#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1due s VAL 2 N 0.00 3.16 0.64 2.62 1.01 -1.26 -5.10 120.40 121.48 1due s VAL 2 Ca 0.00 -0.97 -0.17 0.00 0.00 0.00 0.00 61.98 60.84 1due s VAL 2 Cb 0.00 -2.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.99 1due s VAL 2 CO 0.00 0.39 0.67 -1.54 0.00 0.00 0.00 175.10 174.62 1due n SER 3 N 1.64 -0.53 0.07 3.32 3.41 -1.26 -4.84 113.62 115.43 1due n SER 3 Ca -0.16 0.70 0.09 0.00 -0.26 0.00 0.00 58.87 59.24 1due n SER 3 Cb 0.52 -1.26 0.38 0.00 -0.26 0.00 0.00 64.21 63.60 1due n SER 3 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1due n ALA 4 N -2.01 1.53 0.09 7.33 0.00 -1.26 -2.10 120.51 124.09 1due n ALA 4 Ca 0.12 0.04 -0.14 0.00 0.00 0.00 0.00 53.44 53.46 1due n ALA 4 Cb 0.48 -1.28 -0.09 0.00 0.00 0.00 0.00 19.45 18.56 1due n ALA 4 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1due h GLU 5 N 0.00 0.28 -0.04 0.00 5.08 -1.99 -2.83 114.58 115.08 1due h GLU 5 Ca 0.00 -0.40 -0.00 0.00 -1.00 0.00 0.00 59.36 57.96 1due h GLU 5 Cb 0.25 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 1due h GLU 5 CO 0.00 1.14 0.01 0.93 -1.00 0.00 0.00 179.01 180.09 1due h GLU 6 N 0.12 0.06 -0.93 2.33 4.39 -1.77 -0.96 114.58 117.82 1due h GLU 6 Ca -0.10 -0.01 0.06 0.00 0.34 0.00 0.00 59.36 59.65 1due h GLU 6 Cb 1.79 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 30.36 1due h GLU 6 CO 0.18 0.22 0.59 0.82 -1.16 0.00 0.00 179.01 179.66 1due h ILE 7 N -0.12 1.06 -0.34 3.13 5.03 -1.63 0.47 117.51 125.13 1due h ILE 7 Ca 0.01 -0.37 -0.01 0.00 -0.12 0.00 0.00 64.86 64.37 1due h ILE 7 Cb 0.18 -0.10 -0.02 0.00 -3.03 0.00 0.00 36.82 33.86 1due h ILE 7 CO -0.00 0.20 0.16 0.50 -0.68 0.00 0.00 178.15 178.32 1due h LYS 8 N 1.07 0.49 -0.04 2.37 1.63 -1.22 -1.23 116.57 119.63 1due h LYS 8 Ca 0.40 -0.07 -0.16 0.00 -0.85 0.00 0.00 60.65 59.97 1due h LYS 8 Cb 0.17 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 31.70 1due h LYS 8 CO -0.17 0.45 -0.67 0.87 -3.45 0.00 0.00 179.45 176.48 1due h LYS 9 N 0.40 0.20 0.00 1.90 1.57 -0.45 -2.64 116.57 117.55 1due h LYS 9 Ca 0.11 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1due h LYS 9 Cb 0.13 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1due h LYS 9 CO -0.01 0.80 -0.00 1.25 -0.57 0.00 0.00 179.45 180.91 1due h HIS 10 N 0.14 -0.00 -0.18 -1.35 2.76 0.10 -1.34 115.15 115.27 1due h HIS 10 Ca -0.01 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.21 1due h HIS 10 Cb 1.21 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.16 1due h HIS 10 CO 0.02 0.17 0.18 0.93 -1.30 0.00 0.00 177.93 177.93 1due h GLU 11 N -0.18 0.00 0.41 5.26 5.08 -1.21 0.06 114.58 124.00 1due h GLU 11 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1due h GLU 11 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1due h GLU 11 CO 0.00 0.00 -0.20 1.49 -1.00 0.00 0.00 179.01 179.30 1due h GLU 12 N 0.00 -0.53 0.28 2.33 4.57 -0.89 -1.96 114.58 118.39 1due h GLU 12 Ca 0.09 0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.30 1due h GLU 12 Cb 0.44 0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.13 1due h GLU 12 CO -0.00 -0.35 -0.33 0.87 -1.18 0.00 0.00 179.01 178.02 1due h LYS 13 N -0.69 -0.60 -1.00 1.92 1.57 -0.88 -2.45 116.57 114.45 1due h LYS 13 Ca -0.06 0.04 0.36 0.00 -1.87 0.00 0.00 60.65 59.13 1due h LYS 13 Cb 0.42 0.14 -0.18 0.00 0.08 0.00 0.00 32.23 32.68 1due h LYS 13 CO 0.09 -0.40 0.35 2.35 -0.57 0.00 0.00 179.45 181.28 1due h TRP 14 N -0.62 0.51 0.00 -1.35 2.91 -1.11 0.55 115.95 116.83 1due h TRP 14 Ca -0.03 0.05 -0.05 0.00 1.13 0.00 0.00 58.89 59.99 1due h TRP 14 Cb 0.55 -0.05 -0.01 0.00 -0.51 0.00 0.00 29.16 29.14 1due h TRP 14 CO -0.23 -0.46 -0.23 -0.97 -1.03 0.00 0.00 178.44 175.53 1due h ASN 15 N 0.01 0.00 0.39 2.65 -1.24 -0.86 -1.91 115.58 114.62 1due h ASN 15 Ca 0.76 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.77 1due h ASN 15 Cb 1.87 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.92 1due h ASN 15 CO -0.83 0.23 0.00 2.29 -1.29 0.00 0.00 177.43 177.83 1due n LYS 16 N -4.20 0.08 -0.05 6.67 2.85 0.19 0.17 118.16 123.87 1due n LYS 16 Ca -0.02 0.22 -0.05 0.00 -1.05 0.00 0.00 58.31 57.41 1due n LYS 16 Cb 0.29 -1.50 -0.07 0.00 -0.65 0.00 0.00 35.03 33.10 1due n LYS 16 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1due n TYR 17 N -1.42 0.00 0.06 5.58 4.02 -0.81 -4.73 117.16 119.86 1due n TYR 17 Ca 0.05 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 57.95 1due n TYR 17 Cb 0.14 -0.45 0.01 0.00 -0.02 0.00 0.00 39.34 39.02 1due n TYR 17 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1due n TYR 18 N -2.39 0.02 0.11 -0.72 4.01 -0.78 -4.67 117.16 112.72 1due n TYR 18 Ca -0.15 -0.10 -0.24 0.00 -0.16 0.00 0.00 57.90 57.25 1due n TYR 18 Cb 0.79 -0.01 -0.15 0.00 -0.31 0.00 0.00 39.34 39.65 1due n TYR 18 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1due h GLY 19 N 0.39 0.54 -2.57 2.72 0.00 0.15 -3.47 103.07 100.83 1due h GLY 19 Ca 0.00 -1.37 -0.45 0.00 0.00 0.00 0.00 47.33 45.51 1due h GLY 19 CO 0.00 1.20 -0.23 0.54 0.00 0.00 0.00 176.54 178.05 1due s VAL 20 N -2.58 4.21 0.40 4.60 0.11 -1.25 -5.06 120.40 120.83 1due s VAL 20 Ca -0.12 -0.73 -0.26 0.00 -2.93 0.00 0.00 61.98 57.93 1due s VAL 20 Cb 0.04 -3.51 -0.09 0.00 -1.53 0.00 0.00 36.38 31.29 1due s VAL 20 CO 0.90 -0.28 1.35 0.21 -3.33 0.00 0.00 175.10 173.95 1due s ASN 21 N -4.17 6.28 0.28 3.54 2.47 -1.26 -4.91 114.94 117.17 1due s ASN 21 Ca 0.45 2.77 0.02 0.00 0.42 0.00 0.00 52.86 56.52 1due s ASN 21 Cb -0.10 -2.65 0.64 0.00 -1.45 0.00 0.00 41.25 37.70 1due s ASN 21 CO 0.34 -0.88 1.72 0.00 -3.72 0.00 0.00 177.10 174.56 1due h ALA 22 N 2.73 1.35 0.00 1.71 0.00 -1.97 0.11 119.26 123.20 1due h ALA 22 Ca -0.50 0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 1due h ALA 22 Cb 1.25 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 1due h ALA 22 CO 0.63 -0.24 -0.28 0.74 0.00 0.00 0.00 179.25 180.10 1due h PHE 23 N 0.48 0.00 -0.76 0.00 0.04 -2.01 -2.73 116.94 111.97 1due h PHE 23 Ca 0.52 0.00 -0.37 0.00 2.80 0.00 0.00 57.97 60.92 1due h PHE 23 Cb 0.88 0.00 -0.22 0.00 2.20 0.00 0.00 35.95 38.81 1due h PHE 23 CO -0.12 0.28 0.47 0.09 -0.60 0.00 0.00 178.31 178.42 1due n ASN 24 N -3.84 3.71 -4.84 2.17 4.13 0.38 -4.92 115.26 112.05 1due n ASN 24 Ca -0.01 -3.22 -0.36 0.00 1.68 0.00 0.00 54.58 52.67 1due n ASN 24 Cb 0.37 -0.76 -0.06 0.00 -1.54 0.00 0.00 39.78 37.79 1due n ASN 24 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1due s LEU 25 N -2.56 4.40 0.26 3.41 2.96 -1.03 -4.77 118.68 121.35 1due s LEU 25 Ca 0.45 1.09 -0.30 0.00 -0.22 0.00 0.00 54.13 55.14 1due s LEU 25 Cb 0.37 -3.08 -0.10 0.00 0.50 0.00 0.00 46.19 43.88 1due s LEU 25 CO 0.09 0.17 1.49 -2.16 -1.32 0.00 0.00 176.35 174.62 1due s PRO 26 N -1.65 4.22 0.39 0.98 0.04 -1.26 -4.84 135.00 132.88 1due s PRO 26 Ca 0.34 2.39 0.20 0.00 0.04 0.00 0.00 61.00 63.96 1due s PRO 26 Cb -0.16 -3.09 1.16 0.00 0.04 0.00 0.00 34.50 32.45 1due s PRO 26 CO 0.18 -0.49 1.72 0.87 0.04 0.00 0.00 177.00 179.32 1due h LYS 27 N 5.04 0.32 0.00 4.56 1.57 -1.97 0.30 116.57 126.39 1due h LYS 27 Ca -0.46 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.25 1due h LYS 27 Cb 1.22 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 1due h LYS 27 CO 0.79 0.21 -0.23 1.05 -0.57 0.00 0.00 179.45 180.70 1due h GLU 28 N 0.33 0.00 0.04 3.15 9.09 -1.99 -3.21 114.58 121.98 1due h GLU 28 Ca 0.67 0.00 -0.34 0.00 0.05 0.00 0.00 59.36 59.73 1due h GLU 28 Cb 1.75 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 28.80 1due h GLU 28 CO -0.38 0.23 -2.04 1.28 0.05 0.00 0.00 179.01 178.15 1due n LEU 29 N -4.04 1.55 -3.68 3.06 4.77 0.04 -4.45 117.00 114.26 1due n LEU 29 Ca -0.02 0.19 -0.11 0.00 -0.03 0.00 0.00 56.01 56.04 1due n LEU 29 Cb 0.30 -0.31 -0.12 0.00 -2.33 0.00 0.00 43.42 40.96 1due n LEU 29 CO 0.35 0.63 -0.05 0.12 -1.33 0.00 0.00 177.39 177.12 1due s PHE 30 N -2.55 -0.56 -0.03 -1.77 5.36 -0.90 -0.87 117.98 116.66 1due s PHE 30 Ca -0.15 1.18 -0.28 0.00 -0.96 0.00 0.00 56.93 56.72 1due s PHE 30 Cb 0.07 0.14 0.06 0.00 -0.34 0.00 0.00 43.02 42.96 1due s PHE 30 CO 0.78 -0.37 0.61 -1.54 -1.46 0.00 0.00 175.22 173.23 1due s SER 31 N 2.11 -0.57 0.34 6.13 1.04 -0.81 -4.18 113.70 117.76 1due s SER 31 Ca -0.03 0.55 -0.27 0.00 0.48 0.00 0.00 55.95 56.68 1due s SER 31 Cb -0.11 0.51 -0.09 0.00 0.10 0.00 0.00 66.02 66.42 1due s SER 31 CO -0.11 -0.61 1.10 -0.75 0.98 0.00 0.00 173.24 173.85 1due s LYS 32 N -1.43 4.37 -0.29 4.02 2.20 -1.26 -0.51 119.74 126.83 1due s LYS 32 Ca -0.10 1.73 -0.22 0.00 -0.36 0.00 0.00 55.97 57.01 1due s LYS 32 Cb -0.01 -2.88 -0.01 0.00 -1.51 0.00 0.00 37.83 33.43 1due s LYS 32 CO 0.07 -0.01 0.72 0.08 -0.36 0.00 0.00 175.35 175.85 1due s VAL 33 N -1.37 4.87 0.83 4.02 1.01 0.21 -4.85 120.40 125.12 1due s VAL 33 Ca 0.51 1.12 -0.11 0.00 0.00 0.00 0.00 61.98 63.50 1due s VAL 33 Cb -0.29 -4.07 0.09 0.00 0.00 0.00 0.00 36.38 32.12 1due s VAL 33 CO 0.36 -0.16 1.09 1.51 0.00 0.00 0.00 175.10 177.91 1due s ASP 34 N 1.57 4.05 0.31 3.32 1.47 -1.26 -4.75 116.67 121.39 1due s ASP 34 Ca 0.29 1.55 0.08 0.00 1.18 0.00 0.00 52.55 55.66 1due s ASP 34 Cb -0.15 -2.26 0.88 0.00 -0.34 0.00 0.00 42.92 41.05 1due s ASP 34 CO 0.11 -2.28 1.68 -0.33 0.68 0.00 0.00 175.17 175.03 1due h GLU 35 N -1.30 0.37 0.30 2.11 5.08 -1.98 -1.50 114.58 117.66 1due h GLU 35 Ca -0.47 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 57.85 1due h GLU 35 Cb 1.26 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1due h GLU 35 CO 0.55 0.25 -0.14 0.87 -1.00 0.00 0.00 179.01 179.53 1due h LYS 36 N 0.38 -0.39 0.00 2.33 6.56 -2.01 -2.93 116.57 120.51 1due h LYS 36 Ca 0.63 0.03 -0.03 0.00 -1.06 0.00 0.00 60.65 60.22 1due h LYS 36 Cb 1.30 0.09 -0.00 0.00 -0.57 0.00 0.00 32.23 33.05 1due h LYS 36 CO -0.56 -0.24 -0.15 -0.44 -2.06 0.00 0.00 179.45 176.00 1due h ASP 37 N -0.43 0.00 0.74 0.86 3.32 -1.77 -2.99 116.42 116.15 1due h ASP 37 Ca -0.04 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 1due h ASP 37 Cb 0.33 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.88 1due h ASP 37 CO 0.07 0.15 -0.08 -0.09 -1.72 0.00 0.00 179.24 177.57 1due h ARG 38 N 0.00 0.00 -0.01 3.56 2.43 -1.11 -2.18 114.38 117.07 1due h ARG 38 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1due h ARG 38 Cb 0.66 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1due h ARG 38 CO 0.02 0.08 -0.24 1.04 -1.51 0.00 0.00 179.97 179.36 1due n GLN 39 N -3.27 1.05 -4.16 0.20 6.02 -1.13 -3.50 117.38 112.60 1due n GLN 39 Ca -0.00 -0.67 -0.22 0.00 -0.01 0.00 0.00 57.00 56.10 1due n GLN 39 Cb 0.29 -1.49 -0.05 0.00 1.02 0.00 0.00 30.24 30.02 1due n GLN 39 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1due s LYS 40 N -2.41 2.78 0.35 -1.09 1.02 -0.82 -4.81 119.74 114.76 1due s LYS 40 Ca 0.26 -1.13 -0.26 0.00 0.02 0.00 0.00 55.97 54.86 1due s LYS 40 Cb 0.19 -2.47 -0.09 0.00 -0.52 0.00 0.00 37.83 34.94 1due s LYS 40 CO 0.49 0.39 1.03 -0.47 -0.92 0.00 0.00 175.35 175.87 1due s TYR 41 N -2.17 3.46 -2.52 3.18 6.14 -1.26 -1.23 117.35 122.95 1due s TYR 41 Ca 0.32 1.70 0.27 0.00 0.64 0.00 0.00 57.07 60.00 1due s TYR 41 Cb -0.08 -3.10 0.90 0.00 0.42 0.00 0.00 41.96 40.11 1due s TYR 41 CO 0.24 -0.36 1.66 -0.35 0.64 0.00 0.00 175.55 177.37 1due n PRO 42 N 0.38 1.76 -0.32 4.97 -0.04 -1.26 -4.89 135.00 135.61 1due n PRO 42 Ca 0.03 -1.11 0.05 0.00 -0.04 0.00 0.00 63.50 62.43 1due n PRO 42 Cb 0.49 -1.47 0.24 0.00 -0.04 0.00 0.00 33.50 32.72 1due n PRO 42 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1due h TYR 43 N 2.63 1.07 0.00 0.54 0.05 -1.55 -1.17 116.97 118.54 1due h TYR 43 Ca 0.00 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.81 1due h TYR 43 Cb 0.56 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 37.95 1due h TYR 43 CO 0.02 0.51 0.00 0.27 -1.05 0.00 0.00 178.16 177.91 1due n ASN 44 N -4.53 0.00 -0.08 3.88 0.23 -0.37 -1.77 115.26 112.63 1due n ASN 44 Ca 0.16 -0.05 0.12 0.00 -0.53 0.00 0.00 54.58 54.28 1due n ASN 44 Cb 0.26 -0.23 0.30 0.00 -2.08 0.00 0.00 39.78 38.02 1due n ASN 44 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1due n THR 45 N -1.23 0.00 -3.25 5.53 -2.24 -0.44 -4.72 114.28 107.92 1due n THR 45 Ca 0.08 -0.04 -0.39 0.00 -2.27 0.00 0.00 64.05 61.44 1due n THR 45 Cb 0.11 0.29 -0.06 0.00 -2.10 0.00 0.00 70.33 68.57 1due n THR 45 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1due s ILE 46 N -2.84 4.82 0.24 2.28 -1.09 -0.73 -1.32 121.20 122.56 1due s ILE 46 Ca 0.15 1.22 -0.04 0.00 -2.23 0.00 0.00 60.65 59.75 1due s ILE 46 Cb 0.18 -3.91 -0.02 0.00 -1.58 0.00 0.00 42.46 37.13 1due s ILE 46 CO 0.64 0.50 0.30 -0.83 -1.23 0.00 0.00 174.94 174.32 1due s GLY 47 N -0.73 1.21 -0.23 6.18 0.00 -0.72 -1.71 107.32 111.32 1due s GLY 47 Ca 0.30 -1.43 -0.10 0.00 0.00 0.00 0.00 44.72 43.48 1due s GLY 47 CO 0.18 -1.10 0.14 0.21 0.00 0.00 0.00 173.10 172.53 1due s ASN 48 N -3.14 6.00 -0.37 1.64 3.84 -0.00 -1.89 114.94 121.03 1due s ASN 48 Ca 0.33 0.09 -0.18 0.00 0.21 0.00 0.00 52.86 53.31 1due s ASN 48 Cb 0.03 -2.08 0.00 0.00 -0.55 0.00 0.00 41.25 38.66 1due s ASN 48 CO 0.13 0.08 0.51 -0.69 -2.79 0.00 0.00 177.10 174.34 1due s VAL 49 N 0.98 5.01 -0.22 -5.21 1.01 -0.07 -0.67 120.40 121.23 1due s VAL 49 Ca 0.07 0.18 -0.05 0.00 0.00 0.00 0.00 61.98 62.18 1due s VAL 49 Cb -0.13 -4.00 -0.01 0.00 0.00 0.00 0.00 36.38 32.23 1due s VAL 49 CO 0.04 -0.29 -0.01 0.12 0.00 0.00 0.00 175.10 174.95 1due s PHE 50 N 2.39 2.99 -0.40 5.22 5.36 0.11 -0.88 117.98 132.77 1due s PHE 50 Ca 0.18 -0.77 -0.04 0.00 -0.96 0.00 0.00 56.93 55.34 1due s PHE 50 Cb -0.16 -2.13 0.10 0.00 -0.34 0.00 0.00 43.02 40.49 1due s PHE 50 CO 0.14 -0.47 0.20 0.08 -1.46 0.00 0.00 175.22 173.71 1due s VAL 51 N 1.45 3.47 -0.35 3.12 1.01 -0.14 -0.20 120.40 128.76 1due s VAL 51 Ca 0.05 -1.87 -0.38 0.00 0.00 0.00 0.00 61.98 59.78 1due s VAL 51 Cb -0.14 -3.29 -0.17 0.00 0.00 0.00 0.00 36.38 32.78 1due s VAL 51 CO -0.01 -0.61 1.26 2.29 0.00 0.00 0.00 175.10 178.03 1due n LYS 52 N 4.67 0.00 -2.78 2.72 -0.00 -0.86 -0.83 118.16 121.08 1due n LYS 52 Ca -0.05 0.00 -0.17 0.00 -0.00 0.00 0.00 58.31 58.09 1due n LYS 52 Cb 0.42 -1.24 0.00 0.00 -0.00 0.00 0.00 35.03 34.20 1due n LYS 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1due n GLY 53 N 3.00 -0.50 1.80 2.58 0.00 -1.26 -4.74 105.19 106.07 1due n GLY 53 Ca 0.24 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1due n GLY 53 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1due n GLN 54 N -3.25 0.00 -3.64 1.61 1.13 -0.01 -5.16 117.38 108.05 1due n GLN 54 Ca -0.11 0.00 -0.07 0.00 -1.94 0.00 0.00 57.00 54.88 1due n GLN 54 Cb 0.60 -0.09 -0.02 0.00 0.11 0.00 0.00 30.24 30.84 1due n GLN 54 CO 0.00 0.00 0.00 -0.08 -1.44 0.00 0.00 177.06 175.54 1due s THR 55 N -1.86 0.00 -0.26 5.09 -1.32 -0.90 -5.03 115.64 111.36 1due s THR 55 Ca 0.00 -0.41 -0.03 0.00 -1.21 0.00 0.00 61.69 60.04 1due s THR 55 Cb 0.00 -1.54 0.08 0.00 -1.51 0.00 0.00 72.50 69.54 1due s THR 55 CO 0.00 0.00 0.09 -0.55 -2.21 0.00 0.00 174.62 171.95 1due s SER 56 N -2.77 3.39 0.00 8.08 0.15 -1.26 -0.97 113.70 120.32 1due s SER 56 Ca 0.08 -1.20 0.00 0.00 0.70 0.00 0.00 55.95 55.53 1due s SER 56 Cb -0.02 -0.56 0.00 0.00 -1.71 0.00 0.00 66.02 63.73 1due s SER 56 CO -0.03 -0.39 0.00 0.00 1.20 0.00 0.00 173.24 174.03 1due n ALA 57 N 5.08 0.00 -2.57 5.45 0.00 -0.06 -4.60 120.51 123.81 1due n ALA 57 Ca -0.06 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.14 1due n ALA 57 Cb 0.44 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.80 1due n ALA 57 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1due s THR 58 N 0.88 3.04 0.05 0.00 2.01 -0.26 -0.89 115.64 120.47 1due s THR 58 Ca 0.00 -2.04 -0.19 0.00 0.31 0.00 0.00 61.69 59.78 1due s THR 58 Cb 0.00 -2.59 0.04 0.00 0.01 0.00 0.00 72.50 69.96 1due s THR 58 CO 0.00 -0.33 0.43 -0.83 -0.69 0.00 0.00 174.62 173.21 1due s GLY 59 N -3.43 -0.30 -0.08 4.40 0.00 -0.79 -4.17 107.32 102.95 1due s GLY 59 Ca 0.29 0.33 0.05 0.00 0.00 0.00 0.00 44.72 45.40 1due s GLY 59 CO 0.17 0.07 -0.24 0.14 0.00 0.00 0.00 173.10 173.23 1due s VAL 60 N -2.58 2.06 -0.34 1.40 1.01 -0.18 -1.76 120.40 120.01 1due s VAL 60 Ca -0.05 -1.04 -0.29 0.00 0.00 0.00 0.00 61.98 60.60 1due s VAL 60 Cb -0.01 -1.76 0.01 0.00 0.00 0.00 0.00 36.38 34.62 1due s VAL 60 CO -0.03 0.57 1.23 -0.22 0.00 0.00 0.00 175.10 176.64 1due s LEU 61 N 0.10 3.83 0.00 3.92 2.96 -0.44 -0.13 118.68 128.92 1due s LEU 61 Ca -0.12 1.01 0.05 0.00 -0.22 0.00 0.00 54.13 54.86 1due s LEU 61 Cb -0.16 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.00 1due s LEU 61 CO 0.06 -1.09 0.52 2.30 -1.32 0.00 0.00 176.35 176.83 1due n ILE 62 N 6.30 0.00 -4.06 6.68 -5.35 0.06 -1.26 119.36 121.73 1due n ILE 62 Ca 0.14 -0.47 -0.13 0.00 -0.27 0.00 0.00 62.75 62.02 1due n ILE 62 Cb 0.47 1.08 -0.04 0.00 -1.74 0.00 0.00 39.64 39.40 1due n ILE 62 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1due s GLY 63 N -0.72 1.17 0.36 3.28 0.00 -1.03 -4.67 107.32 105.71 1due s GLY 63 Ca 0.05 -1.32 0.08 0.00 0.00 0.00 0.00 44.72 43.53 1due s GLY 63 CO 0.10 -0.89 1.91 1.70 0.00 0.00 0.00 173.10 175.92 1due h LYS 64 N 2.18 0.69 0.00 2.90 3.64 -1.89 -3.11 116.57 120.98 1due h LYS 64 Ca -0.28 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1due h LYS 64 Cb 1.24 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 1due h LYS 64 CO 0.39 0.45 -0.31 0.09 -2.27 0.00 0.00 179.45 177.81 1due n ASN 65 N -4.52 0.60 -4.32 4.20 3.02 -0.87 -1.06 115.26 112.32 1due n ASN 65 Ca 0.14 -2.12 -0.32 0.00 -0.03 0.00 0.00 54.58 52.25 1due n ASN 65 Cb 0.37 -0.22 -0.15 0.00 -0.61 0.00 0.00 39.78 39.16 1due n ASN 65 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1due s THR 66 N -0.67 2.56 -0.09 3.41 2.01 -1.17 -0.51 115.64 121.18 1due s THR 66 Ca 0.07 -0.85 0.03 0.00 0.31 0.00 0.00 61.69 61.24 1due s THR 66 Cb 0.06 -2.02 -0.02 0.00 0.01 0.00 0.00 72.50 70.54 1due s THR 66 CO 0.01 0.55 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.63 1due s VAL 67 N 0.14 2.77 -0.22 3.82 1.01 0.55 -0.76 120.40 127.71 1due s VAL 67 Ca -0.10 -0.80 -0.09 0.00 0.00 0.00 0.00 61.98 61.00 1due s VAL 67 Cb -0.16 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 1due s VAL 67 CO 0.06 0.56 0.10 -0.22 0.00 0.00 0.00 175.10 175.60 1due s LEU 68 N -0.11 3.85 0.00 3.92 2.96 0.82 -0.57 118.68 129.55 1due s LEU 68 Ca -0.03 0.04 0.00 0.00 -0.22 0.00 0.00 54.13 53.92 1due s LEU 68 Cb -0.14 -2.01 0.00 0.00 0.50 0.00 0.00 46.19 44.54 1due s LEU 68 CO 0.04 0.09 0.00 1.07 -1.32 0.00 0.00 176.35 176.23 1due n THR 69 N 4.08 0.00 -3.12 3.68 5.66 -0.86 -1.01 114.28 122.71 1due n THR 69 Ca -0.16 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.52 1due n THR 69 Cb 0.52 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.24 1due n THR 69 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 1due s ASN 70 N -0.96 6.74 0.18 1.09 0.02 -1.26 -0.35 114.94 120.39 1due s ASN 70 Ca 0.00 1.25 -0.09 0.00 -1.02 0.00 0.00 52.86 53.00 1due s ASN 70 Cb 0.00 -2.36 0.06 0.00 0.02 0.00 0.00 41.25 38.97 1due s ASN 70 CO 0.00 -0.22 1.62 -0.09 0.02 0.00 0.00 177.10 178.42 1due h ARG 71 N 2.15 1.05 0.00 -0.60 2.43 -1.67 -2.04 114.38 115.70 1due h ARG 71 Ca -0.48 -0.37 -0.03 0.00 -0.81 0.00 0.00 59.98 58.29 1due h ARG 71 Cb 1.18 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.64 1due h ARG 71 CO 0.65 1.07 -0.15 1.12 -1.51 0.00 0.00 179.97 181.15 1due h HIS 72 N 0.94 0.00 0.00 2.20 2.07 -1.90 -0.92 115.15 117.54 1due h HIS 72 Ca 0.15 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.59 1due h HIS 72 Cb 0.64 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.63 1due h HIS 72 CO 0.04 0.15 -0.32 0.82 -3.07 0.00 0.00 177.93 175.55 1due h ILE 73 N 0.00 1.53 0.00 6.12 1.08 -1.88 -3.26 117.51 121.10 1due h ILE 73 Ca -0.00 -1.98 -0.02 0.00 -0.39 0.00 0.00 64.86 62.46 1due h ILE 73 Cb 0.37 2.75 -0.00 0.00 -3.07 0.00 0.00 36.82 36.86 1due h ILE 73 CO 0.02 0.55 -0.09 0.00 -0.69 0.00 0.00 178.15 177.94 1due h ALA 74 N 0.26 1.70 0.00 1.87 0.00 -0.92 -2.49 119.26 119.69 1due h ALA 74 Ca -0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1due h ALA 74 Cb 1.07 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1due h ALA 74 CO 0.06 0.11 -0.09 0.87 0.00 0.00 0.00 179.25 180.21 1due h LYS 75 N 0.00 0.00 0.00 0.00 1.57 -1.22 -2.58 116.57 114.34 1due h LYS 75 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1due h LYS 75 Cb 0.18 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 1due h LYS 75 CO 0.01 0.09 -0.02 0.74 -0.57 0.00 0.00 179.45 179.70 1due h PHE 76 N 0.00 0.00 -0.00 -1.35 0.04 -1.58 -2.01 116.94 112.04 1due h PHE 76 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1due h PHE 76 Cb 0.22 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.37 1due h PHE 76 CO 0.00 0.02 -0.19 0.00 -0.60 0.00 0.00 178.31 177.54 1due n ALA 77 N -2.19 2.88 -3.90 2.45 0.00 -0.97 -4.95 120.51 113.83 1due n ALA 77 Ca -0.03 -0.27 -0.25 0.00 0.00 0.00 0.00 53.44 52.90 1due n ALA 77 Cb 0.12 -1.29 -0.01 0.00 0.00 0.00 0.00 19.45 18.27 1due n ALA 77 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1due n ASN 78 N -1.14 -0.75 0.00 0.00 4.13 -0.76 -1.50 115.26 115.24 1due n ASN 78 Ca 0.11 -0.95 0.00 0.00 1.68 0.00 0.00 54.58 55.42 1due n ASN 78 Cb 0.31 -3.32 0.00 0.00 -1.54 0.00 0.00 39.78 35.23 1due n ASN 78 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1due n GLY 79 N -1.85 1.67 3.54 7.41 0.00 -1.26 -4.94 105.19 109.75 1due n GLY 79 Ca -0.29 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 1due n GLY 79 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1due s ASP 80 N -1.95 6.41 0.35 1.61 2.15 -0.56 -4.80 116.67 119.87 1due s ASP 80 Ca 0.00 -0.14 0.06 0.00 0.43 0.00 0.00 52.55 52.90 1due s ASP 80 Cb 0.00 -2.45 0.72 0.00 -0.30 0.00 0.00 42.92 40.89 1due s ASP 80 CO 0.00 -1.18 1.92 -0.65 -0.17 0.00 0.00 175.17 175.09 1due h PRO 81 N 9.24 0.77 0.00 4.34 0.11 -1.87 -2.45 132.00 142.14 1due h PRO 81 Ca -0.25 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1due h PRO 81 Cb 1.07 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1due h PRO 81 CO 1.07 0.51 0.00 -1.13 -0.21 0.00 0.00 178.00 178.24 1due n SER 82 N -4.51 0.00 0.03 -2.05 3.41 -1.26 -1.16 113.62 108.08 1due n SER 82 Ca 0.13 0.44 0.12 0.00 -0.26 0.00 0.00 58.87 59.30 1due n SER 82 Cb 0.30 -0.45 0.21 0.00 -0.26 0.00 0.00 64.21 64.00 1due n SER 82 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1due n LYS 83 N -1.45 0.15 -4.59 4.33 4.76 -0.92 -4.88 118.16 115.55 1due n LYS 83 Ca 0.01 0.04 -0.33 0.00 -2.87 0.00 0.00 58.31 55.16 1due n LYS 83 Cb 0.05 -1.59 -0.11 0.00 -1.84 0.00 0.00 35.03 31.55 1due n LYS 83 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1due s VAL 84 N -3.09 3.65 0.02 -0.18 1.01 -0.31 -2.03 120.40 119.48 1due s VAL 84 Ca 0.08 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.50 1due s VAL 84 Cb 0.16 -2.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 1due s VAL 84 CO 0.71 0.53 -0.07 -0.55 0.00 0.00 0.00 175.10 175.72 1due s SER 85 N -1.00 0.83 -0.14 3.32 0.15 0.72 -3.98 113.70 113.60 1due s SER 85 Ca 0.14 -0.33 0.02 0.00 0.70 0.00 0.00 55.95 56.47 1due s SER 85 Cb -0.11 -0.03 0.00 0.00 -1.71 0.00 0.00 66.02 64.18 1due s SER 85 CO 0.03 -0.06 -0.19 0.12 1.20 0.00 0.00 173.24 174.35 1due s PHE 86 N -0.75 2.71 -0.43 3.44 5.36 -0.40 0.09 117.98 128.01 1due s PHE 86 Ca -0.03 -1.15 0.03 0.00 -0.96 0.00 0.00 56.93 54.82 1due s PHE 86 Cb -0.06 -1.84 0.12 0.00 -0.34 0.00 0.00 43.02 40.90 1due s PHE 86 CO 0.00 -0.51 0.17 1.03 -1.46 0.00 0.00 175.22 174.45 1due s ARG 87 N 0.74 1.60 0.20 10.12 0.52 0.15 -0.44 118.95 131.85 1due s ARG 87 Ca -0.08 -2.14 -0.30 0.00 -0.52 0.00 0.00 55.73 52.69 1due s ARG 87 Cb -0.16 -3.04 -0.09 0.00 0.52 0.00 0.00 34.95 32.18 1due s ARG 87 CO 0.01 -1.04 1.28 -1.25 0.02 0.00 0.00 175.30 174.31 1due s PRO 88 N 0.38 4.41 -1.10 3.54 0.04 -1.26 -0.82 135.00 140.20 1due s PRO 88 Ca 0.14 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.20 1due s PRO 88 Cb -0.23 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 31.11 1due s PRO 88 CO -0.05 -0.21 0.00 0.43 0.04 0.00 0.00 177.00 177.21 1due n SER 89 N 2.53 -3.93 -4.75 6.66 7.64 -0.69 -4.52 113.62 116.56 1due n SER 89 Ca 0.05 0.20 -0.36 0.00 1.01 0.00 0.00 58.87 59.77 1due n SER 89 Cb 0.43 -3.36 0.04 0.00 -1.01 0.00 0.00 64.21 60.31 1due n SER 89 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 1due s ILE 90 N -2.59 2.47 -0.14 0.44 2.07 -1.21 -4.62 121.20 117.61 1due s ILE 90 Ca 0.00 0.29 -0.09 0.00 -1.41 0.00 0.00 60.65 59.44 1due s ILE 90 Cb 0.00 -3.11 0.05 0.00 0.13 0.00 0.00 42.46 39.52 1due s ILE 90 CO 0.00 -0.06 0.35 0.21 -1.91 0.00 0.00 174.94 173.52 1due s ASN 91 N -1.55 -0.40 -0.18 4.50 3.84 -0.51 -4.59 114.94 116.05 1due s ASN 91 Ca 0.79 0.74 0.01 0.00 0.21 0.00 0.00 52.86 54.60 1due s ASN 91 Cb -0.32 0.66 0.04 0.00 -0.55 0.00 0.00 41.25 41.07 1due s ASN 91 CO 0.35 -0.16 -0.11 -0.89 -2.79 0.00 0.00 177.10 173.49 1due s THR 92 N 0.98 1.60 1.04 -5.21 2.01 -0.73 -0.12 115.64 115.21 1due s THR 92 Ca -0.06 -0.88 -0.16 0.00 0.31 0.00 0.00 61.69 60.89 1due s THR 92 Cb -0.07 -1.63 0.22 0.00 0.01 0.00 0.00 72.50 71.03 1due s THR 92 CO -0.07 0.26 1.20 1.51 -0.69 0.00 0.00 174.62 176.83 1due s ASP 93 N 1.43 2.42 0.00 3.53 1.47 -0.39 -4.68 116.67 120.45 1due s ASP 93 Ca 0.01 0.55 0.09 0.00 1.18 0.00 0.00 52.55 54.38 1due s ASP 93 Cb -0.15 -0.78 0.49 0.00 -0.34 0.00 0.00 42.92 42.14 1due s ASP 93 CO -0.09 -3.19 1.16 0.47 0.68 0.00 0.00 175.17 174.20 1due n ASP 94 N -4.12 0.00 -0.90 2.11 8.00 -1.26 -2.21 116.55 118.16 1due n ASP 94 Ca 0.13 0.08 0.07 0.00 0.71 0.00 0.00 54.79 55.78 1due n ASP 94 Cb 0.59 -0.24 0.22 0.00 -0.02 0.00 0.00 41.12 41.67 1due n ASP 94 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1due n ASN 95 N -1.24 3.51 0.00 -2.24 5.03 -1.26 -4.97 115.26 114.09 1due n ASN 95 Ca 0.05 -2.29 0.00 0.00 0.87 0.00 0.00 54.58 53.21 1due n ASN 95 Cb 0.07 -0.37 0.00 0.00 -1.02 0.00 0.00 39.78 38.45 1due n ASN 95 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1due n GLY 96 N 0.49 1.25 3.64 7.41 0.00 -0.94 -5.01 105.19 112.02 1due n GLY 96 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 1due n GLY 96 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1due s ASN 97 N -3.07 6.77 -0.14 1.61 3.04 -1.26 -4.85 114.94 117.04 1due s ASN 97 Ca 0.00 1.42 -0.03 0.00 0.04 0.00 0.00 52.86 54.29 1due s ASN 97 Cb 0.00 -2.54 -0.02 0.00 -1.54 0.00 0.00 41.25 37.15 1due s ASN 97 CO 0.00 -0.96 -0.06 -0.89 -3.04 0.00 0.00 177.10 172.15 1due s THR 98 N 4.07 3.69 -0.00 -5.21 2.01 -1.26 -1.26 115.64 117.68 1due s THR 98 Ca 0.56 -0.43 0.05 0.00 0.31 0.00 0.00 61.69 62.18 1due s THR 98 Cb -0.19 -2.60 -0.01 0.00 0.01 0.00 0.00 72.50 69.71 1due s THR 98 CO 0.20 0.51 -0.17 -1.83 -0.69 0.00 0.00 174.62 172.64 1due s GLU 99 N 0.29 1.32 -0.55 4.92 -1.05 0.83 -4.99 118.70 119.48 1due s GLU 99 Ca -0.05 -0.65 0.04 0.00 -0.15 0.00 0.00 54.97 54.17 1due s GLU 99 Cb -0.14 -1.30 0.16 0.00 -0.44 0.00 0.00 34.13 32.41 1due s GLU 99 CO 0.04 0.35 0.39 0.95 0.95 0.00 0.00 175.26 177.94 1due s THR 100 N -0.47 1.63 0.49 1.83 -4.23 -1.26 -1.42 115.64 112.21 1due s THR 100 Ca 0.06 -3.37 0.34 0.00 -1.18 0.00 0.00 61.69 57.54 1due s THR 100 Cb -0.07 -2.10 0.54 0.00 1.34 0.00 0.00 72.50 72.22 1due s THR 100 CO -0.00 -1.09 1.70 1.55 -0.54 0.00 0.00 174.62 176.24 1due h PRO 101 N 5.69 0.10 -0.23 3.99 0.13 -1.82 0.10 132.00 139.96 1due h PRO 101 Ca 0.17 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1due h PRO 101 Cb 0.84 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1due h PRO 101 CO 0.54 0.07 0.00 0.66 -0.23 0.00 0.00 178.00 179.04 1due n TYR 102 N -4.38 0.45 -3.78 1.56 4.01 -1.26 -5.10 117.16 108.67 1due n TYR 102 Ca 0.33 -0.63 0.00 0.00 -0.16 0.00 0.00 57.90 57.44 1due n TYR 102 Cb 1.39 -0.11 0.00 0.00 -0.31 0.00 0.00 39.34 40.31 1due n TYR 102 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1due n GLY 103 N -0.07 -2.10 3.36 2.72 0.00 0.35 -4.91 105.19 104.55 1due n GLY 103 Ca 0.12 -1.46 -0.32 0.00 0.00 0.00 0.00 46.02 44.37 1due n GLY 103 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1due s GLU 104 N -0.02 2.29 -0.05 1.61 2.12 -1.26 -4.34 118.70 119.05 1due s GLU 104 Ca 0.00 -0.85 0.03 0.00 0.36 0.00 0.00 54.97 54.52 1due s GLU 104 Cb 0.00 -2.17 -0.03 0.00 0.26 0.00 0.00 34.13 32.20 1due s GLU 104 CO 0.00 0.56 -0.14 0.71 -0.54 0.00 0.00 175.26 175.85 1due s TYR 105 N -0.60 2.70 0.38 5.30 1.51 0.42 -4.98 117.35 122.09 1due s TYR 105 Ca 0.09 -0.18 -0.07 0.00 -1.01 0.00 0.00 57.07 55.90 1due s TYR 105 Cb -0.11 -1.64 -0.05 0.00 -0.11 0.00 0.00 41.96 40.05 1due s TYR 105 CO -0.00 0.17 0.70 -1.21 -1.11 0.00 0.00 175.55 174.09 1due s GLU 106 N -0.68 3.68 -0.14 -0.62 2.02 -1.26 -1.27 118.70 120.42 1due s GLU 106 Ca 0.10 0.24 -0.06 0.00 0.02 0.00 0.00 54.97 55.28 1due s GLU 106 Cb -0.11 -2.48 -0.04 0.00 0.10 0.00 0.00 34.13 31.60 1due s GLU 106 CO 0.01 0.02 0.07 0.08 0.02 0.00 0.00 175.26 175.45 1due s VAL 107 N -2.35 4.85 -0.19 2.63 1.01 -1.26 -0.66 120.40 124.43 1due s VAL 107 Ca 0.48 -0.03 0.16 0.00 0.00 0.00 0.00 61.98 62.58 1due s VAL 107 Cb -0.10 -3.13 -0.23 0.00 0.00 0.00 0.00 36.38 32.92 1due s VAL 107 CO 0.34 0.54 0.04 2.29 0.00 0.00 0.00 175.10 178.31 1due n LYS 108 N 2.77 0.89 -3.75 2.72 2.85 0.21 -4.51 118.16 119.34 1due n LYS 108 Ca -0.18 0.00 -0.13 0.00 -1.05 0.00 0.00 58.31 56.95 1due n LYS 108 Cb 0.53 -1.48 -0.10 0.00 -0.65 0.00 0.00 35.03 33.33 1due n LYS 108 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 1due s GLU 109 N -2.46 0.44 -0.20 -1.58 2.12 -1.10 -4.88 118.70 111.04 1due s GLU 109 Ca -0.11 0.51 -0.02 0.00 0.36 0.00 0.00 54.97 55.71 1due s GLU 109 Cb 0.06 0.21 0.00 0.00 0.26 0.00 0.00 34.13 34.67 1due s GLU 109 CO 0.76 -0.05 -0.11 0.42 -0.54 0.00 0.00 175.26 175.73 1due s ILE 110 N 0.18 2.80 -0.68 -3.70 1.01 -1.26 -0.91 121.20 118.64 1due s ILE 110 Ca -0.00 -0.69 -0.12 0.00 0.00 0.00 0.00 60.65 59.84 1due s ILE 110 Cb -0.03 -2.24 0.18 0.00 0.01 0.00 0.00 42.46 40.38 1due s ILE 110 CO 0.01 0.48 0.60 -0.76 0.00 0.00 0.00 174.94 175.26 1due s LEU 111 N 1.36 6.23 0.26 2.97 1.02 -0.20 -4.96 118.68 125.37 1due s LEU 111 Ca 0.05 -2.42 -0.04 0.00 0.02 0.00 0.00 54.13 51.73 1due s LEU 111 Cb -0.14 -2.12 0.33 0.00 0.02 0.00 0.00 46.19 44.28 1due s LEU 111 CO -0.07 -0.61 1.92 -0.61 0.02 0.00 0.00 176.35 177.00 1due h GLN 112 N 7.97 1.25 -0.78 1.70 4.15 -1.93 -1.23 115.11 126.25 1due h GLN 112 Ca -0.04 -0.07 -0.33 0.00 0.77 0.00 0.00 58.65 58.97 1due h GLN 112 Cb 1.04 -0.28 -0.28 0.00 0.21 0.00 0.00 27.48 28.17 1due h GLN 112 CO 0.82 0.82 -0.81 -0.85 -1.93 0.00 0.00 178.83 176.88 1due n GLU 113 N -4.41 1.08 0.13 1.69 0.28 -1.26 -4.48 120.64 113.67 1due n GLU 113 Ca 0.12 -2.62 0.09 0.00 -0.16 0.00 0.00 57.16 54.60 1due n GLU 113 Cb 0.06 -1.02 0.47 0.00 1.43 0.00 0.00 31.44 32.37 1due n GLU 113 CO 0.00 0.00 0.00 -0.35 -0.16 0.00 0.00 177.13 176.62 1due n PRO 114 N 0.00 0.12 0.00 3.44 -0.04 -1.26 -1.76 135.00 135.51 1due n PRO 114 Ca 0.10 0.56 0.08 0.00 -0.04 0.00 0.00 63.50 64.20 1due n PRO 114 Cb 0.76 -1.86 -0.00 0.00 -0.04 0.00 0.00 33.50 32.36 1due n PRO 114 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1due n PHE 115 N -2.11 0.00 0.00 0.54 3.01 -1.26 -5.04 117.46 112.59 1due n PHE 115 Ca -0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1due n PHE 115 Cb 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.54 1due n PHE 115 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1due n GLY 116 N 1.18 3.51 0.31 1.37 0.00 -0.72 -4.70 105.19 106.14 1due n GLY 116 Ca 0.07 -1.67 0.20 0.00 0.00 0.00 0.00 46.02 44.62 1due n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1due h ALA 117 N 0.00 1.10 -0.30 4.61 0.00 -1.98 -2.08 119.26 120.62 1due h ALA 117 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1due h ALA 117 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1due h ALA 117 CO 0.00 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.68 1due n GLY 118 N -0.86 0.90 3.15 0.00 0.00 -1.26 -4.74 105.19 102.38 1due n GLY 118 Ca -0.02 -0.53 -0.33 0.00 0.00 0.00 0.00 46.02 45.14 1due n GLY 118 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1due s VAL 119 N -1.61 2.47 -1.19 1.61 1.01 -0.78 -5.02 120.40 116.88 1due s VAL 119 Ca 0.34 -1.14 -0.08 0.00 0.00 0.00 0.00 61.98 61.10 1due s VAL 119 Cb 0.19 -2.24 -0.08 0.00 0.00 0.00 0.00 36.38 34.25 1due s VAL 119 CO 0.26 0.25 2.54 -0.67 0.00 0.00 0.00 175.10 177.48 1due n ASP 120 N 4.60 6.64 -4.07 3.32 2.03 -1.26 -4.68 116.55 123.13 1due n ASP 120 Ca -0.17 -2.43 -0.14 0.00 0.52 0.00 0.00 54.79 52.57 1due n ASP 120 Cb 0.47 -1.31 -0.12 0.00 -0.72 0.00 0.00 41.12 39.44 1due n ASP 120 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1due s LEU 121 N 0.12 2.24 0.08 -2.67 1.43 -1.26 -3.15 118.68 115.47 1due s LEU 121 Ca 0.54 -0.52 -0.10 0.00 -1.03 0.00 0.00 54.13 53.02 1due s LEU 121 Cb 0.14 -0.22 0.00 0.00 0.03 0.00 0.00 46.19 46.15 1due s LEU 121 CO -0.04 -0.16 0.21 0.00 0.23 0.00 0.00 176.35 176.58 1due s ALA 122 N -1.26 -0.32 -0.05 4.21 0.00 0.52 -3.98 121.76 120.88 1due s ALA 122 Ca -0.08 -0.48 0.03 0.00 0.00 0.00 0.00 51.96 51.43 1due s ALA 122 Cb -0.09 0.45 -0.03 0.00 0.00 0.00 0.00 23.12 23.45 1due s ALA 122 CO 0.01 -0.48 -0.14 -0.51 0.00 0.00 0.00 175.76 174.64 1due s LEU 123 N -2.65 2.78 -0.14 0.00 1.43 -0.46 -2.04 118.68 117.59 1due s LEU 123 Ca 0.02 -0.18 0.02 0.00 -1.03 0.00 0.00 54.13 52.96 1due s LEU 123 Cb 0.03 -1.57 0.02 0.00 0.03 0.00 0.00 46.19 44.70 1due s LEU 123 CO -0.09 0.34 -0.18 -0.63 0.23 0.00 0.00 176.35 176.02 1due s ILE 124 N -0.72 1.77 -0.22 -0.59 -1.09 0.27 -1.03 121.20 119.59 1due s ILE 124 Ca 0.11 -0.79 -0.09 0.00 -2.23 0.00 0.00 60.65 57.65 1due s ILE 124 Cb -0.11 -1.60 -0.04 0.00 -1.58 0.00 0.00 42.46 39.12 1due s ILE 124 CO 0.01 0.49 0.12 -0.13 -1.23 0.00 0.00 174.94 174.20 1due s ARG 125 N 1.06 4.00 0.13 2.79 0.52 -0.09 -0.33 118.95 127.03 1due s ARG 125 Ca -0.03 -0.32 -0.00 0.00 -0.52 0.00 0.00 55.73 54.86 1due s ARG 125 Cb -0.14 -3.40 -0.04 0.00 0.52 0.00 0.00 34.95 31.88 1due s ARG 125 CO -0.05 0.11 0.30 -0.51 0.02 0.00 0.00 175.30 175.18 1due s LEU 126 N 0.86 4.31 0.42 2.53 1.43 0.34 -0.62 118.68 127.94 1due s LEU 126 Ca 0.06 0.32 -0.13 0.00 -1.03 0.00 0.00 54.13 53.34 1due s LEU 126 Cb -0.13 -3.05 -0.08 0.00 0.03 0.00 0.00 46.19 42.97 1due s LEU 126 CO 0.03 0.07 0.83 -0.54 0.23 0.00 0.00 176.35 176.96 1due s LYS 127 N -2.93 3.89 1.02 1.70 1.02 0.16 -4.69 119.74 119.90 1due s LYS 127 Ca 0.37 0.67 -0.15 0.00 0.02 0.00 0.00 55.97 56.87 1due s LYS 127 Cb -0.12 -2.32 0.20 0.00 -0.52 0.00 0.00 37.83 35.07 1due s LYS 127 CO 0.28 -0.06 1.18 -2.14 -0.92 0.00 0.00 175.35 173.68 1due s PRO 128 N -3.71 0.27 1.13 -1.68 0.02 -1.26 -4.55 135.00 125.22 1due s PRO 128 Ca 0.54 0.01 -0.17 0.00 0.02 0.00 0.00 61.00 61.40 1due s PRO 128 Cb -0.10 -1.76 0.25 0.00 0.02 0.00 0.00 34.50 32.91 1due s PRO 128 CO 0.28 -2.73 1.13 0.16 -0.33 0.00 0.00 177.00 175.50 1due s ASP 129 N -4.19 1.53 0.57 2.53 1.47 0.44 -4.74 116.67 114.28 1due s ASP 129 Ca 0.69 0.71 0.35 0.00 1.18 0.00 0.00 52.55 55.48 1due s ASP 129 Cb -0.11 -1.04 1.92 0.00 -0.34 0.00 0.00 42.92 43.36 1due s ASP 129 CO 0.54 -3.76 2.08 0.06 0.68 0.00 0.00 175.17 174.77 1due h GLN 130 N -2.33 0.00 -0.12 2.11 3.07 -1.95 0.64 115.11 116.53 1due h GLN 130 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.27 1due h GLN 130 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.86 1due h GLN 130 CO 0.40 0.00 0.00 -1.71 0.09 0.00 0.00 178.83 177.61 1due n ASN 131 N -2.81 1.80 0.00 0.06 5.15 -1.26 -4.91 115.26 113.29 1due n ASN 131 Ca -0.02 -1.67 0.00 0.00 -0.60 0.00 0.00 54.58 52.29 1due n ASN 131 Cb 0.14 -0.07 0.00 0.00 -0.53 0.00 0.00 39.78 39.32 1due n ASN 131 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1due n GLY 132 N 1.18 0.43 3.67 8.20 0.00 0.22 -5.03 105.19 113.87 1due n GLY 132 Ca 0.17 -0.85 -0.37 0.00 0.00 0.00 0.00 46.02 44.97 1due n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1due s VAL 133 N -2.00 5.28 0.52 1.61 1.01 -1.25 -4.74 120.40 120.83 1due s VAL 133 Ca 0.00 0.47 -0.19 0.00 0.00 0.00 0.00 61.98 62.26 1due s VAL 133 Cb 0.00 -3.62 -0.07 0.00 0.00 0.00 0.00 36.38 32.68 1due s VAL 133 CO 0.00 0.30 1.05 -0.44 0.00 0.00 0.00 175.10 176.01 1due s SER 134 N 0.98 6.18 0.30 3.32 0.01 -1.26 -0.42 113.70 122.81 1due s SER 134 Ca 0.14 1.90 -0.01 0.00 1.31 0.00 0.00 55.95 59.29 1due s SER 134 Cb -0.14 -2.55 0.46 0.00 0.21 0.00 0.00 66.02 64.00 1due s SER 134 CO 0.06 -0.89 1.92 0.25 0.41 0.00 0.00 173.24 174.99 1due h LEU 135 N 1.24 0.84 -0.36 2.44 5.85 -1.88 -1.76 115.31 121.68 1due h LEU 135 Ca -0.49 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.16 1due h LEU 135 Cb 1.22 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.04 1due h LEU 135 CO 0.59 0.69 0.00 0.61 -0.34 0.00 0.00 178.44 179.98 1due n GLY 136 N -1.21 -0.80 0.11 3.75 0.00 -0.22 -1.38 105.19 105.43 1due n GLY 136 Ca 0.07 0.04 0.07 0.00 0.00 0.00 0.00 46.02 46.19 1due n GLY 136 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1due n ASP 137 N -1.74 0.84 0.01 1.61 8.00 -0.66 -4.03 116.55 120.58 1due n ASP 137 Ca 0.01 0.34 -0.16 0.00 0.71 0.00 0.00 54.79 55.69 1due n ASP 137 Cb 0.08 0.37 -0.14 0.00 -0.02 0.00 0.00 41.12 41.41 1due n ASP 137 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1due h LYS 138 N 0.00 0.17 -4.83 -1.24 1.57 -1.26 -3.47 116.57 107.51 1due h LYS 138 Ca -0.06 -0.29 -0.47 0.00 -1.87 0.00 0.00 60.65 57.96 1due h LYS 138 Cb 1.22 0.11 -0.31 0.00 0.08 0.00 0.00 32.23 33.33 1due h LYS 138 CO 0.02 0.94 -0.80 0.42 -0.57 0.00 0.00 179.45 179.46 1due s ILE 139 N -2.59 0.98 0.06 1.86 1.01 -0.50 -5.12 121.20 116.90 1due s ILE 139 Ca -0.12 -0.47 -0.30 0.00 0.00 0.00 0.00 60.65 59.75 1due s ILE 139 Cb 0.07 -0.86 -0.05 0.00 0.01 0.00 0.00 42.46 41.63 1due s ILE 139 CO 0.81 0.30 1.17 -0.44 0.00 0.00 0.00 174.94 176.78 1due s SER 140 N 0.12 7.12 0.99 3.58 0.01 -1.26 -4.20 113.70 120.05 1due s SER 140 Ca -0.03 1.98 -0.11 0.00 1.31 0.00 0.00 55.95 59.11 1due s SER 140 Cb -0.09 -2.58 0.19 0.00 0.21 0.00 0.00 66.02 63.75 1due s SER 140 CO 0.01 -0.43 1.10 -2.84 0.41 0.00 0.00 173.24 171.49 1due s PRO 141 N 0.96 0.42 0.38 12.44 0.02 -1.26 -4.80 135.00 143.16 1due s PRO 141 Ca 0.57 1.30 -0.27 0.00 0.02 0.00 0.00 61.00 62.62 1due s PRO 141 Cb -0.29 -1.68 -0.09 0.00 0.02 0.00 0.00 34.50 32.47 1due s PRO 141 CO 0.29 -2.96 1.27 0.00 -0.33 0.00 0.00 177.00 175.28 1due s ALA 142 N -2.60 3.31 0.01 -1.55 0.00 -0.39 -4.97 121.76 115.57 1due s ALA 142 Ca 0.67 1.18 -0.30 0.00 0.00 0.00 0.00 51.96 53.51 1due s ALA 142 Cb -0.23 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 1due s ALA 142 CO 0.60 -0.69 1.03 0.15 0.00 0.00 0.00 175.76 176.85 1due s LYS 143 N -2.10 4.52 -0.27 0.00 1.02 -1.26 -4.81 119.74 116.84 1due s LYS 143 Ca 0.54 1.50 -0.22 0.00 0.02 0.00 0.00 55.97 57.81 1due s LYS 143 Cb -0.37 -3.44 -0.01 0.00 -0.52 0.00 0.00 37.83 33.49 1due s LYS 143 CO 0.48 -0.11 0.73 0.42 -0.92 0.00 0.00 175.35 175.95 1due s ILE 144 N 1.08 4.88 0.00 2.17 -1.09 -1.26 -0.75 121.20 126.23 1due s ILE 144 Ca 0.53 1.22 0.00 0.00 -2.23 0.00 0.00 60.65 60.18 1due s ILE 144 Cb -0.23 -4.06 0.00 0.00 -1.58 0.00 0.00 42.46 36.59 1due s ILE 144 CO 0.28 -0.11 0.00 0.61 -1.23 0.00 0.00 174.94 174.49 1due n GLY 145 N 4.10 1.63 3.25 6.18 0.00 0.22 -4.86 105.19 115.72 1due n GLY 145 Ca 0.02 -1.53 -0.13 0.00 0.00 0.00 0.00 46.02 44.38 1due n GLY 145 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1due s THR 146 N 4.06 0.07 -1.83 2.61 -1.32 -1.26 -4.90 115.64 113.06 1due s THR 146 Ca 0.00 -0.55 0.23 0.00 -1.21 0.00 0.00 61.69 60.17 1due s THR 146 Cb 0.00 -0.76 0.03 0.00 -1.51 0.00 0.00 72.50 70.26 1due s THR 146 CO 0.00 -0.30 1.19 -1.54 -2.21 0.00 0.00 174.62 171.76 1due n SER 147 N 0.96 1.65 0.22 8.08 3.41 -0.02 -4.49 113.62 123.43 1due n SER 147 Ca -0.20 -1.28 0.15 0.00 -0.26 0.00 0.00 58.87 57.28 1due n SER 147 Cb 0.57 0.45 0.81 0.00 -0.26 0.00 0.00 64.21 65.78 1due n SER 147 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1due h ASN 148 N 1.83 0.00 -0.00 4.04 2.35 -1.94 -2.68 115.58 119.17 1due h ASN 148 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1due h ASN 148 Cb 0.67 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.04 1due h ASN 148 CO 0.00 0.00 -0.17 -0.90 -1.65 0.00 0.00 177.43 174.71 1due n ASP 149 N -3.99 2.33 -4.78 5.81 5.68 -1.26 -4.96 116.55 115.39 1due n ASP 149 Ca 0.01 -1.69 -0.32 0.00 -0.50 0.00 0.00 54.79 52.29 1due n ASP 149 Cb 0.26 0.16 0.06 0.00 -1.14 0.00 0.00 41.12 40.46 1due n ASP 149 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1due s LEU 150 N -2.19 3.22 0.06 -2.12 1.43 -1.01 -5.05 118.68 113.01 1due s LEU 150 Ca 0.26 1.88 -0.12 0.00 -1.03 0.00 0.00 54.13 55.12 1due s LEU 150 Cb 0.19 -4.53 0.01 0.00 0.03 0.00 0.00 46.19 41.90 1due s LEU 150 CO 0.41 -1.76 0.26 -1.59 0.23 0.00 0.00 176.35 173.89 1due s LYS 151 N -4.53 0.80 0.16 1.70 -2.85 -1.26 -5.09 119.74 108.67 1due s LYS 151 Ca 0.63 -0.65 -0.33 0.00 -1.00 0.00 0.00 55.97 54.63 1due s LYS 151 Cb -0.18 0.34 -0.16 0.00 -2.06 0.00 0.00 37.83 35.77 1due s LYS 151 CO 0.49 -0.26 1.06 -3.47 0.10 0.00 0.00 175.35 173.27 1due n ASP 152 N 0.42 0.84 0.00 0.03 -0.08 -1.26 -1.09 116.55 115.40 1due n ASP 152 Ca -0.18 1.14 0.00 0.00 -1.51 0.00 0.00 54.79 54.25 1due n ASP 152 Cb 0.60 -1.15 0.00 0.00 2.34 0.00 0.00 41.12 42.91 1due n ASP 152 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1due n GLY 153 N 1.91 3.36 3.72 0.27 0.00 0.42 -4.97 105.19 109.90 1due n GLY 153 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1due n GLY 153 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1due n ASP 154 N 0.01 2.86 -4.54 1.61 8.00 -0.25 -4.56 116.55 119.67 1due n ASP 154 Ca 0.00 1.13 -0.34 0.00 0.71 0.00 0.00 54.79 56.29 1due n ASP 154 Cb 0.00 -1.54 -0.11 0.00 -0.02 0.00 0.00 41.12 39.45 1due n ASP 154 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1due s LYS 155 N -2.24 3.75 0.30 -1.24 -0.14 -1.26 0.06 119.74 118.96 1due s LYS 155 Ca 0.60 -0.47 0.02 0.00 -1.36 0.00 0.00 55.97 54.77 1due s LYS 155 Cb -0.49 -2.99 -0.05 0.00 -1.68 0.00 0.00 37.83 32.62 1due s LYS 155 CO 0.59 0.26 0.11 -0.51 -0.76 0.00 0.00 175.35 175.04 1due s LEU 156 N 0.33 1.77 -0.20 3.17 1.43 -0.26 -4.85 118.68 120.07 1due s LEU 156 Ca -0.02 -1.45 -0.04 0.00 -1.03 0.00 0.00 54.13 51.59 1due s LEU 156 Cb -0.14 -0.01 -0.02 0.00 0.03 0.00 0.00 46.19 46.05 1due s LEU 156 CO 0.02 -0.77 -0.03 -1.61 0.23 0.00 0.00 176.35 174.20 1due s GLU 157 N -3.93 3.52 -0.22 1.70 0.41 -0.86 -1.09 118.70 118.23 1due s GLU 157 Ca 0.36 -0.57 -0.07 0.00 -0.41 0.00 0.00 54.97 54.28 1due s GLU 157 Cb 0.07 -3.01 -0.03 0.00 -1.78 0.00 0.00 34.13 29.37 1due s GLU 157 CO 0.15 -0.03 0.06 -1.17 -0.49 0.00 0.00 175.26 173.77 1due s LEU 158 N 1.09 3.54 -0.15 1.80 0.20 0.37 -0.94 118.68 124.59 1due s LEU 158 Ca 0.02 -0.11 0.02 0.00 0.69 0.00 0.00 54.13 54.75 1due s LEU 158 Cb -0.15 -1.92 0.01 0.00 -0.43 0.00 0.00 46.19 43.70 1due s LEU 158 CO 0.01 0.05 -0.21 -0.63 -0.29 0.00 0.00 176.35 175.28 1due s ILE 159 N 1.08 2.12 0.00 6.68 1.01 -0.19 -0.06 121.20 131.84 1due s ILE 159 Ca 0.04 -0.96 0.00 0.00 0.00 0.00 0.00 60.65 59.73 1due s ILE 159 Cb -0.14 -1.85 0.00 0.00 0.01 0.00 0.00 42.46 40.47 1due s ILE 159 CO 0.03 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.12 1due n GLY 160 N 4.12 1.69 3.06 6.18 0.00 -0.72 -2.13 105.19 117.39 1due n GLY 160 Ca -0.20 -0.88 -0.34 0.00 0.00 0.00 0.00 46.02 44.59 1due n GLY 160 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1due s TYR 161 N -5.73 3.42 -1.08 1.61 2.02 -1.26 -1.04 117.35 115.28 1due s TYR 161 Ca 0.00 -2.79 -0.14 0.00 -0.37 0.00 0.00 57.07 53.77 1due s TYR 161 Cb 0.00 -3.10 -0.07 0.00 -0.40 0.00 0.00 41.96 38.39 1due s TYR 161 CO 0.00 -0.85 2.19 -0.35 -1.57 0.00 0.00 175.55 174.97 1due n PRO 162 N 3.68 2.27 -0.32 -1.71 -0.04 -1.26 -3.67 135.00 133.96 1due n PRO 162 Ca 0.05 -1.95 -0.02 0.00 -0.04 0.00 0.00 63.50 61.54 1due n PRO 162 Cb 0.38 -2.85 0.02 0.00 -0.04 0.00 0.00 33.50 31.01 1due n PRO 162 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1due n PHE 163 N 5.71 -0.01 0.21 0.54 -0.00 -1.25 0.30 117.46 122.96 1due n PHE 163 Ca 0.53 1.01 0.13 0.00 -0.00 0.00 0.00 57.45 59.12 1due n PHE 163 Cb 0.30 -0.78 0.70 0.00 -0.00 0.00 0.00 39.48 39.69 1due n PHE 163 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 1due h ASP 164 N 0.00 0.00 0.00 -2.13 5.19 -1.92 -2.96 116.42 114.60 1due h ASP 164 Ca 0.27 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.64 1due h ASP 164 Cb 0.47 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.98 1due h ASP 164 CO -0.81 0.00 -0.94 1.57 -3.12 0.00 0.00 179.24 175.95 1due n HIS 165 N -2.44 0.39 -3.77 4.55 -0.00 0.15 -4.99 115.22 109.10 1due n HIS 165 Ca -0.02 0.17 -0.15 0.00 0.46 0.00 0.00 57.72 58.18 1due n HIS 165 Cb 0.12 -0.66 -0.16 0.00 -0.12 0.00 0.00 29.99 29.17 1due n HIS 165 CO 0.00 0.00 0.00 0.15 0.46 0.00 0.00 176.34 176.95 1due s LYS 166 N -2.62 -0.02 0.11 1.57 -0.14 -0.89 -5.14 119.74 112.62 1due s LYS 166 Ca -0.24 0.20 -0.30 0.00 -1.36 0.00 0.00 55.97 54.27 1due s LYS 166 Cb 0.04 -0.23 -0.07 0.00 -1.68 0.00 0.00 37.83 35.89 1due s LYS 166 CO 0.36 -0.16 1.21 0.08 -0.76 0.00 0.00 175.35 176.08 1due s VAL 167 N 1.04 3.81 -1.61 3.17 1.01 -1.24 -3.77 120.40 122.81 1due s VAL 167 Ca -0.09 1.38 -0.15 0.00 0.00 0.00 0.00 61.98 63.12 1due s VAL 167 Cb -0.12 -3.88 0.12 0.00 0.00 0.00 0.00 36.38 32.49 1due s VAL 167 CO -0.03 0.15 0.84 0.59 0.00 0.00 0.00 175.10 176.65 1due n ASN 168 N 3.38 -3.64 -3.98 3.32 3.02 -1.26 -4.46 115.26 111.65 1due n ASN 168 Ca 0.07 -0.92 -0.30 0.00 -0.03 0.00 0.00 54.58 53.40 1due n ASN 168 Cb 0.45 -3.23 -0.16 0.00 -0.61 0.00 0.00 39.78 36.24 1due n ASN 168 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1due s GLN 169 N -6.77 1.86 0.13 3.52 -0.21 -1.25 -1.77 119.66 115.17 1due s GLN 169 Ca 0.65 -0.93 -0.31 0.00 0.02 0.00 0.00 55.36 54.79 1due s GLN 169 Cb -0.34 -2.50 -0.09 0.00 1.00 0.00 0.00 33.01 31.08 1due s GLN 169 CO 0.89 -0.51 1.46 1.41 -2.12 0.00 0.00 175.29 176.42 1due s MET 170 N 1.38 4.28 0.11 2.91 -2.45 -1.26 -4.32 119.30 119.95 1due s MET 170 Ca -0.04 2.19 0.05 0.00 -1.25 0.00 0.00 55.69 56.64 1due s MET 170 Cb -0.17 -3.23 -0.04 0.00 1.25 0.00 0.00 34.83 32.64 1due s MET 170 CO -0.07 -0.51 -0.13 -1.01 1.05 0.00 0.00 175.02 174.35 1due s HIS 171 N 1.18 1.27 0.01 4.11 3.76 -0.21 -0.62 115.29 124.78 1due s HIS 171 Ca 0.67 -0.57 0.04 0.00 -0.15 0.00 0.00 55.06 55.05 1due s HIS 171 Cb -0.39 -0.68 -0.03 0.00 1.11 0.00 0.00 32.58 32.59 1due s HIS 171 CO 0.31 0.09 -0.09 -0.98 -0.85 0.00 0.00 174.74 173.21 1due s ARG 172 N -2.53 2.46 -0.05 1.40 1.70 0.33 -1.75 118.95 120.50 1due s ARG 172 Ca 0.06 -0.77 0.02 0.00 -0.47 0.00 0.00 55.73 54.58 1due s ARG 172 Cb -0.05 -2.43 0.01 0.00 -0.57 0.00 0.00 34.95 31.90 1due s ARG 172 CO 0.02 0.59 -0.11 -1.12 -1.08 0.00 0.00 175.30 173.61 1due s SER 173 N -1.36 1.54 0.00 -2.89 0.01 0.92 -1.92 113.70 110.00 1due s SER 173 Ca 0.16 -0.25 -0.26 0.00 1.31 0.00 0.00 55.95 56.91 1due s SER 173 Cb -0.11 -0.62 -0.04 0.00 0.21 0.00 0.00 66.02 65.46 1due s SER 173 CO 0.06 0.04 0.80 -0.70 0.41 0.00 0.00 173.24 173.85 1due s GLU 174 N 0.52 4.50 0.16 12.44 2.12 -0.05 -0.48 118.70 137.92 1due s GLU 174 Ca -0.10 1.09 0.11 0.00 0.36 0.00 0.00 54.97 56.43 1due s GLU 174 Cb -0.13 -3.41 -0.04 0.00 0.26 0.00 0.00 34.13 30.80 1due s GLU 174 CO 0.02 0.14 -0.25 0.96 -0.54 0.00 0.00 175.26 175.59 1due s ILE 175 N 0.44 2.30 -0.21 -3.70 -4.36 -0.25 -4.55 121.20 110.88 1due s ILE 175 Ca 0.41 -1.91 0.01 0.00 -0.26 0.00 0.00 60.65 58.91 1due s ILE 175 Cb -0.20 -2.06 0.04 0.00 1.25 0.00 0.00 42.46 41.49 1due s ILE 175 CO 0.23 -0.03 -0.12 -0.70 0.24 0.00 0.00 174.94 174.56 1due s GLU 176 N -2.40 2.24 0.48 0.37 2.12 -0.26 -1.10 118.70 120.15 1due s GLU 176 Ca 0.18 -0.94 -0.23 0.00 0.36 0.00 0.00 54.97 54.33 1due s GLU 176 Cb -0.09 -2.54 -0.07 0.00 0.26 0.00 0.00 34.13 31.70 1due s GLU 176 CO 0.08 -0.42 1.31 -0.51 -0.54 0.00 0.00 175.26 175.19 1due s LEU 177 N 1.32 4.00 0.00 2.70 1.43 0.11 -0.84 118.68 127.41 1due s LEU 177 Ca -0.02 2.66 0.00 0.00 -1.03 0.00 0.00 54.13 55.74 1due s LEU 177 Cb -0.16 -4.14 0.00 0.00 0.03 0.00 0.00 46.19 41.92 1due s LEU 177 CO -0.08 -1.21 0.00 1.07 0.23 0.00 0.00 176.35 176.36 1due n THR 178 N -0.53 0.00 -1.43 5.49 5.66 -0.61 -0.43 114.28 122.42 1due n THR 178 Ca 0.07 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.82 1due n THR 178 Cb 0.45 0.00 -0.20 0.00 -1.55 0.00 0.00 70.33 69.03 1due n THR 178 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1due n THR 179 N 0.00 0.00 1.88 1.09 -2.24 -1.26 -4.47 114.28 109.28 1due n THR 179 Ca 0.00 -0.36 0.14 0.00 -2.27 0.00 0.00 64.05 61.56 1due n THR 179 Cb 0.00 -0.11 0.76 0.00 -2.10 0.00 0.00 70.33 68.88 1due n THR 179 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1due n LEU 180 N 6.35 0.32 0.19 3.22 4.77 -1.26 -3.59 117.00 127.00 1due n LEU 180 Ca 0.64 -0.12 0.05 0.00 -0.03 0.00 0.00 56.01 56.56 1due n LEU 180 Cb 0.11 -0.01 0.33 0.00 -2.33 0.00 0.00 43.42 41.52 1due n LEU 180 CO 1.01 0.06 0.67 0.77 -1.33 0.00 0.00 177.39 178.57 1due h SER 181 N 0.48 0.00 -0.63 -1.43 4.64 -2.01 -2.88 113.55 111.72 1due h SER 181 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1due h SER 181 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1due h SER 181 CO 0.00 0.38 0.00 0.54 -0.87 0.00 0.00 176.83 176.88 1due n ARG 182 N -3.53 2.58 0.00 4.77 1.74 -1.24 -5.06 116.66 115.93 1due n ARG 182 Ca -0.00 -2.44 0.00 0.00 -0.77 0.00 0.00 57.85 54.64 1due n ARG 182 Cb 0.52 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 1due n ARG 182 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1due n GLY 183 N 1.58 0.60 3.55 -0.13 0.00 -1.09 -4.93 105.19 104.78 1due n GLY 183 Ca 0.22 -2.32 -0.39 0.00 0.00 0.00 0.00 46.02 43.54 1due n GLY 183 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1due s LEU 184 N 0.00 3.26 0.07 0.99 2.96 -1.25 -4.23 118.68 120.47 1due s LEU 184 Ca 0.00 -0.44 0.08 0.00 -0.22 0.00 0.00 54.13 53.55 1due s LEU 184 Cb 0.00 -2.55 -0.03 0.00 0.50 0.00 0.00 46.19 44.10 1due s LEU 184 CO 0.00 -2.03 -0.20 -0.13 -1.32 0.00 0.00 176.35 172.67 1due s ARG 185 N 6.11 1.92 0.05 1.98 0.52 -1.26 -0.75 118.95 127.51 1due s ARG 185 Ca 0.50 -1.07 -0.27 0.00 -0.52 0.00 0.00 55.73 54.37 1due s ARG 185 Cb -0.08 -2.12 0.09 0.00 0.52 0.00 0.00 34.95 33.36 1due s ARG 185 CO 0.10 0.52 0.75 1.52 0.02 0.00 0.00 175.30 178.21 1due s TYR 186 N -0.97 -0.47 0.20 -0.53 1.13 -0.73 -1.58 117.35 114.40 1due s TYR 186 Ca 0.15 0.41 -0.14 0.00 -1.41 0.00 0.00 57.07 56.09 1due s TYR 186 Cb -0.10 0.52 -0.07 0.00 -1.10 0.00 0.00 41.96 41.21 1due s TYR 186 CO 0.06 -0.67 0.60 0.71 -2.51 0.00 0.00 175.55 173.74 1due s TYR 187 N -2.98 3.53 0.00 -3.49 2.02 -0.02 -2.11 117.35 114.32 1due s TYR 187 Ca 0.01 1.07 0.00 0.00 -0.37 0.00 0.00 57.07 57.78 1due s TYR 187 Cb -0.01 -2.39 0.00 0.00 -0.40 0.00 0.00 41.96 39.16 1due s TYR 187 CO -0.07 0.33 0.00 0.41 -1.57 0.00 0.00 175.55 174.65 1due n GLY 188 N 0.40 3.02 3.65 0.71 0.00 -1.26 -1.11 105.19 110.61 1due n GLY 188 Ca -0.02 -1.04 -0.39 0.00 0.00 0.00 0.00 46.02 44.57 1due n GLY 188 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1due s PHE 189 N -2.00 3.35 0.07 1.61 5.36 -1.26 -4.92 117.98 120.19 1due s PHE 189 Ca 0.00 0.71 -0.10 0.00 -0.96 0.00 0.00 56.93 56.58 1due s PHE 189 Cb 0.00 -2.65 0.01 0.00 -0.34 0.00 0.00 43.02 40.03 1due s PHE 189 CO 0.00 -0.12 0.22 0.95 -1.46 0.00 0.00 175.22 174.81 1due s THR 190 N 1.72 0.12 0.32 0.12 -4.23 -1.26 -4.87 115.64 107.57 1due s THR 190 Ca 0.22 -1.00 0.03 0.00 -1.18 0.00 0.00 61.69 59.77 1due s THR 190 Cb -0.15 -1.17 -0.06 0.00 1.34 0.00 0.00 72.50 72.46 1due s THR 190 CO 0.09 -0.55 0.07 0.68 -0.54 0.00 0.00 174.62 174.37 1due s VAL 191 N -3.37 1.03 0.34 2.29 -7.23 -1.26 -5.03 120.40 107.17 1due s VAL 191 Ca 0.01 -2.00 0.13 0.00 -1.81 0.00 0.00 61.98 58.31 1due s VAL 191 Cb 0.02 -2.72 0.34 0.00 0.56 0.00 0.00 36.38 34.58 1due s VAL 191 CO -0.08 0.00 1.72 -0.65 -0.31 0.00 0.00 175.10 175.77 1due h PRO 192 N 2.12 0.46 0.00 4.82 0.11 -1.96 -0.13 132.00 137.42 1due h PRO 192 Ca -0.40 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 1due h PRO 192 Cb 1.25 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1due h PRO 192 CO 0.67 0.30 -0.00 0.78 -0.21 0.00 0.00 178.00 179.54 1due h GLY 193 N 0.47 0.00 1.98 -0.55 0.00 -1.81 -1.92 103.07 101.24 1due h GLY 193 Ca 0.66 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.99 1due h GLY 193 CO -0.47 0.00 0.00 0.70 0.00 0.00 0.00 176.54 176.77 1due n ASN 194 N -3.10 0.00 -4.66 0.19 4.13 -0.06 -2.95 115.26 108.81 1due n ASN 194 Ca -0.01 0.48 -0.51 0.00 1.68 0.00 0.00 54.58 56.22 1due n ASN 194 Cb 0.19 -0.49 -0.05 0.00 -1.54 0.00 0.00 39.78 37.88 1due n ASN 194 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1due n ALA 195 N -1.49 0.22 -0.31 5.41 0.00 -0.73 -0.53 120.51 123.08 1due n ALA 195 Ca 0.03 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1due n ALA 195 Cb 0.15 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.33 1due n ALA 195 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1due n GLY 196 N 3.53 0.74 3.77 0.00 0.00 -0.54 -1.11 105.19 111.58 1due n GLY 196 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 1due n GLY 196 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1due s SER 197 N -2.57 6.31 0.24 1.61 0.01 0.30 -3.54 113.70 116.06 1due s SER 197 Ca 0.00 2.36 -0.22 0.00 1.31 0.00 0.00 55.95 59.40 1due s SER 197 Cb 0.00 -2.61 -0.09 0.00 0.21 0.00 0.00 66.02 63.53 1due s SER 197 CO 0.00 -0.83 0.78 -0.83 0.41 0.00 0.00 173.24 172.78 1due s GLY 198 N -1.20 2.71 -0.23 3.44 0.00 -0.91 -0.45 107.32 110.68 1due s GLY 198 Ca 0.60 0.28 -0.02 0.00 0.00 0.00 0.00 44.72 45.59 1due s GLY 198 CO 0.38 0.68 -0.08 -0.42 0.00 0.00 0.00 173.10 173.66 1due s ILE 199 N -1.49 2.86 0.12 0.90 1.01 -0.03 -1.02 121.20 123.55 1due s ILE 199 Ca 0.44 -0.90 0.08 0.00 0.00 0.00 0.00 60.65 60.27 1due s ILE 199 Cb -0.18 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.86 1due s ILE 199 CO 0.22 0.30 -0.15 -0.36 0.00 0.00 0.00 174.94 174.95 1due s PHE 200 N 1.35 2.59 0.50 3.97 0.40 -0.11 -0.20 117.98 126.49 1due s PHE 200 Ca 0.02 -0.23 0.06 0.00 -0.60 0.00 0.00 56.93 56.17 1due s PHE 200 Cb -0.16 -1.36 0.04 0.00 0.51 0.00 0.00 43.02 42.05 1due s PHE 200 CO -0.05 0.41 0.70 0.54 0.70 0.00 0.00 175.22 177.51 1due s ASN 201 N -2.22 5.36 0.59 1.36 2.20 -0.47 -2.03 114.94 119.73 1due s ASN 201 Ca 0.19 -0.37 0.29 0.00 -0.94 0.00 0.00 52.86 52.04 1due s ASN 201 Cb -0.11 -0.52 1.44 0.00 -2.00 0.00 0.00 41.25 40.06 1due s ASN 201 CO 0.11 -1.04 1.85 0.77 -2.94 0.00 0.00 177.10 175.85 1due h SER 202 N 0.32 0.00 0.16 3.54 4.64 -1.90 0.59 113.55 120.89 1due h SER 202 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1due h SER 202 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1due h SER 202 CO 0.46 0.00 -0.01 -3.20 -0.87 0.00 0.00 176.83 173.21 1due n ASN 203 N -3.71 0.11 -0.08 4.97 2.85 -1.26 -4.88 115.26 113.26 1due n ASN 203 Ca 0.10 -0.79 -0.01 0.00 -0.11 0.00 0.00 54.58 53.78 1due n ASN 203 Cb 0.77 -0.08 -0.00 0.00 1.24 0.00 0.00 39.78 41.71 1due n ASN 203 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1due n GLY 204 N 1.10 0.48 3.87 8.20 0.00 0.21 -5.03 105.19 114.01 1due n GLY 204 Ca 0.21 -0.77 -0.36 0.00 0.00 0.00 0.00 46.02 45.10 1due n GLY 204 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1due s GLU 205 N -1.62 3.66 -0.22 1.61 2.02 -1.25 -4.57 118.70 118.34 1due s GLU 205 Ca 0.00 0.07 -0.29 0.00 0.02 0.00 0.00 54.97 54.77 1due s GLU 205 Cb 0.00 -3.13 0.00 0.00 0.10 0.00 0.00 34.13 31.10 1due s GLU 205 CO 0.00 0.68 1.14 -1.17 0.02 0.00 0.00 175.26 175.92 1due s LEU 206 N -1.43 4.09 0.00 1.80 2.96 0.07 -1.37 118.68 124.81 1due s LEU 206 Ca 0.24 1.43 0.05 0.00 -0.22 0.00 0.00 54.13 55.63 1due s LEU 206 Cb -0.14 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.01 1due s LEU 206 CO 0.13 -0.75 0.46 1.33 -1.32 0.00 0.00 176.35 176.19 1due n VAL 207 N 5.46 0.00 -3.64 1.68 0.24 0.72 -0.61 118.33 122.19 1due n VAL 207 Ca 0.13 -0.45 0.00 0.00 -2.04 0.00 0.00 64.34 61.98 1due n VAL 207 Cb 0.46 1.06 -0.01 0.00 -1.47 0.00 0.00 33.84 33.88 1due n VAL 207 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1due s GLY 208 N -0.86 -0.38 -0.06 7.63 0.00 -1.15 -1.54 107.32 110.96 1due s GLY 208 Ca 0.04 0.67 0.02 0.00 0.00 0.00 0.00 44.72 45.45 1due s GLY 208 CO 0.12 0.13 -0.09 -0.42 0.00 0.00 0.00 173.10 172.83 1due s ILE 209 N -2.55 0.92 0.47 0.90 -1.09 -0.41 -0.85 121.20 118.59 1due s ILE 209 Ca 0.13 -0.35 -0.23 0.00 -2.23 0.00 0.00 60.65 57.97 1due s ILE 209 Cb 0.04 -0.86 -0.07 0.00 -1.58 0.00 0.00 42.46 39.98 1due s ILE 209 CO -0.03 0.31 1.21 -2.28 -1.23 0.00 0.00 174.94 172.92 1due s HIS 210 N 0.73 2.78 0.04 3.97 5.65 0.41 -0.35 115.29 128.52 1due s HIS 210 Ca -0.13 1.50 -0.00 0.00 0.25 0.00 0.00 55.06 56.67 1due s HIS 210 Cb -0.15 -3.49 -0.00 0.00 -1.18 0.00 0.00 32.58 27.76 1due s HIS 210 CO 0.02 -1.80 -0.00 0.45 -0.65 0.00 0.00 174.74 172.76 1due n SER 211 N -0.48 0.50 0.00 9.88 2.88 -0.32 -1.47 113.62 124.62 1due n SER 211 Ca 0.07 0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.68 1due n SER 211 Cb 0.47 -0.16 0.00 0.00 -0.75 0.00 0.00 64.21 63.77 1due n SER 211 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1due n SER 212 N -2.95 0.00 -4.57 -3.46 3.41 -0.69 -4.52 113.62 100.83 1due n SER 212 Ca -0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.29 1due n SER 212 Cb 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 1due n SER 212 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1due s LYS 213 N 1.22 2.54 0.14 4.33 1.02 -1.26 0.85 119.74 128.58 1due s LYS 213 Ca 0.00 -0.71 0.01 0.00 0.02 0.00 0.00 55.97 55.28 1due s LYS 213 Cb 0.00 -2.48 -0.04 0.00 -0.52 0.00 0.00 37.83 34.79 1due s LYS 213 CO 0.00 0.61 0.01 0.14 -0.92 0.00 0.00 175.35 175.19 1due s VAL 214 N -0.94 0.46 0.68 3.17 -7.23 -0.70 -4.91 120.40 110.92 1due s VAL 214 Ca 0.16 -1.94 -0.17 0.00 -1.81 0.00 0.00 61.98 58.22 1due s VAL 214 Cb -0.11 -1.98 0.01 0.00 0.56 0.00 0.00 36.38 34.85 1due s VAL 214 CO 0.06 -0.57 1.25 -0.94 -0.31 0.00 0.00 175.10 174.59 1due s SER 215 N -3.09 4.49 -0.13 4.85 1.04 -1.26 -2.15 113.70 117.45 1due s SER 215 Ca 0.21 2.49 -0.10 0.00 0.48 0.00 0.00 55.95 59.04 1due s SER 215 Cb 0.07 -2.61 0.04 0.00 0.10 0.00 0.00 66.02 63.62 1due s SER 215 CO 0.01 -2.07 0.33 -2.28 0.98 0.00 0.00 173.24 170.20 1due s HIS 216 N -1.65 -0.40 0.00 5.02 5.04 0.16 -4.75 115.29 118.72 1due s HIS 216 Ca 0.79 0.93 0.00 0.00 -1.54 0.00 0.00 55.06 55.24 1due s HIS 216 Cb -0.33 0.13 0.00 0.00 0.04 0.00 0.00 32.58 32.42 1due s HIS 216 CO 0.41 -0.21 0.00 1.28 -2.34 0.00 0.00 174.74 173.88 1due n LEU 217 N 3.40 0.00 0.00 8.88 4.77 -1.26 -4.11 117.00 128.67 1due n LEU 217 Ca -0.17 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 1due n LEU 217 Cb 0.56 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 1due n LEU 217 CO 0.14 0.00 0.00 -0.90 -1.33 0.00 0.00 177.39 175.30 1due n ASP 218 N 2.28 0.90 -0.21 -1.43 5.68 -1.26 -4.69 116.55 117.81 1due n ASP 218 Ca 0.00 -0.85 0.14 0.00 -0.50 0.00 0.00 54.79 53.59 1due n ASP 218 Cb 0.00 0.00 0.62 0.00 -1.14 0.00 0.00 41.12 40.60 1due n ASP 218 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1due n ARG 219 N 0.00 1.04 -0.01 0.11 5.12 -1.26 -3.91 116.66 117.75 1due n ARG 219 Ca 0.00 -0.43 0.05 0.00 -1.93 0.00 0.00 57.85 55.55 1due n ARG 219 Cb 0.00 -1.49 0.05 0.00 -1.16 0.00 0.00 32.46 29.86 1due n ARG 219 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1due n GLU 220 N -0.61 0.57 -4.45 5.56 1.02 -1.26 -4.95 120.64 116.52 1due n GLU 220 Ca 0.17 -1.17 -0.25 0.00 -0.02 0.00 0.00 57.16 55.90 1due n GLU 220 Cb 0.28 -1.21 -0.11 0.00 -0.02 0.00 0.00 31.44 30.38 1due n GLU 220 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1due s HIS 221 N -0.90 2.29 0.37 -0.32 3.76 -1.25 -5.03 115.29 114.21 1due s HIS 221 Ca 0.13 -0.34 0.08 0.00 -0.15 0.00 0.00 55.06 54.78 1due s HIS 221 Cb 0.09 -1.04 -0.07 0.00 1.11 0.00 0.00 32.58 32.67 1due s HIS 221 CO 0.13 0.64 -0.01 -0.65 -0.85 0.00 0.00 174.74 174.00 1due s GLN 222 N -3.20 1.96 0.06 1.40 -0.21 -1.26 0.40 119.66 118.80 1due s GLN 222 Ca 0.27 -1.95 -0.26 0.00 0.02 0.00 0.00 55.36 53.43 1due s GLN 222 Cb -0.06 -1.75 0.08 0.00 1.00 0.00 0.00 33.01 32.28 1due s GLN 222 CO 0.13 0.05 0.71 -1.50 -2.12 0.00 0.00 175.29 172.56 1due s ILE 223 N -2.63 0.00 0.33 1.08 1.10 -0.91 -4.71 121.20 115.46 1due s ILE 223 Ca 0.35 0.00 -0.26 0.00 -0.51 0.00 0.00 60.65 60.22 1due s ILE 223 Cb 0.05 -1.00 -0.10 0.00 0.15 0.00 0.00 42.46 41.56 1due s ILE 223 CO 0.18 0.00 0.98 0.20 -2.11 0.00 0.00 174.94 174.19 1due s ASN 224 N -2.31 7.23 -0.06 4.50 0.01 -0.90 -1.73 114.94 121.68 1due s ASN 224 Ca -0.00 1.93 0.03 0.00 -0.71 0.00 0.00 52.86 54.11 1due s ASN 224 Cb -0.01 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 39.07 1due s ASN 224 CO -0.07 -0.15 -0.16 -0.47 -1.51 0.00 0.00 177.10 174.74 1due s TYR 225 N -1.55 1.70 0.32 2.20 5.04 0.25 -1.77 117.35 123.54 1due s TYR 225 Ca 0.51 -0.59 0.03 0.00 -2.44 0.00 0.00 57.07 54.58 1due s TYR 225 Cb -0.21 -1.19 -0.04 0.00 0.35 0.00 0.00 41.96 40.87 1due s TYR 225 CO 0.27 -0.25 0.11 0.20 -1.34 0.00 0.00 175.55 174.54 1due s GLY 226 N 0.37 2.11 -0.24 8.97 0.00 0.07 -1.17 107.32 117.43 1due s GLY 226 Ca -0.11 -1.74 -0.04 0.00 0.00 0.00 0.00 44.72 42.83 1due s GLY 226 CO 0.04 -1.71 -0.02 0.14 0.00 0.00 0.00 173.10 171.55 1due s VAL 227 N -3.47 3.35 0.43 1.40 1.01 0.53 -3.96 120.40 119.69 1due s VAL 227 Ca 0.34 -0.68 -0.21 0.00 0.00 0.00 0.00 61.98 61.43 1due s VAL 227 Cb 0.06 -2.61 -0.10 0.00 0.00 0.00 0.00 36.38 33.73 1due s VAL 227 CO 0.15 0.29 0.97 -0.83 0.00 0.00 0.00 175.10 175.69 1due s GLY 228 N 1.44 2.44 -1.07 4.51 0.00 -1.26 -1.29 107.32 112.08 1due s GLY 228 Ca 0.04 0.45 -0.19 0.00 0.00 0.00 0.00 44.72 45.02 1due s GLY 228 CO -0.03 0.75 1.38 -0.42 0.00 0.00 0.00 173.10 174.78 1due s ILE 229 N -2.11 4.49 0.07 0.90 -1.09 -0.59 -4.85 121.20 118.03 1due s ILE 229 Ca 0.62 -1.66 0.00 0.00 -2.23 0.00 0.00 60.65 57.38 1due s ILE 229 Cb -0.11 -4.95 0.01 0.00 -1.58 0.00 0.00 42.46 35.84 1due s ILE 229 CO 0.15 -1.73 0.10 0.61 -1.23 0.00 0.00 174.94 172.84 1due n GLY 230 N 5.52 0.94 0.24 6.18 0.00 -1.26 -0.84 105.19 115.96 1due n GLY 230 Ca 0.33 -1.99 -0.01 0.00 0.00 0.00 0.00 46.02 44.35 1due n GLY 230 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1due h ASN 231 N -0.05 0.36 -0.26 1.61 4.21 -1.99 -1.67 115.58 117.79 1due h ASN 231 Ca -0.03 0.05 -0.04 0.00 1.21 0.00 0.00 56.30 57.49 1due h ASN 231 Cb 0.12 -0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.31 1due h ASN 231 CO 0.04 0.22 -0.00 0.22 -1.29 0.00 0.00 177.43 176.62 1due h TYR 232 N 0.51 0.50 -0.55 1.19 3.20 -1.97 -2.70 116.97 117.15 1due h TYR 232 Ca 0.29 -0.09 -0.05 0.00 3.14 0.00 0.00 58.73 62.03 1due h TYR 232 Cb 0.28 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 1due h TYR 232 CO -0.12 0.62 0.16 0.28 -1.64 0.00 0.00 178.16 177.45 1due h VAL 233 N 0.23 1.24 -0.82 1.81 2.07 -1.83 -2.78 116.25 116.16 1due h VAL 233 Ca 0.07 -0.82 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 1due h VAL 233 Cb 0.42 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 1due h VAL 233 CO 0.01 0.30 0.51 0.11 0.02 0.00 0.00 177.57 178.53 1due h LYS 234 N 0.77 1.11 -0.18 1.57 1.57 -1.32 -1.26 116.57 118.83 1due h LYS 234 Ca 0.18 -0.09 0.04 0.00 -1.87 0.00 0.00 60.65 58.90 1due h LYS 234 Cb 0.30 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1due h LYS 234 CO -0.00 0.77 -0.05 -0.09 -0.57 0.00 0.00 179.45 179.50 1due h ARG 235 N 1.13 -0.01 -0.71 3.15 2.43 -1.30 0.85 114.38 119.91 1due h ARG 235 Ca 0.30 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.40 1due h ARG 235 Cb -0.07 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 1due h ARG 235 CO -0.06 -0.00 0.18 0.82 -1.51 0.00 0.00 179.97 179.40 1due h ILE 236 N -0.01 1.26 0.11 1.20 1.08 -1.22 -1.45 117.51 118.49 1due h ILE 236 Ca 0.09 -0.95 -0.01 0.00 -0.39 0.00 0.00 64.86 63.60 1due h ILE 236 Cb 0.14 0.52 0.00 0.00 -3.07 0.00 0.00 36.82 34.41 1due h ILE 236 CO -0.19 0.37 -0.05 0.40 -0.69 0.00 0.00 178.15 177.99 1due h ILE 237 N 1.07 0.99 -0.36 -0.67 2.04 -0.85 0.14 117.51 119.87 1due h ILE 237 Ca 0.23 -0.38 0.04 0.00 1.00 0.00 0.00 64.86 65.75 1due h ILE 237 Cb 0.35 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 1due h ILE 237 CO -0.00 0.09 0.24 0.78 0.00 0.00 0.00 178.15 179.26 1due h ASN 238 N -0.32 0.27 -0.09 1.72 2.35 -0.72 0.57 115.58 119.37 1due h ASN 238 Ca -0.02 -0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.57 1due h ASN 238 Cb 0.26 -0.06 0.01 0.00 0.05 0.00 0.00 38.32 38.58 1due h ASN 238 CO 0.02 0.19 -0.58 -0.08 -1.65 0.00 0.00 177.43 175.33 1due h GLU 239 N 0.32 0.55 -0.02 0.81 4.81 -0.90 -3.37 114.58 116.78 1due h GLU 239 Ca 0.15 -0.47 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1due h GLU 239 Cb 0.21 0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.70 1due h GLU 239 CO -0.03 1.10 -0.19 1.63 -0.73 0.00 0.00 179.01 180.79 1due n LYS 240 N -4.17 1.53 -2.00 1.92 5.02 0.00 -5.02 118.16 115.44 1due n LYS 240 Ca -0.08 -1.08 -0.35 0.00 -2.02 0.00 0.00 58.31 54.77 1due n LYS 240 Cb 0.65 -1.28 0.03 0.00 -0.02 0.00 0.00 35.03 34.40 1due n LYS 240 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1due s ASN 241 N -1.65 5.22 0.00 4.39 2.47 0.19 -5.05 114.94 120.52 1due s ASN 241 Ca 0.16 2.30 0.00 0.00 0.42 0.00 0.00 52.86 55.73 1due s ASN 241 Cb 0.13 -2.59 0.00 0.00 -1.45 0.00 0.00 41.25 37.34 1due s ASN 241 CO 0.31 -1.56 0.00 -1.84 -3.72 0.00 0.00 177.10 170.29