#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 -1.25 0.00 -0.41 -0.00 -1.26 -4.65 117.12 109.54 2hmx n MET 2 Ca 0.00 0.60 0.00 0.00 -0.00 0.00 0.00 57.70 58.30 2hmx n MET 2 Cb 0.00 -4.76 0.00 0.00 -0.00 0.00 0.00 33.22 28.46 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 -0.17 1.77 2.75 3.17 0.00 -1.26 -4.60 105.19 106.85 2hmx n GLY 3 Ca -0.10 -0.18 -0.07 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.04 -0.86 4.61 0.00 -1.26 -3.75 120.51 113.21 2hmx n ALA 4 Ca 0.00 1.08 0.00 0.00 0.00 0.00 0.00 53.44 54.52 2hmx n ALA 4 Cb 0.00 -3.44 0.00 0.00 0.00 0.00 0.00 19.45 16.01 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 -0.27 0.00 -3.63 0.00 1.74 -1.26 -4.45 116.66 108.78 2hmx n ARG 5 Ca 0.11 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.14 2hmx n ARG 5 Cb 0.41 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.80 2hmx n ARG 5 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2hmx s ALA 6 N -1.00 -2.10 0.18 7.54 0.00 -1.25 -5.17 121.76 119.96 2hmx s ALA 6 Ca 0.00 1.78 0.00 0.00 0.00 0.00 0.00 51.96 53.74 2hmx s ALA 6 Cb 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 23.12 21.68 2hmx s ALA 6 CO 0.00 -0.21 0.00 0.45 0.00 0.00 0.00 175.76 176.00 2hmx n SER 7 N 0.99 0.00 0.42 0.00 2.88 -1.25 -5.04 113.62 111.62 2hmx n SER 7 Ca -0.06 -0.43 -0.17 0.00 -1.33 0.00 0.00 58.87 56.89 2hmx n SER 7 Cb 0.58 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.96 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 -0.08 0.00 -4.99 2.46 2.07 -1.97 -3.48 116.25 110.26 2hmx h VAL 8 Ca 0.00 -0.07 -0.21 0.00 0.82 0.00 0.00 66.70 67.24 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 -0.05 0.18 0.02 0.00 0.00 177.57 177.72 2hmx n LEU 9 N -5.11 0.00 0.00 2.57 4.77 -1.26 -4.91 117.00 113.06 2hmx n LEU 9 Ca -0.13 -1.07 -0.20 0.00 -0.03 0.00 0.00 56.01 54.57 2hmx n LEU 9 Cb 0.43 -0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.36 2hmx n LEU 9 CO 0.32 -0.54 -0.07 -1.54 -1.33 0.00 0.00 177.39 174.24 2hmx n SER 10 N -2.52 2.61 0.30 -1.43 3.41 -1.26 -4.93 113.62 109.80 2hmx n SER 10 Ca 0.05 -2.41 -0.12 0.00 -0.26 0.00 0.00 58.87 56.13 2hmx n SER 10 Cb 0.25 0.12 -0.06 0.00 -0.26 0.00 0.00 64.21 64.26 2hmx n SER 10 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2hmx h GLY 11 N 0.66 -0.80 1.01 5.00 0.00 -1.97 0.58 103.07 107.54 2hmx h GLY 11 Ca -0.26 0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 2hmx h GLY 11 CO 0.43 -0.29 0.47 -1.33 0.00 0.00 0.00 176.54 175.82 2hmx h GLY 12 N -0.81 1.14 1.74 4.60 0.00 -1.98 -2.49 103.07 105.27 2hmx h GLY 12 Ca -0.08 -0.48 -0.09 0.00 0.00 0.00 0.00 47.33 46.68 2hmx h GLY 12 CO 0.13 0.47 -0.32 0.83 0.00 0.00 0.00 176.54 177.65 2hmx h GLU 13 N 1.08 0.30 0.67 4.80 5.08 -1.81 0.51 114.58 125.20 2hmx h GLU 13 Ca 0.28 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 2hmx h GLU 13 Cb -0.03 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.21 2hmx h GLU 13 CO -0.05 0.59 -0.32 1.25 -1.00 0.00 0.00 179.01 179.48 2hmx h LEU 14 N 0.26 -0.76 -0.82 1.33 7.12 0.41 0.57 115.31 123.42 2hmx h LEU 14 Ca 0.03 0.03 0.00 0.00 0.13 0.00 0.00 57.88 58.07 2hmx h LEU 14 Cb 0.69 0.20 0.00 0.00 -0.53 0.00 0.00 40.66 41.02 2hmx h LEU 14 CO 0.05 -0.51 0.00 -0.67 -0.13 0.00 0.00 178.44 177.19 2hmx n ASP 15 N -4.61 0.34 -0.02 1.25 -0.08 -0.88 0.97 116.55 113.52 2hmx n ASP 15 Ca -0.11 0.65 -0.00 0.00 -1.51 0.00 0.00 54.79 53.82 2hmx n ASP 15 Cb 0.35 -0.70 -0.12 0.00 2.34 0.00 0.00 41.12 42.99 2hmx n ASP 15 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2hmx n LYS 16 N -1.95 0.65 0.21 -0.67 4.76 0.17 -3.89 118.16 117.45 2hmx n LYS 16 Ca -0.01 0.05 0.15 0.00 -2.87 0.00 0.00 58.31 55.63 2hmx n LYS 16 Cb 0.03 -1.66 0.55 0.00 -1.84 0.00 0.00 35.03 32.12 2hmx n LYS 16 CO 0.00 0.00 0.00 2.35 -1.37 0.00 0.00 177.40 178.38 2hmx h TRP 17 N 0.00 0.00 -0.75 2.13 2.91 0.62 -3.31 115.95 117.54 2hmx h TRP 17 Ca -0.24 0.00 -0.38 0.00 1.13 0.00 0.00 58.89 59.41 2hmx h TRP 17 Cb 1.63 0.00 -0.23 0.00 -0.51 0.00 0.00 29.16 30.06 2hmx h TRP 17 CO 0.00 0.00 0.48 0.39 -1.03 0.00 0.00 178.44 178.28 2hmx n GLU 18 N -2.71 2.08 0.00 2.65 -0.58 0.10 -3.99 120.64 118.19 2hmx n GLU 18 Ca 0.02 -2.33 0.00 0.00 -0.42 0.00 0.00 57.16 54.43 2hmx n GLU 18 Cb 0.30 -1.92 0.00 0.00 -0.57 0.00 0.00 31.44 29.25 2hmx n GLU 18 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 2hmx n LYS 19 N -0.70 0.00 -3.06 3.49 4.81 -0.41 -4.67 118.16 117.62 2hmx n LYS 19 Ca 0.45 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.46 2hmx n LYS 19 Cb 1.39 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 36.37 2hmx n LYS 19 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2hmx s ILE 20 N 0.00 4.77 0.20 3.15 1.09 -0.84 -4.68 121.20 124.89 2hmx s ILE 20 Ca 0.00 0.22 -0.31 0.00 -1.10 0.00 0.00 60.65 59.45 2hmx s ILE 20 Cb 0.00 -4.24 -0.11 0.00 -1.06 0.00 0.00 42.46 37.05 2hmx s ILE 20 CO 0.00 -0.63 1.61 -0.60 -0.10 0.00 0.00 174.94 175.22 2hmx s ARG 21 N 2.97 4.18 -0.19 2.79 6.06 0.14 0.62 118.95 135.52 2hmx s ARG 21 Ca 0.25 2.46 0.15 0.00 -2.50 0.00 0.00 55.73 56.09 2hmx s ARG 21 Cb -0.13 -3.11 0.40 0.00 0.06 0.00 0.00 34.95 32.17 2hmx s ARG 21 CO 0.20 -0.64 1.27 1.47 -2.50 0.00 0.00 175.30 175.10 2hmx n LEU 22 N 3.67 3.04 0.00 -0.88 -0.00 -0.87 -0.95 117.00 121.01 2hmx n LEU 22 Ca 0.13 -3.38 0.00 0.00 -0.00 0.00 0.00 56.01 52.76 2hmx n LEU 22 Cb 0.37 -0.51 0.00 0.00 -0.00 0.00 0.00 43.42 43.28 2hmx n LEU 22 CO 0.62 0.96 0.00 -2.11 -0.00 0.00 0.00 177.39 176.86 2hmx n ARG 23 N -1.13 0.00 0.05 1.47 1.85 -1.25 -4.88 116.66 112.77 2hmx n ARG 23 Ca 0.21 0.00 0.05 0.00 -1.00 0.00 0.00 57.85 57.10 2hmx n ARG 23 Cb 0.77 0.00 0.22 0.00 -1.05 0.00 0.00 32.46 32.40 2hmx n ARG 23 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2hmx n PRO 24 N 0.00 0.05 -0.50 2.89 -0.02 -1.26 0.58 135.00 136.74 2hmx n PRO 24 Ca 0.00 0.49 0.05 0.00 -2.02 0.00 0.00 63.50 62.01 2hmx n PRO 24 Cb 0.00 -1.63 0.22 0.00 -0.02 0.00 0.00 33.50 32.06 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 -1.11 4.51 0.00 -1.23 0.00 -1.26 -4.49 105.19 101.61 2hmx n GLY 25 Ca 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.89 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 -0.90 0.00 2.34 -0.02 0.00 0.20 -5.02 105.19 101.79 2hmx n GLY 26 Ca 0.24 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.77 -1.33 -3.12 1.61 5.02 0.92 -5.01 118.16 115.48 2hmx n LYS 27 Ca 0.00 0.84 -0.19 0.00 -2.02 0.00 0.00 58.31 56.94 2hmx n LYS 27 Cb 0.10 -5.26 0.03 0.00 -0.02 0.00 0.00 35.03 29.88 2hmx n LYS 27 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2hmx s LYS 28 N -4.71 2.48 -0.17 1.97 3.01 -1.24 -5.02 119.74 116.07 2hmx s LYS 28 Ca 0.00 -1.53 -0.35 0.00 -1.01 0.00 0.00 55.97 53.07 2hmx s LYS 28 Cb 0.00 -2.63 0.15 0.00 -1.01 0.00 0.00 37.83 34.34 2hmx s LYS 28 CO 0.00 -0.61 1.39 1.14 0.51 0.00 0.00 175.35 177.78 2hmx s GLN 29 N -4.51 0.07 0.46 1.68 0.00 -1.26 -2.04 119.66 114.06 2hmx s GLN 29 Ca 0.57 -0.03 -0.21 0.00 -0.00 0.00 0.00 55.36 55.68 2hmx s GLN 29 Cb -0.07 0.03 -0.09 0.00 0.00 0.00 0.00 33.01 32.88 2hmx s GLN 29 CO 0.35 -0.03 1.02 0.71 0.00 0.00 0.00 175.29 177.34 2hmx s TYR 30 N -2.08 3.11 0.00 9.60 1.51 0.20 -4.72 117.35 124.98 2hmx s TYR 30 Ca 0.13 1.60 0.00 0.00 -1.01 0.00 0.00 57.07 57.79 2hmx s TYR 30 Cb 0.04 -3.02 0.00 0.00 -0.11 0.00 0.00 41.96 38.86 2hmx s TYR 30 CO -0.05 -0.62 0.00 1.63 -1.11 0.00 0.00 175.55 175.40 2hmx n LYS 31 N -0.75 1.06 0.08 -0.62 5.02 -1.26 -1.29 118.16 120.40 2hmx n LYS 31 Ca 0.08 0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.47 2hmx n LYS 31 Cb 0.52 0.00 0.42 0.00 -0.02 0.00 0.00 35.03 35.95 2hmx n LYS 31 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2hmx n LEU 32 N 0.00 0.40 0.20 -0.35 4.77 -1.26 -0.20 117.00 120.56 2hmx n LEU 32 Ca 0.00 0.60 0.08 0.00 -0.03 0.00 0.00 56.01 56.66 2hmx n LEU 32 Cb 0.00 -0.54 0.37 0.00 -2.33 0.00 0.00 43.42 40.91 2hmx n LEU 32 CO 0.00 -0.43 0.73 0.50 -1.33 0.00 0.00 177.39 176.86 2hmx h LYS 33 N 0.00 0.00 0.08 3.23 3.64 -1.97 0.57 116.57 122.11 2hmx h LYS 33 Ca 0.00 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.19 2hmx h LYS 33 Cb 0.32 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.16 2hmx h LYS 33 CO 0.00 0.29 -0.78 0.45 -2.27 0.00 0.00 179.45 177.14 2hmx h HIS 34 N 0.00 0.64 0.16 1.91 3.86 -0.96 -2.08 115.15 118.68 2hmx h HIS 34 Ca -0.00 -0.40 -0.01 0.00 -1.16 0.00 0.00 60.37 58.80 2hmx h HIS 34 Cb 0.87 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 29.29 2hmx h HIS 34 CO 0.00 1.26 -0.08 0.97 0.86 0.00 0.00 177.93 180.95 2hmx h ILE 35 N -0.16 0.90 -0.28 2.45 2.10 -1.01 0.57 117.51 122.08 2hmx h ILE 35 Ca -0.12 -0.22 -0.04 0.00 1.08 0.00 0.00 64.86 65.56 2hmx h ILE 35 Cb 1.53 1.03 -0.02 0.00 -1.09 0.00 0.00 36.82 38.28 2hmx h ILE 35 CO 0.15 0.05 -0.01 0.58 -1.08 0.00 0.00 178.15 177.84 2hmx h VAL 36 N -0.31 1.17 0.65 2.19 2.07 0.05 0.58 116.25 122.65 2hmx h VAL 36 Ca -0.02 -0.69 -0.03 0.00 0.82 0.00 0.00 66.70 66.78 2hmx h VAL 36 Cb 0.25 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 2hmx h VAL 36 CO 0.04 0.23 -0.42 -0.25 0.02 0.00 0.00 177.57 177.18 2hmx h TRP 37 N 0.41 -1.13 0.21 1.57 7.01 -1.32 -1.26 115.95 121.43 2hmx h TRP 37 Ca 0.09 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.07 2hmx h TRP 37 Cb 0.29 0.41 0.00 0.00 -2.10 0.00 0.00 29.16 27.76 2hmx h TRP 37 CO 0.01 -0.63 -0.10 0.00 -2.79 0.00 0.00 178.44 174.93 2hmx h ALA 38 N -0.79 -1.02 0.00 2.65 0.00 0.60 0.12 119.26 120.81 2hmx h ALA 38 Ca -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2hmx h ALA 38 Cb 0.83 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2hmx h ALA 38 CO 0.06 -1.00 0.04 1.03 0.00 0.00 0.00 179.25 179.39 2hmx h SER 39 N -0.29 0.00 0.16 0.00 0.87 0.07 0.36 113.55 114.73 2hmx h SER 39 Ca -0.03 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.52 2hmx h SER 39 Cb 0.22 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 2hmx h SER 39 CO 0.05 0.00 -0.08 -0.09 -0.53 0.00 0.00 176.83 176.18 2hmx h ARG 40 N 0.00 -0.21 0.00 2.24 2.43 -1.17 -2.44 114.38 115.22 2hmx h ARG 40 Ca 0.00 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2hmx h ARG 40 Cb 0.08 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2hmx h ARG 40 CO 0.00 -0.14 -0.02 1.49 -1.51 0.00 0.00 179.97 179.79 2hmx h GLU 41 N -0.37 0.00 0.00 0.20 4.57 0.83 0.15 114.58 119.95 2hmx h GLU 41 Ca -0.02 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 2hmx h GLU 41 Cb 0.17 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.76 2hmx h GLU 41 CO 0.04 0.02 0.00 -0.11 -1.18 0.00 0.00 179.01 177.78 2hmx n LEU 42 N -3.95 0.01 0.34 1.64 7.94 0.11 0.32 117.00 123.41 2hmx n LEU 42 Ca -0.03 0.94 0.22 0.00 -1.11 0.00 0.00 56.01 56.04 2hmx n LEU 42 Cb 0.10 -0.49 1.18 0.00 0.53 0.00 0.00 43.42 44.75 2hmx n LEU 42 CO 0.29 -0.49 1.18 -0.08 -1.11 0.00 0.00 177.39 177.18 2hmx h GLU 43 N 0.00 0.00 0.00 1.96 4.22 -0.83 0.69 114.58 120.62 2hmx h GLU 43 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2hmx h GLU 43 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2hmx h GLU 43 CO 0.00 0.00 -1.21 -2.13 -2.18 0.00 0.00 179.01 173.49 2hmx n ARG 44 N -3.12 0.17 0.38 1.92 0.00 0.45 -1.40 116.66 115.05 2hmx n ARG 44 Ca -0.03 -0.05 -0.15 0.00 -0.00 0.00 0.00 57.85 57.63 2hmx n ARG 44 Cb 0.09 -1.51 -0.07 0.00 0.00 0.00 0.00 32.46 30.97 2hmx n ARG 44 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.63 178.37 2hmx h PHE 45 N 0.00 -0.90 0.00 -0.14 -1.00 0.22 -3.46 116.94 111.67 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 0.63 0.30 0.00 0.00 3.61 0.00 0.00 35.95 40.48 2hmx h PHE 45 CO 0.00 -0.56 0.00 0.00 -1.61 0.00 0.00 178.31 176.14 2hmx n ALA 46 N -2.53 0.37 -2.49 2.45 0.00 -0.86 -5.09 120.51 112.37 2hmx n ALA 46 Ca -0.12 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.09 2hmx n ALA 46 Cb 0.38 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.73 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 1.73 -0.07 0.00 1.01 -0.49 -5.00 120.40 117.58 2hmx s VAL 47 Ca 0.00 -2.10 0.03 0.00 0.00 0.00 0.00 61.98 59.91 2hmx s VAL 47 Cb 0.00 -2.64 -0.02 0.00 0.00 0.00 0.00 36.38 33.71 2hmx s VAL 47 CO 0.00 -0.18 -0.13 0.21 0.00 0.00 0.00 175.10 175.00 2hmx s ASN 48 N -3.53 4.08 -0.00 3.32 3.84 -1.26 -4.23 114.94 117.17 2hmx s ASN 48 Ca 0.32 -0.21 -0.24 0.00 0.21 0.00 0.00 52.86 52.94 2hmx s ASN 48 Cb 0.05 -1.04 -0.16 0.00 -0.55 0.00 0.00 41.25 39.55 2hmx s ASN 48 CO 0.14 0.31 1.16 1.55 -2.79 0.00 0.00 177.10 177.48 2hmx h PRO 49 N 5.63 -0.40 0.00 0.43 0.13 -1.92 -1.98 132.00 133.90 2hmx h PRO 49 Ca -0.42 0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.72 2hmx h PRO 49 Cb 1.17 0.09 -0.00 0.00 0.13 0.00 0.00 31.00 32.39 2hmx h PRO 49 CO 0.52 -0.07 -0.07 0.78 -0.23 0.00 0.00 178.00 178.93 2hmx h GLY 50 N -0.80 0.00 1.05 1.56 0.00 -1.97 0.97 103.07 103.87 2hmx h GLY 50 Ca -0.04 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.29 2hmx h GLY 50 CO 0.07 0.00 0.58 -2.00 0.00 0.00 0.00 176.54 175.19 2hmx h LEU 51 N 0.00 1.12 0.00 3.11 6.46 -1.89 -1.52 115.31 122.59 2hmx h LEU 51 Ca -0.00 -0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.70 2hmx h LEU 51 Cb 0.16 -0.28 0.00 0.00 -0.73 0.00 0.00 40.66 39.81 2hmx h LEU 51 CO 0.01 0.85 -0.78 -0.11 -0.62 0.00 0.00 178.44 177.78 2hmx n LEU 52 N -4.36 0.64 0.05 2.25 -0.00 0.28 -2.55 117.00 113.31 2hmx n LEU 52 Ca 0.11 0.10 -0.02 0.00 -0.00 0.00 0.00 56.01 56.19 2hmx n LEU 52 Cb 0.05 -0.15 0.24 0.00 -0.00 0.00 0.00 43.42 43.56 2hmx n LEU 52 CO 0.38 0.01 0.75 -0.08 -0.00 0.00 0.00 177.39 178.44 2hmx h GLU 53 N 0.00 0.39 -7.39 1.96 4.81 0.12 -3.35 114.58 111.12 2hmx h GLU 53 Ca 0.00 -0.14 -0.50 0.00 -0.13 0.00 0.00 59.36 58.59 2hmx h GLU 53 Cb 0.71 -0.03 0.08 0.00 0.63 0.00 0.00 28.75 30.14 2hmx h GLU 53 CO 0.00 0.62 0.40 0.95 -0.73 0.00 0.00 179.01 180.24 2hmx s THR 54 N -4.48 4.06 0.20 0.32 -4.23 -0.85 -4.90 115.64 105.76 2hmx s THR 54 Ca -0.06 0.67 -0.11 0.00 -1.18 0.00 0.00 61.69 61.01 2hmx s THR 54 Cb 0.14 -3.56 0.11 0.00 1.34 0.00 0.00 72.50 70.53 2hmx s THR 54 CO 0.78 -0.87 1.80 0.77 -0.54 0.00 0.00 174.62 176.55 2hmx h SER 55 N -0.59 0.47 -0.63 3.99 4.64 -1.82 -2.47 113.55 117.14 2hmx h SER 55 Ca -0.45 0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 60.87 2hmx h SER 55 Cb 1.22 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 63.22 2hmx h SER 55 CO 0.61 0.31 0.29 -0.08 -0.87 0.00 0.00 176.83 177.08 2hmx h GLU 56 N 0.60 0.94 0.21 4.77 4.81 -1.91 0.65 114.58 124.66 2hmx h GLU 56 Ca 0.27 -0.14 -0.33 0.00 -0.13 0.00 0.00 59.36 59.03 2hmx h GLU 56 Cb 0.16 -0.17 0.02 0.00 0.63 0.00 0.00 28.75 29.40 2hmx h GLU 56 CO -0.17 0.75 -1.49 0.78 -0.73 0.00 0.00 179.01 178.15 2hmx h GLY 57 N 1.02 0.51 1.98 1.92 0.00 -1.44 0.14 103.07 107.21 2hmx h GLY 57 Ca 0.22 -1.31 0.00 0.00 0.00 0.00 0.00 47.33 46.24 2hmx h GLY 57 CO -0.02 1.15 0.01 0.00 0.00 0.00 0.00 176.54 177.67 2hmx n ARG 59 N -2.70 0.73 0.28 0.00 0.63 0.21 0.59 116.66 116.40 2hmx n ARG 59 Ca -0.02 0.25 0.15 0.00 -0.92 0.00 0.00 57.85 57.31 2hmx n ARG 59 Cb 0.06 -1.67 0.84 0.00 0.45 0.00 0.00 32.46 32.14 2hmx n ARG 59 CO 0.00 0.00 0.00 0.37 -2.51 0.00 0.00 177.63 175.49 2hmx h GLN 60 N -0.01 0.00 0.00 -0.14 5.75 0.21 -2.11 115.11 118.81 2hmx h GLN 60 Ca -0.46 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.04 2hmx h GLN 60 Cb 1.97 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.52 2hmx h GLN 60 CO 0.03 0.07 -0.04 0.82 -2.65 0.00 0.00 178.83 177.05 2hmx h ILE 61 N 0.00 0.00 0.00 2.39 1.08 -0.07 -2.42 117.51 118.49 2hmx h ILE 61 Ca -0.00 -0.71 0.00 0.00 -0.39 0.00 0.00 64.86 63.76 2hmx h ILE 61 Cb 0.24 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.99 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 -0.71 0.00 0.00 1.44 5.85 0.17 0.98 115.31 123.04 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 0.04 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 -0.15 1.23 -0.34 0.00 0.00 178.44 179.18 2hmx h GLY 63 N 0.18 0.00 2.00 3.75 0.00 -1.49 -2.52 103.07 104.98 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 -3.27 115.11 119.91 2hmx h GLN 64 Ca -0.03 0.00 -0.33 0.00 0.77 0.00 0.00 58.65 59.07 2hmx h GLN 64 Cb 0.45 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.08 2hmx h GLN 64 CO -0.02 0.00 -2.23 -0.11 -1.93 0.00 0.00 178.83 174.55 2hmx n LEU 65 N -2.62 1.31 0.06 -2.39 7.94 0.21 -3.00 117.00 118.51 2hmx n LEU 65 Ca -0.01 -0.05 -0.12 0.00 -1.11 0.00 0.00 56.01 54.71 2hmx n LEU 65 Cb 0.10 -0.10 -0.07 0.00 0.53 0.00 0.00 43.42 43.88 2hmx n LEU 65 CO 0.16 0.63 0.83 -0.61 -1.11 0.00 0.00 177.39 177.29 2hmx h GLN 66 N 0.00 -0.06 -0.40 1.96 -0.00 -1.50 0.84 115.11 115.95 2hmx h GLN 66 Ca -0.48 0.00 0.06 0.00 -0.00 0.00 0.00 58.65 58.23 2hmx h GLN 66 Cb 1.94 0.01 -0.09 0.00 0.00 0.00 0.00 27.48 29.35 2hmx h GLN 66 CO -0.02 -0.00 -0.48 -1.35 0.00 0.00 0.00 178.83 176.98 2hmx h PRO 67 N -0.11 -0.35 0.00 -2.39 0.11 -1.77 -2.07 132.00 125.42 2hmx h PRO 67 Ca -0.01 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 2hmx h PRO 67 Cb 0.09 0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.28 2hmx h PRO 67 CO 0.01 -0.23 -0.03 0.66 -0.21 0.00 0.00 178.00 178.20 2hmx h SER 68 N -0.36 0.00 -0.33 -2.05 4.64 0.26 -1.90 113.55 113.80 2hmx h SER 68 Ca 0.11 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.42 2hmx h SER 68 Cb 0.59 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.67 2hmx h SER 68 CO -0.58 0.03 0.18 -0.07 -0.87 0.00 0.00 176.83 175.52 2hmx h LEU 69 N 0.00 0.44 -1.76 5.97 3.38 0.11 0.97 115.31 124.42 2hmx h LEU 69 Ca -0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2hmx h LEU 69 Cb 0.10 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2hmx h LEU 69 CO 0.00 0.37 0.00 0.06 0.09 0.00 0.00 178.44 178.96 2hmx h GLN 70 N 0.50 0.00 0.00 1.13 3.07 -1.47 -2.21 115.11 116.13 2hmx h GLN 70 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.87 2hmx h GLN 70 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.60 2hmx h GLN 70 CO -0.02 0.00 -0.24 -2.37 0.09 0.00 0.00 178.83 176.29 2hmx n THR 71 N -2.43 0.00 0.00 1.86 5.66 0.19 -4.91 114.28 114.66 2hmx n THR 71 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 2hmx n THR 71 Cb 0.04 0.40 0.00 0.00 -1.55 0.00 0.00 70.33 69.22 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 0.00 -0.27 3.83 1.09 0.00 0.28 -5.07 105.19 105.05 2hmx n GLY 72 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.98 -0.00 0.16 1.61 1.04 -1.22 -4.82 113.70 107.49 2hmx s SER 73 Ca 0.00 -0.01 0.13 0.00 0.48 0.00 0.00 55.95 56.54 2hmx s SER 73 Cb 0.00 0.01 0.65 0.00 0.10 0.00 0.00 66.02 66.78 2hmx s SER 73 CO 0.00 -0.02 1.39 1.21 0.98 0.00 0.00 173.24 176.79 2hmx n GLU 74 N -0.77 0.08 0.04 4.02 4.07 -1.26 -1.14 120.64 125.67 2hmx n GLU 74 Ca -0.01 0.54 -0.13 0.00 -0.06 0.00 0.00 57.16 57.50 2hmx n GLU 74 Cb 0.61 -1.73 -0.14 0.00 -0.06 0.00 0.00 31.44 30.12 2hmx n GLU 74 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 2hmx h GLU 75 N 0.00 0.13 -0.15 5.31 4.39 -1.95 -1.87 114.58 120.44 2hmx h GLU 75 Ca 0.00 -0.22 -0.06 0.00 0.34 0.00 0.00 59.36 59.42 2hmx h GLU 75 Cb 0.05 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 2hmx h GLU 75 CO 0.00 0.92 -0.18 1.25 -1.16 0.00 0.00 179.01 179.84 2hmx h LEU 76 N 0.04 0.24 -1.32 1.33 6.46 -1.45 -0.10 115.31 120.50 2hmx h LEU 76 Ca -0.21 -0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 57.46 2hmx h LEU 76 Cb 1.96 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 41.81 2hmx h LEU 76 CO 0.13 0.44 0.18 -0.09 -0.62 0.00 0.00 178.44 178.48 2hmx h ARG 77 N 0.23 0.65 0.04 1.25 2.43 -0.40 0.58 114.38 119.16 2hmx h ARG 77 Ca 0.04 -0.09 -0.24 0.00 -0.81 0.00 0.00 59.98 58.89 2hmx h ARG 77 Cb 0.46 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 2hmx h ARG 77 CO 0.03 0.54 -1.02 0.77 -1.51 0.00 0.00 179.97 178.78 2hmx h SER 78 N 0.64 0.47 -0.04 -3.80 0.02 -1.07 -1.77 113.55 108.00 2hmx h SER 78 Ca 0.16 -0.41 -0.01 0.00 -0.84 0.00 0.00 61.79 60.69 2hmx h SER 78 Cb 0.13 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.52 2hmx h SER 78 CO -0.02 1.24 0.02 0.25 -1.14 0.00 0.00 176.83 177.18 2hmx h LEU 79 N 0.17 0.08 0.00 5.07 5.85 -0.61 -1.87 115.31 124.00 2hmx h LEU 79 Ca -0.09 -0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.44 2hmx h LEU 79 Cb 1.68 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.67 2hmx h LEU 79 CO 0.17 0.08 -0.92 0.22 -0.34 0.00 0.00 178.44 177.66 2hmx h TYR 80 N 0.09 0.00 -0.09 1.25 3.20 0.99 -2.22 116.97 120.20 2hmx h TYR 80 Ca 0.02 0.00 -0.19 0.00 3.14 0.00 0.00 58.73 61.71 2hmx h TYR 80 Cb 0.04 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.30 2hmx h TYR 80 CO 0.00 0.86 -0.73 -2.95 -1.64 0.00 0.00 178.16 173.69 2hmx h ASN 81 N 0.00 0.52 0.87 -2.11 7.08 -0.71 0.11 115.58 121.35 2hmx h ASN 81 Ca -0.03 -0.34 -0.21 0.00 -3.08 0.00 0.00 56.30 52.64 2hmx h ASN 81 Cb 1.68 -0.16 -0.02 0.00 -2.08 0.00 0.00 38.32 37.74 2hmx h ASN 81 CO 0.11 1.09 -0.97 0.71 -2.08 0.00 0.00 177.43 176.28 2hmx h THR 82 N 0.30 1.64 -0.06 6.14 1.35 -1.45 -0.31 112.91 120.53 2hmx h THR 82 Ca -0.03 -3.16 -0.07 0.00 -0.55 0.00 0.00 66.41 62.60 2hmx h THR 82 Cb 1.31 2.74 0.00 0.00 -1.73 0.00 0.00 68.15 70.48 2hmx h THR 82 CO 0.13 0.91 -0.22 0.40 -0.25 0.00 0.00 175.52 176.48 2hmx h ILE 83 N 0.02 1.44 -0.43 6.82 1.08 -1.21 0.57 117.51 125.81 2hmx h ILE 83 Ca -0.03 -1.64 -0.09 0.00 -0.39 0.00 0.00 64.86 62.71 2hmx h ILE 83 Cb 1.69 2.36 -0.02 0.00 -3.07 0.00 0.00 36.82 37.78 2hmx h ILE 83 CO 0.13 0.46 -0.10 0.00 -0.69 0.00 0.00 178.15 177.96 2hmx h ALA 84 N 0.42 1.03 0.92 1.87 0.00 -0.67 0.63 119.26 123.45 2hmx h ALA 84 Ca -0.01 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 2hmx h ALA 84 Cb 0.86 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.49 2hmx h ALA 84 CO 0.05 0.59 -0.44 0.28 0.00 0.00 0.00 179.25 179.72 2hmx h VAL 85 N 0.69 0.02 0.00 0.00 2.07 -0.93 0.37 116.25 118.47 2hmx h VAL 85 Ca 0.12 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.56 2hmx h VAL 85 Cb 0.56 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 2hmx h VAL 85 CO 0.03 0.00 0.00 0.25 0.02 0.00 0.00 177.57 177.88 2hmx h LEU 86 N -1.32 0.00 0.01 2.57 5.85 0.20 0.97 115.31 123.59 2hmx h LEU 86 Ca -0.13 0.00 -0.26 0.00 0.84 0.00 0.00 57.88 58.34 2hmx h LEU 86 Cb 0.95 0.00 0.02 0.00 0.37 0.00 0.00 40.66 42.00 2hmx h LEU 86 CO 0.21 0.00 -1.01 0.22 -0.34 0.00 0.00 178.44 177.52 2hmx h TYR 87 N 0.00 1.00 -0.50 1.25 5.03 0.10 0.53 116.97 124.38 2hmx h TYR 87 Ca 0.00 -0.55 0.08 0.00 2.58 0.00 0.00 58.73 60.84 2hmx h TYR 87 Cb 0.06 -0.11 -0.03 0.00 1.55 0.00 0.00 36.73 38.20 2hmx h TYR 87 CO 0.00 1.39 0.34 0.00 -1.32 0.00 0.00 178.16 178.56 2hmx h VAL 89 N 0.34 0.80 0.00 0.00 2.07 0.67 0.14 116.25 120.27 2hmx h VAL 89 Ca 0.23 -2.28 -0.01 0.00 0.82 0.00 0.00 66.70 65.46 2hmx h VAL 89 Cb 0.45 2.41 -0.00 0.00 -1.52 0.00 0.00 31.29 32.63 2hmx h VAL 89 CO -0.05 0.63 -0.04 0.45 0.02 0.00 0.00 177.57 178.57 2hmx h HIS 90 N -0.42 0.00 0.05 1.57 3.86 0.24 0.19 115.15 120.63 2hmx h HIS 90 Ca -0.38 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 58.83 2hmx h HIS 90 Cb 1.70 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.17 2hmx h HIS 90 CO 0.09 0.04 -0.02 1.96 0.86 0.00 0.00 177.93 180.86 2hmx h GLN 91 N 0.00 -0.06 0.00 2.45 7.50 -1.41 -3.45 115.11 120.13 2hmx h GLN 91 Ca -0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2hmx h GLN 91 Cb 0.17 0.01 0.00 0.00 0.05 0.00 0.00 27.48 27.72 2hmx h GLN 91 CO 0.01 -0.04 0.00 -2.13 -1.50 0.00 0.00 178.83 175.16 2hmx n ARG 92 N -2.31 0.00 -1.84 1.46 3.00 0.66 -5.13 116.66 112.49 2hmx n ARG 92 Ca -0.01 0.00 -0.41 0.00 -0.00 0.00 0.00 57.85 57.43 2hmx n ARG 92 Cb 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.47 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 0.00 2.22 0.11 5.15 1.09 0.47 -4.92 121.20 125.32 2hmx s ILE 93 Ca 0.00 0.19 0.08 0.00 -1.10 0.00 0.00 60.65 59.82 2hmx s ILE 93 Cb 0.00 -3.12 -0.04 0.00 -1.06 0.00 0.00 42.46 38.24 2hmx s ILE 93 CO 0.00 0.03 -0.21 -1.81 -0.10 0.00 0.00 174.94 172.85 2hmx s ASP 94 N 0.36 2.60 0.35 3.58 1.01 -1.26 -2.65 116.67 120.65 2hmx s ASP 94 Ca 0.61 -0.71 0.02 0.00 0.71 0.00 0.00 52.55 53.17 2hmx s ASP 94 Cb -0.46 -0.15 -0.01 0.00 1.01 0.00 0.00 42.92 43.32 2hmx s ASP 94 CO 0.49 0.05 0.07 1.33 0.21 0.00 0.00 175.17 177.32 2hmx n VAL 95 N 0.96 0.00 0.28 -1.27 0.24 -1.26 -5.05 118.33 112.23 2hmx n VAL 95 Ca -0.19 -1.86 0.03 0.00 -2.04 0.00 0.00 64.34 60.28 2hmx n VAL 95 Cb 0.54 0.56 -0.03 0.00 -1.47 0.00 0.00 33.84 33.44 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 -0.81 4.68 -3.76 7.34 4.01 -1.26 -4.86 118.16 123.50 2hmx n LYS 96 Ca -0.09 -0.06 -0.03 0.00 -0.51 0.00 0.00 58.31 57.63 2hmx n LYS 96 Cb 0.49 -0.81 -0.00 0.00 -0.51 0.00 0.00 35.03 34.20 2hmx n LYS 96 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2hmx s ASP 97 N -1.50 -0.12 0.00 4.39 2.15 -1.26 0.23 116.67 120.57 2hmx s ASP 97 Ca 0.03 -0.42 0.00 0.00 0.43 0.00 0.00 52.55 52.58 2hmx s ASP 97 Cb 0.05 0.44 0.00 0.00 -0.30 0.00 0.00 42.92 43.10 2hmx s ASP 97 CO 0.23 -0.83 0.48 0.41 -0.17 0.00 0.00 175.17 175.30 2hmx n THR 98 N -0.53 0.00 0.07 1.71 -1.04 -0.13 -2.10 114.28 112.27 2hmx n THR 98 Ca -0.06 0.97 0.02 0.00 -2.04 0.00 0.00 64.05 62.95 2hmx n THR 98 Cb 0.61 -1.95 0.10 0.00 -1.82 0.00 0.00 70.33 67.26 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 -0.49 0.02 -0.00 -2.82 2.85 -1.26 0.98 118.16 117.43 2hmx n LYS 99 Ca 0.00 0.49 -0.19 0.00 -1.05 0.00 0.00 58.31 57.56 2hmx n LYS 99 Cb 0.00 -1.56 -0.14 0.00 -0.65 0.00 0.00 35.03 32.69 2hmx n LYS 99 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 2hmx h GLU 100 N 0.00 0.18 0.05 -1.58 3.07 -1.95 0.15 114.58 114.50 2hmx h GLU 100 Ca 0.00 -0.31 0.01 0.00 -0.50 0.00 0.00 59.36 58.55 2hmx h GLU 100 Cb 0.03 0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.04 2hmx h GLU 100 CO 0.00 1.15 -0.06 0.00 -1.40 0.00 0.00 179.01 178.70 2hmx h ALA 101 N -0.01 -0.11 0.00 3.43 0.00 0.12 -1.53 119.26 121.16 2hmx h ALA 101 Ca -0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2hmx h ALA 101 Cb 1.46 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2hmx h ALA 101 CO 0.06 -0.57 0.00 -0.11 0.00 0.00 0.00 179.25 178.63 2hmx n LEU 102 N -5.17 0.00 0.04 0.00 7.94 0.20 0.11 117.00 120.11 2hmx n LEU 102 Ca -0.07 0.50 -0.21 0.00 -1.11 0.00 0.00 56.01 55.12 2hmx n LEU 102 Cb 0.10 -0.50 -0.14 0.00 0.53 0.00 0.00 43.42 43.41 2hmx n LEU 102 CO 0.31 -0.34 -0.64 -0.78 -1.11 0.00 0.00 177.39 174.84 2hmx h ASP 103 N 0.00 0.48 -0.54 1.96 1.82 0.05 0.57 116.42 120.76 2hmx h ASP 103 Ca 0.00 -0.86 0.07 0.00 -0.39 0.00 0.00 57.03 55.85 2hmx h ASP 103 Cb 0.16 -0.15 -0.06 0.00 0.68 0.00 0.00 39.33 39.96 2hmx h ASP 103 CO 0.00 1.75 0.22 0.50 -1.61 0.00 0.00 179.24 180.10 2hmx h LYS 104 N 0.08 0.42 0.00 0.28 1.63 0.12 -2.37 116.57 116.73 2hmx h LYS 104 Ca -0.37 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.41 2hmx h LYS 104 Cb 2.06 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 33.60 2hmx h LYS 104 CO 0.13 0.27 -0.66 -0.89 -3.45 0.00 0.00 179.45 174.86 2hmx n ILE 105 N -4.96 0.28 0.06 2.00 2.08 0.33 -0.06 119.36 119.10 2hmx n ILE 105 Ca 0.06 -0.23 -0.09 0.00 0.56 0.00 0.00 62.75 63.05 2hmx n ILE 105 Cb 0.20 -0.03 -0.12 0.00 -0.75 0.00 0.00 39.64 38.93 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 0.05 0.00 0.38 4.57 0.28 -1.74 114.58 118.11 2hmx h GLU 106 Ca 0.00 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 2hmx h GLU 106 Cb 0.71 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.33 2hmx h GLU 106 CO 0.00 1.02 0.00 -1.91 -1.18 0.00 0.00 179.01 176.94 2hmx n GLU 107 N -3.37 0.11 -1.39 1.92 2.13 -0.90 -4.74 120.64 114.39 2hmx n GLU 107 Ca -0.02 0.55 -0.14 0.00 0.66 0.00 0.00 57.16 58.21 2hmx n GLU 107 Cb 0.96 -1.81 -0.06 0.00 0.27 0.00 0.00 31.44 30.80 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 -2.03 -1.63 -2.74 5.31 2.13 -0.66 -3.79 120.64 117.24 2hmx n GLU 108 Ca -0.00 0.97 -0.06 0.00 0.66 0.00 0.00 57.16 58.73 2hmx n GLU 108 Cb 0.06 -5.39 0.01 0.00 0.27 0.00 0.00 31.44 26.39 2hmx n GLU 108 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 2hmx n GLN 109 N -1.23 -2.42 -1.03 5.31 7.27 0.92 -4.67 117.38 121.52 2hmx n GLN 109 Ca -0.14 2.13 0.00 0.00 0.07 0.00 0.00 57.00 59.07 2hmx n GLN 109 Cb 0.62 -5.37 0.00 0.00 2.41 0.00 0.00 30.24 27.89 2hmx n GLN 109 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2hmx n ASN 110 N -0.15 -6.11 -1.81 1.69 3.02 -1.26 -5.02 115.26 105.61 2hmx n ASN 110 Ca 0.09 0.76 0.00 0.00 -0.03 0.00 0.00 54.58 55.40 2hmx n ASN 110 Cb 0.36 -2.41 0.00 0.00 -0.61 0.00 0.00 39.78 37.12 2hmx n ASN 110 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2hmx n LYS 111 N -0.06 -4.78 -4.28 3.52 4.76 -1.26 -5.06 118.16 111.00 2hmx n LYS 111 Ca 0.00 3.45 -0.20 0.00 -2.87 0.00 0.00 58.31 58.69 2hmx n LYS 111 Cb 0.00 -3.66 -0.11 0.00 -1.84 0.00 0.00 35.03 29.42 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 -0.65 2.32 0.09 4.39 0.01 -1.25 -4.32 113.70 114.30 2hmx s SER 112 Ca 0.00 -0.80 0.00 0.00 1.31 0.00 0.00 55.95 56.46 2hmx s SER 112 Cb 0.00 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.12 2hmx s SER 112 CO 0.00 -0.07 0.00 0.29 0.41 0.00 0.00 173.24 173.87 2hmx n LYS 113 N 0.58 -4.26 -0.11 12.44 4.76 -1.26 -5.00 118.16 125.31 2hmx n LYS 113 Ca -0.16 3.16 -0.20 0.00 -2.87 0.00 0.00 58.31 58.24 2hmx n LYS 113 Cb 0.56 -3.59 -0.10 0.00 -1.84 0.00 0.00 35.03 30.06 2hmx n LYS 113 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2hmx n LYS 114 N 1.47 0.55 -1.75 1.97 3.00 -1.26 -4.81 118.16 117.33 2hmx n LYS 114 Ca 0.00 0.51 -0.42 0.00 -0.00 0.00 0.00 58.31 58.40 2hmx n LYS 114 Cb 0.00 -1.69 -0.03 0.00 0.00 0.00 0.00 35.03 33.31 2hmx n LYS 114 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 2hmx s LYS 115 N -2.39 4.04 0.00 1.64 2.20 -1.26 -4.94 119.74 119.03 2hmx s LYS 115 Ca -0.29 2.43 0.00 0.00 -0.36 0.00 0.00 55.97 57.76 2hmx s LYS 115 Cb 0.07 -4.14 0.00 0.00 -1.51 0.00 0.00 37.83 32.25 2hmx s LYS 115 CO 0.52 -1.06 0.00 0.00 -0.36 0.00 0.00 175.35 174.45 2hmx n ALA 116 N 7.89 0.00 -0.50 3.13 0.00 -1.26 -4.89 120.51 124.88 2hmx n ALA 116 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2hmx n ALA 116 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 2hmx n ALA 116 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2hmx n GLN 117 N 0.00 0.00 0.00 0.00 -0.06 -1.26 -4.45 117.38 111.60 2hmx n GLN 117 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 2hmx n GLN 117 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 2hmx n GLN 117 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 2hmx n GLN 118 N 0.00 0.00 -2.88 3.69 6.02 -1.26 -5.10 117.38 117.84 2hmx n GLN 118 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 57.00 57.02 2hmx n GLN 118 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 2hmx n GLN 118 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hmx s ALA 119 N -1.00 -4.34 0.00 -1.58 0.00 -1.26 -5.14 121.76 108.44 2hmx s ALA 119 Ca 0.00 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.27 2hmx s ALA 119 Cb 0.00 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.15 2hmx s ALA 119 CO 0.00 -2.38 0.00 0.00 0.00 0.00 0.00 175.76 173.38 2hmx n ALA 120 N 4.11 0.00 -2.69 0.00 0.00 -1.26 -4.44 120.51 116.23 2hmx n ALA 120 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.09 2hmx n ALA 120 Cb 0.62 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.04 2hmx n ALA 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hmx s ALA 121 N -1.93 2.93 -0.10 0.00 0.00 -1.26 -4.67 121.76 116.73 2hmx s ALA 121 Ca 0.00 -1.99 0.15 0.00 0.00 0.00 0.00 51.96 50.12 2hmx s ALA 121 Cb 0.00 -4.21 0.33 0.00 0.00 0.00 0.00 23.12 19.24 2hmx s ALA 121 CO 0.00 -3.21 1.16 -0.40 0.00 0.00 0.00 175.76 173.31 2hmx n ASP 122 N 8.34 1.36 -3.10 0.00 5.75 -1.26 -4.83 116.55 122.81 2hmx n ASP 122 Ca 0.14 -2.90 -0.18 0.00 -0.01 0.00 0.00 54.79 51.84 2hmx n ASP 122 Cb 0.49 -0.39 -0.05 0.00 -1.03 0.00 0.00 41.12 40.14 2hmx n ASP 122 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2hmx n THR 123 N -0.55 -0.64 -0.41 2.12 -2.24 -1.26 -5.10 114.28 106.19 2hmx n THR 123 Ca 0.12 -2.65 0.00 0.00 -2.27 0.00 0.00 64.05 59.25 2hmx n THR 123 Cb 0.81 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 2hmx n THR 123 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2hmx n GLY 124 N 2.44 5.24 2.02 3.38 0.00 -1.26 -5.12 105.19 111.89 2hmx n GLY 124 Ca 0.22 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2hmx n GLY 124 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2hmx n ASN 125 N 0.00 -0.49 -1.48 1.61 4.13 -1.26 -5.02 115.26 112.74 2hmx n ASN 125 Ca 0.00 0.28 -0.19 0.00 1.68 0.00 0.00 54.58 56.35 2hmx n ASN 125 Cb 0.00 0.60 -0.07 0.00 -1.54 0.00 0.00 39.78 38.77 2hmx n ASN 125 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2hmx n ASN 126 N -2.96 -5.25 -3.76 6.41 4.13 -1.26 -4.93 115.26 107.63 2hmx n ASN 126 Ca 0.00 0.42 0.03 0.00 1.68 0.00 0.00 54.58 56.71 2hmx n ASN 126 Cb 0.00 -4.38 0.01 0.00 -1.54 0.00 0.00 39.78 33.87 2hmx n ASN 126 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2hmx s SER 127 N -2.75 -0.01 -0.11 6.41 1.04 -1.26 -5.01 113.70 112.02 2hmx s SER 127 Ca 0.00 -0.12 0.15 0.00 0.48 0.00 0.00 55.95 56.46 2hmx s SER 127 Cb 0.00 0.10 0.23 0.00 0.10 0.00 0.00 66.02 66.45 2hmx s SER 127 CO 0.00 -0.20 1.12 0.00 0.98 0.00 0.00 173.24 175.14 2hmx n GLN 128 N -0.75 1.21 -1.29 4.02 -0.00 -1.26 -4.55 117.38 114.77 2hmx n GLN 128 Ca -0.01 -2.30 -0.16 0.00 -0.00 0.00 0.00 57.00 54.53 2hmx n GLN 128 Cb 0.60 -1.34 0.12 0.00 -0.00 0.00 0.00 30.24 29.63 2hmx n GLN 128 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.06 178.39 2hmx n VAL 129 N -1.19 2.72 0.00 -0.39 0.24 -1.26 -4.43 118.33 114.02 2hmx n VAL 129 Ca 0.13 -3.27 0.00 0.00 -2.04 0.00 0.00 64.34 59.15 2hmx n VAL 129 Cb 0.62 -0.72 0.00 0.00 -1.47 0.00 0.00 33.84 32.27 2hmx n VAL 129 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2hmx n SER 130 N -0.96 2.71 -2.00 -1.34 7.64 -1.26 -5.13 113.62 113.27 2hmx n SER 130 Ca 0.41 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 60.29 2hmx n SER 130 Cb 0.95 0.02 0.01 0.00 -1.01 0.00 0.00 64.21 64.18 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 -2.12 0.24 0.00 1.43 10.64 -1.26 -5.15 117.38 121.15 2hmx n GLN 131 Ca 0.00 -0.57 0.00 0.00 -1.83 0.00 0.00 57.00 54.60 2hmx n GLN 131 Cb 0.33 0.79 0.00 0.00 -0.86 0.00 0.00 30.24 30.50 2hmx n GLN 131 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2hmx n ASN 132 N -0.82 0.00 0.00 2.61 3.02 -1.26 -4.66 115.26 114.16 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 0.24 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.41 2hmx n ASN 132 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64