#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 1.68 0.00 -0.41 0.00 -1.26 -5.16 119.30 114.15 2hmx s MET 2 Ca 0.00 -1.97 0.00 0.00 0.00 0.00 0.00 55.69 53.72 2hmx s MET 2 Cb 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 34.83 34.51 2hmx s MET 2 CO 0.00 -0.42 0.00 0.41 0.00 0.00 0.00 175.02 175.01 2hmx n GLY 3 N -0.67 3.85 0.42 3.16 0.00 -1.26 -5.10 105.19 105.59 2hmx n GLY 3 Ca -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.48 0.00 -2.44 4.61 0.00 -1.26 -4.59 120.51 116.35 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 0.01 0.00 0.00 0.00 0.00 19.45 19.46 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 -2.04 -1.93 0.00 0.00 3.00 -1.26 -3.97 116.66 110.45 2hmx n ARG 5 Ca 0.00 1.80 0.00 0.00 -0.01 0.00 0.00 57.85 59.64 2hmx n ARG 5 Cb 0.00 -4.40 0.00 0.00 0.00 0.00 0.00 32.46 28.06 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 -0.12 0.00 -3.00 7.54 0.00 -1.26 -4.67 120.51 119.00 2hmx n ALA 6 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2hmx n ALA 6 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.69 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 1.87 0.00 0.30 0.00 2.88 -1.26 -5.06 113.62 112.35 2hmx n SER 7 Ca 0.00 -0.67 -0.12 0.00 -1.33 0.00 0.00 58.87 56.75 2hmx n SER 7 Cb 0.00 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 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 0.67 0.00 -2.05 2.46 2.07 -1.83 -3.48 116.25 114.10 2hmx h VAL 8 Ca 0.00 -0.04 -0.03 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 -4.15 0.00 0.00 2.57 4.77 -1.26 -4.84 117.00 114.09 2hmx n LEU 9 Ca -0.09 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 2hmx n LEU 9 Cb 0.30 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 2hmx n LEU 9 CO 0.23 -0.62 0.00 -1.54 -1.33 0.00 0.00 177.39 174.13 2hmx n SER 10 N -3.06 0.00 0.38 -1.43 3.41 -1.26 -4.93 113.62 106.73 2hmx n SER 10 Ca 0.01 -0.98 -0.18 0.00 -0.26 0.00 0.00 58.87 57.46 2hmx n SER 10 Cb 0.03 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.89 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 0.00 -0.99 1.02 5.00 0.00 -1.99 -1.44 103.07 104.67 2hmx h GLY 11 Ca 0.00 0.37 -0.15 0.00 0.00 0.00 0.00 47.33 47.54 2hmx h GLY 11 CO 0.00 -0.36 -0.44 -1.33 0.00 0.00 0.00 176.54 174.41 2hmx h GLY 12 N -0.97 0.79 2.00 4.60 0.00 -1.99 -2.14 103.07 105.37 2hmx h GLY 12 Ca -0.10 -0.92 -0.01 0.00 0.00 0.00 0.00 47.33 46.30 2hmx h GLY 12 CO 0.16 0.83 -0.03 0.83 0.00 0.00 0.00 176.54 178.32 2hmx h GLU 13 N 0.45 0.00 0.58 4.80 5.08 -1.95 0.82 114.58 124.36 2hmx h GLU 13 Ca 0.01 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2hmx h GLU 13 Cb 1.04 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.30 2hmx h GLU 13 CO 0.10 0.03 -0.28 1.25 -1.00 0.00 0.00 179.01 179.11 2hmx h LEU 14 N 0.00 -0.66 -1.64 1.33 7.12 -0.80 0.54 115.31 121.20 2hmx h LEU 14 Ca -0.00 0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.02 2hmx h LEU 14 Cb 0.07 0.17 0.00 0.00 -0.53 0.00 0.00 40.66 40.38 2hmx h LEU 14 CO 0.00 -0.45 0.00 -0.78 -0.13 0.00 0.00 178.44 177.09 2hmx h ASP 15 N -0.81 0.00 0.03 1.25 3.58 0.12 0.68 116.42 121.28 2hmx h ASP 15 Ca -0.08 0.00 -0.25 0.00 0.42 0.00 0.00 57.03 57.12 2hmx h ASP 15 Cb 0.61 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.63 2hmx h ASP 15 CO 0.13 0.00 -1.37 0.50 -2.88 0.00 0.00 179.24 175.62 2hmx h LYS 16 N 0.00 0.07 0.00 0.28 3.11 -1.08 -3.36 116.57 115.59 2hmx h LYS 16 Ca 0.00 -0.11 0.00 0.00 -2.81 0.00 0.00 60.65 57.73 2hmx h LYS 16 Cb 0.04 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 31.31 2hmx h LYS 16 CO 0.00 1.05 0.00 1.87 -2.81 0.00 0.00 179.45 179.56 2hmx n TRP 17 N -4.23 0.32 -0.77 1.91 -0.00 0.19 -2.73 117.44 112.14 2hmx n TRP 17 Ca -0.31 0.16 -0.20 0.00 -0.00 0.00 0.00 57.50 57.16 2hmx n TRP 17 Cb 0.76 -0.76 0.12 0.00 -0.00 0.00 0.00 31.31 31.44 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 -1.82 2.00 0.00 5.87 4.07 0.20 -3.73 120.64 127.23 2hmx n GLU 18 Ca -0.00 -2.32 0.00 0.00 -0.06 0.00 0.00 57.16 54.77 2hmx n GLU 18 Cb 0.03 -1.91 0.00 0.00 -0.06 0.00 0.00 31.44 29.50 2hmx n GLU 18 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 2hmx n LYS 19 N -0.69 0.00 -3.52 5.31 4.81 -0.79 -4.80 118.16 118.48 2hmx n LYS 19 Ca 0.46 0.00 -0.41 0.00 -0.87 0.00 0.00 58.31 57.49 2hmx n LYS 19 Cb 1.27 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 36.22 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 5.19 0.11 3.15 1.01 -0.87 -4.82 121.20 124.96 2hmx s ILE 20 Ca 0.00 -0.41 -0.31 0.00 0.00 0.00 0.00 60.65 59.93 2hmx s ILE 20 Cb 0.00 -3.75 -0.10 0.00 0.01 0.00 0.00 42.46 38.62 2hmx s ILE 20 CO 0.00 -0.11 1.83 -0.60 0.00 0.00 0.00 174.94 176.05 2hmx s ARG 21 N 1.69 4.14 0.00 2.79 3.52 0.20 0.62 118.95 131.91 2hmx s ARG 21 Ca 0.05 2.57 0.00 0.00 -0.13 0.00 0.00 55.73 58.23 2hmx s ARG 21 Cb -0.18 -3.65 0.00 0.00 -1.56 0.00 0.00 34.95 29.56 2hmx s ARG 21 CO 0.10 -0.84 0.36 1.28 -0.81 0.00 0.00 175.30 175.38 2hmx n LEU 22 N 5.85 0.71 -4.55 -0.88 4.77 -0.95 -0.78 117.00 121.17 2hmx n LEU 22 Ca 0.18 0.36 -0.31 0.00 -0.03 0.00 0.00 56.01 56.21 2hmx n LEU 22 Cb 0.39 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.37 2hmx n LEU 22 CO 0.66 0.00 -0.43 0.00 -1.33 0.00 0.00 177.39 176.28 2hmx s ARG 23 N -0.72 2.25 -0.75 3.23 1.70 -1.26 -3.96 118.95 119.45 2hmx s ARG 23 Ca 0.00 -0.91 -0.26 0.00 -0.47 0.00 0.00 55.73 54.09 2hmx s ARG 23 Cb 0.00 -2.33 -0.13 0.00 -0.57 0.00 0.00 34.95 31.91 2hmx s ARG 23 CO 0.00 0.55 2.41 -0.35 -1.08 0.00 0.00 175.30 176.83 2hmx n PRO 24 N 1.25 0.62 0.00 3.89 -0.04 -1.26 -1.77 135.00 137.69 2hmx n PRO 24 Ca -0.15 -0.69 0.00 0.00 -0.04 0.00 0.00 63.50 62.62 2hmx n PRO 24 Cb 0.52 -3.59 0.00 0.00 -0.04 0.00 0.00 33.50 30.40 2hmx n PRO 24 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2hmx n GLY 25 N 6.65 2.05 0.28 0.55 0.00 -1.26 -4.97 105.19 108.49 2hmx n GLY 25 Ca 0.46 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.61 2hmx n GLY 25 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2hmx h GLY 26 N 0.00 0.00 -0.81 -0.02 0.00 -1.77 -3.45 103.07 97.02 2hmx h GLY 26 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 46.98 2hmx h GLY 26 CO 0.00 0.00 -0.32 1.17 0.00 0.00 0.00 176.54 177.39 2hmx n LYS 27 N -3.94 -1.45 -4.15 4.80 3.00 -1.26 -4.98 118.16 110.18 2hmx n LYS 27 Ca -0.03 1.10 -0.27 0.00 -0.00 0.00 0.00 58.31 59.11 2hmx n LYS 27 Cb 0.12 -5.45 -0.07 0.00 0.00 0.00 0.00 35.03 29.63 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 -3.43 2.61 0.05 1.64 1.02 -1.26 -5.10 119.74 115.27 2hmx s LYS 28 Ca 0.00 -0.97 0.03 0.00 0.02 0.00 0.00 55.97 55.05 2hmx s LYS 28 Cb 0.00 -2.50 -0.03 0.00 -0.52 0.00 0.00 37.83 34.79 2hmx s LYS 28 CO 0.00 0.48 -0.09 1.14 -0.92 0.00 0.00 175.35 175.96 2hmx s GLN 29 N -2.86 0.63 0.48 1.68 1.03 -1.26 -2.25 119.66 117.10 2hmx s GLN 29 Ca 0.28 -0.85 -0.24 0.00 0.04 0.00 0.00 55.36 54.59 2hmx s GLN 29 Cb -0.10 -0.43 -0.07 0.00 0.03 0.00 0.00 33.01 32.44 2hmx s GLN 29 CO 0.20 0.08 1.40 0.71 -2.54 0.00 0.00 175.29 175.14 2hmx s TYR 30 N -1.50 2.42 0.26 9.60 1.51 0.20 -4.79 117.35 125.05 2hmx s TYR 30 Ca -0.06 1.30 0.02 0.00 -1.01 0.00 0.00 57.07 57.32 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 0.01 -2.90 0.16 0.21 -1.11 0.00 0.00 175.55 171.91 2hmx s LYS 31 N -2.58 1.44 0.57 -0.62 2.20 -1.26 -1.89 119.74 117.60 2hmx s LYS 31 Ca 0.64 -1.80 0.38 0.00 -0.36 0.00 0.00 55.97 54.83 2hmx s LYS 31 Cb -0.42 0.08 1.87 0.00 -1.51 0.00 0.00 37.83 37.85 2hmx s LYS 31 CO 0.53 -0.44 2.13 1.25 -0.36 0.00 0.00 175.35 178.47 2hmx h LEU 32 N 2.38 0.00 -1.25 5.43 7.12 -1.92 0.28 115.31 127.35 2hmx h LEU 32 Ca -0.34 0.00 -0.05 0.00 0.13 0.00 0.00 57.88 57.62 2hmx h LEU 32 Cb 1.25 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 41.36 2hmx h LEU 32 CO 0.51 0.00 -0.01 0.50 -0.13 0.00 0.00 178.44 179.31 2hmx h LYS 33 N 0.00 0.50 0.00 1.25 1.63 -1.96 0.59 116.57 118.58 2hmx h LYS 33 Ca 0.00 -0.11 0.00 0.00 -0.85 0.00 0.00 60.65 59.69 2hmx h LYS 33 Cb 0.19 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.75 2hmx h LYS 33 CO 0.00 0.53 -1.41 0.72 -3.45 0.00 0.00 179.45 175.84 2hmx n HIS 34 N -4.28 0.33 -0.13 1.91 -0.00 0.92 -2.08 115.22 111.89 2hmx n HIS 34 Ca 0.01 0.09 -0.09 0.00 -0.00 0.00 0.00 57.72 57.74 2hmx n HIS 34 Cb 0.24 -0.57 -0.01 0.00 -0.00 0.00 0.00 29.99 29.65 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 1.19 -0.73 1.59 2.10 -0.62 -0.46 117.51 120.58 2hmx h ILE 35 Ca 0.00 -0.59 -0.03 0.00 1.08 0.00 0.00 64.86 65.32 2hmx h ILE 35 Cb 0.89 0.87 -0.03 0.00 -1.09 0.00 0.00 36.82 37.46 2hmx h ILE 35 CO 0.00 0.21 0.34 0.58 -1.08 0.00 0.00 178.15 178.21 2hmx h VAL 36 N 0.48 1.23 0.07 2.19 2.07 0.53 0.58 116.25 123.41 2hmx h VAL 36 Ca 0.13 -0.67 -0.00 0.00 0.82 0.00 0.00 66.70 66.97 2hmx h VAL 36 Cb 0.19 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 2hmx h VAL 36 CO -0.01 0.28 -0.04 -0.25 0.02 0.00 0.00 177.57 177.58 2hmx h TRP 37 N 1.04 -0.09 0.58 1.57 7.01 -1.44 -0.71 115.95 123.91 2hmx h TRP 37 Ca 0.25 -0.00 -0.03 0.00 2.11 0.00 0.00 58.89 61.22 2hmx h TRP 37 Cb 0.12 0.03 0.00 0.00 -2.10 0.00 0.00 29.16 27.21 2hmx h TRP 37 CO 0.01 -0.03 -0.32 0.00 -2.79 0.00 0.00 178.44 175.31 2hmx h ALA 38 N 0.80 -1.19 0.00 2.65 0.00 -0.35 -1.04 119.26 120.13 2hmx h ALA 38 Ca -0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2hmx h ALA 38 Cb 0.10 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2hmx h ALA 38 CO 0.02 -1.14 -0.01 0.66 0.00 0.00 0.00 179.25 178.78 2hmx h SER 39 N -0.83 0.00 0.23 0.00 4.64 0.16 0.82 113.55 118.56 2hmx h SER 39 Ca -0.08 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.23 2hmx h SER 39 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 2hmx h SER 39 CO 0.10 0.01 -0.11 0.08 -0.87 0.00 0.00 176.83 176.04 2hmx h ARG 40 N 0.00 -0.29 -0.17 4.77 0.11 -1.12 -2.44 114.38 115.23 2hmx h ARG 40 Ca -0.00 0.02 -0.02 0.00 0.10 0.00 0.00 59.98 60.08 2hmx h ARG 40 Cb 0.05 0.07 -0.01 0.00 1.11 0.00 0.00 29.97 31.19 2hmx h ARG 40 CO 0.00 0.08 0.00 1.49 0.10 0.00 0.00 179.97 181.65 2hmx h GLU 41 N -0.86 0.24 0.00 0.08 4.57 0.20 0.07 114.58 118.88 2hmx h GLU 41 Ca -0.03 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2hmx h GLU 41 Cb 0.51 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.06 2hmx h GLU 41 CO 0.05 0.26 0.00 -0.11 -1.18 0.00 0.00 179.01 178.03 2hmx n LEU 42 N -4.40 0.03 0.34 1.64 7.94 -0.14 0.20 117.00 122.61 2hmx n LEU 42 Ca -0.00 0.90 0.22 0.00 -1.11 0.00 0.00 56.01 56.02 2hmx n LEU 42 Cb 0.17 -0.45 1.16 0.00 0.53 0.00 0.00 43.42 44.82 2hmx n LEU 42 CO 0.36 -0.45 1.18 1.05 -1.11 0.00 0.00 177.39 178.42 2hmx h GLU 43 N 0.00 0.00 0.00 1.96 -0.00 -0.95 0.10 114.58 115.70 2hmx h GLU 43 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 2hmx h GLU 43 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 2hmx h GLU 43 CO 0.00 0.00 -1.33 0.54 -0.00 0.00 0.00 179.01 178.22 2hmx n ARG 44 N -3.07 0.23 0.35 1.06 5.12 -0.03 -1.50 116.66 118.83 2hmx n ARG 44 Ca -0.03 -0.07 -0.14 0.00 -1.93 0.00 0.00 57.85 55.69 2hmx n ARG 44 Cb 0.12 -1.51 -0.07 0.00 -1.16 0.00 0.00 32.46 29.85 2hmx n ARG 44 CO 0.00 0.00 0.00 0.74 -1.93 0.00 0.00 177.63 176.44 2hmx h PHE 45 N 0.00 -0.84 0.00 -1.55 0.04 0.23 -3.45 116.94 111.37 2hmx h PHE 45 Ca 0.00 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.75 2hmx h PHE 45 Cb 0.68 0.28 0.00 0.00 2.20 0.00 0.00 35.95 39.10 2hmx h PHE 45 CO 0.00 -0.52 0.00 0.00 -0.60 0.00 0.00 178.31 177.19 2hmx n ALA 46 N -2.48 0.41 -2.55 2.45 0.00 -0.86 -5.09 120.51 112.38 2hmx n ALA 46 Ca -0.11 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.07 2hmx n ALA 46 Cb 0.36 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.72 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 0.88 -0.02 0.00 1.01 -0.56 -5.00 120.40 116.71 2hmx s VAL 47 Ca 0.00 -2.00 0.07 0.00 0.00 0.00 0.00 61.98 60.05 2hmx s VAL 47 Cb 0.00 -2.44 -0.02 0.00 0.00 0.00 0.00 36.38 33.93 2hmx s VAL 47 CO 0.00 0.00 -0.23 0.21 0.00 0.00 0.00 175.10 175.08 2hmx s ASN 48 N -3.63 2.73 -0.01 3.32 3.84 -1.26 -4.38 114.94 115.55 2hmx s ASN 48 Ca 0.24 -0.42 -0.22 0.00 0.21 0.00 0.00 52.86 52.66 2hmx s ASN 48 Cb 0.04 -0.30 -0.14 0.00 -0.55 0.00 0.00 41.25 40.30 2hmx s ASN 48 CO 0.13 0.29 0.98 1.55 -2.79 0.00 0.00 177.10 177.25 2hmx h PRO 49 N 5.54 -0.60 0.00 0.43 0.13 -1.89 -1.40 132.00 134.22 2hmx h PRO 49 Ca -0.41 0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2hmx h PRO 49 Cb 1.13 0.14 -0.00 0.00 0.13 0.00 0.00 31.00 32.40 2hmx h PRO 49 CO 0.47 -0.31 -0.02 0.78 -0.23 0.00 0.00 178.00 178.69 2hmx h GLY 50 N -1.06 0.00 2.00 1.56 0.00 -1.90 0.88 103.07 104.55 2hmx h GLY 50 Ca -0.06 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.26 2hmx h GLY 50 CO 0.10 0.00 -0.04 -2.00 0.00 0.00 0.00 176.54 174.61 2hmx h LEU 51 N 0.00 0.00 0.00 3.11 6.46 -1.90 0.15 115.31 123.13 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 0.04 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.97 2hmx h LEU 51 CO 0.00 0.04 -1.82 -0.11 -0.62 0.00 0.00 178.44 175.93 2hmx n LEU 52 N -4.21 0.17 0.33 2.25 -0.00 0.25 -2.58 117.00 113.20 2hmx n LEU 52 Ca -0.03 -0.04 0.22 0.00 -0.00 0.00 0.00 56.01 56.16 2hmx n LEU 52 Cb 0.12 -0.01 1.16 0.00 -0.00 0.00 0.00 43.42 44.70 2hmx n LEU 52 CO 0.32 0.02 1.16 -0.08 -0.00 0.00 0.00 177.39 178.81 2hmx h GLU 53 N 0.00 0.00 -6.28 1.96 4.81 0.30 -3.40 114.58 111.97 2hmx h GLU 53 Ca 0.00 0.00 -0.46 0.00 -0.13 0.00 0.00 59.36 58.77 2hmx h GLU 53 Cb 0.94 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.32 2hmx h GLU 53 CO 0.00 0.00 -0.36 0.95 -0.73 0.00 0.00 179.01 178.87 2hmx s THR 54 N -4.09 4.89 0.19 0.32 -4.23 -0.84 -4.91 115.64 106.96 2hmx s THR 54 Ca -0.04 -0.91 -0.12 0.00 -1.18 0.00 0.00 61.69 59.44 2hmx s THR 54 Cb 0.12 -3.73 0.10 0.00 1.34 0.00 0.00 72.50 70.33 2hmx s THR 54 CO 0.42 -0.31 1.79 0.77 -0.54 0.00 0.00 174.62 176.74 2hmx h SER 55 N 1.02 0.40 -0.22 3.99 4.64 -1.83 -2.37 113.55 119.17 2hmx h SER 55 Ca -0.50 0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2hmx h SER 55 Cb 1.24 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.28 2hmx h SER 55 CO 0.59 0.27 0.12 -0.08 -0.87 0.00 0.00 176.83 176.85 2hmx h GLU 56 N 0.53 0.30 -0.48 4.77 4.81 -1.92 0.68 114.58 123.28 2hmx h GLU 56 Ca 0.25 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.39 2hmx h GLU 56 Cb 0.17 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 2hmx h GLU 56 CO -0.18 0.28 0.07 0.78 -0.73 0.00 0.00 179.01 179.24 2hmx h GLY 57 N 0.24 0.86 2.00 1.92 0.00 -1.53 -0.09 103.07 106.47 2hmx h GLY 57 Ca 0.08 -0.58 -0.01 0.00 0.00 0.00 0.00 47.33 46.82 2hmx h GLY 57 CO -0.01 0.54 -0.04 0.00 0.00 0.00 0.00 176.54 177.03 2hmx h ARG 59 N 0.00 0.21 0.00 0.00 2.43 0.12 0.58 114.38 117.71 2hmx h ARG 59 Ca -0.00 -0.36 -0.01 0.00 -0.81 0.00 0.00 59.98 58.80 2hmx h ARG 59 Cb 0.11 0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2hmx h ARG 59 CO 0.00 1.17 -0.04 0.37 -1.51 0.00 0.00 179.97 179.97 2hmx h GLN 60 N -0.56 0.00 0.00 0.20 4.15 0.12 -2.04 115.11 116.99 2hmx h GLN 60 Ca -0.11 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.31 2hmx h GLN 60 Cb 1.46 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.15 2hmx h GLN 60 CO 0.10 0.04 -0.07 0.82 -1.93 0.00 0.00 178.83 177.79 2hmx h ILE 61 N 0.00 0.00 0.00 2.39 1.08 0.12 -2.43 117.51 118.67 2hmx h ILE 61 Ca -0.00 -0.74 0.00 0.00 -0.39 0.00 0.00 64.86 63.73 2hmx h ILE 61 Cb 0.20 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.95 2hmx h ILE 61 CO 0.00 0.00 0.00 0.25 -0.69 0.00 0.00 178.15 177.72 2hmx h LEU 62 N -0.74 0.00 0.00 1.44 5.85 0.20 0.98 115.31 123.04 2hmx h LEU 62 Ca 0.00 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2hmx h LEU 62 Cb 0.07 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 2hmx h LEU 62 CO 0.00 0.00 -0.28 1.23 -0.34 0.00 0.00 178.44 179.05 2hmx h GLY 63 N 0.00 0.00 2.00 3.75 0.00 -1.47 -2.49 103.07 104.86 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 -0.18 0.00 0.00 0.00 176.54 176.36 2hmx n GLN 64 N -4.64 0.16 -0.09 4.80 7.27 0.28 -3.66 117.38 121.50 2hmx n GLN 64 Ca -0.10 0.54 -0.10 0.00 0.07 0.00 0.00 57.00 57.42 2hmx n GLN 64 Cb 0.31 -1.91 -0.11 0.00 2.41 0.00 0.00 30.24 30.93 2hmx n GLN 64 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 2hmx n LEU 65 N -2.23 1.08 0.20 1.69 7.94 0.21 -2.85 117.00 123.03 2hmx n LEU 65 Ca 0.00 -0.04 -0.15 0.00 -1.11 0.00 0.00 56.01 54.71 2hmx n LEU 65 Cb 0.12 -0.01 -0.08 0.00 0.53 0.00 0.00 43.42 43.98 2hmx n LEU 65 CO 0.14 0.56 0.74 1.56 -1.11 0.00 0.00 177.39 179.28 2hmx h GLN 66 N 0.00 -0.42 -0.37 1.96 4.20 -1.51 0.95 115.11 119.92 2hmx h GLN 66 Ca -0.44 0.03 0.08 0.00 0.06 0.00 0.00 58.65 58.38 2hmx h GLN 66 Cb 1.89 0.10 -0.08 0.00 0.30 0.00 0.00 27.48 29.68 2hmx h GLN 66 CO -0.01 -0.26 -0.21 -1.00 -0.67 0.00 0.00 178.83 176.68 2hmx h PRO 67 N -0.47 -0.14 0.00 1.46 0.13 -1.78 -2.12 132.00 129.08 2hmx h PRO 67 Ca -0.04 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 2hmx h PRO 67 Cb 0.36 0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.52 2hmx h PRO 67 CO 0.07 -0.10 0.00 0.43 -0.23 0.00 0.00 178.00 178.18 2hmx n SER 68 N -5.37 0.00 0.09 1.44 7.64 0.16 -1.46 113.62 116.11 2hmx n SER 68 Ca 0.02 0.20 -0.05 0.00 1.01 0.00 0.00 58.87 60.05 2hmx n SER 68 Cb 0.29 -0.36 0.13 0.00 -1.01 0.00 0.00 64.21 63.26 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 0.26 -2.20 -3.43 3.38 0.14 0.83 115.31 114.29 2hmx h LEU 69 Ca 0.00 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2hmx h LEU 69 Cb 0.19 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2hmx h LEU 69 CO 0.00 0.80 0.00 0.06 0.09 0.00 0.00 178.44 179.39 2hmx h GLN 70 N 0.17 0.00 0.00 1.13 3.07 -1.39 -2.19 115.11 115.90 2hmx h GLN 70 Ca -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.72 2hmx h GLN 70 Cb 1.09 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.65 2hmx h GLN 70 CO 0.09 0.00 -1.24 0.25 0.09 0.00 0.00 178.83 178.02 2hmx n THR 71 N -2.78 0.06 0.00 1.86 -2.24 -0.54 -4.91 114.28 105.73 2hmx n THR 71 Ca -0.02 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2hmx n THR 71 Cb 0.10 0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 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 2.31 0.49 3.69 3.38 0.00 0.28 -5.09 105.19 110.26 2hmx n GLY 72 Ca -0.02 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.04 2hmx n GLY 72 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2hmx s SER 73 N -1.00 -0.00 0.16 1.61 1.04 -1.21 -4.80 113.70 109.50 2hmx s SER 73 Ca 0.00 -0.01 0.12 0.00 0.48 0.00 0.00 55.95 56.54 2hmx s SER 73 Cb 0.00 0.01 0.62 0.00 0.10 0.00 0.00 66.02 66.74 2hmx s SER 73 CO 0.00 -0.01 1.37 1.21 0.98 0.00 0.00 173.24 176.78 2hmx n GLU 74 N -0.64 0.07 0.03 4.02 2.13 -1.26 -0.67 120.64 124.32 2hmx n GLU 74 Ca -0.05 0.54 -0.12 0.00 0.66 0.00 0.00 57.16 58.19 2hmx n GLU 74 Cb 0.62 -1.73 -0.14 0.00 0.27 0.00 0.00 31.44 30.47 2hmx n GLU 74 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2hmx h GLU 75 N 0.00 0.10 -0.20 5.31 5.08 -1.96 -1.72 114.58 121.19 2hmx h GLU 75 Ca 0.00 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.14 2hmx h GLU 75 Cb 0.04 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2hmx h GLU 75 CO 0.00 0.88 -0.09 1.25 -1.00 0.00 0.00 179.01 180.04 2hmx h LEU 76 N 0.03 0.30 -0.87 1.33 6.46 -1.21 -2.31 115.31 119.04 2hmx h LEU 76 Ca -0.20 -0.06 -0.07 0.00 -0.12 0.00 0.00 57.88 57.43 2hmx h LEU 76 Cb 1.95 -0.08 -0.02 0.00 -0.73 0.00 0.00 40.66 41.78 2hmx h LEU 76 CO 0.12 0.43 0.08 -0.09 -0.62 0.00 0.00 178.44 178.36 2hmx h ARG 77 N 0.30 0.92 -0.53 1.25 1.12 -0.31 0.58 114.38 117.72 2hmx h ARG 77 Ca 0.06 -0.23 0.00 0.00 -1.11 0.00 0.00 59.98 58.70 2hmx h ARG 77 Cb 0.36 -0.12 -0.03 0.00 -0.01 0.00 0.00 29.97 30.18 2hmx h ARG 77 CO 0.02 0.87 0.33 0.77 -3.11 0.00 0.00 179.97 178.85 2hmx h SER 78 N 0.87 0.62 0.09 -3.80 0.02 -1.28 0.10 113.55 110.16 2hmx h SER 78 Ca 0.18 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 2hmx h SER 78 Cb 0.40 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.79 2hmx h SER 78 CO 0.01 0.47 -0.04 0.25 -1.14 0.00 0.00 176.83 176.39 2hmx h LEU 79 N 0.71 0.00 0.00 5.07 5.85 -0.89 -1.13 115.31 124.92 2hmx h LEU 79 Ca 0.19 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.74 2hmx h LEU 79 Cb -0.04 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2hmx h LEU 79 CO -0.04 0.04 -0.81 0.22 -0.34 0.00 0.00 178.44 177.51 2hmx h TYR 80 N 0.00 0.00 0.19 1.25 3.20 0.22 -2.04 116.97 119.79 2hmx h TYR 80 Ca -0.00 0.00 -0.28 0.00 3.14 0.00 0.00 58.73 61.59 2hmx h TYR 80 Cb 0.09 0.00 0.02 0.00 1.54 0.00 0.00 36.73 38.38 2hmx h TYR 80 CO 0.00 0.78 -1.29 -2.95 -1.64 0.00 0.00 178.16 173.06 2hmx h ASN 81 N 0.00 0.62 0.56 -2.11 7.08 -0.58 -0.75 115.58 120.41 2hmx h ASN 81 Ca -0.02 -0.92 -0.13 0.00 -3.08 0.00 0.00 56.30 52.15 2hmx h ASN 81 Cb 1.61 -0.20 -0.02 0.00 -2.08 0.00 0.00 38.32 37.63 2hmx h ASN 81 CO 0.10 1.60 -0.60 0.71 -2.08 0.00 0.00 177.43 177.17 2hmx h THR 82 N -0.10 1.42 0.88 6.14 1.35 -1.46 0.57 112.91 121.71 2hmx h THR 82 Ca -0.24 -2.04 -0.04 0.00 -0.55 0.00 0.00 66.41 63.54 2hmx h THR 82 Cb 1.93 2.09 0.01 0.00 -1.73 0.00 0.00 68.15 70.44 2hmx h THR 82 CO 0.19 0.58 -0.42 0.40 -0.25 0.00 0.00 175.52 176.02 2hmx h ILE 83 N 0.03 0.02 -0.37 6.82 1.08 -1.43 0.77 117.51 124.44 2hmx h ILE 83 Ca -0.01 -0.12 -0.04 0.00 -0.39 0.00 0.00 64.86 64.30 2hmx h ILE 83 Cb 1.06 0.02 -0.02 0.00 -3.07 0.00 0.00 36.82 34.82 2hmx h ILE 83 CO 0.08 0.00 0.06 0.00 -0.69 0.00 0.00 178.15 177.60 2hmx h ALA 84 N -1.28 1.41 0.73 1.87 0.00 0.35 0.67 119.26 123.00 2hmx h ALA 84 Ca -0.12 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 2hmx h ALA 84 Cb 0.91 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.55 2hmx h ALA 84 CO 0.20 0.42 -0.35 0.28 0.00 0.00 0.00 179.25 179.80 2hmx h VAL 85 N 0.54 0.25 0.00 0.00 2.07 0.07 0.24 116.25 119.41 2hmx h VAL 85 Ca 0.12 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.55 2hmx h VAL 85 Cb 0.26 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 2hmx h VAL 85 CO 0.00 0.01 0.01 -0.11 0.02 0.00 0.00 177.57 177.50 2hmx n LEU 86 N -5.48 0.57 0.07 2.57 7.94 0.55 0.65 117.00 123.86 2hmx n LEU 86 Ca -0.14 0.76 -0.22 0.00 -1.11 0.00 0.00 56.01 55.31 2hmx n LEU 86 Cb 0.40 -0.83 -0.15 0.00 0.53 0.00 0.00 43.42 43.37 2hmx n LEU 86 CO 0.37 -0.96 -0.08 0.22 -1.11 0.00 0.00 177.39 175.83 2hmx h TYR 87 N 0.00 0.66 -0.49 1.96 5.03 0.25 0.62 116.97 125.00 2hmx h TYR 87 Ca 0.00 -0.49 0.07 0.00 2.58 0.00 0.00 58.73 60.89 2hmx h TYR 87 Cb 0.02 -0.03 -0.06 0.00 1.55 0.00 0.00 36.73 38.22 2hmx h TYR 87 CO 0.00 1.41 0.17 0.00 -1.32 0.00 0.00 178.16 178.41 2hmx h VAL 89 N 0.34 1.33 0.00 0.00 2.07 0.77 0.64 116.25 121.39 2hmx h VAL 89 Ca 0.23 -1.35 -0.03 0.00 0.82 0.00 0.00 66.70 66.37 2hmx h VAL 89 Cb 0.25 1.74 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 2hmx h VAL 89 CO -0.25 0.41 -0.16 0.45 0.02 0.00 0.00 177.57 178.05 2hmx h HIS 90 N 0.17 0.00 -0.02 1.57 3.86 -0.19 -2.56 115.15 117.98 2hmx h HIS 90 Ca 0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2hmx h HIS 90 Cb 0.73 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.20 2hmx h HIS 90 CO 0.08 0.16 -0.04 0.94 0.86 0.00 0.00 177.93 179.93 2hmx n GLN 91 N -3.54 1.92 -2.52 2.45 -0.06 0.20 -4.75 117.38 111.07 2hmx n GLN 91 Ca -0.01 -1.40 -0.02 0.00 -2.00 0.00 0.00 57.00 53.58 2hmx n GLN 91 Cb 0.30 -1.47 0.01 0.00 -4.06 0.00 0.00 30.24 25.02 2hmx n GLN 91 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2hmx n ARG 92 N 0.68 -0.54 -4.19 3.69 5.12 -0.83 -5.02 116.66 115.57 2hmx n ARG 92 Ca 0.16 0.06 -0.19 0.00 -1.93 0.00 0.00 57.85 55.95 2hmx n ARG 92 Cb 0.47 -2.73 -0.16 0.00 -1.16 0.00 0.00 32.46 28.88 2hmx n ARG 92 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2hmx s ILE 93 N -3.02 0.51 0.20 0.55 1.09 0.20 -5.01 121.20 115.72 2hmx s ILE 93 Ca 0.04 -0.18 0.10 0.00 -1.10 0.00 0.00 60.65 59.51 2hmx s ILE 93 Cb -0.02 -0.50 -0.04 0.00 -1.06 0.00 0.00 42.46 40.84 2hmx s ILE 93 CO 0.05 0.19 -0.11 1.51 -0.10 0.00 0.00 174.94 176.48 2hmx s ASP 94 N 0.49 4.13 0.28 3.58 -4.77 -1.26 -2.11 116.67 117.01 2hmx s ASP 94 Ca -0.06 -0.66 0.02 0.00 -3.30 0.00 0.00 52.55 48.55 2hmx s ASP 94 Cb -0.10 -0.64 -0.04 0.00 -1.09 0.00 0.00 42.92 41.05 2hmx s ASP 94 CO -0.00 0.09 0.15 0.68 0.70 0.00 0.00 175.17 176.79 2hmx s VAL 95 N -1.84 0.28 -0.09 2.11 -7.23 -1.26 -5.05 120.40 107.32 2hmx s VAL 95 Ca 0.26 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.44 2hmx s VAL 95 Cb -0.08 -2.53 -0.06 0.00 0.56 0.00 0.00 36.38 34.27 2hmx s VAL 95 CO 0.15 0.00 -0.07 0.29 -0.31 0.00 0.00 175.10 175.16 2hmx n LYS 96 N -0.50 0.47 -4.35 4.82 4.76 -1.26 -4.90 118.16 117.20 2hmx n LYS 96 Ca 0.02 0.05 -0.18 0.00 -2.87 0.00 0.00 58.31 55.32 2hmx n LYS 96 Cb 0.65 -1.18 -0.10 0.00 -1.84 0.00 0.00 35.03 32.56 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 -4.77 1.50 0.07 4.39 -4.77 -1.26 0.59 116.67 112.43 2hmx s ASP 97 Ca -0.11 -1.43 -0.35 0.00 -3.30 0.00 0.00 52.55 47.36 2hmx s ASP 97 Cb 0.03 0.19 -0.17 0.00 -1.09 0.00 0.00 42.92 41.88 2hmx s ASP 97 CO 0.21 -0.76 1.53 0.74 0.70 0.00 0.00 175.17 177.60 2hmx h THR 98 N 2.28 0.00 0.00 2.11 2.02 -1.08 -1.35 112.91 116.89 2hmx h THR 98 Ca -0.37 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.81 2hmx h THR 98 Cb 1.25 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 2hmx h THR 98 CO 0.60 0.00 0.03 0.11 0.37 0.00 0.00 175.52 176.63 2hmx h LYS 99 N -1.05 0.00 0.00 6.66 1.57 -1.86 0.58 116.57 122.47 2hmx h LYS 99 Ca -0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2hmx h LYS 99 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.19 2hmx h LYS 99 CO 0.01 0.00 -1.39 0.39 -0.57 0.00 0.00 179.45 177.89 2hmx n GLU 100 N -2.48 0.27 0.03 3.15 -0.58 -1.05 -0.16 120.64 119.81 2hmx n GLU 100 Ca -0.02 -0.08 -0.13 0.00 -0.42 0.00 0.00 57.16 56.52 2hmx n GLU 100 Cb 0.07 -1.20 -0.09 0.00 -0.57 0.00 0.00 31.44 29.65 2hmx n GLU 100 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2hmx h ALA 101 N 0.78 -0.05 0.00 0.62 0.00 -0.79 -2.13 119.26 117.69 2hmx h ALA 101 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2hmx h ALA 101 Cb 0.39 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2hmx h ALA 101 CO 0.00 -0.38 0.00 1.25 0.00 0.00 0.00 179.25 180.12 2hmx h LEU 102 N -0.34 0.00 0.21 0.00 5.85 0.18 0.89 115.31 122.10 2hmx h LEU 102 Ca -0.01 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2hmx h LEU 102 Cb 0.31 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.35 2hmx h LEU 102 CO 0.01 0.00 -0.10 -2.24 -0.34 0.00 0.00 178.44 175.77 2hmx h ASP 103 N 0.00 -0.24 0.05 1.25 3.04 -0.53 0.37 116.42 120.35 2hmx h ASP 103 Ca 0.00 0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.80 2hmx h ASP 103 Cb 0.08 0.06 0.00 0.00 -1.04 0.00 0.00 39.33 38.43 2hmx h ASP 103 CO 0.00 0.17 0.00 1.17 -2.04 0.00 0.00 179.24 178.54 2hmx n LYS 104 N -4.69 0.01 -0.06 4.15 3.00 0.28 -1.05 118.16 119.81 2hmx n LYS 104 Ca -0.04 0.37 -0.06 0.00 -0.00 0.00 0.00 58.31 58.59 2hmx n LYS 104 Cb 0.11 -1.50 -0.09 0.00 0.00 0.00 0.00 35.03 33.55 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 -1.39 0.79 0.41 3.15 2.08 0.26 -0.71 119.36 123.95 2hmx n ILE 105 Ca 0.01 -0.50 0.12 0.00 0.56 0.00 0.00 62.75 62.94 2hmx n ILE 105 Cb 0.02 -0.66 0.21 0.00 -0.75 0.00 0.00 39.64 38.46 2hmx n ILE 105 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 2hmx h GLU 106 N 0.00 0.00 0.00 0.38 4.57 0.02 -1.68 114.58 117.87 2hmx h GLU 106 Ca -0.31 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.87 2hmx h GLU 106 Cb 1.70 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.29 2hmx h GLU 106 CO 0.02 0.00 0.00 -1.91 -1.18 0.00 0.00 179.01 175.94 2hmx n GLU 107 N -2.52 0.01 -1.22 1.92 4.07 -0.22 -4.78 120.64 117.89 2hmx n GLU 107 Ca 0.04 0.41 -0.08 0.00 -0.06 0.00 0.00 57.16 57.47 2hmx n GLU 107 Cb 0.48 -1.50 -0.03 0.00 -0.06 0.00 0.00 31.44 30.33 2hmx n GLU 107 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 2hmx n GLU 108 N -1.46 -1.75 -1.39 5.31 1.02 -0.63 -3.82 120.64 117.91 2hmx n GLU 108 Ca 0.01 0.76 -0.13 0.00 -0.02 0.00 0.00 57.16 57.77 2hmx n GLU 108 Cb 0.04 -5.18 -0.06 0.00 -0.02 0.00 0.00 31.44 26.22 2hmx n GLU 108 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 2hmx n GLN 109 N -0.34 -1.59 0.07 3.49 7.27 0.11 -4.53 117.38 121.86 2hmx n GLN 109 Ca -0.08 0.97 0.00 0.00 0.07 0.00 0.00 57.00 57.96 2hmx n GLN 109 Cb 0.55 -5.36 0.00 0.00 2.41 0.00 0.00 30.24 27.84 2hmx n GLN 109 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2hmx n ASN 110 N -1.18 0.65 0.00 1.69 3.02 -1.26 -5.04 115.26 113.14 2hmx n ASN 110 Ca -0.13 0.23 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 2hmx n ASN 110 Cb 0.61 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 2hmx n ASN 110 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2hmx n LYS 111 N -3.44 -1.04 -1.49 3.52 4.76 -1.25 -5.17 118.16 114.05 2hmx n LYS 111 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2hmx n LYS 111 Cb 0.03 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.22 2hmx n LYS 111 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2hmx n SER 112 N 0.28 -6.83 0.00 4.39 2.88 -1.26 -4.74 113.62 108.35 2hmx n SER 112 Ca 0.00 0.93 0.00 0.00 -1.33 0.00 0.00 58.87 58.47 2hmx n SER 112 Cb 0.00 -3.61 0.00 0.00 -0.75 0.00 0.00 64.21 59.85 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 1.02 0.00 0.00 -1.46 3.00 -1.26 -4.78 118.16 114.68 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 -0.02 0.00 -1.28 1.64 4.81 -1.26 -5.14 118.16 116.91 2hmx n LYS 114 Ca 0.00 0.00 0.17 0.00 -0.87 0.00 0.00 58.31 57.61 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 -1.28 -2.74 0.00 1.64 0.00 -1.26 -5.06 118.16 109.47 2hmx n LYS 115 Ca 0.00 2.01 0.00 0.00 0.00 0.00 0.00 58.31 60.32 2hmx n LYS 115 Cb 0.00 -3.27 0.00 0.00 0.00 0.00 0.00 35.03 31.76 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 -3.07 0.00 -1.37 3.14 0.00 -1.26 -5.17 120.51 112.79 2hmx n ALA 116 Ca -0.03 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.59 2hmx n ALA 116 Cb 0.59 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.99 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 -0.42 -2.84 0.00 0.00 1.13 -1.26 -5.05 117.38 108.95 2hmx n GLN 117 Ca 0.00 1.97 0.00 0.00 -1.94 0.00 0.00 57.00 57.03 2hmx n GLN 117 Cb 0.00 -3.43 0.00 0.00 0.11 0.00 0.00 30.24 26.92 2hmx n GLN 117 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2hmx n GLN 118 N -4.12 0.00 -1.79 -1.09 3.00 -1.26 -5.16 117.38 106.96 2hmx n GLN 118 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 2hmx n GLN 118 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.87 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 -2.31 -2.06 -3.61 -1.58 0.00 -1.26 -5.11 120.51 104.58 2hmx n ALA 119 Ca 0.00 0.46 -0.01 0.00 0.00 0.00 0.00 53.44 53.90 2hmx n ALA 119 Cb 0.00 -1.43 -0.01 0.00 0.00 0.00 0.00 19.45 18.01 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 -2.12 -2.19 0.07 0.00 0.00 -1.26 -5.15 121.76 111.11 2hmx s ALA 120 Ca 0.00 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.08 2hmx s ALA 120 Cb 0.00 0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.25 2hmx s ALA 120 CO 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 175.76 174.91 2hmx n ALA 121 N -0.31 -2.12 -3.15 0.00 0.00 -1.26 -5.08 120.51 108.59 2hmx n ALA 121 Ca -0.04 0.44 0.05 0.00 0.00 0.00 0.00 53.44 53.89 2hmx n ALA 121 Cb 0.61 -1.34 -0.01 0.00 0.00 0.00 0.00 19.45 18.71 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 -0.52 -0.43 -0.09 0.00 -4.77 -1.26 -5.18 116.67 104.42 2hmx s ASP 122 Ca 0.00 0.15 -0.32 0.00 -3.30 0.00 0.00 52.55 49.07 2hmx s ASP 122 Cb 0.00 1.31 0.14 0.00 -1.09 0.00 0.00 42.92 43.28 2hmx s ASP 122 CO 0.00 -0.08 1.42 0.28 0.70 0.00 0.00 175.17 177.49 2hmx s THR 123 N 2.96 0.00 0.00 2.11 -1.32 -1.26 -5.17 115.64 112.95 2hmx s THR 123 Ca 0.13 -0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.58 2hmx s THR 123 Cb -0.06 -2.12 0.00 0.00 -1.51 0.00 0.00 72.50 68.81 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 -0.56 2.82 3.30 6.08 0.00 -1.26 -5.16 105.19 110.42 2hmx n GLY 124 Ca -0.08 -1.11 0.03 0.00 0.00 0.00 0.00 46.02 44.85 2hmx n GLY 124 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2hmx s ASN 125 N 0.00 -0.33 0.16 1.61 0.02 -1.26 -5.15 114.94 109.99 2hmx s ASN 125 Ca 0.00 0.45 0.00 0.00 -1.02 0.00 0.00 52.86 52.29 2hmx s ASN 125 Cb 0.00 1.37 0.00 0.00 0.02 0.00 0.00 41.25 42.64 2hmx s ASN 125 CO 0.00 -0.06 0.00 0.59 0.02 0.00 0.00 177.10 177.65 2hmx n ASN 126 N 4.73 -5.91 0.02 -1.22 4.13 -1.26 -5.05 115.26 110.70 2hmx n ASN 126 Ca -0.08 0.74 0.00 0.00 1.68 0.00 0.00 54.58 56.92 2hmx n ASN 126 Cb 0.54 -2.82 0.00 0.00 -1.54 0.00 0.00 39.78 35.96 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 0.61 -0.34 -2.95 6.41 3.41 -1.26 -5.16 113.62 114.34 2hmx n SER 127 Ca 0.00 0.36 -0.14 0.00 -0.26 0.00 0.00 58.87 58.83 2hmx n SER 127 Cb 0.00 0.62 0.11 0.00 -0.26 0.00 0.00 64.21 64.68 2hmx n SER 127 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2hmx n GLN 128 N -2.71 -1.36 -3.68 4.33 7.27 -1.26 -5.09 117.38 114.88 2hmx n GLN 128 Ca 0.00 -0.89 -0.14 0.00 0.07 0.00 0.00 57.00 56.04 2hmx n GLN 128 Cb 0.00 -0.71 -0.07 0.00 2.41 0.00 0.00 30.24 31.87 2hmx n GLN 128 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 2hmx s VAL 129 N -2.13 0.05 -0.03 1.69 0.11 -1.26 -5.09 120.40 113.74 2hmx s VAL 129 Ca 0.34 -0.40 -0.01 0.00 -2.93 0.00 0.00 61.98 58.98 2hmx s VAL 129 Cb -0.02 -0.84 -0.01 0.00 -1.53 0.00 0.00 36.38 33.97 2hmx s VAL 129 CO 0.25 -0.22 -0.03 -1.20 -3.33 0.00 0.00 175.10 170.57 2hmx n SER 130 N 0.83 0.46 0.00 3.54 7.64 -1.26 -5.02 113.62 119.81 2hmx n SER 130 Ca -0.20 0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.71 2hmx n SER 130 Cb 0.58 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 2hmx n SER 130 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2hmx n GLN 131 N -3.08 0.00 -4.04 1.43 7.27 -1.26 -4.57 117.38 113.13 2hmx n GLN 131 Ca -0.05 0.00 -0.32 0.00 0.07 0.00 0.00 57.00 56.70 2hmx n GLN 131 Cb 0.54 0.00 -0.15 0.00 2.41 0.00 0.00 30.24 33.04 2hmx n GLN 131 CO 0.00 0.00 0.00 -0.80 0.07 0.00 0.00 177.06 176.33 2hmx s ASN 132 N -4.00 4.49 0.00 1.69 -0.87 -1.26 -5.39 114.94 109.61 2hmx s ASN 132 Ca 0.00 -1.61 0.03 0.00 -1.57 0.00 0.00 52.86 49.71 2hmx s ASN 132 Cb 0.00 -1.53 0.16 0.00 -0.02 0.00 0.00 41.25 39.85 2hmx s ASN 132 CO 0.00 -0.25 0.64 0.00 -2.57 0.00 0.00 177.10 174.92