#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hmx s MET 2 N 0.00 0.22 0.00 -0.41 0.00 -1.26 -5.11 119.30 112.74 2hmx s MET 2 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 55.69 55.70 2hmx s MET 2 Cb 0.00 0.10 0.00 0.00 0.00 0.00 0.00 34.83 34.93 2hmx s MET 2 CO 0.00 -0.08 0.00 0.41 0.00 0.00 0.00 175.02 175.35 2hmx n GLY 3 N 0.40 -0.99 1.51 3.16 0.00 -1.26 -4.85 105.19 103.15 2hmx n GLY 3 Ca -0.02 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 -2.16 -1.89 0.11 4.61 0.00 -1.26 -4.18 120.51 115.73 2hmx n ALA 4 Ca 0.00 0.45 0.01 0.00 0.00 0.00 0.00 53.44 53.91 2hmx n ALA 4 Cb 0.00 -1.41 0.06 0.00 0.00 0.00 0.00 19.45 18.11 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 -2.02 0.01 -0.95 0.00 3.00 -1.26 -4.92 116.66 110.52 2hmx n ARG 5 Ca 0.00 0.40 0.13 0.00 -0.01 0.00 0.00 57.85 58.37 2hmx n ARG 5 Cb 0.31 -1.50 -0.03 0.00 0.00 0.00 0.00 32.46 31.24 2hmx n ARG 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2hmx n ALA 6 N -1.44 -2.44 -1.00 7.54 0.00 -1.26 -5.03 120.51 116.87 2hmx n ALA 6 Ca 0.01 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.74 2hmx n ALA 6 Cb 0.03 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 18.64 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 -3.44 0.00 -0.13 0.00 2.88 -1.26 -5.00 113.62 106.68 2hmx n SER 7 Ca 0.01 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.29 2hmx n SER 7 Cb 0.43 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.81 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 -0.22 1.44 -3.70 2.46 0.31 -1.26 -4.85 118.33 112.51 2hmx n VAL 8 Ca 0.00 -0.31 -0.19 0.00 -0.01 0.00 0.00 64.34 63.83 2hmx n VAL 8 Cb 0.00 -1.91 0.01 0.00 -0.91 0.00 0.00 33.84 31.03 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 -4.19 0.00 0.00 7.52 4.77 -1.26 -4.83 117.00 119.00 2hmx n LEU 9 Ca -0.47 -2.12 -0.10 0.00 -0.03 0.00 0.00 56.01 53.29 2hmx n LEU 9 Cb 0.82 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.82 2hmx n LEU 9 CO 0.05 -0.52 -0.07 -1.54 -1.33 0.00 0.00 177.39 173.98 2hmx n SER 10 N -1.95 1.36 0.48 -1.43 3.41 -1.26 -4.67 113.62 109.55 2hmx n SER 10 Ca 0.00 -1.82 -0.19 0.00 -0.26 0.00 0.00 58.87 56.60 2hmx n SER 10 Cb 0.47 0.34 -0.09 0.00 -0.26 0.00 0.00 64.21 64.66 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 0.58 -1.29 1.00 5.00 0.00 -1.89 0.57 103.07 107.04 2hmx h GLY 11 Ca -0.13 0.48 -0.10 0.00 0.00 0.00 0.00 47.33 47.58 2hmx h GLY 11 CO 0.20 -0.47 -0.14 -1.33 0.00 0.00 0.00 176.54 174.80 2hmx h GLY 12 N -1.32 0.87 1.17 4.60 0.00 -1.93 -2.50 103.07 103.96 2hmx h GLY 12 Ca -0.13 -0.75 -0.07 0.00 0.00 0.00 0.00 47.33 46.38 2hmx h GLY 12 CO 0.21 0.68 0.09 0.83 0.00 0.00 0.00 176.54 178.35 2hmx h GLU 13 N 0.61 1.01 0.63 4.80 5.08 -1.81 0.37 114.58 125.28 2hmx h GLU 13 Ca 0.10 -0.26 -0.03 0.00 -1.00 0.00 0.00 59.36 58.16 2hmx h GLU 13 Cb 0.68 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.81 2hmx h GLU 13 CO 0.05 0.94 -0.30 1.25 -1.00 0.00 0.00 179.01 179.94 2hmx h LEU 14 N 0.95 -0.72 -0.01 1.33 7.12 0.11 0.37 115.31 124.46 2hmx h LEU 14 Ca 0.19 0.02 0.00 0.00 0.13 0.00 0.00 57.88 58.22 2hmx h LEU 14 Cb 0.43 0.19 0.00 0.00 -0.53 0.00 0.00 40.66 40.74 2hmx h LEU 14 CO 0.01 -0.50 0.00 0.47 -0.13 0.00 0.00 178.44 178.29 2hmx n ASP 15 N -4.38 0.00 -0.05 1.25 9.92 -0.89 0.97 116.55 123.37 2hmx n ASP 15 Ca -0.11 0.50 0.01 0.00 -0.53 0.00 0.00 54.79 54.67 2hmx n ASP 15 Cb 0.34 -0.50 -0.15 0.00 -0.64 0.00 0.00 41.12 40.16 2hmx n ASP 15 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 2hmx n LYS 16 N -1.51 0.78 0.04 -1.24 4.81 0.12 -3.74 118.16 117.43 2hmx n LYS 16 Ca 0.00 -0.10 0.07 0.00 -0.87 0.00 0.00 58.31 57.41 2hmx n LYS 16 Cb 0.01 -1.47 0.32 0.00 0.02 0.00 0.00 35.03 33.91 2hmx n LYS 16 CO 0.00 0.00 0.00 1.87 1.17 0.00 0.00 177.40 180.44 2hmx n TRP 17 N -2.42 0.24 -0.60 5.64 -0.00 0.27 -3.65 117.44 116.93 2hmx n TRP 17 Ca -0.16 0.10 -0.17 0.00 -0.00 0.00 0.00 57.50 57.27 2hmx n TRP 17 Cb 0.78 -0.66 0.13 0.00 -0.00 0.00 0.00 31.31 31.56 2hmx n TRP 17 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 177.69 175.78 2hmx n GLU 18 N -1.72 1.90 0.00 5.87 0.00 -0.32 -3.79 120.64 122.57 2hmx n GLU 18 Ca 0.02 -2.14 0.00 0.00 0.00 0.00 0.00 57.16 55.04 2hmx n GLU 18 Cb 0.15 -1.84 0.00 0.00 0.00 0.00 0.00 31.44 29.75 2hmx n GLU 18 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 2hmx n LYS 19 N -0.66 0.00 -2.32 5.31 4.81 -1.14 -4.88 118.16 119.28 2hmx n LYS 19 Ca 0.43 0.00 -0.27 0.00 -0.87 0.00 0.00 58.31 57.60 2hmx n LYS 19 Cb 1.32 0.00 0.04 0.00 0.02 0.00 0.00 35.03 36.41 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 3.40 0.10 3.15 1.09 -0.93 -4.83 121.20 123.18 2hmx s ILE 20 Ca 0.00 -0.00 0.07 0.00 -1.10 0.00 0.00 60.65 59.62 2hmx s ILE 20 Cb 0.00 -3.38 -0.04 0.00 -1.06 0.00 0.00 42.46 37.98 2hmx s ILE 20 CO 0.00 -0.40 -0.10 -0.60 -0.10 0.00 0.00 174.94 173.74 2hmx s ARG 21 N -5.07 2.15 0.00 2.79 3.52 0.20 0.60 118.95 123.13 2hmx s ARG 21 Ca 0.55 -1.01 0.00 0.00 -0.13 0.00 0.00 55.73 55.14 2hmx s ARG 21 Cb -0.11 -2.31 0.00 0.00 -1.56 0.00 0.00 34.95 30.97 2hmx s ARG 21 CO 0.46 0.51 0.00 1.47 -0.81 0.00 0.00 175.30 176.93 2hmx n LEU 22 N 0.72 0.00 -4.18 -0.88 -0.00 -0.83 -1.20 117.00 110.63 2hmx n LEU 22 Ca -0.13 0.00 -0.40 0.00 -0.00 0.00 0.00 56.01 55.48 2hmx n LEU 22 Cb 0.52 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.88 2hmx n LEU 22 CO 0.33 0.00 0.21 0.00 -0.00 0.00 0.00 177.39 177.93 2hmx s ARG 23 N 0.73 3.00 -0.92 1.47 1.70 -1.26 -4.71 118.95 118.95 2hmx s ARG 23 Ca 0.00 -2.60 -0.16 0.00 -0.47 0.00 0.00 55.73 52.50 2hmx s ARG 23 Cb 0.00 -3.99 -0.26 0.00 -0.57 0.00 0.00 34.95 30.12 2hmx s ARG 23 CO 0.00 -1.22 2.28 -0.35 -1.08 0.00 0.00 175.30 174.93 2hmx n PRO 24 N 3.51 0.20 0.00 3.89 -0.04 -1.26 -0.90 135.00 140.40 2hmx n PRO 24 Ca 0.11 -0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 2hmx n PRO 24 Cb 0.41 -1.91 0.00 0.00 -0.04 0.00 0.00 33.50 31.95 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 5.98 0.62 2.78 0.55 0.00 -1.26 -5.03 105.19 108.82 2hmx n GLY 25 Ca 0.61 0.11 -0.34 0.00 0.00 0.00 0.00 46.02 46.39 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 5.88 4.66 -0.02 0.00 -0.08 -4.82 105.19 110.81 2hmx n GLY 26 Ca 0.00 -2.68 0.00 0.00 0.00 0.00 0.00 46.02 43.34 2hmx n GLY 26 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2hmx n LYS 27 N -0.12 0.00 -3.55 1.61 3.00 -1.26 -4.69 118.16 113.16 2hmx n LYS 27 Ca 0.39 0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 58.49 2hmx n LYS 27 Cb 0.32 0.00 0.08 0.00 0.00 0.00 0.00 35.03 35.43 2hmx n LYS 27 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 2hmx n LYS 28 N 0.00 -7.43 -3.76 1.64 0.00 -1.26 -4.93 118.16 102.42 2hmx n LYS 28 Ca 0.00 0.83 -0.13 0.00 -0.00 0.00 0.00 58.31 59.01 2hmx n LYS 28 Cb 0.00 -5.87 -0.11 0.00 -0.00 0.00 0.00 35.03 29.05 2hmx n LYS 28 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 2hmx s GLN 29 N -5.97 0.33 0.13 -1.58 0.74 -1.26 -1.97 119.66 110.08 2hmx s GLN 29 Ca 0.37 0.44 -0.10 0.00 0.05 0.00 0.00 55.36 56.12 2hmx s GLN 29 Cb -0.16 0.13 -0.06 0.00 1.10 0.00 0.00 33.01 34.02 2hmx s GLN 29 CO 0.73 -0.06 0.45 0.71 -0.55 0.00 0.00 175.29 176.58 2hmx s TYR 30 N 0.31 3.54 0.00 1.67 1.51 0.20 -4.69 117.35 119.89 2hmx s TYR 30 Ca -0.01 0.82 0.00 0.00 -1.01 0.00 0.00 57.07 56.87 2hmx s TYR 30 Cb -0.03 -2.19 0.00 0.00 -0.11 0.00 0.00 41.96 39.62 2hmx s TYR 30 CO -0.01 0.44 0.00 1.63 -1.11 0.00 0.00 175.55 176.50 2hmx n LYS 31 N 0.58 0.00 -0.00 -0.62 5.02 -1.26 -2.19 118.16 119.69 2hmx n LYS 31 Ca -0.05 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.29 2hmx n LYS 31 Cb 0.52 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.46 2hmx n LYS 31 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2hmx n LEU 32 N 0.00 0.18 0.05 -0.35 7.94 -1.26 -0.16 117.00 123.40 2hmx n LEU 32 Ca 0.00 -0.19 0.06 0.00 -1.11 0.00 0.00 56.01 54.77 2hmx n LEU 32 Cb 0.00 0.00 0.28 0.00 0.53 0.00 0.00 43.42 44.23 2hmx n LEU 32 CO 0.00 0.05 0.68 1.17 -1.11 0.00 0.00 177.39 178.18 2hmx n LYS 33 N -1.63 0.06 -0.03 1.96 3.00 -1.26 -2.12 118.16 118.14 2hmx n LYS 33 Ca -0.00 0.45 0.00 0.00 -0.00 0.00 0.00 58.31 58.76 2hmx n LYS 33 Cb 0.23 -1.65 -0.09 0.00 0.00 0.00 0.00 35.03 33.52 2hmx n LYS 33 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.40 178.98 2hmx n HIS 34 N -1.77 0.00 -0.07 5.64 -0.00 -1.02 -1.92 115.22 116.09 2hmx n HIS 34 Ca 0.01 0.00 -0.10 0.00 0.46 0.00 0.00 57.72 58.09 2hmx n HIS 34 Cb 0.09 -0.41 -0.03 0.00 -0.12 0.00 0.00 29.99 29.51 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 1.12 -0.12 3.57 2.10 -0.58 -0.87 117.51 122.73 2hmx h ILE 35 Ca -0.15 -0.33 -0.05 0.00 1.08 0.00 0.00 64.86 65.40 2hmx h ILE 35 Cb 1.13 0.90 -0.01 0.00 -1.09 0.00 0.00 36.82 37.75 2hmx h ILE 35 CO 0.01 0.12 -0.16 0.58 -1.08 0.00 0.00 178.15 177.62 2hmx h VAL 36 N 0.28 1.18 0.36 2.19 2.07 -1.32 0.63 116.25 121.64 2hmx h VAL 36 Ca 0.09 -0.82 -0.02 0.00 0.82 0.00 0.00 66.70 66.77 2hmx h VAL 36 Cb 0.08 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 2hmx h VAL 36 CO -0.01 0.25 -0.19 -0.25 0.02 0.00 0.00 177.57 177.39 2hmx h TRP 37 N 0.18 -0.48 0.35 1.57 7.01 -1.23 0.25 115.95 123.61 2hmx h TRP 37 Ca 0.04 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.01 2hmx h TRP 37 Cb 0.40 0.16 0.00 0.00 -2.10 0.00 0.00 29.16 27.63 2hmx h TRP 37 CO 0.01 -0.30 -0.17 0.00 -2.79 0.00 0.00 178.44 175.19 2hmx h ALA 38 N 0.14 -1.11 -0.04 2.65 0.00 0.47 0.57 119.26 121.94 2hmx h ALA 38 Ca -0.05 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.77 2hmx h ALA 38 Cb 0.40 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2hmx h ALA 38 CO 0.07 -1.07 0.07 1.03 0.00 0.00 0.00 179.25 179.34 2hmx h SER 39 N -0.48 0.00 0.25 0.00 0.87 0.14 0.99 113.55 115.32 2hmx h SER 39 Ca -0.05 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.50 2hmx h SER 39 Cb 0.37 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 2hmx h SER 39 CO 0.08 0.00 -0.12 -0.09 -0.53 0.00 0.00 176.83 176.17 2hmx h ARG 40 N 0.00 -0.32 -0.01 2.24 2.43 -0.45 -2.45 114.38 115.81 2hmx h ARG 40 Ca 0.02 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2hmx h ARG 40 Cb 0.15 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.78 2hmx h ARG 40 CO -0.00 -0.21 0.01 1.49 -1.51 0.00 0.00 179.97 179.74 2hmx h GLU 41 N -0.36 0.00 0.17 0.20 4.22 0.66 0.12 114.58 119.60 2hmx h GLU 41 Ca -0.03 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.40 2hmx h GLU 41 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2hmx h GLU 41 CO 0.06 0.00 -0.08 1.25 -2.18 0.00 0.00 179.01 178.05 2hmx h LEU 42 N 0.00 -0.20 -2.77 1.64 5.85 -0.97 0.25 115.31 119.12 2hmx h LEU 42 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2hmx h LEU 42 Cb 0.02 0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 2hmx h LEU 42 CO -0.00 -0.14 0.05 -0.08 -0.34 0.00 0.00 178.44 177.93 2hmx h GLU 43 N -0.24 0.00 0.00 1.25 4.81 -0.92 0.17 114.58 119.65 2hmx h GLU 43 Ca -0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2hmx h GLU 43 Cb 0.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.56 2hmx h GLU 43 CO 0.04 0.00 -1.02 -2.13 -0.73 0.00 0.00 179.01 175.17 2hmx n ARG 44 N -3.19 0.43 0.32 1.92 0.63 -0.02 -1.50 116.66 115.25 2hmx n ARG 44 Ca -0.03 0.04 -0.13 0.00 -0.92 0.00 0.00 57.85 56.82 2hmx n ARG 44 Cb 0.12 -1.68 -0.06 0.00 0.45 0.00 0.00 32.46 31.29 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 0.00 -0.77 0.00 -0.14 -1.00 0.25 -3.46 116.94 111.82 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 0.84 0.26 0.00 0.00 3.61 0.00 0.00 35.95 40.66 2hmx h PHE 45 CO 0.00 -0.48 0.00 0.00 -1.61 0.00 0.00 178.31 176.22 2hmx n ALA 46 N -2.49 0.39 -2.52 2.45 0.00 -0.86 -5.10 120.51 112.38 2hmx n ALA 46 Ca -0.10 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.09 2hmx n ALA 46 Cb 0.33 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.65 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 1.76 -0.11 0.00 1.01 -0.56 -5.00 120.40 117.50 2hmx s VAL 47 Ca 0.00 -1.53 -0.14 0.00 0.00 0.00 0.00 61.98 60.31 2hmx s VAL 47 Cb 0.00 -1.59 -0.05 0.00 0.00 0.00 0.00 36.38 34.75 2hmx s VAL 47 CO 0.00 -0.02 0.34 0.21 0.00 0.00 0.00 175.10 175.63 2hmx s ASN 48 N -1.84 6.56 -0.02 3.32 3.84 -1.26 -4.19 114.94 121.35 2hmx s ASN 48 Ca 0.07 0.66 -0.26 0.00 0.21 0.00 0.00 52.86 53.55 2hmx s ASN 48 Cb -0.10 -2.21 -0.20 0.00 -0.55 0.00 0.00 41.25 38.19 2hmx s ASN 48 CO 0.04 0.16 1.27 1.55 -2.79 0.00 0.00 177.10 177.33 2hmx h PRO 49 N 6.08 0.00 -0.30 0.43 0.13 -1.92 -1.55 132.00 134.88 2hmx h PRO 49 Ca -0.45 -0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.73 2hmx h PRO 49 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 2hmx h PRO 49 CO 0.71 0.49 0.21 0.78 -0.23 0.00 0.00 178.00 179.95 2hmx h GLY 50 N -0.48 0.22 1.02 1.56 0.00 -1.97 0.12 103.07 103.54 2hmx h GLY 50 Ca 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 47.33 47.23 2hmx h GLY 50 CO 0.00 0.06 0.35 -2.00 0.00 0.00 0.00 176.54 174.95 2hmx h LEU 51 N 0.18 0.96 0.00 3.11 6.46 -1.86 0.35 115.31 124.52 2hmx h LEU 51 Ca 0.13 -0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2hmx h LEU 51 Cb 0.30 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 39.98 2hmx h LEU 51 CO -0.02 0.83 -0.11 -0.11 -0.62 0.00 0.00 178.44 178.41 2hmx n LEU 52 N -4.40 0.35 0.08 2.25 -0.00 0.18 -2.18 117.00 113.29 2hmx n LEU 52 Ca 0.06 0.44 -0.09 0.00 -0.00 0.00 0.00 56.01 56.43 2hmx n LEU 52 Cb 0.14 -0.39 -0.01 0.00 -0.00 0.00 0.00 43.42 43.16 2hmx n LEU 52 CO 0.39 -0.04 0.25 -0.08 -0.00 0.00 0.00 177.39 177.91 2hmx h GLU 53 N 0.00 0.19 -7.34 1.96 4.22 0.20 -3.30 114.58 110.50 2hmx h GLU 53 Ca 0.00 -0.21 -0.50 0.00 0.08 0.00 0.00 59.36 58.73 2hmx h GLU 53 Cb 0.59 0.06 0.12 0.00 0.50 0.00 0.00 28.75 30.02 2hmx h GLU 53 CO 0.00 0.95 0.32 0.95 -2.18 0.00 0.00 179.01 179.05 2hmx s THR 54 N -3.21 3.27 0.19 0.32 -4.23 -0.65 -4.80 115.64 106.52 2hmx s THR 54 Ca -0.03 0.41 -0.12 0.00 -1.18 0.00 0.00 61.69 60.77 2hmx s THR 54 Cb 0.10 -3.01 0.09 0.00 1.34 0.00 0.00 72.50 71.03 2hmx s THR 54 CO 0.83 -0.54 1.81 0.28 -0.54 0.00 0.00 174.62 176.45 2hmx h SER 55 N -1.13 0.48 -0.16 3.99 0.02 -1.82 -2.48 113.55 112.45 2hmx h SER 55 Ca -0.46 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.48 2hmx h SER 55 Cb 1.25 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 2hmx h SER 55 CO 0.55 0.33 0.01 -0.08 -1.14 0.00 0.00 176.83 176.50 2hmx h GLU 56 N 0.61 0.38 0.16 3.45 4.81 -1.91 0.67 114.58 122.74 2hmx h GLU 56 Ca 0.24 -0.06 -0.33 0.00 -0.13 0.00 0.00 59.36 59.07 2hmx h GLU 56 Cb 0.10 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.41 2hmx h GLU 56 CO -0.14 0.40 -1.68 0.78 -0.73 0.00 0.00 179.01 177.64 2hmx h GLY 57 N 0.67 0.38 2.00 1.92 0.00 -1.47 0.24 103.07 106.81 2hmx h GLY 57 Ca 0.09 -0.97 -0.00 0.00 0.00 0.00 0.00 47.33 46.44 2hmx h GLY 57 CO 0.00 0.85 -0.00 0.00 0.00 0.00 0.00 176.54 177.39 2hmx h ARG 59 N 0.00 0.32 0.00 0.00 2.43 0.74 0.58 114.38 118.45 2hmx h ARG 59 Ca -0.00 -0.55 -0.01 0.00 -0.81 0.00 0.00 59.98 58.60 2hmx h ARG 59 Cb 0.01 0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2hmx h ARG 59 CO 0.00 1.23 -0.05 0.37 -1.51 0.00 0.00 179.97 180.01 2hmx h GLN 60 N 0.09 0.00 0.00 0.20 5.75 0.22 -1.95 115.11 119.42 2hmx h GLN 60 Ca -0.36 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.14 2hmx h GLN 60 Cb 2.07 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.62 2hmx h GLN 60 CO 0.15 0.05 -0.21 0.82 -2.65 0.00 0.00 178.83 176.98 2hmx h ILE 61 N 0.00 0.00 0.00 2.39 1.08 0.09 -2.42 117.51 118.65 2hmx h ILE 61 Ca -0.00 -0.92 0.00 0.00 -0.39 0.00 0.00 64.86 63.55 2hmx h ILE 61 Cb 0.23 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.98 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 -0.92 0.00 0.03 1.44 5.85 0.17 0.99 115.31 122.87 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 0.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 2hmx h LEU 62 CO 0.00 0.00 -0.01 1.23 -0.34 0.00 0.00 178.44 179.32 2hmx h GLY 63 N 0.55 -0.04 2.00 3.75 0.00 -1.47 -2.47 103.07 105.40 2hmx h GLY 63 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2hmx h GLY 63 CO 0.00 -0.01 0.00 -1.61 0.00 0.00 0.00 176.54 174.92 2hmx h GLN 64 N -0.88 0.00 0.00 4.80 4.15 0.12 -3.30 115.11 120.00 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 0.03 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.66 2hmx h GLN 64 CO 0.01 0.00 -2.30 -0.11 -1.93 0.00 0.00 178.83 174.50 2hmx n LEU 65 N -2.86 1.90 0.21 -2.39 7.94 0.21 -3.03 117.00 118.97 2hmx n LEU 65 Ca -0.03 -0.08 -0.15 0.00 -1.11 0.00 0.00 56.01 54.65 2hmx n LEU 65 Cb 0.06 -0.36 -0.08 0.00 0.53 0.00 0.00 43.42 43.58 2hmx n LEU 65 CO 0.17 0.73 0.70 -0.61 -1.11 0.00 0.00 177.39 177.28 2hmx h GLN 66 N 0.00 -0.46 -0.49 1.96 -0.00 -1.52 0.97 115.11 115.57 2hmx h GLN 66 Ca -0.51 0.03 0.09 0.00 -0.00 0.00 0.00 58.65 58.26 2hmx h GLN 66 Cb 1.92 0.11 -0.10 0.00 0.00 0.00 0.00 27.48 29.41 2hmx h GLN 66 CO -0.04 -0.26 -0.34 -1.35 0.00 0.00 0.00 178.83 176.84 2hmx h PRO 67 N -0.57 -0.21 0.00 -2.39 0.11 -1.72 -2.21 132.00 125.01 2hmx h PRO 67 Ca -0.05 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2hmx h PRO 67 Cb 0.42 0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.58 2hmx h PRO 67 CO 0.08 -0.14 0.00 0.43 -0.21 0.00 0.00 178.00 178.16 2hmx n SER 68 N -5.42 0.00 0.06 -2.05 7.64 0.20 -1.53 113.62 112.52 2hmx n SER 68 Ca 0.02 -1.46 -0.09 0.00 1.01 0.00 0.00 58.87 58.35 2hmx n SER 68 Cb 0.35 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.42 2hmx n SER 68 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2hmx h LEU 69 N 0.00 0.07 -1.86 -3.43 3.38 0.13 0.83 115.31 114.44 2hmx h LEU 69 Ca 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2hmx h LEU 69 Cb 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.73 2hmx h LEU 69 CO 0.00 1.06 0.00 0.06 0.09 0.00 0.00 178.44 179.65 2hmx h GLN 70 N 0.01 0.00 0.00 1.13 -0.00 -1.42 -2.09 115.11 112.75 2hmx h GLN 70 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.61 2hmx h GLN 70 Cb 1.82 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.30 2hmx h GLN 70 CO 0.14 0.00 -0.95 0.25 -0.00 0.00 0.00 178.83 178.27 2hmx n THR 71 N -2.50 0.00 0.00 1.86 -2.24 -0.51 -4.82 114.28 106.06 2hmx n THR 71 Ca -0.02 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 2hmx n THR 71 Cb 0.06 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 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 2.43 0.18 0.00 3.38 0.00 0.28 -4.63 105.19 106.83 2hmx n GLY 72 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.36 0.00 0.13 1.61 3.41 -1.21 -4.79 113.62 111.42 2hmx n SER 73 Ca 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.71 2hmx n SER 73 Cb 0.00 0.00 0.50 0.00 -0.26 0.00 0.00 64.21 64.45 2hmx n SER 73 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2hmx n GLU 74 N -0.04 0.13 0.04 4.33 0.28 -1.26 -0.38 120.64 123.74 2hmx n GLU 74 Ca 0.00 0.59 -0.04 0.00 -0.16 0.00 0.00 57.16 57.54 2hmx n GLU 74 Cb 0.00 -1.88 -0.09 0.00 1.43 0.00 0.00 31.44 30.90 2hmx n GLU 74 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 2hmx h GLU 75 N 0.00 0.00 0.00 3.44 4.22 -1.96 -0.12 114.58 120.16 2hmx h GLU 75 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2hmx h GLU 75 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2hmx h GLU 75 CO 0.00 0.62 0.00 1.25 -2.18 0.00 0.00 179.01 178.70 2hmx h LEU 76 N 0.00 0.00 -0.06 1.64 6.46 -1.02 -2.45 115.31 119.88 2hmx h LEU 76 Ca -0.12 0.00 -0.23 0.00 -0.12 0.00 0.00 57.88 57.41 2hmx h LEU 76 Cb 1.74 0.00 0.02 0.00 -0.73 0.00 0.00 40.66 41.68 2hmx h LEU 76 CO 0.09 0.00 -0.85 -0.09 -0.62 0.00 0.00 178.44 176.97 2hmx h ARG 77 N 0.00 0.68 -0.15 1.25 2.43 0.23 0.57 114.38 119.39 2hmx h ARG 77 Ca 0.00 -0.65 -0.17 0.00 -0.81 0.00 0.00 59.98 58.34 2hmx h ARG 77 Cb 0.52 0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2hmx h ARG 77 CO 0.00 1.25 -0.63 1.03 -1.51 0.00 0.00 179.97 180.12 2hmx h SER 78 N 0.36 0.61 -0.75 -3.80 0.87 -1.38 -0.83 113.55 108.62 2hmx h SER 78 Ca -0.09 -0.35 0.03 0.00 -1.23 0.00 0.00 61.79 60.15 2hmx h SER 78 Cb 1.50 -0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 63.24 2hmx h SER 78 CO 0.17 1.08 0.49 -0.07 -0.53 0.00 0.00 176.83 177.98 2hmx h LEU 79 N 0.39 0.79 -0.33 2.23 4.07 -1.41 -2.10 115.31 118.95 2hmx h LEU 79 Ca -0.01 -0.01 -0.13 0.00 0.08 0.00 0.00 57.88 57.81 2hmx h LEU 79 Cb 1.19 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.74 2hmx h LEU 79 CO 0.12 0.54 -0.29 0.22 -1.08 0.00 0.00 178.44 177.95 2hmx h TYR 80 N 0.92 0.94 -0.51 1.13 3.20 0.13 -2.02 116.97 120.75 2hmx h TYR 80 Ca 0.30 -0.27 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 2hmx h TYR 80 Cb 0.05 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.10 2hmx h TYR 80 CO -0.00 1.04 0.23 -2.95 -1.64 0.00 0.00 178.16 174.84 2hmx h ASN 81 N 0.56 0.65 1.58 -2.11 7.08 -0.53 -0.55 115.58 122.26 2hmx h ASN 81 Ca 0.06 -0.07 0.00 0.00 -3.08 0.00 0.00 56.30 53.21 2hmx h ASN 81 Cb 0.87 -0.17 0.00 0.00 -2.08 0.00 0.00 38.32 36.94 2hmx h ASN 81 CO 0.07 0.57 0.00 0.71 -2.08 0.00 0.00 177.43 176.71 2hmx h THR 82 N 0.72 0.00 0.12 6.14 1.35 -1.09 0.17 112.91 120.32 2hmx h THR 82 Ca 0.18 -0.68 -0.33 0.00 -0.55 0.00 0.00 66.41 65.03 2hmx h THR 82 Cb 0.11 1.66 -0.01 0.00 -1.73 0.00 0.00 68.15 68.17 2hmx h THR 82 CO -0.02 0.00 -1.74 0.40 -0.25 0.00 0.00 175.52 173.91 2hmx h ILE 83 N 0.00 0.81 0.00 6.82 1.08 -0.96 0.57 117.51 125.83 2hmx h ILE 83 Ca 0.00 -2.37 -0.09 0.00 -0.39 0.00 0.00 64.86 62.01 2hmx h ILE 83 Cb 0.79 2.58 -0.01 0.00 -3.07 0.00 0.00 36.82 37.10 2hmx h ILE 83 CO 0.00 0.79 -0.42 0.00 -0.69 0.00 0.00 178.15 177.83 2hmx h ALA 84 N -0.01 1.10 0.47 1.87 0.00 -0.86 0.60 119.26 122.44 2hmx h ALA 84 Ca -0.37 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.14 2hmx h ALA 84 Cb 1.91 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.64 2hmx h ALA 84 CO 0.07 0.52 -0.23 0.28 0.00 0.00 0.00 179.25 179.89 2hmx h VAL 85 N 0.00 0.00 0.00 0.00 2.07 -0.63 0.34 116.25 118.03 2hmx h VAL 85 Ca -0.00 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.13 2hmx h VAL 85 Cb 0.85 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 2hmx h VAL 85 CO 0.05 0.00 0.00 -0.11 0.02 0.00 0.00 177.57 177.53 2hmx n LEU 86 N -4.77 0.18 0.09 2.57 7.94 0.20 0.99 117.00 124.20 2hmx n LEU 86 Ca -0.08 0.58 -0.22 0.00 -1.11 0.00 0.00 56.01 55.18 2hmx n LEU 86 Cb 0.25 -0.60 -0.15 0.00 0.53 0.00 0.00 43.42 43.45 2hmx n LEU 86 CO 0.19 -0.64 -0.42 0.22 -1.11 0.00 0.00 177.39 175.64 2hmx h TYR 87 N 0.00 0.72 0.37 1.96 5.03 0.51 0.38 116.97 125.93 2hmx h TYR 87 Ca 0.00 -0.52 -0.00 0.00 2.58 0.00 0.00 58.73 60.78 2hmx h TYR 87 Cb 0.01 -0.03 -0.02 0.00 1.55 0.00 0.00 36.73 38.24 2hmx h TYR 87 CO 0.00 1.58 -0.35 0.00 -1.32 0.00 0.00 178.16 178.07 2hmx h VAL 89 N -0.74 1.25 -0.42 0.00 2.07 0.82 0.71 116.25 119.94 2hmx h VAL 89 Ca -0.03 -0.62 -0.05 0.00 0.82 0.00 0.00 66.70 66.82 2hmx h VAL 89 Cb 0.66 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2hmx h VAL 89 CO -0.05 0.28 0.05 0.45 0.02 0.00 0.00 177.57 178.32 2hmx h HIS 90 N 1.16 0.76 0.73 1.57 -0.00 -0.08 -0.25 115.15 119.04 2hmx h HIS 90 Ca 0.29 -0.11 -0.04 0.00 -0.00 0.00 0.00 60.37 60.51 2hmx h HIS 90 Cb 0.04 -0.21 0.01 0.00 -0.00 0.00 0.00 27.41 27.25 2hmx h HIS 90 CO 0.01 0.74 -0.35 0.37 -0.00 0.00 0.00 177.93 178.70 2hmx h GLN 91 N 0.56 -0.95 0.00 2.45 5.75 -0.27 -3.47 115.11 119.18 2hmx h GLN 91 Ca 0.13 0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.69 2hmx h GLN 91 Cb 0.41 0.22 0.00 0.00 1.07 0.00 0.00 27.48 29.17 2hmx h GLN 91 CO 0.01 -0.63 0.00 -2.13 -2.65 0.00 0.00 178.83 173.43 2hmx n ARG 92 N -4.78 0.00 -1.70 1.69 0.00 0.16 -5.10 116.66 106.93 2hmx n ARG 92 Ca -0.12 0.00 -0.43 0.00 -0.00 0.00 0.00 57.85 57.30 2hmx n ARG 92 Cb 0.39 0.00 -0.03 0.00 0.00 0.00 0.00 32.46 32.82 2hmx n ARG 92 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 2hmx n ILE 93 N 0.00 0.19 -4.34 5.15 -0.00 0.20 -4.77 119.36 115.79 2hmx n ILE 93 Ca 0.00 -0.03 -0.28 0.00 -0.00 0.00 0.00 62.75 62.44 2hmx n ILE 93 Cb 0.00 -2.01 -0.11 0.00 -0.00 0.00 0.00 39.64 37.52 2hmx n ILE 93 CO 0.00 0.00 0.00 -1.81 -0.00 0.00 0.00 176.55 174.74 2hmx s ASP 94 N 1.95 3.83 0.31 4.38 1.01 -1.26 -1.97 116.67 124.91 2hmx s ASP 94 Ca 0.79 -0.66 0.05 0.00 0.71 0.00 0.00 52.55 53.44 2hmx s ASP 94 Cb -0.51 -0.49 -0.03 0.00 1.01 0.00 0.00 42.92 42.90 2hmx s ASP 94 CO 0.35 0.14 0.28 0.68 0.21 0.00 0.00 175.17 176.83 2hmx s VAL 95 N -1.44 0.00 0.00 -1.27 -7.23 -1.26 -5.04 120.40 104.16 2hmx s VAL 95 Ca 0.20 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 58.42 2hmx s VAL 95 Cb -0.09 -2.51 0.00 0.00 0.56 0.00 0.00 36.38 34.33 2hmx s VAL 95 CO 0.11 0.00 0.00 2.29 -0.31 0.00 0.00 175.10 177.19 2hmx n LYS 96 N -0.56 2.64 -4.22 4.82 2.85 -1.26 -4.87 118.16 117.56 2hmx n LYS 96 Ca 0.06 0.00 -0.13 0.00 -1.05 0.00 0.00 58.31 57.19 2hmx n LYS 96 Cb 0.63 -0.83 -0.10 0.00 -0.65 0.00 0.00 35.03 34.07 2hmx n LYS 96 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 2hmx s ASP 97 N -2.28 0.31 0.00 -5.58 1.47 -1.26 0.60 116.67 109.93 2hmx s ASP 97 Ca 0.00 -1.39 0.00 0.00 1.18 0.00 0.00 52.55 52.34 2hmx s ASP 97 Cb 0.00 0.35 0.00 0.00 -0.34 0.00 0.00 42.92 42.93 2hmx s ASP 97 CO 0.00 -0.83 0.96 0.41 0.68 0.00 0.00 175.17 176.39 2hmx n THR 98 N -0.30 0.00 0.02 2.11 -1.04 -0.34 -2.20 114.28 112.54 2hmx n THR 98 Ca 0.02 1.46 0.02 0.00 -2.04 0.00 0.00 64.05 63.50 2hmx n THR 98 Cb 0.66 -2.44 0.09 0.00 -1.82 0.00 0.00 70.33 66.82 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 -1.90 0.02 -0.10 -2.82 2.85 -1.26 0.62 118.16 115.58 2hmx n LYS 99 Ca 0.00 0.52 -0.24 0.00 -1.05 0.00 0.00 58.31 57.54 2hmx n LYS 99 Cb 0.00 -1.57 -0.12 0.00 -0.65 0.00 0.00 35.03 32.69 2hmx n LYS 99 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2hmx n GLU 100 N -1.61 0.62 -0.06 -1.58 0.00 -1.22 -1.02 120.64 115.76 2hmx n GLU 100 Ca -0.00 0.39 -0.10 0.00 0.00 0.00 0.00 57.16 57.45 2hmx n GLU 100 Cb 0.01 -1.65 -0.03 0.00 0.00 0.00 0.00 31.44 29.77 2hmx n GLU 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2hmx h ALA 101 N -0.48 0.29 -0.89 4.31 0.00 -0.37 0.57 119.26 122.69 2hmx h ALA 101 Ca -0.49 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.39 2hmx h ALA 101 Cb 1.59 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 19.24 2hmx h ALA 101 CO -0.20 -0.20 0.59 1.25 0.00 0.00 0.00 179.25 180.68 2hmx h LEU 102 N 0.29 1.02 0.21 0.00 5.85 0.05 -0.75 115.31 121.98 2hmx h LEU 102 Ca 0.08 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 2hmx h LEU 102 Cb 0.01 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.79 2hmx h LEU 102 CO -0.02 0.73 -0.10 -0.78 -0.34 0.00 0.00 178.44 177.94 2hmx h ASP 103 N 1.20 -0.24 0.29 1.25 3.58 -0.33 0.61 116.42 122.78 2hmx h ASP 103 Ca 0.33 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.73 2hmx h ASP 103 Cb -0.13 0.06 0.00 0.00 1.72 0.00 0.00 39.33 40.99 2hmx h ASP 103 CO -0.08 -0.11 0.00 1.17 -2.88 0.00 0.00 179.24 177.35 2hmx n LYS 104 N -5.18 0.06 -0.05 0.28 3.00 0.19 0.59 118.16 117.05 2hmx n LYS 104 Ca -0.09 0.43 -0.08 0.00 -0.00 0.00 0.00 58.31 58.57 2hmx n LYS 104 Cb 0.16 -1.64 -0.04 0.00 0.00 0.00 0.00 35.03 33.50 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 -1.76 0.58 0.23 3.15 -0.00 -0.25 -1.93 119.36 119.37 2hmx n ILE 105 Ca 0.01 -0.21 0.12 0.00 -0.00 0.00 0.00 62.75 62.68 2hmx n ILE 105 Cb 0.10 -1.01 0.74 0.00 -0.00 0.00 0.00 39.64 39.47 2hmx n ILE 105 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.55 176.47 2hmx h GLU 106 N -0.07 0.00 0.17 0.38 4.22 0.56 0.53 114.58 120.36 2hmx h GLU 106 Ca -0.23 0.00 -0.34 0.00 0.08 0.00 0.00 59.36 58.87 2hmx h GLU 106 Cb 1.33 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.58 2hmx h GLU 106 CO -0.06 0.00 -1.70 1.49 -2.18 0.00 0.00 179.01 176.56 2hmx h GLU 107 N 0.00 0.37 0.00 1.92 4.22 0.06 -3.46 114.58 117.69 2hmx h GLU 107 Ca 0.04 -0.63 0.00 0.00 0.08 0.00 0.00 59.36 58.85 2hmx h GLU 107 Cb 0.17 0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.65 2hmx h GLU 107 CO -0.00 1.30 0.00 -1.91 -2.18 0.00 0.00 179.01 176.22 2hmx n GLU 108 N -3.65 0.00 -1.64 1.92 0.00 -0.78 -4.92 120.64 111.57 2hmx n GLU 108 Ca -0.25 0.00 -0.16 0.00 0.00 0.00 0.00 57.16 56.75 2hmx n GLU 108 Cb 1.04 -0.42 -0.10 0.00 0.00 0.00 0.00 31.44 31.96 2hmx n GLU 108 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.13 175.99 2hmx s GLN 109 N -1.03 1.31 -0.25 5.31 -0.44 0.11 -4.82 119.66 119.86 2hmx s GLN 109 Ca 0.00 -0.35 -0.28 0.00 -2.50 0.00 0.00 55.36 52.23 2hmx s GLN 109 Cb 0.00 -4.97 -0.05 0.00 -1.64 0.00 0.00 33.01 26.35 2hmx s GLN 109 CO 0.00 -5.27 2.22 1.21 0.50 0.00 0.00 175.29 173.95 2hmx s ASN 110 N 8.73 5.39 0.00 6.67 3.84 -1.26 -4.39 114.94 133.91 2hmx s ASN 110 Ca 0.82 1.80 0.00 0.00 0.21 0.00 0.00 52.86 55.69 2hmx s ASN 110 Cb -0.06 -2.51 0.00 0.00 -0.55 0.00 0.00 41.25 38.13 2hmx s ASN 110 CO 0.16 -2.03 0.00 1.17 -2.79 0.00 0.00 177.10 173.61 2hmx n LYS 111 N 8.78 0.00 -3.96 0.43 0.00 -1.26 -5.09 118.16 117.05 2hmx n LYS 111 Ca 0.30 0.00 -0.20 0.00 0.00 0.00 0.00 58.31 58.41 2hmx n LYS 111 Cb 0.46 0.00 -0.17 0.00 0.00 0.00 0.00 35.03 35.32 2hmx n LYS 111 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2hmx s SER 112 N 0.00 0.93 0.16 3.14 0.15 -1.26 -4.78 113.70 112.04 2hmx s SER 112 Ca 0.00 -0.07 -0.13 0.00 0.70 0.00 0.00 55.95 56.44 2hmx s SER 112 Cb 0.00 -0.35 0.05 0.00 -1.71 0.00 0.00 66.02 64.00 2hmx s SER 112 CO 0.00 -0.11 0.65 0.29 1.20 0.00 0.00 173.24 175.27 2hmx n LYS 113 N 4.41 0.51 -4.13 5.44 4.76 -1.26 -5.13 118.16 122.75 2hmx n LYS 113 Ca -0.20 -1.11 -0.14 0.00 -2.87 0.00 0.00 58.31 53.99 2hmx n LYS 113 Cb 0.50 1.47 -0.06 0.00 -1.84 0.00 0.00 35.03 35.10 2hmx n LYS 113 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2hmx s LYS 114 N -2.04 1.66 0.09 1.97 1.02 -1.26 -4.03 119.74 117.15 2hmx s LYS 114 Ca 0.14 -1.69 -0.15 0.00 0.02 0.00 0.00 55.97 54.30 2hmx s LYS 114 Cb -0.02 0.39 0.05 0.00 -0.52 0.00 0.00 37.83 37.73 2hmx s LYS 114 CO 0.05 -0.65 0.71 1.17 -0.92 0.00 0.00 175.35 175.71 2hmx n LYS 115 N -0.48 0.35 -0.16 1.68 3.00 -1.26 -4.93 118.16 116.37 2hmx n LYS 115 Ca 0.02 -0.86 0.00 0.00 -0.00 0.00 0.00 58.31 57.47 2hmx n LYS 115 Cb 0.63 1.20 0.00 0.00 0.00 0.00 0.00 35.03 36.86 2hmx n LYS 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2hmx n ALA 116 N -1.57 0.00 -2.71 3.14 0.00 -1.26 -5.00 120.51 113.12 2hmx n ALA 116 Ca -0.09 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.31 2hmx n ALA 116 Cb 0.38 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.85 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 -0.29 0.73 -3.58 0.00 7.27 -1.26 -4.78 117.38 115.46 2hmx n GLN 117 Ca 0.00 -0.59 0.03 0.00 0.07 0.00 0.00 57.00 56.50 2hmx n GLN 117 Cb 0.00 -0.09 -0.00 0.00 2.41 0.00 0.00 30.24 32.56 2hmx n GLN 117 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 2hmx s GLN 118 N -2.70 0.19 0.14 3.69 0.74 -1.26 -5.00 119.66 115.46 2hmx s GLN 118 Ca 0.13 -0.11 0.00 0.00 0.05 0.00 0.00 55.36 55.43 2hmx s GLN 118 Cb -0.01 0.06 0.00 0.00 1.10 0.00 0.00 33.01 34.17 2hmx s GLN 118 CO 0.08 -0.09 0.00 0.00 -0.55 0.00 0.00 175.29 174.74 2hmx n ALA 119 N -0.49 -2.13 -3.19 1.58 0.00 -1.26 -4.85 120.51 110.17 2hmx n ALA 119 Ca -0.09 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.78 2hmx n ALA 119 Cb 0.63 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.73 2hmx n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hmx n ALA 120 N 1.71 0.00 -3.46 0.00 0.00 -1.26 -5.12 120.51 112.37 2hmx n ALA 120 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 2hmx n ALA 120 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 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 -2.00 -0.60 -0.31 0.00 0.00 -1.26 -5.09 121.76 112.49 2hmx s ALA 121 Ca 0.00 0.58 -0.09 0.00 0.00 0.00 0.00 51.96 52.45 2hmx s ALA 121 Cb 0.00 -1.41 0.19 0.00 0.00 0.00 0.00 23.12 21.90 2hmx s ALA 121 CO 0.00 -1.16 1.01 -0.51 0.00 0.00 0.00 175.76 175.11 2hmx s ASP 122 N 2.42 -0.46 0.36 0.00 1.01 -1.26 -5.16 116.67 113.57 2hmx s ASP 122 Ca 0.08 -0.08 0.00 0.00 0.71 0.00 0.00 52.55 53.26 2hmx s ASP 122 Cb -0.15 0.95 0.00 0.00 1.01 0.00 0.00 42.92 44.73 2hmx s ASP 122 CO -0.13 -0.07 0.00 0.41 0.21 0.00 0.00 175.17 175.59 2hmx n THR 123 N 4.46 0.00 0.00 -1.27 -1.04 -1.26 -5.04 114.28 110.14 2hmx n THR 123 Ca 0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 2hmx n THR 123 Cb 0.60 -0.45 0.00 0.00 -1.82 0.00 0.00 70.33 68.66 2hmx n THR 123 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2hmx n GLY 124 N -3.90 2.20 2.14 3.41 0.00 -1.26 -5.12 105.19 102.67 2hmx n GLY 124 Ca 0.01 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2hmx n GLY 124 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2hmx n ASN 125 N 0.00 -2.54 -2.31 1.61 2.85 -1.26 -5.10 115.26 108.51 2hmx n ASN 125 Ca 0.00 0.62 -0.05 0.00 -0.11 0.00 0.00 54.58 55.04 2hmx n ASN 125 Cb 0.00 2.49 0.02 0.00 1.24 0.00 0.00 39.78 43.54 2hmx n ASN 125 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 2hmx n ASN 126 N -3.22 -4.43 -0.57 1.20 4.13 -1.26 -4.98 115.26 106.13 2hmx n ASN 126 Ca 0.00 -0.24 -0.00 0.00 1.68 0.00 0.00 54.58 56.02 2hmx n ASN 126 Cb 0.00 -2.88 -0.00 0.00 -1.54 0.00 0.00 39.78 35.36 2hmx n ASN 126 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2hmx n SER 127 N -2.00 0.01 -4.42 6.41 7.64 -1.26 -5.12 113.62 114.88 2hmx n SER 127 Ca -0.02 -1.58 -0.32 0.00 1.01 0.00 0.00 58.87 57.95 2hmx n SER 127 Cb 0.54 -0.10 -0.14 0.00 -1.01 0.00 0.00 64.21 63.50 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 0.00 2.66 0.00 1.43 -2.07 -1.26 -4.91 119.66 115.51 2hmx s GLN 128 Ca 0.02 -0.74 0.00 0.00 -1.82 0.00 0.00 55.36 52.82 2hmx s GLN 128 Cb 0.02 -2.38 0.00 0.00 -1.09 0.00 0.00 33.01 29.56 2hmx s GLN 128 CO -0.01 0.50 0.00 1.55 -1.32 0.00 0.00 175.29 176.02 2hmx n VAL 129 N 2.65 0.00 -0.01 3.63 3.14 -1.26 -5.03 118.33 121.46 2hmx n VAL 129 Ca -0.17 0.00 -0.03 0.00 -2.96 0.00 0.00 64.34 61.18 2hmx n VAL 129 Cb 0.52 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 33.29 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 -1.97 0.39 -2.73 6.55 2.88 -1.26 -5.11 113.62 112.36 2hmx n SER 130 Ca 0.00 0.06 -0.02 0.00 -1.33 0.00 0.00 58.87 57.58 2hmx n SER 130 Cb 0.00 -0.14 -0.02 0.00 -0.75 0.00 0.00 64.21 63.30 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 -3.22 -3.57 -1.15 -1.46 10.64 -1.26 -4.77 117.38 112.60 2hmx n GLN 131 Ca -0.05 2.82 0.00 0.00 -1.83 0.00 0.00 57.00 57.94 2hmx n GLN 131 Cb 0.45 -4.75 0.00 0.00 -0.86 0.00 0.00 30.24 25.08 2hmx n GLN 131 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 2hmx n ASN 132 N 1.20 -5.86 -0.87 2.61 2.85 -1.26 -5.26 115.26 108.66 2hmx n ASN 132 Ca -0.15 0.73 0.12 0.00 -0.11 0.00 0.00 54.58 55.17 2hmx n ASN 132 Cb 0.27 -2.65 0.18 0.00 1.24 0.00 0.00 39.78 38.82 2hmx n ASN 132 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15