#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h4c h LEU 2 N 0.00 0.00 -0.55 -4.53 3.38 -1.84 0.12 115.31 111.90 2h4c h LEU 2 Ca 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2h4c h LEU 2 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2h4c h LEU 2 CO 0.00 0.29 -0.03 -0.26 0.09 0.00 0.00 178.44 178.53 2h4c h PHE 3 N 0.00 1.08 -0.10 1.13 0.04 -1.97 -2.05 116.94 115.06 2h4c h PHE 3 Ca -0.00 -0.20 -0.23 0.00 2.80 0.00 0.00 57.97 60.34 2h4c h PHE 3 Cb 0.75 -0.28 0.01 0.00 2.20 0.00 0.00 35.95 38.63 2h4c h PHE 3 CO 0.00 0.99 -0.83 1.96 -0.60 0.00 0.00 178.31 179.83 2h4c h GLN 4 N 0.86 0.74 -0.76 1.51 4.20 -1.88 -3.07 115.11 116.71 2h4c h GLN 4 Ca 0.15 -0.66 0.04 0.00 0.06 0.00 0.00 58.65 58.24 2h4c h GLN 4 Cb 0.58 0.16 -0.05 0.00 0.30 0.00 0.00 27.48 28.46 2h4c h GLN 4 CO 0.03 1.26 0.48 0.35 -0.67 0.00 0.00 178.83 180.28 2h4c h PHE 5 N 0.44 0.90 0.00 2.96 3.57 -0.69 -0.31 116.94 123.81 2h4c h PHE 5 Ca -0.07 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.40 2h4c h PHE 5 Cb 1.47 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.91 2h4c h PHE 5 CO 0.10 0.50 -0.22 0.00 -2.23 0.00 0.00 178.31 176.46 2h4c h ALA 6 N 1.33 1.37 0.01 2.41 0.00 -1.41 0.58 119.26 123.55 2h4c h ALA 6 Ca 0.31 -0.20 -0.21 0.00 0.00 0.00 0.00 54.91 54.82 2h4c h ALA 6 Cb 0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2h4c h ALA 6 CO -0.12 0.27 -0.99 0.00 0.00 0.00 0.00 179.25 178.41 2h4c h ARG 7 N 0.00 0.03 0.06 0.00 3.08 -1.01 -1.22 114.38 115.32 2h4c h ARG 7 Ca -0.00 -0.05 -0.24 0.00 0.07 0.00 0.00 59.98 59.76 2h4c h ARG 7 Cb 0.46 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 2h4c h ARG 7 CO 0.03 0.99 -1.09 -0.07 -1.07 0.00 0.00 179.97 178.76 2h4c h LEU 8 N 0.01 0.27 0.37 3.04 3.38 -0.78 0.63 115.31 122.24 2h4c h LEU 8 Ca -0.02 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 2h4c h LEU 8 Cb 1.72 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.39 2h4c h LEU 8 CO 0.13 1.18 -0.18 0.40 0.09 0.00 0.00 178.44 180.06 2h4c h ILE 9 N 0.07 0.63 0.53 1.22 2.04 -0.86 -2.75 117.51 118.39 2h4c h ILE 9 Ca -0.08 -0.03 -0.03 0.00 1.00 0.00 0.00 64.86 65.72 2h4c h ILE 9 Cb 1.80 0.65 0.01 0.00 -0.74 0.00 0.00 36.82 38.54 2h4c h ILE 9 CO 0.17 0.01 -0.25 0.44 0.00 0.00 0.00 178.15 178.51 2h4c h ASP 10 N -0.52 -0.60 -1.24 1.72 3.32 -1.22 -2.88 116.42 114.99 2h4c h ASP 10 Ca -0.05 -0.04 0.37 0.00 0.02 0.00 0.00 57.03 57.33 2h4c h ASP 10 Cb 0.40 0.16 -0.06 0.00 0.22 0.00 0.00 39.33 40.04 2h4c h ASP 10 CO 0.08 -0.32 0.88 0.00 -1.72 0.00 0.00 179.24 178.17 2h4c n ALA 11 N -2.50 1.20 -0.40 3.45 0.00 0.22 0.24 120.51 122.72 2h4c n ALA 11 Ca -0.12 0.48 0.06 0.00 0.00 0.00 0.00 53.44 53.86 2h4c n ALA 11 Cb 0.32 -0.76 0.17 0.00 0.00 0.00 0.00 19.45 19.18 2h4c n ALA 11 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2h4c n LYS 12 N -3.48 2.87 0.00 0.00 4.81 -1.05 -4.67 118.16 116.65 2h4c n LYS 12 Ca 0.30 -2.24 0.00 0.00 -0.87 0.00 0.00 58.31 55.50 2h4c n LYS 12 Cb 1.30 -1.41 0.00 0.00 0.02 0.00 0.00 35.03 34.94 2h4c n LYS 12 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2h4c n GLN 13 N 0.15 0.17 0.00 1.64 6.02 0.65 -4.65 117.38 121.36 2h4c n GLN 13 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.13 2h4c n GLN 13 Cb 0.54 -0.55 0.00 0.00 1.02 0.00 0.00 30.24 31.26 2h4c n GLN 13 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2h4c n GLU 14 N -1.17 0.00 -2.04 -1.09 2.13 0.25 -4.99 120.64 113.73 2h4c n GLU 14 Ca 0.00 0.00 -0.40 0.00 0.66 0.00 0.00 57.16 57.42 2h4c n GLU 14 Cb 0.05 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 31.75 2h4c n GLU 14 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2h4c s ALA 16 N -2.01 3.40 -0.68 4.31 0.00 -1.26 -2.75 121.76 122.77 2h4c s ALA 16 Ca 0.00 1.30 0.00 0.00 0.00 0.00 0.00 51.96 53.26 2h4c s ALA 16 Cb 0.00 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.62 2h4c s ALA 16 CO 0.00 -0.79 0.00 1.19 0.00 0.00 0.00 175.76 176.16 2h4c n PHE 17 N 0.45 0.00 0.08 0.00 3.72 -1.26 -4.85 117.46 115.60 2h4c n PHE 17 Ca 0.02 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.42 2h4c n PHE 17 Cb 0.42 -1.99 0.33 0.00 -0.94 0.00 0.00 39.48 37.30 2h4c n PHE 17 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 2h4c h SER 18 N 0.00 0.32 -0.04 4.37 0.02 -1.86 -2.07 113.55 114.29 2h4c h SER 18 Ca -0.13 -0.07 0.01 0.00 -0.84 0.00 0.00 61.79 60.75 2h4c h SER 18 Cb 0.85 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.31 2h4c h SER 18 CO 0.19 0.49 0.07 2.19 -1.14 0.00 0.00 176.83 178.63 2h4c h PHE 19 N 0.31 0.00 -0.06 3.45 -0.00 -1.84 -2.80 116.94 116.00 2h4c h PHE 19 Ca 0.06 0.00 0.02 0.00 -0.00 0.00 0.00 57.97 58.05 2h4c h PHE 19 Cb 0.44 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.39 2h4c h PHE 19 CO 0.01 0.00 0.55 0.74 -0.00 0.00 0.00 178.31 179.61 2h4c h PHE 20 N 0.00 0.00 -0.00 6.09 0.05 -1.77 -0.81 116.94 120.50 2h4c h PHE 20 Ca 0.02 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.81 2h4c h PHE 20 Cb 0.16 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.11 2h4c h PHE 20 CO 0.00 0.00 -0.82 0.36 -0.18 0.00 0.00 178.31 177.67 2h4c n LYS 21 N -2.85 0.35 -0.49 1.51 2.85 -1.06 -3.92 118.16 114.55 2h4c n LYS 21 Ca 0.00 -0.29 0.09 0.00 -1.05 0.00 0.00 58.31 57.06 2h4c n LYS 21 Cb 0.60 -1.49 0.30 0.00 -0.65 0.00 0.00 35.03 33.78 2h4c n LYS 21 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2h4c n TYR 22 N -1.07 1.16 -0.31 5.58 4.01 -0.31 -4.44 117.16 121.77 2h4c n TYR 22 Ca 0.06 -0.64 0.15 0.00 -0.16 0.00 0.00 57.90 57.31 2h4c n TYR 22 Cb 0.37 -0.21 0.33 0.00 -0.31 0.00 0.00 39.34 39.52 2h4c n TYR 22 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 2h4c h ILE 23 N 3.23 0.43 -0.40 -0.72 1.08 -1.67 -3.31 117.51 116.16 2h4c h ILE 23 Ca 0.00 -0.13 0.19 0.00 -0.39 0.00 0.00 64.86 64.53 2h4c h ILE 23 Cb 1.30 0.02 -0.19 0.00 -3.07 0.00 0.00 36.82 34.87 2h4c h ILE 23 CO 0.18 0.07 -0.06 -0.55 -0.69 0.00 0.00 178.15 177.10 2h4c s SER 24 N -5.13 -0.64 0.11 1.72 0.15 -1.26 -4.31 113.70 104.35 2h4c s SER 24 Ca -0.11 0.12 0.02 0.00 0.70 0.00 0.00 55.95 56.68 2h4c s SER 24 Cb 0.26 1.42 -0.04 0.00 -1.71 0.00 0.00 66.02 65.95 2h4c s SER 24 CO 0.78 -0.12 -0.07 -0.47 1.20 0.00 0.00 173.24 174.56 2h4c s TYR 25 N 2.93 0.95 0.00 3.44 6.14 0.41 -2.15 117.35 129.07 2h4c s TYR 25 Ca 0.21 -0.89 0.00 0.00 0.64 0.00 0.00 57.07 57.02 2h4c s TYR 25 Cb -0.05 -0.54 0.00 0.00 0.42 0.00 0.00 41.96 41.80 2h4c s TYR 25 CO -0.22 -0.12 0.00 0.41 0.64 0.00 0.00 175.55 176.27 2h4c n GLY 26 N -0.07 0.91 0.02 8.97 0.00 0.21 -2.53 105.19 112.71 2h4c n GLY 26 Ca -0.12 -0.58 -0.01 0.00 0.00 0.00 0.00 46.02 45.31 2h4c n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h4c h TYR 28 N -0.38 0.93 -1.94 0.00 -1.99 -1.84 -3.27 116.97 108.49 2h4c h TYR 28 Ca 0.00 -0.36 -0.56 0.00 2.00 0.00 0.00 58.73 59.81 2h4c h TYR 28 Cb 0.12 -0.17 -0.00 0.00 2.00 0.00 0.00 36.73 38.68 2h4c h TYR 28 CO -0.05 1.16 1.51 0.00 -0.00 0.00 0.00 178.16 180.78 2h4c n GLY 30 N 5.81 0.56 2.59 0.00 0.00 -1.24 0.15 105.19 113.06 2h4c n GLY 30 Ca 0.31 -1.17 -0.32 0.00 0.00 0.00 0.00 46.02 44.84 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 0.00 3.26 0.00 1.61 7.02 -1.26 -4.96 117.44 123.11 2h4c n TRP 31 Ca 0.00 -3.70 0.00 0.00 -1.02 0.00 0.00 57.50 52.78 2h4c n TRP 31 Cb 0.00 -0.76 0.00 0.00 -2.42 0.00 0.00 31.31 28.13 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 0.96 2.22 0.00 6.99 0.00 -1.23 -5.03 105.19 109.09 2h4c n GLY 32 Ca 0.29 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 1.43 3.42 -0.02 0.00 -1.26 -5.02 105.19 108.74 2h4c n GLY 33 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 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 0.31 0.00 1.61 -2.07 -1.26 -5.05 119.66 113.20 2h4c s GLN 34 Ca 0.00 0.77 0.00 0.00 -1.82 0.00 0.00 55.36 54.31 2h4c s GLN 34 Cb 0.00 0.46 0.00 0.00 -1.09 0.00 0.00 33.01 32.38 2h4c s GLN 34 CO 0.00 -0.11 0.00 0.41 -1.32 0.00 0.00 175.29 174.27 2h4c n GLY 35 N 5.00 0.76 3.08 2.60 0.00 -1.26 -3.87 105.19 111.50 2h4c n GLY 35 Ca -0.09 -1.98 -0.28 0.00 0.00 0.00 0.00 46.02 43.66 2h4c n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2h4c s THR 36 N -1.97 1.51 -0.65 2.61 2.01 -1.26 -1.04 115.64 116.85 2h4c s THR 36 Ca 0.00 -0.68 -0.37 0.00 0.31 0.00 0.00 61.69 60.95 2h4c s THR 36 Cb 0.00 -1.36 -0.18 0.00 0.01 0.00 0.00 72.50 70.97 2h4c s THR 36 CO 0.00 0.44 2.36 -2.65 -0.69 0.00 0.00 174.62 174.08 2h4c n PRO 37 N 3.91 0.24 0.04 4.92 -0.02 -1.26 -4.82 135.00 138.01 2h4c n PRO 37 Ca -0.20 0.05 0.19 0.00 -2.02 0.00 0.00 63.50 61.52 2h4c n PRO 37 Cb 0.52 -1.78 0.70 0.00 -0.02 0.00 0.00 33.50 32.92 2h4c n PRO 37 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2h4c h LYS 38 N 11.27 0.00 0.00 -0.52 1.79 -1.96 -3.45 116.57 123.71 2h4c h LYS 38 Ca -0.12 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.35 2h4c h LYS 38 Cb 1.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.01 2h4c h LYS 38 CO 1.19 0.00 0.02 -0.40 -1.08 0.00 0.00 179.45 179.17 2h4c n ASP 39 N -4.29 -0.17 -0.06 0.86 5.75 -1.26 -5.01 116.55 112.37 2h4c n ASP 39 Ca 0.08 -1.12 0.02 0.00 -0.01 0.00 0.00 54.79 53.76 2h4c n ASP 39 Cb 0.55 0.28 0.34 0.00 -1.03 0.00 0.00 41.12 41.26 2h4c n ASP 39 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2h4c h ALA 40 N 1.96 1.55 0.05 2.12 0.00 -1.89 -0.71 119.26 122.33 2h4c h ALA 40 Ca -0.02 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2h4c h ALA 40 Cb 0.09 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2h4c h ALA 40 CO 0.03 0.38 -0.02 1.15 0.00 0.00 0.00 179.25 180.78 2h4c h THR 41 N 0.67 0.00 -1.45 0.00 2.02 -1.86 -3.10 112.91 109.19 2h4c h THR 41 Ca 0.17 -0.06 0.43 0.00 0.77 0.00 0.00 66.41 67.73 2h4c h THR 41 Cb 0.02 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.34 2h4c h THR 41 CO -0.03 0.00 1.00 -0.78 0.37 0.00 0.00 175.52 176.08 2h4c h ASP 42 N -0.12 0.13 0.39 4.18 3.58 -1.91 2.20 116.42 124.87 2h4c h ASP 42 Ca -0.01 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.50 2h4c h ASP 42 Cb 0.05 0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.14 2h4c h ASP 42 CO 0.01 -0.05 0.00 -0.09 -2.88 0.00 0.00 179.24 176.23 2h4c h ARG 43 N 0.07 0.00 0.12 0.28 2.43 -1.10 -0.67 114.38 115.51 2h4c h ARG 43 Ca 0.76 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 59.69 2h4c h ARG 43 Cb 2.72 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 32.28 2h4c h ARG 43 CO -0.18 0.00 -1.20 0.00 -1.51 0.00 0.00 179.97 177.09 2h4c h PHE 46 N -0.02 0.56 -0.12 0.00 3.57 -1.33 0.99 116.94 120.59 2h4c h PHE 46 Ca 0.04 0.02 -0.16 0.00 3.53 0.00 0.00 57.97 61.40 2h4c h PHE 46 Cb 0.36 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 2h4c h PHE 46 CO 0.03 0.13 -0.61 0.28 -2.23 0.00 0.00 178.31 175.91 2h4c h VAL 47 N 0.41 1.36 -0.82 1.41 2.07 -1.64 -3.15 116.25 115.88 2h4c h VAL 47 Ca 0.49 -1.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.04 2h4c h VAL 47 Cb 1.23 1.93 -0.04 0.00 -1.52 0.00 0.00 31.29 32.89 2h4c h VAL 47 CO -0.19 0.59 0.39 -0.74 0.02 0.00 0.00 177.57 177.63 2h4c h HIS 48 N 0.30 1.19 -0.31 1.57 -0.00 -0.57 -0.53 115.15 116.80 2h4c h HIS 48 Ca -0.01 -0.06 -0.07 0.00 -0.00 0.00 0.00 60.37 60.24 2h4c h HIS 48 Cb 1.15 -0.37 -0.01 0.00 -0.00 0.00 0.00 27.41 28.18 2h4c h HIS 48 CO 0.04 0.86 -0.07 -0.44 -0.00 0.00 0.00 177.93 178.32 2h4c h ASP 49 N 1.17 0.59 0.18 3.26 3.32 -1.48 0.47 116.42 123.94 2h4c h ASP 49 Ca 0.28 -0.36 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 2h4c h ASP 49 Cb 0.13 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.51 2h4c h ASP 49 CO -0.03 0.81 -0.10 0.00 -1.72 0.00 0.00 179.24 178.19 2h4c n TYR 52 N -2.86 0.04 0.09 0.00 4.02 0.15 0.29 117.16 118.89 2h4c n TYR 52 Ca 0.00 0.04 -0.04 0.00 -0.01 0.00 0.00 57.90 57.89 2h4c n TYR 52 Cb 0.01 -0.50 -0.05 0.00 -0.02 0.00 0.00 39.34 38.78 2h4c n TYR 52 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2h4c h ALA 53 N 0.95 0.49 0.34 -0.72 0.00 0.20 -3.32 119.26 117.20 2h4c h ALA 53 Ca 0.86 -0.76 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2h4c h ALA 53 Cb 3.42 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 21.08 2h4c h ALA 53 CO -0.04 1.04 -0.17 0.00 0.00 0.00 0.00 179.25 180.09 2h4c h ARG 54 N 0.00 -0.44 -4.72 0.00 2.47 0.49 -3.45 114.38 108.73 2h4c h ARG 54 Ca -0.01 0.03 -0.58 0.00 -1.26 0.00 0.00 59.98 58.16 2h4c h ARG 54 Cb 1.61 0.10 0.06 0.00 -1.65 0.00 0.00 29.97 30.09 2h4c h ARG 54 CO 0.11 -0.14 -0.15 0.28 0.56 0.00 0.00 179.97 180.63 2h4c n VAL 55 N -5.16 0.68 -4.15 2.04 0.31 -1.06 -4.97 118.33 106.02 2h4c n VAL 55 Ca -0.10 -0.17 -0.19 0.00 -0.01 0.00 0.00 64.34 63.87 2h4c n VAL 55 Cb 0.27 0.00 -0.16 0.00 -0.91 0.00 0.00 33.84 33.04 2h4c n VAL 55 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2h4c s LYS 56 N -0.34 0.68 0.00 5.55 3.01 -1.26 -4.82 119.74 122.55 2h4c s LYS 56 Ca 0.62 -0.11 0.00 0.00 -1.01 0.00 0.00 55.97 55.47 2h4c s LYS 56 Cb -0.88 -0.70 0.00 0.00 -1.01 0.00 0.00 37.83 35.24 2h4c s LYS 56 CO 0.44 -0.03 0.00 0.41 0.51 0.00 0.00 175.35 176.68 2h4c n GLY 58 N 3.78 0.69 3.63 -3.33 0.00 -1.26 -4.79 105.19 103.90 2h4c n GLY 58 Ca -0.23 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.67 2h4c n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h4c s ASN 61 N 0.20 6.51 0.31 0.00 0.01 -1.26 -4.93 114.94 115.78 2h4c s ASN 61 Ca 0.01 0.16 0.08 0.00 -0.71 0.00 0.00 52.86 52.40 2h4c s ASN 61 Cb -0.05 -2.47 0.88 0.00 0.41 0.00 0.00 41.25 40.02 2h4c s ASN 61 CO -0.02 -1.11 1.66 -0.65 -1.51 0.00 0.00 177.10 175.47 2h4c h PRO 68 N 9.14 0.27 0.00 -0.60 0.11 -1.93 0.13 132.00 139.12 2h4c h PRO 68 Ca -0.24 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.81 2h4c h PRO 68 Cb 1.07 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 2h4c h PRO 68 CO 1.05 0.18 -0.49 -0.22 -0.21 0.00 0.00 178.00 178.31 2h4c h LYS 69 N 0.28 0.00 -0.02 1.05 3.64 -1.96 -3.34 116.57 116.23 2h4c h LYS 69 Ca 0.64 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.02 2h4c h LYS 69 Cb 1.36 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.18 2h4c h LYS 69 CO -0.63 0.16 -0.36 1.28 -2.27 0.00 0.00 179.45 177.64 2h4c n LEU 70 N -3.02 2.22 -4.91 5.20 4.77 -0.40 -4.24 117.00 116.61 2h4c n LEU 70 Ca 0.01 -0.82 -0.31 0.00 -0.03 0.00 0.00 56.01 54.87 2h4c n LEU 70 Cb 0.62 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.67 2h4c n LEU 70 CO 0.38 0.40 -0.07 0.54 -1.33 0.00 0.00 177.39 177.31 2h4c s VAL 71 N -2.31 5.29 -0.32 4.08 0.11 0.32 -4.96 120.40 122.62 2h4c s VAL 71 Ca 0.20 -0.25 -0.02 0.00 -2.93 0.00 0.00 61.98 58.98 2h4c s VAL 71 Cb 0.18 -3.64 0.06 0.00 -1.53 0.00 0.00 36.38 31.45 2h4c s VAL 71 CO 0.49 0.07 0.03 -0.70 -3.33 0.00 0.00 175.10 171.66 2h4c s GLU 72 N -2.66 2.34 0.78 1.54 2.12 -1.26 0.03 118.70 121.58 2h4c s GLU 72 Ca 0.37 -1.36 -0.06 0.00 0.36 0.00 0.00 54.97 54.29 2h4c s GLU 72 Cb -0.12 -3.24 0.14 0.00 0.26 0.00 0.00 34.13 31.16 2h4c s GLU 72 CO 0.27 -0.69 1.08 1.52 -0.54 0.00 0.00 175.26 176.90 2h4c s TYR 73 N 1.23 1.76 -0.17 5.30 -0.85 -1.26 -4.95 117.35 118.41 2h4c s TYR 73 Ca -0.03 -0.03 -0.03 0.00 -0.52 0.00 0.00 57.07 56.46 2h4c s TYR 73 Cb -0.20 -3.32 0.06 0.00 0.38 0.00 0.00 41.96 38.88 2h4c s TYR 73 CO -0.02 -1.92 0.05 -1.54 -1.52 0.00 0.00 175.55 170.61 2h4c s SER 74 N -4.75 2.61 0.00 -0.18 1.04 -1.26 -4.91 113.70 106.25 2h4c s SER 74 Ca 0.67 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 56.42 2h4c s SER 74 Cb -0.06 -0.48 0.00 0.00 0.10 0.00 0.00 66.02 65.59 2h4c s SER 74 CO 0.47 -0.31 0.00 0.00 0.98 0.00 0.00 173.24 174.38 2h4c n TYR 75 N 5.12 0.00 0.00 5.02 4.11 -1.26 -2.52 117.16 127.63 2h4c n TYR 75 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.82 2h4c n TYR 75 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.82 2h4c n TYR 75 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 2h4c n SER 76 N 0.00 0.00 -4.63 9.48 2.88 -0.76 -4.61 113.62 115.98 2h4c n SER 76 Ca 0.00 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.11 2h4c n SER 76 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 2h4c n SER 76 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 2h4c s TYR 77 N 0.00 1.47 -0.06 0.66 5.04 -1.26 -2.16 117.35 121.05 2h4c s TYR 77 Ca 0.00 0.19 0.05 0.00 -2.44 0.00 0.00 57.07 54.87 2h4c s TYR 77 Cb 0.00 -4.06 -0.00 0.00 0.35 0.00 0.00 41.96 38.25 2h4c s TYR 77 CO 0.00 -4.28 -0.20 1.03 -1.34 0.00 0.00 175.55 170.76 2h4c s ARG 78 N 5.23 2.14 -0.49 4.97 0.52 0.44 -4.82 118.95 126.93 2h4c s ARG 78 Ca 0.88 -0.71 -0.06 0.00 -0.52 0.00 0.00 55.73 55.32 2h4c s ARG 78 Cb -0.34 -1.79 0.06 0.00 0.52 0.00 0.00 34.95 33.40 2h4c s ARG 78 CO 0.36 0.26 0.16 2.41 0.02 0.00 0.00 175.30 178.50 2h4c n THR 79 N 3.19 0.00 0.00 0.02 -1.04 -1.26 0.15 114.28 115.34 2h4c n THR 79 Ca -0.18 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 2h4c n THR 79 Cb 0.53 -0.13 0.00 0.00 -1.82 0.00 0.00 70.33 68.90 2h4c n THR 79 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2h4c n GLY 80 N -0.55 1.59 3.57 3.41 0.00 -1.26 -5.11 105.19 106.83 2h4c n GLY 80 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 2h4c n GLY 80 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2h4c s LYS 81 N -0.07 1.87 -0.62 1.61 2.20 0.12 -5.04 119.74 119.81 2h4c s LYS 81 Ca 0.00 -1.95 -0.16 0.00 -0.36 0.00 0.00 55.97 53.50 2h4c s LYS 81 Cb 0.00 -1.72 0.14 0.00 -1.51 0.00 0.00 37.83 34.74 2h4c s LYS 81 CO 0.00 0.11 0.62 0.42 -0.36 0.00 0.00 175.35 176.13 2h4c s ILE 82 N -2.62 5.17 -0.74 5.43 1.01 -1.26 0.17 121.20 128.36 2h4c s ILE 82 Ca 0.33 -1.54 -0.24 0.00 0.00 0.00 0.00 60.65 59.20 2h4c s ILE 82 Cb 0.03 -4.42 0.06 0.00 0.01 0.00 0.00 42.46 38.15 2h4c s ILE 82 CO 0.17 -0.98 1.12 -0.69 0.00 0.00 0.00 174.94 174.56 2h4c s VAL 83 N 1.66 4.12 -1.13 2.92 1.01 -0.92 -4.88 120.40 123.19 2h4c s VAL 83 Ca 0.09 -0.22 -0.21 0.00 0.00 0.00 0.00 61.98 61.63 2h4c s VAL 83 Cb -0.24 -4.80 0.06 0.00 0.00 0.00 0.00 36.38 31.40 2h4c s VAL 83 CO 0.01 -1.64 1.55 0.00 0.00 0.00 0.00 175.10 175.03 2h4c s GLY 85 N 4.63 1.80 -0.30 0.00 0.00 -1.05 -4.95 107.32 107.45 2h4c s GLY 85 Ca 0.49 1.19 -0.18 0.00 0.00 0.00 0.00 44.72 46.22 2h4c s GLY 85 CO -0.03 2.50 1.19 -0.32 0.00 0.00 0.00 173.10 176.43 2h4c s GLY 86 N 1.28 0.07 -0.08 0.20 0.00 -1.26 -4.31 107.32 103.23 2h4c s GLY 86 Ca 0.67 3.38 -0.26 0.00 0.00 0.00 0.00 44.72 48.51 2h4c s GLY 86 CO 0.30 3.46 0.92 -0.55 0.00 0.00 0.00 173.10 177.22 2h4c h ASP 88 N 7.35 0.17 -3.20 1.64 5.19 -1.99 -3.44 116.42 122.15 2h4c h ASP 88 Ca -0.13 -0.88 -0.53 0.00 -0.62 0.00 0.00 57.03 54.87 2h4c h ASP 88 Cb 1.13 -0.05 0.04 0.00 0.18 0.00 0.00 39.33 40.63 2h4c h ASP 88 CO 0.02 1.04 0.72 -0.62 -3.12 0.00 0.00 179.24 177.28 2h4c s ASP 89 N -6.37 6.79 0.33 6.45 -1.08 -1.26 -4.89 116.67 116.63 2h4c s ASP 89 Ca -0.17 2.46 0.03 0.00 -0.52 0.00 0.00 52.55 54.35 2h4c s ASP 89 Cb -0.01 -2.60 0.56 0.00 -1.46 0.00 0.00 42.92 39.41 2h4c s ASP 89 CO 0.73 -0.63 1.87 -0.65 0.52 0.00 0.00 175.17 177.01 2h4c h PRO 90 N 5.90 0.59 0.23 4.34 0.11 -1.97 -3.01 132.00 138.18 2h4c h PRO 90 Ca -0.44 -0.12 -0.01 0.00 0.11 0.00 0.00 66.00 65.54 2h4c h PRO 90 Cb 1.21 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2h4c h PRO 90 CO 0.82 0.59 -0.11 0.00 -0.21 0.00 0.00 178.00 179.09 2h4c h LEU 92 N -0.33 0.00 0.00 0.00 4.07 -1.97 2.71 115.31 119.80 2h4c h LEU 92 Ca -0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.93 2h4c h LEU 92 Cb 0.24 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.98 2h4c h LEU 92 CO 0.05 0.00 -0.03 -0.09 -1.08 0.00 0.00 178.44 177.30 2h4c h ARG 93 N 0.00 0.00 0.03 1.13 2.43 -1.34 0.21 114.38 116.83 2h4c h ARG 93 Ca 0.46 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 59.46 2h4c h ARG 93 Cb 1.85 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 31.39 2h4c h ARG 93 CO -0.00 0.00 -0.91 0.00 -1.51 0.00 0.00 179.97 177.54 2h4c h ALA 94 N 2.21 0.16 0.03 2.80 0.00 1.17 -1.31 119.26 124.32 2h4c h ALA 94 Ca 0.00 -0.97 0.03 0.00 0.00 0.00 0.00 54.91 53.97 2h4c h ALA 94 Cb 0.89 0.45 -0.04 0.00 0.00 0.00 0.00 17.79 19.10 2h4c h ALA 94 CO 0.00 0.52 -0.25 0.28 0.00 0.00 0.00 179.25 179.80 2h4c h VAL 95 N -0.83 0.44 -0.19 0.00 2.07 0.97 -1.37 116.25 117.34 2h4c h VAL 95 Ca -0.23 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.33 2h4c h VAL 95 Cb 1.32 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 2h4c h VAL 95 CO -0.08 0.00 -0.08 0.00 0.02 0.00 0.00 177.57 177.43 2h4c h GLU 97 N -0.05 0.00 0.11 0.00 4.39 -0.94 -2.90 114.58 115.19 2h4c h GLU 97 Ca 0.10 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.54 2h4c h GLU 97 Cb 0.20 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 28.88 2h4c h GLU 97 CO -0.23 0.00 -1.07 0.00 -1.16 0.00 0.00 179.01 176.55 2h4c h ASP 99 N 0.10 0.46 -0.31 0.00 5.19 -1.52 -2.61 116.42 117.73 2h4c h ASP 99 Ca -0.16 -0.13 0.05 0.00 -0.62 0.00 0.00 57.03 56.17 2h4c h ASP 99 Cb 1.78 -0.12 -0.08 0.00 0.18 0.00 0.00 39.33 41.09 2h4c h ASP 99 CO 0.21 0.46 -0.48 -0.09 -3.12 0.00 0.00 179.24 176.22 2h4c h ARG 100 N 0.43 -0.41 -0.11 3.56 2.43 -1.56 0.51 114.38 119.22 2h4c h ARG 100 Ca 0.12 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.35 2h4c h ARG 100 Cb 0.13 0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2h4c h ARG 100 CO -0.01 -0.27 0.08 0.28 -1.51 0.00 0.00 179.97 178.54 2h4c h VAL 101 N -0.42 0.94 0.70 0.20 2.07 -1.46 0.52 116.25 118.80 2h4c h VAL 101 Ca 0.09 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.58 2h4c h VAL 101 Cb 0.61 0.94 0.01 0.00 -1.52 0.00 0.00 31.29 31.33 2h4c h VAL 101 CO -0.52 0.00 -0.34 0.00 0.02 0.00 0.00 177.57 176.73 2h4c h ALA 102 N 1.94 -0.94 -0.63 1.67 0.00 0.08 0.18 119.26 121.56 2h4c h ALA 102 Ca 0.05 -0.22 0.13 0.00 0.00 0.00 0.00 54.91 54.87 2h4c h ALA 102 Cb 0.22 0.36 -0.09 0.00 0.00 0.00 0.00 17.79 18.28 2h4c h ALA 102 CO -0.00 -0.92 0.12 0.00 0.00 0.00 0.00 179.25 178.45 2h4c h ALA 103 N -1.06 0.74 0.29 0.00 0.00 0.72 0.33 119.26 120.29 2h4c h ALA 103 Ca -0.10 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2h4c h ALA 103 Cb 0.75 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 2h4c h ALA 103 CO 0.16 -0.33 -0.27 0.82 0.00 0.00 0.00 179.25 179.63 2h4c h ILE 104 N 0.24 0.42 0.01 0.00 2.04 0.12 -1.28 117.51 119.06 2h4c h ILE 104 Ca 0.34 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.23 2h4c h ILE 104 Cb 0.53 0.42 -0.05 0.00 -0.74 0.00 0.00 36.82 36.98 2h4c h ILE 104 CO -0.45 0.00 -0.31 0.00 0.00 0.00 0.00 178.15 177.39 2h4c h PHE 106 N -0.47 -1.13 0.12 0.00 0.04 -0.17 0.23 116.94 115.56 2h4c h PHE 106 Ca 0.06 0.09 0.01 0.00 2.80 0.00 0.00 57.97 60.94 2h4c h PHE 106 Cb 0.55 0.61 -0.05 0.00 2.20 0.00 0.00 35.95 39.26 2h4c h PHE 106 CO -0.33 -0.40 -0.52 -0.09 -0.60 0.00 0.00 178.31 176.37 2h4c h ARG 107 N -0.10 -0.72 -0.94 1.51 2.43 -0.42 0.79 114.38 116.94 2h4c h ARG 107 Ca 0.26 0.05 0.27 0.00 -0.81 0.00 0.00 59.98 59.76 2h4c h ARG 107 Cb 0.56 0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 30.24 2h4c h ARG 107 CO -0.83 -0.48 0.82 0.93 -1.51 0.00 0.00 179.97 178.90 2h4c h GLU 108 N -0.74 0.00 0.00 0.20 5.08 0.12 -1.22 114.58 118.01 2h4c h GLU 108 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2h4c h GLU 108 Cb 0.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 2h4c h GLU 108 CO -0.29 0.00 -0.01 0.09 -1.00 0.00 0.00 179.01 177.81 2h4c n ASN 109 N -3.84 1.85 -0.02 1.42 3.02 0.60 -4.71 115.26 113.58 2h4c n ASN 109 Ca 0.20 -2.05 0.00 0.00 -0.03 0.00 0.00 54.58 52.70 2h4c n ASN 109 Cb 1.13 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 40.25 2h4c n ASN 109 CO 0.00 0.00 0.00 0.80 -2.62 0.00 0.00 177.26 175.44 2h4c n MET 110 N -0.57 0.03 -0.00 3.52 1.56 0.26 0.13 117.12 122.05 2h4c n MET 110 Ca 0.02 0.00 0.01 0.00 -0.27 0.00 0.00 57.70 57.46 2h4c n MET 110 Cb 0.32 -1.00 -0.01 0.00 2.15 0.00 0.00 33.22 34.68 2h4c n MET 110 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 2h4c n ASN 111 N -0.45 1.15 -1.68 6.12 5.03 -1.26 -4.44 115.26 119.73 2h4c n ASN 111 Ca 0.00 -0.42 0.09 0.00 0.87 0.00 0.00 54.58 55.12 2h4c n ASN 111 Cb 0.00 1.03 0.37 0.00 -1.02 0.00 0.00 39.78 40.16 2h4c n ASN 111 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 2h4c n THR 112 N -1.18 2.08 -2.10 3.41 -2.24 0.12 -4.95 114.28 109.41 2h4c n THR 112 Ca 0.00 -1.26 -0.42 0.00 -2.27 0.00 0.00 64.05 60.10 2h4c n THR 112 Cb 0.04 0.03 -0.03 0.00 -2.10 0.00 0.00 70.33 68.27 2h4c n THR 112 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2h4c s TYR 113 N -2.08 2.81 -0.36 4.78 6.14 -1.21 -4.72 117.35 122.71 2h4c s TYR 113 Ca 0.53 0.68 -0.06 0.00 0.64 0.00 0.00 57.07 58.86 2h4c s TYR 113 Cb 0.35 -3.78 0.06 0.00 0.42 0.00 0.00 41.96 39.02 2h4c s TYR 113 CO 0.23 -2.94 0.13 0.34 0.64 0.00 0.00 175.55 173.95 2h4c s ASP 114 N 1.84 5.30 0.00 4.32 -1.08 -1.26 -4.96 116.67 120.83 2h4c s ASP 114 Ca 0.68 -1.36 0.00 0.00 -0.52 0.00 0.00 52.55 51.34 2h4c s ASP 114 Cb -0.36 -1.86 0.00 0.00 -1.46 0.00 0.00 42.92 39.24 2h4c s ASP 114 CO 0.29 -0.39 0.10 1.17 0.52 0.00 0.00 175.17 176.87 2h4c n LYS 115 N 4.77 0.16 -0.14 4.34 4.81 -1.26 -2.02 118.16 128.82 2h4c n LYS 115 Ca -0.11 0.00 0.03 0.00 -0.87 0.00 0.00 58.31 57.37 2h4c n LYS 115 Cb 0.44 -1.17 0.05 0.00 0.02 0.00 0.00 35.03 34.36 2h4c n LYS 115 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2h4c n LYS 116 N 0.55 1.17 -0.07 1.64 5.02 -1.26 -4.73 118.16 120.48 2h4c n LYS 116 Ca 0.00 -1.57 0.06 0.00 -2.02 0.00 0.00 58.31 54.78 2h4c n LYS 116 Cb 0.05 -0.96 0.09 0.00 -0.02 0.00 0.00 35.03 34.19 2h4c n LYS 116 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2h4c n TYR 117 N -0.61 0.07 -3.09 2.13 4.01 -0.85 -5.02 117.16 113.80 2h4c n TYR 117 Ca 0.05 -0.79 -0.36 0.00 -0.16 0.00 0.00 57.90 56.64 2h4c n TYR 117 Cb 0.53 -0.12 -0.06 0.00 -0.31 0.00 0.00 39.34 39.39 2h4c n TYR 117 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 2h4c s MET 118 N -2.11 4.26 -0.99 -0.72 -1.94 -1.26 0.66 119.30 117.21 2h4c s MET 118 Ca 0.20 0.88 -0.11 0.00 -1.71 0.00 0.00 55.69 54.96 2h4c s MET 118 Cb 0.17 -2.88 -0.02 0.00 2.01 0.00 0.00 34.83 34.12 2h4c s MET 118 CO 0.03 0.39 0.77 1.28 -0.01 0.00 0.00 175.02 177.48 2h4c n LEU 119 N 0.72 -4.08 -4.85 -0.03 4.77 -0.92 -4.97 117.00 107.65 2h4c n LEU 119 Ca -0.02 -0.74 -0.32 0.00 -0.03 0.00 0.00 56.01 54.89 2h4c n LEU 119 Cb 0.51 -2.63 -0.06 0.00 -2.33 0.00 0.00 43.42 38.91 2h4c n LEU 119 CO 0.43 0.03 0.46 -0.31 -1.33 0.00 0.00 177.39 176.67 2h4c s TYR 120 N -3.28 3.39 0.02 -1.77 4.12 -1.26 -5.09 117.35 113.48 2h4c s TYR 120 Ca 0.30 1.24 0.02 0.00 0.02 0.00 0.00 57.07 58.65 2h4c s TYR 120 Cb -0.09 -2.57 -0.04 0.00 -1.52 0.00 0.00 41.96 37.75 2h4c s TYR 120 CO 0.82 0.01 0.03 -1.54 0.02 0.00 0.00 175.55 174.89 2h4c s SER 121 N -2.46 5.28 0.45 2.29 1.04 -1.26 -4.96 113.70 114.08 2h4c s SER 121 Ca 0.55 -0.00 0.30 0.00 0.48 0.00 0.00 55.95 57.28 2h4c s SER 121 Cb -0.10 -1.40 1.03 0.00 0.10 0.00 0.00 66.02 65.65 2h4c s SER 121 CO 0.20 0.25 1.11 -0.38 0.98 0.00 0.00 173.24 175.40 2h4c n ILE 122 N 1.10 0.00 0.34 -1.02 -0.00 -1.26 -0.23 119.36 118.30 2h4c n ILE 122 Ca -0.13 1.07 -0.14 0.00 -0.00 0.00 0.00 62.75 63.55 2h4c n ILE 122 Cb 0.52 -1.84 -0.07 0.00 -0.00 0.00 0.00 39.64 38.26 2h4c n ILE 122 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.55 176.70 2h4c h PHE 124 N 0.00 -0.84 0.00 1.39 3.57 -1.98 -3.16 116.94 115.92 2h4c h PHE 124 Ca 0.56 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 62.04 2h4c h PHE 124 Cb 2.61 0.28 0.00 0.00 2.79 0.00 0.00 35.95 41.63 2h4c h PHE 124 CO 0.00 -0.52 0.00 -0.25 -2.23 0.00 0.00 178.31 175.31 2h4c n ASP 125 N -5.36 0.00 -3.26 0.41 9.92 0.68 -3.85 116.55 115.09 2h4c n ASP 125 Ca -0.11 -0.88 -0.05 0.00 -0.53 0.00 0.00 54.79 53.22 2h4c n ASP 125 Cb 0.36 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 40.80 2h4c n ASP 125 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2h4c n LYS 127 N 4.64 0.00 0.00 0.00 2.85 -1.22 -4.60 118.16 119.83 2h4c n LYS 127 Ca 0.09 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.35 2h4c n LYS 127 Cb 0.52 -0.15 0.00 0.00 -0.65 0.00 0.00 35.03 34.75 2h4c n LYS 127 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2h4c n GLU 128 N -0.66 0.00 -3.85 -1.58 1.02 -1.26 -4.41 120.64 109.91 2h4c n GLU 128 Ca 0.00 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.78 2h4c n GLU 128 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.29 2h4c n GLU 128 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2h4c s GLU 129 N 0.00 3.09 -0.31 3.49 0.41 -1.26 -4.92 118.70 119.20 2h4c s GLU 129 Ca 0.00 -0.84 -0.28 0.00 -0.41 0.00 0.00 54.97 53.45 2h4c s GLU 129 Cb 0.00 -3.18 -0.06 0.00 -1.78 0.00 0.00 34.13 29.11 2h4c s GLU 129 CO 0.00 -0.37 2.28 0.43 -0.49 0.00 0.00 175.26 177.11 2h4c n SER 130 N 4.79 2.93 -3.74 -0.19 7.64 -1.26 -4.35 113.62 119.44 2h4c n SER 130 Ca -0.16 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.39 2h4c n SER 130 Cb 0.48 -1.55 0.03 0.00 -1.01 0.00 0.00 64.21 62.17 2h4c n SER 130 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2h4c n ASP 131 N 12.86 -5.30 -4.95 6.43 9.92 -0.21 -4.85 116.55 130.46 2h4c n ASP 131 Ca 0.33 0.23 -0.24 0.00 -0.53 0.00 0.00 54.79 54.57 2h4c n ASP 131 Cb 0.46 -0.72 -0.02 0.00 -0.64 0.00 0.00 41.12 40.21 2h4c n ASP 131 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 2h4c s GLN 132 N -1.72 3.48 0.00 -1.24 -0.21 -1.26 -4.97 119.66 113.73 2h4c s GLN 132 Ca 0.39 -0.51 0.21 0.00 0.02 0.00 0.00 55.36 55.47 2h4c s GLN 132 Cb -0.21 -2.83 0.16 0.00 1.00 0.00 0.00 33.01 31.14 2h4c s GLN 132 CO 0.75 0.36 1.16 0.00 -2.12 0.00 0.00 175.29 175.43