#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 0.57 -0.28 1.61 6.02 -1.26 -3.94 117.38 120.10 3hm2 n GLN 4 Ca 0.00 -0.17 0.03 0.00 -0.01 0.00 0.00 57.00 56.85 3hm2 n GLN 4 Cb 0.00 -1.51 0.24 0.00 1.02 0.00 0.00 30.24 30.00 3hm2 n GLN 4 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3hm2 h LEU 5 N 0.00 0.89 -0.02 1.08 3.38 -2.06 -2.97 115.31 115.61 3hm2 h LEU 5 Ca 0.00 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hm2 h LEU 5 Cb 0.91 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 3hm2 h LEU 5 CO 0.00 0.60 0.01 0.71 0.09 0.00 0.00 178.44 179.85 3hm2 h THR 6 N 1.03 1.09 0.00 0.22 1.35 -2.02 -3.13 112.91 111.46 3hm2 h THR 6 Ca 0.36 -0.28 -0.01 0.00 -0.55 0.00 0.00 66.41 65.93 3hm2 h THR 6 Cb 0.11 1.25 -0.00 0.00 -1.73 0.00 0.00 68.15 67.78 3hm2 h THR 6 CO -0.12 0.07 -0.07 0.11 -0.25 0.00 0.00 175.52 175.27 3hm2 h LYS 7 N -0.08 0.00 -0.04 4.72 1.57 -1.65 -1.85 116.57 119.24 3hm2 h LYS 7 Ca 0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 3hm2 h LYS 7 Cb 0.11 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 3hm2 h LYS 7 CO -0.00 0.07 -0.01 0.37 -0.57 0.00 0.00 179.45 179.31 3hm2 h GLN 8 N 0.00 0.08 0.04 3.15 4.15 -1.51 -1.26 115.11 119.77 3hm2 h GLN 8 Ca -0.00 -0.03 0.03 0.00 0.77 0.00 0.00 58.65 59.42 3hm2 h GLN 8 Cb 0.13 -0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.77 3hm2 h GLN 8 CO 0.01 0.44 -0.30 0.45 -1.93 0.00 0.00 178.83 177.50 3hm2 h HIS 9 N -0.28 -0.82 -0.70 3.99 3.86 -1.36 0.46 115.15 120.29 3hm2 h HIS 9 Ca 0.01 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.24 3hm2 h HIS 9 Cb 0.41 0.36 -0.03 0.00 1.06 0.00 0.00 27.41 29.20 3hm2 h HIS 9 CO 0.06 -0.40 0.42 0.28 0.86 0.00 0.00 177.93 179.14 3hm2 h VAL 10 N -0.48 1.20 0.00 2.45 2.07 -1.47 -0.67 116.25 119.35 3hm2 h VAL 10 Ca 0.05 -0.45 -0.07 0.00 0.82 0.00 0.00 66.70 67.05 3hm2 h VAL 10 Cb 0.54 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 3hm2 h VAL 10 CO -0.23 0.21 -0.32 -0.09 0.02 0.00 0.00 177.57 177.16 3hm2 h ARG 11 N 0.97 0.00 -0.13 1.57 2.43 -0.48 -2.32 114.38 116.42 3hm2 h ARG 11 Ca 0.25 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.30 3hm2 h ARG 11 Cb -0.03 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 3hm2 h ARG 11 CO -0.05 0.32 -0.38 0.00 -1.51 0.00 0.00 179.97 178.36 3hm2 h ALA 12 N 1.68 0.22 0.00 2.80 0.00 0.83 -2.89 119.26 121.90 3hm2 h ALA 12 Ca -0.00 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 3hm2 h ALA 12 Cb 0.65 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3hm2 h ALA 12 CO 0.04 0.31 -0.19 -0.07 0.00 0.00 0.00 179.25 179.34 3hm2 h LEU 13 N 0.10 0.00 0.03 0.00 3.38 -0.84 -1.70 115.31 116.28 3hm2 h LEU 13 Ca -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3hm2 h LEU 13 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 3hm2 h LEU 13 CO 0.08 0.19 -0.01 0.00 0.09 0.00 0.00 178.44 178.79 3hm2 h ALA 14 N 1.81 -0.19 0.00 1.53 0.00 -1.50 -2.23 119.26 118.69 3hm2 h ALA 14 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3hm2 h ALA 14 Cb 0.57 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3hm2 h ALA 14 CO 0.02 -0.19 0.11 -0.89 0.00 0.00 0.00 179.25 178.31 3hm2 n ILE 15 N -2.42 1.10 0.12 0.00 5.41 -1.09 0.20 119.36 122.67 3hm2 n ILE 15 Ca -0.00 0.67 -0.23 0.00 1.00 0.00 0.00 62.75 64.18 3hm2 n ILE 15 Cb 0.01 -1.67 -0.16 0.00 -0.71 0.00 0.00 39.64 37.12 3hm2 n ILE 15 CO 0.00 0.00 0.00 -1.28 0.00 0.00 0.00 176.55 175.27 3hm2 h SER 16 N 0.00 0.73 0.64 4.38 0.87 -1.38 -0.95 113.55 117.84 3hm2 h SER 16 Ca 0.00 -0.93 -0.02 0.00 -1.23 0.00 0.00 61.79 59.61 3hm2 h SER 16 Cb 0.22 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 61.94 3hm2 h SER 16 CO 0.00 1.62 -0.10 0.00 -0.53 0.00 0.00 176.83 177.82 3hm2 h ALA 17 N 0.13 1.11 0.00 6.23 0.00 0.40 -3.14 119.26 123.98 3hm2 h ALA 17 Ca -0.23 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.42 3hm2 h ALA 17 Cb 2.01 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.76 3hm2 h ALA 17 CO 0.24 0.13 -1.38 -0.07 0.00 0.00 0.00 179.25 178.16 3hm2 h LEU 18 N 0.00 0.00 -3.83 0.00 3.38 -0.47 -3.49 115.31 110.90 3hm2 h LEU 18 Ca -0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 3hm2 h LEU 18 Cb 0.45 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 3hm2 h LEU 18 CO 0.01 0.61 -1.01 0.00 0.09 0.00 0.00 178.44 178.15 3hm2 n ALA 19 N -2.40 -2.63 -1.63 1.53 0.00 -0.37 -4.61 120.51 110.41 3hm2 n ALA 19 Ca -0.09 -0.51 -0.43 0.00 0.00 0.00 0.00 53.44 52.40 3hm2 n ALA 19 Cb 0.85 -2.59 -0.03 0.00 0.00 0.00 0.00 19.45 17.68 3hm2 n ALA 19 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3hm2 n PRO 20 N -4.68 2.38 0.09 0.00 -0.02 -1.26 -5.11 135.00 126.40 3hm2 n PRO 20 Ca -0.13 0.79 -0.04 0.00 -2.02 0.00 0.00 63.50 62.09 3hm2 n PRO 20 Cb 0.58 -3.06 -0.02 0.00 -0.02 0.00 0.00 33.50 30.97 3hm2 n PRO 20 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3hm2 h LYS 21 N 12.48 -0.28 0.00 -0.52 1.57 -2.00 -3.48 116.57 124.35 3hm2 h LYS 21 Ca -0.45 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 3hm2 h LYS 21 Cb 1.25 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.62 3hm2 h LYS 21 CO 0.95 -0.19 0.00 -1.91 -0.57 0.00 0.00 179.45 177.74 3hm2 n GLU 24 N -4.02 0.00 -2.07 3.15 2.13 -1.26 -5.10 120.64 113.48 3hm2 n GLU 24 Ca -0.04 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.36 3hm2 n GLU 24 Cb 0.11 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.80 3hm2 n GLU 24 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 3hm2 s THR 25 N 0.00 3.54 0.16 6.31 2.01 -1.26 -3.79 115.64 122.61 3hm2 s THR 25 Ca 0.00 0.80 0.10 0.00 0.31 0.00 0.00 61.69 62.91 3hm2 s THR 25 Cb 0.00 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 68.95 3hm2 s THR 25 CO 0.00 -0.04 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.44 3hm2 s LEU 26 N 3.32 2.39 -0.14 4.42 2.96 -0.72 0.11 118.68 131.02 3hm2 s LEU 26 Ca 0.70 -0.81 -0.02 0.00 -0.22 0.00 0.00 54.13 53.78 3hm2 s LEU 26 Cb -0.33 -1.06 -0.02 0.00 0.50 0.00 0.00 46.19 45.27 3hm2 s LEU 26 CO 0.28 0.09 -0.07 0.26 -1.32 0.00 0.00 176.35 175.59 3hm2 s TRP 27 N -1.54 2.94 -0.41 5.38 0.52 0.51 -1.39 118.94 124.96 3hm2 s TRP 27 Ca 0.16 -0.41 -0.15 0.00 0.02 0.00 0.00 56.10 55.72 3hm2 s TRP 27 Cb -0.08 -1.90 0.02 0.00 -1.15 0.00 0.00 33.47 30.35 3hm2 s TRP 27 CO 0.07 -0.08 0.30 0.34 0.02 0.00 0.00 176.95 177.60 3hm2 s ASP 28 N 0.29 6.11 -0.26 2.95 -1.08 -0.18 -0.49 116.67 124.00 3hm2 s ASP 28 Ca -0.06 -0.88 -0.03 0.00 -0.52 0.00 0.00 52.55 51.06 3hm2 s ASP 28 Cb -0.15 -2.16 0.02 0.00 -1.46 0.00 0.00 42.92 39.17 3hm2 s ASP 28 CO 0.04 -0.44 -0.01 -0.63 0.52 0.00 0.00 175.17 174.64 3hm2 s ILE 29 N 1.69 3.24 0.00 4.11 1.01 -0.36 -0.89 121.20 129.99 3hm2 s ILE 29 Ca 0.05 -0.90 0.00 0.00 0.00 0.00 0.00 60.65 59.80 3hm2 s ILE 29 Cb -0.19 -2.65 0.00 0.00 0.01 0.00 0.00 42.46 39.63 3hm2 s ILE 29 CO 0.10 0.17 0.00 0.61 0.00 0.00 0.00 174.94 175.82 3hm2 n GLY 30 N 4.73 -0.56 2.08 6.18 0.00 -1.22 -1.25 105.19 115.16 3hm2 n GLY 30 Ca -0.16 -1.61 -0.35 0.00 0.00 0.00 0.00 46.02 43.90 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 -0.19 2.35 -0.02 0.00 -1.19 -1.47 105.19 104.68 3hm2 n GLY 31 Ca 0.00 0.45 -0.17 0.00 0.00 0.00 0.00 46.02 46.30 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 0.90 -0.02 3.65 -0.02 0.00 -1.26 -4.57 105.19 103.87 3hm2 n GLY 32 Ca 0.12 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 3hm2 n GLY 32 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hm2 s SER 33 N -2.32 6.49 0.00 1.61 1.04 -0.54 -2.62 113.70 117.36 3hm2 s SER 33 Ca 0.00 2.14 0.00 0.00 0.48 0.00 0.00 55.95 58.57 3hm2 s SER 33 Cb 0.00 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.59 3hm2 s SER 33 CO 0.00 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 173.74 3hm2 n GLY 34 N 4.41 3.55 0.15 7.32 0.00 -1.26 -4.79 105.19 114.57 3hm2 n GLY 34 Ca 0.19 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.54 3hm2 n GLY 34 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3hm2 h SER 35 N 0.34 -0.23 1.67 1.61 0.87 -1.87 -1.62 113.55 114.32 3hm2 h SER 35 Ca 0.00 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.40 3hm2 h SER 35 Cb 0.00 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 3hm2 h SER 35 CO 0.00 0.03 0.00 0.40 -0.53 0.00 0.00 176.83 176.73 3hm2 h ILE 36 N -0.50 0.00 0.06 2.23 5.03 -1.95 -2.15 117.51 120.23 3hm2 h ILE 36 Ca -0.03 -0.80 -0.00 0.00 -0.12 0.00 0.00 64.86 63.91 3hm2 h ILE 36 Cb 0.38 1.78 0.00 0.00 -3.03 0.00 0.00 36.82 35.96 3hm2 h ILE 36 CO 0.05 0.00 -0.03 0.00 -0.68 0.00 0.00 178.15 177.49 3hm2 h ALA 37 N 2.08 -0.09 0.00 1.87 0.00 -1.92 -1.70 119.26 119.50 3hm2 h ALA 37 Ca 0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 3hm2 h ALA 37 Cb 0.84 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 3hm2 h ALA 37 CO 0.00 -0.19 -0.09 0.82 0.00 0.00 0.00 179.25 179.79 3hm2 h ILE 38 N -0.80 1.00 0.00 0.00 2.04 -1.33 -0.23 117.51 118.19 3hm2 h ILE 38 Ca -0.01 -0.32 -0.17 0.00 1.00 0.00 0.00 64.86 65.37 3hm2 h ILE 38 Cb 0.62 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.85 3hm2 h ILE 38 CO 0.01 0.09 -0.97 -0.08 0.00 0.00 0.00 178.15 177.21 3hm2 h GLU 39 N 0.00 0.00 0.00 2.37 4.57 -1.37 -1.45 114.58 118.70 3hm2 h GLU 39 Ca -0.00 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.08 3hm2 h GLU 39 Cb 0.17 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 3hm2 h GLU 39 CO 0.01 0.58 -1.18 2.35 -1.18 0.00 0.00 179.01 179.60 3hm2 h TRP 40 N 0.00 0.00 0.07 0.92 2.91 -0.86 -2.34 115.95 116.65 3hm2 h TRP 40 Ca -0.07 0.00 -0.25 0.00 1.13 0.00 0.00 58.89 59.70 3hm2 h TRP 40 Cb 1.60 0.00 0.02 0.00 -0.51 0.00 0.00 29.16 30.27 3hm2 h TRP 40 CO 0.00 0.35 -1.03 -0.07 -1.03 0.00 0.00 178.44 176.66 3hm2 h LEU 41 N 0.00 0.79 -1.67 0.65 3.38 -1.10 -2.84 115.31 114.52 3hm2 h LEU 41 Ca -0.09 -0.80 -0.04 0.00 0.09 0.00 0.00 57.88 57.04 3hm2 h LEU 41 Cb 1.35 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 3hm2 h LEU 41 CO 0.03 1.50 -0.19 -0.09 0.09 0.00 0.00 178.44 179.78 3hm2 h ARG 42 N 0.18 0.00 0.20 1.13 2.43 -1.32 -3.31 114.38 113.68 3hm2 h ARG 42 Ca -0.15 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 3hm2 h ARG 42 Cb 1.72 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.27 3hm2 h ARG 42 CO 0.20 0.19 -0.09 0.66 -1.51 0.00 0.00 179.97 179.42 3hm2 h SER 43 N 0.00 -0.22 -3.73 -3.80 4.64 -1.37 -3.47 113.55 105.60 3hm2 h SER 43 Ca -0.00 0.01 -0.47 0.00 -0.47 0.00 0.00 61.79 60.86 3hm2 h SER 43 Cb 0.37 0.06 0.06 0.00 -0.31 0.00 0.00 62.40 62.58 3hm2 h SER 43 CO 0.02 0.02 0.20 0.42 -0.87 0.00 0.00 176.83 176.63 3hm2 s THR 44 N -2.46 3.24 -0.02 2.95 -4.23 -1.08 -5.06 115.64 108.98 3hm2 s THR 44 Ca -0.04 -0.05 -0.22 0.00 -1.18 0.00 0.00 61.69 60.21 3hm2 s THR 44 Cb 0.00 -3.32 -0.05 0.00 1.34 0.00 0.00 72.50 70.47 3hm2 s THR 44 CO 0.11 -0.34 0.64 -2.16 -0.54 0.00 0.00 174.62 172.33 3hm2 s PRO 45 N -5.09 4.38 -1.96 3.99 0.05 -1.26 -4.21 135.00 130.90 3hm2 s PRO 45 Ca 0.56 0.80 0.00 0.00 0.05 0.00 0.00 61.00 62.41 3hm2 s PRO 45 Cb -0.11 -3.38 0.00 0.00 0.05 0.00 0.00 34.50 31.06 3hm2 s PRO 45 CO 0.45 0.25 0.00 1.04 0.05 0.00 0.00 177.00 178.80 3hm2 n GLN 46 N 3.11 -1.55 -1.34 4.56 6.02 -1.26 -4.92 117.38 122.00 3hm2 n GLN 46 Ca -0.05 1.10 -0.31 0.00 -0.01 0.00 0.00 57.00 57.73 3hm2 n GLN 46 Cb 0.51 -5.57 0.08 0.00 1.02 0.00 0.00 30.24 26.29 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 -2.79 3.44 -0.02 5.09 -4.23 -1.26 -4.61 115.64 111.26 3hm2 s THR 47 Ca 0.00 0.47 0.06 0.00 -1.18 0.00 0.00 61.69 61.03 3hm2 s THR 47 Cb 0.00 -3.03 -0.01 0.00 1.34 0.00 0.00 72.50 70.80 3hm2 s THR 47 CO 0.00 -0.61 -0.19 0.42 -0.54 0.00 0.00 174.62 173.70 3hm2 s THR 48 N -2.95 1.49 -0.03 3.99 -4.23 -1.25 -4.84 115.64 107.82 3hm2 s THR 48 Ca 0.61 -0.80 -0.04 0.00 -1.18 0.00 0.00 61.69 60.28 3hm2 s THR 48 Cb -0.16 -1.24 0.01 0.00 1.34 0.00 0.00 72.50 72.44 3hm2 s THR 48 CO 0.56 0.42 0.11 0.00 -0.54 0.00 0.00 174.62 175.17 3hm2 s ALA 49 N -0.37 -0.26 -0.14 3.99 0.00 -1.00 -1.75 121.76 122.24 3hm2 s ALA 49 Ca 0.05 0.16 -0.00 0.00 0.00 0.00 0.00 51.96 52.17 3hm2 s ALA 49 Cb -0.08 -0.10 0.03 0.00 0.00 0.00 0.00 23.12 22.96 3hm2 s ALA 49 CO -0.00 -0.09 -0.10 0.08 0.00 0.00 0.00 175.76 175.65 3hm2 s VAL 50 N -0.34 1.31 0.02 0.00 1.01 -0.48 -1.17 120.40 120.75 3hm2 s VAL 50 Ca -0.04 -0.55 -0.04 0.00 0.00 0.00 0.00 61.98 61.35 3hm2 s VAL 50 Cb -0.03 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 3hm2 s VAL 50 CO 0.00 0.34 0.23 0.00 0.00 0.00 0.00 175.10 175.68 3hm2 s PHE 52 N -1.38 2.78 -0.19 0.00 0.08 -0.07 -1.15 117.98 118.05 3hm2 s PHE 52 Ca 0.30 -2.93 -0.12 0.00 0.12 0.00 0.00 56.93 54.30 3hm2 s PHE 52 Cb -0.13 -2.46 -0.05 0.00 -0.57 0.00 0.00 43.02 39.81 3hm2 s PHE 52 CO 0.20 -0.74 0.23 -2.00 -0.10 0.00 0.00 175.22 172.81 3hm2 s GLU 53 N -0.20 4.19 0.08 0.44 2.56 -1.20 -3.38 118.70 121.20 3hm2 s GLU 53 Ca 0.18 -0.06 -0.30 0.00 0.00 0.00 0.00 54.97 54.80 3hm2 s GLU 53 Cb -0.23 -3.46 -0.16 0.00 2.00 0.00 0.00 34.13 32.29 3hm2 s GLU 53 CO -0.02 0.19 1.65 0.82 -0.56 0.00 0.00 175.26 177.34 3hm2 h ILE 54 N 4.78 0.46 -3.24 -3.70 2.04 -1.89 -3.17 117.51 112.79 3hm2 h ILE 54 Ca -0.40 0.00 -0.57 0.00 1.00 0.00 0.00 64.86 64.89 3hm2 h ILE 54 Cb 1.16 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 37.66 3hm2 h ILE 54 CO 0.74 0.00 -0.19 -0.94 0.00 0.00 0.00 178.15 177.76 3hm2 s SER 55 N -4.63 6.66 0.07 1.72 1.04 -1.26 -4.70 113.70 112.60 3hm2 s SER 55 Ca -0.16 0.86 -0.29 0.00 0.48 0.00 0.00 55.95 56.84 3hm2 s SER 55 Cb 0.05 -2.20 -0.17 0.00 0.10 0.00 0.00 66.02 63.79 3hm2 s SER 55 CO 0.63 0.09 1.63 -0.08 0.98 0.00 0.00 173.24 176.49 3hm2 h GLU 56 N 3.30 -0.52 -0.85 4.02 4.81 -1.98 1.44 114.58 124.80 3hm2 h GLU 56 Ca -0.48 0.04 0.12 0.00 -0.13 0.00 0.00 59.36 58.90 3hm2 h GLU 56 Cb 1.18 0.12 -0.08 0.00 0.63 0.00 0.00 28.75 30.60 3hm2 h GLU 56 CO 0.68 -0.32 0.48 1.49 -0.73 0.00 0.00 179.01 180.60 3hm2 h GLU 57 N -0.57 0.72 0.45 1.92 4.57 -1.97 0.77 114.58 120.48 3hm2 h GLU 57 Ca -0.05 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.06 3hm2 h GLU 57 Cb 0.43 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 3hm2 h GLU 57 CO 0.09 0.48 -0.23 0.00 -1.18 0.00 0.00 179.01 178.17 3hm2 h ARG 58 N 0.74 -0.59 -0.52 1.92 3.08 -1.57 0.41 114.38 117.84 3hm2 h ARG 58 Ca 0.44 0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.58 3hm2 h ARG 58 Cb 0.50 0.14 -0.05 0.00 0.08 0.00 0.00 29.97 30.64 3hm2 h ARG 58 CO -0.30 -0.40 0.24 0.00 -1.07 0.00 0.00 179.97 178.45 3hm2 h ARG 59 N -0.62 0.46 -0.90 0.04 3.08 0.24 -0.16 114.38 116.52 3hm2 h ARG 59 Ca -0.06 -0.03 0.10 0.00 0.07 0.00 0.00 59.98 60.07 3hm2 h ARG 59 Cb 0.48 -0.10 -0.07 0.00 0.08 0.00 0.00 29.97 30.36 3hm2 h ARG 59 CO 0.09 0.30 0.58 0.93 -1.07 0.00 0.00 179.97 180.80 3hm2 h GLU 60 N 0.47 0.85 -0.08 0.04 5.08 1.00 -2.54 114.58 119.41 3hm2 h GLU 60 Ca 0.24 -0.05 -0.24 0.00 -1.00 0.00 0.00 59.36 58.31 3hm2 h GLU 60 Cb 0.19 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 29.26 3hm2 h GLU 60 CO -0.19 0.56 -0.89 0.00 -1.00 0.00 0.00 179.01 177.50 3hm2 h ARG 61 N 0.88 0.68 -0.85 2.33 3.08 0.15 -2.77 114.38 117.88 3hm2 h ARG 61 Ca 0.42 -0.63 0.21 0.00 0.07 0.00 0.00 59.98 60.05 3hm2 h ARG 61 Cb 0.44 0.16 -0.13 0.00 0.08 0.00 0.00 29.97 30.52 3hm2 h ARG 61 CO -0.19 1.24 0.27 0.82 -1.07 0.00 0.00 179.97 181.04 3hm2 h ILE 62 N 0.43 0.42 -0.46 2.04 2.04 -0.74 -0.46 117.51 120.78 3hm2 h ILE 62 Ca -0.08 -0.10 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 3hm2 h ILE 62 Cb 1.52 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 3hm2 h ILE 62 CO 0.17 0.05 0.04 0.25 0.00 0.00 0.00 178.15 178.66 3hm2 h LEU 63 N 0.28 0.76 -0.33 1.44 5.85 -1.18 -2.14 115.31 119.99 3hm2 h LEU 63 Ca 0.52 -0.29 -0.16 0.00 0.84 0.00 0.00 57.88 58.79 3hm2 h LEU 63 Cb 0.98 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.81 3hm2 h LEU 63 CO -0.58 0.85 -0.41 -1.28 -0.34 0.00 0.00 178.44 176.69 3hm2 h SER 64 N 0.64 0.93 -1.13 1.25 0.87 -1.46 0.48 113.55 115.13 3hm2 h SER 64 Ca 0.13 -0.49 0.40 0.00 -1.23 0.00 0.00 61.79 60.60 3hm2 h SER 64 Cb 0.44 -0.26 -0.15 0.00 -0.44 0.00 0.00 62.40 61.99 3hm2 h SER 64 CO 0.02 1.24 0.68 -1.13 -0.53 0.00 0.00 176.83 177.10 3hm2 h ASN 65 N 0.65 0.35 0.00 6.23 -1.24 -0.58 -0.13 115.58 120.86 3hm2 h ASN 65 Ca 0.04 0.19 -0.38 0.00 0.71 0.00 0.00 56.30 56.86 3hm2 h ASN 65 Cb 1.00 0.17 -0.06 0.00 0.73 0.00 0.00 38.32 40.16 3hm2 h ASN 65 CO 0.10 -0.24 -2.31 0.00 -1.29 0.00 0.00 177.43 173.69 3hm2 n ALA 66 N -2.38 1.48 -0.23 1.57 0.00 -0.85 -4.03 120.51 116.06 3hm2 n ALA 66 Ca 0.36 -0.95 -0.00 0.00 0.00 0.00 0.00 53.44 52.85 3hm2 n ALA 66 Cb 1.25 0.13 0.07 0.00 0.00 0.00 0.00 19.45 20.90 3hm2 n ALA 66 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3hm2 h ILE 67 N -0.59 0.29 0.00 0.00 2.04 -0.80 0.51 117.51 118.97 3hm2 h ILE 67 Ca -0.57 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.29 3hm2 h ILE 67 Cb 1.61 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.98 3hm2 h ILE 67 CO -0.28 0.00 0.00 0.78 0.00 0.00 0.00 178.15 178.65 3hm2 h ASN 68 N -0.02 0.00 -0.47 1.72 2.35 -1.21 -2.13 115.58 115.82 3hm2 h ASN 68 Ca 0.32 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.89 3hm2 h ASN 68 Cb 0.51 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 38.77 3hm2 h ASN 68 CO -0.71 0.00 0.09 0.18 -1.65 0.00 0.00 177.43 175.34 3hm2 n LEU 69 N -2.87 4.70 0.00 1.61 4.77 0.18 -4.95 117.00 120.44 3hm2 n LEU 69 Ca -0.02 -3.47 0.00 0.00 -0.03 0.00 0.00 56.01 52.48 3hm2 n LEU 69 Cb 0.08 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.51 3hm2 n LEU 69 CO 0.18 1.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.86 3hm2 n GLY 70 N -0.83 0.04 0.03 -0.72 0.00 -0.80 -4.78 105.19 98.13 3hm2 n GLY 70 Ca 0.35 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.48 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 -2.02 0.17 0.08 1.61 0.31 -0.87 -4.62 118.33 112.99 3hm2 n VAL 71 Ca 0.00 -0.23 0.19 0.00 -0.01 0.00 0.00 64.34 64.30 3hm2 n VAL 71 Cb 0.16 0.21 0.61 0.00 -0.91 0.00 0.00 33.84 33.91 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 0.00 0.00 0.79 4.52 4.64 -1.84 -1.77 113.55 119.89 3hm2 h SER 72 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hm2 h SER 72 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 3hm2 h SER 72 CO 0.00 0.00 -0.12 0.47 -0.87 0.00 0.00 176.83 176.31 3hm2 n ASP 73 N -3.31 0.16 -1.15 4.97 8.00 -1.26 -3.73 116.55 120.21 3hm2 n ASP 73 Ca 0.09 0.17 -0.04 0.00 0.71 0.00 0.00 54.79 55.72 3hm2 n ASP 73 Cb 0.85 -0.27 0.14 0.00 -0.02 0.00 0.00 41.12 41.81 3hm2 n ASP 73 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3hm2 n ARG 74 N -1.43 2.24 -3.96 -1.24 1.74 -0.66 -5.04 116.66 108.30 3hm2 n ARG 74 Ca 0.08 -3.57 -0.09 0.00 -0.77 0.00 0.00 57.85 53.51 3hm2 n ARG 74 Cb 0.32 -1.79 -0.09 0.00 -1.02 0.00 0.00 32.46 29.88 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 -3.61 0.15 -0.09 0.55 2.07 -1.24 -2.37 121.20 116.65 3hm2 s ILE 75 Ca 0.42 -1.24 0.01 0.00 -1.41 0.00 0.00 60.65 58.42 3hm2 s ILE 75 Cb 0.38 -1.03 0.02 0.00 0.13 0.00 0.00 42.46 41.97 3hm2 s ILE 75 CO -0.04 -0.69 -0.09 0.00 -1.91 0.00 0.00 174.94 172.22 3hm2 s ALA 76 N -2.93 1.27 -0.54 1.50 0.00 -0.32 -4.97 121.76 115.77 3hm2 s ALA 76 Ca -0.02 -0.48 -0.19 0.00 0.00 0.00 0.00 51.96 51.27 3hm2 s ALA 76 Cb 0.01 -0.76 0.08 0.00 0.00 0.00 0.00 23.12 22.44 3hm2 s ALA 76 CO -0.06 -0.21 0.65 0.08 0.00 0.00 0.00 175.76 176.22 3hm2 s VAL 77 N 1.29 4.87 0.21 0.00 1.01 -1.26 -0.05 120.40 126.48 3hm2 s VAL 77 Ca -0.03 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.21 3hm2 s VAL 77 Cb -0.14 -4.37 0.04 0.00 0.00 0.00 0.00 36.38 31.91 3hm2 s VAL 77 CO -0.04 -0.93 0.29 0.00 0.00 0.00 0.00 175.10 174.42 3hm2 n GLN 78 N 6.18 0.43 -0.02 2.72 1.13 -0.30 -4.97 117.38 122.55 3hm2 n GLN 78 Ca -0.08 -0.81 0.00 0.00 -1.94 0.00 0.00 57.00 54.17 3hm2 n GLN 78 Cb 0.44 -0.19 0.00 0.00 0.11 0.00 0.00 30.24 30.60 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 -1.53 1.21 -2.93 -1.09 6.02 -1.26 -3.68 117.38 114.12 3hm2 n GLN 79 Ca 0.05 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.71 3hm2 n GLN 79 Cb 0.17 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.38 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 -1.20 2.29 0.41 1.08 0.00 -1.20 -3.23 107.32 105.47 3hm2 s GLY 80 Ca 0.00 0.16 -0.22 0.00 0.00 0.00 0.00 44.72 44.66 3hm2 s GLY 80 CO 0.00 0.39 0.94 0.00 0.00 0.00 0.00 173.10 174.43 3hm2 s ALA 81 N -2.16 3.08 -2.08 3.20 0.00 -1.26 -1.78 121.76 120.76 3hm2 s ALA 81 Ca 0.57 0.41 0.22 0.00 0.00 0.00 0.00 51.96 53.16 3hm2 s ALA 81 Cb -0.10 -3.14 0.54 0.00 0.00 0.00 0.00 23.12 20.43 3hm2 s ALA 81 CO 0.19 0.15 1.47 -0.35 0.00 0.00 0.00 175.76 177.21 3hm2 n PRO 82 N -0.41 2.64 0.11 0.00 -0.05 -1.26 -4.79 135.00 131.23 3hm2 n PRO 82 Ca 0.06 -2.49 0.07 0.00 -0.05 0.00 0.00 63.50 61.09 3hm2 n PRO 82 Cb 0.53 -1.53 0.01 0.00 -0.05 0.00 0.00 33.50 32.46 3hm2 n PRO 82 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 175.50 175.36 3hm2 h ARG 83 N 4.22 0.00 0.00 0.54 1.12 -1.93 -3.29 114.38 115.04 3hm2 h ARG 83 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 3hm2 h ARG 83 Cb 0.97 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.93 3hm2 h ARG 83 CO 0.00 0.16 -0.64 0.00 -3.11 0.00 0.00 179.97 176.38 3hm2 n ALA 84 N -2.24 3.29 0.25 2.80 0.00 -0.73 -3.90 120.51 119.98 3hm2 n ALA 84 Ca -0.02 -0.32 0.09 0.00 0.00 0.00 0.00 53.44 53.19 3hm2 n ALA 84 Cb 0.66 -1.11 0.65 0.00 0.00 0.00 0.00 19.45 19.64 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 0.00 -0.27 0.00 0.04 -1.81 -1.11 116.94 113.79 3hm2 h PHE 85 Ca 0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 3hm2 h PHE 85 Cb 0.63 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.77 3hm2 h PHE 85 CO 0.00 0.09 0.11 -0.44 -0.60 0.00 0.00 178.31 177.46 3hm2 h ASP 86 N 0.00 0.33 0.00 2.17 3.32 -1.78 -1.64 116.42 118.82 3hm2 h ASP 86 Ca -0.00 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.02 3hm2 h ASP 86 Cb 0.17 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.63 3hm2 h ASP 86 CO 0.01 0.31 0.00 0.47 -1.72 0.00 0.00 179.24 178.31 3hm2 n ASP 87 N -4.43 0.00 -3.80 6.45 8.00 -0.42 -4.41 116.55 117.94 3hm2 n ASP 87 Ca 0.01 -0.65 -0.30 0.00 0.71 0.00 0.00 54.79 54.56 3hm2 n ASP 87 Cb 0.13 0.00 -0.15 0.00 -0.02 0.00 0.00 41.12 41.08 3hm2 n ASP 87 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3hm2 s VAL 88 N -2.00 1.21 0.24 2.53 1.01 -0.62 -5.04 120.40 117.74 3hm2 s VAL 88 Ca 0.24 -1.61 -0.11 0.00 0.00 0.00 0.00 61.98 60.51 3hm2 s VAL 88 Cb 0.11 -1.90 0.34 0.00 0.00 0.00 0.00 36.38 34.93 3hm2 s VAL 88 CO 0.19 -0.64 1.60 -0.65 0.00 0.00 0.00 175.10 175.59 3hm2 h PRO 89 N 7.98 0.00 -7.52 2.72 0.11 -1.80 -3.45 132.00 130.04 3hm2 h PRO 89 Ca -0.11 -0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.54 3hm2 h PRO 89 Cb 1.02 -0.00 0.13 0.00 0.11 0.00 0.00 31.00 32.26 3hm2 h PRO 89 CO 0.48 0.00 0.28 -0.51 -0.21 0.00 0.00 178.00 178.05 3hm2 s ASP 90 N -5.24 3.46 -0.11 -2.05 1.11 -1.26 -5.10 116.67 107.48 3hm2 s ASP 90 Ca -0.15 -0.15 0.01 0.00 0.18 0.00 0.00 52.55 52.44 3hm2 s ASP 90 Cb 0.23 0.05 -0.02 0.00 1.07 0.00 0.00 42.92 44.26 3hm2 s ASP 90 CO 0.76 -2.48 -0.14 0.20 1.18 0.00 0.00 175.17 174.69 3hm2 s ASN 91 N -4.89 3.94 0.87 0.27 0.02 -1.26 -5.08 114.94 108.82 3hm2 s ASN 91 Ca 0.73 -0.31 -0.13 0.00 -1.02 0.00 0.00 52.86 52.12 3hm2 s ASN 91 Cb -0.03 -1.39 0.12 0.00 0.02 0.00 0.00 41.25 39.97 3hm2 s ASN 91 CO 0.50 0.21 1.21 -2.16 0.02 0.00 0.00 177.10 176.88 3hm2 s PRO 92 N 0.06 1.44 0.05 -0.60 0.04 -1.26 -4.97 135.00 129.76 3hm2 s PRO 92 Ca -0.06 -0.01 0.00 0.00 0.04 0.00 0.00 61.00 60.98 3hm2 s PRO 92 Cb -0.15 -1.90 -0.26 0.00 0.04 0.00 0.00 34.50 32.23 3hm2 s PRO 92 CO 0.05 -1.93 1.03 -0.44 0.04 0.00 0.00 177.00 175.74 3hm2 h ASP 93 N -1.30 0.27 -5.22 6.66 3.32 -0.69 -3.41 116.42 116.05 3hm2 h ASP 93 Ca -0.46 -0.34 -0.21 0.00 0.02 0.00 0.00 57.03 56.05 3hm2 h ASP 93 Cb 1.30 -0.09 -0.15 0.00 0.22 0.00 0.00 39.33 40.62 3hm2 h ASP 93 CO 0.57 1.27 -0.65 -0.69 -1.72 0.00 0.00 179.24 178.03 3hm2 s VAL 94 N -2.65 0.23 -0.26 -1.35 1.01 -0.22 -1.79 120.40 115.36 3hm2 s VAL 94 Ca -0.05 -1.92 -0.09 0.00 0.00 0.00 0.00 61.98 59.92 3hm2 s VAL 94 Cb 0.08 -2.06 0.11 0.00 0.00 0.00 0.00 36.38 34.52 3hm2 s VAL 94 CO 0.85 -0.47 0.58 -0.63 0.00 0.00 0.00 175.10 175.42 3hm2 s ILE 95 N -3.96 -0.80 -0.19 2.22 1.01 0.11 -0.36 121.20 119.22 3hm2 s ILE 95 Ca 0.24 0.05 -0.04 0.00 0.00 0.00 0.00 60.65 60.90 3hm2 s ILE 95 Cb 0.07 -0.89 -0.02 0.00 0.01 0.00 0.00 42.46 41.63 3hm2 s ILE 95 CO 0.02 0.02 -0.02 0.12 0.00 0.00 0.00 174.94 175.09 3hm2 s PHE 96 N 2.69 3.02 -0.51 3.97 5.36 0.35 -0.65 117.98 132.21 3hm2 s PHE 96 Ca -0.05 -0.48 -0.16 0.00 -0.96 0.00 0.00 56.93 55.28 3hm2 s PHE 96 Cb -0.11 -2.05 0.11 0.00 -0.34 0.00 0.00 43.02 40.62 3hm2 s PHE 96 CO -0.17 -0.23 0.47 0.42 -1.46 0.00 0.00 175.22 174.24 3hm2 s ILE 97 N 0.91 5.21 -0.54 3.12 1.01 0.45 -1.23 121.20 130.13 3hm2 s ILE 97 Ca 0.01 -1.31 0.25 0.00 0.00 0.00 0.00 60.65 59.59 3hm2 s ILE 97 Cb -0.14 -4.26 0.27 0.00 0.01 0.00 0.00 42.46 38.34 3hm2 s ILE 97 CO 0.02 -0.76 1.75 1.23 0.00 0.00 0.00 174.94 177.17 3hm2 h GLY 98 N 8.87 0.00 0.00 6.18 0.00 -1.44 -1.98 103.07 114.70 3hm2 h GLY 98 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 3hm2 h GLY 98 CO 0.98 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.13 3hm2 n GLY 99 N 0.53 2.22 3.15 4.60 0.00 -1.26 -4.55 105.19 109.88 3hm2 n GLY 99 Ca 0.03 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.95 3hm2 n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hm2 n GLY 100 N -0.86 -1.11 0.31 -0.02 0.00 -1.26 -3.14 105.19 99.11 3hm2 n GLY 100 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 46.02 46.56 3hm2 n GLY 100 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hm2 n LEU 101 N -2.95 0.44 -0.03 0.99 4.77 -1.26 -3.61 117.00 115.35 3hm2 n LEU 101 Ca -0.06 -0.22 0.06 0.00 -0.03 0.00 0.00 56.01 55.76 3hm2 n LEU 101 Cb 0.60 -0.22 -0.16 0.00 -2.33 0.00 0.00 43.42 41.31 3hm2 n LEU 101 CO 0.56 0.11 -0.84 0.35 -1.33 0.00 0.00 177.39 176.24 3hm2 n THR 102 N -0.10 0.31 -1.79 -5.08 -2.24 -1.26 -4.92 114.28 99.19 3hm2 n THR 102 Ca 0.00 -0.56 -0.42 0.00 -2.27 0.00 0.00 64.05 60.80 3hm2 n THR 102 Cb 0.11 -0.10 -0.03 0.00 -2.10 0.00 0.00 70.33 68.22 3hm2 n THR 102 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hm2 s ALA 103 N -3.22 3.87 0.24 6.98 0.00 -1.24 -4.89 121.76 123.50 3hm2 s ALA 103 Ca -0.08 1.53 -0.31 0.00 0.00 0.00 0.00 51.96 53.10 3hm2 s ALA 103 Cb 0.12 -3.67 -0.11 0.00 0.00 0.00 0.00 23.12 19.45 3hm2 s ALA 103 CO 0.85 -0.89 1.61 -2.14 0.00 0.00 0.00 175.76 175.20 3hm2 s PRO 104 N 0.98 4.16 0.00 0.00 0.02 -1.26 -2.87 135.00 136.02 3hm2 s PRO 104 Ca 0.72 2.52 0.00 0.00 0.02 0.00 0.00 61.00 64.26 3hm2 s PRO 104 Cb -0.48 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 30.97 3hm2 s PRO 104 CO 0.34 -0.64 0.00 0.41 -0.33 0.00 0.00 177.00 176.77 3hm2 n GLY 105 N 3.03 1.77 0.11 0.52 0.00 -1.26 -4.73 105.19 104.63 3hm2 n GLY 105 Ca 0.11 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 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 1.05 -0.14 1.61 2.07 -1.83 -1.56 116.25 117.45 3hm2 h VAL 106 Ca 0.00 -0.97 -0.05 0.00 0.82 0.00 0.00 66.70 66.51 3hm2 h VAL 106 Cb 0.00 1.63 -0.00 0.00 -1.52 0.00 0.00 31.29 31.40 3hm2 h VAL 106 CO 0.00 0.22 -0.09 0.15 0.02 0.00 0.00 177.57 177.87 3hm2 h PHE 107 N -0.65 0.36 -0.50 1.57 3.57 -1.89 -2.25 116.94 117.15 3hm2 h PHE 107 Ca -0.02 -0.10 0.07 0.00 3.53 0.00 0.00 57.97 61.46 3hm2 h PHE 107 Cb 0.49 -0.08 -0.10 0.00 2.79 0.00 0.00 35.95 39.06 3hm2 h PHE 107 CO 0.07 0.67 -0.46 0.00 -2.23 0.00 0.00 178.31 176.35 3hm2 h ALA 108 N 0.64 -0.46 -0.40 2.41 0.00 -1.93 0.33 119.26 119.84 3hm2 h ALA 108 Ca 0.03 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 3hm2 h ALA 108 Cb 0.59 0.99 -0.02 0.00 0.00 0.00 0.00 17.79 19.35 3hm2 h ALA 108 CO 0.03 -0.89 -0.15 0.00 0.00 0.00 0.00 179.25 178.23 3hm2 h ALA 109 N 0.41 0.97 0.14 0.00 0.00 -1.33 -2.23 119.26 117.23 3hm2 h ALA 109 Ca 0.14 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 3hm2 h ALA 109 Cb 0.57 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3hm2 h ALA 109 CO -0.64 0.60 -0.07 0.00 0.00 0.00 0.00 179.25 179.14 3hm2 h ALA 110 N 1.16 -0.19 -0.89 0.00 0.00 -0.75 -2.99 119.26 115.60 3hm2 h ALA 110 Ca 0.11 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.92 3hm2 h ALA 110 Cb 0.63 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 3hm2 h ALA 110 CO 0.04 -0.53 0.58 2.35 0.00 0.00 0.00 179.25 181.70 3hm2 h TRP 111 N -0.36 1.10 0.00 0.00 2.91 -0.36 0.12 115.95 119.37 3hm2 h TRP 111 Ca -0.02 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.03 3hm2 h TRP 111 Cb 0.29 -0.37 0.00 0.00 -0.51 0.00 0.00 29.16 28.56 3hm2 h TRP 111 CO -0.02 0.68 0.00 0.36 -1.03 0.00 0.00 178.44 178.43 3hm2 n LYS 112 N -4.49 0.16 0.08 2.65 -0.00 -0.84 -0.57 118.16 115.15 3hm2 n LYS 112 Ca 0.10 0.53 0.12 0.00 -0.00 0.00 0.00 58.31 59.06 3hm2 n LYS 112 Cb 0.04 -1.91 0.04 0.00 -0.00 0.00 0.00 35.03 33.20 3hm2 n LYS 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 3hm2 n ARG 113 N -2.24 0.48 -2.99 -1.58 5.12 0.01 -4.85 116.66 110.61 3hm2 n ARG 113 Ca 0.00 0.09 -0.40 0.00 -1.93 0.00 0.00 57.85 55.62 3hm2 n ARG 113 Cb 0.13 -1.76 -0.04 0.00 -1.16 0.00 0.00 32.46 29.63 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 -4.87 4.34 0.94 0.55 2.96 0.26 -4.33 118.68 118.53 3hm2 s LEU 114 Ca 0.02 1.28 -0.14 0.00 -0.22 0.00 0.00 54.13 55.06 3hm2 s LEU 114 Cb 0.11 -3.16 0.16 0.00 0.50 0.00 0.00 46.19 43.80 3hm2 s LEU 114 CO 0.78 -0.12 1.18 -2.84 -1.32 0.00 0.00 176.35 174.02 3hm2 s PRO 115 N 0.75 0.90 0.31 0.98 0.02 -1.26 -4.99 135.00 131.70 3hm2 s PRO 115 Ca 0.40 0.07 -0.29 0.00 0.02 0.00 0.00 61.00 61.19 3hm2 s PRO 115 Cb -0.18 -1.83 -0.10 0.00 0.02 0.00 0.00 34.50 32.40 3hm2 s PRO 115 CO 0.20 -2.32 1.36 0.08 -0.33 0.00 0.00 177.00 175.99 3hm2 s VAL 116 N -3.43 2.64 0.00 3.83 1.01 -1.26 -3.30 120.40 119.89 3hm2 s VAL 116 Ca 0.66 0.61 0.00 0.00 0.00 0.00 0.00 61.98 63.26 3hm2 s VAL 116 Cb -0.11 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.88 3hm2 s VAL 116 CO 0.53 0.13 0.00 0.61 0.00 0.00 0.00 175.10 176.37 3hm2 n GLY 117 N 1.12 2.40 2.13 4.51 0.00 1.00 -4.94 105.19 111.41 3hm2 n GLY 117 Ca 0.02 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.85 3hm2 n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hm2 n GLY 118 N -2.00 -2.90 2.99 -0.02 0.00 -1.21 -4.60 105.19 97.46 3hm2 n GLY 118 Ca 0.00 -1.43 -0.14 0.00 0.00 0.00 0.00 46.02 44.45 3hm2 n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hm2 s ARG 119 N -4.49 0.39 -0.05 1.61 0.52 -0.74 -1.38 118.95 114.81 3hm2 s ARG 119 Ca 0.43 -0.41 -0.02 0.00 -0.52 0.00 0.00 55.73 55.22 3hm2 s ARG 119 Cb -0.05 -0.26 0.04 0.00 0.52 0.00 0.00 34.95 35.19 3hm2 s ARG 119 CO 0.34 0.06 0.09 -1.17 0.02 0.00 0.00 175.30 174.64 3hm2 s LEU 120 N -0.76 0.48 -0.06 2.53 0.20 -1.16 -0.71 118.68 119.20 3hm2 s LEU 120 Ca -0.04 0.18 0.03 0.00 0.69 0.00 0.00 54.13 54.99 3hm2 s LEU 120 Cb -0.05 0.09 -0.02 0.00 -0.43 0.00 0.00 46.19 45.77 3hm2 s LEU 120 CO -0.00 -0.19 -0.16 -0.69 -0.29 0.00 0.00 176.35 175.02 3hm2 s VAL 121 N 1.67 2.93 0.00 1.68 1.01 0.18 -2.05 120.40 125.83 3hm2 s VAL 121 Ca -0.02 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.23 3hm2 s VAL 121 Cb -0.12 -2.15 -0.01 0.00 0.00 0.00 0.00 36.38 34.10 3hm2 s VAL 121 CO -0.04 0.58 -0.11 0.00 0.00 0.00 0.00 175.10 175.53 3hm2 s ALA 122 N -0.51 0.90 0.20 5.51 0.00 -0.49 -0.41 121.76 126.96 3hm2 s ALA 122 Ca 0.07 -0.53 0.04 0.00 0.00 0.00 0.00 51.96 51.54 3hm2 s ALA 122 Cb -0.12 -0.20 -0.03 0.00 0.00 0.00 0.00 23.12 22.77 3hm2 s ALA 122 CO 0.01 0.20 0.29 -0.80 0.00 0.00 0.00 175.76 175.47 3hm2 s ASN 123 N -0.48 6.19 -0.01 0.00 0.01 -0.75 -0.66 114.94 119.24 3hm2 s ASN 123 Ca 0.03 0.07 0.00 0.00 -0.71 0.00 0.00 52.86 52.25 3hm2 s ASN 123 Cb -0.05 -1.80 0.01 0.00 0.41 0.00 0.00 41.25 39.81 3hm2 s ASN 123 CO -0.00 -0.00 0.00 0.00 -1.51 0.00 0.00 177.10 175.59 3hm2 s ALA 124 N -1.88 0.08 -0.01 0.60 0.00 0.20 -4.38 121.76 116.38 3hm2 s ALA 124 Ca 0.34 0.06 0.03 0.00 0.00 0.00 0.00 51.96 52.39 3hm2 s ALA 124 Cb -0.10 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 22.89 3hm2 s ALA 124 CO 0.28 -0.02 0.05 1.55 0.00 0.00 0.00 175.76 177.62 3hm2 n VAL 125 N 3.40 0.08 -3.81 0.00 3.14 -1.26 -0.48 118.33 119.39 3hm2 n VAL 125 Ca -0.17 -0.09 -0.28 0.00 -2.96 0.00 0.00 64.34 60.84 3hm2 n VAL 125 Cb 0.57 -0.07 -0.03 0.00 -1.06 0.00 0.00 33.84 33.24 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 -2.17 5.27 0.43 1.55 -4.23 -1.26 -4.89 115.64 110.33 3hm2 s THR 126 Ca -0.01 -0.44 0.12 0.00 -1.18 0.00 0.00 61.69 60.17 3hm2 s THR 126 Cb 0.02 -3.71 0.31 0.00 1.34 0.00 0.00 72.50 70.45 3hm2 s THR 126 CO 0.13 -0.08 2.00 0.58 -0.54 0.00 0.00 174.62 176.71 3hm2 h VAL 127 N 1.70 0.95 0.10 2.29 2.07 -1.97 0.54 116.25 121.93 3hm2 h VAL 127 Ca -0.47 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 66.88 3hm2 h VAL 127 Cb 1.19 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 3hm2 h VAL 127 CO 0.70 0.08 -0.05 -0.33 0.02 0.00 0.00 177.57 177.99 3hm2 h GLU 128 N 0.46 -0.13 -0.90 1.57 3.07 -1.98 0.97 114.58 117.63 3hm2 h GLU 128 Ca 0.24 0.01 0.01 0.00 -0.50 0.00 0.00 59.36 59.12 3hm2 h GLU 128 Cb 0.37 0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 28.27 3hm2 h GLU 128 CO -0.07 0.27 0.59 0.77 -1.40 0.00 0.00 179.01 179.17 3hm2 h SER 129 N -0.57 1.05 0.49 1.42 0.02 -1.88 -3.14 113.55 110.94 3hm2 h SER 129 Ca -0.01 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 3hm2 h SER 129 Cb 0.46 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 3hm2 h SER 129 CO 0.02 0.77 -0.36 -0.08 -1.14 0.00 0.00 176.83 176.04 3hm2 h GLU 130 N 1.23 -0.80 -1.95 3.45 4.81 -0.79 0.17 114.58 120.69 3hm2 h GLU 130 Ca 0.33 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.61 3hm2 h GLU 130 Cb -0.12 0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.44 3hm2 h GLU 130 CO -0.07 -0.53 0.00 1.04 -0.73 0.00 0.00 179.01 178.72 3hm2 n GLN 131 N -5.48 0.06 0.00 1.92 6.02 0.33 -2.37 117.38 117.85 3hm2 n GLN 131 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.88 3hm2 n GLN 131 Cb 0.38 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.17 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 1.13 0.00 -0.07 1.08 4.77 0.58 -1.63 117.00 122.86 3hm2 n LEU 133 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 3hm2 n LEU 133 Cb 0.03 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.03 3hm2 n LEU 133 CO 0.00 0.00 0.11 -0.50 -1.33 0.00 0.00 177.39 175.67 3hm2 h TRP 134 N 0.00 0.00 -0.65 -1.77 4.06 -1.73 0.70 115.95 116.57 3hm2 h TRP 134 Ca 0.00 0.00 0.06 0.00 2.06 0.00 0.00 58.89 61.01 3hm2 h TRP 134 Cb 0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 29.16 28.08 3hm2 h TRP 134 CO 0.00 0.77 -0.39 0.00 -3.56 0.00 0.00 178.44 175.27 3hm2 n ALA 135 N -2.84 -0.42 0.03 1.49 0.00 -0.65 -0.89 120.51 117.24 3hm2 n ALA 135 Ca -0.11 0.55 -0.10 0.00 0.00 0.00 0.00 53.44 53.78 3hm2 n ALA 135 Cb 0.38 0.07 -0.04 0.00 0.00 0.00 0.00 19.45 19.87 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 -0.71 -1.69 0.00 3.38 -1.81 -2.81 115.31 111.66 3hm2 h LEU 136 Ca 0.10 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 3hm2 h LEU 136 Cb 0.27 0.31 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 3hm2 h LEU 136 CO -0.61 -0.29 -0.16 -0.09 0.09 0.00 0.00 178.44 177.37 3hm2 h ARG 137 N -0.33 0.00 -0.00 1.13 1.12 0.76 0.37 114.38 117.44 3hm2 h ARG 137 Ca 0.08 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.95 3hm2 h ARG 137 Cb 0.45 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.41 3hm2 h ARG 137 CO -0.26 0.16 -0.03 1.63 -3.11 0.00 0.00 179.97 178.36 3hm2 n LYS 138 N -3.62 0.26 -0.00 0.20 5.02 -0.06 -2.98 118.16 116.97 3hm2 n LYS 138 Ca -0.01 -0.02 0.03 0.00 -2.02 0.00 0.00 58.31 56.29 3hm2 n LYS 138 Cb 0.29 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.75 3hm2 n LYS 138 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 3hm2 n GLN 139 N -1.36 0.25 0.00 1.97 7.27 0.13 -4.66 117.38 120.98 3hm2 n GLN 139 Ca 0.11 -0.06 0.00 0.00 0.07 0.00 0.00 57.00 57.12 3hm2 n GLN 139 Cb 0.29 -1.14 0.00 0.00 2.41 0.00 0.00 30.24 31.79 3hm2 n GLN 139 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 3hm2 n PHE 140 N -1.71 0.00 -2.85 3.69 3.72 -0.82 -5.10 117.46 114.39 3hm2 n PHE 140 Ca -0.01 -0.20 0.00 0.00 -0.05 0.00 0.00 57.45 57.19 3hm2 n PHE 140 Cb 0.16 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 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 -0.20 -1.93 0.24 1.37 0.00 -1.16 -4.69 105.19 98.82 3hm2 n GLY 141 Ca 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.42 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 -1.85 3.20 -0.02 0.00 -1.26 -4.65 105.19 100.62 3hm2 n GLY 142 Ca 0.00 -2.00 -0.13 0.00 0.00 0.00 0.00 46.02 43.89 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 0.00 0.04 -0.14 2.61 2.01 -0.70 -5.02 115.64 114.45 3hm2 s THR 143 Ca 0.00 -0.36 -0.03 0.00 0.31 0.00 0.00 61.69 61.61 3hm2 s THR 143 Cb 0.00 -0.53 -0.03 0.00 0.01 0.00 0.00 72.50 71.96 3hm2 s THR 143 CO 0.00 -0.20 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.05 3hm2 s ILE 144 N -0.87 3.81 0.41 1.82 1.01 -1.26 -1.31 121.20 124.81 3hm2 s ILE 144 Ca -0.10 -0.40 0.06 0.00 0.00 0.00 0.00 60.65 60.21 3hm2 s ILE 144 Cb -0.05 -2.65 -0.07 0.00 0.01 0.00 0.00 42.46 39.71 3hm2 s ILE 144 CO 0.03 0.52 0.02 -0.44 0.00 0.00 0.00 174.94 175.06 3hm2 s SER 145 N 0.13 3.68 -0.12 3.58 0.01 -0.23 -4.98 113.70 115.78 3hm2 s SER 145 Ca -0.02 -1.42 -0.21 0.00 1.31 0.00 0.00 55.95 55.62 3hm2 s SER 145 Cb -0.14 -0.21 0.05 0.00 0.21 0.00 0.00 66.02 65.93 3hm2 s SER 145 CO 0.03 -0.54 0.52 -0.94 0.41 0.00 0.00 173.24 172.72 3hm2 s SER 146 N -3.70 -0.49 -0.17 2.44 1.04 -1.26 -0.63 113.70 110.93 3hm2 s SER 146 Ca 0.31 0.74 0.00 0.00 0.48 0.00 0.00 55.95 57.48 3hm2 s SER 146 Cb 0.09 0.75 0.03 0.00 0.10 0.00 0.00 66.02 66.99 3hm2 s SER 146 CO 0.16 -0.36 -0.10 -0.36 0.98 0.00 0.00 173.24 173.55 3hm2 s PHE 147 N -0.50 2.09 -0.32 5.02 0.08 0.24 -4.93 117.98 119.67 3hm2 s PHE 147 Ca -0.06 -1.28 -0.06 0.00 0.12 0.00 0.00 56.93 55.65 3hm2 s PHE 147 Cb -0.03 -1.51 0.03 0.00 -0.57 0.00 0.00 43.02 40.93 3hm2 s PHE 147 CO 0.04 -0.67 0.08 0.00 -0.10 0.00 0.00 175.22 174.57 3hm2 s ALA 148 N 1.51 3.02 -0.01 5.36 0.00 -1.26 -0.64 121.76 129.74 3hm2 s ALA 148 Ca 0.02 -1.63 0.03 0.00 0.00 0.00 0.00 51.96 50.38 3hm2 s ALA 148 Cb -0.15 -2.18 -0.03 0.00 0.00 0.00 0.00 23.12 20.76 3hm2 s ALA 148 CO -0.09 -1.16 -0.06 0.42 0.00 0.00 0.00 175.76 174.87 3hm2 s ILE 149 N 1.43 3.67 0.00 0.00 1.01 -1.26 -5.05 121.20 121.00 3hm2 s ILE 149 Ca -0.00 -0.73 0.08 0.00 0.00 0.00 0.00 60.65 60.00 3hm2 s ILE 149 Cb -0.19 -2.58 -0.02 0.00 0.01 0.00 0.00 42.46 39.68 3hm2 s ILE 149 CO 0.02 0.42 -0.24 -0.44 0.00 0.00 0.00 174.94 174.70 3hm2 s SER 150 N -1.34 3.28 0.09 3.58 0.01 -1.26 -1.97 113.70 116.09 3hm2 s SER 150 Ca 0.16 -0.47 0.10 0.00 1.31 0.00 0.00 55.95 57.05 3hm2 s SER 150 Cb -0.11 -0.42 -0.04 0.00 0.21 0.00 0.00 66.02 65.67 3hm2 s SER 150 CO 0.07 0.30 -0.24 -1.00 0.41 0.00 0.00 173.24 172.77 3hm2 s HIS 151 N -0.71 2.38 0.94 2.43 3.76 -0.59 -4.94 115.29 118.55 3hm2 s HIS 151 Ca 0.11 -0.36 -0.12 0.00 -0.15 0.00 0.00 55.06 54.54 3hm2 s HIS 151 Cb -0.10 -1.34 0.05 0.00 1.11 0.00 0.00 32.58 32.30 3hm2 s HIS 151 CO 0.01 0.26 0.50 -0.85 -0.85 0.00 0.00 174.74 173.81 3hm2 n GLU 152 N 1.27 -0.31 -3.29 1.40 0.28 -1.26 -1.20 120.64 117.54 3hm2 n GLU 152 Ca -0.17 -0.04 0.02 0.00 -0.16 0.00 0.00 57.16 56.80 3hm2 n GLU 152 Cb 0.52 -1.92 -0.02 0.00 1.43 0.00 0.00 31.44 31.45 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 -2.42 -1.48 -0.25 -1.84 2.46 -0.68 -4.64 115.29 106.45 3hm2 s HIS 153 Ca 0.58 1.79 -0.18 0.00 0.47 0.00 0.00 55.06 57.72 3hm2 s HIS 153 Cb -0.21 0.58 -0.03 0.00 -0.13 0.00 0.00 32.58 32.78 3hm2 s HIS 153 CO 0.66 -0.81 0.50 -0.08 -2.47 0.00 0.00 174.74 172.54 3hm2 s THR 154 N 2.84 5.09 -0.47 0.89 -1.32 -1.26 -2.52 115.64 118.89 3hm2 s THR 154 Ca 0.14 0.86 0.03 0.00 -1.21 0.00 0.00 61.69 61.51 3hm2 s THR 154 Cb -0.14 -3.82 0.15 0.00 -1.51 0.00 0.00 72.50 67.18 3hm2 s THR 154 CO -0.20 0.11 0.32 -0.69 -2.21 0.00 0.00 174.62 171.95 3hm2 s VAL 155 N 2.15 1.15 0.00 5.08 1.01 0.05 -5.00 120.40 124.84 3hm2 s VAL 155 Ca 0.21 -2.81 0.00 0.00 0.00 0.00 0.00 61.98 59.38 3hm2 s VAL 155 Cb -0.16 -1.79 0.00 0.00 0.00 0.00 0.00 36.38 34.44 3hm2 s VAL 155 CO 0.09 -1.05 0.00 0.61 0.00 0.00 0.00 175.10 174.75 3hm2 n GLY 156 N 3.06 0.15 1.17 4.51 0.00 -1.26 -3.20 105.19 109.62 3hm2 n GLY 156 Ca 0.19 -0.98 -0.03 0.00 0.00 0.00 0.00 46.02 45.20 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 2.38 3.14 -4.03 1.61 3.41 -1.26 -4.80 113.62 114.08 3hm2 n SER 157 Ca 0.00 -2.22 -0.28 0.00 -0.26 0.00 0.00 58.87 56.10 3hm2 n SER 157 Cb 0.00 -0.55 -0.17 0.00 -0.26 0.00 0.00 64.21 63.23 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 -0.44 1.93 -0.11 7.33 0.08 -1.20 -5.12 117.98 120.46 3hm2 s PHE 158 Ca 0.08 -0.94 -0.02 0.00 0.12 0.00 0.00 56.93 56.17 3hm2 s PHE 158 Cb 0.06 -1.42 -0.03 0.00 -0.57 0.00 0.00 43.02 41.07 3hm2 s PHE 158 CO 0.01 -0.51 -0.03 0.42 -0.10 0.00 0.00 175.22 175.02 3hm2 s ILE 159 N 1.14 4.04 0.00 0.64 -1.09 -1.26 -0.77 121.20 123.90 3hm2 s ILE 159 Ca -0.04 -0.34 0.00 0.00 -2.23 0.00 0.00 60.65 58.05 3hm2 s ILE 159 Cb -0.14 -2.71 0.00 0.00 -1.58 0.00 0.00 42.46 38.03 3hm2 s ILE 159 CO -0.04 0.56 0.00 0.35 -1.23 0.00 0.00 174.94 174.59 3hm2 n THR 160 N 2.63 0.00 -3.58 2.92 -2.24 -1.05 -4.98 114.28 107.99 3hm2 n THR 160 Ca -0.18 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.58 3hm2 n THR 160 Cb 0.53 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.70 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 3.24 0.45 -0.09 -0.78 2.47 -0.34 -1.68 119.74 123.01 3hm2 s LYS 162 Ca 0.00 0.89 -0.12 0.00 -1.56 0.00 0.00 55.97 55.18 3hm2 s LYS 162 Cb 0.00 0.29 -0.05 0.00 -1.46 0.00 0.00 37.83 36.61 3hm2 s LYS 162 CO 0.00 -0.11 0.29 -1.25 0.16 0.00 0.00 175.35 174.43 3hm2 s PRO 163 N 1.90 3.87 0.81 4.03 0.04 -1.26 -1.55 135.00 142.84 3hm2 s PRO 163 Ca -0.07 0.14 -0.08 0.00 0.04 0.00 0.00 61.00 61.03 3hm2 s PRO 163 Cb -0.06 -3.27 0.14 0.00 0.04 0.00 0.00 34.50 31.35 3hm2 s PRO 163 CO -0.17 0.58 1.12 0.00 0.04 0.00 0.00 177.00 178.58 3hm2 s ALA 164 N -0.59 3.05 0.37 8.56 0.00 -0.83 -5.01 121.76 127.30 3hm2 s ALA 164 Ca 0.19 -1.40 -0.28 0.00 0.00 0.00 0.00 51.96 50.46 3hm2 s ALA 164 Cb -0.14 -2.40 -0.11 0.00 0.00 0.00 0.00 23.12 20.47 3hm2 s ALA 164 CO 0.07 -1.81 1.50 1.28 0.00 0.00 0.00 175.76 176.80 3hm2 n LEU 165 N -3.21 4.74 -4.75 0.00 4.77 -1.26 -4.66 117.00 112.63 3hm2 n LEU 165 Ca 0.14 1.22 -0.37 0.00 -0.03 0.00 0.00 56.01 56.97 3hm2 n LEU 165 Cb 0.60 -1.62 0.03 0.00 -2.33 0.00 0.00 43.42 40.10 3hm2 n LEU 165 CO 0.45 0.16 0.91 -2.84 -1.33 0.00 0.00 177.39 174.74 3hm2 s PRO 166 N -1.92 3.19 -0.16 3.23 0.02 -1.26 -4.75 135.00 133.35 3hm2 s PRO 166 Ca 0.54 2.02 -0.01 0.00 0.02 0.00 0.00 61.00 63.58 3hm2 s PRO 166 Cb -0.48 -2.18 -0.01 0.00 0.02 0.00 0.00 34.50 31.86 3hm2 s PRO 166 CO 0.62 -1.08 -0.12 0.08 -0.33 0.00 0.00 177.00 176.17 3hm2 s VAL 167 N -1.43 2.96 -0.17 3.83 1.01 0.18 -4.60 120.40 122.18 3hm2 s VAL 167 Ca 0.72 -0.67 -0.08 0.00 0.00 0.00 0.00 61.98 61.95 3hm2 s VAL 167 Cb -0.35 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 3hm2 s VAL 167 CO 0.41 0.50 0.12 -1.00 0.00 0.00 0.00 175.10 175.13 3hm2 s HIS 168 N 0.74 3.44 -0.04 5.22 3.76 0.37 0.81 115.29 129.59 3hm2 s HIS 168 Ca -0.05 0.36 0.03 0.00 -0.15 0.00 0.00 55.06 55.25 3hm2 s HIS 168 Cb -0.15 -2.06 0.00 0.00 1.11 0.00 0.00 32.58 31.48 3hm2 s HIS 168 CO 0.01 0.43 -0.13 -1.14 -0.85 0.00 0.00 174.74 173.06 3hm2 s GLN 169 N -0.15 1.43 -0.17 1.40 0.74 0.20 -0.63 119.66 122.48 3hm2 s GLN 169 Ca 0.10 -0.45 -0.00 0.00 0.05 0.00 0.00 55.36 55.06 3hm2 s GLN 169 Cb -0.12 -1.26 0.00 0.00 1.10 0.00 0.00 33.01 32.74 3hm2 s GLN 169 CO 0.00 0.15 -0.14 -0.46 -0.55 0.00 0.00 175.29 174.29 3hm2 s TRP 170 N 0.22 2.81 -0.09 1.67 -0.00 0.16 -1.07 118.94 122.64 3hm2 s TRP 170 Ca -0.05 -1.15 0.01 0.00 -0.00 0.00 0.00 56.10 54.91 3hm2 s TRP 170 Cb -0.11 -1.93 -0.02 0.00 -0.00 0.00 0.00 33.47 31.40 3hm2 s TRP 170 CO 0.02 -0.56 -0.10 0.99 -0.00 0.00 0.00 176.95 177.30 3hm2 s THR 171 N 1.03 3.35 0.03 5.86 2.01 -0.43 -1.39 115.64 126.09 3hm2 s THR 171 Ca -0.01 -0.59 -0.12 0.00 0.31 0.00 0.00 61.69 61.28 3hm2 s THR 171 Cb -0.15 -2.37 0.01 0.00 0.01 0.00 0.00 72.50 70.00 3hm2 s THR 171 CO -0.03 0.57 0.25 0.54 -0.69 0.00 0.00 174.62 175.25 3hm2 s VAL 172 N -0.37 0.09 -0.28 3.82 0.11 -0.87 -1.72 120.40 121.17 3hm2 s VAL 172 Ca 0.05 -0.73 0.01 0.00 -2.93 0.00 0.00 61.98 58.38 3hm2 s VAL 172 Cb -0.12 -0.83 0.06 0.00 -1.53 0.00 0.00 36.38 33.95 3hm2 s VAL 172 CO 0.02 -0.40 -0.06 -0.69 -3.33 0.00 0.00 175.10 170.64 3hm2 s VAL 173 N -2.26 2.49 -0.23 2.04 1.01 -1.26 -2.96 120.40 119.23 3hm2 s VAL 173 Ca -0.07 -1.59 -0.30 0.00 0.00 0.00 0.00 61.98 60.02 3hm2 s VAL 173 Cb -0.02 -2.48 -0.06 0.00 0.00 0.00 0.00 36.38 33.82 3hm2 s VAL 173 CO -0.02 -0.10 2.20 1.17 0.00 0.00 0.00 175.10 178.36 3hm2 n LYS 174 N 4.49 1.86 0.00 2.72 4.81 -0.48 -4.72 118.16 126.84 3hm2 n LYS 174 Ca -0.13 0.52 0.03 0.00 -0.87 0.00 0.00 58.31 57.87 3hm2 n LYS 174 Cb 0.42 -3.09 0.03 0.00 0.02 0.00 0.00 35.03 32.42 3hm2 n LYS 174 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57