#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hmx n MET 2 N 0.00 -3.07 -3.13 1.57 0.00 -1.26 -4.93 117.12 106.30 2hmx n MET 2 Ca 0.00 2.50 -0.11 0.00 -0.00 0.00 0.00 57.70 60.09 2hmx n MET 2 Cb 0.00 -3.49 0.05 0.00 0.00 0.00 0.00 33.22 29.78 2hmx n MET 2 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2hmx n GLY 3 N -3.88 -1.11 1.81 -5.12 0.00 -1.26 -4.89 105.19 90.73 2hmx n GLY 3 Ca -0.08 0.53 -0.09 0.00 0.00 0.00 0.00 46.02 46.39 2hmx n GLY 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hmx n ALA 4 N -2.83 4.37 -0.41 4.61 0.00 -1.26 -2.97 120.51 122.02 2hmx n ALA 4 Ca -0.05 -1.94 0.00 0.00 0.00 0.00 0.00 53.44 51.44 2hmx n ALA 4 Cb 0.59 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.79 2hmx n ALA 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2hmx n ARG 5 N -0.25 1.41 0.00 0.00 5.12 -1.26 -5.13 116.66 116.56 2hmx n ARG 5 Ca 0.36 -0.97 0.00 0.00 -1.93 0.00 0.00 57.85 55.31 2hmx n ARG 5 Cb 1.24 -0.79 0.00 0.00 -1.16 0.00 0.00 32.46 31.75 2hmx n ARG 5 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2hmx n ALA 6 N -0.25 0.00 -3.32 7.54 0.00 -1.16 -4.74 120.51 118.58 2hmx n ALA 6 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hmx n ALA 6 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.77 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 -2.90 0.80 0.38 0.00 2.88 -1.26 -5.01 113.62 108.50 2hmx n SER 7 Ca 0.00 -0.92 -0.15 0.00 -1.33 0.00 0.00 58.87 56.47 2hmx n SER 7 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 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 0.37 0.00 -4.05 2.46 2.07 -1.93 -3.48 116.25 111.68 2hmx h VAL 8 Ca 0.00 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 2hmx h VAL 8 Cb 0.00 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.77 2hmx h VAL 8 CO 0.00 0.00 -0.01 0.18 0.02 0.00 0.00 177.57 177.76 2hmx n LEU 9 N -4.73 0.00 0.00 2.57 4.77 -1.26 -4.72 117.00 113.62 2hmx n LEU 9 Ca -0.12 -0.09 -0.01 0.00 -0.03 0.00 0.00 56.01 55.76 2hmx n LEU 9 Cb 0.38 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 2hmx n LEU 9 CO 0.29 -0.21 0.01 -1.54 -1.33 0.00 0.00 177.39 174.61 2hmx n SER 10 N -1.81 0.06 0.11 -1.43 3.41 -1.26 -4.92 113.62 107.77 2hmx n SER 10 Ca -0.00 -1.04 -0.04 0.00 -0.26 0.00 0.00 58.87 57.53 2hmx n SER 10 Cb 0.02 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 63.94 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 -0.28 0.97 5.00 0.00 -2.01 -1.64 103.07 105.10 2hmx h GLY 11 Ca -0.01 0.10 -0.03 0.00 0.00 0.00 0.00 47.33 47.40 2hmx h GLY 11 CO 0.01 -0.10 0.19 -1.33 0.00 0.00 0.00 176.54 175.31 2hmx h GLY 12 N -0.28 0.78 2.00 4.60 0.00 -1.98 -2.36 103.07 105.83 2hmx h GLY 12 Ca -0.03 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 2hmx h GLY 12 CO 0.05 0.40 -0.05 0.83 0.00 0.00 0.00 176.54 177.77 2hmx h GLU 13 N 0.64 0.00 0.54 4.80 5.08 -1.94 0.25 114.58 123.96 2hmx h GLU 13 Ca 0.16 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 2hmx h GLU 13 Cb 0.20 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.45 2hmx h GLU 13 CO -0.01 0.05 -0.26 1.25 -1.00 0.00 0.00 179.01 179.03 2hmx h LEU 14 N 0.00 -0.62 -0.05 1.33 5.85 -0.80 0.56 115.31 121.58 2hmx h LEU 14 Ca -0.00 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.67 2hmx h LEU 14 Cb 0.09 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.28 2hmx h LEU 14 CO 0.01 -0.25 0.00 -0.67 -0.34 0.00 0.00 178.44 177.19 2hmx n ASP 15 N -5.30 0.02 -0.01 1.25 2.03 0.34 0.59 116.55 115.47 2hmx n ASP 15 Ca -0.11 0.51 0.02 0.00 0.52 0.00 0.00 54.79 55.73 2hmx n ASP 15 Cb 0.33 -0.51 -0.06 0.00 -0.72 0.00 0.00 41.12 40.16 2hmx n ASP 15 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2hmx n LYS 16 N -1.53 0.78 -0.29 -0.67 3.00 0.62 -4.12 118.16 115.95 2hmx n LYS 16 Ca 0.00 -0.05 -0.06 0.00 -0.00 0.00 0.00 58.31 58.20 2hmx n LYS 16 Cb 0.01 -1.18 0.06 0.00 0.00 0.00 0.00 35.03 33.93 2hmx n LYS 16 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.40 179.75 2hmx h TRP 17 N 0.00 1.17 -0.94 5.64 2.91 0.25 -3.37 115.95 121.61 2hmx h TRP 17 Ca -0.04 -0.08 -0.49 0.00 1.13 0.00 0.00 58.89 59.42 2hmx h TRP 17 Cb 0.57 -0.36 -0.16 0.00 -0.51 0.00 0.00 29.16 28.70 2hmx h TRP 17 CO 0.00 0.88 0.53 -1.91 -1.03 0.00 0.00 178.44 176.91 2hmx n GLU 18 N -4.32 2.58 -2.66 2.65 2.13 0.20 -3.42 120.64 117.81 2hmx n GLU 18 Ca 0.07 -2.30 -0.04 0.00 0.66 0.00 0.00 57.16 55.56 2hmx n GLU 18 Cb 0.17 -2.18 0.09 0.00 0.27 0.00 0.00 31.44 29.79 2hmx n GLU 18 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2hmx n LYS 19 N 1.18 0.05 -3.70 5.31 4.81 -1.23 -4.88 118.16 119.71 2hmx n LYS 19 Ca 0.50 -0.58 -0.21 0.00 -0.87 0.00 0.00 58.31 57.15 2hmx n LYS 19 Cb 0.56 -0.08 -0.04 0.00 0.02 0.00 0.00 35.03 35.50 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 0.03 2.99 -0.12 3.15 1.01 -0.96 -4.80 121.20 122.50 2hmx s ILE 20 Ca 0.24 -1.38 -0.02 0.00 0.00 0.00 0.00 60.65 59.49 2hmx s ILE 20 Cb 0.24 -3.06 -0.03 0.00 0.01 0.00 0.00 42.46 39.61 2hmx s ILE 20 CO -0.12 -0.07 -0.06 -0.60 0.00 0.00 0.00 174.94 174.09 2hmx s ARG 21 N -4.06 3.27 -0.35 2.79 6.06 0.71 0.60 118.95 127.97 2hmx s ARG 21 Ca 0.45 -0.54 0.07 0.00 -2.50 0.00 0.00 55.73 53.21 2hmx s ARG 21 Cb -0.04 -2.76 0.52 0.00 0.06 0.00 0.00 34.95 32.73 2hmx s ARG 21 CO 0.27 0.42 1.55 1.47 -2.50 0.00 0.00 175.30 176.51 2hmx n LEU 22 N 2.98 4.86 0.00 -0.88 -0.00 -0.87 -1.48 117.00 121.60 2hmx n LEU 22 Ca -0.18 -3.90 0.00 0.00 -0.00 0.00 0.00 56.01 51.93 2hmx n LEU 22 Cb 0.53 -0.67 0.00 0.00 -0.00 0.00 0.00 43.42 43.28 2hmx n LEU 22 CO 0.30 1.34 0.00 -2.11 -0.00 0.00 0.00 177.39 176.92 2hmx n ARG 23 N -1.08 0.00 0.08 1.47 1.85 -1.22 -4.90 116.66 112.87 2hmx n ARG 23 Ca 0.40 0.00 -0.13 0.00 -1.00 0.00 0.00 57.85 57.13 2hmx n ARG 23 Cb 1.10 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 32.43 2hmx n ARG 23 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 2hmx h PRO 24 N 0.00 -0.13 -0.77 2.89 0.13 -1.90 -2.14 132.00 130.08 2hmx h PRO 24 Ca 0.00 0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 65.03 2hmx h PRO 24 Cb 0.00 0.03 -0.07 0.00 0.13 0.00 0.00 31.00 31.09 2hmx h PRO 24 CO 0.00 -0.04 0.14 0.41 -0.23 0.00 0.00 178.00 178.28 2hmx n GLY 25 N -1.02 2.98 3.48 1.56 0.00 -1.26 -4.88 105.19 106.05 2hmx n GLY 25 Ca -0.08 -0.73 -0.24 0.00 0.00 0.00 0.00 46.02 44.97 2hmx n GLY 25 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2hmx s GLY 26 N -0.63 1.96 -0.21 -0.02 0.00 -0.80 -5.01 107.32 102.61 2hmx s GLY 26 Ca 0.42 -1.95 0.08 0.00 0.00 0.00 0.00 44.72 43.27 2hmx s GLY 26 CO 0.11 -1.96 1.44 0.28 0.00 0.00 0.00 173.10 172.98 2hmx n LYS 27 N -0.66 3.21 -3.22 2.90 4.01 -1.26 -4.69 118.16 118.45 2hmx n LYS 27 Ca -0.05 -2.16 -0.39 0.00 -0.51 0.00 0.00 58.31 55.20 2hmx n LYS 27 Cb 0.62 -1.98 -0.06 0.00 -0.51 0.00 0.00 35.03 33.11 2hmx n LYS 27 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 2hmx s LYS 28 N -2.24 4.29 0.42 1.97 2.47 -1.26 -5.04 119.74 120.35 2hmx s LYS 28 Ca 0.38 0.74 0.04 0.00 -1.56 0.00 0.00 55.97 55.57 2hmx s LYS 28 Cb 0.30 -3.32 -0.02 0.00 -1.46 0.00 0.00 37.83 33.33 2hmx s LYS 28 CO 0.10 0.43 0.15 -0.65 0.16 0.00 0.00 175.35 175.54 2hmx s GLN 29 N -0.39 1.97 0.22 4.03 -0.21 -1.26 -2.05 119.66 121.98 2hmx s GLN 29 Ca 0.31 -2.21 0.07 0.00 0.02 0.00 0.00 55.36 53.54 2hmx s GLN 29 Cb -0.18 -0.51 -0.04 0.00 1.00 0.00 0.00 33.01 33.28 2hmx s GLN 29 CO 0.18 -0.54 0.13 0.71 -2.12 0.00 0.00 175.29 173.65 2hmx s TYR 30 N -3.19 3.03 0.08 0.91 2.02 0.20 -4.38 117.35 116.02 2hmx s TYR 30 Ca 0.23 -0.11 0.01 0.00 -0.37 0.00 0.00 57.07 56.84 2hmx s TYR 30 Cb 0.02 -1.40 -0.00 0.00 -0.40 0.00 0.00 41.96 40.18 2hmx s TYR 30 CO 0.16 0.54 0.08 1.63 -1.57 0.00 0.00 175.55 176.38 2hmx n LYS 31 N -0.82 0.11 0.00 -0.62 5.02 -1.26 -2.28 118.16 118.32 2hmx n LYS 31 Ca -0.08 -0.74 0.05 0.00 -2.02 0.00 0.00 58.31 55.52 2hmx n LYS 31 Cb 0.57 0.63 0.27 0.00 -0.02 0.00 0.00 35.03 36.48 2hmx n LYS 31 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2hmx n LEU 32 N 0.00 0.00 0.11 -0.35 4.77 -1.26 0.66 117.00 120.93 2hmx n LEU 32 Ca 0.01 0.15 -0.22 0.00 -0.03 0.00 0.00 56.01 55.93 2hmx n LEU 32 Cb 0.14 -0.15 -0.15 0.00 -2.33 0.00 0.00 43.42 40.92 2hmx n LEU 32 CO 0.07 -0.11 -0.30 0.11 -1.33 0.00 0.00 177.39 175.84 2hmx h LYS 33 N 0.00 0.41 0.00 3.23 1.79 -1.97 0.33 116.57 120.36 2hmx h LYS 33 Ca 0.00 -0.71 -0.04 0.00 -2.18 0.00 0.00 60.65 57.72 2hmx h LYS 33 Cb 0.05 0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 30.96 2hmx h LYS 33 CO 0.00 1.32 -0.18 0.45 -1.08 0.00 0.00 179.45 179.96 2hmx h HIS 34 N 0.11 0.00 0.59 -1.35 3.86 -0.15 0.57 115.15 118.77 2hmx h HIS 34 Ca -0.26 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 58.93 2hmx h HIS 34 Cb 2.10 0.00 0.01 0.00 1.06 0.00 0.00 27.41 30.57 2hmx h HIS 34 CO 0.10 0.18 -0.28 0.82 0.86 0.00 0.00 177.93 179.61 2hmx h ILE 35 N 0.00 0.00 -0.36 2.45 1.08 -1.24 0.56 117.51 120.00 2hmx h ILE 35 Ca -0.00 -0.02 -0.01 0.00 -0.39 0.00 0.00 64.86 64.44 2hmx h ILE 35 Cb 0.45 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 34.18 2hmx h ILE 35 CO 0.02 0.00 0.18 0.58 -0.69 0.00 0.00 178.15 178.24 2hmx h VAL 36 N -0.81 1.13 0.51 1.67 2.07 -0.56 0.62 116.25 120.88 2hmx h VAL 36 Ca -0.08 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 2hmx h VAL 36 Cb 0.60 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2hmx h VAL 36 CO 0.13 0.14 -0.26 -0.25 0.02 0.00 0.00 177.57 177.36 2hmx h TRP 37 N 0.50 -0.67 0.26 1.57 7.01 0.10 -1.83 115.95 122.89 2hmx h TRP 37 Ca 0.13 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.10 2hmx h TRP 37 Cb 0.05 0.23 0.00 0.00 -2.10 0.00 0.00 29.16 27.34 2hmx h TRP 37 CO 0.00 -0.41 -0.13 0.00 -2.79 0.00 0.00 178.44 175.11 2hmx h ALA 38 N -0.21 -1.07 -0.04 2.65 0.00 0.49 -1.53 119.26 119.55 2hmx h ALA 38 Ca -0.07 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.78 2hmx h ALA 38 Cb 0.55 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 2hmx h ALA 38 CO 0.10 -1.04 0.04 0.77 0.00 0.00 0.00 179.25 179.11 2hmx h SER 39 N -0.36 0.00 0.29 0.00 0.02 -0.11 0.36 113.55 113.76 2hmx h SER 39 Ca -0.04 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 2hmx h SER 39 Cb 0.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.81 2hmx h SER 39 CO 0.06 0.00 -0.14 0.03 -1.14 0.00 0.00 176.83 175.64 2hmx h ARG 40 N 0.00 -0.38 -0.69 3.45 3.08 -1.37 -1.29 114.38 117.18 2hmx h ARG 40 Ca 0.02 0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 2hmx h ARG 40 Cb 0.09 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.19 2hmx h ARG 40 CO -0.00 -0.12 0.39 1.49 -1.07 0.00 0.00 179.97 180.67 2hmx h GLU 41 N -0.61 0.95 0.24 0.04 4.57 -0.18 -2.24 114.58 117.34 2hmx h GLU 41 Ca -0.04 -0.09 -0.01 0.00 -1.18 0.00 0.00 59.36 58.04 2hmx h GLU 41 Cb 0.44 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 28.84 2hmx h GLU 41 CO 0.07 0.68 -0.11 1.25 -1.18 0.00 0.00 179.01 179.72 2hmx h LEU 42 N 0.96 -0.27 -2.91 1.64 5.85 -0.66 0.34 115.31 120.26 2hmx h LEU 42 Ca 0.25 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.98 2hmx h LEU 42 Cb -0.00 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 2hmx h LEU 42 CO -0.04 -0.18 0.02 -0.33 -0.34 0.00 0.00 178.44 177.57 2hmx h GLU 43 N -0.34 0.00 0.00 1.25 5.08 -1.08 0.30 114.58 119.79 2hmx h GLU 43 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2hmx h GLU 43 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2hmx h GLU 43 CO 0.05 0.00 -1.15 0.54 -1.00 0.00 0.00 179.01 177.45 2hmx n ARG 44 N -3.12 0.12 0.35 2.33 1.74 -0.86 -1.41 116.66 115.81 2hmx n ARG 44 Ca -0.03 -0.03 -0.14 0.00 -0.77 0.00 0.00 57.85 56.88 2hmx n ARG 44 Cb 0.09 -1.51 -0.06 0.00 -1.02 0.00 0.00 32.46 29.96 2hmx n ARG 44 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 2hmx h PHE 45 N 0.00 -0.82 0.00 -1.55 0.04 0.18 -3.46 116.94 111.34 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 0.59 0.27 0.00 0.00 2.20 0.00 0.00 35.95 39.01 2hmx h PHE 45 CO 0.00 -0.51 0.00 0.00 -0.60 0.00 0.00 178.31 177.20 2hmx n ALA 46 N -2.48 0.36 -2.60 2.45 0.00 -0.87 -5.10 120.51 112.27 2hmx n ALA 46 Ca -0.11 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.05 2hmx n ALA 46 Cb 0.35 0.00 -0.09 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 1.13 0.10 0.00 1.01 -0.50 -5.00 120.40 117.14 2hmx s VAL 47 Ca 0.00 -2.00 0.10 0.00 0.00 0.00 0.00 61.98 60.08 2hmx s VAL 47 Cb 0.00 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 2hmx s VAL 47 CO 0.00 0.00 -0.26 0.21 0.00 0.00 0.00 175.10 175.05 2hmx s ASN 48 N -3.69 3.15 -0.01 3.32 3.84 -1.26 -4.20 114.94 116.09 2hmx s ASN 48 Ca 0.22 -0.70 -0.23 0.00 0.21 0.00 0.00 52.86 52.36 2hmx s ASN 48 Cb 0.05 -0.22 -0.13 0.00 -0.55 0.00 0.00 41.25 40.40 2hmx s ASN 48 CO 0.11 0.18 0.94 1.55 -2.79 0.00 0.00 177.10 177.09 2hmx h PRO 49 N 4.14 -0.77 0.00 0.43 0.13 -1.92 -2.39 132.00 131.62 2hmx h PRO 49 Ca -0.49 0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2hmx h PRO 49 Cb 1.16 0.18 -0.00 0.00 0.13 0.00 0.00 31.00 32.47 2hmx h PRO 49 CO 0.40 -0.51 -0.01 0.78 -0.23 0.00 0.00 178.00 178.43 2hmx h GLY 50 N -1.21 0.00 0.99 1.56 0.00 -1.93 0.59 103.07 103.06 2hmx h GLY 50 Ca -0.08 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.24 2hmx h GLY 50 CO 0.14 0.00 -0.04 -2.00 0.00 0.00 0.00 176.54 174.64 2hmx h LEU 51 N 0.00 -0.09 0.00 3.11 6.46 -1.90 -2.31 115.31 120.57 2hmx h LEU 51 Ca -0.00 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.75 2hmx h LEU 51 Cb 0.07 0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.02 2hmx h LEU 51 CO 0.00 -0.05 -0.67 0.25 -0.62 0.00 0.00 178.44 177.35 2hmx h LEU 52 N -0.12 0.00 -2.57 2.25 7.12 -0.88 -1.52 115.31 119.59 2hmx h LEU 52 Ca -0.01 -0.10 0.00 0.00 0.13 0.00 0.00 57.88 57.90 2hmx h LEU 52 Cb 0.09 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.22 2hmx h LEU 52 CO 0.02 0.05 0.00 -0.08 -0.13 0.00 0.00 178.44 178.30 2hmx h GLU 53 N 0.00 0.00 -6.03 1.25 4.22 0.58 -3.30 114.58 111.30 2hmx h GLU 53 Ca 0.00 0.00 -0.64 0.00 0.08 0.00 0.00 59.36 58.80 2hmx h GLU 53 Cb 0.87 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.05 2hmx h GLU 53 CO 0.00 0.00 -0.56 0.95 -2.18 0.00 0.00 179.01 177.22 2hmx s THR 54 N -4.54 4.92 0.54 0.32 -4.23 -0.60 -4.87 115.64 107.18 2hmx s THR 54 Ca -0.05 -0.53 0.23 0.00 -1.18 0.00 0.00 61.69 60.16 2hmx s THR 54 Cb 0.15 -3.35 0.35 0.00 1.34 0.00 0.00 72.50 70.98 2hmx s THR 54 CO 0.52 0.18 2.07 0.77 -0.54 0.00 0.00 174.62 177.63 2hmx h SER 55 N 3.40 0.00 -0.45 3.99 4.64 -1.82 0.24 113.55 123.57 2hmx h SER 55 Ca -0.47 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.84 2hmx h SER 55 Cb 1.17 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.24 2hmx h SER 55 CO 0.69 0.00 0.24 -0.33 -0.87 0.00 0.00 176.83 176.56 2hmx h GLU 56 N 0.00 0.62 0.11 4.77 4.39 -1.91 0.60 114.58 123.16 2hmx h GLU 56 Ca 0.13 -0.08 -0.32 0.00 0.34 0.00 0.00 59.36 59.43 2hmx h GLU 56 Cb 0.55 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 2hmx h GLU 56 CO -0.00 0.50 -1.71 0.78 -1.16 0.00 0.00 179.01 177.42 2hmx h GLY 57 N 0.58 0.26 2.00 -3.84 0.00 -0.75 0.82 103.07 102.13 2hmx h GLY 57 Ca 0.16 -0.66 -0.01 0.00 0.00 0.00 0.00 47.33 46.83 2hmx h GLY 57 CO -0.02 0.57 -0.02 0.00 0.00 0.00 0.00 176.54 177.07 2hmx h ARG 59 N 0.00 0.16 0.00 0.00 9.65 0.91 0.58 114.38 125.68 2hmx h ARG 59 Ca -0.00 -0.17 0.00 0.00 -1.10 0.00 0.00 59.98 58.71 2hmx h ARG 59 Cb 0.07 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.69 2hmx h ARG 59 CO 0.00 0.91 0.00 0.37 2.80 0.00 0.00 179.97 184.05 2hmx h GLN 60 N -0.52 0.00 0.00 0.20 5.75 0.18 -1.36 115.11 119.36 2hmx h GLN 60 Ca -0.03 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.46 2hmx h GLN 60 Cb 0.99 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.54 2hmx h GLN 60 CO 0.05 0.00 -0.44 0.82 -2.65 0.00 0.00 178.83 176.60 2hmx h ILE 61 N 0.00 0.07 0.00 2.39 1.08 0.33 -2.50 117.51 118.88 2hmx h ILE 61 Ca 0.00 -1.08 0.00 0.00 -0.39 0.00 0.00 64.86 63.39 2hmx h ILE 61 Cb 0.10 0.15 0.00 0.00 -3.07 0.00 0.00 36.82 34.01 2hmx h ILE 61 CO 0.00 0.02 0.00 0.25 -0.69 0.00 0.00 178.15 177.73 2hmx h LEU 62 N -1.00 0.00 0.04 1.44 5.85 0.21 0.98 115.31 122.83 2hmx h LEU 62 Ca -0.02 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 2hmx h LEU 62 Cb 0.45 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.48 2hmx h LEU 62 CO -0.01 0.00 -0.02 1.23 -0.34 0.00 0.00 178.44 179.30 2hmx h GLY 63 N 0.08 -0.06 2.00 3.75 0.00 -1.35 -2.50 103.07 104.99 2hmx h GLY 63 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2hmx h GLY 63 CO 0.00 -0.02 0.00 -1.61 0.00 0.00 0.00 176.54 174.91 2hmx h GLN 64 N -1.01 0.00 0.00 4.80 4.15 0.11 -3.29 115.11 119.87 2hmx h GLN 64 Ca -0.01 0.00 -0.34 0.00 0.77 0.00 0.00 58.65 59.08 2hmx h GLN 64 Cb 0.09 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.72 2hmx h GLN 64 CO 0.01 0.00 -2.27 -0.11 -1.93 0.00 0.00 178.83 174.53 2hmx n LEU 65 N -2.63 1.07 0.15 -2.39 7.94 0.21 -2.82 117.00 118.53 2hmx n LEU 65 Ca -0.01 -0.04 -0.14 0.00 -1.11 0.00 0.00 56.01 54.70 2hmx n LEU 65 Cb 0.10 -0.01 -0.08 0.00 0.53 0.00 0.00 43.42 43.97 2hmx n LEU 65 CO 0.16 0.61 0.77 -0.61 -1.11 0.00 0.00 177.39 177.22 2hmx h GLN 66 N 0.00 -0.30 -0.37 1.96 4.15 -1.51 0.96 115.11 120.01 2hmx h GLN 66 Ca -0.50 0.02 0.07 0.00 0.77 0.00 0.00 58.65 59.01 2hmx h GLN 66 Cb 2.01 0.07 -0.09 0.00 0.21 0.00 0.00 27.48 29.68 2hmx h GLN 66 CO -0.01 -0.17 -0.34 -1.35 -1.93 0.00 0.00 178.83 175.03 2hmx h PRO 67 N -0.35 -0.27 0.00 -2.39 0.11 -1.78 -2.06 132.00 125.26 2hmx h PRO 67 Ca -0.03 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2hmx h PRO 67 Cb 0.26 0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.44 2hmx h PRO 67 CO 0.05 -0.18 0.00 0.43 -0.21 0.00 0.00 178.00 178.09 2hmx n SER 68 N -5.42 0.00 0.09 -2.05 7.64 0.20 -1.61 113.62 112.47 2hmx n SER 68 Ca 0.00 -0.67 -0.16 0.00 1.01 0.00 0.00 58.87 59.05 2hmx n SER 68 Cb 0.34 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.44 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 0.54 -1.81 -3.43 3.38 0.14 0.84 115.31 114.96 2hmx h LEU 69 Ca 0.00 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.46 2hmx h LEU 69 Cb 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.58 2hmx h LEU 69 CO 0.00 1.35 0.00 0.06 0.09 0.00 0.00 178.44 179.94 2hmx h GLN 70 N 0.16 0.00 0.00 1.13 -0.00 -1.43 -2.25 115.11 112.71 2hmx h GLN 70 Ca -0.13 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.51 2hmx h GLN 70 Cb 1.83 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 29.31 2hmx h GLN 70 CO 0.20 0.00 -1.17 0.25 -0.00 0.00 0.00 178.83 178.11 2hmx n THR 71 N -2.50 0.03 0.00 1.86 -2.24 -0.51 -4.92 114.28 106.00 2hmx n THR 71 Ca -0.02 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2hmx n THR 71 Cb 0.06 0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 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 2.38 0.28 3.61 3.38 0.00 0.28 -5.08 105.19 110.03 2hmx n GLY 72 Ca -0.01 0.00 0.03 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 -0.01 0.35 1.61 1.04 -1.23 -4.80 113.70 109.66 2hmx s SER 73 Ca 0.00 -0.04 0.24 0.00 0.48 0.00 0.00 55.95 56.63 2hmx s SER 73 Cb 0.00 0.04 1.28 0.00 0.10 0.00 0.00 66.02 67.44 2hmx s SER 73 CO 0.00 -0.08 1.73 -0.33 0.98 0.00 0.00 173.24 175.54 2hmx h GLU 74 N 2.00 0.00 0.07 4.02 4.39 -1.99 0.39 114.58 123.46 2hmx h GLU 74 Ca -0.32 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.14 2hmx h GLU 74 Cb 1.19 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.83 2hmx h GLU 74 CO 0.30 0.00 -1.13 0.93 -1.16 0.00 0.00 179.01 177.94 2hmx h GLU 75 N 0.00 0.14 0.00 2.33 3.07 -1.97 0.02 114.58 118.16 2hmx h GLU 75 Ca 0.00 -0.24 -0.04 0.00 -0.50 0.00 0.00 59.36 58.58 2hmx h GLU 75 Cb 0.02 0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.01 2hmx h GLU 75 CO 0.00 1.11 -0.20 1.25 -1.40 0.00 0.00 179.01 179.77 2hmx h LEU 76 N 0.04 0.00 -0.28 1.33 6.46 -0.61 -2.03 115.31 120.22 2hmx h LEU 76 Ca -0.08 0.00 -0.13 0.00 -0.12 0.00 0.00 57.88 57.55 2hmx h LEU 76 Cb 1.88 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.80 2hmx h LEU 76 CO 0.17 0.20 -0.33 -0.09 -0.62 0.00 0.00 178.44 177.77 2hmx h ARG 77 N 0.00 0.71 -0.24 1.25 1.12 0.51 0.57 114.38 118.31 2hmx h ARG 77 Ca -0.00 -0.40 -0.08 0.00 -1.11 0.00 0.00 59.98 58.39 2hmx h ARG 77 Cb 0.56 0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 30.53 2hmx h ARG 77 CO 0.03 1.02 -0.21 1.03 -3.11 0.00 0.00 179.97 178.72 2hmx h SER 78 N 0.45 0.42 -0.17 -3.80 0.87 -1.37 0.21 113.55 110.16 2hmx h SER 78 Ca 0.04 -0.13 -0.01 0.00 -1.23 0.00 0.00 61.79 60.45 2hmx h SER 78 Cb 0.91 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.75 2hmx h SER 78 CO 0.08 0.65 0.08 0.25 -0.53 0.00 0.00 176.83 177.35 2hmx h LEU 79 N 0.39 0.27 0.00 2.23 5.85 -1.16 -2.29 115.31 120.60 2hmx h LEU 79 Ca 0.06 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 2hmx h LEU 79 Cb 0.59 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 2hmx h LEU 79 CO 0.04 0.26 -0.00 0.22 -0.34 0.00 0.00 178.44 178.62 2hmx h TYR 80 N 0.31 0.00 -0.12 1.25 3.20 0.24 0.24 116.97 122.09 2hmx h TYR 80 Ca 0.08 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.88 2hmx h TYR 80 Cb 0.09 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 2hmx h TYR 80 CO 0.00 0.63 -0.21 -2.95 -1.64 0.00 0.00 178.16 173.99 2hmx h ASN 81 N -1.00 0.20 0.65 -2.11 7.08 -0.76 0.57 115.58 120.21 2hmx h ASN 81 Ca -0.00 -0.05 0.00 0.00 -3.08 0.00 0.00 56.30 53.17 2hmx h ASN 81 Cb 0.63 -0.05 0.00 0.00 -2.08 0.00 0.00 38.32 36.82 2hmx h ASN 81 CO -0.00 0.43 -0.71 0.41 -2.08 0.00 0.00 177.43 175.48 2hmx n THR 82 N -4.21 0.21 0.08 6.14 -1.04 -0.86 -0.56 114.28 114.04 2hmx n THR 82 Ca -0.01 -0.19 -0.09 0.00 -2.04 0.00 0.00 64.05 61.71 2hmx n THR 82 Cb 0.32 0.07 -0.06 0.00 -1.82 0.00 0.00 70.33 68.84 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 0.00 0.56 -0.07 12.58 1.08 -0.18 -2.04 117.51 129.44 2hmx h ILE 83 Ca 0.00 -0.99 -0.01 0.00 -0.39 0.00 0.00 64.86 63.47 2hmx h ILE 83 Cb 0.68 0.95 -0.01 0.00 -3.07 0.00 0.00 36.82 35.37 2hmx h ILE 83 CO 0.00 0.15 -0.02 0.00 -0.69 0.00 0.00 178.15 177.59 2hmx h ALA 84 N -0.59 1.84 0.77 1.87 0.00 0.33 0.73 119.26 124.22 2hmx h ALA 84 Ca -0.03 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2hmx h ALA 84 Cb 0.47 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.23 2hmx h ALA 84 CO 0.05 0.12 -0.37 0.28 0.00 0.00 0.00 179.25 179.33 2hmx h VAL 85 N 0.09 0.00 0.00 0.00 2.07 -0.95 0.30 116.25 117.77 2hmx h VAL 85 Ca 0.02 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2hmx h VAL 85 Cb 0.10 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.87 2hmx h VAL 85 CO 0.00 0.00 0.03 0.25 0.02 0.00 0.00 177.57 177.87 2hmx h LEU 86 N -1.07 0.00 0.05 2.57 5.85 0.87 0.99 115.31 124.56 2hmx h LEU 86 Ca -0.11 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.49 2hmx h LEU 86 Cb 0.79 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.83 2hmx h LEU 86 CO 0.17 0.00 -0.50 0.22 -0.34 0.00 0.00 178.44 177.99 2hmx h TYR 87 N 0.00 0.42 -0.14 1.25 5.03 0.12 0.39 116.97 124.03 2hmx h TYR 87 Ca 0.00 -0.26 0.04 0.00 2.58 0.00 0.00 58.73 61.09 2hmx h TYR 87 Cb 0.06 -0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.30 2hmx h TYR 87 CO 0.00 1.12 0.13 0.00 -1.32 0.00 0.00 178.16 178.09 2hmx h VAL 89 N 0.00 1.08 -0.30 0.00 2.07 0.46 0.20 116.25 119.76 2hmx h VAL 89 Ca 0.07 -2.27 -0.03 0.00 0.82 0.00 0.00 66.70 65.29 2hmx h VAL 89 Cb 0.32 2.56 -0.02 0.00 -1.52 0.00 0.00 31.29 32.64 2hmx h VAL 89 CO -0.00 0.49 0.06 0.45 0.02 0.00 0.00 177.57 178.59 2hmx h HIS 90 N -0.77 0.44 0.56 1.57 3.86 0.04 -0.72 115.15 120.14 2hmx h HIS 90 Ca -0.28 -0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 58.88 2hmx h HIS 90 Cb 1.41 -0.14 0.01 0.00 1.06 0.00 0.00 27.41 29.75 2hmx h HIS 90 CO 0.14 0.40 -0.27 0.37 0.86 0.00 0.00 177.93 179.43 2hmx h GLN 91 N 0.43 -0.73 0.00 2.45 -0.00 -1.19 -3.46 115.11 112.61 2hmx h GLN 91 Ca 0.10 0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.80 2hmx h GLN 91 Cb 0.20 0.17 0.00 0.00 0.00 0.00 0.00 27.48 27.84 2hmx h GLN 91 CO -0.00 -0.49 0.00 -2.13 0.00 0.00 0.00 178.83 176.21 2hmx n ARG 92 N -4.09 0.00 -1.49 1.69 0.00 -0.28 -5.12 116.66 107.37 2hmx n ARG 92 Ca -0.09 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.41 2hmx n ARG 92 Cb 0.30 0.00 0.09 0.00 0.00 0.00 0.00 32.46 32.85 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 2.24 0.04 5.15 1.09 0.69 -4.93 121.20 125.47 2hmx s ILE 93 Ca 0.00 0.12 0.01 0.00 -1.10 0.00 0.00 60.65 59.69 2hmx s ILE 93 Cb 0.00 -2.77 -0.02 0.00 -1.06 0.00 0.00 42.46 38.60 2hmx s ILE 93 CO 0.00 -0.06 -0.06 -1.81 -0.10 0.00 0.00 174.94 172.92 2hmx s ASP 94 N -1.89 0.63 0.41 3.58 1.01 -1.26 -3.24 116.67 115.91 2hmx s ASP 94 Ca 0.76 -0.58 0.03 0.00 0.71 0.00 0.00 52.55 53.47 2hmx s ASP 94 Cb -0.31 0.07 -0.03 0.00 1.01 0.00 0.00 42.92 43.66 2hmx s ASP 94 CO 0.44 -0.27 0.10 0.68 0.21 0.00 0.00 175.17 176.33 2hmx s VAL 95 N -1.66 0.78 -0.04 -1.27 -7.23 -1.26 -5.03 120.40 104.69 2hmx s VAL 95 Ca -0.10 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.05 2hmx s VAL 95 Cb -0.08 -2.39 -0.02 0.00 0.56 0.00 0.00 36.38 34.45 2hmx s VAL 95 CO -0.01 0.00 -0.05 0.29 -0.31 0.00 0.00 175.10 175.03 2hmx n LYS 96 N -0.93 0.08 -4.60 4.82 4.01 -1.26 -4.83 118.16 115.45 2hmx n LYS 96 Ca -0.07 0.03 -0.27 0.00 -0.51 0.00 0.00 58.31 57.49 2hmx n LYS 96 Cb 0.65 -0.68 -0.10 0.00 -0.51 0.00 0.00 35.03 34.40 2hmx n LYS 96 CO 0.00 0.00 0.00 0.16 -1.11 0.00 0.00 177.40 176.45 2hmx s ASP 97 N -5.22 3.40 0.14 4.39 -4.77 -1.26 -0.21 116.67 113.14 2hmx s ASP 97 Ca -0.05 -1.48 -0.18 0.00 -3.30 0.00 0.00 52.55 47.54 2hmx s ASP 97 Cb 0.02 0.02 -0.02 0.00 -1.09 0.00 0.00 42.92 41.84 2hmx s ASP 97 CO 0.07 -0.65 1.78 0.74 0.70 0.00 0.00 175.17 177.81 2hmx h THR 98 N 1.76 1.03 0.00 2.11 2.02 -1.65 -1.99 112.91 116.19 2hmx h THR 98 Ca -0.42 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 66.64 2hmx h THR 98 Cb 1.26 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 68.35 2hmx h THR 98 CO 0.73 0.06 -0.06 0.50 0.37 0.00 0.00 175.52 177.12 2hmx h LYS 99 N 0.32 0.00 0.15 6.66 3.64 -1.96 0.62 116.57 125.99 2hmx h LYS 99 Ca 0.11 0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 59.19 2hmx h LYS 99 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 2hmx h LYS 99 CO -0.05 0.06 -1.49 0.93 -2.27 0.00 0.00 179.45 176.63 2hmx h GLU 100 N 0.00 0.31 0.74 1.90 5.08 -1.79 -1.17 114.58 119.65 2hmx h GLU 100 Ca -0.00 -0.53 -0.04 0.00 -1.00 0.00 0.00 59.36 57.80 2hmx h GLU 100 Cb 0.14 0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.60 2hmx h GLU 100 CO 0.01 1.25 -0.36 0.00 -1.00 0.00 0.00 179.01 178.92 2hmx h ALA 101 N 0.02 -0.99 0.00 3.43 0.00 -0.90 -1.51 119.26 119.31 2hmx h ALA 101 Ca -0.31 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2hmx h ALA 101 Cb 1.88 0.38 0.00 0.00 0.00 0.00 0.00 17.79 20.05 2hmx h ALA 101 CO 0.11 -1.02 0.00 1.25 0.00 0.00 0.00 179.25 179.59 2hmx h LEU 102 N -1.07 0.00 0.00 0.00 5.85 0.24 0.99 115.31 121.32 2hmx h LEU 102 Ca -0.10 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.62 2hmx h LEU 102 Cb 0.78 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.81 2hmx h LEU 102 CO 0.17 0.00 -0.00 -0.78 -0.34 0.00 0.00 178.44 177.48 2hmx h ASP 103 N 0.00 -0.00 0.02 1.25 3.58 -1.17 -2.41 116.42 117.68 2hmx h ASP 103 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2hmx h ASP 103 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2hmx h ASP 103 CO 0.00 0.35 0.00 1.17 -2.88 0.00 0.00 179.24 177.88 2hmx n LYS 104 N -3.95 0.00 -0.11 0.28 0.00 0.28 0.60 118.16 115.27 2hmx n LYS 104 Ca -0.00 0.40 -0.20 0.00 0.00 0.00 0.00 58.31 58.51 2hmx n LYS 104 Cb 0.00 -1.50 -0.09 0.00 0.00 0.00 0.00 35.03 33.44 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 -1.41 1.51 -0.16 3.15 2.08 0.20 -2.24 119.36 122.50 2hmx n ILE 105 Ca 0.00 -0.05 -0.09 0.00 0.56 0.00 0.00 62.75 63.17 2hmx n ILE 105 Cb 0.01 -2.09 0.00 0.00 -0.75 0.00 0.00 39.64 36.81 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 -1.00 0.71 0.00 0.38 4.57 -0.41 0.21 114.58 119.03 2hmx h GLU 106 Ca -0.34 -0.15 -0.04 0.00 -1.18 0.00 0.00 59.36 57.65 2hmx h GLU 106 Cb 1.21 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.69 2hmx h GLU 106 CO -0.21 0.67 -0.18 1.49 -1.18 0.00 0.00 179.01 179.60 2hmx h GLU 107 N 0.60 0.00 0.00 1.92 4.57 -0.00 -3.44 114.58 118.23 2hmx h GLU 107 Ca 0.15 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 2hmx h GLU 107 Cb 0.25 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.84 2hmx h GLU 107 CO -0.01 0.18 0.00 0.39 -1.18 0.00 0.00 179.01 178.39 2hmx n GLU 108 N -3.18 0.00 -0.67 1.92 -0.58 -0.88 -4.96 120.64 112.29 2hmx n GLU 108 Ca 0.02 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.47 2hmx n GLU 108 Cb 0.55 0.00 0.21 0.00 -0.57 0.00 0.00 31.44 31.63 2hmx n GLU 108 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2hmx s GLN 109 N -0.92 0.07 0.00 3.49 1.11 0.01 -2.46 119.66 120.95 2hmx s GLN 109 Ca 0.00 1.13 0.00 0.00 0.01 0.00 0.00 55.36 56.50 2hmx s GLN 109 Cb 0.00 -1.65 0.00 0.00 -1.01 0.00 0.00 33.01 30.35 2hmx s GLN 109 CO 0.00 -3.15 0.00 -1.71 0.01 0.00 0.00 175.29 170.44 2hmx n ASN 110 N -4.55 0.00 -2.33 5.90 5.15 -1.26 -4.43 115.26 113.74 2hmx n ASN 110 Ca 0.07 0.00 -0.04 0.00 -0.60 0.00 0.00 54.58 54.00 2hmx n ASN 110 Cb 0.53 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.75 2hmx n ASN 110 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2hmx n LYS 111 N 0.00 -3.54 0.00 1.20 5.02 -1.03 -5.06 118.16 114.75 2hmx n LYS 111 Ca 0.00 2.78 0.00 0.00 -2.02 0.00 0.00 58.31 59.07 2hmx n LYS 111 Cb 0.00 -4.13 0.00 0.00 -0.02 0.00 0.00 35.03 30.88 2hmx n LYS 111 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2hmx n SER 112 N 1.30 0.00 -2.32 4.39 3.41 -1.26 -5.04 113.62 114.10 2hmx n SER 112 Ca -0.33 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.09 2hmx n SER 112 Cb 0.51 0.16 -0.02 0.00 -0.26 0.00 0.00 64.21 64.60 2hmx n SER 112 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 2hmx n LYS 113 N -1.47 -1.74 -0.00 4.33 2.85 -1.26 -4.71 118.16 116.16 2hmx n LYS 113 Ca 0.00 0.96 0.00 0.00 -1.05 0.00 0.00 58.31 58.23 2hmx n LYS 113 Cb 0.00 -5.59 -0.00 0.00 -0.65 0.00 0.00 35.03 28.79 2hmx n LYS 113 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 2hmx n LYS 114 N -2.90 0.73 0.00 -1.58 0.00 -1.26 -4.87 118.16 108.28 2hmx n LYS 114 Ca -0.23 -0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.08 2hmx n LYS 114 Cb 0.67 -0.96 0.00 0.00 0.00 0.00 0.00 35.03 34.74 2hmx n LYS 114 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2hmx n LYS 115 N -1.47 0.00 -3.20 1.64 4.01 -1.26 -4.95 118.16 112.94 2hmx n LYS 115 Ca -0.00 0.25 -0.22 0.00 -0.51 0.00 0.00 58.31 57.83 2hmx n LYS 115 Cb 0.01 -0.71 0.05 0.00 -0.51 0.00 0.00 35.03 33.87 2hmx n LYS 115 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2hmx n ALA 116 N -1.61 -1.04 -2.40 7.82 0.00 -1.26 -2.58 120.51 119.44 2hmx n ALA 116 Ca 0.00 0.32 -0.11 0.00 0.00 0.00 0.00 53.44 53.65 2hmx n ALA 116 Cb 0.00 -4.32 0.01 0.00 0.00 0.00 0.00 19.45 15.13 2hmx n ALA 116 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2hmx n GLN 117 N -4.19 -1.58 0.00 0.00 7.27 -1.26 -4.60 117.38 113.02 2hmx n GLN 117 Ca -0.06 0.47 0.00 0.00 0.07 0.00 0.00 57.00 57.49 2hmx n GLN 117 Cb 0.59 -4.47 0.00 0.00 2.41 0.00 0.00 30.24 28.77 2hmx n GLN 117 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 2hmx n GLN 118 N -2.16 0.00 0.00 3.69 3.00 -1.07 -2.32 117.38 118.52 2hmx n GLN 118 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.90 2hmx n GLN 118 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.82 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 2.74 1.47 -2.56 -1.58 0.00 -1.26 -5.07 120.51 114.25 2hmx n ALA 119 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2hmx n ALA 119 Cb 0.00 0.11 -0.02 0.00 0.00 0.00 0.00 19.45 19.54 2hmx n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hmx n ALA 120 N -1.24 -3.56 -0.07 0.00 0.00 -0.98 -5.02 120.51 109.64 2hmx n ALA 120 Ca 0.00 1.32 -0.05 0.00 0.00 0.00 0.00 53.44 54.71 2hmx n ALA 120 Cb 0.21 -2.60 -0.02 0.00 0.00 0.00 0.00 19.45 17.05 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 1.09 0.48 0.00 0.00 0.00 -1.26 -4.95 120.51 115.86 2hmx n ALA 121 Ca -0.19 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.79 2hmx n ALA 121 Cb 0.29 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.76 2hmx n ALA 121 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2hmx n ASP 122 N -4.45 0.00 -0.07 0.00 8.00 -1.26 -4.91 116.55 113.86 2hmx n ASP 122 Ca -0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.42 2hmx n ASP 122 Cb 0.28 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 2hmx n ASP 122 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2hmx n THR 123 N 0.00 0.00 -3.83 -3.53 -2.24 -1.26 -4.91 114.28 98.50 2hmx n THR 123 Ca 0.00 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.56 2hmx n THR 123 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2hmx n THR 123 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2hmx n GLY 124 N 0.00 2.81 0.00 3.38 0.00 -1.26 -5.11 105.19 105.01 2hmx n GLY 124 Ca 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 46.02 43.74 2hmx n GLY 124 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2hmx n ASN 125 N -1.85 0.00 0.00 1.61 4.13 -1.26 -4.93 115.26 112.96 2hmx n ASN 125 Ca -0.02 0.02 0.00 0.00 1.68 0.00 0.00 54.58 56.26 2hmx n ASN 125 Cb 0.52 -0.16 0.00 0.00 -1.54 0.00 0.00 39.78 38.60 2hmx n ASN 125 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2hmx n ASN 126 N -1.70 0.00 -2.17 6.41 5.03 -1.26 -4.79 115.26 116.77 2hmx n ASN 126 Ca 0.00 0.00 -0.02 0.00 0.87 0.00 0.00 54.58 55.43 2hmx n ASN 126 Cb 0.00 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 38.74 2hmx n ASN 126 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 2hmx n SER 127 N 2.30 -3.70 0.00 6.41 2.88 -1.26 -5.00 113.62 115.25 2hmx n SER 127 Ca 0.00 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.70 2hmx n SER 127 Cb 0.00 -4.14 0.00 0.00 -0.75 0.00 0.00 64.21 59.32 2hmx n SER 127 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2hmx n GLN 128 N 1.30 0.00 0.00 -1.46 1.13 -1.26 -4.96 117.38 112.13 2hmx n GLN 128 Ca -0.18 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.88 2hmx n GLN 128 Cb 0.28 -0.57 0.00 0.00 0.11 0.00 0.00 30.24 30.06 2hmx n GLN 128 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 2hmx n VAL 129 N -0.25 0.00 -1.85 5.09 0.24 -1.26 -5.01 118.33 115.29 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 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 2hmx n VAL 129 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2hmx n SER 130 N -3.02 -7.37 -1.10 -1.34 2.88 -1.26 -5.10 113.62 97.31 2hmx n SER 130 Ca 0.00 1.22 0.00 0.00 -1.33 0.00 0.00 58.87 58.76 2hmx n SER 130 Cb 0.00 -4.04 0.00 0.00 -0.75 0.00 0.00 64.21 59.42 2hmx n SER 130 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2hmx n GLN 131 N 1.36 2.12 -0.71 -1.46 0.00 -1.26 -5.10 117.38 112.32 2hmx n GLN 131 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 57.00 57.10 2hmx n GLN 131 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 30.24 30.22 2hmx n GLN 131 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2hmx n ASN 132 N -0.91 -4.65 0.00 2.61 3.02 -1.26 -5.35 115.26 108.72 2hmx n ASN 132 Ca 0.00 0.77 0.00 0.00 -0.03 0.00 0.00 54.58 55.32 2hmx n ASN 132 Cb 0.00 -2.15 0.00 0.00 -0.61 0.00 0.00 39.78 37.02 2hmx n ASN 132 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64