#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h4c n PHE 2 N 0.00 0.12 -0.02 -2.53 0.99 -1.26 -1.80 117.46 112.95 2h4c n PHE 2 Ca 0.00 0.05 -0.16 0.00 -0.00 0.00 0.00 57.45 57.34 2h4c n PHE 2 Cb 0.00 -0.58 -0.10 0.00 -1.00 0.00 0.00 39.48 37.81 2h4c n PHE 2 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.76 177.50 2h4c h PHE 3 N 0.00 0.56 -0.08 1.38 0.04 -1.98 -3.12 116.94 113.74 2h4c h PHE 3 Ca 0.00 -0.26 -0.11 0.00 2.80 0.00 0.00 57.97 60.40 2h4c h PHE 3 Cb 0.23 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.31 2h4c h PHE 3 CO 0.00 1.04 -0.37 1.96 -0.60 0.00 0.00 178.31 180.33 2h4c h GLN 4 N -0.07 0.40 -0.87 1.51 4.20 -1.81 -3.05 115.11 115.41 2h4c h GLN 4 Ca -0.04 -0.32 0.22 0.00 0.06 0.00 0.00 58.65 58.57 2h4c h GLN 4 Cb 1.11 0.06 -0.13 0.00 0.30 0.00 0.00 27.48 28.83 2h4c h GLN 4 CO 0.09 0.95 0.33 0.35 -0.67 0.00 0.00 178.83 179.88 2h4c h PHE 5 N -0.07 0.53 -0.54 2.96 3.57 -1.47 1.06 116.94 122.99 2h4c h PHE 5 Ca -0.02 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 2h4c h PHE 5 Cb 1.02 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.64 2h4c h PHE 5 CO 0.12 -0.10 0.18 0.00 -2.23 0.00 0.00 178.31 176.29 2h4c h ALA 6 N 1.72 1.31 0.00 2.41 0.00 -1.52 0.79 119.26 123.98 2h4c h ALA 6 Ca 0.54 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.27 2h4c h ALA 6 Cb 1.05 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 2h4c h ALA 6 CO -0.56 0.50 -0.11 0.93 0.00 0.00 0.00 179.25 180.01 2h4c h GLU 7 N 0.78 0.00 0.03 0.00 5.08 0.11 -0.62 114.58 119.95 2h4c h GLU 7 Ca 0.18 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.54 2h4c h GLU 7 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2h4c h GLU 7 CO -0.01 0.11 -0.02 0.52 -1.00 0.00 0.00 179.01 178.61 2h4c h MET 8 N 0.00 -0.04 0.55 2.33 2.86 0.69 -2.67 114.93 118.64 2h4c h MET 8 Ca -0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2h4c h MET 8 Cb 0.74 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.40 2h4c h MET 8 CO 0.01 0.26 -0.49 0.82 1.06 0.00 0.00 176.91 178.57 2h4c h ILE 9 N -1.00 0.00 -1.08 -1.22 2.04 -0.93 -1.89 117.51 113.44 2h4c h ILE 9 Ca -0.00 0.00 0.29 0.00 1.00 0.00 0.00 64.86 66.15 2h4c h ILE 9 Cb 0.32 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.31 2h4c h ILE 9 CO 0.01 0.00 0.70 0.58 0.00 0.00 0.00 178.15 179.44 2h4c h VAL 10 N -1.02 0.47 0.00 1.67 2.07 -1.27 0.82 116.25 118.99 2h4c h VAL 10 Ca -0.07 -0.11 -0.09 0.00 0.82 0.00 0.00 66.70 67.25 2h4c h VAL 10 Cb 0.87 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2h4c h VAL 10 CO -0.03 0.06 -0.44 0.07 0.02 0.00 0.00 177.57 177.25 2h4c h LYS 11 N 0.32 0.00 0.00 1.57 2.10 -1.10 -1.19 116.57 118.27 2h4c h LYS 11 Ca 0.61 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.26 2h4c h LYS 11 Cb 1.69 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.02 2h4c h LYS 11 CO -0.28 0.44 0.00 -1.33 -2.00 0.00 0.00 179.45 176.29 2h4c n MET 12 N -3.40 0.00 -0.23 0.07 2.81 0.28 -3.98 117.12 112.67 2h4c n MET 12 Ca 0.01 0.00 0.32 0.00 -1.81 0.00 0.00 57.70 56.21 2h4c n MET 12 Cb 0.61 -0.08 0.67 0.00 -0.71 0.00 0.00 33.22 33.71 2h4c n MET 12 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 2h4c h THR 13 N 0.00 0.23 0.00 2.03 1.35 -1.63 -3.42 112.91 111.47 2h4c h THR 13 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2h4c h THR 13 Cb 0.00 0.31 0.00 0.00 -1.73 0.00 0.00 68.15 66.73 2h4c h THR 13 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2h4c n GLY 14 N -1.70 2.76 3.84 5.82 0.00 -0.45 -4.97 105.19 110.50 2h4c n GLY 14 Ca 0.22 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 2h4c n GLY 14 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2h4c s LYS 16 N -0.05 4.05 -0.35 1.61 2.20 -1.25 -4.80 119.74 121.15 2h4c s LYS 16 Ca 0.00 0.69 -0.34 0.00 -0.36 0.00 0.00 55.97 55.96 2h4c s LYS 16 Cb 0.00 -2.54 -0.15 0.00 -1.51 0.00 0.00 37.83 33.63 2h4c s LYS 16 CO 0.00 0.22 1.15 0.39 -0.36 0.00 0.00 175.35 176.75 2h4c n GLU 17 N -0.11 0.00 -0.06 4.03 4.71 -1.26 -4.26 120.64 123.69 2h4c n GLU 17 Ca 0.02 0.00 -0.10 0.00 -0.01 0.00 0.00 57.16 57.07 2h4c n GLU 17 Cb 0.53 -1.11 -0.09 0.00 -1.01 0.00 0.00 31.44 29.76 2h4c n GLU 17 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2h4c h ALA 18 N 3.59 0.00 -2.36 0.62 0.00 -1.88 -3.36 119.26 115.88 2h4c h ALA 18 Ca -0.33 -0.37 -0.52 0.00 0.00 0.00 0.00 54.91 53.69 2h4c h ALA 18 Cb 1.01 0.00 0.19 0.00 0.00 0.00 0.00 17.79 19.00 2h4c h ALA 18 CO 0.71 0.00 0.25 0.14 0.00 0.00 0.00 179.25 180.35 2h4c s VAL 19 N -2.04 2.06 0.00 0.00 -7.23 -1.26 -2.51 120.40 109.41 2h4c s VAL 19 Ca -0.14 0.02 0.00 0.00 -1.81 0.00 0.00 61.98 60.05 2h4c s VAL 19 Cb -0.02 -2.14 0.00 0.00 0.56 0.00 0.00 36.38 34.78 2h4c s VAL 19 CO 0.50 -0.02 0.00 1.57 -0.31 0.00 0.00 175.10 176.84 2h4c n HIS 20 N -3.99 0.00 0.29 2.82 -0.00 -1.26 -4.05 115.22 109.02 2h4c n HIS 20 Ca 0.12 0.00 0.09 0.00 -0.00 0.00 0.00 57.72 57.94 2h4c n HIS 20 Cb 0.52 0.00 0.42 0.00 -0.00 0.00 0.00 29.99 30.92 2h4c n HIS 20 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 2h4c h SER 21 N 0.00 0.00 0.00 0.26 0.87 -1.71 0.27 113.55 113.24 2h4c h SER 21 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2h4c h SER 21 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2h4c h SER 21 CO 0.00 0.00 -0.10 -1.22 -0.53 0.00 0.00 176.83 174.98 2h4c n TYR 22 N -2.78 0.00 0.15 2.24 4.01 -1.05 -4.78 117.16 114.95 2h4c n TYR 22 Ca 0.01 -0.17 0.18 0.00 -0.16 0.00 0.00 57.90 57.76 2h4c n TYR 22 Cb 0.75 -0.03 0.79 0.00 -0.31 0.00 0.00 39.34 40.53 2h4c n TYR 22 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2h4c h ALA 23 N 0.00 1.96 -0.25 -0.72 0.00 -0.68 -1.59 119.26 117.98 2h4c h ALA 23 Ca 0.00 -0.01 0.26 0.00 0.00 0.00 0.00 54.91 55.16 2h4c h ALA 23 Cb 0.99 0.02 -0.23 0.00 0.00 0.00 0.00 17.79 18.57 2h4c h ALA 23 CO 0.00 -0.45 0.30 -1.50 0.00 0.00 0.00 179.25 177.60 2h4c s ILE 24 N -4.65 -0.18 -0.17 0.00 2.07 -1.26 -3.05 121.20 113.95 2h4c s ILE 24 Ca -0.05 0.00 -0.24 0.00 -1.41 0.00 0.00 60.65 58.95 2h4c s ILE 24 Cb 0.16 -1.00 0.06 0.00 0.13 0.00 0.00 42.46 41.81 2h4c s ILE 24 CO 0.56 0.00 0.63 -0.47 -1.91 0.00 0.00 174.94 173.74 2h4c s TYR 25 N 2.68 -0.65 0.00 3.50 6.14 -1.26 -2.69 117.35 125.07 2h4c s TYR 25 Ca -0.04 1.46 0.00 0.00 0.64 0.00 0.00 57.07 59.13 2h4c s TYR 25 Cb -0.07 0.27 0.00 0.00 0.42 0.00 0.00 41.96 42.59 2h4c s TYR 25 CO -0.12 -0.41 0.00 0.41 0.64 0.00 0.00 175.55 176.07 2h4c n GLY 26 N 2.15 0.49 0.28 8.97 0.00 -0.81 -2.49 105.19 113.78 2h4c n GLY 26 Ca -0.16 -0.82 0.05 0.00 0.00 0.00 0.00 46.02 45.09 2h4c n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h4c n TYR 28 N 0.01 0.00 0.00 0.00 4.01 -1.25 0.59 117.16 120.52 2h4c n TYR 28 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 2h4c n TYR 28 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.25 2h4c n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2h4c n GLY 30 N 0.00 -0.66 3.30 0.00 0.00 -0.60 -4.32 105.19 102.91 2h4c n GLY 30 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 2h4c n GLY 30 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2h4c s TRP 31 N 0.00 4.16 0.00 1.61 0.52 -1.17 -4.83 118.94 119.23 2h4c s TRP 31 Ca 0.00 -2.70 0.00 0.00 0.02 0.00 0.00 56.10 53.42 2h4c s TRP 31 Cb 0.00 -3.73 0.00 0.00 -1.15 0.00 0.00 33.47 28.59 2h4c s TRP 31 CO 0.00 -0.92 0.00 0.41 0.02 0.00 0.00 176.95 176.46 2h4c n GLY 32 N 2.75 3.78 0.00 0.98 0.00 -1.26 -4.94 105.19 106.50 2h4c n GLY 32 Ca 0.22 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2h4c n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h4c n GLY 33 N 2.65 1.64 0.00 -0.02 0.00 0.20 -4.91 105.19 104.74 2h4c n GLY 33 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2h4c n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h4c n GLN 34 N 0.00 3.89 0.00 1.61 10.64 -1.21 -4.88 117.38 127.43 2h4c n GLN 34 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2h4c n GLN 34 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 2h4c n GLN 34 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2h4c n GLY 35 N 5.00 0.58 3.09 2.61 0.00 -1.18 -4.64 105.19 110.64 2h4c n GLY 35 Ca 0.00 -0.87 -0.31 0.00 0.00 0.00 0.00 46.02 44.85 2h4c n GLY 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h4c s LYS 36 N 0.00 2.55 -0.01 1.61 1.02 -1.23 -2.37 119.74 121.31 2h4c s LYS 36 Ca 0.00 -0.67 -0.38 0.00 0.02 0.00 0.00 55.97 54.93 2h4c s LYS 36 Cb 0.00 -2.17 -0.18 0.00 -0.52 0.00 0.00 37.83 34.96 2h4c s LYS 36 CO 0.00 -0.11 1.34 -0.35 -0.92 0.00 0.00 175.35 175.31 2h4c n PRO 37 N 4.36 0.82 0.00 -1.68 -0.04 -1.26 -4.83 135.00 132.36 2h4c n PRO 37 Ca -0.19 0.30 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2h4c n PRO 37 Cb 0.51 -1.90 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 2h4c n PRO 37 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2h4c n GLN 38 N 2.74 0.00 -1.36 0.54 1.13 -1.26 -4.93 117.38 114.24 2h4c n GLN 38 Ca 0.20 0.29 0.00 0.00 -1.94 0.00 0.00 57.00 55.55 2h4c n GLN 38 Cb 0.14 -1.29 0.00 0.00 0.11 0.00 0.00 30.24 29.21 2h4c n GLN 38 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 2h4c n ASP 39 N -1.36 1.08 0.00 1.08 3.85 -1.26 -5.01 116.55 114.93 2h4c n ASP 39 Ca 0.00 -0.88 0.08 0.00 -0.71 0.00 0.00 54.79 53.27 2h4c n ASP 39 Cb 0.00 0.00 0.45 0.00 -1.35 0.00 0.00 41.12 40.22 2h4c n ASP 39 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2h4c n ALA 40 N -3.00 2.47 -0.09 2.12 0.00 -1.26 -2.72 120.51 118.03 2h4c n ALA 40 Ca 0.00 -0.10 -0.07 0.00 0.00 0.00 0.00 53.44 53.27 2h4c n ALA 40 Cb 0.00 -1.25 -0.16 0.00 0.00 0.00 0.00 19.45 18.04 2h4c n ALA 40 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2h4c n THR 41 N -0.77 1.20 0.82 0.00 -1.04 -1.26 -4.00 114.28 109.23 2h4c n THR 41 Ca 0.11 -0.80 0.13 0.00 -2.04 0.00 0.00 64.05 61.46 2h4c n THR 41 Cb 0.05 -0.41 0.47 0.00 -1.82 0.00 0.00 70.33 68.62 2h4c n THR 41 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2h4c n ASP 42 N -2.68 0.41 0.12 8.00 2.03 -1.10 -3.29 116.55 120.04 2h4c n ASP 42 Ca -0.29 0.43 0.03 0.00 0.52 0.00 0.00 54.79 55.47 2h4c n ASP 42 Cb 1.08 -0.48 0.01 0.00 -0.72 0.00 0.00 41.12 41.00 2h4c n ASP 42 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 2h4c h ARG 43 N 0.00 0.00 0.00 -0.67 3.08 -1.67 -3.01 114.38 112.10 2h4c h ARG 43 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 2h4c h ARG 43 Cb 0.61 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.66 2h4c h ARG 43 CO 0.00 0.43 -0.15 0.00 -1.07 0.00 0.00 179.97 179.18 2h4c h PHE 46 N 0.00 0.86 0.00 0.00 3.57 -1.28 -0.05 116.94 120.04 2h4c h PHE 46 Ca -0.13 -0.63 -0.02 0.00 3.53 0.00 0.00 57.97 60.72 2h4c h PHE 46 Cb 1.82 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 40.52 2h4c h PHE 46 CO 0.00 1.57 -0.11 0.28 -2.23 0.00 0.00 178.31 177.82 2h4c h VAL 47 N 0.07 0.43 0.08 1.41 2.07 -1.24 -2.46 116.25 116.61 2h4c h VAL 47 Ca -0.27 -0.59 -0.31 0.00 0.82 0.00 0.00 66.70 66.35 2h4c h VAL 47 Cb 2.09 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 33.25 2h4c h VAL 47 CO 0.23 0.11 -1.68 -0.74 0.02 0.00 0.00 177.57 175.51 2h4c h HIS 48 N 0.00 0.30 0.15 1.57 -0.00 -1.51 -3.14 115.15 112.51 2h4c h HIS 48 Ca -0.00 -0.22 -0.01 0.00 -0.00 0.00 0.00 60.37 60.15 2h4c h HIS 48 Cb 0.41 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 27.81 2h4c h HIS 48 CO 0.00 1.35 -0.07 -0.44 -0.00 0.00 0.00 177.93 178.77 2h4c h ASP 49 N 0.04 -0.17 -0.40 3.26 3.32 -0.73 -2.22 116.42 119.53 2h4c h ASP 49 Ca -0.29 -0.23 0.09 0.00 0.02 0.00 0.00 57.03 56.63 2h4c h ASP 49 Cb 2.01 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 41.58 2h4c h ASP 49 CO 0.12 0.14 0.28 0.00 -1.72 0.00 0.00 179.24 178.06 2h4c n TYR 52 N -5.09 0.00 -0.02 0.00 4.02 -0.27 -1.05 117.16 114.75 2h4c n TYR 52 Ca -0.08 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.70 2h4c n TYR 52 Cb 0.09 -0.27 -0.14 0.00 -0.02 0.00 0.00 39.34 38.99 2h4c n TYR 52 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2h4c n GLY 53 N -1.09 -0.89 0.73 2.72 0.00 0.15 -4.17 105.19 102.63 2h4c n GLY 53 Ca 0.01 -0.10 0.07 0.00 0.00 0.00 0.00 46.02 46.00 2h4c n GLY 53 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2h4c n THR 54 N -3.15 0.51 -2.93 2.61 -2.24 -0.22 -4.48 114.28 104.38 2h4c n THR 54 Ca -0.20 -0.52 -0.37 0.00 -2.27 0.00 0.00 64.05 60.69 2h4c n THR 54 Cb 1.05 0.28 -0.01 0.00 -2.10 0.00 0.00 70.33 69.55 2h4c n THR 54 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2h4c n VAL 55 N 0.65 4.73 0.50 2.28 0.31 -1.19 -4.82 118.33 120.78 2h4c n VAL 55 Ca 0.14 -5.78 0.12 0.00 -0.01 0.00 0.00 64.34 58.81 2h4c n VAL 55 Cb 0.34 -1.77 0.46 0.00 -0.91 0.00 0.00 33.84 31.96 2h4c n VAL 55 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2h4c n ASN 56 N 0.47 0.65 0.18 4.52 3.02 -1.26 -3.53 115.26 119.31 2h4c n ASN 56 Ca 0.35 0.62 0.11 0.00 -0.03 0.00 0.00 54.58 55.63 2h4c n ASN 56 Cb 0.33 -0.77 0.60 0.00 -0.61 0.00 0.00 39.78 39.32 2h4c n ASN 56 CO 0.00 0.00 0.00 -0.78 -2.62 0.00 0.00 177.26 173.86 2h4c h ASP 58 N 0.00 0.00 0.00 6.41 1.82 -1.96 -3.46 116.42 119.24 2h4c h ASP 58 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2h4c h ASP 58 Cb 0.48 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.49 2h4c h ASP 58 CO 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 179.24 177.63 2h4c s ASN 61 N -2.90 6.26 0.18 0.00 2.47 -1.26 -4.93 114.94 114.76 2h4c s ASN 61 Ca 0.00 -0.16 -0.16 0.00 0.42 0.00 0.00 52.86 52.97 2h4c s ASN 61 Cb 0.00 -2.24 0.15 0.00 -1.45 0.00 0.00 41.25 37.71 2h4c s ASN 61 CO 0.00 -0.45 1.65 -0.65 -3.72 0.00 0.00 177.10 173.93 2h4c h PRO 68 N 8.49 -0.00 -2.96 0.43 0.11 -1.89 -2.25 132.00 133.93 2h4c h PRO 68 Ca -0.28 0.00 -0.77 0.00 0.11 0.00 0.00 66.00 65.06 2h4c h PRO 68 Cb 1.13 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.06 2h4c h PRO 68 CO 0.75 -0.00 1.81 1.17 -0.21 0.00 0.00 178.00 181.51 2h4c n LYS 69 N -5.36 4.32 0.00 1.05 4.81 -1.26 -3.91 118.16 117.81 2h4c n LYS 69 Ca 0.04 -3.83 0.00 0.00 -0.87 0.00 0.00 58.31 53.65 2h4c n LYS 69 Cb 0.27 -2.70 0.00 0.00 0.02 0.00 0.00 35.03 32.62 2h4c n LYS 69 CO 0.00 0.00 0.00 -0.12 1.17 0.00 0.00 177.40 178.45 2h4c n MET 70 N 2.23 0.00 -2.32 1.64 1.56 -1.04 -4.92 117.12 114.28 2h4c n MET 70 Ca 0.45 0.00 -0.41 0.00 -0.27 0.00 0.00 57.70 57.48 2h4c n MET 70 Cb 0.31 0.00 -0.03 0.00 2.15 0.00 0.00 33.22 35.64 2h4c n MET 70 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2h4c s ALA 71 N -1.57 3.45 -0.48 -5.12 0.00 -0.87 -4.83 121.76 112.34 2h4c s ALA 71 Ca 0.00 1.05 -0.13 0.00 0.00 0.00 0.00 51.96 52.87 2h4c s ALA 71 Cb 0.00 -3.40 0.10 0.00 0.00 0.00 0.00 23.12 19.82 2h4c s ALA 71 CO 0.00 -0.37 0.39 0.99 0.00 0.00 0.00 175.76 176.77 2h4c s THR 72 N -1.01 4.86 0.66 0.00 2.01 -1.26 -0.17 115.64 120.72 2h4c s THR 72 Ca 0.47 -1.37 0.02 0.00 0.31 0.00 0.00 61.69 61.12 2h4c s THR 72 Cb -0.35 -4.02 0.10 0.00 0.01 0.00 0.00 72.50 68.24 2h4c s THR 72 CO 0.45 -0.68 0.91 -0.72 -0.69 0.00 0.00 174.62 173.89 2h4c s TYR 73 N 1.54 1.78 0.05 4.92 -0.85 -1.26 -4.98 117.35 118.54 2h4c s TYR 73 Ca 0.04 -0.33 0.09 0.00 -0.52 0.00 0.00 57.07 56.35 2h4c s TYR 73 Cb -0.26 -2.79 -0.03 0.00 0.38 0.00 0.00 41.96 39.26 2h4c s TYR 73 CO 0.03 -1.44 -0.23 0.45 -1.52 0.00 0.00 175.55 172.84 2h4c s SER 74 N -4.67 3.40 0.00 -0.18 0.15 -1.26 -4.98 113.70 106.17 2h4c s SER 74 Ca 0.64 -0.54 0.00 0.00 0.70 0.00 0.00 55.95 56.75 2h4c s SER 74 Cb -0.06 -0.40 0.00 0.00 -1.71 0.00 0.00 66.02 63.85 2h4c s SER 74 CO 0.42 0.25 0.00 0.00 1.20 0.00 0.00 173.24 175.12 2h4c n TYR 75 N 1.66 0.00 0.00 3.44 4.11 -1.26 -2.42 117.16 122.69 2h4c n TYR 75 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.73 2h4c n TYR 75 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.86 2h4c n TYR 75 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.86 175.73 2h4c n SER 76 N 0.00 0.00 -3.25 9.48 3.41 -1.04 -4.37 113.62 117.85 2h4c n SER 76 Ca 0.00 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.35 2h4c n SER 76 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 2h4c n SER 76 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2h4c n PHE 77 N -0.55 2.75 -1.54 7.33 -0.00 -1.20 -0.47 117.46 123.77 2h4c n PHE 77 Ca 0.00 -3.99 -0.35 0.00 -0.00 0.00 0.00 57.45 53.11 2h4c n PHE 77 Cb 0.00 -0.49 -0.05 0.00 -0.00 0.00 0.00 39.48 38.94 2h4c n PHE 77 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 2h4c n GLU 78 N 0.65 0.87 -3.83 -4.13 1.02 0.18 -3.08 120.64 112.32 2h4c n GLU 78 Ca 0.28 -0.06 -0.35 0.00 -0.02 0.00 0.00 57.16 57.00 2h4c n GLU 78 Cb 0.45 -3.20 0.03 0.00 -0.02 0.00 0.00 31.44 28.69 2h4c n GLU 78 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2h4c n ASN 79 N 15.39 -4.92 -1.83 1.62 5.15 -1.26 -2.61 115.26 126.80 2h4c n ASN 79 Ca 0.42 -1.08 -0.08 0.00 -0.60 0.00 0.00 54.58 53.24 2h4c n ASN 79 Cb 0.47 -2.54 0.03 0.00 -0.53 0.00 0.00 39.78 37.21 2h4c n ASN 79 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2h4c n GLY 80 N -1.85 0.24 3.61 8.20 0.00 -1.18 -5.05 105.19 109.17 2h4c n GLY 80 Ca -0.13 -0.28 -0.11 0.00 0.00 0.00 0.00 46.02 45.50 2h4c n GLY 80 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2h4c s ASP 81 N -3.34 -0.81 0.08 1.61 3.68 -1.07 -5.12 116.67 111.70 2h4c s ASP 81 Ca 0.11 1.44 -0.30 0.00 2.13 0.00 0.00 52.55 55.93 2h4c s ASP 81 Cb -0.05 1.40 -0.05 0.00 -1.45 0.00 0.00 42.92 42.77 2h4c s ASP 81 CO 0.28 -0.24 1.01 -0.63 0.13 0.00 0.00 175.17 175.73 2h4c s ILE 82 N 0.88 4.49 -0.42 4.11 1.01 -1.25 0.48 121.20 130.50 2h4c s ILE 82 Ca -0.04 1.94 0.02 0.00 0.00 0.00 0.00 60.65 62.57 2h4c s ILE 82 Cb -0.05 -4.24 0.15 0.00 0.01 0.00 0.00 42.46 38.33 2h4c s ILE 82 CO -0.07 0.24 0.28 -0.69 0.00 0.00 0.00 174.94 174.69 2h4c s VAL 83 N 0.43 0.66 -0.90 2.92 1.01 0.38 -4.90 120.40 120.01 2h4c s VAL 83 Ca 0.50 -2.39 -0.26 0.00 0.00 0.00 0.00 61.98 59.83 2h4c s VAL 83 Cb -0.24 -1.47 -0.17 0.00 0.00 0.00 0.00 36.38 34.50 2h4c s VAL 83 CO 0.30 -1.06 2.31 0.00 0.00 0.00 0.00 175.10 176.65 2h4c n GLY 85 N 6.58 2.68 3.61 0.00 0.00 -1.01 -4.81 105.19 112.24 2h4c n GLY 85 Ca 0.45 -0.93 -0.26 0.00 0.00 0.00 0.00 46.02 45.27 2h4c n GLY 85 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2h4c s ASP 86 N 2.38 4.44 0.00 1.61 1.01 -1.26 -4.75 116.67 120.11 2h4c s ASP 86 Ca 0.50 -0.54 0.00 0.00 0.71 0.00 0.00 52.55 53.22 2h4c s ASP 86 Cb 0.22 -0.82 0.00 0.00 1.01 0.00 0.00 42.92 43.33 2h4c s ASP 86 CO -0.01 0.08 0.00 -3.20 0.21 0.00 0.00 175.17 172.25 2h4c n ASN 88 N -0.16 0.46 -4.77 0.27 2.85 -1.26 -4.86 115.26 107.79 2h4c n ASN 88 Ca -0.10 -0.21 -0.36 0.00 -0.11 0.00 0.00 54.58 53.80 2h4c n ASN 88 Cb 0.56 0.51 0.00 0.00 1.24 0.00 0.00 39.78 42.10 2h4c n ASN 88 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 2h4c s ASN 89 N -0.61 5.80 0.02 1.20 2.47 -1.26 -4.95 114.94 117.62 2h4c s ASN 89 Ca 0.00 2.31 -0.20 0.00 0.42 0.00 0.00 52.86 55.39 2h4c s ASN 89 Cb 0.00 -2.60 -0.18 0.00 -1.45 0.00 0.00 41.25 37.02 2h4c s ASN 89 CO 0.00 -1.17 1.23 0.25 -3.72 0.00 0.00 177.10 173.69 2h4c h LEU 90 N 1.54 0.46 0.06 3.21 6.46 -2.00 -3.00 115.31 122.04 2h4c h LEU 90 Ca -0.50 -0.61 -0.00 0.00 -0.12 0.00 0.00 57.88 56.65 2h4c h LEU 90 Cb 1.26 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 41.06 2h4c h LEU 90 CO 0.58 0.99 -0.03 0.00 -0.62 0.00 0.00 178.44 179.37 2h4c h LEU 92 N -0.73 -0.47 -0.74 0.00 3.38 -1.97 -1.70 115.31 113.09 2h4c h LEU 92 Ca -0.01 0.05 0.09 0.00 0.09 0.00 0.00 57.88 58.10 2h4c h LEU 92 Cb 0.60 0.17 -0.12 0.00 0.09 0.00 0.00 40.66 41.41 2h4c h LEU 92 CO 0.01 -0.19 -0.49 0.50 0.09 0.00 0.00 178.44 178.37 2h4c h LYS 93 N -0.26 -0.15 -0.55 1.13 3.64 -1.70 0.22 116.57 118.90 2h4c h LYS 93 Ca -0.01 0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.50 2h4c h LYS 93 Cb 0.25 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.07 2h4c h LYS 93 CO -0.06 -0.10 0.38 1.15 -2.27 0.00 0.00 179.45 178.55 2h4c h THR 94 N -0.15 0.83 0.00 1.00 2.02 -1.56 1.23 112.91 116.28 2h4c h THR 94 Ca 0.19 -0.08 -0.09 0.00 0.77 0.00 0.00 66.41 67.20 2h4c h THR 94 Cb 0.53 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 2h4c h THR 94 CO -0.79 0.04 -0.43 0.58 0.37 0.00 0.00 175.52 175.29 2h4c h VAL 95 N 0.22 1.05 0.00 3.16 2.07 0.34 -1.25 116.25 121.83 2h4c h VAL 95 Ca 0.26 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 66.14 2h4c h VAL 95 Cb 0.72 1.96 0.00 0.00 -1.52 0.00 0.00 31.29 32.45 2h4c h VAL 95 CO -0.05 0.42 0.00 0.00 0.02 0.00 0.00 177.57 177.96 2h4c n GLU 97 N -1.41 0.72 0.14 0.00 -0.58 -0.37 -2.60 120.64 116.54 2h4c n GLU 97 Ca 0.08 0.22 -0.15 0.00 -0.42 0.00 0.00 57.16 56.90 2h4c n GLU 97 Cb 0.25 -1.64 -0.07 0.00 -0.57 0.00 0.00 31.44 29.40 2h4c n GLU 97 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2h4c h ASP 99 N -0.68 0.34 0.66 0.00 5.19 -1.72 -0.35 116.42 119.86 2h4c h ASP 99 Ca 0.01 0.10 -0.03 0.00 -0.62 0.00 0.00 57.03 56.49 2h4c h ASP 99 Cb 0.68 0.05 0.01 0.00 0.18 0.00 0.00 39.33 40.25 2h4c h ASP 99 CO -0.21 0.15 -0.33 -0.09 -3.12 0.00 0.00 179.24 175.64 2h4c h ARG 100 N 0.49 -0.87 -0.58 3.56 2.43 -1.02 -1.60 114.38 116.79 2h4c h ARG 100 Ca 0.40 0.06 0.09 0.00 -0.81 0.00 0.00 59.98 59.72 2h4c h ARG 100 Cb 0.57 0.20 -0.07 0.00 -0.42 0.00 0.00 29.97 30.24 2h4c h ARG 100 CO -0.37 -0.58 0.21 0.00 -1.51 0.00 0.00 179.97 177.73 2h4c h ALA 101 N -1.55 0.74 -0.88 2.80 0.00 -0.42 -2.62 119.26 117.34 2h4c h ALA 101 Ca -0.09 0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2h4c h ALA 101 Cb 0.70 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.48 2h4c h ALA 101 CO 0.14 -0.20 0.56 0.00 0.00 0.00 0.00 179.25 179.75 2h4c h ALA 102 N 1.40 1.20 -0.32 0.00 0.00 -1.04 -1.50 119.26 119.00 2h4c h ALA 102 Ca 0.29 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2h4c h ALA 102 Cb 0.35 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2h4c h ALA 102 CO -0.29 0.34 0.16 0.00 0.00 0.00 0.00 179.25 179.45 2h4c h ALA 103 N 1.40 0.42 0.52 0.00 0.00 -0.91 -1.33 119.26 119.36 2h4c h ALA 103 Ca 0.38 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 2h4c h ALA 103 Cb 0.13 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.79 2h4c h ALA 103 CO -0.16 -0.03 -0.25 0.82 0.00 0.00 0.00 179.25 179.64 2h4c h ILE 104 N 0.39 0.48 0.03 0.00 2.04 -1.32 -0.03 117.51 119.10 2h4c h ILE 104 Ca 0.11 -0.09 0.01 0.00 1.00 0.00 0.00 64.86 65.89 2h4c h ILE 104 Cb 0.11 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 2h4c h ILE 104 CO -0.01 0.02 -0.32 0.00 0.00 0.00 0.00 178.15 177.83 2h4c h LEU 106 N -0.42 -1.62 -1.96 0.00 3.38 -1.26 0.49 115.31 113.92 2h4c h LEU 106 Ca 0.00 0.25 0.18 0.00 0.09 0.00 0.00 57.88 58.40 2h4c h LEU 106 Cb 0.44 0.71 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 2h4c h LEU 106 CO -0.20 -0.35 0.53 1.23 0.09 0.00 0.00 178.44 179.74 2h4c h GLY 107 N -0.26 0.00 1.44 0.83 0.00 -0.49 -0.04 103.07 104.55 2h4c h GLY 107 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.28 2h4c h GLY 107 CO -0.67 0.00 -1.21 1.46 0.00 0.00 0.00 176.54 176.11 2h4c h GLN 108 N 0.00 0.00 -0.92 4.80 4.20 0.30 -3.37 115.11 120.12 2h4c h GLN 108 Ca 0.30 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.48 2h4c h GLN 108 Cb 1.36 0.00 -0.29 0.00 0.30 0.00 0.00 27.48 28.85 2h4c h GLN 108 CO -0.00 0.56 0.59 0.09 -0.67 0.00 0.00 178.83 179.40 2h4c n ASN 109 N -3.11 4.64 0.02 1.46 3.02 -0.02 -4.39 115.26 116.87 2h4c n ASN 109 Ca -0.07 -3.68 -0.10 0.00 -0.03 0.00 0.00 54.58 50.70 2h4c n ASN 109 Cb 0.90 -0.84 -0.13 0.00 -0.61 0.00 0.00 39.78 39.10 2h4c n ASN 109 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 2h4c h VAL 110 N 1.03 1.18 -0.72 2.41 -1.51 -1.71 -3.07 116.25 113.85 2h4c h VAL 110 Ca 0.58 -2.95 0.21 0.00 -1.23 0.00 0.00 66.70 63.31 2h4c h VAL 110 Cb 2.19 2.62 -0.03 0.00 -2.13 0.00 0.00 31.29 33.94 2h4c h VAL 110 CO 1.14 0.71 0.55 -0.55 -1.23 0.00 0.00 177.57 178.19 2h4c h ASN 111 N 0.01 0.00 -0.34 4.19 -1.07 -1.89 1.78 115.58 118.26 2h4c h ASN 111 Ca -0.19 0.00 -0.07 0.00 0.07 0.00 0.00 56.30 56.11 2h4c h ASN 111 Cb 1.93 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 38.14 2h4c h ASN 111 CO 0.11 0.00 0.02 1.07 0.07 0.00 0.00 177.43 178.70 2h4c n THR 112 N -4.21 2.44 -2.62 6.14 5.66 -1.22 -4.96 114.28 115.50 2h4c n THR 112 Ca 0.14 -2.05 -0.43 0.00 -3.05 0.00 0.00 64.05 58.67 2h4c n THR 112 Cb 0.82 -0.29 -0.03 0.00 -1.55 0.00 0.00 70.33 69.29 2h4c n THR 112 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 2h4c s TYR 113 N -2.95 2.69 -0.28 1.09 6.14 0.61 -4.86 117.35 119.78 2h4c s TYR 113 Ca 0.44 0.44 -0.22 0.00 0.64 0.00 0.00 57.07 58.37 2h4c s TYR 113 Cb 0.37 -4.43 -0.01 0.00 0.42 0.00 0.00 41.96 38.31 2h4c s TYR 113 CO 0.07 -1.47 0.71 0.34 0.64 0.00 0.00 175.55 175.85 2h4c s ASP 114 N 2.80 6.63 0.38 4.32 2.15 -1.26 -4.95 116.67 126.74 2h4c s ASP 114 Ca 0.42 0.69 0.12 0.00 0.43 0.00 0.00 52.55 54.22 2h4c s ASP 114 Cb -0.08 -2.38 0.74 0.00 -0.30 0.00 0.00 42.92 40.91 2h4c s ASP 114 CO 0.26 -0.50 1.85 0.07 -0.17 0.00 0.00 175.17 176.69 2h4c h LYS 115 N 7.99 0.05 -0.91 4.34 2.10 -1.99 -3.17 116.57 124.98 2h4c h LYS 115 Ca -0.25 -0.02 0.17 0.00 -2.00 0.00 0.00 60.65 58.55 2h4c h LYS 115 Cb 1.11 -0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 32.36 2h4c h LYS 115 CO 0.83 0.37 0.59 -2.95 -2.00 0.00 0.00 179.45 176.28 2h4c h ASN 116 N 0.05 0.60 0.00 7.07 7.08 -2.03 -0.14 115.58 128.21 2h4c h ASN 116 Ca 0.00 0.05 0.00 0.00 -3.08 0.00 0.00 56.30 53.27 2h4c h ASN 116 Cb 0.59 -0.07 0.00 0.00 -2.08 0.00 0.00 38.32 36.76 2h4c h ASN 116 CO 0.04 0.28 0.00 -1.22 -2.08 0.00 0.00 177.43 174.45 2h4c n TYR 117 N -4.57 0.00 -2.40 4.14 4.01 -1.20 -4.74 117.16 112.40 2h4c n TYR 117 Ca 0.19 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.50 2h4c n TYR 117 Cb 0.55 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.55 2h4c n TYR 117 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2h4c s GLU 118 N -2.00 4.37 -0.72 -0.72 2.02 -0.07 -1.92 118.70 119.66 2h4c s GLU 118 Ca 0.13 1.77 -0.03 0.00 0.02 0.00 0.00 54.97 56.86 2h4c s GLU 118 Cb 0.06 -3.47 0.00 0.00 0.10 0.00 0.00 34.13 30.82 2h4c s GLU 118 CO 0.10 -0.39 0.67 0.09 0.02 0.00 0.00 175.26 175.74 2h4c n ASN 119 N 4.70 -7.10 -4.17 -0.19 3.02 -1.09 -4.96 115.26 105.47 2h4c n ASN 119 Ca 0.11 -0.20 -0.40 0.00 -0.03 0.00 0.00 54.58 54.06 2h4c n ASN 119 Cb 0.46 -4.41 -0.07 0.00 -0.61 0.00 0.00 39.78 35.15 2h4c n ASN 119 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2h4c s TYR 120 N -2.90 3.57 1.07 3.10 5.04 -1.25 -5.09 117.35 120.88 2h4c s TYR 120 Ca 0.04 -2.55 -0.22 0.00 -2.44 0.00 0.00 57.07 51.91 2h4c s TYR 120 Cb -0.01 -3.40 -0.01 0.00 0.35 0.00 0.00 41.96 38.89 2h4c s TYR 120 CO 0.79 -0.87 -0.55 0.00 -1.34 0.00 0.00 175.55 173.57 2h4c n ALA 121 N 3.47 -4.72 -2.58 3.97 0.00 -1.26 -4.83 120.51 114.55 2h4c n ALA 121 Ca 0.12 -1.27 -0.43 0.00 0.00 0.00 0.00 53.44 51.86 2h4c n ALA 121 Cb 0.40 -1.27 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 2h4c n ALA 121 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2h4c s ILE 122 N -2.15 4.40 0.00 0.00 -4.36 -1.26 -3.29 121.20 114.54 2h4c s ILE 122 Ca 0.48 0.98 0.00 0.00 -0.26 0.00 0.00 60.65 61.86 2h4c s ILE 122 Cb -0.05 -4.48 0.00 0.00 1.25 0.00 0.00 42.46 39.19 2h4c s ILE 122 CO 0.67 -0.84 0.00 -0.24 0.24 0.00 0.00 174.94 174.77 2h4c n SER 124 N 7.32 0.00 -0.12 4.36 2.88 -1.26 -4.87 113.62 121.93 2h4c n SER 124 Ca 0.08 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.66 2h4c n SER 124 Cb 0.49 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 64.11 2h4c n SER 124 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2h4c n HIS 125 N 0.00 0.08 -1.24 0.66 8.25 -1.21 -3.11 115.22 118.65 2h4c n HIS 125 Ca 0.00 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 2h4c n HIS 125 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2h4c n HIS 125 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2h4c h THR 127 N 2.61 0.00 -1.03 0.00 1.35 -1.89 -3.13 112.91 110.82 2h4c h THR 127 Ca 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2h4c h THR 127 Cb 0.90 0.40 0.00 0.00 -1.73 0.00 0.00 68.15 67.73 2h4c h THR 127 CO 0.00 0.00 -0.00 -0.62 -0.25 0.00 0.00 175.52 174.65 2h4c n GLU 128 N -2.62 -1.98 -2.21 4.72 4.71 -1.26 -4.88 120.64 117.12 2h4c n GLU 128 Ca -0.01 -0.01 -0.41 0.00 -0.01 0.00 0.00 57.16 56.71 2h4c n GLU 128 Cb 0.56 -0.01 -0.03 0.00 -1.01 0.00 0.00 31.44 30.95 2h4c n GLU 128 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 2h4c s GLU 129 N -3.01 4.39 0.18 3.49 2.12 -1.26 -4.31 118.70 120.29 2h4c s GLU 129 Ca 0.00 2.06 -0.30 0.00 0.36 0.00 0.00 54.97 57.09 2h4c s GLU 129 Cb -0.00 -3.19 -0.08 0.00 0.26 0.00 0.00 34.13 31.12 2h4c s GLU 129 CO 0.00 -0.26 1.10 -1.12 -0.54 0.00 0.00 175.26 174.45 2h4c s SER 130 N 0.34 7.27 1.01 -1.70 0.01 -1.25 -3.53 113.70 115.86 2h4c s SER 130 Ca 0.57 2.10 -0.15 0.00 1.31 0.00 0.00 55.95 59.77 2h4c s SER 130 Cb -0.37 -2.60 0.20 0.00 0.21 0.00 0.00 66.02 63.46 2h4c s SER 130 CO 0.38 -0.22 1.16 -1.61 0.41 0.00 0.00 173.24 173.37 2h4c s GLU 131 N -0.41 0.28 -0.05 12.44 0.41 -1.00 -4.91 118.70 125.47 2h4c s GLU 131 Ca 0.49 0.07 0.01 0.00 -0.41 0.00 0.00 54.97 55.14 2h4c s GLU 131 Cb -0.29 -1.76 0.02 0.00 -1.78 0.00 0.00 34.13 30.32 2h4c s GLU 131 CO 0.35 -2.74 -0.06 1.14 -0.49 0.00 0.00 175.26 173.47 2h4c s GLN 132 N -5.40 0.95 0.00 1.61 0.00 -1.26 -5.05 119.66 110.51 2h4c s GLN 132 Ca 0.68 -0.15 0.00 0.00 -0.00 0.00 0.00 55.36 55.89 2h4c s GLN 132 Cb -0.12 -0.91 0.00 0.00 0.00 0.00 0.00 33.01 31.99 2h4c s GLN 132 CO 0.54 -0.06 0.25 0.00 0.00 0.00 0.00 175.29 176.03