#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 177l s ASN 2 N 0.00 -0.12 0.28 6.12 2.20 -1.26 -5.01 114.94 117.15 177l s ASN 2 Ca 0.00 -0.77 -0.00 0.00 -0.94 0.00 0.00 52.86 51.15 177l s ASN 2 Cb 0.00 0.70 0.65 0.00 -2.00 0.00 0.00 41.25 40.60 177l s ASN 2 CO 0.00 -1.35 1.62 -0.29 -2.94 0.00 0.00 177.10 174.14 177l h ILE 3 N 2.00 0.24 0.13 0.54 6.09 -1.96 0.96 117.51 125.52 177l h ILE 3 Ca -0.25 -0.04 -0.01 0.00 -1.37 0.00 0.00 64.86 63.19 177l h ILE 3 Cb 1.24 0.11 0.00 0.00 0.47 0.00 0.00 36.82 38.64 177l h ILE 3 CO 0.31 0.02 -0.06 -0.26 -3.07 0.00 0.00 178.15 175.09 177l h PHE 4 N 0.12 -0.17 -0.12 2.19 0.04 -1.99 -0.21 116.94 116.81 177l h PHE 4 Ca 0.53 -0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.28 177l h PHE 4 Cb 1.05 0.05 -0.01 0.00 2.20 0.00 0.00 35.95 39.24 177l h PHE 4 CO -0.37 -0.05 0.00 0.93 -0.60 0.00 0.00 178.31 178.22 177l h GLU 5 N -0.24 0.17 0.02 1.51 5.08 -1.57 -2.52 114.58 117.03 177l h GLU 5 Ca -0.02 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 177l h GLU 5 Cb 0.19 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.41 177l h GLU 5 CO 0.03 0.19 -0.01 1.98 -1.00 0.00 0.00 179.01 180.20 177l h MET 6 N 0.17 -0.02 -1.01 2.33 4.05 -0.14 -2.95 114.93 117.35 177l h MET 6 Ca 0.04 0.00 0.25 0.00 -0.28 0.00 0.00 59.70 59.71 177l h MET 6 Cb 0.12 0.00 -0.12 0.00 -0.80 0.00 0.00 31.60 30.81 177l h MET 6 CO 0.00 -0.01 0.61 -0.07 0.23 0.00 0.00 176.91 177.67 177l h LEU 7 N -0.03 0.64 -1.19 3.39 3.38 -1.10 0.30 115.31 120.70 177l h LEU 7 Ca -0.00 0.13 0.08 0.00 0.09 0.00 0.00 57.88 58.18 177l h LEU 7 Cb 0.02 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.73 177l h LEU 7 CO 0.00 0.11 0.57 -0.09 0.09 0.00 0.00 178.44 179.13 177l h ARG 8 N 0.56 0.90 -0.05 1.13 9.65 -1.49 0.45 114.38 125.53 177l h ARG 8 Ca 0.64 -0.05 -0.18 0.00 -1.10 0.00 0.00 59.98 59.28 177l h ARG 8 Cb 1.27 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 29.64 177l h ARG 8 CO -0.44 0.60 -0.75 0.82 2.80 0.00 0.00 179.97 183.00 177l h ILE 9 N 0.93 1.41 0.00 1.20 2.04 -0.26 -2.38 117.51 120.45 177l h ILE 9 Ca 0.40 -2.24 -0.17 0.00 1.00 0.00 0.00 64.86 63.85 177l h ILE 9 Cb 0.32 2.19 -0.03 0.00 -0.74 0.00 0.00 36.82 38.57 177l h ILE 9 CO -0.16 0.66 -0.87 0.44 0.00 0.00 0.00 178.15 178.22 177l h ASP 10 N 0.20 0.00 0.04 1.72 3.32 -0.03 -3.40 116.42 118.27 177l h ASP 10 Ca -0.03 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.64 177l h ASP 10 Cb 1.32 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.82 177l h ASP 10 CO 0.12 0.80 -2.30 -0.62 -1.72 0.00 0.00 179.24 175.51 177l n GLU 11 N -3.27 0.68 -0.42 3.56 -0.58 0.14 -5.01 120.64 115.74 177l n GLU 11 Ca -0.01 0.20 0.05 0.00 -0.42 0.00 0.00 57.16 56.99 177l n GLU 11 Cb 0.87 -1.58 -0.03 0.00 -0.57 0.00 0.00 31.44 30.13 177l n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 177l n GLY 12 N 2.10 -2.72 3.93 0.62 0.00 -0.90 -4.37 105.19 103.85 177l n GLY 12 Ca -0.42 -1.34 -0.25 0.00 0.00 0.00 0.00 46.02 44.01 177l n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 177l s LEU 13 N -5.08 3.74 -0.30 0.99 1.98 -1.26 -3.89 118.68 114.86 177l s LEU 13 Ca 0.00 0.58 -0.18 0.00 -2.89 0.00 0.00 54.13 51.64 177l s LEU 13 Cb 0.00 -3.47 0.19 0.00 0.66 0.00 0.00 46.19 43.57 177l s LEU 13 CO 0.00 -0.55 1.22 0.00 -1.89 0.00 0.00 176.35 175.13 177l s ARG 14 N -4.56 0.10 0.00 1.98 1.70 -1.02 -4.89 118.95 112.25 177l s ARG 14 Ca 0.45 0.21 0.17 0.00 -0.47 0.00 0.00 55.73 56.09 177l s ARG 14 Cb -0.10 0.09 0.25 0.00 -0.57 0.00 0.00 34.95 34.62 177l s ARG 14 CO 0.40 -0.03 1.15 1.28 -1.08 0.00 0.00 175.30 177.02 177l n LEU 15 N 4.09 2.74 -4.07 -1.89 4.77 -1.26 0.88 117.00 122.27 177l n LEU 15 Ca -0.11 -1.35 -0.19 0.00 -0.03 0.00 0.00 56.01 54.33 177l n LEU 15 Cb 0.56 -0.12 -0.14 0.00 -2.33 0.00 0.00 43.42 41.38 177l n LEU 15 CO -0.01 0.57 -0.44 -0.75 -1.33 0.00 0.00 177.39 175.43 177l s LYS 16 N -1.26 0.83 0.59 3.23 2.20 -1.26 -1.73 119.74 122.34 177l s LYS 16 Ca 0.25 -0.51 -0.18 0.00 -0.36 0.00 0.00 55.97 55.17 177l s LYS 16 Cb 0.15 -0.79 -0.07 0.00 -1.51 0.00 0.00 37.83 35.61 177l s LYS 16 CO 0.22 0.21 0.64 -0.89 -0.36 0.00 0.00 175.35 175.17 177l n ILE 17 N 2.43 2.65 -3.70 5.43 5.41 -1.26 -4.76 119.36 125.56 177l n ILE 17 Ca -0.16 -0.49 -0.13 0.00 1.00 0.00 0.00 62.75 62.97 177l n ILE 17 Cb 0.56 -0.81 -0.07 0.00 -0.71 0.00 0.00 39.64 38.61 177l n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 177l s TYR 18 N -1.68 -0.23 -0.23 1.39 1.13 0.16 -4.98 117.35 112.90 177l s TYR 18 Ca 0.71 0.24 -0.13 0.00 -1.41 0.00 0.00 57.07 56.48 177l s TYR 18 Cb -0.43 0.17 -0.05 0.00 -1.10 0.00 0.00 41.96 40.56 177l s TYR 18 CO 0.52 -0.51 0.26 0.15 -2.51 0.00 0.00 175.55 173.47 177l s LYS 19 N -2.10 4.11 0.00 -3.49 1.02 -1.25 0.22 119.74 118.25 177l s LYS 19 Ca -0.08 -0.07 0.00 0.00 0.02 0.00 0.00 55.97 55.84 177l s LYS 19 Cb -0.02 -3.55 0.00 0.00 -0.52 0.00 0.00 37.83 33.74 177l s LYS 19 CO 0.00 -0.00 0.00 -0.40 -0.92 0.00 0.00 175.35 174.03 177l n ASP 20 N 4.43 0.00 0.00 2.83 5.68 -0.82 -4.69 116.55 123.97 177l n ASP 20 Ca -0.12 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.17 177l n ASP 20 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 177l n ASP 20 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 177l n THR 21 N 0.00 0.00 -0.11 2.12 -1.04 -1.26 -2.59 114.28 111.39 177l n THR 21 Ca 0.00 1.03 -0.09 0.00 -2.04 0.00 0.00 64.05 62.95 177l n THR 21 Cb 0.00 -1.78 0.05 0.00 -1.82 0.00 0.00 70.33 66.78 177l n THR 21 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 177l n GLU 22 N -0.87 1.47 -4.03 -2.82 0.28 -1.26 -4.91 120.64 108.49 177l n GLU 22 Ca 0.00 -1.04 -0.43 0.00 -0.16 0.00 0.00 57.16 55.53 177l n GLU 22 Cb 0.00 -1.41 0.01 0.00 1.43 0.00 0.00 31.44 31.48 177l n GLU 22 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 177l n GLY 23 N 0.21 -0.79 3.93 -1.84 0.00 -1.07 -5.02 105.19 100.61 177l n GLY 23 Ca 0.20 0.34 -0.29 0.00 0.00 0.00 0.00 46.02 46.27 177l n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 177l s TYR 24 N -3.60 3.50 -0.34 1.61 2.02 -1.26 -4.68 117.35 114.59 177l s TYR 24 Ca 0.44 0.19 -0.29 0.00 -0.37 0.00 0.00 57.07 57.05 177l s TYR 24 Cb -0.23 -1.72 -0.01 0.00 -0.40 0.00 0.00 41.96 39.60 177l s TYR 24 CO 0.96 0.56 1.67 0.71 -1.57 0.00 0.00 175.55 177.87 177l s TYR 25 N -1.60 2.01 0.35 2.71 1.51 -0.87 -1.95 117.35 119.51 177l s TYR 25 Ca 0.35 0.63 0.09 0.00 -1.01 0.00 0.00 57.07 57.12 177l s TYR 25 Cb -0.12 -4.17 -0.06 0.00 -0.11 0.00 0.00 41.96 37.50 177l s TYR 25 CO 0.28 -2.67 -0.01 0.99 -1.11 0.00 0.00 175.55 173.04 177l s THR 26 N 6.29 2.47 0.21 -0.71 2.01 0.60 0.26 115.64 126.77 177l s THR 26 Ca 0.74 -2.02 -0.23 0.00 0.31 0.00 0.00 61.69 60.49 177l s THR 26 Cb -0.20 -2.78 0.04 0.00 0.01 0.00 0.00 72.50 69.57 177l s THR 26 CO 0.33 -0.18 0.77 -0.51 -0.69 0.00 0.00 174.62 174.35 177l s ILE 27 N -2.56 0.00 0.00 1.82 2.07 0.44 -0.67 121.20 122.31 177l s ILE 27 Ca 0.35 -0.70 0.00 0.00 -1.41 0.00 0.00 60.65 58.89 177l s ILE 27 Cb 0.01 -1.78 0.00 0.00 0.13 0.00 0.00 42.46 40.82 177l s ILE 27 CO 0.19 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 173.83 177l n GLY 28 N -0.44 3.65 3.26 1.50 0.00 0.26 -0.07 105.19 113.35 177l n GLY 28 Ca -0.07 -0.02 -0.44 0.00 0.00 0.00 0.00 46.02 45.49 177l n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 177l n ILE 29 N 0.00 4.71 -3.73 -0.61 5.41 -1.25 -2.44 119.36 121.45 177l n ILE 29 Ca 0.00 -5.42 -0.28 0.00 1.00 0.00 0.00 62.75 58.05 177l n ILE 29 Cb 0.00 -2.46 0.02 0.00 -0.71 0.00 0.00 39.64 36.49 177l n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 177l n GLY 30 N 2.51 -0.50 3.57 7.39 0.00 -1.18 -4.90 105.19 112.09 177l n GLY 30 Ca 0.26 0.16 -0.42 0.00 0.00 0.00 0.00 46.02 46.03 177l n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 177l s HIS 31 N -3.20 3.15 -0.07 1.61 5.04 0.90 -4.90 115.29 117.81 177l s HIS 31 Ca 0.58 0.38 -0.30 0.00 -1.54 0.00 0.00 55.06 54.18 177l s HIS 31 Cb -0.29 -3.16 -0.02 0.00 0.04 0.00 0.00 32.58 29.14 177l s HIS 31 CO 0.72 -0.63 1.09 -1.17 -2.34 0.00 0.00 174.74 172.41 177l s LEU 32 N 2.75 4.27 -0.15 8.88 0.20 -1.26 -0.42 118.68 132.95 177l s LEU 32 Ca 0.25 1.67 -0.11 0.00 0.69 0.00 0.00 54.13 56.64 177l s LEU 32 Cb -0.14 -3.56 -0.06 0.00 -0.43 0.00 0.00 46.19 42.00 177l s LEU 32 CO 0.15 -0.50 -0.04 -0.07 -0.29 0.00 0.00 176.35 175.60 177l h LEU 33 N 8.00 0.00 -7.48 -0.68 3.38 0.32 -3.48 115.31 115.37 177l h LEU 33 Ca -0.33 -0.13 -0.13 0.00 0.09 0.00 0.00 57.88 57.39 177l h LEU 33 Cb 1.16 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.69 177l h LEU 33 CO 0.86 0.85 -0.30 0.28 0.09 0.00 0.00 178.44 180.22 177l s THR 34 N -2.15 0.04 0.06 0.22 -1.32 -0.92 -4.85 115.64 106.73 177l s THR 34 Ca -0.15 -0.33 -0.17 0.00 -1.21 0.00 0.00 61.69 59.83 177l s THR 34 Cb 0.02 -0.56 -0.16 0.00 -1.51 0.00 0.00 72.50 70.29 177l s THR 34 CO 0.26 -0.18 1.27 0.11 -2.21 0.00 0.00 174.62 173.88 177l h LYS 35 N 4.45 0.56 0.00 7.08 1.57 -1.95 -2.31 116.57 125.96 177l h LYS 35 Ca -0.29 -0.41 -0.05 0.00 -1.87 0.00 0.00 60.65 58.04 177l h LYS 35 Cb 1.18 0.07 0.03 0.00 0.08 0.00 0.00 32.23 33.59 177l h LYS 35 CO 0.37 1.03 -0.02 0.45 -0.57 0.00 0.00 179.45 180.70 177l n SER 36 N -4.24 -1.49 0.00 0.86 2.88 -1.26 -4.74 113.62 105.62 177l n SER 36 Ca -0.07 -0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 177l n SER 36 Cb 0.57 -0.28 0.00 0.00 -0.75 0.00 0.00 64.21 63.74 177l n SER 36 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 177l n PRO 37 N -0.15 1.44 -2.62 -1.46 -0.02 -1.26 -4.52 135.00 126.40 177l n PRO 37 Ca 0.02 -1.08 -0.42 0.00 -2.02 0.00 0.00 63.50 60.00 177l n PRO 37 Cb 0.08 -0.97 -0.04 0.00 -0.02 0.00 0.00 33.50 32.56 177l n PRO 37 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 177l s SER 38 N -0.59 7.32 0.00 2.55 1.04 -1.26 -4.85 113.70 117.91 177l s SER 38 Ca 0.00 1.84 0.21 0.00 0.48 0.00 0.00 55.95 58.48 177l s SER 38 Cb 0.00 -2.58 1.03 0.00 0.10 0.00 0.00 66.02 64.57 177l s SER 38 CO 0.00 -0.25 1.68 -0.11 0.98 0.00 0.00 173.24 175.54 177l n LEU 39 N 3.37 0.00 0.00 2.42 7.94 -1.26 -3.57 117.00 125.90 177l n LEU 39 Ca 0.05 0.33 0.00 0.00 -1.11 0.00 0.00 56.01 55.28 177l n LEU 39 Cb 0.49 -0.33 0.00 0.00 0.53 0.00 0.00 43.42 44.11 177l n LEU 39 CO 0.53 -0.10 0.35 0.59 -1.11 0.00 0.00 177.39 177.65 177l n ASN 40 N -1.33 0.00 -0.15 1.96 3.02 -1.26 -2.24 115.26 115.26 177l n ASN 40 Ca 0.09 0.73 -0.08 0.00 -0.03 0.00 0.00 54.58 55.29 177l n ASN 40 Cb 0.18 -0.26 0.01 0.00 -0.61 0.00 0.00 39.78 39.10 177l n ASN 40 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 177l h ALA 41 N -2.00 0.57 -0.75 5.41 0.00 -1.97 0.30 119.26 120.81 177l h ALA 41 Ca 0.00 -0.07 0.15 0.00 0.00 0.00 0.00 54.91 54.99 177l h ALA 41 Cb 0.00 -0.18 -0.14 0.00 0.00 0.00 0.00 17.79 17.47 177l h ALA 41 CO 0.00 0.07 -0.21 0.00 0.00 0.00 0.00 179.25 179.11 177l h ALA 42 N 1.11 0.43 -0.77 0.00 0.00 -1.70 5.51 119.26 123.84 177l h ALA 42 Ca 0.16 0.28 -0.05 0.00 0.00 0.00 0.00 54.91 55.30 177l h ALA 42 Cb 0.02 0.62 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 177l h ALA 42 CO -0.03 -0.45 0.29 -0.22 0.00 0.00 0.00 179.25 178.85 177l h LYS 43 N -0.02 1.17 0.49 0.00 3.64 -0.83 2.02 116.57 123.04 177l h LYS 43 Ca 0.35 -0.22 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 177l h LYS 43 Cb 0.56 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 177l h LYS 43 CO -0.78 0.96 -0.48 0.77 -2.27 0.00 0.00 179.45 177.65 177l h SER 44 N 1.13 -1.30 -0.19 4.20 0.02 0.92 0.14 113.55 118.47 177l h SER 44 Ca 0.26 0.10 0.03 0.00 -0.84 0.00 0.00 61.79 61.34 177l h SER 44 Cb 0.24 0.43 -0.07 0.00 0.14 0.00 0.00 62.40 63.14 177l h SER 44 CO -0.02 -0.63 -0.55 -0.33 -1.14 0.00 0.00 176.83 174.16 177l h GLU 45 N -0.96 -0.53 -0.83 3.45 4.39 0.98 -0.00 114.58 121.08 177l h GLU 45 Ca -0.06 0.04 0.19 0.00 0.34 0.00 0.00 59.36 59.86 177l h GLU 45 Cb 0.83 0.12 -0.15 0.00 -0.10 0.00 0.00 28.75 29.45 177l h GLU 45 CO -0.05 -0.35 -0.08 1.25 -1.16 0.00 0.00 179.01 178.62 177l h LEU 46 N -0.55 -0.54 -0.73 1.33 5.85 0.35 -1.65 115.31 119.37 177l h LEU 46 Ca 0.04 0.23 -0.11 0.00 0.84 0.00 0.00 57.88 58.88 177l h LEU 46 Cb 0.66 0.44 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 177l h LEU 46 CO -0.47 -0.25 -0.25 0.44 -0.34 0.00 0.00 178.44 177.57 177l h ASP 47 N 0.04 0.71 -0.16 1.25 3.32 0.12 -1.78 116.42 119.92 177l h ASP 47 Ca 0.45 -0.26 -0.05 0.00 0.02 0.00 0.00 57.03 57.19 177l h ASP 47 Cb 0.78 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 177l h ASP 47 CO -0.79 0.93 -0.04 0.11 -1.72 0.00 0.00 179.24 177.73 177l h LYS 48 N 0.61 0.45 -0.17 3.56 1.57 -0.56 0.42 116.57 122.45 177l h LYS 48 Ca 0.08 -0.10 -0.22 0.00 -1.87 0.00 0.00 60.65 58.54 177l h LYS 48 Cb 0.74 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 33.00 177l h LYS 48 CO 0.06 0.51 -0.76 0.00 -0.57 0.00 0.00 179.45 178.69 177l h ALA 49 N 1.53 0.32 0.00 3.86 0.00 -1.31 -3.23 119.26 120.43 177l h ALA 49 Ca 0.09 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.41 177l h ALA 49 Cb 0.35 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.12 177l h ALA 49 CO 0.01 0.68 -0.49 0.82 0.00 0.00 0.00 179.25 180.28 177l h ILE 50 N 0.56 0.00 -2.89 0.00 1.08 -0.84 -3.47 117.51 111.94 177l h ILE 50 Ca -0.05 -0.71 -0.15 0.00 -0.39 0.00 0.00 64.86 63.56 177l h ILE 50 Cb 1.39 1.42 0.05 0.00 -3.07 0.00 0.00 36.82 36.62 177l h ILE 50 CO 0.16 0.00 -0.26 0.61 -0.69 0.00 0.00 178.15 177.96 177l n GLY 51 N 1.25 0.37 3.60 5.37 0.00 0.14 -5.00 105.19 110.92 177l n GLY 51 Ca 0.03 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.74 177l n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 177l s ARG 52 N -5.47 0.09 -0.85 1.61 1.70 -0.77 -5.05 118.95 110.21 177l s ARG 52 Ca 0.22 -0.04 -0.25 0.00 -0.47 0.00 0.00 55.73 55.19 177l s ARG 52 Cb -0.10 0.04 0.04 0.00 -0.57 0.00 0.00 34.95 34.36 177l s ARG 52 CO 0.28 -0.04 1.33 1.21 -1.08 0.00 0.00 175.30 177.00 177l s ASN 53 N -2.51 6.30 0.28 -2.89 2.47 -1.26 -4.38 114.94 112.95 177l s ASN 53 Ca 0.13 -0.88 0.04 0.00 0.42 0.00 0.00 52.86 52.57 177l s ASN 53 Cb 0.03 -2.55 0.40 0.00 -1.45 0.00 0.00 41.25 37.68 177l s ASN 53 CO -0.04 -1.68 1.68 0.74 -3.72 0.00 0.00 177.10 174.08 177l h THR 54 N 6.31 1.30 -5.11 -5.21 2.02 -1.91 -3.46 112.91 106.84 177l h THR 54 Ca -0.09 -1.50 -0.31 0.00 0.77 0.00 0.00 66.41 65.29 177l h THR 54 Cb 1.04 1.62 -0.19 0.00 -1.74 0.00 0.00 68.15 68.87 177l h THR 54 CO 1.33 0.45 -0.44 -3.20 0.37 0.00 0.00 175.52 174.03 177l n ASN 55 N -4.04 -0.99 0.00 4.18 5.15 -1.26 -3.09 115.26 115.20 177l n ASN 55 Ca -0.01 -0.56 0.00 0.00 -0.60 0.00 0.00 54.58 53.40 177l n ASN 55 Cb 0.48 -0.88 0.00 0.00 -0.53 0.00 0.00 39.78 38.85 177l n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 177l n GLY 56 N -0.74 0.94 2.73 8.20 0.00 -1.26 -5.07 105.19 109.99 177l n GLY 56 Ca 0.06 -0.54 -0.19 0.00 0.00 0.00 0.00 46.02 45.35 177l n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 177l s VAL 57 N -2.00 -0.35 0.43 1.61 1.01 -1.18 -4.14 120.40 115.79 177l s VAL 57 Ca 0.00 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 61.41 177l s VAL 57 Cb 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.43 177l s VAL 57 CO 0.00 -0.52 0.62 0.27 0.00 0.00 0.00 175.10 175.47 177l s ILE 58 N 2.20 3.64 0.43 2.22 -4.36 -0.70 -4.89 121.20 119.74 177l s ILE 58 Ca 0.10 -0.73 0.05 0.00 -0.26 0.00 0.00 60.65 59.81 177l s ILE 58 Cb -0.14 -3.31 0.08 0.00 1.25 0.00 0.00 42.46 40.33 177l s ILE 58 CO -0.29 -0.18 0.59 0.35 0.24 0.00 0.00 174.94 175.65 177l n THR 59 N -1.98 0.00 0.00 8.37 -2.24 -1.26 -4.70 114.28 112.47 177l n THR 59 Ca 0.03 -1.28 0.00 0.00 -2.27 0.00 0.00 64.05 60.53 177l n THR 59 Cb 0.58 -0.76 0.00 0.00 -2.10 0.00 0.00 70.33 68.06 177l n THR 59 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 177l n LYS 60 N -1.98 0.00 -0.02 -0.78 5.02 -1.26 -1.87 118.16 117.28 177l n LYS 60 Ca 0.11 0.22 0.00 0.00 -2.02 0.00 0.00 58.31 56.63 177l n LYS 60 Cb 0.41 -1.12 0.01 0.00 -0.02 0.00 0.00 35.03 34.31 177l n LYS 60 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 177l n ASP 61 N -1.16 -0.02 -0.03 4.39 8.00 -1.26 0.33 116.55 126.80 177l n ASP 61 Ca 0.00 0.07 -0.12 0.00 0.71 0.00 0.00 54.79 55.45 177l n ASP 61 Cb 0.00 -0.02 -0.07 0.00 -0.02 0.00 0.00 41.12 41.00 177l n ASP 61 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 177l h GLU 62 N 0.00 0.19 -0.77 -1.24 5.08 -1.95 0.92 114.58 116.81 177l h GLU 62 Ca 0.02 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.33 177l h GLU 62 Cb 0.03 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 177l h GLU 62 CO -0.04 0.50 0.51 0.00 -1.00 0.00 0.00 179.01 178.97 177l h ALA 63 N 0.68 1.50 -0.14 3.43 0.00 0.63 0.40 119.26 125.76 177l h ALA 63 Ca 0.02 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 177l h ALA 63 Cb 0.44 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 177l h ALA 63 CO 0.01 0.44 -0.58 1.49 0.00 0.00 0.00 179.25 180.62 177l h GLU 64 N 0.99 0.44 0.26 0.00 4.81 -0.87 -1.79 114.58 118.42 177l h GLU 64 Ca 0.29 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 177l h GLU 64 Cb -0.04 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 177l h GLU 64 CO -0.07 0.89 -0.24 -0.22 -0.73 0.00 0.00 179.01 178.64 177l h LYS 65 N 0.33 -0.51 -0.41 1.92 3.64 0.26 -0.15 116.57 121.66 177l h LYS 65 Ca 0.00 0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.48 177l h LYS 65 Cb 1.11 0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 32.98 177l h LYS 65 CO 0.10 -0.34 0.06 -0.07 -2.27 0.00 0.00 179.45 176.93 177l h LEU 66 N -0.52 -0.04 -0.34 5.20 3.38 -0.87 -2.44 115.31 119.67 177l h LEU 66 Ca -0.01 0.08 0.05 0.00 0.09 0.00 0.00 57.88 58.09 177l h LEU 66 Cb 0.48 0.12 -0.08 0.00 0.09 0.00 0.00 40.66 41.27 177l h LEU 66 CO -0.04 0.01 -0.51 0.15 0.09 0.00 0.00 178.44 178.14 177l h PHE 67 N 0.18 -1.54 -0.56 1.13 3.57 -0.89 0.20 116.94 119.03 177l h PHE 67 Ca 0.20 0.07 0.10 0.00 3.53 0.00 0.00 57.97 61.87 177l h PHE 67 Cb 0.26 0.72 -0.03 0.00 2.79 0.00 0.00 35.95 39.68 177l h PHE 67 CO -0.22 -0.49 0.38 -0.91 -2.23 0.00 0.00 178.31 174.84 177l h ASN 68 N -0.42 0.31 -0.12 0.41 2.35 -0.73 -0.58 115.58 116.80 177l h ASN 68 Ca 0.08 0.01 -0.19 0.00 -0.55 0.00 0.00 56.30 55.65 177l h ASN 68 Cb 0.62 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.93 177l h ASN 68 CO -0.55 0.19 -0.63 1.56 -1.65 0.00 0.00 177.43 176.35 177l h GLN 69 N 0.35 0.74 0.78 0.81 4.20 -0.53 -2.81 115.11 118.64 177l h GLN 69 Ca 0.26 -0.51 -0.04 0.00 0.06 0.00 0.00 58.65 58.42 177l h GLN 69 Cb 0.56 0.08 0.01 0.00 0.30 0.00 0.00 27.48 28.42 177l h GLN 69 CO -0.06 1.14 -0.37 -0.44 -0.67 0.00 0.00 178.83 178.42 177l h ASP 70 N 0.54 -0.88 -0.73 1.46 5.19 0.74 0.89 116.42 123.63 177l h ASP 70 Ca -0.01 0.03 0.16 0.00 -0.62 0.00 0.00 57.03 56.59 177l h ASP 70 Cb 1.23 0.23 -0.12 0.00 0.18 0.00 0.00 39.33 40.85 177l h ASP 70 CO 0.13 -0.62 0.12 0.58 -3.12 0.00 0.00 179.24 176.32 177l h VAL 71 N -1.06 0.46 -0.77 -1.35 2.07 -1.27 0.54 116.25 114.87 177l h VAL 71 Ca -0.11 -0.07 -0.05 0.00 0.82 0.00 0.00 66.70 67.29 177l h VAL 71 Cb 0.80 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 177l h VAL 71 CO 0.18 0.04 0.28 -0.78 0.02 0.00 0.00 177.57 177.30 177l h ASP 72 N 0.20 1.08 0.22 0.57 1.82 -1.21 -2.20 116.42 116.90 177l h ASP 72 Ca 0.41 -0.19 -0.03 0.00 -0.39 0.00 0.00 57.03 56.83 177l h ASP 72 Cb 0.71 -0.28 -0.00 0.00 0.68 0.00 0.00 39.33 40.44 177l h ASP 72 CO -0.56 0.98 -0.14 0.00 -1.61 0.00 0.00 179.24 177.91 177l h ALA 73 N 1.15 1.54 0.04 -0.78 0.00 0.60 -2.93 119.26 118.87 177l h ALA 73 Ca 0.25 -0.13 -0.22 0.00 0.00 0.00 0.00 54.91 54.81 177l h ALA 73 Cb 0.25 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 177l h ALA 73 CO -0.02 0.18 -1.02 0.00 0.00 0.00 0.00 179.25 178.39 177l h ALA 74 N 1.86 0.35 0.00 0.00 0.00 -0.51 -3.05 119.26 117.90 177l h ALA 74 Ca -0.00 -0.82 -0.07 0.00 0.00 0.00 0.00 54.91 54.03 177l h ALA 74 Cb 0.29 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 177l h ALA 74 CO 0.02 1.01 -0.31 0.28 0.00 0.00 0.00 179.25 180.25 177l h VAL 75 N 0.07 1.01 0.11 0.00 2.07 -1.30 -2.16 116.25 116.05 177l h VAL 75 Ca -0.06 -1.16 -0.24 0.00 0.82 0.00 0.00 66.70 66.05 177l h VAL 75 Cb 1.71 1.67 0.02 0.00 -1.52 0.00 0.00 31.29 33.17 177l h VAL 75 CO 0.15 0.31 -1.02 0.03 0.02 0.00 0.00 177.57 177.06 177l h ARG 76 N 0.00 0.50 -0.42 1.57 3.08 -1.58 -0.13 114.38 117.39 177l h ARG 76 Ca -0.00 -0.68 0.03 0.00 0.07 0.00 0.00 59.98 59.40 177l h ARG 76 Cb 0.64 0.23 -0.04 0.00 0.08 0.00 0.00 29.97 30.88 177l h ARG 76 CO 0.04 1.29 0.21 0.78 -1.07 0.00 0.00 179.97 181.23 177l h GLY 77 N 0.02 0.58 -0.01 0.04 0.00 -1.44 2.98 103.07 105.24 177l h GLY 77 Ca -0.16 -0.15 0.01 0.00 0.00 0.00 0.00 47.33 47.03 177l h GLY 77 CO 0.20 0.11 -0.20 -2.22 0.00 0.00 0.00 176.54 174.42 177l h ILE 78 N 0.43 0.00 -0.85 2.60 2.04 -1.36 0.11 117.51 120.49 177l h ILE 78 Ca 0.18 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.24 177l h ILE 78 Cb 0.08 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.04 177l h ILE 78 CO -0.13 0.00 0.31 -0.07 0.00 0.00 0.00 178.15 178.26 177l h LEU 79 N -0.24 0.19 -0.41 1.44 3.38 0.01 0.96 115.31 120.64 177l h LEU 79 Ca 0.01 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.13 177l h LEU 79 Cb 0.26 0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.18 177l h LEU 79 CO -0.14 -0.03 0.00 0.54 0.09 0.00 0.00 178.44 178.90 177l n ARG 80 N -5.10 0.92 -4.04 1.13 1.74 0.99 -4.69 116.66 107.60 177l n ARG 80 Ca 0.20 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.96 177l n ARG 80 Cb 0.60 -1.19 -0.15 0.00 -1.02 0.00 0.00 32.46 30.70 177l n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 177l s ASN 81 N -0.67 4.20 0.00 0.55 3.84 0.33 -4.96 114.94 118.23 177l s ASN 81 Ca 0.00 -1.29 0.00 0.00 0.21 0.00 0.00 52.86 51.78 177l s ASN 81 Cb 0.00 -1.45 0.00 0.00 -0.55 0.00 0.00 41.25 39.25 177l s ASN 81 CO 0.00 -0.19 0.72 0.00 -2.79 0.00 0.00 177.10 174.84 177l n ALA 82 N 4.50 0.46 0.00 1.71 0.00 -1.26 0.61 120.51 126.53 177l n ALA 82 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 177l n ALA 82 Cb 0.43 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.43 177l n ALA 82 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 177l n LYS 83 N -1.22 2.41 -0.11 0.00 5.02 -1.26 -4.74 118.16 118.26 177l n LYS 83 Ca 0.00 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.07 177l n LYS 83 Cb 0.27 -0.75 -0.10 0.00 -0.02 0.00 0.00 35.03 34.42 177l n LYS 83 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 177l n LEU 84 N -0.97 1.88 -0.37 -0.35 4.77 0.17 -4.31 117.00 117.82 177l n LEU 84 Ca 0.00 0.41 -0.02 0.00 -0.03 0.00 0.00 56.01 56.37 177l n LEU 84 Cb 0.00 -0.92 0.02 0.00 -2.33 0.00 0.00 43.42 40.19 177l n LEU 84 CO 0.00 0.28 0.55 1.17 -1.33 0.00 0.00 177.39 178.06 177l n LYS 85 N -4.40 -0.25 -0.31 3.23 4.81 0.20 -0.02 118.16 121.42 177l n LYS 85 Ca -0.36 1.47 0.10 0.00 -0.87 0.00 0.00 58.31 58.66 177l n LYS 85 Cb 0.70 -2.18 0.32 0.00 0.02 0.00 0.00 35.03 33.89 177l n LYS 85 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 177l h PRO 86 N 0.00 0.79 -0.10 1.64 0.11 -1.78 0.13 132.00 132.78 177l h PRO 86 Ca 0.31 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 66.23 177l h PRO 86 Cb 0.55 -0.18 0.01 0.00 0.11 0.00 0.00 31.00 31.49 177l h PRO 86 CO -0.95 0.52 -0.48 0.28 -0.21 0.00 0.00 178.00 177.16 177l h VAL 87 N 0.81 1.37 -0.18 3.15 2.07 -0.63 -3.11 116.25 119.73 177l h VAL 87 Ca 0.47 -1.81 0.05 0.00 0.82 0.00 0.00 66.70 66.24 177l h VAL 87 Cb 0.64 2.19 -0.06 0.00 -1.52 0.00 0.00 31.29 32.54 177l h VAL 87 CO -0.24 0.54 -0.27 0.22 0.02 0.00 0.00 177.57 177.85 177l h TYR 88 N 0.10 -0.72 -0.56 1.57 3.20 0.33 -2.05 116.97 118.84 177l h TYR 88 Ca -0.03 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 177l h TYR 88 Cb 1.13 0.34 -0.03 0.00 1.54 0.00 0.00 36.73 39.71 177l h TYR 88 CO 0.11 -0.35 0.28 -0.44 -1.64 0.00 0.00 178.16 176.13 177l h ASP 89 N -0.31 0.70 0.42 -2.11 3.32 -0.90 -1.93 116.42 115.61 177l h ASP 89 Ca 0.11 -0.06 -0.05 0.00 0.02 0.00 0.00 57.03 57.06 177l h ASP 89 Cb 0.49 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 177l h ASP 89 CO -0.35 0.59 -0.23 0.77 -1.72 0.00 0.00 179.24 178.30 177l h SER 90 N 0.78 0.00 -3.10 6.45 4.64 -1.31 -3.45 113.55 117.56 177l h SER 90 Ca 0.20 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 61.05 177l h SER 90 Cb 0.07 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.19 177l h SER 90 CO -0.03 0.23 -0.00 -0.76 -0.87 0.00 0.00 176.83 175.40 177l s LEU 91 N -7.66 3.56 0.85 5.97 1.43 -0.72 -5.06 118.68 117.05 177l s LEU 91 Ca -0.02 0.50 -0.07 0.00 -1.03 0.00 0.00 54.13 53.50 177l s LEU 91 Cb 0.13 -3.37 0.18 0.00 0.03 0.00 0.00 46.19 43.16 177l s LEU 91 CO 0.65 -0.75 1.16 1.51 0.23 0.00 0.00 176.35 179.15 177l s ASP 92 N -4.21 3.63 0.08 2.29 1.47 -1.26 -4.78 116.67 113.89 177l s ASP 92 Ca 0.49 -0.19 -0.28 0.00 1.18 0.00 0.00 52.55 53.74 177l s ASP 92 Cb -0.10 0.04 -0.12 0.00 -0.34 0.00 0.00 42.92 42.40 177l s ASP 92 CO 0.41 -2.36 1.45 0.00 0.68 0.00 0.00 175.17 175.34 177l h ALA 93 N -1.09 -0.96 0.41 2.11 0.00 -1.97 0.68 119.26 118.44 177l h ALA 93 Ca -0.39 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 177l h ALA 93 Cb 1.24 0.78 -0.02 0.00 0.00 0.00 0.00 17.79 19.79 177l h ALA 93 CO 0.36 -1.04 -0.35 0.28 0.00 0.00 0.00 179.25 178.50 177l h VAL 94 N -0.67 0.29 -0.80 0.00 2.07 -1.96 -2.25 116.25 112.93 177l h VAL 94 Ca -0.02 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.61 177l h VAL 94 Cb 0.64 0.29 -0.06 0.00 -1.52 0.00 0.00 31.29 30.65 177l h VAL 94 CO -0.19 0.00 0.52 0.03 0.02 0.00 0.00 177.57 177.95 177l h ARG 95 N -0.76 0.70 -0.62 1.57 3.08 -1.78 0.55 114.38 117.11 177l h ARG 95 Ca -0.04 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 177l h ARG 95 Cb 0.66 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.53 177l h ARG 95 CO -0.02 0.46 0.34 0.00 -1.07 0.00 0.00 179.97 179.67 177l h ARG 96 N 0.72 0.86 -0.53 0.04 3.08 0.77 -1.84 114.38 117.47 177l h ARG 96 Ca 0.37 -0.09 0.07 0.00 0.07 0.00 0.00 59.98 60.40 177l h ARG 96 Cb 0.49 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 177l h ARG 96 CO -0.15 0.63 0.36 0.00 -1.07 0.00 0.00 179.97 179.74 177l h ALA 97 N 1.51 1.90 -0.06 0.04 0.00 -0.31 -1.29 119.26 121.05 177l h ALA 97 Ca 0.22 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.88 177l h ALA 97 Cb 0.03 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.72 177l h ALA 97 CO -0.04 0.00 -0.91 0.00 0.00 0.00 0.00 179.25 178.30 177l h ALA 98 N 1.71 0.27 -0.46 0.00 0.00 -1.16 -2.07 119.26 117.55 177l h ALA 98 Ca 0.23 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.49 177l h ALA 98 Cb 0.33 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 177l h ALA 98 CO -0.06 0.71 0.29 1.25 0.00 0.00 0.00 179.25 181.44 177l h LEU 99 N 0.42 0.54 -0.98 0.00 5.85 -1.15 -0.67 115.31 119.31 177l h LEU 99 Ca -0.09 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 177l h LEU 99 Cb 1.55 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.40 177l h LEU 99 CO 0.18 0.41 0.41 0.40 -0.34 0.00 0.00 178.44 179.50 177l h ILE 100 N 0.62 1.24 -0.14 4.05 2.04 -1.21 -0.65 117.51 123.46 177l h ILE 100 Ca 0.17 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 177l h ILE 100 Cb -0.04 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.23 177l h ILE 100 CO -0.03 0.28 0.05 -1.13 0.00 0.00 0.00 178.15 177.32 177l h ASN 101 N 1.13 0.19 0.07 1.72 -0.73 -0.87 0.53 115.58 117.63 177l h ASN 101 Ca 0.28 -0.17 0.01 0.00 1.87 0.00 0.00 56.30 58.28 177l h ASN 101 Cb 0.08 -0.05 -0.03 0.00 0.27 0.00 0.00 38.32 38.58 177l h ASN 101 CO -0.04 0.31 -0.36 0.24 -0.37 0.00 0.00 177.43 177.22 177l h MET 102 N 0.06 -0.48 -0.85 6.67 2.86 -0.52 0.26 114.93 122.92 177l h MET 102 Ca 0.05 0.03 0.18 0.00 -2.06 0.00 0.00 59.70 57.90 177l h MET 102 Cb 0.18 0.11 -0.11 0.00 0.06 0.00 0.00 31.60 31.85 177l h MET 102 CO -0.00 -0.32 0.38 0.28 1.06 0.00 0.00 176.91 178.31 177l h VAL 103 N -0.50 0.60 -0.46 -2.22 2.07 -1.02 0.83 116.25 115.54 177l h VAL 103 Ca -0.00 -0.17 0.01 0.00 0.82 0.00 0.00 66.70 67.36 177l h VAL 103 Cb 0.51 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 177l h VAL 103 CO -0.20 0.09 0.31 0.15 0.02 0.00 0.00 177.57 177.93 177l h PHE 104 N 0.48 0.56 0.08 1.57 3.04 0.11 0.05 116.94 122.83 177l h PHE 104 Ca 0.50 0.01 -0.12 0.00 3.98 0.00 0.00 57.97 62.34 177l h PHE 104 Cb 0.83 -0.19 0.01 0.00 2.56 0.00 0.00 35.95 39.16 177l h PHE 104 CO -0.13 0.35 -0.52 0.37 -2.02 0.00 0.00 178.31 176.36 177l h GLN 105 N 0.60 0.20 0.00 1.11 4.15 0.40 -3.43 115.11 118.14 177l h GLN 105 Ca 0.17 -0.33 0.00 0.00 0.77 0.00 0.00 58.65 59.26 177l h GLN 105 Cb -0.03 0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.78 177l h GLN 105 CO -0.04 1.14 -0.37 0.00 -1.93 0.00 0.00 178.83 177.63 177l n MET 106 N -4.30 4.67 0.00 1.69 0.00 0.94 -5.09 117.12 115.02 177l n MET 106 Ca -0.12 -0.01 0.00 0.00 0.00 0.00 0.00 57.70 57.57 177l n MET 106 Cb 0.69 -0.77 0.00 0.00 0.00 0.00 0.00 33.22 33.14 177l n MET 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 177l n GLY 107 N 1.30 2.27 0.38 3.17 0.00 -0.01 -3.88 105.19 108.42 177l n GLY 107 Ca 0.01 -1.73 -0.03 0.00 0.00 0.00 0.00 46.02 44.26 177l n GLY 107 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 177l h GLU 108 N 0.00 -0.05 0.16 1.61 5.08 -1.95 0.23 114.58 119.66 177l h GLU 108 Ca 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 177l h GLU 108 Cb 0.00 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 177l h GLU 108 CO 0.00 -0.04 -0.53 1.15 -1.00 0.00 0.00 179.01 178.60 177l h THR 109 N -0.06 0.01 -0.78 1.13 2.02 -1.97 0.23 112.91 113.50 177l h THR 109 Ca 0.30 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.51 177l h THR 109 Cb 0.57 0.01 -0.05 0.00 -1.74 0.00 0.00 68.15 66.94 177l h THR 109 CO -0.89 0.00 0.50 1.23 0.37 0.00 0.00 175.52 176.72 177l h GLY 110 N -0.78 1.13 1.09 2.16 0.00 -1.04 -2.49 103.07 103.13 177l h GLY 110 Ca -0.01 -0.38 -0.11 0.00 0.00 0.00 0.00 47.33 46.83 177l h GLY 110 CO -0.26 0.32 -0.09 -2.08 0.00 0.00 0.00 176.54 174.43 177l h VAL 111 N 0.97 1.27 0.00 4.60 2.07 -0.42 -2.58 116.25 122.15 177l h VAL 111 Ca 0.31 -1.25 0.00 0.00 0.82 0.00 0.00 66.70 66.58 177l h VAL 111 Cb 0.01 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 177l h VAL 111 CO -0.11 0.44 0.00 0.00 0.02 0.00 0.00 177.57 177.92 177l n ALA 112 N -2.50 1.34 1.27 1.67 0.00 0.05 -1.31 120.51 121.04 177l n ALA 112 Ca 0.02 -0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.60 177l n ALA 112 Cb 0.39 -1.00 0.64 0.00 0.00 0.00 0.00 19.45 19.48 177l n ALA 112 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 177l n GLY 113 N -1.15 -1.25 2.21 0.00 0.00 -0.97 -4.06 105.19 99.97 177l n GLY 113 Ca 0.00 -0.18 -0.20 0.00 0.00 0.00 0.00 46.02 45.64 177l n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 177l n PHE 114 N -1.27 1.16 -0.40 1.61 3.72 -0.43 -4.73 117.46 117.12 177l n PHE 114 Ca 0.12 -1.80 -0.07 0.00 -0.05 0.00 0.00 57.45 55.65 177l n PHE 114 Cb 0.28 -1.29 -0.04 0.00 -0.94 0.00 0.00 39.48 37.49 177l n PHE 114 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 177l n THR 115 N 1.14 -0.61 0.06 4.37 -2.24 -1.26 0.93 114.28 116.68 177l n THR 115 Ca 0.41 2.35 -0.13 0.00 -2.27 0.00 0.00 64.05 64.41 177l n THR 115 Cb 0.63 -2.98 -0.09 0.00 -2.10 0.00 0.00 70.33 65.80 177l n THR 115 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 177l h ASN 116 N 0.00 -0.12 -0.82 3.42 4.21 -1.96 -1.61 115.58 118.70 177l h ASN 116 Ca 0.23 -0.25 0.10 0.00 1.21 0.00 0.00 56.30 57.60 177l h ASN 116 Cb 0.48 0.03 -0.06 0.00 -1.12 0.00 0.00 38.32 37.65 177l h ASN 116 CO -0.94 0.19 0.54 0.28 -1.29 0.00 0.00 177.43 176.20 177l h SER 117 N -0.44 0.68 0.20 5.81 0.02 -1.75 0.32 113.55 118.39 177l h SER 117 Ca -0.01 0.02 -0.12 0.00 -0.84 0.00 0.00 61.79 60.84 177l h SER 117 Cb 0.36 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 177l h SER 117 CO 0.02 0.39 -0.44 -0.07 -1.14 0.00 0.00 176.83 175.60 177l h LEU 118 N 0.75 0.32 -0.60 5.07 3.38 0.76 -1.72 115.31 123.26 177l h LEU 118 Ca 0.39 -0.14 -0.15 0.00 0.09 0.00 0.00 57.88 58.06 177l h LEU 118 Cb 0.49 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 177l h LEU 118 CO -0.16 0.72 -0.68 -0.09 0.09 0.00 0.00 178.44 178.32 177l h ARG 119 N 0.25 0.09 0.00 1.13 1.12 0.06 -2.60 114.38 114.42 177l h ARG 119 Ca 0.02 -0.08 -0.05 0.00 -1.11 0.00 0.00 59.98 58.77 177l h ARG 119 Cb 0.88 0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 30.85 177l h ARG 119 CO 0.07 0.74 -0.42 0.52 -3.11 0.00 0.00 179.97 177.77 177l h MET 120 N 0.06 0.00 0.15 0.20 0.00 0.12 -2.47 114.93 112.99 177l h MET 120 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 59.70 59.68 177l h MET 120 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.82 177l h MET 120 CO 0.10 0.18 -0.07 -0.07 0.00 0.00 0.00 176.91 177.05 177l h LEU 121 N 0.00 -0.17 -2.03 1.22 3.38 -1.18 0.65 115.31 117.17 177l h LEU 121 Ca -0.01 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 177l h LEU 121 Cb 1.17 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 177l h LEU 121 CO 0.02 0.16 -0.09 0.06 0.09 0.00 0.00 178.44 178.68 177l h GLN 122 N -0.52 0.00 0.00 1.13 3.07 -1.55 0.12 115.11 117.36 177l h GLN 122 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.72 177l h GLN 122 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.96 177l h GLN 122 CO 0.03 0.09 -0.40 1.96 0.09 0.00 0.00 178.83 180.60 177l h GLN 123 N 0.00 0.00 0.00 0.06 4.20 -1.20 -3.48 115.11 114.69 177l h GLN 123 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 177l h GLN 123 Cb 0.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.03 177l h GLN 123 CO 0.01 0.00 0.00 1.63 -0.67 0.00 0.00 178.83 179.80 177l n LYS 124 N -2.61 0.00 -1.70 1.46 5.02 0.17 -4.94 118.16 115.56 177l n LYS 124 Ca 0.03 0.44 -0.42 0.00 -2.02 0.00 0.00 58.31 56.34 177l n LYS 124 Cb 0.50 -3.61 -0.00 0.00 -0.02 0.00 0.00 35.03 31.89 177l n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 177l n ARG 125 N -2.91 2.85 -0.11 1.97 1.74 0.17 -4.69 116.66 115.68 177l n ARG 125 Ca 0.00 -2.57 -0.09 0.00 -0.77 0.00 0.00 57.85 54.43 177l n ARG 125 Cb 0.00 -3.26 -0.03 0.00 -1.02 0.00 0.00 32.46 28.15 177l n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 177l h TRP 126 N 6.00 -1.01 -0.27 -1.55 -0.00 -1.91 -1.42 115.95 115.78 177l h TRP 126 Ca 0.58 0.06 0.06 0.00 -0.00 0.00 0.00 58.89 59.59 177l h TRP 126 Cb 0.63 0.50 -0.06 0.00 -0.00 0.00 0.00 29.16 30.22 177l h TRP 126 CO 1.47 -0.41 -0.12 0.00 -0.00 0.00 0.00 178.44 179.39 177l h GLU 128 N -0.08 0.80 -0.55 0.00 5.08 -1.83 -2.82 114.58 115.19 177l h GLU 128 Ca 0.14 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 177l h GLU 128 Cb 0.29 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 177l h GLU 128 CO -0.33 0.59 0.23 0.00 -1.00 0.00 0.00 179.01 178.50 177l h ALA 129 N 1.54 0.71 0.40 3.43 0.00 -0.65 -0.85 119.26 123.84 177l h ALA 129 Ca 0.21 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 177l h ALA 129 Cb 0.03 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 177l h ALA 129 CO -0.03 0.32 -0.22 0.00 0.00 0.00 0.00 179.25 179.32 177l h ALA 130 N 1.07 -0.57 0.19 0.00 0.00 -1.06 0.22 119.26 119.11 177l h ALA 130 Ca 0.18 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.99 177l h ALA 130 Cb 0.19 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 177l h ALA 130 CO -0.02 -0.83 -0.36 0.28 0.00 0.00 0.00 179.25 178.32 177l h VAL 131 N -0.57 0.25 -0.31 0.00 2.07 -1.41 0.15 116.25 116.42 177l h VAL 131 Ca -0.05 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.54 177l h VAL 131 Cb 0.46 0.25 -0.08 0.00 -1.52 0.00 0.00 31.29 30.39 177l h VAL 131 CO 0.07 0.00 -0.33 0.78 0.02 0.00 0.00 177.57 178.11 177l h ASN 132 N -0.64 -1.08 -0.97 0.57 2.35 -0.98 -0.32 115.58 114.51 177l h ASN 132 Ca 0.01 0.18 0.13 0.00 -0.55 0.00 0.00 56.30 56.06 177l h ASN 132 Cb 0.64 0.49 -0.09 0.00 0.05 0.00 0.00 38.32 39.41 177l h ASN 132 CO -0.17 -0.34 0.59 -0.07 -1.65 0.00 0.00 177.43 175.79 177l h LEU 133 N -0.31 0.85 -1.13 1.61 3.38 -0.10 -0.93 115.31 118.69 177l h LEU 133 Ca 0.14 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.17 177l h LEU 133 Cb 0.54 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.18 177l h LEU 133 CO -0.48 0.44 0.00 0.00 0.09 0.00 0.00 178.44 178.49 177l h ALA 134 N 1.54 1.00 -1.48 1.53 0.00 0.10 -3.31 119.26 118.64 177l h ALA 134 Ca 0.49 0.00 -0.77 0.00 0.00 0.00 0.00 54.91 54.63 177l h ALA 134 Cb 0.52 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.11 177l h ALA 134 CO -0.28 0.00 1.43 1.63 0.00 0.00 0.00 179.25 182.02 177l n LYS 135 N -2.94 3.78 -3.90 0.00 5.02 -0.35 -4.69 118.16 115.08 177l n LYS 135 Ca 0.01 -3.94 -0.08 0.00 -2.02 0.00 0.00 58.31 52.28 177l n LYS 135 Cb 0.33 -2.81 -0.04 0.00 -0.02 0.00 0.00 35.03 32.49 177l n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 177l s SER 136 N 0.63 -0.18 0.17 4.39 1.04 -1.25 -4.98 113.70 113.52 177l s SER 136 Ca 0.37 -0.72 -0.10 0.00 0.48 0.00 0.00 55.95 55.97 177l s SER 136 Cb 0.04 0.63 0.04 0.00 0.10 0.00 0.00 66.02 66.84 177l s SER 136 CO 0.02 -1.19 1.62 0.08 0.98 0.00 0.00 173.24 174.75 177l h ARG 137 N 2.16 1.00 -0.15 4.02 0.11 -1.91 -2.00 114.38 117.61 177l h ARG 137 Ca -0.24 -0.33 0.04 0.00 0.10 0.00 0.00 59.98 59.55 177l h ARG 137 Cb 1.25 -0.09 -0.07 0.00 1.11 0.00 0.00 29.97 32.18 177l h ARG 137 CO 0.32 1.01 -0.44 2.35 0.10 0.00 0.00 179.97 183.31 177l h TRP 138 N 0.88 -1.26 -0.92 4.08 7.01 -1.95 3.31 115.95 127.10 177l h TRP 138 Ca 0.16 0.05 0.08 0.00 2.11 0.00 0.00 58.89 61.29 177l h TRP 138 Cb 0.57 0.57 -0.07 0.00 -2.10 0.00 0.00 29.16 28.13 177l h TRP 138 CO 0.04 -0.48 0.57 -0.92 -2.79 0.00 0.00 178.44 174.86 177l h TYR 139 N -0.49 1.05 0.00 2.65 5.03 -1.77 0.28 116.97 123.72 177l h TYR 139 Ca 0.07 0.03 -0.11 0.00 2.58 0.00 0.00 58.73 61.30 177l h TYR 139 Cb 0.63 -0.34 -0.02 0.00 1.55 0.00 0.00 36.73 38.56 177l h TYR 139 CO -0.51 0.49 -0.54 -0.97 -1.32 0.00 0.00 178.16 175.31 177l h ASN 140 N 1.00 0.00 0.29 -2.11 -1.24 0.84 0.81 115.58 115.17 177l h ASN 140 Ca 0.42 0.00 -0.30 0.00 0.71 0.00 0.00 56.30 57.13 177l h ASN 140 Cb 0.28 0.00 0.02 0.00 0.73 0.00 0.00 38.32 39.35 177l h ASN 140 CO -0.21 0.54 -1.28 1.56 -1.29 0.00 0.00 177.43 176.75 177l h GLN 141 N 0.00 0.51 -2.08 6.67 7.50 0.82 -3.39 115.11 125.14 177l h GLN 141 Ca -0.01 -0.75 -0.53 0.00 0.50 0.00 0.00 58.65 57.86 177l h GLN 141 Cb 0.97 0.26 -0.40 0.00 0.05 0.00 0.00 27.48 28.35 177l h GLN 141 CO 0.07 1.34 -0.99 0.25 -1.50 0.00 0.00 178.83 178.00 177l n THR 142 N -3.71 0.70 -0.32 -0.54 -2.24 0.74 -4.99 114.28 103.91 177l n THR 142 Ca -0.13 -4.75 0.12 0.00 -2.27 0.00 0.00 64.05 57.01 177l n THR 142 Cb 1.01 -1.06 0.25 0.00 -2.10 0.00 0.00 70.33 68.43 177l n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 177l h PRO 143 N 3.33 0.04 0.67 -0.78 0.13 -1.01 -0.45 132.00 133.92 177l h PRO 143 Ca 0.11 -0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.21 177l h PRO 143 Cb 0.81 -0.01 0.01 0.00 0.13 0.00 0.00 31.00 31.94 177l h PRO 143 CO 0.60 0.03 -0.32 -0.91 -0.23 0.00 0.00 178.00 177.16 177l h ASN 144 N 0.04 -0.76 -0.26 1.44 2.35 -1.94 0.15 115.58 116.60 177l h ASN 144 Ca 0.55 0.03 0.05 0.00 -0.55 0.00 0.00 56.30 56.38 177l h ASN 144 Cb 1.08 0.20 -0.05 0.00 0.05 0.00 0.00 38.32 39.59 177l h ASN 144 CO -0.86 -0.45 -0.07 -0.09 -1.65 0.00 0.00 177.43 174.30 177l h ARG 145 N -1.08 -0.01 -0.76 0.81 2.43 -1.93 0.15 114.38 113.99 177l h ARG 145 Ca -0.09 0.00 0.16 0.00 -0.81 0.00 0.00 59.98 59.24 177l h ARG 145 Cb 0.69 0.00 -0.10 0.00 -0.42 0.00 0.00 29.97 30.14 177l h ARG 145 CO 0.15 -0.01 0.27 0.00 -1.51 0.00 0.00 179.97 178.87 177l h ALA 146 N 1.24 1.06 -0.45 2.80 0.00 -1.09 0.17 119.26 123.00 177l h ALA 146 Ca 0.13 0.14 -0.10 0.00 0.00 0.00 0.00 54.91 55.08 177l h ALA 146 Cb 0.20 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 177l h ALA 146 CO -0.27 -0.28 -0.10 -0.22 0.00 0.00 0.00 179.25 178.38 177l h LYS 147 N 0.37 0.86 -0.61 0.00 3.64 0.24 -0.39 116.57 120.69 177l h LYS 147 Ca 0.43 -0.33 0.02 0.00 -1.27 0.00 0.00 60.65 59.51 177l h LYS 147 Cb 0.71 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.44 177l h LYS 147 CO -0.46 0.97 0.38 0.00 -2.27 0.00 0.00 179.45 178.07 177l h ARG 148 N 0.70 0.73 -0.49 1.90 3.08 0.10 -1.15 114.38 119.26 177l h ARG 148 Ca 0.11 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 177l h ARG 148 Cb 0.64 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 177l h ARG 148 CO 0.04 0.48 0.07 0.28 -1.07 0.00 0.00 179.97 179.77 177l h VAL 149 N 0.75 1.25 0.13 2.04 2.07 -0.67 -2.40 116.25 119.42 177l h VAL 149 Ca 0.24 -0.95 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 177l h VAL 149 Cb -0.00 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 177l h VAL 149 CO -0.09 0.34 -0.06 0.40 0.02 0.00 0.00 177.57 178.17 177l h ILE 150 N 0.69 0.93 -0.86 4.57 2.04 -0.51 -1.92 117.51 122.45 177l h ILE 150 Ca 0.15 -0.22 0.13 0.00 1.00 0.00 0.00 64.86 65.92 177l h ILE 150 Cb 0.41 1.07 -0.07 0.00 -0.74 0.00 0.00 36.82 37.50 177l h ILE 150 CO 0.01 0.05 0.56 0.74 0.00 0.00 0.00 178.15 179.51 177l h THR 151 N -0.27 0.85 0.50 -0.27 2.02 -1.22 0.21 112.91 114.74 177l h THR 151 Ca -0.02 -0.23 -0.02 0.00 0.77 0.00 0.00 66.41 66.91 177l h THR 151 Cb 0.22 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.75 177l h THR 151 CO 0.03 0.12 -0.24 0.74 0.37 0.00 0.00 175.52 176.54 177l h THR 152 N 0.67 0.40 -0.92 3.16 2.02 -1.07 0.82 112.91 117.99 177l h THR 152 Ca 0.42 -0.38 0.24 0.00 0.77 0.00 0.00 66.41 67.46 177l h THR 152 Cb 0.68 0.54 -0.13 0.00 -1.74 0.00 0.00 68.15 67.50 177l h THR 152 CO -0.18 0.05 0.42 -0.26 0.37 0.00 0.00 175.52 175.92 177l h PHE 153 N -0.94 0.69 -0.07 3.16 0.04 -0.53 1.93 116.94 121.23 177l h PHE 153 Ca -0.07 0.04 -0.07 0.00 2.80 0.00 0.00 57.97 60.67 177l h PHE 153 Cb 0.60 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.60 177l h PHE 153 CO 0.00 -0.07 -0.23 0.00 -0.60 0.00 0.00 178.31 177.41 177l h THR 155 N -0.23 0.59 0.00 0.00 1.35 0.15 -3.47 112.91 111.31 177l h THR 155 Ca -0.01 -1.95 0.00 0.00 -0.55 0.00 0.00 66.41 63.90 177l h THR 155 Cb 0.86 2.16 0.00 0.00 -1.73 0.00 0.00 68.15 69.45 177l h THR 155 CO 0.05 0.34 0.00 0.61 -0.25 0.00 0.00 175.52 176.27 177l n GLY 156 N 1.28 1.29 3.89 5.82 0.00 0.65 -4.97 105.19 113.15 177l n GLY 156 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.73 177l n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 177l s THR 157 N -3.66 1.67 -2.52 2.61 -4.23 -1.25 -4.59 115.64 103.66 177l s THR 157 Ca 0.00 -1.52 0.23 0.00 -1.18 0.00 0.00 61.69 59.22 177l s THR 157 Cb 0.00 -2.19 0.40 0.00 1.34 0.00 0.00 72.50 72.05 177l s THR 157 CO 0.00 0.00 1.41 0.79 -0.54 0.00 0.00 174.62 176.28 177l n TRP 158 N -1.72 0.40 -0.24 3.99 7.02 -1.26 -4.49 117.44 121.14 177l n TRP 158 Ca -0.03 -0.20 0.25 0.00 -1.02 0.00 0.00 57.50 56.51 177l n TRP 158 Cb 0.64 0.00 0.63 0.00 -2.42 0.00 0.00 31.31 30.16 177l n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 177l h ASP 159 N 4.18 0.20 0.46 -0.99 5.19 -1.96 0.18 116.42 123.69 177l h ASP 159 Ca 0.00 0.03 -0.00 0.00 -0.62 0.00 0.00 57.03 56.43 177l h ASP 159 Cb 0.92 -0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.42 177l h ASP 159 CO 0.00 0.06 -0.02 0.00 -3.12 0.00 0.00 179.24 176.17 177l h ALA 160 N 1.57 1.04 -0.71 3.45 0.00 -1.88 -2.54 119.26 120.19 177l h ALA 160 Ca 0.48 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 55.21 177l h ALA 160 Cb 1.56 -0.00 -0.10 0.00 0.00 0.00 0.00 17.79 19.25 177l h ALA 160 CO -0.11 0.02 0.21 0.66 0.00 0.00 0.00 179.25 180.03 177l n TYR 161 N -3.16 2.39 -1.98 0.00 4.02 0.64 -4.95 117.16 114.11 177l n TYR 161 Ca -0.01 -1.09 0.00 0.00 -0.01 0.00 0.00 57.90 56.78 177l n TYR 161 Cb 0.19 -0.65 0.00 0.00 -0.02 0.00 0.00 39.34 38.85 177l n TYR 161 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48