#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hm2 n GLN 4 N 0.00 0.70 -0.16 1.61 7.27 -1.26 -3.50 117.38 122.04 3hm2 n GLN 4 Ca 0.00 -0.14 -0.10 0.00 0.07 0.00 0.00 57.00 56.83 3hm2 n GLN 4 Cb 0.00 -1.46 -0.00 0.00 2.41 0.00 0.00 30.24 31.19 3hm2 n GLN 4 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 3hm2 h LEU 5 N 0.00 0.85 -1.26 1.69 3.38 -2.04 -0.94 115.31 116.99 3hm2 h LEU 5 Ca -0.11 -0.34 0.05 0.00 0.09 0.00 0.00 57.88 57.57 3hm2 h LEU 5 Cb 1.16 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.63 3hm2 h LEU 5 CO 0.01 0.99 0.52 0.71 0.09 0.00 0.00 178.44 180.76 3hm2 h THR 6 N 0.70 1.09 0.14 0.22 1.35 -1.96 -1.07 112.91 113.38 3hm2 h THR 6 Ca 0.12 -0.32 -0.00 0.00 -0.55 0.00 0.00 66.41 65.66 3hm2 h THR 6 Cb 0.59 0.08 -0.00 0.00 -1.73 0.00 0.00 68.15 67.08 3hm2 h THR 6 CO 0.04 0.17 -0.10 0.50 -0.25 0.00 0.00 175.52 175.88 3hm2 h LYS 7 N 0.93 -0.23 0.69 4.72 3.11 -1.50 -2.10 116.57 122.20 3hm2 h LYS 7 Ca 0.33 0.02 -0.03 0.00 -2.81 0.00 0.00 60.65 58.16 3hm2 h LYS 7 Cb 0.12 0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.40 3hm2 h LYS 7 CO -0.10 -0.15 -0.49 0.37 -2.81 0.00 0.00 179.45 176.27 3hm2 h GLN 8 N -0.24 -1.08 -0.58 1.90 4.15 -0.96 -3.11 115.11 115.20 3hm2 h GLN 8 Ca -0.01 0.07 0.02 0.00 0.77 0.00 0.00 58.65 59.51 3hm2 h GLN 8 Cb 0.20 0.25 -0.03 0.00 0.21 0.00 0.00 27.48 28.11 3hm2 h GLN 8 CO 0.00 -0.72 0.38 0.45 -1.93 0.00 0.00 178.83 177.01 3hm2 h HIS 9 N -1.12 0.67 -0.26 3.99 3.86 -1.14 -2.64 115.15 118.51 3hm2 h HIS 9 Ca -0.09 0.02 -0.18 0.00 -1.16 0.00 0.00 60.37 58.96 3hm2 h HIS 9 Cb 0.92 -0.23 -0.00 0.00 1.06 0.00 0.00 27.41 29.17 3hm2 h HIS 9 CO -0.15 0.40 -0.55 0.28 0.86 0.00 0.00 177.93 178.78 3hm2 h VAL 10 N 0.71 1.29 -0.54 2.45 2.07 -1.42 -2.92 116.25 117.88 3hm2 h VAL 10 Ca 0.22 -1.75 -0.03 0.00 0.82 0.00 0.00 66.70 65.97 3hm2 h VAL 10 Cb 0.03 1.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 3hm2 h VAL 10 CO -0.06 0.56 0.22 0.03 0.02 0.00 0.00 177.57 178.35 3hm2 h ARG 11 N 0.61 0.81 0.12 1.57 3.08 -1.40 -1.07 114.38 118.10 3hm2 h ARG 11 Ca 0.01 -0.14 0.02 0.00 0.07 0.00 0.00 59.98 59.94 3hm2 h ARG 11 Cb 1.14 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 31.02 3hm2 h ARG 11 CO 0.12 0.70 -0.28 0.00 -1.07 0.00 0.00 179.97 179.44 3hm2 h ALA 12 N 1.07 -0.47 -0.59 0.04 0.00 -1.46 1.56 119.26 119.40 3hm2 h ALA 12 Ca 0.18 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.13 3hm2 h ALA 12 Cb 0.19 0.45 -0.07 0.00 0.00 0.00 0.00 17.79 18.36 3hm2 h ALA 12 CO -0.02 -0.82 0.24 -0.07 0.00 0.00 0.00 179.25 178.59 3hm2 h LEU 13 N -0.49 0.26 -0.35 0.00 3.38 -1.50 1.86 115.31 118.47 3hm2 h LEU 13 Ca 0.03 0.07 0.06 0.00 0.09 0.00 0.00 57.88 58.13 3hm2 h LEU 13 Cb 0.52 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.25 3hm2 h LEU 13 CO -0.16 0.16 0.02 0.00 0.09 0.00 0.00 178.44 178.56 3hm2 h ALA 14 N 1.39 0.34 -0.07 1.53 0.00 0.10 0.87 119.26 123.41 3hm2 h ALA 14 Ca 0.29 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.27 3hm2 h ALA 14 Cb 0.33 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 3hm2 h ALA 14 CO -0.28 -0.38 -0.04 0.82 0.00 0.00 0.00 179.25 179.38 3hm2 h ILE 15 N 0.13 1.33 -0.82 0.00 1.08 0.59 -0.26 117.51 119.56 3hm2 h ILE 15 Ca 0.17 -1.06 0.07 0.00 -0.39 0.00 0.00 64.86 63.66 3hm2 h ILE 15 Cb 0.22 1.89 -0.10 0.00 -3.07 0.00 0.00 36.82 35.77 3hm2 h ILE 15 CO -0.27 0.29 -0.48 -0.24 -0.69 0.00 0.00 178.15 176.76 3hm2 n SER 16 N -4.77 -0.86 -0.08 1.72 2.88 0.60 -2.53 113.62 110.57 3hm2 n SER 16 Ca -0.07 1.50 -0.07 0.00 -1.33 0.00 0.00 58.87 58.90 3hm2 n SER 16 Cb 0.26 -0.21 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 3hm2 n SER 16 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hm2 h ALA 17 N 0.36 0.27 -0.69 -1.46 0.00 -0.25 -3.02 119.26 114.47 3hm2 h ALA 17 Ca 0.13 0.08 0.08 0.00 0.00 0.00 0.00 54.91 55.20 3hm2 h ALA 17 Cb 0.33 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 3hm2 h ALA 17 CO -0.77 -0.40 0.46 -0.07 0.00 0.00 0.00 179.25 178.47 3hm2 h LEU 18 N 0.09 0.57 -2.42 0.00 3.38 -0.77 -3.47 115.31 112.70 3hm2 h LEU 18 Ca 0.14 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 3hm2 h LEU 18 Cb 0.19 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3hm2 h LEU 18 CO -0.24 0.36 -0.19 0.00 0.09 0.00 0.00 178.44 178.46 3hm2 n ALA 19 N -2.47 -2.64 -2.57 1.53 0.00 -1.14 -4.97 120.51 108.24 3hm2 n ALA 19 Ca 0.11 0.30 -0.42 0.00 0.00 0.00 0.00 53.44 53.42 3hm2 n ALA 19 Cb 0.29 -2.07 -0.03 0.00 0.00 0.00 0.00 19.45 17.63 3hm2 n ALA 19 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3hm2 s PRO 20 N -2.97 4.44 0.39 0.00 0.02 -1.26 -5.06 135.00 130.56 3hm2 s PRO 20 Ca 0.07 1.56 0.01 0.00 0.02 0.00 0.00 61.00 62.66 3hm2 s PRO 20 Cb -0.02 -3.48 -0.00 0.00 0.02 0.00 0.00 34.50 31.01 3hm2 s PRO 20 CO 0.76 -0.27 0.05 1.63 -0.33 0.00 0.00 177.00 178.84 3hm2 n LYS 21 N 4.55 0.85 -1.84 5.54 5.02 -1.26 -5.06 118.16 125.95 3hm2 n LYS 21 Ca 0.09 -2.99 -0.40 0.00 -2.02 0.00 0.00 58.31 52.98 3hm2 n LYS 21 Cb 0.48 1.10 0.00 0.00 -0.02 0.00 0.00 35.03 36.60 3hm2 n LYS 21 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 3hm2 s PRO 22 N -3.43 3.96 -1.38 1.97 0.02 -1.26 -3.79 135.00 131.08 3hm2 s PRO 22 Ca 0.07 2.46 -0.00 0.00 0.02 0.00 0.00 61.00 63.54 3hm2 s PRO 22 Cb 0.00 -2.84 0.00 0.00 0.02 0.00 0.00 34.50 31.68 3hm2 s PRO 22 CO 0.05 -0.61 0.01 0.72 -0.33 0.00 0.00 177.00 176.83 3hm2 n HIS 23 N 0.21 -0.78 -4.16 6.54 8.25 -0.85 -5.01 115.22 119.43 3hm2 n HIS 23 Ca 0.03 0.01 -0.28 0.00 -0.26 0.00 0.00 57.72 57.21 3hm2 n HIS 23 Cb 0.41 -3.31 -0.08 0.00 1.12 0.00 0.00 29.99 28.13 3hm2 n HIS 23 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 3hm2 s GLU 24 N -4.82 2.52 -0.13 -0.41 2.02 -1.25 -4.98 118.70 111.65 3hm2 s GLU 24 Ca 0.00 -0.96 0.01 0.00 0.02 0.00 0.00 54.97 54.04 3hm2 s GLU 24 Cb -0.00 -2.47 -0.01 0.00 0.10 0.00 0.00 34.13 31.75 3hm2 s GLU 24 CO 0.01 0.49 -0.17 0.99 0.02 0.00 0.00 175.26 176.60 3hm2 s THR 25 N -1.55 2.63 -0.23 3.63 2.01 -1.26 -1.67 115.64 119.21 3hm2 s THR 25 Ca 0.27 -0.80 -0.07 0.00 0.31 0.00 0.00 61.69 61.39 3hm2 s THR 25 Cb -0.10 -2.08 -0.03 0.00 0.01 0.00 0.00 72.50 70.29 3hm2 s THR 25 CO 0.19 0.53 0.07 -0.22 -0.69 0.00 0.00 174.62 174.51 3hm2 s LEU 26 N 0.50 3.58 -0.18 4.42 2.96 0.66 -1.17 118.68 129.45 3hm2 s LEU 26 Ca -0.11 -0.11 -0.26 0.00 -0.22 0.00 0.00 54.13 53.43 3hm2 s LEU 26 Cb -0.16 -1.95 -0.01 0.00 0.50 0.00 0.00 46.19 44.57 3hm2 s LEU 26 CO 0.05 0.03 0.87 0.26 -1.32 0.00 0.00 176.35 176.23 3hm2 s TRP 27 N 1.24 3.41 -0.38 5.38 0.52 -0.65 0.67 118.94 129.13 3hm2 s TRP 27 Ca 0.05 1.29 -0.02 0.00 0.02 0.00 0.00 56.10 57.44 3hm2 s TRP 27 Cb -0.14 -3.06 0.09 0.00 -1.15 0.00 0.00 33.47 29.21 3hm2 s TRP 27 CO 0.04 -0.29 0.14 0.34 0.02 0.00 0.00 176.95 177.20 3hm2 s ASP 28 N 1.18 5.13 -0.16 2.95 2.15 -0.02 0.44 116.67 128.33 3hm2 s ASP 28 Ca 0.39 -1.86 -0.01 0.00 0.43 0.00 0.00 52.55 51.50 3hm2 s ASP 28 Cb -0.16 -1.78 -0.01 0.00 -0.30 0.00 0.00 42.92 40.66 3hm2 s ASP 28 CO 0.11 -0.46 -0.10 -0.63 -0.17 0.00 0.00 175.17 173.92 3hm2 s ILE 29 N 1.15 3.13 0.00 4.11 1.09 0.78 -3.13 121.20 128.32 3hm2 s ILE 29 Ca 0.05 -0.61 0.00 0.00 -1.10 0.00 0.00 60.65 58.99 3hm2 s ILE 29 Cb -0.22 -2.35 0.00 0.00 -1.06 0.00 0.00 42.46 38.83 3hm2 s ILE 29 CO -0.04 0.49 0.00 0.61 -0.10 0.00 0.00 174.94 175.91 3hm2 n GLY 30 N 3.97 0.96 3.58 6.18 0.00 -1.26 -2.87 105.19 115.74 3hm2 n GLY 30 Ca -0.18 -1.57 -0.58 0.00 0.00 0.00 0.00 46.02 43.68 3hm2 n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hm2 n GLY 31 N 0.00 0.50 3.55 -0.02 0.00 -1.26 0.33 105.19 108.28 3hm2 n GLY 31 Ca 0.00 0.98 -0.19 0.00 0.00 0.00 0.00 46.02 46.81 3hm2 n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hm2 n GLY 32 N 5.27 -0.37 3.66 -0.02 0.00 -1.26 -4.65 105.19 107.83 3hm2 n GLY 32 Ca 0.35 0.14 -0.52 0.00 0.00 0.00 0.00 46.02 45.99 3hm2 n GLY 32 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3hm2 n SER 33 N -3.09 2.94 0.00 1.61 2.88 0.15 -3.16 113.62 114.94 3hm2 n SER 33 Ca -0.28 0.93 0.00 0.00 -1.33 0.00 0.00 58.87 58.18 3hm2 n SER 33 Cb 0.67 -1.28 0.00 0.00 -0.75 0.00 0.00 64.21 62.85 3hm2 n SER 33 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hm2 n GLY 34 N 4.63 3.42 0.23 0.46 0.00 -1.26 -4.91 105.19 107.76 3hm2 n GLY 34 Ca 0.26 -0.63 -0.06 0.00 0.00 0.00 0.00 46.02 45.60 3hm2 n GLY 34 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3hm2 h SER 35 N 2.00 0.59 -0.04 1.61 0.02 -1.92 0.64 113.55 116.45 3hm2 h SER 35 Ca 0.00 -0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.70 3hm2 h SER 35 Cb 0.00 -0.13 0.02 0.00 0.14 0.00 0.00 62.40 62.42 3hm2 h SER 35 CO 0.00 0.42 -0.95 0.40 -1.14 0.00 0.00 176.83 175.56 3hm2 h ILE 36 N 0.71 1.29 -0.07 3.27 2.04 -1.94 -2.86 117.51 119.95 3hm2 h ILE 36 Ca 0.22 -2.16 0.04 0.00 1.00 0.00 0.00 64.86 63.96 3hm2 h ILE 36 Cb -0.02 2.29 -0.05 0.00 -0.74 0.00 0.00 36.82 38.30 3hm2 h ILE 36 CO -0.08 0.67 -0.23 0.00 0.00 0.00 0.00 178.15 178.52 3hm2 h ALA 37 N 0.43 -0.24 -0.91 1.87 0.00 -1.84 0.30 119.26 118.86 3hm2 h ALA 37 Ca -0.11 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.86 3hm2 h ALA 37 Cb 1.60 0.43 -0.05 0.00 0.00 0.00 0.00 17.79 19.76 3hm2 h ALA 37 CO 0.19 -0.71 0.60 0.82 0.00 0.00 0.00 179.25 180.15 3hm2 h ILE 38 N -0.32 1.15 0.23 0.00 5.03 0.24 0.28 117.51 124.12 3hm2 h ILE 38 Ca 0.08 -0.39 -0.33 0.00 -0.12 0.00 0.00 64.86 64.11 3hm2 h ILE 38 Cb 0.44 -0.08 0.03 0.00 -3.03 0.00 0.00 36.82 34.18 3hm2 h ILE 38 CO -0.26 0.21 -1.48 -0.08 -0.68 0.00 0.00 178.15 175.86 3hm2 h GLU 39 N 1.13 0.48 -0.57 2.37 4.57 -1.26 -0.04 114.58 121.25 3hm2 h GLU 39 Ca 0.36 -0.82 0.11 0.00 -1.18 0.00 0.00 59.36 57.84 3hm2 h GLU 39 Cb 0.03 0.30 -0.11 0.00 -0.16 0.00 0.00 28.75 28.82 3hm2 h GLU 39 CO -0.11 1.39 -0.25 2.35 -1.18 0.00 0.00 179.01 181.21 3hm2 h TRP 40 N 0.13 -0.63 -0.28 0.92 2.91 -0.22 0.21 115.95 118.99 3hm2 h TRP 40 Ca -0.25 0.06 -0.02 0.00 1.13 0.00 0.00 58.89 59.82 3hm2 h TRP 40 Cb 2.13 0.36 -0.01 0.00 -0.51 0.00 0.00 29.16 31.13 3hm2 h TRP 40 CO 0.11 -0.33 0.11 -0.07 -1.03 0.00 0.00 178.44 177.23 3hm2 h LEU 41 N -0.10 0.38 0.30 0.65 3.38 -0.33 -3.26 115.31 116.33 3hm2 h LEU 41 Ca 0.26 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3hm2 h LEU 41 Cb 0.51 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3hm2 h LEU 41 CO -0.64 0.45 -0.29 0.03 0.09 0.00 0.00 178.44 178.09 3hm2 h ARG 42 N 0.29 -0.56 0.00 1.13 3.08 -0.64 -3.29 114.38 114.39 3hm2 h ARG 42 Ca 0.09 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.18 3hm2 h ARG 42 Cb 0.19 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3hm2 h ARG 42 CO -0.01 -0.38 0.03 -1.13 -1.07 0.00 0.00 179.97 177.42 3hm2 n SER 43 N -4.12 0.26 -3.76 7.04 3.41 0.71 -4.61 113.62 112.55 3hm2 n SER 43 Ca -0.07 0.60 -0.13 0.00 -0.26 0.00 0.00 58.87 59.02 3hm2 n SER 43 Cb 0.27 -0.63 -0.13 0.00 -0.26 0.00 0.00 64.21 63.46 3hm2 n SER 43 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3hm2 s THR 44 N -3.23 -0.02 0.31 6.66 2.01 -1.24 -5.11 115.64 115.03 3hm2 s THR 44 Ca -0.01 0.08 -0.22 0.00 0.31 0.00 0.00 61.69 61.85 3hm2 s THR 44 Cb 0.03 -0.34 -0.10 0.00 0.01 0.00 0.00 72.50 72.10 3hm2 s THR 44 CO 0.09 0.03 0.86 -2.84 -0.69 0.00 0.00 174.62 172.08 3hm2 s PRO 45 N 0.71 4.36 -0.64 4.92 0.02 -1.26 -4.46 135.00 138.65 3hm2 s PRO 45 Ca -0.05 1.09 -0.04 0.00 0.02 0.00 0.00 61.00 62.02 3hm2 s PRO 45 Cb -0.06 -2.67 -0.04 0.00 0.02 0.00 0.00 34.50 31.75 3hm2 s PRO 45 CO -0.04 0.24 0.56 1.04 -0.33 0.00 0.00 177.00 178.47 3hm2 n GLN 46 N 0.28 -1.36 -4.01 5.54 6.02 -1.26 -4.72 117.38 117.86 3hm2 n GLN 46 Ca 0.02 0.54 -0.08 0.00 -0.01 0.00 0.00 57.00 57.47 3hm2 n GLN 46 Cb 0.51 -4.14 -0.09 0.00 1.02 0.00 0.00 30.24 27.54 3hm2 n GLN 46 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3hm2 s THR 47 N -3.24 0.18 -0.01 5.09 -4.23 -1.26 -2.00 115.64 110.18 3hm2 s THR 47 Ca 0.28 -1.59 0.05 0.00 -1.18 0.00 0.00 61.69 59.24 3hm2 s THR 47 Cb -0.04 -1.51 -0.01 0.00 1.34 0.00 0.00 72.50 72.29 3hm2 s THR 47 CO 0.45 -0.82 -0.15 0.42 -0.54 0.00 0.00 174.62 173.97 3hm2 s THR 48 N -3.91 1.22 0.02 3.99 -4.23 -0.67 -4.84 115.64 107.22 3hm2 s THR 48 Ca 0.08 -0.70 0.06 0.00 -1.18 0.00 0.00 61.69 59.96 3hm2 s THR 48 Cb 0.07 -1.02 -0.02 0.00 1.34 0.00 0.00 72.50 72.86 3hm2 s THR 48 CO -0.09 0.32 -0.19 0.00 -0.54 0.00 0.00 174.62 174.11 3hm2 s ALA 49 N -0.41 1.64 -0.01 3.99 0.00 -0.53 -0.25 121.76 126.19 3hm2 s ALA 49 Ca 0.06 -0.94 0.06 0.00 0.00 0.00 0.00 51.96 51.14 3hm2 s ALA 49 Cb -0.06 -0.35 -0.02 0.00 0.00 0.00 0.00 23.12 22.69 3hm2 s ALA 49 CO -0.00 0.38 -0.20 0.08 0.00 0.00 0.00 175.76 176.01 3hm2 s VAL 50 N -0.65 1.61 0.08 0.00 1.01 0.21 -2.41 120.40 120.24 3hm2 s VAL 50 Ca 0.07 -0.89 0.10 0.00 0.00 0.00 0.00 61.98 61.26 3hm2 s VAL 50 Cb -0.08 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 3hm2 s VAL 50 CO 0.01 0.44 -0.25 0.00 0.00 0.00 0.00 175.10 175.30 3hm2 s PHE 52 N -0.93 3.51 -0.06 0.00 0.40 -1.19 -0.82 117.98 118.89 3hm2 s PHE 52 Ca 0.13 -2.55 0.02 0.00 -0.60 0.00 0.00 56.93 53.93 3hm2 s PHE 52 Cb -0.10 -2.50 0.02 0.00 0.51 0.00 0.00 43.02 40.94 3hm2 s PHE 52 CO 0.04 -0.91 -0.09 -2.00 0.70 0.00 0.00 175.22 172.97 3hm2 s GLU 53 N 1.05 1.35 -0.07 0.44 2.56 -0.59 -4.19 118.70 119.24 3hm2 s GLU 53 Ca 0.02 -0.28 -0.09 0.00 0.00 0.00 0.00 54.97 54.62 3hm2 s GLU 53 Cb -0.20 -1.20 -0.05 0.00 2.00 0.00 0.00 34.13 34.68 3hm2 s GLU 53 CO -0.06 -0.04 0.34 0.97 -0.56 0.00 0.00 175.26 175.92 3hm2 h ILE 54 N 6.05 0.11 -2.58 -3.70 2.10 -1.86 -3.20 117.51 114.44 3hm2 h ILE 54 Ca -0.33 -0.88 -0.53 0.00 1.08 0.00 0.00 64.86 64.20 3hm2 h ILE 54 Cb 1.17 0.20 0.04 0.00 -1.09 0.00 0.00 36.82 37.14 3hm2 h ILE 54 CO 0.47 0.03 1.08 -0.55 -1.08 0.00 0.00 178.15 178.10 3hm2 s SER 55 N -5.31 6.46 0.66 2.19 0.15 -1.26 -4.80 113.70 111.79 3hm2 s SER 55 Ca -0.05 2.72 0.28 0.00 0.70 0.00 0.00 55.95 59.60 3hm2 s SER 55 Cb 0.00 -2.57 1.51 0.00 -1.71 0.00 0.00 66.02 63.25 3hm2 s SER 55 CO 0.15 -0.98 1.85 -0.08 1.20 0.00 0.00 173.24 175.39 3hm2 h GLU 56 N 8.37 0.00 0.00 5.44 4.81 -2.01 -1.26 114.58 129.94 3hm2 h GLU 56 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 3hm2 h GLU 56 Cb 1.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.59 3hm2 h GLU 56 CO 0.94 0.00 -0.66 0.39 -0.73 0.00 0.00 179.01 178.95 3hm2 n GLU 57 N -2.91 3.21 0.10 1.92 -0.58 -1.26 -3.46 120.64 117.66 3hm2 n GLU 57 Ca -0.01 -0.02 0.01 0.00 -0.42 0.00 0.00 57.16 56.71 3hm2 n GLU 57 Cb 0.44 -0.94 -0.02 0.00 -0.57 0.00 0.00 31.44 30.35 3hm2 n GLU 57 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3hm2 h ARG 58 N 0.00 0.00 -0.08 3.49 3.08 -1.62 -3.09 114.38 116.17 3hm2 h ARG 58 Ca 0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.95 3hm2 h ARG 58 Cb 0.21 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3hm2 h ARG 58 CO 0.00 0.50 -0.39 0.00 -1.07 0.00 0.00 179.97 179.01 3hm2 h ARG 59 N 0.00 0.17 -0.44 0.04 3.08 -1.56 -3.03 114.38 112.63 3hm2 h ARG 59 Ca -0.05 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.93 3hm2 h ARG 59 Cb 1.48 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.53 3hm2 h ARG 59 CO 0.07 0.54 0.00 0.39 -1.07 0.00 0.00 179.97 179.90 3hm2 n GLU 60 N -4.05 1.29 0.00 0.04 1.02 -1.17 -3.05 120.64 114.72 3hm2 n GLU 60 Ca -0.01 -0.32 0.00 0.00 -0.02 0.00 0.00 57.16 56.81 3hm2 n GLU 60 Cb 0.45 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 3hm2 n GLU 60 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 3hm2 n ARG 61 N -0.13 2.30 0.02 3.49 3.00 -1.18 -4.52 116.66 119.64 3hm2 n ARG 61 Ca 0.03 0.00 -0.13 0.00 -0.00 0.00 0.00 57.85 57.75 3hm2 n ARG 61 Cb 0.19 -0.85 -0.09 0.00 0.00 0.00 0.00 32.46 31.70 3hm2 n ARG 61 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 3hm2 h ILE 62 N 0.00 1.24 -0.01 5.15 2.04 -1.52 -3.03 117.51 121.38 3hm2 h ILE 62 Ca 0.00 -0.93 -0.24 0.00 1.00 0.00 0.00 64.86 64.68 3hm2 h ILE 62 Cb 0.36 1.86 0.01 0.00 -0.74 0.00 0.00 36.82 38.30 3hm2 h ILE 62 CO 0.00 0.24 -0.98 0.25 0.00 0.00 0.00 178.15 177.66 3hm2 h LEU 63 N -0.47 0.72 -0.63 1.44 5.85 -1.85 -2.54 115.31 117.84 3hm2 h LEU 63 Ca -0.01 -0.57 0.10 0.00 0.84 0.00 0.00 57.88 58.25 3hm2 h LEU 63 Cb 0.43 -0.22 -0.08 0.00 0.37 0.00 0.00 40.66 41.16 3hm2 h LEU 63 CO 0.01 1.37 0.22 -1.28 -0.34 0.00 0.00 178.44 178.42 3hm2 h SER 64 N 0.32 0.20 -0.21 1.25 0.87 -1.79 -2.06 113.55 112.13 3hm2 h SER 64 Ca -0.10 0.09 -0.06 0.00 -1.23 0.00 0.00 61.79 60.49 3hm2 h SER 64 Cb 1.62 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 63.65 3hm2 h SER 64 CO 0.18 0.11 -0.10 -1.13 -0.53 0.00 0.00 176.83 175.36 3hm2 h ASN 65 N 0.39 0.45 -0.56 6.23 -0.00 -1.46 -2.94 115.58 117.69 3hm2 h ASN 65 Ca 0.32 -0.41 0.09 0.00 -0.00 0.00 0.00 56.30 56.30 3hm2 h ASN 65 Cb 0.43 -0.12 -0.10 0.00 -0.00 0.00 0.00 38.32 38.52 3hm2 h ASN 65 CO -0.33 0.76 -0.43 0.00 -0.00 0.00 0.00 177.43 177.43 3hm2 h ALA 66 N 0.70 -0.33 -1.00 1.57 0.00 -1.34 -0.80 119.26 118.06 3hm2 h ALA 66 Ca 0.05 0.11 0.33 0.00 0.00 0.00 0.00 54.91 55.39 3hm2 h ALA 66 Cb 0.60 0.94 -0.18 0.00 0.00 0.00 0.00 17.79 19.15 3hm2 h ALA 66 CO 0.03 -0.82 0.22 -0.89 0.00 0.00 0.00 179.25 177.79 3hm2 n ILE 67 N -5.41 -0.42 0.35 0.00 5.41 -0.79 -1.74 119.36 116.77 3hm2 n ILE 67 Ca 0.01 2.13 -0.16 0.00 1.00 0.00 0.00 62.75 65.73 3hm2 n ILE 67 Cb 0.35 -3.24 -0.08 0.00 -0.71 0.00 0.00 39.64 35.95 3hm2 n ILE 67 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 3hm2 h ASN 68 N 0.00 -0.74 0.00 4.38 2.35 -1.11 -1.41 115.58 119.05 3hm2 h ASN 68 Ca 0.70 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.44 3hm2 h ASN 68 Cb 1.64 0.19 0.00 0.00 0.05 0.00 0.00 38.32 40.20 3hm2 h ASN 68 CO -0.87 -0.44 0.00 0.18 -1.65 0.00 0.00 177.43 174.65 3hm2 n LEU 69 N -5.41 0.00 -0.04 1.61 4.77 -0.74 -4.78 117.00 112.41 3hm2 n LEU 69 Ca -0.13 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.85 3hm2 n LEU 69 Cb 0.37 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.46 3hm2 n LEU 69 CO 0.34 0.00 -0.01 0.61 -1.33 0.00 0.00 177.39 177.01 3hm2 n GLY 70 N -0.41 0.46 2.06 -0.72 0.00 -0.53 -4.88 105.19 101.16 3hm2 n GLY 70 Ca 0.06 -0.15 -0.19 0.00 0.00 0.00 0.00 46.02 45.74 3hm2 n GLY 70 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hm2 n VAL 71 N -2.86 3.08 0.27 1.61 0.24 -0.89 -4.42 118.33 115.37 3hm2 n VAL 71 Ca -0.01 -1.98 0.16 0.00 -2.04 0.00 0.00 64.34 60.48 3hm2 n VAL 71 Cb 0.08 -0.43 0.67 0.00 -1.47 0.00 0.00 33.84 32.69 3hm2 n VAL 71 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 3hm2 h SER 72 N 1.27 0.00 0.27 -1.34 4.64 -1.79 -3.26 113.55 113.35 3hm2 h SER 72 Ca 0.53 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.79 3hm2 h SER 72 Cb 2.64 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 64.72 3hm2 h SER 72 CO 0.96 0.05 -0.27 -0.78 -0.87 0.00 0.00 176.83 175.92 3hm2 h ASP 73 N 0.00 0.00 0.00 4.97 3.58 -1.93 -3.33 116.42 119.71 3hm2 h ASP 73 Ca -0.00 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 3hm2 h ASP 73 Cb 0.52 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.57 3hm2 h ASP 73 CO 0.01 0.27 -0.18 0.54 -2.88 0.00 0.00 179.24 176.99 3hm2 n ARG 74 N -4.22 0.86 -4.89 0.28 1.74 -1.23 -5.01 116.66 104.19 3hm2 n ARG 74 Ca -0.02 -1.85 -0.25 0.00 -0.77 0.00 0.00 57.85 54.95 3hm2 n ARG 74 Cb 0.32 -1.06 -0.15 0.00 -1.02 0.00 0.00 32.46 30.54 3hm2 n ARG 74 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 3hm2 s ILE 75 N -1.59 1.45 0.03 0.55 2.07 -1.25 -1.45 121.20 121.00 3hm2 s ILE 75 Ca 0.17 -0.78 0.09 0.00 -1.41 0.00 0.00 60.65 58.71 3hm2 s ILE 75 Cb 0.15 -1.21 -0.03 0.00 0.13 0.00 0.00 42.46 41.50 3hm2 s ILE 75 CO 0.02 0.41 -0.26 0.00 -1.91 0.00 0.00 174.94 173.20 3hm2 s ALA 76 N -0.40 2.17 -0.40 1.50 0.00 -1.01 -5.00 121.76 118.61 3hm2 s ALA 76 Ca 0.06 -1.20 -0.02 0.00 0.00 0.00 0.00 51.96 50.80 3hm2 s ALA 76 Cb -0.07 -0.48 0.11 0.00 0.00 0.00 0.00 23.12 22.67 3hm2 s ALA 76 CO -0.01 0.52 0.18 0.08 0.00 0.00 0.00 175.76 176.53 3hm2 s VAL 77 N -0.74 3.17 0.70 0.00 1.01 -1.26 -1.83 120.40 121.44 3hm2 s VAL 77 Ca 0.11 -2.07 -0.00 0.00 0.00 0.00 0.00 61.98 60.02 3hm2 s VAL 77 Cb -0.10 -3.18 0.11 0.00 0.00 0.00 0.00 36.38 33.22 3hm2 s VAL 77 CO 0.01 -0.67 0.96 -1.10 0.00 0.00 0.00 175.10 174.31 3hm2 s GLN 78 N 1.12 1.80 0.00 2.72 -1.52 -0.00 -4.96 119.66 118.82 3hm2 s GLN 78 Ca 0.08 -1.08 0.00 0.00 -1.95 0.00 0.00 55.36 52.41 3hm2 s GLN 78 Cb -0.22 -2.36 0.00 0.00 -0.22 0.00 0.00 33.01 30.21 3hm2 s GLN 78 CO -0.05 -1.34 0.00 1.04 -0.25 0.00 0.00 175.29 174.69 3hm2 n GLN 79 N -2.76 1.23 -2.59 2.91 6.02 -1.26 -1.54 117.38 119.40 3hm2 n GLN 79 Ca 0.14 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.73 3hm2 n GLN 79 Cb 0.60 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.82 3hm2 n GLN 79 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 3hm2 s GLY 80 N -1.79 3.01 0.47 1.08 0.00 -1.21 -3.17 107.32 105.70 3hm2 s GLY 80 Ca 0.00 0.76 -0.14 0.00 0.00 0.00 0.00 44.72 45.35 3hm2 s GLY 80 CO 0.00 1.46 0.89 0.00 0.00 0.00 0.00 173.10 175.46 3hm2 s ALA 81 N -0.77 3.19 -2.32 3.20 0.00 -1.26 -2.58 121.76 121.22 3hm2 s ALA 81 Ca 0.45 0.02 0.21 0.00 0.00 0.00 0.00 51.96 52.64 3hm2 s ALA 81 Cb -0.29 -2.94 0.68 0.00 0.00 0.00 0.00 23.12 20.57 3hm2 s ALA 81 CO 0.36 -0.15 1.52 -2.30 0.00 0.00 0.00 175.76 175.19 3hm2 n PRO 82 N -1.47 1.86 0.25 0.00 -0.02 -1.26 -4.84 135.00 129.51 3hm2 n PRO 82 Ca 0.05 -1.29 0.16 0.00 -2.02 0.00 0.00 63.50 60.40 3hm2 n PRO 82 Cb 0.54 -1.41 0.64 0.00 -0.02 0.00 0.00 33.50 33.25 3hm2 n PRO 82 CO 0.00 0.00 0.00 0.07 1.98 0.00 0.00 175.50 177.55 3hm2 h ARG 83 N 2.60 0.00 -0.01 -0.52 0.11 -1.95 -2.67 114.38 111.94 3hm2 h ARG 83 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3hm2 h ARG 83 Cb 0.57 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.65 3hm2 h ARG 83 CO 0.00 0.00 -0.71 0.00 0.10 0.00 0.00 179.97 179.36 3hm2 n ALA 84 N -2.03 4.10 0.25 0.08 0.00 -1.07 -3.58 120.51 118.27 3hm2 n ALA 84 Ca 0.01 -0.62 0.13 0.00 0.00 0.00 0.00 53.44 52.96 3hm2 n ALA 84 Cb 0.30 -0.79 0.65 0.00 0.00 0.00 0.00 19.45 19.61 3hm2 n ALA 84 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3hm2 h PHE 85 N 1.32 0.00 0.00 0.00 0.04 -1.76 -3.06 116.94 113.47 3hm2 h PHE 85 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3hm2 h PHE 85 Cb 0.64 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.79 3hm2 h PHE 85 CO 0.00 0.14 0.00 -0.25 -0.60 0.00 0.00 178.31 177.60 3hm2 n ASP 86 N -3.43 0.00 -0.00 2.17 9.92 -1.23 -2.98 116.55 120.99 3hm2 n ASP 86 Ca -0.01 0.46 -0.05 0.00 -0.53 0.00 0.00 54.79 54.67 3hm2 n ASP 86 Cb 0.31 -0.49 -0.03 0.00 -0.64 0.00 0.00 41.12 40.27 3hm2 n ASP 86 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 3hm2 h ASP 87 N 0.00 -0.10 -2.94 -2.24 3.32 -1.73 -3.46 116.42 109.27 3hm2 h ASP 87 Ca 0.00 -0.19 -0.56 0.00 0.02 0.00 0.00 57.03 56.31 3hm2 h ASP 87 Cb 0.49 0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.01 3hm2 h ASP 87 CO 0.00 0.47 1.14 -0.69 -1.72 0.00 0.00 179.24 178.44 3hm2 s VAL 88 N -2.15 3.75 -0.02 -1.35 1.01 -1.16 -4.96 120.40 115.52 3hm2 s VAL 88 Ca -0.06 0.71 -0.25 0.00 0.00 0.00 0.00 61.98 62.39 3hm2 s VAL 88 Cb -0.00 -4.15 -0.20 0.00 0.00 0.00 0.00 36.38 32.02 3hm2 s VAL 88 CO 0.20 -0.83 1.20 -0.65 0.00 0.00 0.00 175.10 175.01 3hm2 h PRO 89 N 11.54 0.12 -6.87 2.72 0.11 -1.89 -3.46 132.00 134.27 3hm2 h PRO 89 Ca -0.28 -0.08 -0.49 0.00 0.11 0.00 0.00 66.00 65.25 3hm2 h PRO 89 Cb 1.12 0.01 0.01 0.00 0.11 0.00 0.00 31.00 32.25 3hm2 h PRO 89 CO 1.11 0.67 0.44 -0.51 -0.21 0.00 0.00 178.00 179.51 3hm2 s ASP 90 N -5.96 7.09 0.01 -2.05 1.11 -1.26 -4.99 116.67 110.62 3hm2 s ASP 90 Ca -0.16 2.15 -0.30 0.00 0.18 0.00 0.00 52.55 54.42 3hm2 s ASP 90 Cb 0.02 -2.61 -0.06 0.00 1.07 0.00 0.00 42.92 41.34 3hm2 s ASP 90 CO 0.71 -0.26 1.47 0.20 1.18 0.00 0.00 175.17 178.47 3hm2 s ASN 91 N -1.19 6.79 0.81 0.27 0.02 -1.26 -5.02 114.94 115.36 3hm2 s ASN 91 Ca 0.50 2.19 -0.11 0.00 -1.02 0.00 0.00 52.86 54.42 3hm2 s ASN 91 Cb -0.27 -2.56 0.08 0.00 0.02 0.00 0.00 41.25 38.52 3hm2 s ASN 91 CO 0.35 -0.77 1.12 -2.16 0.02 0.00 0.00 177.10 175.66 3hm2 s PRO 92 N 2.57 1.86 -0.15 -0.60 0.04 -1.26 -4.97 135.00 132.48 3hm2 s PRO 92 Ca 0.66 1.39 0.03 0.00 0.04 0.00 0.00 61.00 63.12 3hm2 s PRO 92 Cb -0.33 -1.84 -0.23 0.00 0.04 0.00 0.00 34.50 32.14 3hm2 s PRO 92 CO 0.28 -1.98 0.23 -0.25 0.04 0.00 0.00 177.00 175.32 3hm2 n ASP 93 N -3.58 1.54 -3.89 6.66 8.00 -0.32 -4.59 116.55 120.36 3hm2 n ASP 93 Ca 0.11 0.13 -0.11 0.00 0.71 0.00 0.00 54.79 55.62 3hm2 n ASP 93 Cb 0.52 -0.32 -0.13 0.00 -0.02 0.00 0.00 41.12 41.17 3hm2 n ASP 93 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3hm2 s VAL 94 N -2.55 0.03 -0.02 2.53 1.01 -0.43 -2.87 120.40 118.10 3hm2 s VAL 94 Ca -0.20 -0.26 0.06 0.00 0.00 0.00 0.00 61.98 61.58 3hm2 s VAL 94 Cb 0.07 -0.11 -0.02 0.00 0.00 0.00 0.00 36.38 36.33 3hm2 s VAL 94 CO 0.74 -0.14 -0.21 -0.63 0.00 0.00 0.00 175.10 174.86 3hm2 s ILE 95 N -0.43 1.67 -0.12 2.22 1.01 -0.45 -1.63 121.20 123.47 3hm2 s ILE 95 Ca -0.05 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 59.73 3hm2 s ILE 95 Cb -0.03 -1.39 0.00 0.00 0.01 0.00 0.00 42.46 41.05 3hm2 s ILE 95 CO -0.00 0.47 -0.21 0.12 0.00 0.00 0.00 174.94 175.32 3hm2 s PHE 96 N -0.45 2.65 -0.24 3.97 5.36 0.17 -1.25 117.98 128.19 3hm2 s PHE 96 Ca 0.07 -1.09 0.01 0.00 -0.96 0.00 0.00 56.93 54.96 3hm2 s PHE 96 Cb -0.09 -1.78 0.04 0.00 -0.34 0.00 0.00 43.02 40.86 3hm2 s PHE 96 CO -0.00 -0.46 -0.12 0.42 -1.46 0.00 0.00 175.22 173.60 3hm2 s ILE 97 N 0.54 2.34 -0.79 3.12 1.01 -1.01 -0.16 121.20 126.26 3hm2 s ILE 97 Ca -0.13 -1.32 -0.02 0.00 0.00 0.00 0.00 60.65 59.19 3hm2 s ILE 97 Cb -0.17 -2.24 0.38 0.00 0.01 0.00 0.00 42.46 40.44 3hm2 s ILE 97 CO 0.04 0.16 1.98 0.61 0.00 0.00 0.00 174.94 177.73 3hm2 n GLY 98 N 4.54 5.63 0.00 6.18 0.00 -1.14 -1.48 105.19 118.92 3hm2 n GLY 98 Ca -0.16 -2.46 0.00 0.00 0.00 0.00 0.00 46.02 43.40 3hm2 n GLY 98 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3hm2 n LEU 101 N -0.62 0.00 0.00 0.99 -0.00 -1.26 -4.37 117.00 111.74 3hm2 n LEU 101 Ca 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.56 3hm2 n LEU 101 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.77 3hm2 n LEU 101 CO 0.56 0.00 0.35 0.41 -0.00 0.00 0.00 177.39 178.71 3hm2 n THR 102 N 0.00 0.42 -1.38 1.47 -1.04 -1.26 -4.86 114.28 107.63 3hm2 n THR 102 Ca 0.00 -0.43 -0.41 0.00 -2.04 0.00 0.00 64.05 61.17 3hm2 n THR 102 Cb 0.00 0.82 0.01 0.00 -1.82 0.00 0.00 70.33 69.33 3hm2 n THR 102 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3hm2 n ALA 103 N -0.21 -2.15 -1.54 2.41 0.00 -1.26 -4.68 120.51 113.09 3hm2 n ALA 103 Ca 0.00 0.12 -0.46 0.00 0.00 0.00 0.00 53.44 53.10 3hm2 n ALA 103 Cb 0.38 -1.64 -0.05 0.00 0.00 0.00 0.00 19.45 18.14 3hm2 n ALA 103 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3hm2 n PRO 104 N 0.88 1.60 -0.70 0.00 -0.02 -1.26 -3.01 135.00 132.49 3hm2 n PRO 104 Ca 0.11 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3hm2 n PRO 104 Cb 0.41 -2.90 0.00 0.00 -0.02 0.00 0.00 33.50 30.99 3hm2 n PRO 104 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hm2 n GLY 105 N 6.06 0.79 0.17 -1.23 0.00 -1.26 -4.90 105.19 104.82 3hm2 n GLY 105 Ca 0.34 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.19 3hm2 n GLY 105 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3hm2 h VAL 106 N 0.00 1.34 0.40 1.61 2.07 -1.86 -2.57 116.25 117.23 3hm2 h VAL 106 Ca 0.00 -2.38 -0.02 0.00 0.82 0.00 0.00 66.70 65.12 3hm2 h VAL 106 Cb 0.00 2.44 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 3hm2 h VAL 106 CO 0.00 0.72 -0.19 0.15 0.02 0.00 0.00 177.57 178.27 3hm2 h PHE 107 N 0.30 -0.49 -1.01 1.57 3.57 -1.89 -0.62 116.94 118.37 3hm2 h PHE 107 Ca -0.11 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.49 3hm2 h PHE 107 Cb 1.67 0.16 -0.08 0.00 2.79 0.00 0.00 35.95 40.49 3hm2 h PHE 107 CO 0.08 -0.31 0.64 0.00 -2.23 0.00 0.00 178.31 176.49 3hm2 h ALA 108 N -1.70 1.51 0.71 2.41 0.00 -1.96 0.68 119.26 120.91 3hm2 h ALA 108 Ca -0.05 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3hm2 h ALA 108 Cb 0.41 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 3hm2 h ALA 108 CO 0.09 0.25 -0.44 0.00 0.00 0.00 0.00 179.25 179.16 3hm2 h ALA 109 N 1.53 -1.24 -0.37 0.00 0.00 -1.52 0.18 119.26 117.85 3hm2 h ALA 109 Ca 0.49 -0.22 0.11 0.00 0.00 0.00 0.00 54.91 55.28 3hm2 h ALA 109 Cb 0.46 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 3hm2 h ALA 109 CO -0.26 -1.20 0.31 0.00 0.00 0.00 0.00 179.25 178.11 3hm2 h ALA 110 N -1.28 2.20 0.00 0.00 0.00 0.40 -2.00 119.26 118.59 3hm2 h ALA 110 Ca -0.10 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.64 3hm2 h ALA 110 Cb 0.86 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 3hm2 h ALA 110 CO 0.10 -0.50 -1.09 2.35 0.00 0.00 0.00 179.25 180.11 3hm2 h TRP 111 N 0.00 0.00 0.00 0.00 2.91 0.80 -2.96 115.95 116.70 3hm2 h TRP 111 Ca 0.17 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.19 3hm2 h TRP 111 Cb 0.79 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.44 3hm2 h TRP 111 CO 0.00 0.64 0.00 1.63 -1.03 0.00 0.00 178.44 179.68 3hm2 n LYS 112 N -3.07 0.47 -0.00 2.65 5.02 0.60 -2.85 118.16 120.98 3hm2 n LYS 112 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 3hm2 n LYS 112 Cb 0.84 -1.38 -0.00 0.00 -0.02 0.00 0.00 35.03 34.46 3hm2 n LYS 112 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3hm2 n ARG 113 N -0.88 4.58 -2.79 1.97 5.12 -1.12 -4.99 116.66 118.55 3hm2 n ARG 113 Ca 0.09 -0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.59 3hm2 n ARG 113 Cb 0.04 -0.68 -0.03 0.00 -1.16 0.00 0.00 32.46 30.63 3hm2 n ARG 113 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 3hm2 s LEU 114 N -2.35 4.35 0.39 0.55 2.96 -1.13 -4.31 118.68 119.14 3hm2 s LEU 114 Ca 0.00 1.54 -0.13 0.00 -0.22 0.00 0.00 54.13 55.31 3hm2 s LEU 114 Cb 0.00 -3.46 -0.08 0.00 0.50 0.00 0.00 46.19 43.16 3hm2 s LEU 114 CO 0.01 -0.24 0.80 -2.16 -1.32 0.00 0.00 176.35 173.43 3hm2 s PRO 115 N 1.05 3.90 -0.14 0.98 0.04 -1.26 -4.97 135.00 134.61 3hm2 s PRO 115 Ca 0.48 0.64 -0.36 0.00 0.04 0.00 0.00 61.00 61.80 3hm2 s PRO 115 Cb -0.20 -2.35 -0.17 0.00 0.04 0.00 0.00 34.50 31.81 3hm2 s PRO 115 CO 0.25 -0.01 1.06 0.28 0.04 0.00 0.00 177.00 178.62 3hm2 n VAL 116 N -0.99 0.00 -0.31 -0.36 0.31 -1.26 -1.06 118.33 114.66 3hm2 n VAL 116 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 3hm2 n VAL 116 Cb 0.54 -0.14 0.00 0.00 -0.91 0.00 0.00 33.84 33.33 3hm2 n VAL 116 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hm2 n GLY 117 N 1.97 0.87 3.61 2.92 0.00 0.68 -4.85 105.19 110.38 3hm2 n GLY 117 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 3hm2 n GLY 117 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hm2 s GLY 118 N -1.58 1.55 0.01 -0.02 0.00 -0.22 -4.44 107.32 102.62 3hm2 s GLY 118 Ca 0.00 -0.43 0.04 0.00 0.00 0.00 0.00 44.72 44.33 3hm2 s GLY 118 CO 0.00 0.27 -0.12 0.50 0.00 0.00 0.00 173.10 173.75 3hm2 s ARG 119 N -4.92 0.89 0.00 2.90 0.52 -1.14 0.57 118.95 117.78 3hm2 s ARG 119 Ca 0.67 -0.54 0.02 0.00 -0.52 0.00 0.00 55.73 55.35 3hm2 s ARG 119 Cb -0.19 -0.87 -0.01 0.00 0.52 0.00 0.00 34.95 34.41 3hm2 s ARG 119 CO 0.59 0.23 -0.05 -1.17 0.02 0.00 0.00 175.30 174.91 3hm2 s LEU 120 N -0.64 2.04 -0.15 2.53 0.20 -0.88 -1.34 118.68 120.45 3hm2 s LEU 120 Ca 0.03 -0.16 -0.00 0.00 0.69 0.00 0.00 54.13 54.69 3hm2 s LEU 120 Cb -0.06 -0.25 0.03 0.00 -0.43 0.00 0.00 46.19 45.48 3hm2 s LEU 120 CO 0.00 0.02 -0.10 -0.69 -0.29 0.00 0.00 176.35 175.30 3hm2 s VAL 121 N -0.30 1.32 0.08 1.68 1.01 -0.38 -2.62 120.40 121.19 3hm2 s VAL 121 Ca 0.00 -0.56 0.08 0.00 0.00 0.00 0.00 61.98 61.49 3hm2 s VAL 121 Cb -0.03 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 3hm2 s VAL 121 CO -0.00 0.33 -0.15 0.00 0.00 0.00 0.00 175.10 175.28 3hm2 s ALA 122 N 1.58 2.76 -0.06 5.51 0.00 0.58 -2.39 121.76 129.73 3hm2 s ALA 122 Ca 0.03 -1.26 0.05 0.00 0.00 0.00 0.00 51.96 50.79 3hm2 s ALA 122 Cb -0.14 -0.77 -0.01 0.00 0.00 0.00 0.00 23.12 22.20 3hm2 s ALA 122 CO -0.09 0.60 -0.22 -0.80 0.00 0.00 0.00 175.76 175.25 3hm2 s ASN 123 N -1.92 2.72 -0.01 0.00 -0.87 -0.55 0.65 114.94 114.97 3hm2 s ASN 123 Ca 0.18 -0.46 0.02 0.00 -1.57 0.00 0.00 52.86 51.03 3hm2 s ASN 123 Cb -0.11 -0.85 -0.03 0.00 -0.02 0.00 0.00 41.25 40.24 3hm2 s ASN 123 CO 0.10 0.19 -0.03 0.00 -2.57 0.00 0.00 177.10 174.79 3hm2 s ALA 124 N 0.01 3.17 0.00 0.60 0.00 0.46 -4.71 121.76 121.30 3hm2 s ALA 124 Ca -0.06 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 50.93 3hm2 s ALA 124 Cb -0.14 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.72 3hm2 s ALA 124 CO 0.04 0.63 0.00 1.55 0.00 0.00 0.00 175.76 177.98 3hm2 n VAL 125 N 1.53 0.00 -3.74 0.00 3.14 -1.26 -1.53 118.33 116.47 3hm2 n VAL 125 Ca -0.15 0.00 -0.22 0.00 -2.96 0.00 0.00 64.34 61.01 3hm2 n VAL 125 Cb 0.53 -0.20 -0.04 0.00 -1.06 0.00 0.00 33.84 33.06 3hm2 n VAL 125 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 3hm2 s THR 126 N -1.61 2.80 0.05 1.55 -4.23 -1.26 -4.90 115.64 108.04 3hm2 s THR 126 Ca 0.00 -1.43 -0.18 0.00 -1.18 0.00 0.00 61.69 58.90 3hm2 s THR 126 Cb 0.00 -3.03 -0.16 0.00 1.34 0.00 0.00 72.50 70.65 3hm2 s THR 126 CO 0.00 -0.05 1.28 0.58 -0.54 0.00 0.00 174.62 175.89 3hm2 h VAL 127 N 1.18 1.36 -0.66 2.29 2.07 -1.98 0.22 116.25 120.73 3hm2 h VAL 127 Ca -0.42 -1.69 0.13 0.00 0.82 0.00 0.00 66.70 65.54 3hm2 h VAL 127 Cb 1.26 2.05 -0.12 0.00 -1.52 0.00 0.00 31.29 32.96 3hm2 h VAL 127 CO 0.60 0.51 -0.12 -0.33 0.02 0.00 0.00 177.57 178.24 3hm2 h GLU 128 N 0.14 0.02 -0.31 1.57 4.39 -2.00 -0.01 114.58 118.40 3hm2 h GLU 128 Ca -0.01 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 3hm2 h GLU 128 Cb 1.02 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.65 3hm2 h GLU 128 CO 0.09 0.02 0.17 0.77 -1.16 0.00 0.00 179.01 178.89 3hm2 h SER 129 N 0.02 0.38 -0.79 1.42 0.02 -1.93 -3.15 113.55 109.52 3hm2 h SER 129 Ca 0.32 -0.08 0.08 0.00 -0.84 0.00 0.00 61.79 61.27 3hm2 h SER 129 Cb 0.51 -0.10 -0.06 0.00 0.14 0.00 0.00 62.40 62.89 3hm2 h SER 129 CO -0.65 0.35 0.46 -0.08 -1.14 0.00 0.00 176.83 175.77 3hm2 h GLU 130 N 0.38 0.79 -1.77 3.45 4.81 0.08 -3.07 114.58 119.26 3hm2 h GLU 130 Ca 0.11 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 3hm2 h GLU 130 Cb 0.05 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.25 3hm2 h GLU 130 CO -0.02 0.52 0.00 1.04 -0.73 0.00 0.00 179.01 179.82 3hm2 n GLN 131 N -4.72 0.53 0.00 1.92 6.02 -0.11 -3.32 117.38 117.69 3hm2 n GLN 131 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 3hm2 n GLN 131 Cb 0.22 -1.23 0.00 0.00 1.02 0.00 0.00 30.24 30.25 3hm2 n GLN 131 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3hm2 n LEU 133 N 1.30 0.00 0.24 1.08 4.77 -1.16 -3.42 117.00 119.81 3hm2 n LEU 133 Ca 0.00 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.14 3hm2 n LEU 133 Cb 0.27 0.00 0.57 0.00 -2.33 0.00 0.00 43.42 41.92 3hm2 n LEU 133 CO 0.00 0.00 0.94 -0.50 -1.33 0.00 0.00 177.39 176.50 3hm2 h TRP 134 N 0.00 0.00 0.00 -1.77 4.06 -1.87 -0.01 115.95 116.36 3hm2 h TRP 134 Ca 0.00 0.00 -0.29 0.00 2.06 0.00 0.00 58.89 60.66 3hm2 h TRP 134 Cb 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.11 3hm2 h TRP 134 CO 0.00 0.00 -2.08 0.00 -3.56 0.00 0.00 178.44 172.80 3hm2 n ALA 135 N -2.04 1.61 0.21 1.49 0.00 -1.22 -3.39 120.51 117.16 3hm2 n ALA 135 Ca 0.02 -1.03 0.09 0.00 0.00 0.00 0.00 53.44 52.52 3hm2 n ALA 135 Cb 0.34 -0.07 0.28 0.00 0.00 0.00 0.00 19.45 20.00 3hm2 n ALA 135 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3hm2 h LEU 136 N 0.00 0.00 -0.69 0.00 3.38 -1.87 -3.01 115.31 113.11 3hm2 h LEU 136 Ca -0.43 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.40 3hm2 h LEU 136 Cb 1.95 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.69 3hm2 h LEU 136 CO 0.02 0.21 -0.60 -0.09 0.09 0.00 0.00 178.44 178.06 3hm2 h ARG 137 N 0.00 0.18 0.50 1.13 2.43 -1.13 -2.68 114.38 114.81 3hm2 h ARG 137 Ca -0.00 -0.12 -0.02 0.00 -0.81 0.00 0.00 59.98 59.02 3hm2 h ARG 137 Cb 0.97 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 3hm2 h ARG 137 CO 0.03 0.73 -0.29 0.87 -1.51 0.00 0.00 179.97 179.80 3hm2 h LYS 138 N 0.13 -0.71 0.73 0.20 1.57 -1.54 -2.33 116.57 114.64 3hm2 h LYS 138 Ca -0.01 0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 3hm2 h LYS 138 Cb 1.10 0.16 0.01 0.00 0.08 0.00 0.00 32.23 33.57 3hm2 h LYS 138 CO 0.09 -0.47 -0.35 -0.56 -0.57 0.00 0.00 179.45 177.59 3hm2 h GLN 139 N -0.73 -0.95 0.00 3.15 3.07 -1.74 -3.37 115.11 114.54 3hm2 h GLN 139 Ca -0.07 0.06 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3hm2 h GLN 139 Cb 0.58 0.22 0.00 0.00 0.08 0.00 0.00 27.48 28.35 3hm2 h GLN 139 CO 0.08 -0.62 0.00 1.19 0.09 0.00 0.00 178.83 179.57 3hm2 n PHE 140 N -5.44 0.00 -3.12 0.06 3.72 -1.01 -4.96 117.46 106.72 3hm2 n PHE 140 Ca -0.13 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.27 3hm2 n PHE 140 Cb 0.40 -0.21 0.00 0.00 -0.94 0.00 0.00 39.48 38.73 3hm2 n PHE 140 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hm2 n GLY 141 N 0.75 -1.74 0.00 1.37 0.00 -0.88 -4.87 105.19 99.81 3hm2 n GLY 141 Ca 0.14 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.65 3hm2 n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hm2 n GLY 142 N 0.00 0.34 2.96 -0.02 0.00 -1.26 -4.34 105.19 102.86 3hm2 n GLY 142 Ca 0.00 -1.90 -0.13 0.00 0.00 0.00 0.00 46.02 43.99 3hm2 n GLY 142 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hm2 s THR 143 N -1.73 -0.03 -0.16 2.61 2.01 -1.22 -4.97 115.64 112.16 3hm2 s THR 143 Ca 0.00 0.11 -0.06 0.00 0.31 0.00 0.00 61.69 62.05 3hm2 s THR 143 Cb 0.00 -0.22 -0.04 0.00 0.01 0.00 0.00 72.50 72.25 3hm2 s THR 143 CO 0.00 0.04 0.04 -0.63 -0.69 0.00 0.00 174.62 173.38 3hm2 s ILE 144 N 0.74 4.58 0.31 1.82 1.01 -1.26 -1.54 121.20 126.86 3hm2 s ILE 144 Ca -0.06 -0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.52 3hm2 s ILE 144 Cb -0.07 -3.03 -0.06 0.00 0.01 0.00 0.00 42.46 39.30 3hm2 s ILE 144 CO -0.04 0.50 0.05 -0.44 0.00 0.00 0.00 174.94 175.02 3hm2 s SER 145 N 0.11 2.29 0.00 3.58 0.01 -0.64 -4.98 113.70 114.07 3hm2 s SER 145 Ca 0.04 -1.36 0.02 0.00 1.31 0.00 0.00 55.95 55.95 3hm2 s SER 145 Cb -0.13 -0.07 -0.01 0.00 0.21 0.00 0.00 66.02 66.03 3hm2 s SER 145 CO 0.01 -0.60 -0.05 -0.94 0.41 0.00 0.00 173.24 172.07 3hm2 s SER 146 N -3.47 0.64 -0.25 2.44 1.04 -1.26 -2.28 113.70 110.56 3hm2 s SER 146 Ca 0.36 -0.15 -0.01 0.00 0.48 0.00 0.00 55.95 56.63 3hm2 s SER 146 Cb 0.08 -0.06 0.07 0.00 0.10 0.00 0.00 66.02 66.22 3hm2 s SER 146 CO 0.15 0.03 0.03 -0.36 0.98 0.00 0.00 173.24 174.07 3hm2 s PHE 147 N -0.27 1.78 -0.38 5.02 0.40 0.51 -4.96 117.98 120.08 3hm2 s PHE 147 Ca 0.01 -1.50 -0.17 0.00 -0.60 0.00 0.00 56.93 54.67 3hm2 s PHE 147 Cb -0.03 -1.49 0.01 0.00 0.51 0.00 0.00 43.02 42.01 3hm2 s PHE 147 CO -0.00 -0.76 0.42 0.00 0.70 0.00 0.00 175.22 175.58 3hm2 s ALA 148 N 1.60 3.46 -0.20 5.36 0.00 -1.26 -1.21 121.76 129.51 3hm2 s ALA 148 Ca 0.01 -1.34 -0.03 0.00 0.00 0.00 0.00 51.96 50.60 3hm2 s ALA 148 Cb -0.18 -2.96 -0.01 0.00 0.00 0.00 0.00 23.12 19.97 3hm2 s ALA 148 CO -0.13 -1.35 -0.06 0.42 0.00 0.00 0.00 175.76 174.65 3hm2 s ILE 149 N 2.13 3.35 0.02 0.00 1.01 -1.26 -4.97 121.20 121.47 3hm2 s ILE 149 Ca 0.13 -0.51 0.04 0.00 0.00 0.00 0.00 60.65 60.30 3hm2 s ILE 149 Cb -0.17 -2.50 -0.03 0.00 0.01 0.00 0.00 42.46 39.77 3hm2 s ILE 149 CO 0.13 0.45 -0.07 -0.44 0.00 0.00 0.00 174.94 175.00 3hm2 s SER 150 N 1.21 4.58 -0.03 3.58 0.01 -1.26 -0.69 113.70 121.10 3hm2 s SER 150 Ca 0.03 -0.18 0.05 0.00 1.31 0.00 0.00 55.95 57.15 3hm2 s SER 150 Cb -0.14 -1.04 -0.01 0.00 0.21 0.00 0.00 66.02 65.04 3hm2 s SER 150 CO -0.02 0.27 -0.17 -1.00 0.41 0.00 0.00 173.24 172.73 3hm2 s HIS 151 N -1.02 1.58 0.61 2.43 0.09 -0.78 -4.91 115.29 113.29 3hm2 s HIS 151 Ca 0.18 -0.37 -0.18 0.00 -0.00 0.00 0.00 55.06 54.69 3hm2 s HIS 151 Cb -0.11 -1.04 -0.05 0.00 -0.00 0.00 0.00 32.58 31.38 3hm2 s HIS 151 CO 0.08 -0.08 0.96 -0.85 -0.00 0.00 0.00 174.74 174.85 3hm2 n GLU 152 N 2.87 0.86 -3.27 1.40 0.28 -1.26 -1.27 120.64 120.26 3hm2 n GLU 152 Ca -0.16 0.34 -0.05 0.00 -0.16 0.00 0.00 57.16 57.13 3hm2 n GLU 152 Cb 0.54 -2.17 -0.05 0.00 1.43 0.00 0.00 31.44 31.19 3hm2 n GLU 152 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 3hm2 s HIS 153 N -1.53 -1.17 -0.74 -1.84 2.46 -0.23 -4.78 115.29 107.47 3hm2 s HIS 153 Ca 0.76 0.90 -0.13 0.00 0.47 0.00 0.00 55.06 57.07 3hm2 s HIS 153 Cb -0.41 0.12 0.19 0.00 -0.13 0.00 0.00 32.58 32.35 3hm2 s HIS 153 CO 0.47 -0.87 0.67 0.99 -2.47 0.00 0.00 174.74 173.52 3hm2 s THR 154 N 2.64 5.27 -0.70 0.89 2.01 -1.26 -2.13 115.64 122.36 3hm2 s THR 154 Ca 0.13 -2.34 -0.24 0.00 0.31 0.00 0.00 61.69 59.55 3hm2 s THR 154 Cb -0.14 -4.30 0.06 0.00 0.01 0.00 0.00 72.50 68.13 3hm2 s THR 154 CO -0.22 -0.97 1.09 -0.69 -0.69 0.00 0.00 174.62 173.13 3hm2 s VAL 155 N 0.43 4.11 0.00 3.82 1.01 -0.75 -4.86 120.40 124.15 3hm2 s VAL 155 Ca 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.02 3hm2 s VAL 155 Cb -0.15 -4.78 0.00 0.00 0.00 0.00 0.00 36.38 31.45 3hm2 s VAL 155 CO -0.06 -1.61 0.00 0.61 0.00 0.00 0.00 175.10 174.04 3hm2 n GLY 156 N 5.37 1.53 0.48 4.51 0.00 -1.26 -2.44 105.19 113.38 3hm2 n GLY 156 Ca -0.00 0.13 0.09 0.00 0.00 0.00 0.00 46.02 46.24 3hm2 n GLY 156 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hm2 n SER 157 N 7.42 1.93 -3.91 1.61 3.41 -1.26 -4.96 113.62 117.86 3hm2 n SER 157 Ca 0.00 -1.47 -0.25 0.00 -0.26 0.00 0.00 58.87 56.90 3hm2 n SER 157 Cb 0.00 0.40 -0.17 0.00 -0.26 0.00 0.00 64.21 64.18 3hm2 n SER 157 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3hm2 s PHE 158 N -2.05 1.22 0.25 7.33 0.08 -1.02 -5.12 117.98 118.67 3hm2 s PHE 158 Ca 0.17 -0.52 -0.24 0.00 0.12 0.00 0.00 56.93 56.46 3hm2 s PHE 158 Cb 0.15 -1.03 -0.09 0.00 -0.57 0.00 0.00 43.02 41.48 3hm2 s PHE 158 CO 0.44 -0.38 0.83 0.42 -0.10 0.00 0.00 175.22 176.43 3hm2 s ILE 159 N 1.40 4.36 0.00 0.64 1.01 -1.26 -1.82 121.20 125.53 3hm2 s ILE 159 Ca -0.02 1.63 0.00 0.00 0.00 0.00 0.00 60.65 62.26 3hm2 s ILE 159 Cb -0.13 -4.00 0.00 0.00 0.01 0.00 0.00 42.46 38.33 3hm2 s ILE 159 CO -0.04 0.26 0.00 0.35 0.00 0.00 0.00 174.94 175.51 3hm2 n THR 160 N 0.87 0.00 -3.52 2.92 -2.24 -0.91 -4.95 114.28 106.45 3hm2 n THR 160 Ca -0.01 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.76 3hm2 n THR 160 Cb 0.50 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.68 3hm2 n THR 160 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3hm2 s LYS 162 N 2.73 0.41 0.04 -0.78 2.20 -0.39 -1.06 119.74 122.87 3hm2 s LYS 162 Ca 0.00 0.92 -0.30 0.00 -0.36 0.00 0.00 55.97 56.23 3hm2 s LYS 162 Cb 0.00 0.44 -0.05 0.00 -1.51 0.00 0.00 37.83 36.72 3hm2 s LYS 162 CO 0.00 -0.12 1.09 -1.25 -0.36 0.00 0.00 175.35 174.70 3hm2 s PRO 163 N 2.26 4.51 0.98 4.03 0.05 -1.26 -1.87 135.00 143.69 3hm2 s PRO 163 Ca -0.05 1.59 -0.12 0.00 0.05 0.00 0.00 61.00 62.47 3hm2 s PRO 163 Cb -0.07 -3.40 0.18 0.00 0.05 0.00 0.00 34.50 31.26 3hm2 s PRO 163 CO -0.17 -0.13 1.09 0.00 0.05 0.00 0.00 177.00 177.83 3hm2 s ALA 164 N 0.94 1.02 0.31 8.56 0.00 0.13 -4.98 121.76 127.75 3hm2 s ALA 164 Ca 0.55 -0.17 -0.29 0.00 0.00 0.00 0.00 51.96 52.05 3hm2 s ALA 164 Cb -0.25 -3.18 -0.10 0.00 0.00 0.00 0.00 23.12 19.59 3hm2 s ALA 164 CO 0.29 -2.77 1.25 -0.51 0.00 0.00 0.00 175.76 174.02 3hm2 s LEU 165 N -6.47 4.46 0.77 0.00 1.43 -1.26 -4.60 118.68 113.01 3hm2 s LEU 165 Ca 0.65 2.56 -0.13 0.00 -1.03 0.00 0.00 54.13 56.19 3hm2 s LEU 165 Cb -0.19 -3.64 0.06 0.00 0.03 0.00 0.00 46.19 42.45 3hm2 s LEU 165 CO 0.58 -0.43 1.14 -2.84 0.23 0.00 0.00 176.35 175.03 3hm2 s PRO 166 N -1.60 2.02 -0.07 1.29 0.02 -1.26 -4.78 135.00 130.62 3hm2 s PRO 166 Ca 0.48 1.49 0.04 0.00 0.02 0.00 0.00 61.00 63.03 3hm2 s PRO 166 Cb -0.38 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.30 3hm2 s PRO 166 CO 0.49 -1.87 -0.19 0.08 -0.33 0.00 0.00 177.00 175.18 3hm2 s VAL 167 N -2.45 1.59 -0.01 3.83 1.01 -0.35 -4.67 120.40 119.36 3hm2 s VAL 167 Ca 0.68 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.91 3hm2 s VAL 167 Cb -0.23 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.73 3hm2 s VAL 167 CO 0.50 0.46 -0.07 -1.00 0.00 0.00 0.00 175.10 174.99 3hm2 s HIS 168 N 0.25 2.89 -0.13 5.22 3.76 -0.58 -0.37 115.29 126.33 3hm2 s HIS 168 Ca -0.10 -0.03 -0.04 0.00 -0.15 0.00 0.00 55.06 54.73 3hm2 s HIS 168 Cb -0.15 -1.63 0.07 0.00 1.11 0.00 0.00 32.58 31.99 3hm2 s HIS 168 CO 0.05 0.36 0.24 -1.14 -0.85 0.00 0.00 174.74 173.40 3hm2 s GLN 169 N -1.30 0.14 -0.27 1.40 0.74 -0.97 0.17 119.66 119.57 3hm2 s GLN 169 Ca 0.16 0.65 -0.09 0.00 0.05 0.00 0.00 55.36 56.13 3hm2 s GLN 169 Cb -0.11 -0.22 -0.03 0.00 1.10 0.00 0.00 33.01 33.75 3hm2 s GLN 169 CO 0.06 -0.34 0.13 -0.46 -0.55 0.00 0.00 175.29 174.13 3hm2 s TRP 170 N 2.39 3.15 -0.28 1.67 -0.00 0.21 -1.62 118.94 124.45 3hm2 s TRP 170 Ca 0.02 -0.29 0.02 0.00 -0.00 0.00 0.00 56.10 55.86 3hm2 s TRP 170 Cb -0.12 -2.31 0.08 0.00 -0.00 0.00 0.00 33.47 31.11 3hm2 s TRP 170 CO -0.09 -0.32 -0.02 0.99 -0.00 0.00 0.00 176.95 177.51 3hm2 s THR 171 N 1.66 1.90 0.18 5.86 2.01 -0.59 -0.31 115.64 126.35 3hm2 s THR 171 Ca 0.06 -1.72 0.07 0.00 0.31 0.00 0.00 61.69 60.41 3hm2 s THR 171 Cb -0.16 -2.21 -0.04 0.00 0.01 0.00 0.00 72.50 70.09 3hm2 s THR 171 CO 0.07 -0.29 -0.14 0.54 -0.69 0.00 0.00 174.62 174.11 3hm2 s VAL 172 N 1.17 1.55 -0.08 3.82 0.11 -1.08 -3.38 120.40 122.52 3hm2 s VAL 172 Ca 0.00 -2.10 0.00 0.00 -2.93 0.00 0.00 61.98 56.95 3hm2 s VAL 172 Cb -0.19 -1.92 -0.03 0.00 -1.53 0.00 0.00 36.38 32.71 3hm2 s VAL 172 CO -0.08 -0.60 -0.06 -0.69 -3.33 0.00 0.00 175.10 170.34 3hm2 s VAL 173 N -2.91 3.81 0.34 2.04 1.01 -1.26 -2.08 120.40 121.35 3hm2 s VAL 173 Ca 0.19 -0.44 0.05 0.00 0.00 0.00 0.00 61.98 61.78 3hm2 s VAL 173 Cb -0.01 -2.57 -0.01 0.00 0.00 0.00 0.00 36.38 33.79 3hm2 s VAL 173 CO 0.05 0.59 0.49 -0.75 0.00 0.00 0.00 175.10 175.48 3hm2 s LYS 174 N -0.74 3.20 0.00 2.72 2.20 0.19 -4.83 119.74 122.48 3hm2 s LYS 174 Ca 0.11 -0.82 0.00 0.00 -0.36 0.00 0.00 55.97 54.90 3hm2 s LYS 174 Cb -0.11 -2.78 0.00 0.00 -1.51 0.00 0.00 37.83 33.43 3hm2 s LYS 174 CO 0.02 0.08 0.00 0.00 -0.36 0.00 0.00 175.35 175.09