#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 2.35 -0.03 1.61 6.02 -1.26 -3.75 117.38 122.32 3hm2 n GLN 4 Ca 0.00 -2.06 0.01 0.00 -0.01 0.00 0.00 57.00 54.94 3hm2 n GLN 4 Cb 0.00 -1.48 -0.10 0.00 1.02 0.00 0.00 30.24 29.68 3hm2 n GLN 4 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3hm2 n LEU 5 N 1.23 0.00 0.09 1.08 4.77 -1.26 -1.42 117.00 121.49 3hm2 n LEU 5 Ca 0.19 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 56.18 3hm2 n LEU 5 Cb 0.53 0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.73 3hm2 n LEU 5 CO 0.15 0.14 0.09 0.71 -1.33 0.00 0.00 177.39 177.15 3hm2 h THR 6 N 0.00 0.70 0.00 -5.08 1.35 -1.98 -2.28 112.91 105.62 3hm2 h THR 6 Ca -0.15 -2.12 -0.05 0.00 -0.55 0.00 0.00 66.41 63.53 3hm2 h THR 6 Cb 1.13 2.23 -0.01 0.00 -1.73 0.00 0.00 68.15 69.77 3hm2 h THR 6 CO 0.01 0.40 -0.25 0.11 -0.25 0.00 0.00 175.52 175.53 3hm2 h LYS 7 N 0.00 0.00 0.00 4.72 1.57 -1.65 0.21 116.57 121.43 3hm2 h LYS 7 Ca -0.08 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 3hm2 h LYS 7 Cb 1.48 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.79 3hm2 h LYS 7 CO 0.06 0.25 -0.09 0.37 -0.57 0.00 0.00 179.45 179.48 3hm2 h GLN 8 N 0.00 0.00 0.00 3.15 4.15 -1.32 -3.33 115.11 117.75 3hm2 h GLN 8 Ca -0.00 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 3hm2 h GLN 8 Cb 0.88 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.57 3hm2 h GLN 8 CO 0.03 0.78 -0.11 0.45 -1.93 0.00 0.00 178.83 178.06 3hm2 h HIS 9 N -1.00 0.00 -0.05 3.99 3.86 -1.31 -2.07 115.15 118.57 3hm2 h HIS 9 Ca -0.02 0.00 -0.24 0.00 -1.16 0.00 0.00 60.37 58.95 3hm2 h HIS 9 Cb 0.81 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.29 3hm2 h HIS 9 CO 0.20 0.11 -0.90 0.28 0.86 0.00 0.00 177.93 178.47 3hm2 h VAL 10 N 0.00 1.30 -0.02 2.45 2.07 -0.77 -2.75 116.25 118.52 3hm2 h VAL 10 Ca -0.00 -2.13 0.03 0.00 0.82 0.00 0.00 66.70 65.42 3hm2 h VAL 10 Cb 0.19 2.29 -0.04 0.00 -1.52 0.00 0.00 31.29 32.21 3hm2 h VAL 10 CO 0.01 0.66 -0.20 0.03 0.02 0.00 0.00 177.57 178.10 3hm2 h ARG 11 N 0.37 -0.29 -0.61 1.57 3.08 -1.59 -2.24 114.38 114.67 3hm2 h ARG 11 Ca -0.10 0.02 0.12 0.00 0.07 0.00 0.00 59.98 60.09 3hm2 h ARG 11 Cb 1.56 0.07 -0.12 0.00 0.08 0.00 0.00 29.97 31.56 3hm2 h ARG 11 CO 0.18 -0.19 -0.23 0.00 -1.07 0.00 0.00 179.97 178.65 3hm2 h ALA 12 N 0.62 0.22 -0.07 0.04 0.00 -1.35 0.30 119.26 119.02 3hm2 h ALA 12 Ca 0.07 0.21 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 3hm2 h ALA 12 Cb 0.39 0.61 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 3hm2 h ALA 12 CO -0.20 -0.53 -0.27 -0.07 0.00 0.00 0.00 179.25 178.18 3hm2 h LEU 13 N -0.08 0.13 -0.19 0.00 3.38 -1.35 -0.97 115.31 116.23 3hm2 h LEU 13 Ca 0.28 -0.04 -0.22 0.00 0.09 0.00 0.00 57.88 57.98 3hm2 h LEU 13 Cb 0.51 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.23 3hm2 h LEU 13 CO -0.66 0.41 -0.86 0.00 0.09 0.00 0.00 178.44 177.42 3hm2 h ALA 14 N 1.61 0.35 0.14 1.53 0.00 -0.47 -1.86 119.26 120.56 3hm2 h ALA 14 Ca 0.02 -0.64 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 3hm2 h ALA 14 Cb 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3hm2 h ALA 14 CO 0.04 0.73 -0.07 0.82 0.00 0.00 0.00 179.25 180.77 3hm2 h ILE 15 N 0.39 0.97 -0.55 0.00 1.08 -0.05 -1.76 117.51 117.59 3hm2 h ILE 15 Ca -0.07 -0.50 0.15 0.00 -0.39 0.00 0.00 64.86 64.06 3hm2 h ILE 15 Cb 1.48 1.28 -0.02 0.00 -3.07 0.00 0.00 36.82 36.48 3hm2 h ILE 15 CO 0.16 0.12 0.39 0.77 -0.69 0.00 0.00 178.15 178.90 3hm2 h SER 16 N -0.43 0.03 0.48 1.72 4.64 -1.20 -1.31 113.55 117.48 3hm2 h SER 16 Ca -0.02 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.04 3hm2 h SER 16 Cb 0.34 -0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.43 3hm2 h SER 16 CO 0.03 0.02 -1.14 0.00 -0.87 0.00 0.00 176.83 174.87 3hm2 h ALA 17 N 1.73 0.18 0.00 5.18 0.00 -1.14 -3.30 119.26 121.91 3hm2 h ALA 17 Ca 0.26 -0.81 -0.10 0.00 0.00 0.00 0.00 54.91 54.26 3hm2 h ALA 17 Cb 1.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 3hm2 h ALA 17 CO -0.01 0.88 -0.46 -0.07 0.00 0.00 0.00 179.25 179.59 3hm2 h LEU 18 N 0.15 0.00 -2.41 0.00 3.38 -0.33 -3.48 115.31 112.61 3hm2 h LEU 18 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3hm2 h LEU 18 Cb 1.83 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.58 3hm2 h LEU 18 CO 0.19 0.46 -0.10 0.00 0.09 0.00 0.00 178.44 179.08 3hm2 n ALA 19 N -2.35 -2.54 -2.32 1.53 0.00 -1.05 -4.91 120.51 108.87 3hm2 n ALA 19 Ca -0.01 0.25 -0.42 0.00 0.00 0.00 0.00 53.44 53.27 3hm2 n ALA 19 Cb 0.54 -1.84 -0.03 0.00 0.00 0.00 0.00 19.45 18.12 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 -2.87 4.51 0.21 0.00 0.02 -1.26 -5.04 135.00 130.56 3hm2 s PRO 20 Ca 0.05 1.71 -0.01 0.00 0.02 0.00 0.00 61.00 62.78 3hm2 s PRO 20 Cb -0.01 -3.33 -0.04 0.00 0.02 0.00 0.00 34.50 31.13 3hm2 s PRO 20 CO 0.68 -0.11 0.12 0.15 -0.33 0.00 0.00 177.00 177.51 3hm2 s LYS 21 N 0.50 1.23 0.48 5.54 1.02 -1.26 -5.08 119.74 122.17 3hm2 s LYS 21 Ca 0.54 -1.65 -0.24 0.00 0.02 0.00 0.00 55.97 54.65 3hm2 s LYS 21 Cb -0.29 0.17 -0.07 0.00 -0.52 0.00 0.00 37.83 37.13 3hm2 s LYS 21 CO 0.31 -0.37 1.32 -2.14 -0.92 0.00 0.00 175.35 173.55 3hm2 s PRO 22 N -4.13 3.57 -1.46 -1.68 0.02 -1.26 -2.68 135.00 127.38 3hm2 s PRO 22 Ca 0.38 2.15 -0.00 0.00 0.02 0.00 0.00 61.00 63.56 3hm2 s PRO 22 Cb 0.07 -2.48 0.00 0.00 0.02 0.00 0.00 34.50 32.11 3hm2 s PRO 22 CO 0.12 -0.82 0.01 0.72 -0.33 0.00 0.00 177.00 176.71 3hm2 n HIS 23 N -0.48 -0.84 -3.91 6.54 8.25 -1.13 -5.01 115.22 118.65 3hm2 n HIS 23 Ca 0.07 0.01 -0.33 0.00 -0.26 0.00 0.00 57.72 57.21 3hm2 n HIS 23 Cb 0.45 -3.45 -0.05 0.00 1.12 0.00 0.00 29.99 28.06 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 -4.87 3.43 -0.22 -0.41 2.02 -1.09 -4.99 118.70 112.58 3hm2 s GLU 24 Ca 0.01 -0.34 0.02 0.00 0.02 0.00 0.00 54.97 54.68 3hm2 s GLU 24 Cb -0.00 -3.09 0.04 0.00 0.10 0.00 0.00 34.13 31.18 3hm2 s GLU 24 CO 0.01 0.67 -0.15 0.99 0.02 0.00 0.00 175.26 176.80 3hm2 s THR 25 N -1.35 2.06 -0.04 3.63 2.01 -1.25 -2.71 115.64 117.99 3hm2 s THR 25 Ca 0.28 -1.25 -0.25 0.00 0.31 0.00 0.00 61.69 60.78 3hm2 s THR 25 Cb -0.13 -2.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.32 3hm2 s THR 25 CO 0.20 0.25 0.75 -0.22 -0.69 0.00 0.00 174.62 174.91 3hm2 s LEU 26 N 1.22 4.34 -0.31 4.42 2.96 -0.95 0.03 118.68 130.38 3hm2 s LEU 26 Ca -0.02 1.29 -0.22 0.00 -0.22 0.00 0.00 54.13 54.97 3hm2 s LEU 26 Cb -0.16 -3.18 -0.00 0.00 0.50 0.00 0.00 46.19 43.34 3hm2 s LEU 26 CO -0.09 -0.13 0.71 0.26 -1.32 0.00 0.00 176.35 175.78 3hm2 s TRP 27 N 0.75 3.20 -0.45 5.38 0.52 0.48 0.15 118.94 128.96 3hm2 s TRP 27 Ca 0.40 0.66 -0.09 0.00 0.02 0.00 0.00 56.10 57.09 3hm2 s TRP 27 Cb -0.19 -3.12 0.10 0.00 -1.15 0.00 0.00 33.47 29.11 3hm2 s TRP 27 CO 0.20 -0.54 0.31 0.34 0.02 0.00 0.00 176.95 177.28 3hm2 s ASP 28 N 1.66 5.69 -0.07 2.95 2.15 0.16 -0.23 116.67 128.98 3hm2 s ASP 28 Ca 0.28 -1.73 0.03 0.00 0.43 0.00 0.00 52.55 51.57 3hm2 s ASP 28 Cb -0.14 -2.01 -0.02 0.00 -0.30 0.00 0.00 42.92 40.45 3hm2 s ASP 28 CO 0.13 -0.63 -0.14 -0.63 -0.17 0.00 0.00 175.17 173.72 3hm2 s ILE 29 N 1.40 3.03 0.00 4.11 1.01 -0.14 -3.48 121.20 127.12 3hm2 s ILE 29 Ca 0.04 -0.72 0.00 0.00 0.00 0.00 0.00 60.65 59.97 3hm2 s ILE 29 Cb -0.25 -2.20 0.00 0.00 0.01 0.00 0.00 42.46 40.02 3hm2 s ILE 29 CO 0.01 0.57 0.00 0.61 0.00 0.00 0.00 174.94 176.13 3hm2 n GLY 30 N 2.62 -1.22 2.48 6.18 0.00 -1.26 -3.22 105.19 110.77 3hm2 n GLY 30 Ca -0.17 -1.95 -0.42 0.00 0.00 0.00 0.00 46.02 43.47 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 -0.12 3.68 -0.02 0.00 -1.26 -1.65 105.19 105.81 3hm2 n GLY 31 Ca 0.00 0.57 -0.23 0.00 0.00 0.00 0.00 46.02 46.36 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 1.42 -0.38 3.63 -0.02 0.00 -1.26 -4.75 105.19 103.84 3hm2 n GLY 32 Ca 0.16 0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.90 3hm2 n GLY 32 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hm2 n SER 33 N -3.02 3.69 0.00 1.61 3.41 -0.66 -2.59 113.62 116.06 3hm2 n SER 33 Ca -0.19 0.59 0.00 0.00 -0.26 0.00 0.00 58.87 59.01 3hm2 n SER 33 Cb 0.63 -1.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.05 3hm2 n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hm2 n GLY 34 N 5.13 4.27 0.35 5.00 0.00 -1.26 -4.91 105.19 113.77 3hm2 n GLY 34 Ca 0.25 -0.73 -0.07 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.19 1.00 1.61 0.02 -1.86 -1.09 113.55 114.04 3hm2 h SER 35 Ca 0.00 0.21 -0.12 0.00 -0.84 0.00 0.00 61.79 61.04 3hm2 h SER 35 Cb 0.00 0.56 -0.02 0.00 0.14 0.00 0.00 62.40 63.08 3hm2 h SER 35 CO 0.00 -0.32 -0.59 0.40 -1.14 0.00 0.00 176.83 175.17 3hm2 h ILE 36 N -0.23 1.17 0.02 3.27 1.08 -1.95 -3.28 117.51 117.59 3hm2 h ILE 36 Ca 0.19 -2.23 -0.00 0.00 -0.39 0.00 0.00 64.86 62.42 3hm2 h ILE 36 Cb 0.55 2.30 0.00 0.00 -3.07 0.00 0.00 36.82 36.60 3hm2 h ILE 36 CO -0.60 0.58 -0.01 0.00 -0.69 0.00 0.00 178.15 177.43 3hm2 h ALA 37 N 1.41 -0.03 0.00 1.87 0.00 -1.64 0.18 119.26 121.06 3hm2 h ALA 37 Ca -0.01 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 3hm2 h ALA 37 Cb 1.25 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 3hm2 h ALA 37 CO 0.08 -0.22 -0.31 0.82 0.00 0.00 0.00 179.25 179.62 3hm2 h ILE 38 N -0.62 0.69 0.03 0.00 5.03 -1.41 0.30 117.51 121.54 3hm2 h ILE 38 Ca -0.00 -1.39 -0.05 0.00 -0.12 0.00 0.00 64.86 63.29 3hm2 h ILE 38 Cb 0.58 1.91 0.01 0.00 -3.03 0.00 0.00 36.82 36.28 3hm2 h ILE 38 CO 0.00 0.30 -0.21 -0.08 -0.68 0.00 0.00 178.15 177.48 3hm2 h GLU 39 N 0.00 0.09 -0.84 2.37 4.57 -1.61 0.20 114.58 119.36 3hm2 h GLU 39 Ca -0.00 -0.14 0.21 0.00 -1.18 0.00 0.00 59.36 58.25 3hm2 h GLU 39 Cb 0.88 0.05 -0.14 0.00 -0.16 0.00 0.00 28.75 29.38 3hm2 h GLU 39 CO 0.04 1.04 0.08 2.35 -1.18 0.00 0.00 179.01 181.33 3hm2 h TRP 40 N -0.79 0.07 -0.11 0.92 2.91 -0.39 0.33 115.95 118.89 3hm2 h TRP 40 Ca -0.04 0.06 -0.21 0.00 1.13 0.00 0.00 58.89 59.83 3hm2 h TRP 40 Cb 1.14 0.10 0.01 0.00 -0.51 0.00 0.00 29.16 29.90 3hm2 h TRP 40 CO 0.25 -0.26 -0.77 -0.07 -1.03 0.00 0.00 178.44 176.55 3hm2 h LEU 41 N 0.12 0.87 -3.22 0.65 3.38 -0.43 -3.21 115.31 113.46 3hm2 h LEU 41 Ca 0.49 -0.66 -0.30 0.00 0.09 0.00 0.00 57.88 57.50 3hm2 h LEU 41 Cb 0.93 -0.26 -0.16 0.00 0.09 0.00 0.00 40.66 41.26 3hm2 h LEU 41 CO -0.71 1.39 0.39 -1.14 0.09 0.00 0.00 178.44 178.46 3hm2 n ARG 42 N -3.99 1.74 0.00 1.13 0.63 0.71 -3.40 116.66 113.48 3hm2 n ARG 42 Ca -0.08 -1.64 0.00 0.00 -0.92 0.00 0.00 57.85 55.21 3hm2 n ARG 42 Cb 0.74 -1.64 0.00 0.00 0.45 0.00 0.00 32.46 32.01 3hm2 n ARG 42 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 3hm2 n SER 43 N -0.16 0.04 -3.43 6.15 3.41 -0.05 -4.88 113.62 114.70 3hm2 n SER 43 Ca 0.32 -0.02 -0.15 0.00 -0.26 0.00 0.00 58.87 58.77 3hm2 n SER 43 Cb 0.93 0.05 -0.11 0.00 -0.26 0.00 0.00 64.21 64.82 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 -0.05 -0.44 0.43 6.66 2.01 -1.22 -5.08 115.64 117.94 3hm2 s THR 44 Ca 0.00 -0.15 -0.21 0.00 0.31 0.00 0.00 61.69 61.63 3hm2 s THR 44 Cb 0.00 -0.77 -0.14 0.00 0.01 0.00 0.00 72.50 71.60 3hm2 s THR 44 CO 0.00 -0.21 0.35 -0.81 -0.69 0.00 0.00 174.62 173.25 3hm2 n PRO 45 N 5.33 0.32 -2.61 4.92 -0.04 -1.26 -4.09 135.00 137.58 3hm2 n PRO 45 Ca -0.04 0.12 -0.01 0.00 -0.04 0.00 0.00 63.50 63.53 3hm2 n PRO 45 Cb 0.49 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.65 3hm2 n PRO 45 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3hm2 n GLN 46 N 0.86 -0.99 -3.59 0.54 6.02 -1.26 -4.83 117.38 114.12 3hm2 n GLN 46 Ca 0.11 1.14 -0.16 0.00 -0.01 0.00 0.00 57.00 58.08 3hm2 n GLN 46 Cb 0.41 -4.50 -0.07 0.00 1.02 0.00 0.00 30.24 27.10 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 -3.03 0.01 -0.03 5.09 -4.23 -1.26 -2.85 115.64 109.35 3hm2 s THR 47 Ca 0.03 -0.11 0.07 0.00 -1.18 0.00 0.00 61.69 60.51 3hm2 s THR 47 Cb -0.00 -0.89 -0.02 0.00 1.34 0.00 0.00 72.50 72.93 3hm2 s THR 47 CO 0.52 -0.06 -0.26 0.42 -0.54 0.00 0.00 174.62 174.71 3hm2 s THR 48 N -1.02 2.05 0.13 3.99 -4.23 -1.10 -4.77 115.64 110.69 3hm2 s THR 48 Ca -0.10 -1.09 0.10 0.00 -1.18 0.00 0.00 61.69 59.41 3hm2 s THR 48 Cb -0.02 -1.71 -0.04 0.00 1.34 0.00 0.00 72.50 72.07 3hm2 s THR 48 CO 0.07 0.58 -0.20 0.00 -0.54 0.00 0.00 174.62 174.53 3hm2 s ALA 49 N -0.44 2.62 -0.08 3.99 0.00 -0.18 -2.24 121.76 125.43 3hm2 s ALA 49 Ca 0.05 -1.40 0.05 0.00 0.00 0.00 0.00 51.96 50.65 3hm2 s ALA 49 Cb -0.11 -0.57 -0.00 0.00 0.00 0.00 0.00 23.12 22.43 3hm2 s ALA 49 CO 0.01 0.57 -0.24 0.08 0.00 0.00 0.00 175.76 176.18 3hm2 s VAL 50 N -1.18 1.99 0.04 0.00 1.01 0.39 -2.35 120.40 120.31 3hm2 s VAL 50 Ca 0.17 -1.00 0.06 0.00 0.00 0.00 0.00 61.98 61.21 3hm2 s VAL 50 Cb -0.10 -1.71 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 3hm2 s VAL 50 CO 0.09 0.55 -0.15 0.00 0.00 0.00 0.00 175.10 175.60 3hm2 s PHE 52 N -0.99 1.17 -0.06 0.00 0.40 -1.23 -0.22 117.98 117.06 3hm2 s PHE 52 Ca 0.16 -1.81 0.06 0.00 -0.60 0.00 0.00 56.93 54.73 3hm2 s PHE 52 Cb -0.11 -1.30 -0.01 0.00 0.51 0.00 0.00 43.02 42.11 3hm2 s PHE 52 CO 0.07 -0.82 -0.24 -2.00 0.70 0.00 0.00 175.22 172.93 3hm2 s GLU 53 N 1.00 2.59 0.10 0.44 2.56 -0.69 -4.25 118.70 120.45 3hm2 s GLU 53 Ca 0.16 -0.89 -0.13 0.00 0.00 0.00 0.00 54.97 54.11 3hm2 s GLU 53 Cb -0.22 -2.19 -0.15 0.00 2.00 0.00 0.00 34.13 33.56 3hm2 s GLU 53 CO -0.05 0.38 1.31 0.97 -0.56 0.00 0.00 175.26 177.31 3hm2 h ILE 54 N 5.06 1.29 -2.97 -3.70 2.10 -1.85 -3.10 117.51 114.33 3hm2 h ILE 54 Ca -0.32 -1.90 -0.55 0.00 1.08 0.00 0.00 64.86 63.16 3hm2 h ILE 54 Cb 1.18 1.95 -0.02 0.00 -1.09 0.00 0.00 36.82 38.84 3hm2 h ILE 54 CO 0.47 0.60 0.81 -0.55 -1.08 0.00 0.00 178.15 178.41 3hm2 s SER 55 N -7.02 6.96 0.29 2.19 0.15 -1.26 -4.79 113.70 110.22 3hm2 s SER 55 Ca -0.11 1.86 -0.01 0.00 0.70 0.00 0.00 55.95 58.39 3hm2 s SER 55 Cb 0.08 -2.55 0.48 0.00 -1.71 0.00 0.00 66.02 62.32 3hm2 s SER 55 CO 0.89 -0.68 1.90 1.05 1.20 0.00 0.00 173.24 177.60 3hm2 h GLU 56 N 7.88 1.07 -0.05 5.44 4.11 -2.01 -1.88 114.58 129.13 3hm2 h GLU 56 Ca -0.33 -0.06 -0.13 0.00 0.07 0.00 0.00 59.36 58.91 3hm2 h GLU 56 Cb 1.15 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 3hm2 h GLU 56 CO 0.92 0.71 -0.56 0.93 0.07 0.00 0.00 179.01 181.07 3hm2 h GLU 57 N 1.10 0.16 0.02 1.06 4.39 -2.00 -2.82 114.58 116.48 3hm2 h GLU 57 Ca 0.41 -0.10 -0.21 0.00 0.34 0.00 0.00 59.36 59.80 3hm2 h GLU 57 Cb 0.18 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 3hm2 h GLU 57 CO -0.16 0.68 -0.93 0.00 -1.16 0.00 0.00 179.01 177.45 3hm2 h ARG 58 N 0.12 0.19 -0.43 2.33 3.08 -1.86 -3.15 114.38 114.66 3hm2 h ARG 58 Ca -0.00 -0.23 -0.08 0.00 0.07 0.00 0.00 59.98 59.74 3hm2 h ARG 58 Cb 1.03 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.13 3hm2 h ARG 58 CO 0.08 0.99 -0.05 0.00 -1.07 0.00 0.00 179.97 179.92 3hm2 h ARG 59 N 0.10 0.73 0.00 0.04 3.08 -1.26 -2.50 114.38 114.57 3hm2 h ARG 59 Ca -0.05 -0.21 -0.04 0.00 0.07 0.00 0.00 59.98 59.75 3hm2 h ARG 59 Cb 1.58 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.54 3hm2 h ARG 59 CO 0.14 0.78 -0.18 0.93 -1.07 0.00 0.00 179.97 180.57 3hm2 h GLU 60 N 0.68 0.00 0.00 0.04 5.08 -1.50 -2.95 114.58 115.93 3hm2 h GLU 60 Ca 0.13 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.33 3hm2 h GLU 60 Cb 0.49 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 3hm2 h GLU 60 CO 0.03 0.18 -1.37 -0.09 -1.00 0.00 0.00 179.01 176.76 3hm2 h ARG 61 N 0.00 0.00 0.12 2.33 9.65 -1.45 -2.92 114.38 122.11 3hm2 h ARG 61 Ca -0.00 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.87 3hm2 h ARG 61 Cb 0.33 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.91 3hm2 h ARG 61 CO 0.02 0.27 -0.06 0.82 2.80 0.00 0.00 179.97 183.82 3hm2 h ILE 62 N 0.00 1.06 -0.41 1.20 2.04 -1.38 -2.71 117.51 117.30 3hm2 h ILE 62 Ca -0.15 -0.86 -0.07 0.00 1.00 0.00 0.00 64.86 64.77 3hm2 h ILE 62 Cb 1.54 1.59 -0.02 0.00 -0.74 0.00 0.00 36.82 39.19 3hm2 h ILE 62 CO 0.04 0.20 -0.04 0.25 0.00 0.00 0.00 178.15 178.60 3hm2 h LEU 63 N -0.58 0.67 -0.79 1.44 5.85 -1.68 -0.84 115.31 119.38 3hm2 h LEU 63 Ca -0.02 -0.16 0.14 0.00 0.84 0.00 0.00 57.88 58.68 3hm2 h LEU 63 Cb 0.46 -0.18 -0.09 0.00 0.37 0.00 0.00 40.66 41.22 3hm2 h LEU 63 CO 0.03 0.76 0.36 -1.28 -0.34 0.00 0.00 178.44 177.97 3hm2 h SER 64 N 0.64 0.38 1.12 1.25 0.87 -1.53 -0.57 113.55 115.72 3hm2 h SER 64 Ca 0.12 0.10 -0.18 0.00 -1.23 0.00 0.00 61.79 60.60 3hm2 h SER 64 Cb 0.47 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.45 3hm2 h SER 64 CO 0.02 0.16 -0.88 0.78 -0.53 0.00 0.00 176.83 176.38 3hm2 h ASN 65 N 0.52 0.00 -0.45 6.23 2.35 -1.01 -2.07 115.58 121.14 3hm2 h ASN 65 Ca 0.43 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.12 3hm2 h ASN 65 Cb 0.63 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.98 3hm2 h ASN 65 CO -0.38 0.87 0.05 0.00 -1.65 0.00 0.00 177.43 176.32 3hm2 h ALA 66 N 1.13 0.61 0.45 -0.83 0.00 -0.73 -2.17 119.26 117.72 3hm2 h ALA 66 Ca -0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3hm2 h ALA 66 Cb 1.67 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.27 3hm2 h ALA 66 CO 0.11 0.35 -0.51 0.82 0.00 0.00 0.00 179.25 180.03 3hm2 h ILE 67 N 0.63 0.02 0.00 0.00 2.04 -1.10 0.87 117.51 119.96 3hm2 h ILE 67 Ca 0.13 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.99 3hm2 h ILE 67 Cb 0.42 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.52 3hm2 h ILE 67 CO 0.01 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.75 3hm2 n ASN 68 N -5.55 0.00 -0.22 1.72 4.13 -0.78 0.15 115.26 114.71 3hm2 n ASN 68 Ca -0.12 0.00 0.10 0.00 1.68 0.00 0.00 54.58 56.25 3hm2 n ASN 68 Cb 0.46 -0.09 0.16 0.00 -1.54 0.00 0.00 39.78 38.76 3hm2 n ASN 68 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3hm2 n LEU 69 N -1.09 2.61 -1.28 3.41 4.77 -0.83 -4.96 117.00 119.62 3hm2 n LEU 69 Ca 0.02 -3.10 -0.13 0.00 -0.03 0.00 0.00 56.01 52.77 3hm2 n LEU 69 Cb 0.02 -0.45 -0.06 0.00 -2.33 0.00 0.00 43.42 40.60 3hm2 n LEU 69 CO 0.02 0.72 -0.12 0.61 -1.33 0.00 0.00 177.39 177.29 3hm2 n GLY 70 N -1.29 1.23 1.77 -0.72 0.00 0.40 -4.79 105.19 101.79 3hm2 n GLY 70 Ca 0.17 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.01 3hm2 n GLY 70 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3hm2 n VAL 71 N -1.88 2.93 0.19 1.61 0.31 0.29 -4.66 118.33 117.12 3hm2 n VAL 71 Ca -0.13 -2.76 0.06 0.00 -0.01 0.00 0.00 64.34 61.50 3hm2 n VAL 71 Cb 0.45 -0.62 0.32 0.00 -0.91 0.00 0.00 33.84 33.08 3hm2 n VAL 71 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 3hm2 h SER 72 N 1.33 0.00 -0.56 4.52 4.64 -1.56 -3.35 113.55 118.56 3hm2 h SER 72 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 3hm2 h SER 72 Cb 1.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.90 3hm2 h SER 72 CO 0.85 0.38 0.00 -0.90 -0.87 0.00 0.00 176.83 176.28 3hm2 n ASP 73 N -3.49 5.25 -0.09 4.97 3.85 -1.26 -4.00 116.55 121.77 3hm2 n ASP 73 Ca 0.00 -2.79 0.00 0.00 -0.71 0.00 0.00 54.79 51.29 3hm2 n ASP 73 Cb 0.52 -0.64 0.00 0.00 -1.35 0.00 0.00 41.12 39.66 3hm2 n ASP 73 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3hm2 n ARG 74 N 0.66 0.00 -5.04 0.11 1.74 -1.25 -5.06 116.66 107.82 3hm2 n ARG 74 Ca 0.26 -0.52 -0.29 0.00 -0.77 0.00 0.00 57.85 56.54 3hm2 n ARG 74 Cb 1.07 -0.43 -0.16 0.00 -1.02 0.00 0.00 32.46 31.91 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 0.00 1.75 -0.11 0.55 2.07 -1.26 -1.01 121.20 123.20 3hm2 s ILE 75 Ca 0.00 -0.88 -0.03 0.00 -1.41 0.00 0.00 60.65 58.33 3hm2 s ILE 75 Cb 0.00 -1.50 -0.03 0.00 0.13 0.00 0.00 42.46 41.05 3hm2 s ILE 75 CO 0.00 0.49 0.01 0.00 -1.91 0.00 0.00 174.94 173.54 3hm2 s ALA 76 N 0.12 3.31 -0.43 1.50 0.00 -0.99 -5.00 121.76 120.27 3hm2 s ALA 76 Ca -0.09 -0.79 -0.06 0.00 0.00 0.00 0.00 51.96 51.02 3hm2 s ALA 76 Cb -0.14 -1.58 0.11 0.00 0.00 0.00 0.00 23.12 21.51 3hm2 s ALA 76 CO 0.04 0.50 0.27 0.08 0.00 0.00 0.00 175.76 176.65 3hm2 s VAL 77 N -0.61 3.79 0.28 0.00 1.01 -1.26 -1.74 120.40 121.87 3hm2 s VAL 77 Ca 0.10 -1.84 0.00 0.00 0.00 0.00 0.00 61.98 60.25 3hm2 s VAL 77 Cb -0.12 -3.50 0.06 0.00 0.00 0.00 0.00 36.38 32.81 3hm2 s VAL 77 CO 0.02 -0.69 0.39 0.00 0.00 0.00 0.00 175.10 174.82 3hm2 n GLN 78 N 4.77 0.37 -0.27 2.72 1.13 0.69 -4.97 117.38 121.82 3hm2 n GLN 78 Ca -0.06 -1.08 0.00 0.00 -1.94 0.00 0.00 57.00 53.92 3hm2 n GLN 78 Cb 0.41 -0.25 0.00 0.00 0.11 0.00 0.00 30.24 30.51 3hm2 n GLN 78 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3hm2 n GLN 79 N -1.71 1.70 -2.30 -1.09 6.02 -1.25 -1.71 117.38 117.04 3hm2 n GLN 79 Ca 0.06 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.64 3hm2 n GLN 79 Cb 0.23 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.46 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 -1.52 2.57 0.75 1.08 0.00 -1.17 -3.15 107.32 105.87 3hm2 s GLY 80 Ca 0.00 1.02 -0.11 0.00 0.00 0.00 0.00 44.72 45.63 3hm2 s GLY 80 CO 0.00 1.96 1.08 0.00 0.00 0.00 0.00 173.10 176.14 3hm2 s ALA 81 N 0.04 2.41 -0.38 3.20 0.00 -1.26 -0.25 121.76 125.52 3hm2 s ALA 81 Ca 0.55 0.05 0.26 0.00 0.00 0.00 0.00 51.96 52.82 3hm2 s ALA 81 Cb -0.34 -3.18 0.63 0.00 0.00 0.00 0.00 23.12 20.22 3hm2 s ALA 81 CO 0.37 -1.53 1.71 -1.35 0.00 0.00 0.00 175.76 174.96 3hm2 h PRO 82 N -0.95 0.00 -0.21 0.00 0.11 -1.87 -3.45 132.00 125.63 3hm2 h PRO 82 Ca -0.45 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.71 3hm2 h PRO 82 Cb 1.23 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.30 3hm2 h PRO 82 CO 0.56 0.00 -0.09 -0.09 -0.21 0.00 0.00 178.00 178.17 3hm2 h ARG 83 N 0.00 -0.06 0.00 1.05 2.43 -1.94 -2.08 114.38 113.78 3hm2 h ARG 83 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3hm2 h ARG 83 Cb 0.84 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.40 3hm2 h ARG 83 CO 0.00 -0.04 0.00 0.00 -1.51 0.00 0.00 179.97 178.42 3hm2 n ALA 84 N -2.49 1.60 -0.16 2.80 0.00 0.65 -0.02 120.51 122.88 3hm2 n ALA 84 Ca -0.02 -0.04 -0.11 0.00 0.00 0.00 0.00 53.44 53.27 3hm2 n ALA 84 Cb 0.17 -1.14 -0.00 0.00 0.00 0.00 0.00 19.45 18.48 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 0.00 1.01 0.00 0.00 0.04 -1.63 -3.22 116.94 113.14 3hm2 h PHE 85 Ca 0.00 -0.21 0.00 0.00 2.80 0.00 0.00 57.97 60.56 3hm2 h PHE 85 Cb 0.07 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 37.97 3hm2 h PHE 85 CO 0.00 0.97 0.01 -0.25 -0.60 0.00 0.00 178.31 178.45 3hm2 n ASP 86 N -4.25 0.19 -0.16 2.17 8.00 0.96 -1.14 116.55 122.32 3hm2 n ASP 86 Ca 0.00 0.58 0.02 0.00 0.71 0.00 0.00 54.79 56.10 3hm2 n ASP 86 Cb 0.37 -0.60 0.03 0.00 -0.02 0.00 0.00 41.12 40.90 3hm2 n ASP 86 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3hm2 n ASP 87 N -1.76 1.75 -4.30 -2.24 -0.08 -1.22 -4.89 116.55 103.81 3hm2 n ASP 87 Ca -0.00 -1.55 -0.38 0.00 -1.51 0.00 0.00 54.79 51.34 3hm2 n ASP 87 Cb 0.03 -0.03 -0.12 0.00 2.34 0.00 0.00 41.12 43.33 3hm2 n ASP 87 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 3hm2 s VAL 88 N -0.62 4.00 0.05 5.18 1.01 -0.29 -5.02 120.40 124.72 3hm2 s VAL 88 Ca 0.05 -1.04 -0.17 0.00 0.00 0.00 0.00 61.98 60.83 3hm2 s VAL 88 Cb 0.03 -3.25 -0.17 0.00 0.00 0.00 0.00 36.38 32.99 3hm2 s VAL 88 CO 0.04 -0.18 1.25 -0.65 0.00 0.00 0.00 175.10 175.56 3hm2 h PRO 89 N 8.28 0.57 -6.14 2.72 0.11 -1.90 -3.45 132.00 132.19 3hm2 h PRO 89 Ca -0.24 -0.46 -0.58 0.00 0.11 0.00 0.00 66.00 64.82 3hm2 h PRO 89 Cb 1.09 0.09 -0.05 0.00 0.11 0.00 0.00 31.00 32.25 3hm2 h PRO 89 CO 0.62 1.09 -0.09 -0.51 -0.21 0.00 0.00 178.00 178.90 3hm2 s ASP 90 N -6.75 6.97 0.18 -2.05 1.01 -1.26 -5.03 116.67 109.74 3hm2 s ASP 90 Ca -0.12 1.15 -0.30 0.00 0.71 0.00 0.00 52.55 53.98 3hm2 s ASP 90 Cb 0.06 -2.32 -0.09 0.00 1.01 0.00 0.00 42.92 41.58 3hm2 s ASP 90 CO 0.84 0.27 1.34 0.20 0.21 0.00 0.00 175.17 178.03 3hm2 s ASN 91 N -0.97 6.86 0.75 0.27 0.02 -1.26 -4.99 114.94 115.62 3hm2 s ASN 91 Ca 0.27 2.40 -0.15 0.00 -1.02 0.00 0.00 52.86 54.36 3hm2 s ASN 91 Cb -0.18 -2.60 0.05 0.00 0.02 0.00 0.00 41.25 38.53 3hm2 s ASN 91 CO 0.17 -0.58 1.23 -2.16 0.02 0.00 0.00 177.10 175.78 3hm2 s PRO 92 N 0.23 1.94 -0.19 -0.60 0.04 -1.26 -4.99 135.00 130.16 3hm2 s PRO 92 Ca 0.59 1.85 -0.10 0.00 0.04 0.00 0.00 61.00 63.38 3hm2 s PRO 92 Cb -0.37 -1.80 -0.20 0.00 0.04 0.00 0.00 34.50 32.17 3hm2 s PRO 92 CO 0.36 -2.01 0.10 -0.25 0.04 0.00 0.00 177.00 175.24 3hm2 n ASP 93 N -2.85 2.01 -4.20 6.66 8.00 0.10 -4.57 116.55 121.70 3hm2 n ASP 93 Ca 0.14 0.21 -0.18 0.00 0.71 0.00 0.00 54.79 55.67 3hm2 n ASP 93 Cb 0.50 -0.79 -0.11 0.00 -0.02 0.00 0.00 41.12 40.69 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 -2.49 1.18 0.12 2.53 1.01 -0.65 -3.28 120.40 118.82 3hm2 s VAL 94 Ca -0.29 -1.50 0.07 0.00 0.00 0.00 0.00 61.98 60.25 3hm2 s VAL 94 Cb 0.08 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 3hm2 s VAL 94 CO 0.65 -0.34 -0.17 -0.63 0.00 0.00 0.00 175.10 174.61 3hm2 s ILE 95 N -1.74 1.51 -0.05 2.22 1.01 -0.09 -0.39 121.20 123.67 3hm2 s ILE 95 Ca 0.03 -1.63 0.01 0.00 0.00 0.00 0.00 60.65 59.06 3hm2 s ILE 95 Cb -0.07 -1.52 0.02 0.00 0.01 0.00 0.00 42.46 40.90 3hm2 s ILE 95 CO 0.02 -0.25 -0.05 0.12 0.00 0.00 0.00 174.94 174.78 3hm2 s PHE 96 N -1.66 0.82 -0.13 3.97 5.36 0.69 -1.77 117.98 125.26 3hm2 s PHE 96 Ca 0.07 -0.25 0.01 0.00 -0.96 0.00 0.00 56.93 55.80 3hm2 s PHE 96 Cb -0.08 -0.73 -0.01 0.00 -0.34 0.00 0.00 43.02 41.87 3hm2 s PHE 96 CO 0.04 -0.22 -0.15 0.42 -1.46 0.00 0.00 175.22 173.85 3hm2 s ILE 97 N 1.00 2.79 -0.15 3.12 1.01 -0.91 -0.97 121.20 127.10 3hm2 s ILE 97 Ca -0.10 -0.75 0.05 0.00 0.00 0.00 0.00 60.65 59.86 3hm2 s ILE 97 Cb -0.14 -2.16 -0.07 0.00 0.01 0.00 0.00 42.46 40.10 3hm2 s ILE 97 CO -0.00 0.53 0.18 0.61 0.00 0.00 0.00 174.94 176.25 3hm2 n GLY 98 N 3.68 0.19 0.37 6.18 0.00 -1.20 0.40 105.19 114.81 3hm2 n GLY 98 Ca -0.18 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.69 3hm2 n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hm2 n GLY 100 N 1.57 0.00 0.19 -0.02 0.00 -1.26 -4.55 105.19 101.12 3hm2 n GLY 100 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 3hm2 n GLY 100 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3hm2 h LEU 101 N 0.00 0.00 -2.74 0.99 5.85 -1.91 -3.06 115.31 114.45 3hm2 h LEU 101 Ca 0.00 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 3hm2 h LEU 101 Cb 0.00 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 40.90 3hm2 h LEU 101 CO 0.00 0.00 -0.59 0.35 -0.34 0.00 0.00 178.44 177.86 3hm2 n THR 102 N -2.22 0.84 -1.74 1.05 -2.24 -1.26 -4.92 114.28 103.80 3hm2 n THR 102 Ca -0.01 -1.48 -0.40 0.00 -2.27 0.00 0.00 64.05 59.89 3hm2 n THR 102 Cb 0.27 0.37 0.02 0.00 -2.10 0.00 0.00 70.33 68.89 3hm2 n THR 102 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hm2 n ALA 103 N -0.34 1.67 -1.52 6.98 0.00 -1.16 -4.86 120.51 121.29 3hm2 n ALA 103 Ca 0.09 0.23 -0.44 0.00 0.00 0.00 0.00 53.44 53.31 3hm2 n ALA 103 Cb 0.84 -2.34 -0.05 0.00 0.00 0.00 0.00 19.45 17.90 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 -0.28 1.29 0.00 0.00 -0.02 -1.26 -3.20 135.00 131.53 3hm2 n PRO 104 Ca 0.07 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 3hm2 n PRO 104 Cb 0.42 -2.87 0.00 0.00 -0.02 0.00 0.00 33.50 31.02 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 6.17 2.23 0.26 -1.23 0.00 -1.26 -4.85 105.19 106.52 3hm2 n GLY 105 Ca 0.38 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.44 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 0.65 0.42 1.61 2.07 -1.88 -2.36 116.25 116.76 3hm2 h VAL 106 Ca 0.00 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 3hm2 h VAL 106 Cb 0.00 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.00 3hm2 h VAL 106 CO 0.00 0.07 -0.20 0.15 0.02 0.00 0.00 177.57 177.61 3hm2 h PHE 107 N 0.39 -0.52 -0.65 1.57 3.57 -1.91 0.87 116.94 120.26 3hm2 h PHE 107 Ca 0.39 -0.01 0.14 0.00 3.53 0.00 0.00 57.97 62.01 3hm2 h PHE 107 Cb 0.58 0.17 -0.10 0.00 2.79 0.00 0.00 35.95 39.39 3hm2 h PHE 107 CO -0.19 -0.32 0.07 0.00 -2.23 0.00 0.00 178.31 175.64 3hm2 h ALA 108 N -1.18 0.73 0.17 2.41 0.00 -1.95 1.60 119.26 121.03 3hm2 h ALA 108 Ca -0.06 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3hm2 h ALA 108 Cb 0.43 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 3hm2 h ALA 108 CO 0.09 -0.37 -0.14 0.00 0.00 0.00 0.00 179.25 178.83 3hm2 h ALA 109 N 1.57 -0.90 -0.96 0.00 0.00 -1.45 0.15 119.26 117.67 3hm2 h ALA 109 Ca 0.35 -0.06 0.37 0.00 0.00 0.00 0.00 54.91 55.58 3hm2 h ALA 109 Cb 0.58 0.35 -0.17 0.00 0.00 0.00 0.00 17.79 18.54 3hm2 h ALA 109 CO -0.51 -0.91 0.42 0.00 0.00 0.00 0.00 179.25 178.25 3hm2 n ALA 110 N -2.37 0.88 -0.04 0.00 0.00 0.30 -1.90 120.51 117.39 3hm2 n ALA 110 Ca -0.04 0.99 -0.15 0.00 0.00 0.00 0.00 53.44 54.24 3hm2 n ALA 110 Cb 0.13 -0.93 -0.08 0.00 0.00 0.00 0.00 19.45 18.57 3hm2 n ALA 110 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 3hm2 h TRP 111 N 0.00 0.59 -0.36 0.00 2.91 0.35 -2.66 115.95 116.78 3hm2 h TRP 111 Ca 0.77 -0.23 0.10 0.00 1.13 0.00 0.00 58.89 60.66 3hm2 h TRP 111 Cb 1.96 -0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 30.49 3hm2 h TRP 111 CO -0.11 0.96 0.50 1.57 -1.03 0.00 0.00 178.44 180.34 3hm2 h LYS 112 N 0.05 0.00 0.00 2.65 2.10 -0.04 0.25 116.57 121.59 3hm2 h LYS 112 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3hm2 h LYS 112 Cb 0.96 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.29 3hm2 h LYS 112 CO 0.07 0.00 -0.49 0.54 -2.00 0.00 0.00 179.45 177.58 3hm2 n ARG 113 N -3.46 0.20 -2.82 0.07 5.12 -1.00 -4.86 116.66 109.91 3hm2 n ARG 113 Ca 0.06 0.07 -0.40 0.00 -1.93 0.00 0.00 57.85 55.66 3hm2 n ARG 113 Cb 0.66 -1.64 -0.06 0.00 -1.16 0.00 0.00 32.46 30.26 3hm2 n ARG 113 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3hm2 s LEU 114 N -3.86 4.62 0.70 0.55 1.02 0.08 -4.38 118.68 117.40 3hm2 s LEU 114 Ca 0.08 1.84 -0.11 0.00 0.02 0.00 0.00 54.13 55.96 3hm2 s LEU 114 Cb 0.15 -3.51 0.01 0.00 0.02 0.00 0.00 46.19 42.86 3hm2 s LEU 114 CO 0.69 0.15 1.09 -2.84 0.02 0.00 0.00 176.35 175.46 3hm2 s PRO 115 N -1.03 2.89 0.37 1.29 0.02 -1.26 -4.96 135.00 132.31 3hm2 s PRO 115 Ca 0.40 0.47 -0.25 0.00 0.02 0.00 0.00 61.00 61.64 3hm2 s PRO 115 Cb -0.25 -2.02 -0.12 0.00 0.02 0.00 0.00 34.50 32.13 3hm2 s PRO 115 CO 0.30 -1.02 0.94 0.28 -0.33 0.00 0.00 177.00 177.17 3hm2 n VAL 116 N -3.00 2.17 -4.19 3.83 0.31 -1.26 -2.08 118.33 114.11 3hm2 n VAL 116 Ca 0.07 -0.50 -0.34 0.00 -0.01 0.00 0.00 64.34 63.56 3hm2 n VAL 116 Cb 0.57 -0.99 -0.03 0.00 -0.91 0.00 0.00 33.84 32.48 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 1.29 -0.38 3.95 2.92 0.00 0.24 -4.89 105.19 108.32 3hm2 n GLY 117 Ca 0.10 0.14 -0.19 0.00 0.00 0.00 0.00 46.02 46.06 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 -3.58 1.91 -0.09 -0.02 0.00 -0.88 -4.71 107.32 99.95 3hm2 s GLY 118 Ca 0.55 -1.69 0.04 0.00 0.00 0.00 0.00 44.72 43.62 3hm2 s GLY 118 CO 0.93 -1.54 -0.23 0.50 0.00 0.00 0.00 173.10 172.76 3hm2 s ARG 119 N -4.20 2.94 -0.08 2.90 0.52 -1.20 0.16 118.95 119.99 3hm2 s ARG 119 Ca 0.49 -0.86 0.02 0.00 -0.52 0.00 0.00 55.73 54.86 3hm2 s ARG 119 Cb -0.07 -2.30 0.02 0.00 0.52 0.00 0.00 34.95 33.11 3hm2 s ARG 119 CO 0.30 0.25 -0.11 -1.17 0.02 0.00 0.00 175.30 174.59 3hm2 s LEU 120 N 0.18 1.54 -0.17 2.53 0.20 -1.08 -0.91 118.68 120.97 3hm2 s LEU 120 Ca -0.13 -0.30 -0.02 0.00 0.69 0.00 0.00 54.13 54.37 3hm2 s LEU 120 Cb -0.16 -0.83 -0.01 0.00 -0.43 0.00 0.00 46.19 44.76 3hm2 s LEU 120 CO 0.07 -0.00 -0.10 -0.69 -0.29 0.00 0.00 176.35 175.34 3hm2 s VAL 121 N 0.91 3.12 0.19 1.68 1.01 -0.73 -1.81 120.40 124.78 3hm2 s VAL 121 Ca -0.10 -0.61 0.11 0.00 0.00 0.00 0.00 61.98 61.38 3hm2 s VAL 121 Cb -0.15 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 3hm2 s VAL 121 CO 0.01 0.49 -0.23 0.00 0.00 0.00 0.00 175.10 175.37 3hm2 s ALA 122 N 0.86 2.44 -0.00 5.51 0.00 0.36 -2.13 121.76 128.80 3hm2 s ALA 122 Ca -0.03 -1.62 0.08 0.00 0.00 0.00 0.00 51.96 50.39 3hm2 s ALA 122 Cb -0.15 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 3hm2 s ALA 122 CO 0.00 0.39 -0.24 -0.80 0.00 0.00 0.00 175.76 175.12 3hm2 s ASN 123 N -2.69 2.80 0.08 0.00 -0.87 0.16 -0.84 114.94 113.59 3hm2 s ASN 123 Ca 0.20 -0.46 0.03 0.00 -1.57 0.00 0.00 52.86 51.06 3hm2 s ASN 123 Cb -0.07 -0.29 -0.03 0.00 -0.02 0.00 0.00 41.25 40.83 3hm2 s ASN 123 CO 0.09 0.27 -0.10 0.00 -2.57 0.00 0.00 177.10 174.80 3hm2 s ALA 124 N -0.62 0.97 0.00 0.60 0.00 0.10 -4.50 121.76 118.30 3hm2 s ALA 124 Ca 0.09 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 51.01 3hm2 s ALA 124 Cb -0.09 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.05 3hm2 s ALA 124 CO -0.00 -0.01 0.00 1.55 0.00 0.00 0.00 175.76 177.30 3hm2 n VAL 125 N 0.90 0.00 -4.48 0.00 3.14 -1.26 -0.15 118.33 116.47 3hm2 n VAL 125 Ca -0.19 0.00 -0.23 0.00 -2.96 0.00 0.00 64.34 60.97 3hm2 n VAL 125 Cb 0.56 1.32 -0.10 0.00 -1.06 0.00 0.00 33.84 34.55 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 0.00 1.26 -0.01 1.55 -4.23 -1.26 -4.84 115.64 108.11 3hm2 s THR 126 Ca 0.00 -2.00 -0.23 0.00 -1.18 0.00 0.00 61.69 58.28 3hm2 s THR 126 Cb 0.00 -2.78 -0.19 0.00 1.34 0.00 0.00 72.50 70.87 3hm2 s THR 126 CO 0.00 0.00 1.21 0.58 -0.54 0.00 0.00 174.62 175.87 3hm2 h VAL 127 N 2.04 1.43 -0.49 2.29 2.07 -1.98 -0.29 116.25 121.32 3hm2 h VAL 127 Ca -0.41 -1.51 0.10 0.00 0.82 0.00 0.00 66.70 65.70 3hm2 h VAL 127 Cb 1.25 2.27 -0.10 0.00 -1.52 0.00 0.00 31.29 33.18 3hm2 h VAL 127 CO 0.70 0.42 -0.19 -0.33 0.02 0.00 0.00 177.57 178.20 3hm2 h GLU 128 N -0.29 -0.07 -0.44 1.57 3.07 -1.99 0.18 114.58 116.61 3hm2 h GLU 128 Ca -0.00 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.87 3hm2 h GLU 128 Cb 0.76 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.67 3hm2 h GLU 128 CO 0.03 -0.05 0.29 0.77 -1.40 0.00 0.00 179.01 178.66 3hm2 h SER 129 N -0.07 0.49 -1.00 1.42 0.02 -1.97 -3.15 113.55 109.29 3hm2 h SER 129 Ca 0.23 -0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.22 3hm2 h SER 129 Cb 0.43 -0.12 -0.06 0.00 0.14 0.00 0.00 62.40 62.79 3hm2 h SER 129 CO -0.54 0.36 0.65 -0.08 -1.14 0.00 0.00 176.83 176.07 3hm2 h GLU 130 N 0.59 1.19 -1.83 3.45 4.81 0.88 -2.34 114.58 121.33 3hm2 h GLU 130 Ca 0.17 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 3hm2 h GLU 130 Cb -0.05 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.06 3hm2 h GLU 130 CO -0.04 0.79 0.00 1.04 -0.73 0.00 0.00 179.01 180.07 3hm2 n GLN 131 N -4.46 0.94 0.00 1.92 6.02 0.44 -3.10 117.38 119.14 3hm2 n GLN 131 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.13 3hm2 n GLN 131 Cb 0.13 -1.03 0.00 0.00 1.02 0.00 0.00 30.24 30.35 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 1.36 0.00 0.22 1.08 4.77 -0.88 -2.82 117.00 120.73 3hm2 n LEU 133 Ca 0.00 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.09 3hm2 n LEU 133 Cb 0.47 0.00 0.27 0.00 -2.33 0.00 0.00 43.42 41.83 3hm2 n LEU 133 CO 0.00 0.00 0.79 -0.50 -1.33 0.00 0.00 177.39 176.35 3hm2 h TRP 134 N 0.00 0.00 0.07 -1.77 4.06 -1.83 0.30 115.95 116.78 3hm2 h TRP 134 Ca 0.00 0.00 -0.33 0.00 2.06 0.00 0.00 58.89 60.62 3hm2 h TRP 134 Cb 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.13 3hm2 h TRP 134 CO 0.00 0.11 -1.82 0.00 -3.56 0.00 0.00 178.44 173.17 3hm2 n ALA 135 N -2.13 0.90 0.19 1.49 0.00 -1.13 -3.40 120.51 116.43 3hm2 n ALA 135 Ca 0.03 -0.61 0.04 0.00 0.00 0.00 0.00 53.44 52.90 3hm2 n ALA 135 Cb 0.51 -0.57 0.39 0.00 0.00 0.00 0.00 19.45 19.79 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 -0.34 0.00 -1.48 0.00 3.38 -1.87 -2.05 115.31 112.96 3hm2 h LEU 136 Ca -0.42 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.60 3hm2 h LEU 136 Cb 1.77 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.48 3hm2 h LEU 136 CO -0.05 0.36 0.41 -0.09 0.09 0.00 0.00 178.44 179.16 3hm2 h ARG 137 N 0.00 0.63 0.00 1.13 2.43 -0.51 -2.71 114.38 115.36 3hm2 h ARG 137 Ca -0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3hm2 h ARG 137 Cb 0.71 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 3hm2 h ARG 137 CO 0.05 0.42 -0.31 1.63 -1.51 0.00 0.00 179.97 180.24 3hm2 n LYS 138 N -4.47 0.27 -0.02 0.20 4.76 -0.78 -2.39 118.16 115.74 3hm2 n LYS 138 Ca 0.08 0.15 -0.01 0.00 -2.87 0.00 0.00 58.31 55.66 3hm2 n LYS 138 Cb 0.20 -1.74 -0.00 0.00 -1.84 0.00 0.00 35.03 31.64 3hm2 n LYS 138 CO 0.00 0.00 0.00 1.96 -1.37 0.00 0.00 177.40 177.99 3hm2 h GLN 139 N 0.00 0.00 -0.45 1.97 4.20 -1.44 -3.43 115.11 115.96 3hm2 h GLN 139 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3hm2 h GLN 139 Cb 0.74 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.52 3hm2 h GLN 139 CO 0.00 0.00 0.00 1.19 -0.67 0.00 0.00 178.83 179.35 3hm2 n PHE 140 N -3.14 0.58 -1.94 2.96 3.72 -1.03 -5.03 117.46 113.57 3hm2 n PHE 140 Ca -0.01 -0.29 0.00 0.00 -0.05 0.00 0.00 57.45 57.10 3hm2 n PHE 140 Cb 0.05 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 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 1.48 0.58 5.29 1.37 0.00 -1.00 -4.85 105.19 108.05 3hm2 n GLY 141 Ca 0.20 -1.11 0.04 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.44 3.20 -0.02 0.00 -1.26 -4.50 105.19 101.17 3hm2 n GLY 142 Ca 0.00 -1.14 -0.13 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.56 0.02 -0.15 2.61 2.01 -1.09 -5.01 115.64 113.47 3hm2 s THR 143 Ca 0.00 -0.13 0.02 0.00 0.31 0.00 0.00 61.69 61.88 3hm2 s THR 143 Cb 0.00 -0.47 0.01 0.00 0.01 0.00 0.00 72.50 72.05 3hm2 s THR 143 CO 0.00 -0.07 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.02 3hm2 s ILE 144 N -0.23 2.16 0.45 1.82 1.01 -1.26 -2.72 121.20 122.44 3hm2 s ILE 144 Ca -0.04 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 59.71 3hm2 s ILE 144 Cb -0.03 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.52 3hm2 s ILE 144 CO 0.01 0.54 0.03 -0.94 0.00 0.00 0.00 174.94 174.58 3hm2 s SER 145 N 0.90 3.72 -0.05 3.58 1.04 -1.09 -5.00 113.70 116.80 3hm2 s SER 145 Ca -0.05 -1.55 -0.14 0.00 0.48 0.00 0.00 55.95 54.69 3hm2 s SER 145 Cb -0.15 0.21 0.03 0.00 0.10 0.00 0.00 66.02 66.20 3hm2 s SER 145 CO -0.03 -0.73 0.32 -0.94 0.98 0.00 0.00 173.24 172.84 3hm2 s SER 146 N -3.76 -0.25 -0.14 7.02 1.04 -1.26 -2.51 113.70 113.84 3hm2 s SER 146 Ca 0.19 0.27 0.01 0.00 0.48 0.00 0.00 55.95 56.90 3hm2 s SER 146 Cb 0.05 0.43 0.02 0.00 0.10 0.00 0.00 66.02 66.62 3hm2 s SER 146 CO 0.10 -0.35 -0.15 -0.36 0.98 0.00 0.00 173.24 173.46 3hm2 s PHE 147 N -0.87 2.14 -0.26 5.02 0.40 -0.41 -4.95 117.98 119.05 3hm2 s PHE 147 Ca -0.09 -1.16 -0.02 0.00 -0.60 0.00 0.00 56.93 55.06 3hm2 s PHE 147 Cb -0.04 -1.57 0.03 0.00 0.51 0.00 0.00 43.02 41.95 3hm2 s PHE 147 CO 0.03 -0.63 -0.05 0.00 0.70 0.00 0.00 175.22 175.27 3hm2 s ALA 148 N 1.37 2.72 -0.14 5.36 0.00 -1.26 -1.99 121.76 127.82 3hm2 s ALA 148 Ca 0.02 -1.53 -0.02 0.00 0.00 0.00 0.00 51.96 50.44 3hm2 s ALA 148 Cb -0.13 -1.74 -0.02 0.00 0.00 0.00 0.00 23.12 21.22 3hm2 s ALA 148 CO -0.09 -0.92 -0.09 0.42 0.00 0.00 0.00 175.76 175.08 3hm2 s ILE 149 N 1.31 3.35 0.22 0.00 1.01 -1.26 -4.95 121.20 120.87 3hm2 s ILE 149 Ca -0.01 -0.55 0.11 0.00 0.00 0.00 0.00 60.65 60.20 3hm2 s ILE 149 Cb -0.17 -2.44 -0.05 0.00 0.01 0.00 0.00 42.46 39.81 3hm2 s ILE 149 CO -0.04 0.51 -0.19 -0.44 0.00 0.00 0.00 174.94 174.78 3hm2 s SER 150 N 0.39 3.67 0.04 3.58 0.01 -1.26 -0.79 113.70 119.34 3hm2 s SER 150 Ca -0.08 -0.85 0.01 0.00 1.31 0.00 0.00 55.95 56.35 3hm2 s SER 150 Cb -0.15 -0.38 -0.03 0.00 0.21 0.00 0.00 66.02 65.67 3hm2 s SER 150 CO 0.04 0.09 -0.06 -1.00 0.41 0.00 0.00 173.24 172.73 3hm2 s HIS 151 N -1.92 0.55 0.51 2.43 3.76 -1.09 -4.86 115.29 114.68 3hm2 s HIS 151 Ca 0.24 -0.61 -0.22 0.00 -0.15 0.00 0.00 55.06 54.32 3hm2 s HIS 151 Cb -0.07 -0.35 -0.07 0.00 1.11 0.00 0.00 32.58 33.21 3hm2 s HIS 151 CO 0.13 -0.15 1.23 -0.85 -0.85 0.00 0.00 174.74 174.24 3hm2 n GLU 152 N 1.20 1.58 -3.52 1.40 0.28 -1.26 -1.69 120.64 118.63 3hm2 n GLU 152 Ca -0.21 0.58 -0.24 0.00 -0.16 0.00 0.00 57.16 57.13 3hm2 n GLU 152 Cb 0.56 -2.40 -0.14 0.00 1.43 0.00 0.00 31.44 30.89 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 -1.30 0.02 -1.21 -1.84 2.46 0.72 -4.86 115.29 109.29 3hm2 s HIS 153 Ca 0.69 -0.39 -0.09 0.00 0.47 0.00 0.00 55.06 55.74 3hm2 s HIS 153 Cb -0.45 -0.66 0.21 0.00 -0.13 0.00 0.00 32.58 31.55 3hm2 s HIS 153 CO 0.52 -0.72 1.61 2.41 -2.47 0.00 0.00 174.74 176.08 3hm2 n THR 154 N 5.28 4.54 -2.50 0.89 -1.04 -1.26 -0.99 114.28 119.20 3hm2 n THR 154 Ca -0.05 -4.89 -0.42 0.00 -2.04 0.00 0.00 64.05 56.64 3hm2 n THR 154 Cb 0.46 -2.36 -0.00 0.00 -1.82 0.00 0.00 70.33 66.61 3hm2 n THR 154 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 3hm2 n VAL 155 N 3.20 3.85 -0.85 12.58 0.31 -1.12 -4.79 118.33 131.50 3hm2 n VAL 155 Ca 0.35 -3.97 0.00 0.00 -0.01 0.00 0.00 64.34 60.71 3hm2 n VAL 155 Cb 0.38 -2.36 0.00 0.00 -0.91 0.00 0.00 33.84 30.94 3hm2 n VAL 155 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hm2 n GLY 156 N 5.32 0.94 0.00 2.92 0.00 -1.26 -4.29 105.19 108.82 3hm2 n GLY 156 Ca 0.49 -1.48 0.12 0.00 0.00 0.00 0.00 46.02 45.15 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 0.86 0.00 -3.81 1.61 3.41 -1.26 -4.70 113.62 109.72 3hm2 n SER 157 Ca 0.00 -0.80 -0.28 0.00 -0.26 0.00 0.00 58.87 57.53 3hm2 n SER 157 Cb 0.00 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 63.79 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 -2.00 1.37 0.19 7.33 0.08 -1.26 -5.11 117.98 118.59 3hm2 s PHE 158 Ca 0.37 -0.97 -0.30 0.00 0.12 0.00 0.00 56.93 56.15 3hm2 s PHE 158 Cb 0.17 -1.16 -0.08 0.00 -0.57 0.00 0.00 43.02 41.37 3hm2 s PHE 158 CO 0.28 -0.60 1.23 0.42 -0.10 0.00 0.00 175.22 176.45 3hm2 s ILE 159 N 1.74 3.45 0.00 0.64 1.01 -1.26 -2.81 121.20 123.97 3hm2 s ILE 159 Ca -0.00 1.22 0.00 0.00 0.00 0.00 0.00 60.65 61.87 3hm2 s ILE 159 Cb -0.16 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.53 3hm2 s ILE 159 CO -0.07 0.20 0.00 0.35 0.00 0.00 0.00 174.94 175.41 3hm2 n THR 160 N 2.49 0.00 0.00 2.92 -2.24 -0.16 -4.92 114.28 112.36 3hm2 n THR 160 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 3hm2 n THR 160 Cb 0.44 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 3hm2 n THR 160 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3hm2 n LYS 162 N 0.00 0.00 -2.26 -0.78 4.81 -0.68 -0.20 118.16 119.05 3hm2 n LYS 162 Ca 0.00 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 57.05 3hm2 n LYS 162 Cb 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.03 3hm2 n LYS 162 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 3hm2 s PRO 163 N 0.00 4.26 0.54 1.64 0.04 -1.26 -2.67 135.00 137.54 3hm2 s PRO 163 Ca 0.00 1.97 -0.01 0.00 0.04 0.00 0.00 61.00 63.00 3hm2 s PRO 163 Cb 0.00 -2.91 0.02 0.00 0.04 0.00 0.00 34.50 31.65 3hm2 s PRO 163 CO 0.00 -0.18 0.78 0.00 0.04 0.00 0.00 177.00 177.64 3hm2 s ALA 164 N -1.27 3.67 0.40 8.56 0.00 0.03 -4.96 121.76 128.19 3hm2 s ALA 164 Ca 0.52 -1.09 -0.27 0.00 0.00 0.00 0.00 51.96 51.12 3hm2 s ALA 164 Cb -0.34 -2.24 -0.10 0.00 0.00 0.00 0.00 23.12 20.44 3hm2 s ALA 164 CO 0.44 -0.68 1.42 -0.51 0.00 0.00 0.00 175.76 176.43 3hm2 s LEU 165 N -4.78 4.25 1.25 0.00 1.43 -1.26 -4.51 118.68 115.06 3hm2 s LEU 165 Ca 0.54 2.91 -0.18 0.00 -1.03 0.00 0.00 54.13 56.37 3hm2 s LEU 165 Cb -0.10 -3.79 0.31 0.00 0.03 0.00 0.00 46.19 42.63 3hm2 s LEU 165 CO 0.40 -0.94 1.02 -2.84 0.23 0.00 0.00 176.35 174.22 3hm2 s PRO 166 N -2.20 -1.59 -0.10 1.29 0.02 -1.26 -4.76 135.00 126.39 3hm2 s PRO 166 Ca 0.56 0.32 -0.05 0.00 0.02 0.00 0.00 61.00 61.84 3hm2 s PRO 166 Cb -0.44 -1.52 0.04 0.00 0.02 0.00 0.00 34.50 32.61 3hm2 s PRO 166 CO 0.58 -4.04 0.24 0.08 -0.33 0.00 0.00 177.00 173.53 3hm2 s VAL 167 N -2.58 -0.04 -0.06 3.83 1.01 -0.84 -4.68 120.40 117.03 3hm2 s VAL 167 Ca 0.69 0.14 -0.00 0.00 0.00 0.00 0.00 61.98 62.80 3hm2 s VAL 167 Cb -0.16 -0.37 -0.03 0.00 0.00 0.00 0.00 36.38 35.81 3hm2 s VAL 167 CO 0.59 0.06 -0.03 -1.00 0.00 0.00 0.00 175.10 174.72 3hm2 s HIS 168 N 1.18 3.05 -0.08 5.22 3.76 0.78 -1.28 115.29 127.92 3hm2 s HIS 168 Ca -0.09 0.10 -0.01 0.00 -0.15 0.00 0.00 55.06 54.92 3hm2 s HIS 168 Cb -0.10 -1.73 0.03 0.00 1.11 0.00 0.00 32.58 31.89 3hm2 s HIS 168 CO -0.08 0.41 -0.03 -1.14 -0.85 0.00 0.00 174.74 173.05 3hm2 s GLN 169 N -0.99 0.95 -0.26 1.40 0.74 -1.04 0.00 119.66 120.46 3hm2 s GLN 169 Ca 0.14 -0.05 -0.08 0.00 0.05 0.00 0.00 55.36 55.42 3hm2 s GLN 169 Cb -0.11 -1.15 -0.03 0.00 1.10 0.00 0.00 33.01 32.82 3hm2 s GLN 169 CO 0.03 -0.25 0.10 -0.46 -0.55 0.00 0.00 175.29 174.17 3hm2 s TRP 170 N 1.68 3.12 -0.05 1.67 -0.00 -0.02 -2.69 118.94 122.67 3hm2 s TRP 170 Ca 0.02 -0.33 0.06 0.00 -0.00 0.00 0.00 56.10 55.84 3hm2 s TRP 170 Cb -0.13 -2.28 -0.02 0.00 -0.00 0.00 0.00 33.47 31.04 3hm2 s TRP 170 CO -0.05 -0.33 -0.22 -0.08 -0.00 0.00 0.00 176.95 176.27 3hm2 s THR 171 N 1.64 2.36 0.12 5.86 -1.32 -1.10 0.14 115.64 123.34 3hm2 s THR 171 Ca 0.06 -0.97 -0.09 0.00 -1.21 0.00 0.00 61.69 59.48 3hm2 s THR 171 Cb -0.16 -1.87 -0.00 0.00 -1.51 0.00 0.00 72.50 68.96 3hm2 s THR 171 CO 0.05 0.58 0.23 0.54 -2.21 0.00 0.00 174.62 173.81 3hm2 s VAL 172 N -0.41 0.11 -0.11 5.08 0.11 -0.75 -2.66 120.40 121.77 3hm2 s VAL 172 Ca 0.04 -1.27 0.03 0.00 -2.93 0.00 0.00 61.98 57.85 3hm2 s VAL 172 Cb -0.12 -1.56 0.00 0.00 -1.53 0.00 0.00 36.38 33.18 3hm2 s VAL 172 CO 0.01 -0.50 -0.22 -0.69 -3.33 0.00 0.00 175.10 170.38 3hm2 s VAL 173 N -3.91 1.92 -2.00 2.04 1.01 -1.26 -2.64 120.40 115.56 3hm2 s VAL 173 Ca 0.10 -0.93 0.07 0.00 0.00 0.00 0.00 61.98 61.23 3hm2 s VAL 173 Cb 0.04 -1.68 0.20 0.00 0.00 0.00 0.00 36.38 34.94 3hm2 s VAL 173 CO -0.06 0.53 0.88 1.17 0.00 0.00 0.00 175.10 177.61