#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 3.99 0.00 -0.41 1.00 -1.26 -4.76 119.30 117.86 2hmx s MET 2 Ca 0.00 -2.02 0.00 0.00 0.00 0.00 0.00 55.69 53.67 2hmx s MET 2 Cb 0.00 -5.51 0.00 0.00 0.00 0.00 0.00 34.83 29.32 2hmx s MET 2 CO 0.00 -2.23 0.00 0.41 0.00 0.00 0.00 175.02 173.20 2hmx n GLY 3 N 5.35 -0.72 0.24 -0.03 0.00 -1.26 -4.63 105.19 104.14 2hmx n GLY 3 Ca 0.48 -1.54 0.07 0.00 0.00 0.00 0.00 46.02 45.04 2hmx n GLY 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hmx h ALA 4 N 0.00 1.63 -1.92 4.61 0.00 -2.02 -3.45 119.26 118.11 2hmx h ALA 4 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2hmx h ALA 4 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2hmx h ALA 4 CO 0.00 0.19 0.00 0.54 0.00 0.00 0.00 179.25 179.98 2hmx n ARG 5 N -4.19 0.00 -2.61 0.00 1.74 -1.26 -4.85 116.66 105.50 2hmx n ARG 5 Ca -0.02 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.86 2hmx n ARG 5 Cb 0.22 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 31.67 2hmx n ARG 5 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2hmx n ALA 6 N -1.31 -0.69 -0.96 7.54 0.00 -1.26 -4.74 120.51 119.08 2hmx n ALA 6 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2hmx n ALA 6 Cb 0.00 -2.69 0.00 0.00 0.00 0.00 0.00 19.45 16.76 2hmx n ALA 6 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2hmx n SER 7 N -1.82 0.00 0.15 0.00 2.88 -1.26 0.99 113.62 114.56 2hmx n SER 7 Ca -0.17 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.21 2hmx n SER 7 Cb 0.65 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 64.02 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 0.00 0.07 -3.19 2.46 2.07 -1.92 -3.48 116.25 112.26 2hmx h VAL 8 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2hmx h VAL 8 Cb 0.00 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.84 2hmx h VAL 8 CO 0.00 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.77 2hmx n LEU 9 N -5.49 0.00 -4.62 2.57 4.77 0.28 -4.68 117.00 109.82 2hmx n LEU 9 Ca -0.09 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.66 2hmx n LEU 9 Cb 0.41 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.42 2hmx n LEU 9 CO 0.19 -0.32 -0.33 -0.94 -1.33 0.00 0.00 177.39 174.66 2hmx s SER 10 N -1.00 4.29 0.17 -1.43 1.04 -1.26 -4.49 113.70 111.03 2hmx s SER 10 Ca 0.00 -0.83 -0.13 0.00 0.48 0.00 0.00 55.95 55.48 2hmx s SER 10 Cb 0.00 -0.65 0.08 0.00 0.10 0.00 0.00 66.02 65.55 2hmx s SER 10 CO 0.00 -0.09 1.77 1.23 0.98 0.00 0.00 173.24 177.13 2hmx h GLY 11 N 1.89 0.88 0.82 7.32 0.00 -1.94 0.69 103.07 112.73 2hmx h GLY 11 Ca -0.43 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 46.44 2hmx h GLY 11 CO 0.63 0.40 -0.03 -1.33 0.00 0.00 0.00 176.54 176.20 2hmx h GLY 12 N 0.79 0.44 2.00 4.60 0.00 -1.99 -2.22 103.07 106.68 2hmx h GLY 12 Ca 0.20 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.18 2hmx h GLY 12 CO -0.03 0.32 0.00 1.18 0.00 0.00 0.00 176.54 178.01 2hmx n GLU 13 N -4.63 0.11 -0.09 4.80 1.02 0.12 -1.57 120.64 120.40 2hmx n GLU 13 Ca -0.04 0.58 -0.20 0.00 -0.02 0.00 0.00 57.16 57.48 2hmx n GLU 13 Cb 0.27 -1.83 -0.12 0.00 -0.02 0.00 0.00 31.44 29.73 2hmx n GLU 13 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2hmx n LEU 14 N -2.05 2.77 0.06 -4.62 7.94 0.20 -0.18 117.00 121.11 2hmx n LEU 14 Ca -0.01 0.01 0.04 0.00 -1.11 0.00 0.00 56.01 54.94 2hmx n LEU 14 Cb 0.04 -0.96 0.21 0.00 0.53 0.00 0.00 43.42 43.24 2hmx n LEU 14 CO 0.08 0.87 0.62 -0.67 -1.11 0.00 0.00 177.39 177.18 2hmx n ASP 15 N -3.44 0.20 -0.06 1.96 -0.08 -0.75 0.60 116.55 114.98 2hmx n ASP 15 Ca -0.42 0.58 -0.06 0.00 -1.51 0.00 0.00 54.79 53.38 2hmx n ASP 15 Cb 0.99 -0.61 -0.04 0.00 2.34 0.00 0.00 41.12 43.80 2hmx n ASP 15 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 2hmx h LYS 16 N 0.00 0.00 0.00 -0.67 3.11 -1.06 -3.38 116.57 114.56 2hmx h LYS 16 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2hmx h LYS 16 Cb 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.26 2hmx h LYS 16 CO 0.00 0.27 0.00 1.87 -2.81 0.00 0.00 179.45 178.78 2hmx n TRP 17 N -4.67 0.63 -0.49 1.91 -0.00 0.20 -3.20 117.44 111.82 2hmx n TRP 17 Ca -0.07 0.33 -0.13 0.00 -0.00 0.00 0.00 57.50 57.62 2hmx n TRP 17 Cb 0.22 -1.02 0.15 0.00 -0.00 0.00 0.00 31.31 30.66 2hmx n TRP 17 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08 2hmx n GLU 18 N -2.15 2.12 0.00 5.87 1.02 -0.80 -3.60 120.64 123.10 2hmx n GLU 18 Ca -0.01 -2.07 0.00 0.00 -0.02 0.00 0.00 57.16 55.06 2hmx n GLU 18 Cb 0.04 -1.84 0.00 0.00 -0.02 0.00 0.00 31.44 29.62 2hmx n GLU 18 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2hmx n LYS 19 N -0.48 0.00 -3.50 3.49 4.81 -1.03 -4.82 118.16 116.63 2hmx n LYS 19 Ca 0.38 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.40 2hmx n LYS 19 Cb 1.25 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 36.20 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 5.21 0.35 3.15 1.01 -0.91 -4.82 121.20 125.19 2hmx s ILE 20 Ca 0.00 -0.49 -0.29 0.00 0.00 0.00 0.00 60.65 59.88 2hmx s ILE 20 Cb 0.00 -3.80 -0.11 0.00 0.01 0.00 0.00 42.46 38.56 2hmx s ILE 20 CO 0.00 -0.17 1.48 -0.13 0.00 0.00 0.00 174.94 176.11 2hmx s ARG 21 N 1.69 4.15 0.32 2.79 0.52 0.20 0.61 118.95 129.23 2hmx s ARG 21 Ca 0.05 2.51 0.17 0.00 -0.52 0.00 0.00 55.73 57.95 2hmx s ARG 21 Cb -0.18 -3.00 0.31 0.00 0.52 0.00 0.00 34.95 32.60 2hmx s ARG 21 CO 0.10 -0.50 1.56 -0.07 0.02 0.00 0.00 175.30 176.41 2hmx h LEU 22 N 3.42 0.00 -7.58 2.53 3.38 -1.75 0.30 115.31 115.61 2hmx h LEU 22 Ca -0.50 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.34 2hmx h LEU 22 Cb 1.23 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.78 2hmx h LEU 22 CO 0.67 0.44 -0.35 0.00 0.09 0.00 0.00 178.44 179.29 2hmx s ARG 23 N -3.18 0.59 0.42 1.13 1.70 -1.26 -4.17 118.95 114.17 2hmx s ARG 23 Ca 0.03 -0.21 0.17 0.00 -0.47 0.00 0.00 55.73 55.25 2hmx s ARG 23 Cb 0.09 0.26 1.07 0.00 -0.57 0.00 0.00 34.95 35.79 2hmx s ARG 23 CO 0.72 -0.15 1.89 -1.35 -1.08 0.00 0.00 175.30 175.33 2hmx h PRO 24 N 4.14 0.40 0.00 3.89 0.11 -1.96 -0.98 132.00 137.60 2hmx h PRO 24 Ca -0.30 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.78 2hmx h PRO 24 Cb 1.18 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2hmx h PRO 24 CO 0.40 0.26 -0.06 0.78 -0.21 0.00 0.00 178.00 179.17 2hmx h GLY 25 N 0.41 0.00 -1.97 -0.55 0.00 -2.00 -3.47 103.07 95.50 2hmx h GLY 25 Ca 0.41 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.69 2hmx h GLY 25 CO -0.14 0.00 -0.09 0.61 0.00 0.00 0.00 176.54 176.92 2hmx n GLY 26 N -1.29 0.59 0.00 4.60 0.00 -0.37 -5.02 105.19 103.69 2hmx n GLY 26 Ca -0.03 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.20 0.00 -4.51 1.61 0.00 -1.26 -4.99 118.16 107.80 2hmx n LYS 27 Ca -0.01 0.17 -0.24 0.00 0.00 0.00 0.00 58.31 58.22 2hmx n LYS 27 Cb 0.51 -0.93 -0.10 0.00 0.00 0.00 0.00 35.03 34.51 2hmx n LYS 27 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 2hmx s LYS 28 N -1.04 1.79 0.06 1.64 2.47 -1.26 -5.08 119.74 118.32 2hmx s LYS 28 Ca 0.00 -2.02 0.05 0.00 -1.56 0.00 0.00 55.97 52.44 2hmx s LYS 28 Cb 0.00 -1.03 -0.03 0.00 -1.46 0.00 0.00 37.83 35.31 2hmx s LYS 28 CO 0.00 -0.21 -0.14 1.14 0.16 0.00 0.00 175.35 176.30 2hmx s GLN 29 N -3.83 0.85 0.44 4.03 0.00 -1.26 -2.18 119.66 117.71 2hmx s GLN 29 Ca 0.32 -0.90 -0.26 0.00 -0.00 0.00 0.00 55.36 54.52 2hmx s GLN 29 Cb 0.08 -0.86 -0.09 0.00 0.00 0.00 0.00 33.01 32.14 2hmx s GLN 29 CO 0.15 0.20 1.45 0.66 0.00 0.00 0.00 175.29 177.75 2hmx n TYR 30 N 1.44 2.78 -4.35 9.60 4.02 0.20 -4.75 117.16 126.10 2hmx n TYR 30 Ca -0.20 0.44 -0.21 0.00 -0.01 0.00 0.00 57.90 57.92 2hmx n TYR 30 Cb 0.54 -2.48 -0.08 0.00 -0.02 0.00 0.00 39.34 37.30 2hmx n TYR 30 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 176.86 176.06 2hmx s LYS 31 N -2.38 1.79 -0.07 -0.72 2.20 -1.26 -2.15 119.74 117.15 2hmx s LYS 31 Ca 0.60 -2.05 0.19 0.00 -0.36 0.00 0.00 55.97 54.34 2hmx s LYS 31 Cb -0.45 0.05 -0.25 0.00 -1.51 0.00 0.00 37.83 35.67 2hmx s LYS 31 CO 0.59 -0.59 0.42 1.28 -0.36 0.00 0.00 175.35 176.68 2hmx n LEU 32 N -0.70 0.23 0.00 5.43 4.77 -1.26 0.59 117.00 126.06 2hmx n LEU 32 Ca 0.03 0.10 0.03 0.00 -0.03 0.00 0.00 56.01 56.14 2hmx n LEU 32 Cb 0.63 0.21 0.14 0.00 -2.33 0.00 0.00 43.42 42.08 2hmx n LEU 32 CO 0.33 0.22 0.61 1.17 -1.33 0.00 0.00 177.39 178.39 2hmx n LYS 33 N -2.61 0.00 -0.02 3.23 3.00 -1.26 -2.15 118.16 118.35 2hmx n LYS 33 Ca -0.16 0.38 0.01 0.00 -0.00 0.00 0.00 58.31 58.54 2hmx n LYS 33 Cb 0.86 -1.50 -0.07 0.00 0.00 0.00 0.00 35.03 34.32 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 -1.50 0.00 -0.02 5.64 -0.00 -0.68 -1.79 115.22 116.87 2hmx n HIS 34 Ca 0.02 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.09 2hmx n HIS 34 Cb 0.08 -0.28 -0.05 0.00 -0.12 0.00 0.00 29.99 29.61 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 1.09 0.00 3.57 2.10 0.12 -0.80 117.51 123.59 2hmx h ILE 35 Ca -0.09 -0.26 -0.05 0.00 1.08 0.00 0.00 64.86 65.54 2hmx h ILE 35 Cb 0.84 1.05 -0.01 0.00 -1.09 0.00 0.00 36.82 37.61 2hmx h ILE 35 CO 0.00 0.09 -0.25 0.58 -1.08 0.00 0.00 178.15 177.49 2hmx h VAL 36 N 0.10 1.11 0.60 2.19 2.07 -1.37 0.95 116.25 121.91 2hmx h VAL 36 Ca 0.04 -0.87 -0.03 0.00 0.82 0.00 0.00 66.70 66.67 2hmx h VAL 36 Cb 0.08 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 2hmx h VAL 36 CO -0.01 0.24 -0.32 -0.25 0.02 0.00 0.00 177.57 177.25 2hmx h TRP 37 N 0.00 -0.84 0.65 1.57 7.01 -1.23 0.81 115.95 123.93 2hmx h TRP 37 Ca -0.00 -0.01 -0.03 0.00 2.11 0.00 0.00 58.89 60.95 2hmx h TRP 37 Cb 0.46 0.29 0.01 0.00 -2.10 0.00 0.00 29.16 27.81 2hmx h TRP 37 CO 0.00 -0.50 -0.33 0.00 -2.79 0.00 0.00 178.44 174.82 2hmx h ALA 38 N -0.47 -1.23 0.00 2.65 0.00 0.21 0.19 119.26 120.61 2hmx h ALA 38 Ca -0.08 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2hmx h ALA 38 Cb 0.67 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2hmx h ALA 38 CO 0.11 -1.17 0.00 0.45 0.00 0.00 0.00 179.25 178.64 2hmx n SER 39 N -4.43 0.12 0.09 0.00 2.88 0.19 0.97 113.62 113.44 2hmx n SER 39 Ca -0.11 0.54 -0.04 0.00 -1.33 0.00 0.00 58.87 57.93 2hmx n SER 39 Cb 0.35 -0.56 -0.02 0.00 -0.75 0.00 0.00 64.21 63.23 2hmx n SER 39 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2hmx h ARG 40 N 0.00 -0.24 -0.07 -1.46 3.08 -0.66 -2.22 114.38 112.81 2hmx h ARG 40 Ca 0.00 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 2hmx h ARG 40 Cb 0.17 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 2hmx h ARG 40 CO 0.00 -0.16 0.03 1.49 -1.07 0.00 0.00 179.97 180.26 2hmx h GLU 41 N -0.42 0.09 0.22 0.04 4.57 0.38 0.28 114.58 119.75 2hmx h GLU 41 Ca -0.03 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 2hmx h GLU 41 Cb 0.19 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.76 2hmx h GLU 41 CO 0.04 0.08 -0.11 1.25 -1.18 0.00 0.00 179.01 179.09 2hmx h LEU 42 N 0.09 -0.26 -2.42 1.64 5.85 -0.66 0.37 115.31 119.92 2hmx h LEU 42 Ca 0.03 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2hmx h LEU 42 Cb 0.02 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.12 2hmx h LEU 42 CO -0.00 -0.17 0.04 1.05 -0.34 0.00 0.00 178.44 179.02 2hmx h GLU 43 N -0.34 0.00 0.00 1.25 -0.00 -0.63 0.13 114.58 115.00 2hmx h GLU 43 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.33 2hmx h GLU 43 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.98 2hmx h GLU 43 CO 0.05 0.00 -1.12 -2.13 -0.00 0.00 0.00 179.01 175.82 2hmx n ARG 44 N -2.81 0.65 0.37 1.06 0.00 0.87 -1.40 116.66 115.41 2hmx n ARG 44 Ca -0.02 -0.04 -0.15 0.00 -0.00 0.00 0.00 57.85 57.64 2hmx n ARG 44 Cb 0.10 -1.42 -0.07 0.00 0.00 0.00 0.00 32.46 31.07 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 -0.88 0.00 -0.14 -1.00 0.25 -3.46 116.94 111.71 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 0.55 0.29 0.00 0.00 3.61 0.00 0.00 35.95 40.40 2hmx h PHE 45 CO 0.00 -0.55 0.00 0.00 -1.61 0.00 0.00 178.31 176.15 2hmx n ALA 46 N -2.51 0.42 -2.53 2.45 0.00 -0.86 -5.09 120.51 112.39 2hmx n ALA 46 Ca -0.12 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.07 2hmx n ALA 46 Cb 0.38 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.74 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 0.81 -0.04 0.00 1.01 -0.49 -5.00 120.40 116.68 2hmx s VAL 47 Ca 0.00 -2.00 0.05 0.00 0.00 0.00 0.00 61.98 60.03 2hmx s VAL 47 Cb 0.00 -2.44 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 2hmx s VAL 47 CO 0.00 0.00 -0.19 0.21 0.00 0.00 0.00 175.10 175.12 2hmx s ASN 48 N -3.61 2.30 -0.04 3.32 3.84 -1.26 -4.30 114.94 115.19 2hmx s ASN 48 Ca 0.25 -0.37 -0.26 0.00 0.21 0.00 0.00 52.86 52.68 2hmx s ASN 48 Cb 0.04 -0.57 -0.21 0.00 -0.55 0.00 0.00 41.25 39.96 2hmx s ASN 48 CO 0.13 0.18 1.18 1.55 -2.79 0.00 0.00 177.10 177.36 2hmx h PRO 49 N 6.12 -0.01 -0.02 0.43 0.14 -1.91 0.83 132.00 137.59 2hmx h PRO 49 Ca -0.33 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.81 2hmx h PRO 49 Cb 1.17 0.00 -0.00 0.00 0.14 0.00 0.00 31.00 32.31 2hmx h PRO 49 CO 0.48 0.56 0.03 0.78 0.14 0.00 0.00 178.00 179.99 2hmx h GLY 50 N -0.58 0.00 0.86 1.56 0.00 -1.96 0.58 103.07 103.52 2hmx h GLY 50 Ca -0.00 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.11 2hmx h GLY 50 CO 0.00 0.00 -0.97 -2.00 0.00 0.00 0.00 176.54 173.57 2hmx h LEU 51 N 0.00 0.59 -0.30 3.11 7.12 -1.82 -0.75 115.31 123.26 2hmx h LEU 51 Ca 0.01 -0.92 0.00 0.00 0.13 0.00 0.00 57.88 57.09 2hmx h LEU 51 Cb 0.08 -0.19 0.00 0.00 -0.53 0.00 0.00 40.66 40.02 2hmx h LEU 51 CO -0.00 1.46 0.00 0.25 -0.13 0.00 0.00 178.44 180.02 2hmx h LEU 52 N -0.19 0.00 -0.52 2.25 7.12 -0.17 -2.46 115.31 121.33 2hmx h LEU 52 Ca -0.17 0.00 -0.16 0.00 0.13 0.00 0.00 57.88 57.68 2hmx h LEU 52 Cb 1.75 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.87 2hmx h LEU 52 CO 0.18 0.00 -0.65 -0.08 -0.13 0.00 0.00 178.44 177.76 2hmx h GLU 53 N 0.00 0.34 -7.34 1.25 4.81 0.16 -3.31 114.58 110.49 2hmx h GLU 53 Ca 0.00 -0.25 -0.51 0.00 -0.13 0.00 0.00 59.36 58.47 2hmx h GLU 53 Cb 0.64 0.04 0.11 0.00 0.63 0.00 0.00 28.75 30.18 2hmx h GLU 53 CO 0.00 0.88 0.34 0.95 -0.73 0.00 0.00 179.01 180.45 2hmx s THR 54 N -3.72 3.60 0.21 0.32 -4.23 -0.64 -4.79 115.64 106.39 2hmx s THR 54 Ca -0.05 0.52 -0.10 0.00 -1.18 0.00 0.00 61.69 60.88 2hmx s THR 54 Cb 0.11 -3.16 0.14 0.00 1.34 0.00 0.00 72.50 70.94 2hmx s THR 54 CO 0.82 -0.68 1.83 0.77 -0.54 0.00 0.00 174.62 176.82 2hmx h SER 55 N -0.95 0.64 -0.65 3.99 4.64 -1.81 -2.46 113.55 116.95 2hmx h SER 55 Ca -0.44 0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 60.85 2hmx h SER 55 Cb 1.23 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 63.17 2hmx h SER 55 CO 0.55 0.44 0.27 -0.08 -0.87 0.00 0.00 176.83 177.14 2hmx h GLU 56 N 0.78 0.96 -0.28 4.77 4.81 -1.89 0.70 114.58 124.42 2hmx h GLU 56 Ca 0.28 -0.16 -0.17 0.00 -0.13 0.00 0.00 59.36 59.18 2hmx h GLU 56 Cb 0.09 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.30 2hmx h GLU 56 CO -0.14 0.79 -0.49 0.78 -0.73 0.00 0.00 179.01 179.22 2hmx h GLY 57 N 0.91 0.86 2.00 1.92 0.00 -1.46 0.54 103.07 107.83 2hmx h GLY 57 Ca 0.22 -0.95 -0.01 0.00 0.00 0.00 0.00 47.33 46.59 2hmx h GLY 57 CO -0.02 0.85 -0.04 0.00 0.00 0.00 0.00 176.54 177.33 2hmx h ARG 59 N 0.00 0.29 0.00 0.00 9.65 0.13 0.57 114.38 125.03 2hmx h ARG 59 Ca -0.00 -0.50 -0.02 0.00 -1.10 0.00 0.00 59.98 58.36 2hmx h ARG 59 Cb 0.13 0.19 -0.00 0.00 -1.39 0.00 0.00 29.97 28.89 2hmx h ARG 59 CO 0.01 1.24 -0.08 0.37 2.80 0.00 0.00 179.97 184.31 2hmx h GLN 60 N -0.34 0.00 0.04 0.20 5.75 0.79 -2.03 115.11 119.53 2hmx h GLN 60 Ca -0.19 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.30 2hmx h GLN 60 Cb 1.70 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.25 2hmx h GLN 60 CO 0.13 0.08 -0.02 0.82 -2.65 0.00 0.00 178.83 177.18 2hmx h ILE 61 N 0.00 0.00 0.00 2.39 1.08 -0.62 -2.41 117.51 117.95 2hmx h ILE 61 Ca -0.00 -0.44 0.00 0.00 -0.39 0.00 0.00 64.86 64.03 2hmx h ILE 61 Cb 0.22 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.97 2hmx h ILE 61 CO 0.01 0.00 0.03 0.25 -0.69 0.00 0.00 178.15 177.75 2hmx h LEU 62 N -0.49 0.00 0.00 1.44 5.85 0.21 0.98 115.31 123.29 2hmx h LEU 62 Ca -0.01 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 0.01 0.00 -0.21 1.23 -0.34 0.00 0.00 178.44 179.13 2hmx h GLY 63 N 0.00 0.00 2.00 3.75 0.00 -1.48 -2.42 103.07 104.92 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 -3.23 115.11 119.95 2hmx h GLN 64 Ca -0.03 0.00 -0.31 0.00 0.77 0.00 0.00 58.65 59.08 2hmx h GLN 64 Cb 0.40 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.03 2hmx h GLN 64 CO -0.02 0.00 -2.16 -0.11 -1.93 0.00 0.00 178.83 174.61 2hmx n LEU 65 N -2.54 0.37 0.22 -2.39 7.94 0.21 -3.22 117.00 117.60 2hmx n LEU 65 Ca -0.01 -0.01 -0.15 0.00 -1.11 0.00 0.00 56.01 54.72 2hmx n LEU 65 Cb 0.08 0.27 -0.08 0.00 0.53 0.00 0.00 43.42 44.21 2hmx n LEU 65 CO 0.14 0.47 0.72 1.56 -1.11 0.00 0.00 177.39 179.17 2hmx h GLN 66 N 0.00 -0.50 -0.37 1.96 4.20 -1.44 0.95 115.11 119.91 2hmx h GLN 66 Ca -0.46 0.03 0.08 0.00 0.06 0.00 0.00 58.65 58.36 2hmx h GLN 66 Cb 2.00 0.11 -0.09 0.00 0.30 0.00 0.00 27.48 29.80 2hmx h GLN 66 CO 0.01 -0.31 -0.29 -1.35 -0.67 0.00 0.00 178.83 176.23 2hmx h PRO 67 N -0.56 -0.22 0.00 1.46 0.11 -1.79 -2.20 132.00 128.80 2hmx h PRO 67 Ca -0.05 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.07 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 0.09 -0.15 0.00 0.77 -0.21 0.00 0.00 178.00 178.50 2hmx h SER 68 N -0.23 0.00 0.16 -2.05 0.02 0.11 -1.65 113.55 109.92 2hmx h SER 68 Ca 0.17 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.02 2hmx h SER 68 Cb 0.51 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 2hmx h SER 68 CO -0.50 0.00 -0.36 -0.07 -1.14 0.00 0.00 176.83 174.76 2hmx h LEU 69 N 0.00 0.29 -1.84 5.07 3.38 0.13 0.83 115.31 123.17 2hmx h LEU 69 Ca 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2hmx h LEU 69 Cb 0.18 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2hmx h LEU 69 CO 0.00 0.63 0.02 0.06 0.09 0.00 0.00 178.44 179.24 2hmx h GLN 70 N 0.24 0.00 0.00 1.13 3.07 -1.43 -2.26 115.11 115.86 2hmx h GLN 70 Ca 0.03 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.77 2hmx h GLN 70 Cb 0.75 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.31 2hmx h GLN 70 CO 0.06 0.00 -0.31 -2.37 0.09 0.00 0.00 178.83 176.30 2hmx n THR 71 N -2.48 0.00 0.00 1.86 5.66 -0.69 -4.93 114.28 113.70 2hmx n THR 71 Ca -0.02 -0.01 0.00 0.00 -3.05 0.00 0.00 64.05 60.97 2hmx n THR 71 Cb 0.06 0.31 0.00 0.00 -1.55 0.00 0.00 70.33 69.15 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 -0.08 0.00 1.09 0.00 0.28 -5.06 105.19 101.42 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 -1.27 0.00 0.14 1.61 3.41 -1.23 -4.80 113.62 111.48 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 0.53 0.00 -0.26 0.00 0.00 64.21 64.48 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 -0.02 0.13 0.06 4.33 0.28 -1.26 0.04 120.64 124.20 2hmx n GLU 74 Ca 0.00 0.60 -0.04 0.00 -0.16 0.00 0.00 57.16 57.56 2hmx n GLU 74 Cb 0.00 -1.91 -0.08 0.00 1.43 0.00 0.00 31.44 30.88 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 -1.97 -0.19 114.58 120.08 2hmx h GLU 75 Ca 0.00 0.00 -0.06 0.00 0.08 0.00 0.00 59.36 59.38 2hmx h GLU 75 Cb 0.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2hmx h GLU 75 CO 0.00 0.66 -0.28 1.25 -2.18 0.00 0.00 179.01 178.47 2hmx h LEU 76 N 0.00 0.00 -0.95 1.64 6.46 -0.71 -2.34 115.31 119.41 2hmx h LEU 76 Ca -0.09 0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.57 2hmx h LEU 76 Cb 1.70 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.62 2hmx h LEU 76 CO 0.09 0.28 -0.28 -0.09 -0.62 0.00 0.00 178.44 177.82 2hmx h ARG 77 N 0.00 0.42 -0.12 1.25 2.43 0.80 0.57 114.38 119.73 2hmx h ARG 77 Ca -0.00 -0.17 -0.20 0.00 -0.81 0.00 0.00 59.98 58.80 2hmx h ARG 77 Cb 0.73 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 2hmx h ARG 77 CO 0.04 0.67 -0.75 1.03 -1.51 0.00 0.00 179.97 179.45 2hmx h SER 78 N 0.37 0.72 -0.33 -3.80 0.87 -1.15 0.40 113.55 110.63 2hmx h SER 78 Ca 0.05 -0.47 -0.01 0.00 -1.23 0.00 0.00 61.79 60.13 2hmx h SER 78 Cb 0.69 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.42 2hmx h SER 78 CO 0.05 1.24 0.19 -0.07 -0.53 0.00 0.00 176.83 177.71 2hmx h LEU 79 N 0.42 0.41 0.76 2.23 4.07 -1.31 -2.24 115.31 119.65 2hmx h LEU 79 Ca -0.04 -0.08 -0.04 0.00 0.08 0.00 0.00 57.88 57.80 2hmx h LEU 79 Cb 1.35 -0.10 0.01 0.00 1.08 0.00 0.00 40.66 43.00 2hmx h LEU 79 CO 0.14 0.37 -0.37 0.22 -1.08 0.00 0.00 178.44 177.73 2hmx h TYR 80 N 0.42 -0.95 -0.29 1.13 3.20 0.55 0.57 116.97 121.60 2hmx h TYR 80 Ca 0.12 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.96 2hmx h TYR 80 Cb 0.05 0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 2hmx h TYR 80 CO -0.03 -0.59 0.18 -2.95 -1.64 0.00 0.00 178.16 173.13 2hmx h ASN 81 N -1.27 0.34 0.62 -2.11 -1.07 -0.30 0.60 115.58 112.39 2hmx h ASN 81 Ca -0.10 -0.01 0.00 0.00 0.07 0.00 0.00 56.30 56.25 2hmx h ASN 81 Cb 0.79 -0.09 0.00 0.00 -2.07 0.00 0.00 38.32 36.95 2hmx h ASN 81 CO 0.17 0.26 -0.34 0.41 0.07 0.00 0.00 177.43 178.01 2hmx n THR 82 N -4.48 0.00 0.02 6.14 -1.04 -0.84 -2.04 114.28 112.03 2hmx n THR 82 Ca 0.01 -0.01 -0.20 0.00 -2.04 0.00 0.00 64.05 61.81 2hmx n THR 82 Cb 0.08 0.04 -0.14 0.00 -1.82 0.00 0.00 70.33 68.49 2hmx n THR 82 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 2hmx h ILE 83 N 0.08 1.27 -0.17 12.58 1.08 0.29 -1.80 117.51 130.84 2hmx h ILE 83 Ca 0.00 -2.44 -0.09 0.00 -0.39 0.00 0.00 64.86 61.94 2hmx h ILE 83 Cb 0.49 2.93 -0.01 0.00 -3.07 0.00 0.00 36.82 37.16 2hmx h ILE 83 CO 0.00 0.68 -0.28 0.00 -0.69 0.00 0.00 178.15 177.86 2hmx h ALA 84 N -0.01 1.21 0.88 1.87 0.00 0.34 0.54 119.26 124.09 2hmx h ALA 84 Ca -0.22 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 2hmx h ALA 84 Cb 1.65 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 19.34 2hmx h ALA 84 CO 0.08 0.52 -0.42 0.28 0.00 0.00 0.00 179.25 179.71 2hmx h VAL 85 N 0.28 0.11 0.00 0.00 2.07 -1.50 0.59 116.25 117.81 2hmx h VAL 85 Ca 0.04 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2hmx h VAL 85 Cb 0.65 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2hmx h VAL 85 CO 0.05 0.00 0.00 0.25 0.02 0.00 0.00 177.57 177.89 2hmx h LEU 86 N -1.22 0.00 0.00 2.57 5.85 -0.04 0.98 115.31 123.45 2hmx h LEU 86 Ca -0.12 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.46 2hmx h LEU 86 Cb 0.91 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.95 2hmx h LEU 86 CO 0.20 0.00 -0.54 0.22 -0.34 0.00 0.00 178.44 177.98 2hmx h TYR 87 N 0.00 0.54 -0.36 1.25 5.03 0.11 -1.26 116.97 122.28 2hmx h TYR 87 Ca 0.00 -0.29 0.04 0.00 2.58 0.00 0.00 58.73 61.05 2hmx h TYR 87 Cb 0.08 -0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.28 2hmx h TYR 87 CO 0.00 1.11 0.24 0.00 -1.32 0.00 0.00 178.16 178.19 2hmx h VAL 89 N 0.33 1.31 -0.51 0.00 2.07 0.29 0.23 116.25 119.97 2hmx h VAL 89 Ca 0.15 -2.35 -0.03 0.00 0.82 0.00 0.00 66.70 65.29 2hmx h VAL 89 Cb 0.18 2.87 -0.02 0.00 -1.52 0.00 0.00 31.29 32.80 2hmx h VAL 89 CO -0.03 0.58 0.19 0.45 0.02 0.00 0.00 177.57 178.78 2hmx h HIS 90 N -0.71 0.75 0.82 1.57 3.86 -0.98 -1.20 115.15 119.25 2hmx h HIS 90 Ca -0.20 -0.04 -0.04 0.00 -1.16 0.00 0.00 60.37 58.93 2hmx h HIS 90 Cb 1.39 -0.23 0.01 0.00 1.06 0.00 0.00 27.41 29.64 2hmx h HIS 90 CO 0.18 0.59 -0.39 0.37 0.86 0.00 0.00 177.93 179.54 2hmx h GLN 91 N 0.74 -1.06 0.00 2.45 5.75 -1.24 -3.45 115.11 118.30 2hmx h GLN 91 Ca 0.18 0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.75 2hmx h GLN 91 Cb 0.17 0.24 0.00 0.00 1.07 0.00 0.00 27.48 28.96 2hmx h GLN 91 CO -0.01 -0.70 0.00 -2.13 -2.65 0.00 0.00 178.83 173.34 2hmx n ARG 92 N -5.53 0.00 -1.82 1.69 0.00 -0.45 -5.12 116.66 105.42 2hmx n ARG 92 Ca -0.14 0.00 -0.39 0.00 -0.00 0.00 0.00 57.85 57.31 2hmx n ARG 92 Cb 0.44 0.00 0.02 0.00 0.00 0.00 0.00 32.46 32.92 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 2.13 0.25 5.15 1.09 0.80 -4.91 121.20 125.71 2hmx s ILE 93 Ca 0.00 0.11 0.10 0.00 -1.10 0.00 0.00 60.65 59.76 2hmx s ILE 93 Cb 0.00 -3.06 -0.04 0.00 -1.06 0.00 0.00 42.46 38.29 2hmx s ILE 93 CO 0.00 0.01 -0.10 1.51 -0.10 0.00 0.00 174.94 176.26 2hmx s ASP 94 N -0.69 4.13 0.29 3.58 1.47 -1.26 -3.01 116.67 121.17 2hmx s ASP 94 Ca 0.64 -0.76 0.05 0.00 1.18 0.00 0.00 52.55 53.66 2hmx s ASP 94 Cb -0.42 -0.62 -0.03 0.00 -0.34 0.00 0.00 42.92 41.51 2hmx s ASP 94 CO 0.52 0.04 0.24 0.68 0.68 0.00 0.00 175.17 177.33 2hmx s VAL 95 N -2.21 0.00 -0.04 2.11 -7.23 -1.26 -4.96 120.40 106.80 2hmx s VAL 95 Ca 0.29 -1.99 -0.05 0.00 -1.81 0.00 0.00 61.98 58.42 2hmx s VAL 95 Cb -0.07 -2.50 -0.03 0.00 0.56 0.00 0.00 36.38 34.34 2hmx s VAL 95 CO 0.17 0.00 -0.11 0.29 -0.31 0.00 0.00 175.10 175.14 2hmx n LYS 96 N -0.52 0.17 -4.73 4.82 4.76 -1.26 -4.93 118.16 116.47 2hmx n LYS 96 Ca 0.06 0.07 -0.32 0.00 -2.87 0.00 0.00 58.31 55.25 2hmx n LYS 96 Cb 0.63 -0.79 -0.08 0.00 -1.84 0.00 0.00 35.03 32.95 2hmx n LYS 96 CO 0.00 0.00 0.00 0.16 -1.37 0.00 0.00 177.40 176.19 2hmx s ASP 97 N -5.85 4.00 0.14 4.39 -4.77 -1.26 0.60 116.67 113.92 2hmx s ASP 97 Ca -0.11 -1.63 -0.16 0.00 -3.30 0.00 0.00 52.55 47.35 2hmx s ASP 97 Cb 0.03 0.45 0.01 0.00 -1.09 0.00 0.00 42.92 42.32 2hmx s ASP 97 CO 0.14 -0.83 1.74 0.00 0.70 0.00 0.00 175.17 176.92 2hmx h THR 98 N 1.42 1.16 0.00 2.11 1.03 -0.56 -0.83 112.91 117.24 2hmx h THR 98 Ca -0.43 -0.44 0.00 0.00 -0.01 0.00 0.00 66.41 65.52 2hmx h THR 98 Cb 1.31 0.69 0.00 0.00 -1.07 0.00 0.00 68.15 69.08 2hmx h THR 98 CO 0.73 0.17 0.00 0.11 -0.01 0.00 0.00 175.52 176.53 2hmx h LYS 99 N 0.54 0.00 0.14 0.00 1.79 -1.86 0.58 116.57 117.76 2hmx h LYS 99 Ca 0.15 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.29 2hmx h LYS 99 Cb 0.08 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.73 2hmx h LYS 99 CO -0.02 0.00 -1.68 1.49 -1.08 0.00 0.00 179.45 178.16 2hmx h GLU 100 N 0.00 0.30 0.67 3.15 4.57 -1.57 -0.34 114.58 121.36 2hmx h GLU 100 Ca 0.00 -0.51 -0.03 0.00 -1.18 0.00 0.00 59.36 57.63 2hmx h GLU 100 Cb 0.44 0.19 0.01 0.00 -0.16 0.00 0.00 28.75 29.23 2hmx h GLU 100 CO 0.00 1.25 -0.32 0.00 -1.18 0.00 0.00 179.01 178.76 2hmx h ALA 101 N 0.02 -0.89 0.00 2.92 0.00 -1.41 -2.53 119.26 117.37 2hmx h ALA 101 Ca -0.35 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2hmx h ALA 101 Cb 1.94 0.35 0.00 0.00 0.00 0.00 0.00 17.79 20.08 2hmx h ALA 101 CO 0.10 -0.98 0.00 1.25 0.00 0.00 0.00 179.25 179.62 2hmx h LEU 102 N -0.94 0.00 0.31 0.00 5.85 0.18 0.98 115.31 121.70 2hmx h LEU 102 Ca -0.09 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.61 2hmx h LEU 102 Cb 0.70 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.73 2hmx h LEU 102 CO 0.15 0.00 -0.15 -0.78 -0.34 0.00 0.00 178.44 177.32 2hmx h ASP 103 N 0.00 -0.36 0.00 1.25 3.58 -1.02 0.20 116.42 120.07 2hmx h ASP 103 Ca 0.00 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2hmx h ASP 103 Cb 0.08 0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.22 2hmx h ASP 103 CO 0.00 -0.02 0.06 0.50 -2.88 0.00 0.00 179.24 176.90 2hmx h LYS 104 N -0.89 0.00 0.00 0.28 3.64 0.11 0.66 116.57 120.37 2hmx h LYS 104 Ca -0.04 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.23 2hmx h LYS 104 Cb 0.32 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 2hmx h LYS 104 CO 0.07 0.00 -0.64 0.82 -2.27 0.00 0.00 179.45 177.43 2hmx h ILE 105 N 0.00 1.01 -0.40 2.00 1.08 0.29 -1.93 117.51 119.56 2hmx h ILE 105 Ca 0.00 -1.99 -0.07 0.00 -0.39 0.00 0.00 64.86 62.41 2hmx h ILE 105 Cb 0.12 2.14 -0.02 0.00 -3.07 0.00 0.00 36.82 35.99 2hmx h ILE 105 CO 0.00 0.34 -0.06 -0.08 -0.69 0.00 0.00 178.15 177.66 2hmx h GLU 106 N -1.00 0.68 0.00 2.37 4.81 0.26 0.85 114.58 122.55 2hmx h GLU 106 Ca -0.16 -0.19 -0.15 0.00 -0.13 0.00 0.00 59.36 58.73 2hmx h GLU 106 Cb 0.99 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.27 2hmx h GLU 106 CO -0.10 0.73 -1.25 1.49 -0.73 0.00 0.00 179.01 179.16 2hmx h GLU 107 N 0.63 0.00 0.00 1.92 4.57 0.06 -3.22 114.58 118.54 2hmx h GLU 107 Ca 0.12 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.30 2hmx h GLU 107 Cb 0.48 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 2hmx h GLU 107 CO 0.03 0.30 -0.52 0.39 -1.18 0.00 0.00 179.01 178.02 2hmx n GLU 108 N -2.92 0.00 -0.33 1.92 -0.58 -0.77 -4.68 120.64 113.27 2hmx n GLU 108 Ca -0.07 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.63 2hmx n GLU 108 Cb 0.80 -0.28 0.08 0.00 -0.57 0.00 0.00 31.44 31.48 2hmx n GLU 108 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 2hmx h GLN 109 N 0.00 1.24 -2.53 3.49 7.50 0.23 -3.49 115.11 121.55 2hmx h GLN 109 Ca 0.00 -0.14 0.00 0.00 0.50 0.00 0.00 58.65 59.01 2hmx h GLN 109 Cb 0.52 -0.24 0.00 0.00 0.05 0.00 0.00 27.48 27.81 2hmx h GLN 109 CO 0.00 0.90 -0.44 -1.71 -1.50 0.00 0.00 178.83 176.08 2hmx n ASN 110 N -4.35 -5.24 0.00 1.46 2.85 0.25 -4.98 115.26 105.25 2hmx n ASN 110 Ca 0.09 0.64 0.00 0.00 -0.11 0.00 0.00 54.58 55.20 2hmx n ASN 110 Cb 0.09 -2.85 0.00 0.00 1.24 0.00 0.00 39.78 38.26 2hmx n ASN 110 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 2hmx n LYS 111 N 0.85 0.00 -3.51 1.20 2.85 -1.25 -4.99 118.16 113.32 2hmx n LYS 111 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2hmx n LYS 111 Cb 0.00 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.33 2hmx n LYS 111 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2hmx s SER 112 N 0.00 -0.45 0.00 -5.58 1.04 -1.26 -4.99 113.70 102.46 2hmx s SER 112 Ca 0.00 0.66 0.00 0.00 0.48 0.00 0.00 55.95 57.09 2hmx s SER 112 Cb 0.00 1.36 0.00 0.00 0.10 0.00 0.00 66.02 67.48 2hmx s SER 112 CO 0.00 -0.10 0.00 1.17 0.98 0.00 0.00 173.24 175.29 2hmx n LYS 113 N 4.22 0.00 -2.53 4.02 0.00 -1.26 -5.11 118.16 117.50 2hmx n LYS 113 Ca -0.13 0.00 -0.42 0.00 0.00 0.00 0.00 58.31 57.75 2hmx n LYS 113 Cb 0.55 0.00 -0.02 0.00 0.00 0.00 0.00 35.03 35.56 2hmx n LYS 113 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 2hmx s LYS 114 N -0.06 3.53 0.46 1.64 2.20 -1.26 -4.86 119.74 121.39 2hmx s LYS 114 Ca 0.00 0.42 0.00 0.00 -0.36 0.00 0.00 55.97 56.03 2hmx s LYS 114 Cb 0.00 -4.01 0.00 0.00 -1.51 0.00 0.00 37.83 32.31 2hmx s LYS 114 CO 0.00 -1.65 0.00 1.63 -0.36 0.00 0.00 175.35 174.97 2hmx n LYS 115 N 8.32 -2.62 -0.77 4.03 5.02 -1.26 -5.02 118.16 125.86 2hmx n LYS 115 Ca 0.11 2.08 0.00 0.00 -2.02 0.00 0.00 58.31 58.47 2hmx n LYS 115 Cb 0.49 -3.09 0.00 0.00 -0.02 0.00 0.00 35.03 32.41 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 -3.60 0.00 -0.05 7.82 0.00 -1.26 -5.11 120.51 118.32 2hmx n ALA 116 Ca -0.06 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.33 2hmx n ALA 116 Cb 0.55 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.98 2hmx n ALA 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hmx n GLN 117 N -0.16 0.30 -2.55 0.00 10.64 -1.26 -5.06 117.38 119.29 2hmx n GLN 117 Ca 0.00 0.12 -0.31 0.00 -1.83 0.00 0.00 57.00 54.98 2hmx n GLN 117 Cb 0.00 -1.01 -0.02 0.00 -0.86 0.00 0.00 30.24 28.35 2hmx n GLN 117 CO 0.00 0.00 0.00 1.14 -1.83 0.00 0.00 177.06 176.37 2hmx s GLN 118 N -2.15 3.78 0.00 2.61 -2.07 -1.26 -5.04 119.66 115.52 2hmx s GLN 118 Ca -0.16 0.62 0.00 0.00 -1.82 0.00 0.00 55.36 54.00 2hmx s GLN 118 Cb 0.02 -2.27 0.00 0.00 -1.09 0.00 0.00 33.01 29.67 2hmx s GLN 118 CO 0.24 -0.20 0.00 0.00 -1.32 0.00 0.00 175.29 174.01 2hmx n ALA 119 N -1.70 0.42 -0.91 2.60 0.00 -1.26 -5.10 120.51 114.55 2hmx n ALA 119 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2hmx n ALA 119 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 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 -2.02 1.43 -3.30 0.00 0.00 -1.26 -5.18 120.51 110.18 2hmx n ALA 120 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 2hmx n ALA 120 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 2hmx n ALA 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hmx n ALA 121 N -1.13 0.01 -3.88 0.00 0.00 -1.26 -5.12 120.51 109.14 2hmx n ALA 121 Ca 0.00 -0.05 -0.33 0.00 0.00 0.00 0.00 53.44 53.06 2hmx n ALA 121 Cb 0.00 0.03 -0.13 0.00 0.00 0.00 0.00 19.45 19.36 2hmx n ALA 121 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2hmx s ASP 122 N -1.06 4.80 0.14 0.00 -4.77 -1.26 -5.08 116.67 109.45 2hmx s ASP 122 Ca 0.01 -2.63 0.00 0.00 -3.30 0.00 0.00 52.55 46.63 2hmx s ASP 122 Cb 0.00 -1.72 0.00 0.00 -1.09 0.00 0.00 42.92 40.11 2hmx s ASP 122 CO 0.00 -0.35 0.00 1.07 0.70 0.00 0.00 175.17 176.60 2hmx n THR 123 N 3.69 0.00 0.00 2.11 5.66 -1.26 -5.01 114.28 119.47 2hmx n THR 123 Ca 0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.04 2hmx n THR 123 Cb 0.37 -1.01 0.00 0.00 -1.55 0.00 0.00 70.33 68.15 2hmx n THR 123 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2hmx n GLY 124 N 2.52 0.07 0.92 1.09 0.00 -1.26 -5.14 105.19 103.38 2hmx n GLY 124 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -5.50 0.00 1.61 2.85 -1.26 -5.07 115.26 107.89 2hmx n ASN 125 Ca 0.00 0.70 0.00 0.00 -0.11 0.00 0.00 54.58 55.17 2hmx n ASN 125 Cb 0.00 -2.24 0.00 0.00 1.24 0.00 0.00 39.78 38.78 2hmx n ASN 125 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 2hmx n ASN 126 N -0.62 0.00 0.00 1.20 2.85 -1.26 -5.09 115.26 112.35 2hmx n ASN 126 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2hmx n ASN 126 Cb 0.00 0.06 0.00 0.00 1.24 0.00 0.00 39.78 41.08 2hmx n ASN 126 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2hmx n SER 127 N -1.28 0.00 0.00 1.20 7.64 -1.26 -4.37 113.62 115.55 2hmx n SER 127 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2hmx n SER 127 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2hmx n SER 127 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2hmx n GLN 128 N 0.00 0.00 0.06 1.43 -0.06 -1.26 -5.10 117.38 112.45 2hmx n GLN 128 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 2hmx n GLN 128 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 2hmx n GLN 128 CO 0.00 0.00 0.00 1.33 -0.20 0.00 0.00 177.06 178.19 2hmx n VAL 129 N -0.40 0.00 0.00 1.69 0.24 -1.26 -5.05 118.33 113.54 2hmx n VAL 129 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2hmx n VAL 129 Cb 0.00 -0.06 0.00 0.00 -1.47 0.00 0.00 33.84 32.31 2hmx n VAL 129 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2hmx n SER 130 N -2.80 0.00 0.00 -1.34 3.41 -1.26 -5.04 113.62 106.59 2hmx n SER 130 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2hmx n SER 130 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2hmx n SER 130 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2hmx n GLN 131 N -0.56 0.00 -2.59 4.33 -0.06 -1.26 -4.79 117.38 112.45 2hmx n GLN 131 Ca 0.00 0.00 -0.04 0.00 -2.00 0.00 0.00 57.00 54.96 2hmx n GLN 131 Cb 0.00 0.00 -0.04 0.00 -4.06 0.00 0.00 30.24 26.14 2hmx n GLN 131 CO 0.00 0.00 0.00 0.27 -0.20 0.00 0.00 177.06 177.13 2hmx n ASN 132 N 2.00 -2.11 0.00 1.69 0.23 -1.26 -5.31 115.26 110.50 2hmx n ASN 132 Ca 0.00 1.33 0.00 0.00 -0.53 0.00 0.00 54.58 55.38 2hmx n ASN 132 Cb 0.00 -5.18 0.00 0.00 -2.08 0.00 0.00 39.78 32.52 2hmx n ASN 132 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11