#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h4c h PHE 2 N 0.00 0.25 -0.26 -2.53 0.05 -1.86 1.25 116.94 113.84 2h4c h PHE 2 Ca 0.00 0.01 0.02 0.00 3.82 0.00 0.00 57.97 61.81 2h4c h PHE 2 Cb 0.00 -0.08 -0.02 0.00 2.00 0.00 0.00 35.95 37.85 2h4c h PHE 2 CO 0.00 0.13 0.13 0.74 -0.18 0.00 0.00 178.31 179.13 2h4c h PHE 3 N 0.24 0.24 -0.03 -0.55 0.04 -1.98 0.67 116.94 115.58 2h4c h PHE 3 Ca 0.17 0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.89 2h4c h PHE 3 Cb 0.36 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.45 2h4c h PHE 3 CO -0.00 0.13 -0.21 1.96 -0.60 0.00 0.00 178.31 179.59 2h4c h GLN 4 N 0.27 0.19 -0.31 1.51 4.20 -1.41 -0.67 115.11 118.89 2h4c h GLN 4 Ca 0.11 -0.17 0.07 0.00 0.06 0.00 0.00 58.65 58.72 2h4c h GLN 4 Cb 0.03 0.04 -0.07 0.00 0.30 0.00 0.00 27.48 27.78 2h4c h GLN 4 CO -0.07 0.85 -0.16 0.35 -0.67 0.00 0.00 178.83 179.13 2h4c h PHE 5 N -0.41 -0.38 -0.51 2.96 3.57 0.16 0.32 116.94 122.65 2h4c h PHE 5 Ca -0.02 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.53 2h4c h PHE 5 Cb 0.90 0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.83 2h4c h PHE 5 CO 0.15 -0.23 0.33 0.00 -2.23 0.00 0.00 178.31 176.33 2h4c h ALA 6 N 1.13 0.65 -0.81 2.41 0.00 0.32 0.36 119.26 123.31 2h4c h ALA 6 Ca 0.16 -0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.19 2h4c h ALA 6 Cb 0.36 -0.19 -0.10 0.00 0.00 0.00 0.00 17.79 17.86 2h4c h ALA 6 CO -0.38 0.06 0.38 0.93 0.00 0.00 0.00 179.25 180.24 2h4c h GLU 7 N 0.66 0.52 0.83 0.00 5.08 0.65 -0.07 114.58 122.25 2h4c h GLU 7 Ca 0.19 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 2h4c h GLU 7 Cb -0.05 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.09 2h4c h GLU 7 CO -0.06 0.34 -0.40 0.52 -1.00 0.00 0.00 179.01 178.42 2h4c h MET 8 N 0.54 -1.07 -0.45 2.33 2.86 0.94 -2.70 114.93 117.36 2h4c h MET 8 Ca 0.45 0.07 0.06 0.00 -2.06 0.00 0.00 59.70 58.22 2h4c h MET 8 Cb 0.67 0.24 -0.09 0.00 0.06 0.00 0.00 31.60 32.49 2h4c h MET 8 CO -0.39 -0.71 -0.53 0.82 1.06 0.00 0.00 176.91 177.16 2h4c h ILE 9 N -1.28 0.02 0.00 -1.22 2.04 -0.44 0.12 117.51 116.76 2h4c h ILE 9 Ca -0.11 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.75 2h4c h ILE 9 Cb 0.86 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 2h4c h ILE 9 CO 0.19 0.00 0.00 0.52 0.00 0.00 0.00 178.15 178.86 2h4c n VAL 10 N -5.38 0.00 0.07 1.67 0.31 -0.09 -1.44 118.33 113.47 2h4c n VAL 10 Ca -0.02 1.13 0.03 0.00 -0.01 0.00 0.00 64.34 65.46 2h4c n VAL 10 Cb 0.34 -1.81 0.14 0.00 -0.91 0.00 0.00 33.84 31.60 2h4c n VAL 10 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2h4c n LYS 11 N -1.27 0.04 0.00 5.55 5.02 -1.02 -2.40 118.16 124.07 2h4c n LYS 11 Ca 0.00 0.40 0.00 0.00 -2.02 0.00 0.00 58.31 56.69 2h4c n LYS 11 Cb 0.00 -1.86 0.00 0.00 -0.02 0.00 0.00 35.03 33.15 2h4c n LYS 11 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 2h4c n MET 12 N -1.59 1.00 0.00 1.97 1.56 0.42 -4.78 117.12 115.69 2h4c n MET 12 Ca -0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 2h4c n MET 12 Cb 0.25 -1.44 0.00 0.00 2.15 0.00 0.00 33.22 34.18 2h4c n MET 12 CO 0.00 0.00 0.00 -2.37 -0.73 0.00 0.00 175.97 172.87 2h4c n THR 13 N -0.05 0.00 -1.51 1.12 5.66 -1.01 -4.78 114.28 113.71 2h4c n THR 13 Ca 0.00 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.58 2h4c n THR 13 Cb 0.22 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.93 2h4c n THR 13 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2h4c n GLY 14 N 0.00 0.19 3.60 1.09 0.00 -1.10 -4.79 105.19 104.17 2h4c n GLY 14 Ca 0.00 0.86 -0.47 0.00 0.00 0.00 0.00 46.02 46.41 2h4c n GLY 14 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h4c n LYS 16 N 8.63 1.88 -3.47 1.61 5.02 -1.26 -2.32 118.16 128.24 2h4c n LYS 16 Ca 0.44 0.61 -0.25 0.00 -2.02 0.00 0.00 58.31 57.09 2h4c n LYS 16 Cb 0.33 -2.80 0.01 0.00 -0.02 0.00 0.00 35.03 32.54 2h4c n LYS 16 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2h4c n GLU 17 N 7.75 -4.31 -0.91 1.97 4.71 -1.26 -4.92 120.64 123.67 2h4c n GLU 17 Ca 0.29 0.60 -0.31 0.00 -0.01 0.00 0.00 57.16 57.73 2h4c n GLU 17 Cb 0.33 -5.39 0.04 0.00 -1.01 0.00 0.00 31.44 25.41 2h4c n GLU 17 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2h4c n ALA 18 N -3.88 -3.71 0.00 0.62 0.00 -0.98 -5.00 120.51 107.56 2h4c n ALA 18 Ca -0.02 -1.15 0.00 0.00 0.00 0.00 0.00 53.44 52.28 2h4c n ALA 18 Cb 0.55 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 19.27 2h4c n ALA 18 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2h4c n VAL 19 N -3.54 0.00 0.00 0.00 3.14 -1.26 -4.99 118.33 111.68 2h4c n VAL 19 Ca -0.01 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.37 2h4c n VAL 19 Cb 0.61 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.39 2h4c n VAL 19 CO 0.00 0.00 0.00 1.57 -6.46 0.00 0.00 176.83 171.94 2h4c n HIS 20 N 0.00 0.00 0.00 1.45 -0.00 -1.26 -5.10 115.22 110.31 2h4c n HIS 20 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2h4c n HIS 20 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2h4c n HIS 20 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2h4c n SER 21 N 0.00 0.00 -0.65 0.26 2.88 -1.26 -4.36 113.62 110.49 2h4c n SER 21 Ca 0.00 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.60 2h4c n SER 21 Cb 0.00 0.00 0.14 0.00 -0.75 0.00 0.00 64.21 63.60 2h4c n SER 21 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2h4c n TYR 22 N 0.00 0.37 0.17 0.66 4.01 -1.26 -4.46 117.16 116.65 2h4c n TYR 22 Ca 0.00 -0.36 0.16 0.00 -0.16 0.00 0.00 57.90 57.54 2h4c n TYR 22 Cb 0.00 -0.02 0.77 0.00 -0.31 0.00 0.00 39.34 39.78 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 2.30 1.99 -0.99 -0.72 0.00 -1.77 -3.33 119.26 116.74 2h4c h ALA 23 Ca 0.00 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.02 2h4c h ALA 23 Cb 0.69 0.02 -0.21 0.00 0.00 0.00 0.00 17.79 18.29 2h4c h ALA 23 CO 0.00 -0.32 -0.17 0.42 0.00 0.00 0.00 179.25 179.18 2h4c s ILE 24 N -4.80 -0.87 -0.21 0.00 1.01 -1.22 -3.88 121.20 111.25 2h4c s ILE 24 Ca -0.05 0.00 -0.28 0.00 0.00 0.00 0.00 60.65 60.32 2h4c s ILE 24 Cb 0.17 -1.00 0.13 0.00 0.01 0.00 0.00 42.46 41.76 2h4c s ILE 24 CO 0.61 0.00 1.01 -0.47 0.00 0.00 0.00 174.94 176.09 2h4c s TYR 25 N 2.86 -0.41 0.00 3.97 5.04 0.08 -2.71 117.35 126.20 2h4c s TYR 25 Ca 0.13 0.83 0.00 0.00 -2.44 0.00 0.00 57.07 55.59 2h4c s TYR 25 Cb -0.14 0.42 0.00 0.00 0.35 0.00 0.00 41.96 42.59 2h4c s TYR 25 CO -0.19 -0.30 0.00 0.41 -1.34 0.00 0.00 175.55 174.13 2h4c n GLY 26 N 1.31 0.90 0.03 8.97 0.00 0.05 -1.34 105.19 115.11 2h4c n GLY 26 Ca -0.11 -0.76 0.11 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.07 0.00 -2.48 0.00 4.01 -1.26 -1.98 117.16 113.37 2h4c n TYR 28 Ca -0.00 -0.09 -0.41 0.00 -0.16 0.00 0.00 57.90 57.25 2h4c n TYR 28 Cb 0.48 -0.01 0.02 0.00 -0.31 0.00 0.00 39.34 39.52 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 0.17 0.12 2.18 0.00 0.00 -1.25 -0.74 105.19 105.67 2h4c n GLY 30 Ca 0.50 -1.08 -0.16 0.00 0.00 0.00 0.00 46.02 45.28 2h4c n GLY 30 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2h4c n TRP 31 N 4.53 0.52 0.00 1.61 7.02 -1.25 -4.61 117.44 125.26 2h4c n TRP 31 Ca 0.00 -1.60 0.00 0.00 -1.02 0.00 0.00 57.50 54.88 2h4c n TRP 31 Cb 0.00 -1.59 0.00 0.00 -2.42 0.00 0.00 31.31 27.30 2h4c n TRP 31 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2h4c n GLY 32 N 2.87 1.42 0.00 6.99 0.00 -1.26 -5.07 105.19 110.14 2h4c n GLY 32 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 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 5.00 0.75 3.08 -0.02 0.00 -0.84 -5.03 105.19 108.13 2h4c n GLY 33 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 2h4c n GLY 33 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2h4c s GLN 34 N 0.00 0.54 0.00 1.61 -2.07 -1.23 -5.01 119.66 113.51 2h4c s GLN 34 Ca 0.00 -0.90 0.00 0.00 -1.82 0.00 0.00 55.36 52.64 2h4c s GLN 34 Cb 0.00 0.20 0.00 0.00 -1.09 0.00 0.00 33.01 32.12 2h4c s GLN 34 CO 0.00 -0.12 0.00 0.41 -1.32 0.00 0.00 175.29 174.26 2h4c n GLY 35 N 0.68 -1.72 3.51 2.60 0.00 0.04 -4.61 105.19 105.69 2h4c n GLY 35 Ca -0.18 -2.05 -0.31 0.00 0.00 0.00 0.00 46.02 43.48 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 2.20 -0.78 1.61 3.01 -1.26 -1.17 119.74 123.34 2h4c s LYS 36 Ca 0.00 -0.92 -0.29 0.00 -1.01 0.00 0.00 55.97 53.75 2h4c s LYS 36 Cb 0.00 -2.28 -0.16 0.00 -1.01 0.00 0.00 37.83 34.38 2h4c s LYS 36 CO 0.00 0.55 2.58 -2.30 0.51 0.00 0.00 175.35 176.69 2h4c n PRO 37 N 1.45 0.43 -0.45 -1.68 -0.02 -1.26 -4.69 135.00 128.77 2h4c n PRO 37 Ca -0.16 0.00 0.40 0.00 -2.02 0.00 0.00 63.50 61.73 2h4c n PRO 37 Cb 0.52 -2.30 0.75 0.00 -0.02 0.00 0.00 33.50 32.45 2h4c n PRO 37 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2h4c h GLN 38 N 15.06 0.04 -3.36 -0.52 1.08 -1.95 -3.42 115.11 122.04 2h4c h GLN 38 Ca -0.13 -0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.03 2h4c h GLN 38 Cb 1.29 -0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 28.66 2h4c h GLN 38 CO 1.29 0.02 0.08 0.16 -0.95 0.00 0.00 178.83 179.43 2h4c s ASP 39 N -4.72 0.03 0.26 1.46 -4.77 -1.26 -4.99 116.67 102.69 2h4c s ASP 39 Ca -0.06 -0.98 -0.04 0.00 -3.30 0.00 0.00 52.55 48.18 2h4c s ASP 39 Cb 0.25 0.71 0.51 0.00 -1.09 0.00 0.00 42.92 43.30 2h4c s ASP 39 CO 0.84 -1.37 1.64 0.00 0.70 0.00 0.00 175.17 176.97 2h4c h ALA 40 N 2.09 0.92 0.06 2.11 0.00 -1.94 0.83 119.26 123.33 2h4c h ALA 40 Ca -0.26 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2h4c h ALA 40 Cb 1.25 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 2h4c h ALA 40 CO 0.34 -0.43 -0.05 1.15 0.00 0.00 0.00 179.25 180.25 2h4c h THR 41 N 0.13 0.88 0.00 0.00 2.02 -1.93 0.46 112.91 114.46 2h4c h THR 41 Ca 0.45 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.63 2h4c h THR 41 Cb 0.83 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.12 2h4c h THR 41 CO -0.67 0.00 0.00 -0.67 0.37 0.00 0.00 175.52 174.55 2h4c n ASP 42 N -5.16 0.00 -0.35 4.18 2.03 0.80 -0.99 116.55 117.05 2h4c n ASP 42 Ca -0.07 0.27 0.11 0.00 0.52 0.00 0.00 54.79 55.62 2h4c n ASP 42 Cb 0.09 -0.39 0.01 0.00 -0.72 0.00 0.00 41.12 40.10 2h4c n ASP 42 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2h4c n ARG 43 N -1.39 0.87 -0.03 -0.67 0.63 0.25 -3.28 116.66 113.04 2h4c n ARG 43 Ca 0.06 -0.71 -0.15 0.00 -0.92 0.00 0.00 57.85 56.13 2h4c n ARG 43 Cb 0.17 -1.49 -0.12 0.00 0.45 0.00 0.00 32.46 31.47 2h4c n ARG 43 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2h4c h PHE 46 N 0.41 0.59 0.25 0.00 3.57 -1.67 0.20 116.94 120.29 2h4c h PHE 46 Ca 0.02 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.54 2h4c h PHE 46 Cb 1.01 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.54 2h4c h PHE 46 CO 0.04 0.35 -0.29 0.28 -2.23 0.00 0.00 178.31 176.46 2h4c h VAL 47 N 0.63 0.39 -0.89 1.41 2.07 -1.57 -0.43 116.25 117.86 2h4c h VAL 47 Ca 0.20 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.96 2h4c h VAL 47 Cb -0.00 0.39 -0.05 0.00 -1.52 0.00 0.00 31.29 30.11 2h4c h VAL 47 CO -0.08 0.00 0.62 -0.74 0.02 0.00 0.00 177.57 177.39 2h4c h HIS 48 N -0.58 0.26 0.00 1.57 -0.00 -1.35 1.78 115.15 116.83 2h4c h HIS 48 Ca -0.00 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 2h4c h HIS 48 Cb 0.55 -0.08 0.00 0.00 -0.00 0.00 0.00 27.41 27.88 2h4c h HIS 48 CO -0.20 0.06 0.00 -0.25 -0.00 0.00 0.00 177.93 177.54 2h4c n ASP 49 N -4.39 0.00 -0.84 3.26 9.92 0.65 -2.56 116.55 122.58 2h4c n ASP 49 Ca 0.19 -0.92 0.01 0.00 -0.53 0.00 0.00 54.79 53.53 2h4c n ASP 49 Cb 0.84 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.32 2h4c n ASP 49 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2h4c h TYR 52 N 0.00 -0.08 0.00 0.00 0.99 -1.72 -3.30 116.97 112.86 2h4c h TYR 52 Ca -0.10 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.63 2h4c h TYR 52 Cb 1.19 0.03 0.00 0.00 1.00 0.00 0.00 36.73 38.95 2h4c h TYR 52 CO 0.00 0.46 0.23 0.41 -0.00 0.00 0.00 178.16 179.25 2h4c n GLY 53 N 1.17 -0.49 0.02 3.88 0.00 -1.26 -0.59 105.19 107.91 2h4c n GLY 53 Ca -0.07 0.07 0.11 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.72 0.07 -1.57 2.61 -2.24 -1.24 -4.97 114.28 105.21 2h4c n THR 54 Ca -0.00 -0.45 -0.38 0.00 -2.27 0.00 0.00 64.05 60.95 2h4c n THR 54 Cb 0.24 0.06 0.05 0.00 -2.10 0.00 0.00 70.33 68.58 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 -2.22 3.33 -4.34 2.28 0.31 0.24 -5.00 118.33 112.93 2h4c n VAL 55 Ca -0.03 -0.50 -0.20 0.00 -0.01 0.00 0.00 64.34 63.61 2h4c n VAL 55 Cb 0.54 -1.01 -0.13 0.00 -0.91 0.00 0.00 33.84 32.33 2h4c n VAL 55 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2h4c s ASN 56 N -1.24 1.61 0.00 4.52 0.01 -1.26 -4.84 114.94 113.74 2h4c s ASN 56 Ca 0.74 -0.45 0.00 0.00 -0.71 0.00 0.00 52.86 52.44 2h4c s ASN 56 Cb -0.42 -0.10 0.00 0.00 0.41 0.00 0.00 41.25 41.14 2h4c s ASN 56 CO 0.49 0.03 0.00 -0.67 -1.51 0.00 0.00 177.10 175.43 2h4c n ASP 58 N 1.92 0.00 -2.47 -1.22 -0.08 -1.26 -4.26 116.55 109.17 2h4c n ASP 58 Ca -0.18 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.00 2h4c n ASP 58 Cb 0.55 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.98 2h4c n ASP 58 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2h4c s ASN 61 N -2.01 2.86 0.53 0.00 3.84 -1.26 -4.94 114.94 113.96 2h4c s ASN 61 Ca 0.08 -0.53 0.38 0.00 0.21 0.00 0.00 52.86 53.00 2h4c s ASN 61 Cb 0.00 -1.31 1.56 0.00 -0.55 0.00 0.00 41.25 40.95 2h4c s ASN 61 CO 0.05 0.09 1.74 -0.65 -2.79 0.00 0.00 177.10 175.54 2h4c h PRO 68 N 7.14 0.03 -0.07 0.43 0.11 -1.93 -2.46 132.00 135.25 2h4c h PRO 68 Ca -0.28 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 2h4c h PRO 68 Cb 1.20 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2h4c h PRO 68 CO 0.51 0.02 -0.01 0.87 -0.21 0.00 0.00 178.00 179.19 2h4c h LYS 69 N 0.04 0.13 0.15 1.05 1.57 -1.99 -3.34 116.57 114.17 2h4c h LYS 69 Ca 0.67 -0.04 -0.23 0.00 -1.87 0.00 0.00 60.65 59.18 2h4c h LYS 69 Cb 2.60 -0.01 0.02 0.00 0.08 0.00 0.00 32.23 34.91 2h4c h LYS 69 CO -0.06 0.42 -1.05 0.52 -0.57 0.00 0.00 179.45 178.72 2h4c h MET 70 N -0.18 0.32 -3.24 3.15 2.86 -1.95 -3.42 114.93 112.47 2h4c h MET 70 Ca 0.02 -0.54 -0.41 0.00 -2.06 0.00 0.00 59.70 56.71 2h4c h MET 70 Cb 0.37 0.20 0.04 0.00 0.06 0.00 0.00 31.60 32.27 2h4c h MET 70 CO 0.00 1.26 -0.05 0.00 1.06 0.00 0.00 176.91 179.18 2h4c n ALA 71 N -2.75 -2.15 -3.47 6.32 0.00 -0.95 -4.72 120.51 112.78 2h4c n ALA 71 Ca -0.17 0.30 -0.27 0.00 0.00 0.00 0.00 53.44 53.31 2h4c n ALA 71 Cb 0.88 -0.93 -0.09 0.00 0.00 0.00 0.00 19.45 19.31 2h4c n ALA 71 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2h4c n THR 72 N 0.60 0.98 -0.34 0.00 -1.04 -1.26 -2.07 114.28 111.16 2h4c n THR 72 Ca 0.11 -4.61 -0.05 0.00 -2.04 0.00 0.00 64.05 57.46 2h4c n THR 72 Cb 0.07 -2.03 0.04 0.00 -1.82 0.00 0.00 70.33 66.60 2h4c n THR 72 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2h4c n TYR 73 N 1.50 -2.75 -3.85 -1.42 0.18 -1.26 -4.99 117.16 104.57 2h4c n TYR 73 Ca 0.26 -0.15 -0.12 0.00 1.88 0.00 0.00 57.90 59.77 2h4c n TYR 73 Cb 0.43 -0.19 -0.13 0.00 -0.38 0.00 0.00 39.34 39.07 2h4c n TYR 73 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 2h4c s SER 74 N -2.07 -0.08 0.15 9.48 1.04 -1.26 -4.97 113.70 115.99 2h4c s SER 74 Ca 0.11 0.14 0.02 0.00 0.48 0.00 0.00 55.95 56.69 2h4c s SER 74 Cb -0.01 0.19 -0.01 0.00 0.10 0.00 0.00 66.02 66.29 2h4c s SER 74 CO 0.09 -0.07 0.16 0.00 0.98 0.00 0.00 173.24 174.40 2h4c n TYR 75 N 2.87 -0.57 -3.44 5.02 4.11 -1.26 -3.33 117.16 120.55 2h4c n TYR 75 Ca -0.13 -1.13 0.01 0.00 -0.00 0.00 0.00 57.90 56.64 2h4c n TYR 75 Cb 0.59 0.17 -0.03 0.00 -0.00 0.00 0.00 39.34 40.07 2h4c n TYR 75 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.86 175.74 2h4c s SER 76 N -1.98 -1.00 -0.98 9.48 0.01 -0.91 -4.88 113.70 113.43 2h4c s SER 76 Ca 0.15 1.14 -0.24 0.00 1.31 0.00 0.00 55.95 58.31 2h4c s SER 76 Cb 0.00 2.05 -0.03 0.00 0.21 0.00 0.00 66.02 68.25 2h4c s SER 76 CO 0.11 -0.19 1.84 0.12 0.41 0.00 0.00 173.24 175.53 2h4c s PHE 77 N 2.78 2.01 0.00 2.43 5.36 -1.26 -1.55 117.98 127.75 2h4c s PHE 77 Ca 0.01 0.23 0.00 0.00 -0.96 0.00 0.00 56.93 56.21 2h4c s PHE 77 Cb -0.11 -4.20 0.00 0.00 -0.34 0.00 0.00 43.02 38.37 2h4c s PHE 77 CO -0.18 -1.71 0.00 -1.91 -1.46 0.00 0.00 175.22 169.96 2h4c n GLU 78 N 8.76 0.00 0.00 10.12 4.07 0.21 -4.89 120.64 138.91 2h4c n GLU 78 Ca 0.40 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.50 2h4c n GLU 78 Cb 0.48 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.86 2h4c n GLU 78 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2h4c n ASN 79 N 0.00 0.00 -1.65 4.31 5.03 -1.26 -4.71 115.26 116.98 2h4c n ASN 79 Ca 0.00 0.00 -0.00 0.00 0.87 0.00 0.00 54.58 55.45 2h4c n ASN 79 Cb 0.00 0.00 -0.00 0.00 -1.02 0.00 0.00 39.78 38.76 2h4c n ASN 79 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2h4c n GLY 80 N 5.00 1.95 3.05 7.41 0.00 -1.26 -4.42 105.19 116.92 2h4c n GLY 80 Ca 0.00 -0.02 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 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 2.01 -0.15 0.56 1.61 3.68 -1.26 -5.14 116.67 117.97 2h4c s ASP 81 Ca 0.01 0.28 0.09 0.00 2.13 0.00 0.00 52.55 55.06 2h4c s ASP 81 Cb 0.01 0.33 0.07 0.00 -1.45 0.00 0.00 42.92 41.88 2h4c s ASP 81 CO 0.00 -0.09 0.68 -0.63 0.13 0.00 0.00 175.17 175.27 2h4c s ILE 82 N -0.05 2.02 0.05 4.11 1.01 -1.26 0.64 121.20 127.71 2h4c s ILE 82 Ca -0.01 -1.13 -0.23 0.00 0.00 0.00 0.00 60.65 59.27 2h4c s ILE 82 Cb -0.02 -2.15 0.06 0.00 0.01 0.00 0.00 42.46 40.36 2h4c s ILE 82 CO 0.00 0.00 0.54 -0.69 0.00 0.00 0.00 174.94 174.79 2h4c s VAL 83 N -2.69 0.02 -0.39 2.92 1.01 -0.59 -4.57 120.40 116.10 2h4c s VAL 83 Ca 0.54 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.34 2h4c s VAL 83 Cb -0.05 -0.98 0.11 0.00 0.00 0.00 0.00 36.38 35.46 2h4c s VAL 83 CO 0.34 -0.11 0.13 0.00 0.00 0.00 0.00 175.10 175.46 2h4c n GLY 85 N 4.11 -1.07 3.53 0.00 0.00 -1.22 -4.82 105.19 105.71 2h4c n GLY 85 Ca 0.03 -0.19 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 2h4c n GLY 85 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2h4c n ASP 86 N -1.07 0.38 -4.18 1.61 -0.08 -1.21 -4.86 116.55 107.15 2h4c n ASP 86 Ca 0.19 -0.84 -0.43 0.00 -1.51 0.00 0.00 54.79 52.20 2h4c n ASP 86 Cb 0.18 -1.12 0.00 0.00 2.34 0.00 0.00 41.12 42.52 2h4c n ASP 86 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2h4c n ASN 88 N 12.30 4.82 -3.64 1.67 3.02 -1.26 -4.38 115.26 127.79 2h4c n ASN 88 Ca 0.56 -2.97 -0.06 0.00 -0.03 0.00 0.00 54.58 52.09 2h4c n ASN 88 Cb 0.28 -1.61 -0.07 0.00 -0.61 0.00 0.00 39.78 37.77 2h4c n ASN 88 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2h4c s ASN 89 N 2.77 -0.69 0.07 6.41 3.84 -1.26 -5.06 114.94 121.02 2h4c s ASN 89 Ca 0.46 1.14 -0.32 0.00 0.21 0.00 0.00 52.86 54.34 2h4c s ASN 89 Cb 0.06 1.26 -0.16 0.00 -0.55 0.00 0.00 41.25 41.86 2h4c s ASN 89 CO 0.00 -0.18 1.50 0.25 -2.79 0.00 0.00 177.10 175.88 2h4c h LEU 90 N 6.13 -1.22 -1.06 3.21 6.46 -1.97 -1.75 115.31 125.11 2h4c h LEU 90 Ca -0.29 0.09 -0.05 0.00 -0.12 0.00 0.00 57.88 57.51 2h4c h LEU 90 Cb 1.20 0.39 -0.01 0.00 -0.73 0.00 0.00 40.66 41.52 2h4c h LEU 90 CO 0.16 -0.61 -0.25 0.00 -0.62 0.00 0.00 178.44 177.12 2h4c h LEU 92 N 0.00 -0.37 -0.80 0.00 3.38 -1.89 -3.35 115.31 112.28 2h4c h LEU 92 Ca -0.00 0.01 0.19 0.00 0.09 0.00 0.00 57.88 58.17 2h4c h LEU 92 Cb 0.78 0.10 -0.13 0.00 0.09 0.00 0.00 40.66 41.49 2h4c h LEU 92 CO 0.03 0.08 0.12 0.07 0.09 0.00 0.00 178.44 178.82 2h4c h LYS 93 N -1.12 0.16 -0.51 1.13 2.10 -1.41 0.20 116.57 117.14 2h4c h LYS 93 Ca -0.04 -0.01 0.15 0.00 -2.00 0.00 0.00 60.65 58.74 2h4c h LYS 93 Cb 0.34 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 31.61 2h4c h LYS 93 CO 0.07 0.11 0.41 1.79 -2.00 0.00 0.00 179.45 179.83 2h4c h THR 94 N 0.17 0.60 0.15 0.07 1.35 -1.69 0.63 112.91 114.19 2h4c h THR 94 Ca 0.47 0.00 -0.23 0.00 -0.55 0.00 0.00 66.41 66.10 2h4c h THR 94 Cb 0.87 0.70 0.02 0.00 -1.73 0.00 0.00 68.15 68.01 2h4c h THR 94 CO -0.64 0.00 -1.07 0.58 -0.25 0.00 0.00 175.52 174.14 2h4c h VAL 95 N 0.00 1.36 0.00 6.82 2.07 -0.75 -1.19 116.25 124.55 2h4c h VAL 95 Ca 0.24 -2.53 0.00 0.00 0.82 0.00 0.00 66.70 65.23 2h4c h VAL 95 Cb 1.05 3.06 0.00 0.00 -1.52 0.00 0.00 31.29 33.88 2h4c h VAL 95 CO -0.00 0.73 0.00 0.00 0.02 0.00 0.00 177.57 178.32 2h4c h GLU 97 N 0.00 0.00 -0.53 0.00 4.57 0.37 -2.90 114.58 116.09 2h4c h GLU 97 Ca 0.00 0.00 0.09 0.00 -1.18 0.00 0.00 59.36 58.27 2h4c h GLU 97 Cb 0.02 0.00 -0.11 0.00 -0.16 0.00 0.00 28.75 28.51 2h4c h GLU 97 CO 0.00 0.00 -0.37 0.00 -1.18 0.00 0.00 179.01 177.46 2h4c h ASP 99 N -0.22 0.00 0.30 0.00 5.19 -1.15 0.27 116.42 120.82 2h4c h ASP 99 Ca 0.20 0.00 -0.27 0.00 -0.62 0.00 0.00 57.03 56.34 2h4c h ASP 99 Cb 0.56 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.08 2h4c h ASP 99 CO -0.65 0.00 -1.15 -0.09 -3.12 0.00 0.00 179.24 174.24 2h4c h ARG 100 N 0.00 0.48 0.00 3.56 2.43 0.29 -2.71 114.38 118.43 2h4c h ARG 100 Ca 0.18 -0.63 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 2h4c h ARG 100 Cb 0.89 0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 2h4c h ARG 100 CO -0.00 1.26 0.00 0.00 -1.51 0.00 0.00 179.97 179.72 2h4c n ALA 101 N -2.60 2.09 -0.06 2.80 0.00 0.91 -3.34 120.51 120.31 2h4c n ALA 101 Ca -0.10 -0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.12 2h4c n ALA 101 Cb 0.94 -1.44 -0.12 0.00 0.00 0.00 0.00 19.45 18.83 2h4c n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h4c n ALA 102 N -1.75 0.91 0.04 0.00 0.00 -0.24 -2.60 120.51 116.88 2h4c n ALA 102 Ca 0.05 -0.63 0.16 0.00 0.00 0.00 0.00 53.44 53.02 2h4c n ALA 102 Cb 0.36 -0.52 0.65 0.00 0.00 0.00 0.00 19.45 19.94 2h4c n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h4c h ALA 103 N -0.25 2.32 0.05 0.00 0.00 -1.55 0.57 119.26 120.39 2h4c h ALA 103 Ca -0.43 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 2h4c h ALA 103 Cb 1.70 0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.51 2h4c h ALA 103 CO -0.09 -0.44 -0.35 0.82 0.00 0.00 0.00 179.25 179.20 2h4c h ILE 104 N 0.06 1.66 0.10 0.00 2.04 -1.69 -2.69 117.51 116.99 2h4c h ILE 104 Ca 0.20 -2.41 0.00 0.00 1.00 0.00 0.00 64.86 63.65 2h4c h ILE 104 Cb 0.72 3.28 -0.02 0.00 -0.74 0.00 0.00 36.82 40.07 2h4c h ILE 104 CO -0.01 0.64 -0.24 0.00 0.00 0.00 0.00 178.15 178.53 2h4c h LEU 106 N -0.38 -0.76 0.09 0.00 3.38 -0.09 -0.92 115.31 116.62 2h4c h LEU 106 Ca -0.01 0.20 0.01 0.00 0.09 0.00 0.00 57.88 58.17 2h4c h LEU 106 Cb 0.37 0.45 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 2h4c h LEU 106 CO -0.11 -0.24 -0.15 1.23 0.09 0.00 0.00 178.44 179.26 2h4c h GLY 107 N -0.06 -0.26 -0.20 0.83 0.00 -1.17 -2.67 103.07 99.54 2h4c h GLY 107 Ca 0.28 0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.78 2h4c h GLY 107 CO -0.65 -0.15 0.00 -1.06 0.00 0.00 0.00 176.54 174.68 2h4c n GLN 108 N -5.27 0.57 -0.99 4.80 6.02 0.10 -3.29 117.38 119.31 2h4c n GLN 108 Ca -0.07 0.00 0.03 0.00 -0.01 0.00 0.00 57.00 56.95 2h4c n GLN 108 Cb 0.19 -1.06 0.03 0.00 1.02 0.00 0.00 30.24 30.43 2h4c n GLN 108 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2h4c n ASN 109 N -0.36 0.76 -0.08 1.08 3.02 -0.90 -4.84 115.26 113.95 2h4c n ASN 109 Ca 0.00 -2.20 0.13 0.00 -0.03 0.00 0.00 54.58 52.48 2h4c n ASN 109 Cb 0.03 -0.29 0.39 0.00 -0.61 0.00 0.00 39.78 39.30 2h4c n ASN 109 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2h4c n VAL 110 N 0.09 0.00 -0.10 2.41 0.24 -1.21 -2.85 118.33 116.91 2h4c n VAL 110 Ca 0.05 -0.04 -0.14 0.00 -2.04 0.00 0.00 64.34 62.18 2h4c n VAL 110 Cb 0.92 0.13 -0.04 0.00 -1.47 0.00 0.00 33.84 33.38 2h4c n VAL 110 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2h4c h ASN 111 N 0.38 0.88 0.06 -1.34 -1.07 -1.88 -2.78 115.58 109.83 2h4c h ASN 111 Ca 0.00 -0.49 0.00 0.00 0.07 0.00 0.00 56.30 55.88 2h4c h ASN 111 Cb 0.48 -0.25 0.00 0.00 -2.07 0.00 0.00 38.32 36.48 2h4c h ASN 111 CO 0.00 1.19 -0.08 0.35 0.07 0.00 0.00 177.43 178.96 2h4c n THR 112 N -4.14 0.00 -1.53 6.14 -2.24 -1.24 -4.91 114.28 106.36 2h4c n THR 112 Ca -0.04 -0.22 -0.48 0.00 -2.27 0.00 0.00 64.05 61.04 2h4c n THR 112 Cb 0.53 0.52 -0.05 0.00 -2.10 0.00 0.00 70.33 69.23 2h4c n THR 112 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2h4c n TYR 113 N -0.03 1.81 -2.38 4.78 4.19 -1.05 -4.94 117.16 119.54 2h4c n TYR 113 Ca 0.17 0.10 -0.27 0.00 3.31 0.00 0.00 57.90 61.21 2h4c n TYR 113 Cb 0.36 -2.62 0.02 0.00 0.49 0.00 0.00 39.34 37.60 2h4c n TYR 113 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 2h4c s ASP 114 N 7.27 5.78 0.00 2.98 -1.08 -1.26 -5.04 116.67 125.32 2h4c s ASP 114 Ca 1.05 0.84 0.00 0.00 -0.52 0.00 0.00 52.55 53.91 2h4c s ASP 114 Cb -0.66 -1.90 0.00 0.00 -1.46 0.00 0.00 42.92 38.90 2h4c s ASP 114 CO 0.45 -0.96 0.00 1.17 0.52 0.00 0.00 175.17 176.35 2h4c n LYS 115 N -2.55 0.00 0.00 4.34 4.81 -1.26 -4.55 118.16 118.95 2h4c n LYS 115 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 2h4c n LYS 115 Cb 0.57 -0.26 0.00 0.00 0.02 0.00 0.00 35.03 35.36 2h4c n LYS 115 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2h4c n ASN 116 N -2.03 0.00 0.00 3.14 4.13 -1.26 0.46 115.26 119.70 2h4c n ASN 116 Ca 0.00 0.00 0.11 0.00 1.68 0.00 0.00 54.58 56.37 2h4c n ASN 116 Cb 0.00 0.00 0.66 0.00 -1.54 0.00 0.00 39.78 38.90 2h4c n ASN 116 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 2h4c n TYR 117 N -0.87 0.00 -1.84 3.10 4.01 -1.26 -4.75 117.16 115.56 2h4c n TYR 117 Ca 0.00 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.45 2h4c n TYR 117 Cb 0.38 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.49 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 2.10 0.00 -0.72 2.02 0.17 -0.77 118.70 119.50 2h4c s GLU 118 Ca 0.33 0.25 0.00 0.00 0.02 0.00 0.00 54.97 55.57 2h4c s GLU 118 Cb 0.15 -1.95 0.00 0.00 0.10 0.00 0.00 34.13 32.43 2h4c s GLU 118 CO 0.26 -1.53 0.00 0.09 0.02 0.00 0.00 175.26 174.10 2h4c n ASN 119 N -3.30 0.00 -4.29 -0.19 3.02 -1.10 -4.85 115.26 104.55 2h4c n ASN 119 Ca 0.08 0.00 -0.17 0.00 -0.03 0.00 0.00 54.58 54.45 2h4c n ASN 119 Cb 0.60 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.66 2h4c n ASN 119 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 2h4c s TYR 120 N -4.11 1.52 0.00 3.10 -0.00 -1.26 -4.96 117.35 111.64 2h4c s TYR 120 Ca 0.00 -0.61 0.00 0.00 -0.00 0.00 0.00 57.07 56.46 2h4c s TYR 120 Cb 0.00 -0.75 0.00 0.00 -0.00 0.00 0.00 41.96 41.21 2h4c s TYR 120 CO 0.00 0.23 0.00 0.00 -0.00 0.00 0.00 175.55 175.78 2h4c n ALA 121 N -0.02 -0.65 0.86 9.51 0.00 -1.26 -4.93 120.51 124.03 2h4c n ALA 121 Ca -0.11 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.43 2h4c n ALA 121 Cb 0.59 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.53 2h4c n ALA 121 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2h4c n ILE 122 N -0.16 0.47 -2.69 0.00 5.41 -1.26 -3.96 119.36 117.16 2h4c n ILE 122 Ca 0.00 0.12 -0.03 0.00 1.00 0.00 0.00 62.75 63.83 2h4c n ILE 122 Cb 0.04 -0.77 0.03 0.00 -0.71 0.00 0.00 39.64 38.22 2h4c n ILE 122 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 2h4c n SER 124 N -1.37 -1.92 -3.69 4.38 7.64 -1.26 -5.18 113.62 112.22 2h4c n SER 124 Ca 0.08 -1.40 -0.01 0.00 1.01 0.00 0.00 58.87 58.55 2h4c n SER 124 Cb 0.19 0.97 -0.01 0.00 -1.01 0.00 0.00 64.21 64.35 2h4c n SER 124 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2h4c s HIS 125 N 0.95 -0.09 0.00 1.43 5.04 -1.25 -4.95 115.29 116.42 2h4c s HIS 125 Ca 0.25 -0.12 0.00 0.00 -1.54 0.00 0.00 55.06 53.65 2h4c s HIS 125 Cb 0.10 0.59 0.00 0.00 0.04 0.00 0.00 32.58 33.31 2h4c s HIS 125 CO -0.09 -0.55 0.00 0.00 -2.34 0.00 0.00 174.74 171.75 2h4c n THR 127 N -2.89 0.00 -0.68 0.00 5.66 -1.26 -0.78 114.28 114.33 2h4c n THR 127 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2h4c n THR 127 Cb 0.00 -1.44 0.00 0.00 -1.55 0.00 0.00 70.33 67.34 2h4c n THR 127 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2h4c n GLU 128 N -0.43 0.00 0.00 1.09 1.02 -1.26 -4.68 120.64 116.38 2h4c n GLU 128 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2h4c n GLU 128 Cb 0.00 -2.35 0.00 0.00 -0.02 0.00 0.00 31.44 29.07 2h4c n GLU 128 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 2h4c n GLU 129 N -2.00 0.00 -0.95 3.49 0.28 -1.26 -5.09 120.64 115.11 2h4c n GLU 129 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2h4c n GLU 129 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 2h4c n GLU 129 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 2h4c n SER 130 N -1.45 -1.79 -4.56 -1.84 7.64 -1.25 -4.73 113.62 105.64 2h4c n SER 130 Ca 0.00 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.52 2h4c n SER 130 Cb 0.00 -0.90 0.07 0.00 -1.01 0.00 0.00 64.21 62.37 2h4c n SER 130 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2h4c n GLU 131 N 0.29 0.53 -3.26 1.43 2.13 -0.32 -4.80 120.64 116.64 2h4c n GLU 131 Ca 0.00 0.23 -0.21 0.00 0.66 0.00 0.00 57.16 57.84 2h4c n GLU 131 Cb 0.00 -2.04 0.04 0.00 0.27 0.00 0.00 31.44 29.70 2h4c n GLU 131 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2h4c s GLN 132 N -2.91 2.35 0.00 5.31 -0.21 -1.26 -4.95 119.66 117.98 2h4c s GLN 132 Ca 0.71 -1.69 0.06 0.00 0.02 0.00 0.00 55.36 54.46 2h4c s GLN 132 Cb -0.37 -2.51 0.05 0.00 1.00 0.00 0.00 33.01 31.17 2h4c s GLN 132 CO 0.52 -0.72 0.68 0.00 -2.12 0.00 0.00 175.29 173.65