SER 127 Ca 0.22 1.08 -0.41 0.00 1.01 0.00 0.00 58.87 60.76 2hmx n SER 127 Cb 0.61 -4.02 -0.03 0.00 -1.01 0.00 0.00 64.21 59.76 2hmx n SER 127 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hmx s GLN 128 N -1.21 3.30 0.04 1.43 -2.07 -1.26 -4.83 119.66 115.06 2hmx s GLN 128 Ca 0.00 -0.09 0.22 0.00 -1.82 0.00 0.00 55.36 53.67 2hmx s GLN 128 Cb 0.00 -4.12 -0.13 0.00 -1.09 0.00 0.00 33.01 27.66 2hmx s GLN 128 CO 0.00 -1.98 0.82 1.55 -1.32 0.00 0.00 175.29 174.36 2hmx n VAL 129 N 6.46 0.16 0.00 3.63 3.14 -1.26 -4.96 118.33 125.50 2hmx n VAL 129 Ca 0.05 -0.35 0.00 0.00 -2.96 0.00 0.00 64.34 61.08 2hmx n VAL 129 Cb 0.49 0.15 0.00 0.00 -1.06 0.00 0.00 33.84 33.42 2hmx n VAL 129 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2hmx n SER 130 N -2.12 0.00 0.00 6.55 2.88 -1.26 -4.80 113.62 114.87 2hmx n SER 130 Ca -0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2hmx n SER 130 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 2hmx n SER 130 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2hmx n GLN 131 N 0.00 0.00 0.00 -1.46 6.02 -1.26 -4.29 117.38 116.39 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 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 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 2.84 0.00 0.00 1.08 3.02 -1.26 -5.34 115.26 115.60 2hmx n ASN 132 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 2hmx n ASN 132 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2hmx n ASN 132 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64