#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 1.78 0.00 -1.40 0.00 -1.26 -5.08 119.30 113.34 2hmx s MET 2 Ca 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 55.69 54.51 2hmx s MET 2 Cb 0.00 -2.11 0.00 0.00 0.00 0.00 0.00 34.83 32.72 2hmx s MET 2 CO 0.00 0.48 0.00 0.41 0.00 0.00 0.00 175.02 175.91 2hmx n GLY 3 N 0.84 2.68 0.00 3.16 0.00 -1.26 -5.09 105.19 105.52 2hmx n GLY 3 Ca -0.16 0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 0.00 0.00 -2.34 4.61 0.00 -1.26 -4.56 120.51 116.96 2hmx n ALA 4 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 2hmx n ALA 4 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2hmx n ALA 4 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2hmx n ARG 5 N -0.40 -3.31 0.00 0.00 3.00 -1.26 -4.08 116.66 110.61 2hmx n ARG 5 Ca 0.00 2.64 0.00 0.00 -0.00 0.00 0.00 57.85 60.49 2hmx n ARG 5 Cb 0.00 -4.13 0.00 0.00 0.00 0.00 0.00 32.46 28.33 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 1.13 0.00 -3.00 5.13 0.00 -1.26 -4.69 120.51 117.82 2hmx n ALA 6 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2hmx n ALA 6 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 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 1.30 0.00 0.29 0.00 2.88 -1.26 -5.06 113.62 111.78 2hmx n SER 7 Ca 0.00 -0.75 -0.12 0.00 -1.33 0.00 0.00 58.87 56.68 2hmx n SER 7 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 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 0.75 0.00 -2.24 2.46 2.07 -1.83 -3.48 116.25 113.98 2hmx h VAL 8 Ca 0.00 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 2hmx h VAL 8 Cb 0.00 0.00 0.01 0.00 -1.52 0.00 0.00 31.29 29.78 2hmx h VAL 8 CO 0.00 0.00 0.02 0.18 0.02 0.00 0.00 177.57 177.79 2hmx n LEU 9 N -4.11 0.00 0.00 2.57 4.77 -1.26 -4.69 117.00 114.27 2hmx n LEU 9 Ca -0.09 -0.08 -0.01 0.00 -0.03 0.00 0.00 56.01 55.80 2hmx n LEU 9 Cb 0.30 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2hmx n LEU 9 CO 0.22 -0.55 0.02 -1.54 -1.33 0.00 0.00 177.39 174.21 2hmx n SER 10 N -3.04 0.06 0.16 -1.43 3.41 -1.26 -4.92 113.62 106.61 2hmx n SER 10 Ca 0.01 -1.05 -0.14 0.00 -0.26 0.00 0.00 58.87 57.43 2hmx n SER 10 Cb 0.03 -0.02 -0.08 0.00 -0.26 0.00 0.00 64.21 63.88 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 -0.01 -0.36 0.94 5.00 0.00 -1.99 -1.66 103.07 104.99 2hmx h GLY 11 Ca -0.01 0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.43 2hmx h GLY 11 CO 0.01 -0.13 -0.21 -1.33 0.00 0.00 0.00 176.54 174.88 2hmx h GLY 12 N -0.37 -0.62 2.00 4.60 0.00 -1.99 -2.37 103.07 104.31 2hmx h GLY 12 Ca -0.04 0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.52 2hmx h GLY 12 CO 0.06 -0.23 -0.01 0.83 0.00 0.00 0.00 176.54 177.19 2hmx h GLU 13 N -0.67 0.00 0.76 4.80 5.08 -1.93 0.22 114.58 122.84 2hmx h GLU 13 Ca -0.06 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 2hmx h GLU 13 Cb 0.50 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.76 2hmx h GLU 13 CO 0.10 0.01 -0.36 1.25 -1.00 0.00 0.00 179.01 179.01 2hmx h LEU 14 N 0.00 -0.86 -2.39 1.33 7.12 -0.90 0.29 115.31 119.90 2hmx h LEU 14 Ca -0.00 0.03 0.00 0.00 0.13 0.00 0.00 57.88 58.04 2hmx h LEU 14 Cb 0.33 0.22 0.00 0.00 -0.53 0.00 0.00 40.66 40.68 2hmx h LEU 14 CO 0.00 -0.60 0.00 -0.78 -0.13 0.00 0.00 178.44 176.93 2hmx h ASP 15 N -1.06 0.00 0.46 1.25 3.58 -0.12 0.96 116.42 121.49 2hmx h ASP 15 Ca -0.10 0.00 -0.30 0.00 0.42 0.00 0.00 57.03 57.05 2hmx h ASP 15 Cb 0.78 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.79 2hmx h ASP 15 CO 0.17 0.00 -1.73 0.50 -2.88 0.00 0.00 179.24 175.30 2hmx h LYS 16 N 0.00 0.03 0.00 0.28 3.11 -1.28 -3.31 116.57 115.40 2hmx h LYS 16 Ca 0.00 -0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.78 2hmx h LYS 16 Cb 0.03 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.28 2hmx h LYS 16 CO 0.00 0.59 0.00 1.87 -2.81 0.00 0.00 179.45 179.10 2hmx n TRP 17 N -3.10 0.49 -0.80 1.91 -0.00 0.27 -3.70 117.44 112.51 2hmx n TRP 17 Ca -0.18 0.19 -0.20 0.00 -0.00 0.00 0.00 57.50 57.30 2hmx n TRP 17 Cb 1.05 -0.80 0.11 0.00 -0.00 0.00 0.00 31.31 31.68 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 -1.94 2.03 0.00 5.87 0.00 0.20 -3.73 120.64 123.07 2hmx n GLU 18 Ca 0.03 -2.32 0.00 0.00 0.00 0.00 0.00 57.16 54.87 2hmx n GLU 18 Cb 0.22 -1.91 0.00 0.00 0.00 0.00 0.00 31.44 29.76 2hmx n GLU 18 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2hmx n LYS 19 N -0.62 0.00 -3.26 5.31 5.02 -0.89 -4.82 118.16 118.89 2hmx n LYS 19 Ca 0.46 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 56.31 2hmx n LYS 19 Cb 1.17 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 36.12 2hmx n LYS 19 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2hmx s ILE 20 N 0.00 5.04 0.17 -0.18 1.01 -0.88 -4.77 121.20 121.59 2hmx s ILE 20 Ca 0.00 -0.78 -0.32 0.00 0.00 0.00 0.00 60.65 59.56 2hmx s ILE 20 Cb 0.00 -4.22 -0.11 0.00 0.01 0.00 0.00 42.46 38.14 2hmx s ILE 20 CO 0.00 -0.71 1.75 -0.60 0.00 0.00 0.00 174.94 175.38 2hmx s ARG 21 N 2.16 4.14 0.03 2.79 3.52 0.20 0.60 118.95 132.39 2hmx s ARG 21 Ca 0.10 2.58 -0.27 0.00 -0.13 0.00 0.00 55.73 58.00 2hmx s ARG 21 Cb -0.22 -3.30 -0.17 0.00 -1.56 0.00 0.00 34.95 29.70 2hmx s ARG 21 CO 0.09 -0.78 1.31 -0.07 -0.81 0.00 0.00 175.30 175.04 2hmx h LEU 22 N 7.58 -0.57 -8.21 -0.88 3.38 -1.75 -1.93 115.31 112.92 2hmx h LEU 22 Ca -0.44 -0.06 -0.44 0.00 0.09 0.00 0.00 57.88 57.02 2hmx h LEU 22 Cb 1.21 0.15 -0.27 0.00 0.09 0.00 0.00 40.66 41.83 2hmx h LEU 22 CO 0.95 -0.25 -0.79 0.00 0.09 0.00 0.00 178.44 178.44 2hmx s ARG 23 N -5.05 0.95 -0.59 1.13 1.70 -1.26 -4.41 118.95 111.43 2hmx s ARG 23 Ca -0.15 -0.56 -0.22 0.00 -0.47 0.00 0.00 55.73 54.32 2hmx s ARG 23 Cb 0.02 -0.93 -0.22 0.00 -0.57 0.00 0.00 34.95 33.25 2hmx s ARG 23 CO 0.53 0.24 1.72 -0.35 -1.08 0.00 0.00 175.30 176.36 2hmx n PRO 24 N 2.41 0.05 0.00 3.89 -0.04 -1.26 -1.85 135.00 138.19 2hmx n PRO 24 Ca -0.16 -1.17 0.00 0.00 -0.04 0.00 0.00 63.50 62.13 2hmx n PRO 24 Cb 0.55 -2.97 0.00 0.00 -0.04 0.00 0.00 33.50 31.04 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 5.44 1.27 0.02 0.55 0.00 -1.26 -4.96 105.19 106.25 2hmx n GLY 25 Ca 0.34 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.49 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 -1.46 -1.31 4.66 -0.02 0.00 -0.77 -4.95 105.19 101.34 2hmx n GLY 26 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.42 0.00 -1.65 1.61 3.00 -1.26 -4.96 118.16 113.48 2hmx n LYS 27 Ca 0.07 0.00 -0.36 0.00 -0.00 0.00 0.00 58.31 58.03 2hmx n LYS 27 Cb 0.33 0.00 0.07 0.00 0.00 0.00 0.00 35.03 35.43 2hmx n LYS 27 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2hmx s LYS 28 N 0.00 2.43 0.06 1.64 1.02 -1.26 -4.88 119.74 118.75 2hmx s LYS 28 Ca 0.00 1.89 0.07 0.00 0.02 0.00 0.00 55.97 57.94 2hmx s LYS 28 Cb 0.00 -1.85 -0.03 0.00 -0.52 0.00 0.00 37.83 35.43 2hmx s LYS 28 CO 0.00 -1.64 -0.19 1.14 -0.92 0.00 0.00 175.35 173.74 2hmx s GLN 29 N -3.61 1.18 0.46 1.68 1.03 -1.26 -2.21 119.66 116.93 2hmx s GLN 29 Ca 0.78 -0.95 -0.25 0.00 0.04 0.00 0.00 55.36 54.98 2hmx s GLN 29 Cb -0.32 -1.31 -0.08 0.00 0.03 0.00 0.00 33.01 31.33 2hmx s GLN 29 CO 0.41 0.32 1.41 0.71 -2.54 0.00 0.00 175.29 175.60 2hmx s TYR 30 N -0.93 2.45 0.29 9.60 1.51 0.20 -4.76 117.35 125.71 2hmx s TYR 30 Ca 0.05 1.29 0.02 0.00 -1.01 0.00 0.00 57.07 57.43 2hmx s TYR 30 Cb -0.09 -3.88 -0.04 0.00 -0.11 0.00 0.00 41.96 37.84 2hmx s TYR 30 CO 0.02 -2.87 0.14 0.21 -1.11 0.00 0.00 175.55 171.94 2hmx s LYS 31 N -2.52 1.52 0.61 -0.62 2.47 -1.26 -2.08 119.74 117.86 2hmx s LYS 31 Ca 0.63 -1.85 0.38 0.00 -1.56 0.00 0.00 55.97 53.57 2hmx s LYS 31 Cb -0.43 -0.14 1.96 0.00 -1.46 0.00 0.00 37.83 37.76 2hmx s LYS 31 CO 0.54 -0.40 2.22 1.25 0.16 0.00 0.00 175.35 179.12 2hmx h LEU 32 N 2.28 0.00 -1.99 5.43 7.12 -1.92 0.71 115.31 126.93 2hmx h LEU 32 Ca -0.35 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 57.65 2hmx h LEU 32 Cb 1.25 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 41.38 2hmx h LEU 32 CO 0.55 0.02 -0.04 0.50 -0.13 0.00 0.00 178.44 179.33 2hmx h LYS 33 N 0.00 0.00 0.00 1.25 1.63 -1.97 0.59 116.57 118.07 2hmx h LYS 33 Ca -0.00 0.00 -0.27 0.00 -0.85 0.00 0.00 60.65 59.53 2hmx h LYS 33 Cb 0.20 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 31.78 2hmx h LYS 33 CO 0.00 0.04 -1.79 0.72 -3.45 0.00 0.00 179.45 174.98 2hmx n HIS 34 N -4.35 0.75 -0.04 1.91 -0.00 0.24 -2.04 115.22 111.69 2hmx n HIS 34 Ca -0.03 0.27 -0.11 0.00 -0.00 0.00 0.00 57.72 57.85 2hmx n HIS 34 Cb 0.13 -1.10 -0.04 0.00 -0.00 0.00 0.00 29.99 28.97 2hmx n HIS 34 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.34 177.31 2hmx h ILE 35 N 0.00 1.11 -0.40 1.59 2.10 -0.67 0.15 117.51 121.39 2hmx h ILE 35 Ca -0.30 -0.30 -0.03 0.00 1.08 0.00 0.00 64.86 65.31 2hmx h ILE 35 Cb 1.93 0.99 -0.02 0.00 -1.09 0.00 0.00 36.82 38.63 2hmx h ILE 35 CO 0.06 0.10 0.13 0.58 -1.08 0.00 0.00 178.15 177.94 2hmx h VAL 36 N 0.18 1.17 0.46 2.19 2.07 0.24 0.43 116.25 122.98 2hmx h VAL 36 Ca 0.06 -0.56 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 2hmx h VAL 36 Cb 0.08 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 2hmx h VAL 36 CO -0.01 0.21 -0.27 -0.25 0.02 0.00 0.00 177.57 177.27 2hmx h TRP 37 N 0.56 -0.70 0.81 1.57 7.01 -1.31 0.13 115.95 124.01 2hmx h TRP 37 Ca 0.14 -0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.09 2hmx h TRP 37 Cb 0.17 0.25 0.00 0.00 -2.10 0.00 0.00 29.16 27.48 2hmx h TRP 37 CO 0.01 -0.42 -0.44 0.00 -2.79 0.00 0.00 178.44 174.80 2hmx h ALA 38 N -0.18 -1.28 0.00 2.65 0.00 0.01 0.40 119.26 120.86 2hmx h ALA 38 Ca -0.05 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2hmx h ALA 38 Cb 0.56 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2hmx h ALA 38 CO 0.06 -1.22 0.00 0.66 0.00 0.00 0.00 179.25 178.76 2hmx h SER 39 N -1.14 0.00 0.00 0.00 4.64 -0.23 0.94 113.55 117.75 2hmx h SER 39 Ca -0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 2hmx h SER 39 Cb 0.89 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.98 2hmx h SER 39 CO 0.15 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.65 2hmx n ARG 40 N -2.54 0.00 0.26 4.77 3.00 0.44 -1.89 116.66 120.69 2hmx n ARG 40 Ca -0.02 0.42 0.08 0.00 -0.01 0.00 0.00 57.85 58.32 2hmx n ARG 40 Cb 0.06 -1.27 0.63 0.00 0.00 0.00 0.00 32.46 31.88 2hmx n ARG 40 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 2hmx h GLU 41 N 0.00 0.00 0.00 5.56 4.57 0.51 0.48 114.58 125.69 2hmx h GLU 41 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2hmx h GLU 41 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2hmx h GLU 41 CO 0.00 0.01 0.00 -0.11 -1.18 0.00 0.00 179.01 177.73 2hmx n LEU 42 N -4.52 0.10 0.34 1.64 7.94 0.17 0.31 117.00 122.98 2hmx n LEU 42 Ca -0.03 0.80 0.22 0.00 -1.11 0.00 0.00 56.01 55.89 2hmx n LEU 42 Cb 0.10 -0.37 1.15 0.00 0.53 0.00 0.00 43.42 44.83 2hmx n LEU 42 CO 0.34 -0.37 1.18 -0.08 -1.11 0.00 0.00 177.39 177.35 2hmx h GLU 43 N 0.00 0.00 0.00 1.96 4.22 -1.08 0.67 114.58 120.34 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 -1.19 -2.13 -2.18 0.00 0.00 179.01 173.51 2hmx n ARG 44 N -3.09 0.23 0.36 1.92 0.63 0.13 -1.40 116.66 115.44 2hmx n ARG 44 Ca -0.03 -0.04 -0.14 0.00 -0.92 0.00 0.00 57.85 56.72 2hmx n ARG 44 Cb 0.12 -1.49 -0.07 0.00 0.45 0.00 0.00 32.46 31.47 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 -0.86 0.00 -0.14 -1.00 0.22 -3.46 116.94 111.70 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 0.59 0.29 0.00 0.00 3.61 0.00 0.00 35.95 40.44 2hmx h PHE 45 CO 0.00 -0.54 0.00 0.00 -1.61 0.00 0.00 178.31 176.16 2hmx n ALA 46 N -2.50 0.37 -2.55 2.45 0.00 -0.86 -5.09 120.51 112.33 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 0.37 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.71 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 1.47 -0.05 0.00 1.01 -0.50 -5.00 120.40 117.34 2hmx s VAL 47 Ca 0.00 -2.00 0.06 0.00 0.00 0.00 0.00 61.98 60.04 2hmx s VAL 47 Cb 0.00 -2.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.57 2hmx s VAL 47 CO 0.00 0.00 -0.24 0.21 0.00 0.00 0.00 175.10 175.07 2hmx s ASN 48 N -3.62 3.15 0.02 3.32 3.84 -1.26 -4.30 114.94 116.09 2hmx s ASN 48 Ca 0.32 -0.48 -0.25 0.00 0.21 0.00 0.00 52.86 52.67 2hmx s ASN 48 Cb 0.08 -0.73 -0.18 0.00 -0.55 0.00 0.00 41.25 39.88 2hmx s ASN 48 CO 0.15 0.27 1.36 1.55 -2.79 0.00 0.00 177.10 177.64 2hmx h PRO 49 N 5.88 -0.20 0.00 0.43 0.13 -1.88 -1.62 132.00 134.75 2hmx h PRO 49 Ca -0.36 0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.73 2hmx h PRO 49 Cb 1.16 0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2hmx h PRO 49 CO 0.47 0.12 -0.27 0.78 -0.23 0.00 0.00 178.00 178.87 2hmx h GLY 50 N -0.51 0.00 1.98 1.56 0.00 -1.87 0.89 103.07 105.11 2hmx h GLY 50 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 2hmx h GLY 50 CO 0.03 0.00 0.01 -2.00 0.00 0.00 0.00 176.54 174.58 2hmx h LEU 51 N 0.00 0.00 -0.63 3.11 6.46 -1.89 0.15 115.31 122.52 2hmx h LEU 51 Ca -0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2hmx h LEU 51 Cb 0.64 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.57 2hmx h LEU 51 CO 0.04 0.00 -0.52 -0.11 -0.62 0.00 0.00 178.44 177.22 2hmx n LEU 52 N -3.93 1.46 -0.30 2.25 -0.00 0.28 -1.71 117.00 115.05 2hmx n LEU 52 Ca -0.03 -0.68 -0.01 0.00 -0.00 0.00 0.00 56.01 55.30 2hmx n LEU 52 Cb 0.09 0.00 0.12 0.00 -0.00 0.00 0.00 43.42 43.64 2hmx n LEU 52 CO 0.28 0.29 1.19 -0.08 -0.00 0.00 0.00 177.39 179.08 2hmx h GLU 53 N 1.37 0.96 -5.59 1.96 4.22 0.23 -3.40 114.58 114.33 2hmx h GLU 53 Ca 0.00 -0.06 -0.63 0.00 0.08 0.00 0.00 59.36 58.75 2hmx h GLU 53 Cb 0.55 -0.22 -0.08 0.00 0.50 0.00 0.00 28.75 29.50 2hmx h GLU 53 CO 0.00 0.64 -0.42 0.95 -2.18 0.00 0.00 179.01 178.00 2hmx s THR 54 N -6.08 5.39 0.65 0.32 -4.23 -0.69 -4.88 115.64 106.11 2hmx s THR 54 Ca -0.13 0.35 0.33 0.00 -1.18 0.00 0.00 61.69 61.06 2hmx s THR 54 Cb 0.18 -3.50 0.34 0.00 1.34 0.00 0.00 72.50 70.86 2hmx s THR 54 CO 0.79 0.54 2.03 0.28 -0.54 0.00 0.00 174.62 177.72 2hmx h SER 55 N 5.58 0.00 -0.18 3.99 0.02 -1.83 0.33 113.55 121.45 2hmx h SER 55 Ca -0.49 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.41 2hmx h SER 55 Cb 1.20 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.74 2hmx h SER 55 CO 0.65 0.00 -0.08 -0.08 -1.14 0.00 0.00 176.83 176.18 2hmx h GLU 56 N 0.00 0.38 -0.03 3.45 4.57 -1.92 0.60 114.58 121.62 2hmx h GLU 56 Ca 0.03 -0.16 -0.09 0.00 -1.18 0.00 0.00 59.36 57.96 2hmx h GLU 56 Cb 0.56 -0.01 0.01 0.00 -0.16 0.00 0.00 28.75 29.14 2hmx h GLU 56 CO -0.00 0.67 -0.33 0.78 -1.18 0.00 0.00 179.01 178.95 2hmx h GLY 57 N 0.06 0.30 2.00 1.92 0.00 -0.48 0.88 103.07 107.76 2hmx h GLY 57 Ca 0.04 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 46.90 2hmx h GLY 57 CO 0.03 0.42 -0.00 0.00 0.00 0.00 0.00 176.54 176.98 2hmx h ARG 59 N 0.00 0.10 0.00 0.00 2.43 0.83 0.58 114.38 118.32 2hmx h ARG 59 Ca -0.00 -0.16 -0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2hmx h ARG 59 Cb 0.04 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.65 2hmx h ARG 59 CO 0.00 1.06 -0.01 0.37 -1.51 0.00 0.00 179.97 179.89 2hmx h GLN 60 N -0.78 0.00 0.00 0.20 4.15 0.19 -0.82 115.11 118.06 2hmx h GLN 60 Ca -0.04 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.38 2hmx h GLN 60 Cb 1.18 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.87 2hmx h GLN 60 CO 0.05 0.01 -0.16 0.82 -1.93 0.00 0.00 178.83 177.61 2hmx h ILE 61 N 0.00 0.00 0.00 2.39 1.08 0.22 -2.45 117.51 118.75 2hmx h ILE 61 Ca -0.00 -0.75 0.00 0.00 -0.39 0.00 0.00 64.86 63.72 2hmx h ILE 61 Cb 0.13 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.88 2hmx h ILE 61 CO 0.00 0.00 0.00 0.25 -0.69 0.00 0.00 178.15 177.71 2hmx h LEU 62 N -0.75 0.00 0.01 1.44 5.85 0.24 0.99 115.31 123.09 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 0.16 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.19 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 0.15 -0.02 2.00 3.75 0.00 -1.26 -2.47 103.07 105.23 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 -1.00 0.00 0.00 4.80 4.15 0.12 -3.28 115.11 119.89 2hmx h GLN 64 Ca -0.00 0.00 -0.31 0.00 0.77 0.00 0.00 58.65 59.11 2hmx h GLN 64 Cb 0.14 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.77 2hmx h GLN 64 CO 0.00 0.00 -2.17 -0.11 -1.93 0.00 0.00 178.83 174.63 2hmx n LEU 65 N -2.64 1.44 0.16 -2.39 7.94 0.21 -2.83 117.00 118.89 2hmx n LEU 65 Ca -0.02 -0.06 -0.14 0.00 -1.11 0.00 0.00 56.01 54.69 2hmx n LEU 65 Cb 0.08 -0.15 -0.08 0.00 0.53 0.00 0.00 43.42 43.80 2hmx n LEU 65 CO 0.16 0.63 0.77 1.56 -1.11 0.00 0.00 177.39 179.39 2hmx h GLN 66 N 0.00 -0.32 -0.36 1.96 4.20 -1.50 0.94 115.11 120.04 2hmx h GLN 66 Ca -0.46 0.02 0.08 0.00 0.06 0.00 0.00 58.65 58.35 2hmx h GLN 66 Cb 1.88 0.07 -0.08 0.00 0.30 0.00 0.00 27.48 29.65 2hmx h GLN 66 CO -0.02 -0.18 -0.24 -1.00 -0.67 0.00 0.00 178.83 176.71 2hmx h PRO 67 N -0.37 -0.19 0.00 1.46 0.13 -1.78 -2.05 132.00 129.20 2hmx h PRO 67 Ca -0.03 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2hmx h PRO 67 Cb 0.28 0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.46 2hmx h PRO 67 CO 0.06 -0.12 0.00 0.43 -0.23 0.00 0.00 178.00 178.13 2hmx n SER 68 N -5.39 0.00 0.08 1.44 7.64 0.17 -1.57 113.62 115.99 2hmx n SER 68 Ca 0.01 -0.74 -0.14 0.00 1.01 0.00 0.00 58.87 59.01 2hmx n SER 68 Cb 0.30 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.43 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 0.48 -1.82 -3.43 3.38 0.14 0.84 115.31 114.90 2hmx h LEU 69 Ca 0.00 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2hmx h LEU 69 Cb 0.00 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2hmx h LEU 69 CO 0.00 1.27 0.00 0.06 0.09 0.00 0.00 178.44 179.86 2hmx h GLN 70 N 0.16 0.00 0.00 1.13 3.07 -1.42 -1.86 115.11 116.20 2hmx h GLN 70 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.64 2hmx h GLN 70 Cb 1.73 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.29 2hmx h GLN 70 CO 0.18 0.00 -1.05 0.25 0.09 0.00 0.00 178.83 178.30 2hmx n THR 71 N -2.60 0.00 0.00 1.86 -2.24 -0.47 -4.91 114.28 105.92 2hmx n THR 71 Ca -0.01 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 2hmx n THR 71 Cb 0.10 0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 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 1.94 -0.41 3.64 3.38 0.00 0.28 -5.08 105.19 108.94 2hmx n GLY 72 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.08 -0.02 0.37 1.61 1.04 -1.21 -4.80 113.70 109.60 2hmx s SER 73 Ca 0.00 0.00 0.25 0.00 0.48 0.00 0.00 55.95 56.68 2hmx s SER 73 Cb 0.00 0.02 1.34 0.00 0.10 0.00 0.00 66.02 67.49 2hmx s SER 73 CO 0.00 -0.04 1.76 -0.33 0.98 0.00 0.00 173.24 175.61 2hmx h GLU 74 N 2.00 0.00 0.00 4.02 5.08 -1.99 0.61 114.58 124.30 2hmx h GLU 74 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2hmx h GLU 74 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 2hmx h GLU 74 CO 0.19 0.00 -0.93 -0.85 -1.00 0.00 0.00 179.01 176.41 2hmx n GLU 75 N -2.37 0.03 0.15 2.33 -0.00 -1.26 -1.21 120.64 118.30 2hmx n GLU 75 Ca -0.02 -0.01 0.01 0.00 -0.00 0.00 0.00 57.16 57.15 2hmx n GLU 75 Cb 0.05 -1.50 0.18 0.00 -0.00 0.00 0.00 31.44 30.16 2hmx n GLU 75 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 2hmx h LEU 76 N 0.00 0.00 -0.39 -1.84 6.46 -0.17 -2.18 115.31 117.19 2hmx h LEU 76 Ca 0.00 0.00 -0.18 0.00 -0.12 0.00 0.00 57.88 57.58 2hmx h LEU 76 Cb 0.53 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.45 2hmx h LEU 76 CO 0.00 0.56 -0.77 -0.09 -0.62 0.00 0.00 178.44 177.52 2hmx h ARG 77 N 0.00 0.30 -0.39 1.25 1.12 0.37 0.58 114.38 117.61 2hmx h ARG 77 Ca -0.01 -0.27 -0.11 0.00 -1.11 0.00 0.00 59.98 58.48 2hmx h ARG 77 Cb 1.14 0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 31.15 2hmx h ARG 77 CO 0.07 0.94 -0.22 1.03 -3.11 0.00 0.00 179.97 178.68 2hmx h SER 78 N 0.19 0.79 -0.03 -3.80 0.87 -1.38 0.40 113.55 110.59 2hmx h SER 78 Ca -0.04 -0.28 -0.01 0.00 -1.23 0.00 0.00 61.79 60.23 2hmx h SER 78 Cb 1.36 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 63.10 2hmx h SER 78 CO 0.13 0.99 0.00 0.25 -0.53 0.00 0.00 176.83 177.66 2hmx h LEU 79 N 0.68 0.09 0.00 2.23 5.85 -1.18 -2.33 115.31 120.65 2hmx h LEU 79 Ca 0.09 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 2hmx h LEU 79 Cb 0.73 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.74 2hmx h LEU 79 CO 0.06 0.11 -0.08 0.22 -0.34 0.00 0.00 178.44 178.41 2hmx h TYR 80 N 0.10 0.00 0.00 1.25 3.20 0.15 -0.73 116.97 120.94 2hmx h TYR 80 Ca 0.03 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 2hmx h TYR 80 Cb 0.07 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.34 2hmx h TYR 80 CO 0.00 0.08 -0.03 -2.95 -1.64 0.00 0.00 178.16 173.61 2hmx h ASN 81 N -1.00 0.00 0.96 -2.11 -1.07 -0.29 0.57 115.58 112.64 2hmx h ASN 81 Ca -0.00 0.00 -0.04 0.00 0.07 0.00 0.00 56.30 56.33 2hmx h ASN 81 Cb 0.14 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.38 2hmx h ASN 81 CO -0.00 0.03 -1.07 0.74 0.07 0.00 0.00 177.43 177.21 2hmx h THR 82 N 0.00 0.11 -0.18 6.14 2.02 -1.48 -1.01 112.91 118.51 2hmx h THR 82 Ca -0.00 -1.22 -0.11 0.00 0.77 0.00 0.00 66.41 65.85 2hmx h THR 82 Cb 0.07 1.63 0.00 0.00 -1.74 0.00 0.00 68.15 68.11 2hmx h THR 82 CO 0.00 0.06 -0.33 0.40 0.37 0.00 0.00 175.52 176.03 2hmx h ILE 83 N 0.00 1.34 0.00 3.11 1.08 -0.13 -1.55 117.51 121.36 2hmx h ILE 83 Ca -0.03 -1.56 -0.01 0.00 -0.39 0.00 0.00 64.86 62.87 2hmx h ILE 83 Cb 1.13 1.89 -0.00 0.00 -3.07 0.00 0.00 36.82 36.77 2hmx h ILE 83 CO 0.01 0.48 -0.04 0.00 -0.69 0.00 0.00 178.15 177.90 2hmx h ALA 84 N 0.59 0.99 0.32 1.87 0.00 0.34 0.66 119.26 124.03 2hmx h ALA 84 Ca 0.01 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2hmx h ALA 84 Cb 0.91 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2hmx h ALA 84 CO 0.07 0.05 -0.15 0.28 0.00 0.00 0.00 179.25 179.50 2hmx h VAL 85 N 0.00 0.00 -0.00 0.00 2.07 -1.16 0.30 116.25 117.46 2hmx h VAL 85 Ca -0.00 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2hmx h VAL 85 Cb 0.73 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 2hmx h VAL 85 CO 0.01 0.00 0.00 0.25 0.02 0.00 0.00 177.57 177.85 2hmx h LEU 86 N -0.47 0.00 -0.07 2.57 5.85 0.42 0.97 115.31 124.58 2hmx h LEU 86 Ca -0.04 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.53 2hmx h LEU 86 Cb 0.33 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.37 2hmx h LEU 86 CO 0.07 0.00 -0.51 0.22 -0.34 0.00 0.00 178.44 177.88 2hmx h TYR 87 N 0.00 0.66 -0.26 1.25 5.03 0.14 0.14 116.97 123.93 2hmx h TYR 87 Ca 0.00 -0.31 0.03 0.00 2.58 0.00 0.00 58.73 61.04 2hmx h TYR 87 Cb 0.00 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.18 2hmx h TYR 87 CO 0.00 1.09 0.18 0.00 -1.32 0.00 0.00 178.16 178.10 2hmx h VAL 89 N 0.20 1.70 -0.38 0.00 2.07 0.48 0.73 116.25 121.05 2hmx h VAL 89 Ca 0.11 -2.32 -0.04 0.00 0.82 0.00 0.00 66.70 65.27 2hmx h VAL 89 Cb 0.19 3.25 -0.02 0.00 -1.52 0.00 0.00 31.29 33.19 2hmx h VAL 89 CO -0.02 0.58 0.07 0.45 0.02 0.00 0.00 177.57 178.67 2hmx h HIS 90 N -1.00 0.58 0.84 1.57 3.86 -0.34 -0.90 115.15 119.76 2hmx h HIS 90 Ca -0.03 -0.04 -0.04 0.00 -1.16 0.00 0.00 60.37 59.10 2hmx h HIS 90 Cb 1.01 -0.18 0.01 0.00 1.06 0.00 0.00 27.41 29.31 2hmx h HIS 90 CO 0.26 0.52 -0.40 0.37 0.86 0.00 0.00 177.93 179.54 2hmx h GLN 91 N 0.56 -1.08 0.00 2.45 5.75 -1.19 -3.46 115.11 118.14 2hmx h GLN 91 Ca 0.13 0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.70 2hmx h GLN 91 Cb 0.25 0.25 0.00 0.00 1.07 0.00 0.00 27.48 29.05 2hmx h GLN 91 CO 0.00 -0.72 0.00 -2.13 -2.65 0.00 0.00 178.83 173.33 2hmx n ARG 92 N -5.24 0.00 -1.89 1.69 3.00 -0.34 -5.12 116.66 108.75 2hmx n ARG 92 Ca -0.14 0.00 -0.40 0.00 -0.00 0.00 0.00 57.85 57.31 2hmx n ARG 92 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.91 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 2.26 0.23 5.15 1.09 0.23 -4.93 121.20 125.23 2hmx s ILE 93 Ca 0.00 0.24 0.11 0.00 -1.10 0.00 0.00 60.65 59.90 2hmx s ILE 93 Cb 0.00 -3.15 -0.05 0.00 -1.06 0.00 0.00 42.46 38.21 2hmx s ILE 93 CO 0.00 0.04 -0.16 1.51 -0.10 0.00 0.00 174.94 176.23 2hmx s ASP 94 N -0.50 3.81 0.31 3.58 -4.77 -1.26 -2.89 116.67 114.96 2hmx s ASP 94 Ca 0.57 -0.82 0.05 0.00 -3.30 0.00 0.00 52.55 49.05 2hmx s ASP 94 Cb -0.42 -0.45 -0.03 0.00 -1.09 0.00 0.00 42.92 40.92 2hmx s ASP 94 CO 0.55 0.08 0.21 0.68 0.70 0.00 0.00 175.17 177.39 2hmx s VAL 95 N -2.03 0.14 0.00 2.11 -7.23 -1.26 -5.01 120.40 107.13 2hmx s VAL 95 Ca 0.26 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.43 2hmx s VAL 95 Cb -0.07 -2.48 0.00 0.00 0.56 0.00 0.00 36.38 34.39 2hmx s VAL 95 CO 0.14 0.00 0.00 2.29 -0.31 0.00 0.00 175.10 177.22 2hmx n LYS 96 N -0.60 0.20 -4.28 4.82 -0.00 -1.26 -4.86 118.16 112.18 2hmx n LYS 96 Ca 0.04 0.00 -0.23 0.00 -0.00 0.00 0.00 58.31 58.11 2hmx n LYS 96 Cb 0.64 -0.60 -0.07 0.00 -0.00 0.00 0.00 35.03 34.99 2hmx n LYS 96 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2hmx s ASP 97 N -2.74 4.43 0.04 -5.58 -1.08 -1.26 0.60 116.67 111.08 2hmx s ASP 97 Ca 0.00 -0.77 -0.26 0.00 -0.52 0.00 0.00 52.55 51.00 2hmx s ASP 97 Cb 0.00 -0.72 -0.17 0.00 -1.46 0.00 0.00 42.92 40.57 2hmx s ASP 97 CO 0.00 -0.11 1.45 0.74 0.52 0.00 0.00 175.17 177.77 2hmx h THR 98 N 1.82 0.87 0.00 1.71 2.02 -1.55 -2.01 112.91 115.78 2hmx h THR 98 Ca -0.44 -0.43 -0.01 0.00 0.77 0.00 0.00 66.41 66.31 2hmx h THR 98 Cb 1.25 1.13 -0.00 0.00 -1.74 0.00 0.00 68.15 68.79 2hmx h THR 98 CO 0.62 0.10 -0.03 0.11 0.37 0.00 0.00 175.52 176.69 2hmx h LYS 99 N -0.49 0.00 -0.35 6.66 6.56 -1.85 0.59 116.57 127.69 2hmx h LYS 99 Ca -0.03 0.00 -0.05 0.00 -1.06 0.00 0.00 60.65 59.51 2hmx h LYS 99 Cb 0.37 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.02 2hmx h LYS 99 CO 0.05 0.03 0.02 1.49 -2.06 0.00 0.00 179.45 178.98 2hmx h GLU 100 N 0.00 0.60 -0.00 3.15 4.22 -1.86 0.57 114.58 121.26 2hmx h GLU 100 Ca -0.00 -0.18 0.00 0.00 0.08 0.00 0.00 59.36 59.26 2hmx h GLU 100 Cb 0.09 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 2hmx h GLU 100 CO 0.00 0.71 0.00 0.00 -2.18 0.00 0.00 179.01 177.54 2hmx h ALA 101 N 0.88 0.00 0.00 2.92 0.00 -0.61 -1.10 119.26 121.34 2hmx h ALA 101 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2hmx h ALA 101 Cb 0.42 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2hmx h ALA 101 CO 0.01 -0.48 0.00 1.28 0.00 0.00 0.00 179.25 180.06 2hmx n LEU 102 N -5.08 0.00 -0.04 0.00 4.32 0.20 0.98 117.00 117.38 2hmx n LEU 102 Ca -0.07 0.31 -0.18 0.00 -0.02 0.00 0.00 56.01 56.05 2hmx n LEU 102 Cb 0.04 -0.31 -0.13 0.00 -1.62 0.00 0.00 43.42 41.40 2hmx n LEU 102 CO 0.33 -0.17 0.04 -0.78 -1.22 0.00 0.00 177.39 175.59 2hmx h ASP 103 N 0.00 0.14 -0.70 -1.43 3.58 0.14 -1.10 116.42 117.05 2hmx h ASP 103 Ca 0.00 -0.88 0.03 0.00 0.42 0.00 0.00 57.03 56.60 2hmx h ASP 103 Cb 0.13 -0.05 -0.04 0.00 1.72 0.00 0.00 39.33 41.10 2hmx h ASP 103 CO 0.00 1.25 0.46 0.50 -2.88 0.00 0.00 179.24 178.58 2hmx h LYS 104 N -0.79 0.83 0.00 0.28 1.63 0.11 -1.28 116.57 117.35 2hmx h LYS 104 Ca -0.13 -0.05 -0.09 0.00 -0.85 0.00 0.00 60.65 59.53 2hmx h LYS 104 Cb 1.28 -0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 32.71 2hmx h LYS 104 CO -0.00 0.55 -1.19 0.82 -3.45 0.00 0.00 179.45 176.17 2hmx h ILE 105 N 0.86 0.26 -0.04 2.00 1.08 0.05 0.63 117.51 122.34 2hmx h ILE 105 Ca 0.28 -1.51 -0.04 0.00 -0.39 0.00 0.00 64.86 63.19 2hmx h ILE 105 Cb 0.04 1.78 -0.01 0.00 -3.07 0.00 0.00 36.82 35.57 2hmx h ILE 105 CO -0.08 0.15 -0.16 -0.08 -0.69 0.00 0.00 178.15 177.29 2hmx h GLU 106 N 0.00 0.06 -0.95 2.37 4.57 -0.31 -2.33 114.58 117.99 2hmx h GLU 106 Ca -0.08 -0.01 -0.27 0.00 -1.18 0.00 0.00 59.36 57.81 2hmx h GLU 106 Cb 1.30 -0.01 -0.16 0.00 -0.16 0.00 0.00 28.75 29.72 2hmx h GLU 106 CO 0.02 0.22 0.34 -1.91 -1.18 0.00 0.00 179.01 176.51 2hmx n GLU 107 N -4.32 2.13 -1.25 1.92 2.13 0.09 -4.80 120.64 116.54 2hmx n GLU 107 Ca -0.02 -1.96 -0.09 0.00 0.66 0.00 0.00 57.16 55.75 2hmx n GLU 107 Cb 0.24 -1.81 -0.04 0.00 0.27 0.00 0.00 31.44 30.11 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 -0.38 -1.77 -1.60 5.31 4.07 -0.88 -1.53 120.64 123.87 2hmx n GLU 108 Ca 0.35 0.81 -0.19 0.00 -0.06 0.00 0.00 57.16 58.06 2hmx n GLU 108 Cb 1.19 -5.24 -0.08 0.00 -0.06 0.00 0.00 31.44 27.24 2hmx n GLU 108 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2hmx n GLN 109 N -0.44 -1.32 0.08 5.31 0.00 0.20 -4.53 117.38 116.68 2hmx n GLN 109 Ca -0.09 1.15 0.00 0.00 0.00 0.00 0.00 57.00 58.06 2hmx n GLN 109 Cb 0.57 -5.46 0.00 0.00 0.00 0.00 0.00 30.24 25.35 2hmx n GLN 109 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 2hmx n ASN 110 N -1.07 0.09 0.00 2.61 6.94 -1.18 -4.93 115.26 117.71 2hmx n ASN 110 Ca -0.19 0.27 0.00 0.00 -0.02 0.00 0.00 54.58 54.64 2hmx n ASN 110 Cb 0.62 0.15 0.00 0.00 -2.36 0.00 0.00 39.78 38.19 2hmx n ASN 110 CO 0.00 0.00 0.00 1.17 -1.03 0.00 0.00 177.26 177.40 2hmx n LYS 111 N -3.19 -1.11 -1.27 -3.83 0.00 -0.58 -5.08 118.16 103.11 2hmx n LYS 111 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 2hmx n LYS 111 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.07 2hmx n LYS 111 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2hmx n SER 112 N 0.20 -5.80 0.00 3.14 2.88 -1.26 -4.43 113.62 108.35 2hmx n SER 112 Ca 0.00 0.74 0.00 0.00 -1.33 0.00 0.00 58.87 58.28 2hmx n SER 112 Cb 0.00 -2.98 0.00 0.00 -0.75 0.00 0.00 64.21 60.48 2hmx n SER 112 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2hmx n LYS 113 N 0.81 0.00 0.00 -1.46 0.00 -1.26 -4.63 118.16 111.62 2hmx n LYS 113 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 2hmx n LYS 113 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 2hmx n LYS 113 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2hmx n LYS 114 N -0.11 0.00 -1.20 1.64 4.81 -1.26 -5.15 118.16 116.89 2hmx n LYS 114 Ca 0.00 0.00 0.15 0.00 -0.87 0.00 0.00 58.31 57.59 2hmx n LYS 114 Cb 0.00 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 34.99 2hmx n LYS 114 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 2hmx n LYS 115 N -1.10 -2.66 0.00 1.64 0.00 -1.26 -5.07 118.16 109.72 2hmx n LYS 115 Ca 0.00 2.04 0.00 0.00 0.00 0.00 0.00 58.31 60.35 2hmx n LYS 115 Cb 0.00 -3.15 0.00 0.00 0.00 0.00 0.00 35.03 31.88 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 -3.41 0.00 -0.98 3.14 0.00 -1.26 -5.17 120.51 112.83 2hmx n ALA 116 Ca -0.05 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.52 2hmx n ALA 116 Cb 0.56 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.96 2hmx n ALA 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2hmx n GLN 117 N -0.60 -2.14 0.00 0.00 6.02 -1.26 -5.07 117.38 114.33 2hmx n GLN 117 Ca 0.00 1.62 0.00 0.00 -0.01 0.00 0.00 57.00 58.61 2hmx n GLN 117 Cb 0.00 -2.55 0.00 0.00 1.02 0.00 0.00 30.24 28.71 2hmx n GLN 117 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 2hmx n GLN 118 N -3.71 0.00 -1.37 -1.09 0.00 -1.26 -5.17 117.38 104.78 2hmx n GLN 118 Ca -0.03 0.00 0.17 0.00 -0.00 0.00 0.00 57.00 57.13 2hmx n GLN 118 Cb 0.46 0.00 -0.09 0.00 0.00 0.00 0.00 30.24 30.61 2hmx n GLN 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2hmx n ALA 119 N -2.33 -3.59 -3.15 1.69 0.00 -1.26 -5.03 120.51 106.84 2hmx n ALA 119 Ca 0.00 0.89 0.06 0.00 0.00 0.00 0.00 53.44 54.38 2hmx n ALA 119 Cb 0.00 -1.50 -0.01 0.00 0.00 0.00 0.00 19.45 17.94 2hmx n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hmx s ALA 120 N -4.19 -3.79 0.50 0.00 0.00 -1.26 -5.17 121.76 107.84 2hmx s ALA 120 Ca 0.00 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.33 2hmx s ALA 120 Cb 0.00 -2.66 0.00 0.00 0.00 0.00 0.00 23.12 20.46 2hmx s ALA 120 CO 0.00 -1.72 0.00 0.00 0.00 0.00 0.00 175.76 174.04 2hmx n ALA 121 N 5.34 -1.85 -2.93 0.00 0.00 -1.26 -5.04 120.51 114.77 2hmx n ALA 121 Ca -0.01 0.44 0.03 0.00 0.00 0.00 0.00 53.44 53.90 2hmx n ALA 121 Cb 0.56 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.69 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 -5.16 -0.49 -0.08 0.00 1.47 -1.26 -5.18 116.67 105.98 2hmx s ASP 122 Ca 0.00 -0.14 -0.31 0.00 1.18 0.00 0.00 52.55 53.27 2hmx s ASP 122 Cb 0.00 0.84 0.12 0.00 -0.34 0.00 0.00 42.92 43.54 2hmx s ASP 122 CO 0.00 -0.07 1.39 0.28 0.68 0.00 0.00 175.17 177.45 2hmx s THR 123 N 2.28 0.00 0.00 2.11 -1.32 -1.26 -5.16 115.64 112.28 2hmx s THR 123 Ca 0.18 -0.04 0.00 0.00 -1.21 0.00 0.00 61.69 60.62 2hmx s THR 123 Cb 0.01 -2.49 0.00 0.00 -1.51 0.00 0.00 72.50 68.51 2hmx s THR 123 CO -0.17 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 172.85 2hmx n GLY 124 N -0.73 2.51 3.35 6.08 0.00 -1.26 -5.17 105.19 109.97 2hmx n GLY 124 Ca -0.02 -0.86 0.02 0.00 0.00 0.00 0.00 46.02 45.16 2hmx n GLY 124 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2hmx s ASN 125 N 0.00 -0.31 0.10 1.61 2.47 -1.26 -5.14 114.94 112.42 2hmx s ASN 125 Ca 0.00 0.43 0.00 0.00 0.42 0.00 0.00 52.86 53.71 2hmx s ASN 125 Cb 0.00 1.32 0.00 0.00 -1.45 0.00 0.00 41.25 41.12 2hmx s ASN 125 CO 0.00 -0.06 0.00 0.59 -3.72 0.00 0.00 177.10 173.91 2hmx n ASN 126 N 4.51 -7.42 -1.52 -4.21 4.13 -1.26 -5.04 115.26 104.46 2hmx n ASN 126 Ca -0.09 1.17 -0.00 0.00 1.68 0.00 0.00 54.58 57.34 2hmx n ASN 126 Cb 0.55 -4.10 0.01 0.00 -1.54 0.00 0.00 39.78 34.69 2hmx n ASN 126 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2hmx n SER 127 N 1.41 -0.17 -2.28 6.41 3.41 -1.26 -5.16 113.62 115.98 2hmx n SER 127 Ca 0.00 -1.04 -0.11 0.00 -0.26 0.00 0.00 58.87 57.46 2hmx n SER 127 Cb 0.00 0.08 -0.04 0.00 -0.26 0.00 0.00 64.21 63.98 2hmx n SER 127 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hmx n GLN 128 N -0.17 0.24 -3.47 4.33 6.02 -1.26 -5.18 117.38 117.89 2hmx n GLN 128 Ca -0.02 -1.92 -0.11 0.00 -0.01 0.00 0.00 57.00 54.94 2hmx n GLN 128 Cb 0.52 1.58 -0.02 0.00 1.02 0.00 0.00 30.24 33.33 2hmx n GLN 128 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2hmx s VAL 129 N -2.78 0.00 0.00 5.09 0.11 -1.26 -5.07 120.40 116.49 2hmx s VAL 129 Ca 0.23 -0.12 0.00 0.00 -2.93 0.00 0.00 61.98 59.16 2hmx s VAL 129 Cb 0.01 -1.12 0.00 0.00 -1.53 0.00 0.00 36.38 33.74 2hmx s VAL 129 CO 0.16 0.00 0.00 -0.24 -3.33 0.00 0.00 175.10 171.69 2hmx n SER 130 N -0.39 4.68 0.00 3.54 2.88 -1.26 -5.04 113.62 118.03 2hmx n SER 130 Ca -0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.39 2hmx n SER 130 Cb 0.64 0.64 0.00 0.00 -0.75 0.00 0.00 64.21 64.74 2hmx n SER 130 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2hmx n GLN 131 N -1.72 0.00 -0.62 -1.46 7.27 -1.26 -4.80 117.38 114.78 2hmx n GLN 131 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 57.00 57.04 2hmx n GLN 131 Cb 0.30 0.00 0.02 0.00 2.41 0.00 0.00 30.24 32.97 2hmx n GLN 131 CO 0.00 0.00 0.00 -1.71 0.07 0.00 0.00 177.06 175.42 2hmx n ASN 132 N 2.90 0.10 0.00 1.69 5.15 -1.26 -5.37 115.26 118.47 2hmx n ASN 132 Ca 0.00 -1.10 0.03 0.00 -0.60 0.00 0.00 54.58 52.91 2hmx n ASN 132 Cb 0.00 -0.08 0.15 0.00 -0.53 0.00 0.00 39.78 39.32 2hmx n ASN 132 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66