#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ol5 n PRO 12 N 0.00 0.00 -0.07 -0.24 -0.04 -1.26 -5.02 135.00 128.37 2ol5 n PRO 12 Ca 0.00 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.57 2ol5 n PRO 12 Cb 0.00 0.00 0.40 0.00 -0.04 0.00 0.00 33.50 33.86 2ol5 n PRO 12 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2ol5 n ASP 13 N 0.00 1.50 0.18 3.54 2.03 -1.26 -2.78 116.55 119.75 2ol5 n ASP 13 Ca 0.00 -1.67 0.13 0.00 0.52 0.00 0.00 54.79 53.77 2ol5 n ASP 13 Cb 0.00 -0.09 0.36 0.00 -0.72 0.00 0.00 41.12 40.67 2ol5 n ASP 13 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2ol5 h VAL 14 N 2.00 0.00 -0.60 5.18 2.07 -2.01 -3.23 116.25 119.67 2ol5 h VAL 14 Ca 0.00 -0.67 -0.07 0.00 0.82 0.00 0.00 66.70 66.78 2ol5 h VAL 14 Cb 0.44 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 2ol5 h VAL 14 CO 0.00 0.00 0.10 0.00 0.02 0.00 0.00 177.57 177.69 2ol5 h ALA 15 N 2.21 0.79 -0.64 1.67 0.00 -1.94 -2.45 119.26 118.90 2ol5 h ALA 15 Ca 0.00 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.67 2ol5 h ALA 15 Cb 0.78 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 2ol5 h ALA 15 CO 0.00 0.54 0.41 1.88 0.00 0.00 0.00 179.25 182.08 2ol5 h TYR 16 N 0.89 0.77 -0.21 0.00 0.99 -1.82 -2.24 116.97 115.34 2ol5 h TYR 16 Ca 0.18 0.02 0.05 0.00 2.00 0.00 0.00 58.73 60.98 2ol5 h TYR 16 Cb 0.42 -0.25 -0.04 0.00 1.00 0.00 0.00 36.73 37.85 2ol5 h TYR 16 CO 0.03 0.46 -0.08 0.37 -0.00 0.00 0.00 178.16 178.94 2ol5 h GLN 17 N 0.82 -0.04 -0.82 4.88 4.15 -1.65 -1.26 115.11 121.18 2ol5 h GLN 17 Ca 0.25 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.69 2ol5 h GLN 17 Cb -0.04 0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.62 2ol5 h GLN 17 CO -0.08 -0.03 0.54 0.28 -1.93 0.00 0.00 178.83 177.61 2ol5 h VAL 18 N -0.04 1.16 -0.21 2.39 2.07 -1.17 -1.04 116.25 119.41 2ol5 h VAL 18 Ca 0.11 -0.37 0.01 0.00 0.82 0.00 0.00 66.70 67.27 2ol5 h VAL 18 Cb 0.20 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.97 2ol5 h VAL 18 CO -0.24 0.19 0.12 0.40 0.02 0.00 0.00 177.57 178.07 2ol5 h ILE 19 N 1.07 1.03 -0.12 4.57 2.04 -0.84 -1.66 117.51 123.59 2ol5 h ILE 19 Ca 0.32 -0.09 -0.10 0.00 1.00 0.00 0.00 64.86 65.99 2ol5 h ILE 19 Cb -0.05 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 2ol5 h ILE 19 CO -0.09 0.05 -0.35 -0.33 0.00 0.00 0.00 178.15 177.42 2ol5 h GLU 20 N 0.26 0.25 0.00 2.37 5.08 -0.93 -3.09 114.58 118.52 2ol5 h GLU 20 Ca 0.08 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2ol5 h GLU 20 Cb -0.01 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2ol5 h GLU 20 CO -0.04 0.58 -0.61 0.93 -1.00 0.00 0.00 179.01 178.87 2ol5 h GLU 21 N 0.22 0.00 -2.10 2.33 5.08 -1.06 -3.37 114.58 115.67 2ol5 h GLU 21 Ca 0.03 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.84 2ol5 h GLU 21 Cb 0.73 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 29.58 2ol5 h GLU 21 CO 0.06 0.00 -0.95 0.09 -1.00 0.00 0.00 179.01 177.20 2ol5 n ASN 22 N -2.34 2.07 0.15 1.42 4.13 -0.64 -4.94 115.26 115.11 2ol5 n ASN 22 Ca 0.03 -3.18 0.13 0.00 1.68 0.00 0.00 54.58 53.23 2ol5 n ASN 22 Cb 0.47 -0.61 0.41 0.00 -1.54 0.00 0.00 39.78 38.51 2ol5 n ASN 22 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 2ol5 h SER 23 N 3.35 0.00 -0.87 6.41 4.64 -1.72 -3.39 113.55 121.97 2ol5 h SER 23 Ca 0.12 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.89 2ol5 h SER 23 Cb 0.79 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.80 2ol5 h SER 23 CO 0.62 0.00 1.56 0.12 -0.87 0.00 0.00 176.83 178.26 2ol5 s PHE 24 N -3.22 2.42 0.68 4.77 5.36 -1.26 -1.10 117.98 125.62 2ol5 s PHE 24 Ca 0.08 -0.69 -0.05 0.00 -0.96 0.00 0.00 56.93 55.30 2ol5 s PHE 24 Cb 0.10 -4.52 0.06 0.00 -0.34 0.00 0.00 43.02 38.32 2ol5 s PHE 24 CO 0.56 -1.76 0.97 0.00 -1.46 0.00 0.00 175.22 173.54 2ol5 s ALA 25 N 6.40 3.28 -0.20 11.12 0.00 -0.22 -4.73 121.76 137.40 2ol5 s ALA 25 Ca 0.56 -0.98 -0.08 0.00 0.00 0.00 0.00 51.96 51.46 2ol5 s ALA 25 Cb 0.00 -2.52 -0.04 0.00 0.00 0.00 0.00 23.12 20.56 2ol5 s ALA 25 CO 0.01 -1.20 0.07 0.99 0.00 0.00 0.00 175.76 175.63 2ol5 s THR 26 N -3.17 4.73 -0.37 0.00 2.01 -0.39 -2.33 115.64 116.12 2ol5 s THR 26 Ca 0.60 -0.05 -0.06 0.00 0.31 0.00 0.00 61.69 62.49 2ol5 s THR 26 Cb -0.11 -3.16 0.06 0.00 0.01 0.00 0.00 72.50 69.31 2ol5 s THR 26 CO 0.44 0.42 0.15 -0.22 -0.69 0.00 0.00 174.62 174.71 2ol5 s LEU 27 N 0.75 4.64 -0.12 4.42 2.96 0.19 -1.06 118.68 130.46 2ol5 s LEU 27 Ca 0.04 -1.43 -0.04 0.00 -0.22 0.00 0.00 54.13 52.48 2ol5 s LEU 27 Cb -0.13 -1.86 -0.03 0.00 0.50 0.00 0.00 46.19 44.66 2ol5 s LEU 27 CO 0.02 -0.41 0.02 -0.69 -1.32 0.00 0.00 176.35 173.96 2ol5 s VAL 28 N 1.33 4.42 0.00 1.68 1.01 -0.21 -1.76 120.40 126.88 2ol5 s VAL 28 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.80 2ol5 s VAL 28 Cb -0.21 -2.91 0.00 0.00 0.00 0.00 0.00 36.38 33.26 2ol5 s VAL 28 CO 0.01 0.55 0.00 -1.54 0.00 0.00 0.00 175.10 174.12 2ol5 n SER 29 N 2.70 0.00 -3.18 3.32 3.41 -0.47 -1.34 113.62 118.06 2ol5 n SER 29 Ca -0.18 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.47 2ol5 n SER 29 Cb 0.53 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.44 2ol5 n SER 29 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2ol5 s HIS 31 N 2.03 -0.01 -1.60 7.33 5.04 0.39 -1.83 115.29 126.64 2ol5 s HIS 31 Ca 0.00 0.02 -0.09 0.00 -1.54 0.00 0.00 55.06 53.45 2ol5 s HIS 31 Cb 0.00 0.01 0.08 0.00 0.04 0.00 0.00 32.58 32.71 2ol5 s HIS 31 CO 0.00 -0.01 0.46 1.04 -2.34 0.00 0.00 174.74 173.90 2ol5 n GLN 32 N 4.42 -2.38 -1.21 2.88 6.02 -1.26 -1.30 117.38 124.55 2ol5 n GLN 32 Ca -0.07 0.29 -0.07 0.00 -0.01 0.00 0.00 57.00 57.14 2ol5 n GLN 32 Cb 0.56 -4.52 -0.03 0.00 1.02 0.00 0.00 30.24 27.27 2ol5 n GLN 32 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2ol5 n ARG 33 N -4.40 -0.81 -4.19 -1.09 1.74 -1.26 -5.00 116.66 101.66 2ol5 n ARG 33 Ca -0.14 0.67 -0.17 0.00 -0.77 0.00 0.00 57.85 57.44 2ol5 n ARG 33 Cb 0.60 -4.55 -0.12 0.00 -1.02 0.00 0.00 32.46 27.36 2ol5 n ARG 33 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2ol5 s GLU 34 N -2.28 0.73 0.28 5.56 2.12 -0.42 -5.13 118.70 119.55 2ol5 s GLU 34 Ca 0.00 -0.77 -0.29 0.00 0.36 0.00 0.00 54.97 54.27 2ol5 s GLU 34 Cb 0.00 -0.66 -0.10 0.00 0.26 0.00 0.00 34.13 33.64 2ol5 s GLU 34 CO 0.00 0.15 1.35 -0.51 -0.54 0.00 0.00 175.26 175.71 2ol5 s LEU 35 N -1.37 4.41 -0.05 2.70 1.43 -1.26 -0.46 118.68 124.08 2ol5 s LEU 35 Ca -0.03 2.63 -0.04 0.00 -1.03 0.00 0.00 54.13 55.66 2ol5 s LEU 35 Cb -0.09 -3.63 0.02 0.00 0.03 0.00 0.00 46.19 42.52 2ol5 s LEU 35 CO 0.01 -0.58 0.13 0.12 0.23 0.00 0.00 176.35 176.26 2ol5 s PHE 36 N -0.57 -0.14 0.00 0.29 5.36 -0.76 -4.85 117.98 117.32 2ol5 s PHE 36 Ca 0.53 0.37 0.02 0.00 -0.96 0.00 0.00 56.93 56.90 2ol5 s PHE 36 Cb -0.40 0.00 -0.01 0.00 -0.34 0.00 0.00 43.02 42.28 2ol5 s PHE 36 CO 0.47 -0.10 -0.08 0.00 -1.46 0.00 0.00 175.22 174.06 2ol5 s ALA 37 N 0.41 0.66 0.08 11.12 0.00 -1.26 -1.37 121.76 131.39 2ol5 s ALA 37 Ca -0.03 -0.41 0.09 0.00 0.00 0.00 0.00 51.96 51.61 2ol5 s ALA 37 Cb -0.04 -0.14 -0.03 0.00 0.00 0.00 0.00 23.12 22.91 2ol5 s ALA 37 CO -0.02 0.14 -0.23 0.99 0.00 0.00 0.00 175.76 176.64 2ol5 s THR 38 N -0.37 1.92 -0.20 0.00 2.01 -0.72 -4.93 115.64 113.35 2ol5 s THR 38 Ca 0.01 -1.45 -0.07 0.00 0.31 0.00 0.00 61.69 60.49 2ol5 s THR 38 Cb -0.04 -1.69 -0.04 0.00 0.01 0.00 0.00 72.50 70.74 2ol5 s THR 38 CO -0.00 0.15 0.07 -1.00 -0.69 0.00 0.00 174.62 173.15 2ol5 s HIS 39 N -0.95 3.20 -0.30 4.92 3.76 -1.26 -0.64 115.29 124.03 2ol5 s HIS 39 Ca 0.10 -0.05 -0.28 0.00 -0.15 0.00 0.00 55.06 54.68 2ol5 s HIS 39 Cb -0.10 -2.12 0.20 0.00 1.11 0.00 0.00 32.58 31.67 2ol5 s HIS 39 CO 0.03 0.02 1.41 -0.48 -0.85 0.00 0.00 174.74 174.87 2ol5 s LEU 40 N 0.71 -0.01 0.23 0.89 2.34 -0.98 -5.01 118.68 116.85 2ol5 s LEU 40 Ca 0.03 0.01 -0.30 0.00 0.06 0.00 0.00 54.13 53.94 2ol5 s LEU 40 Cb -0.13 1.03 -0.09 0.00 -0.56 0.00 0.00 46.19 46.44 2ol5 s LEU 40 CO 0.02 -0.01 1.11 -2.16 -1.06 0.00 0.00 176.35 174.25 2ol5 s PRO 41 N -0.81 4.61 -0.10 1.48 0.05 -1.26 -1.06 135.00 137.91 2ol5 s PRO 41 Ca 0.09 1.78 0.00 0.00 0.05 0.00 0.00 61.00 62.92 2ol5 s PRO 41 Cb -0.02 -3.23 0.02 0.00 0.05 0.00 0.00 34.50 31.32 2ol5 s PRO 41 CO -0.10 0.12 -0.09 -0.51 0.05 0.00 0.00 177.00 176.48 2ol5 s LEU 42 N -0.87 1.29 -0.02 -3.56 1.43 -0.26 -4.55 118.68 112.14 2ol5 s LEU 42 Ca 0.47 -0.30 0.02 0.00 -1.03 0.00 0.00 54.13 53.29 2ol5 s LEU 42 Cb -0.31 -0.83 -0.03 0.00 0.03 0.00 0.00 46.19 45.05 2ol5 s LEU 42 CO 0.38 -0.08 -0.03 -0.76 0.23 0.00 0.00 176.35 176.09 2ol5 s LEU 43 N 1.46 3.38 0.12 1.79 1.43 -0.33 -4.80 118.68 121.73 2ol5 s LEU 43 Ca 0.00 -0.03 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 2ol5 s LEU 43 Cb -0.13 -1.90 -0.06 0.00 0.03 0.00 0.00 46.19 44.13 2ol5 s LEU 43 CO -0.05 0.30 1.02 -0.76 0.23 0.00 0.00 176.35 177.08 2ol5 s LEU 44 N -1.36 4.48 0.88 1.79 1.43 -1.26 0.02 118.68 124.66 2ol5 s LEU 44 Ca 0.17 1.88 -0.11 0.00 -1.03 0.00 0.00 54.13 55.04 2ol5 s LEU 44 Cb -0.11 -3.59 0.12 0.00 0.03 0.00 0.00 46.19 42.63 2ol5 s LEU 44 CO 0.08 -0.15 1.09 1.51 0.23 0.00 0.00 176.35 179.11 2ol5 s ASP 45 N 0.12 3.66 0.31 2.29 -4.77 0.22 -4.88 116.67 113.62 2ol5 s ASP 45 Ca 0.49 1.47 0.02 0.00 -3.30 0.00 0.00 52.55 51.22 2ol5 s ASP 45 Cb -0.25 -2.16 0.57 0.00 -1.09 0.00 0.00 42.92 39.99 2ol5 s ASP 45 CO 0.31 -2.52 1.91 -0.09 0.70 0.00 0.00 175.17 175.48 2ol5 h ARG 46 N -1.47 0.95 0.00 2.11 2.43 -1.97 0.14 114.38 116.58 2ol5 h ARG 46 Ca -0.49 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.62 2ol5 h ARG 46 Cb 1.28 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 2ol5 h ARG 46 CO 0.55 0.63 0.00 0.39 -1.51 0.00 0.00 179.97 180.03 2ol5 n GLU 47 N -4.50 0.26 -1.96 0.20 -0.58 -1.26 -4.93 120.64 107.88 2ol5 n GLU 47 Ca 0.14 0.04 -0.21 0.00 -0.42 0.00 0.00 57.16 56.71 2ol5 n GLU 47 Cb 0.22 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.54 2ol5 n GLU 47 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2ol5 n LYS 48 N -1.35 -1.57 0.02 3.49 5.02 0.48 -4.87 118.16 119.39 2ol5 n LYS 48 Ca 0.11 1.12 0.11 0.00 -2.02 0.00 0.00 58.31 57.63 2ol5 n LYS 48 Cb 0.24 -5.64 -0.02 0.00 -0.02 0.00 0.00 35.03 29.60 2ol5 n LYS 48 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2ol5 n THR 49 N -3.11 0.16 -3.94 -0.18 -2.24 -1.26 -4.94 114.28 98.77 2ol5 n THR 49 Ca -0.22 -0.28 -0.09 0.00 -2.27 0.00 0.00 64.05 61.18 2ol5 n THR 49 Cb 0.68 0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 69.09 2ol5 n THR 49 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ol5 s LEU 51 N -3.02 2.20 -0.01 0.00 1.43 -0.57 -0.61 118.68 118.10 2ol5 s LEU 51 Ca 0.19 -0.52 0.01 0.00 -1.03 0.00 0.00 54.13 52.77 2ol5 s LEU 51 Cb -0.03 -1.45 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 2ol5 s LEU 51 CO 0.10 0.15 0.02 -0.31 0.23 0.00 0.00 176.35 176.54 2ol5 s TYR 52 N 0.39 3.13 0.07 0.29 1.51 0.10 -0.24 117.35 122.61 2ol5 s TYR 52 Ca -0.16 0.12 -0.02 0.00 -1.01 0.00 0.00 57.07 56.00 2ol5 s TYR 52 Cb -0.17 -1.70 0.01 0.00 -0.11 0.00 0.00 41.96 39.99 2ol5 s TYR 52 CO 0.07 0.48 0.13 0.41 -1.11 0.00 0.00 175.55 175.54 2ol5 n GLY 53 N 1.42 2.16 3.43 0.71 0.00 -0.95 -1.18 105.19 110.77 2ol5 n GLY 53 Ca -0.15 -1.17 -0.14 0.00 0.00 0.00 0.00 46.02 44.57 2ol5 n GLY 53 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2ol5 s HIS 54 N -6.74 -0.57 0.43 1.61 -3.43 -1.26 -1.69 115.29 103.63 2ol5 s HIS 54 Ca 0.04 1.38 0.06 0.00 -0.80 0.00 0.00 55.06 55.73 2ol5 s HIS 54 Cb -0.01 0.21 0.01 0.00 -1.43 0.00 0.00 32.58 31.36 2ol5 s HIS 54 CO 0.03 -0.30 0.60 -0.06 -2.00 0.00 0.00 174.74 173.00 2ol5 s PHE 55 N 0.16 2.93 0.32 0.38 0.40 -0.80 -4.90 117.98 116.48 2ol5 s PHE 55 Ca -0.01 -0.22 -0.26 0.00 -0.60 0.00 0.00 56.93 55.85 2ol5 s PHE 55 Cb -0.04 -2.36 -0.10 0.00 0.51 0.00 0.00 43.02 41.04 2ol5 s PHE 55 CO 0.01 -0.41 0.94 0.00 0.70 0.00 0.00 175.22 176.46 2ol5 s ALA 56 N -2.41 3.21 0.31 5.36 0.00 -1.26 -1.33 121.76 125.64 2ol5 s ALA 56 Ca 0.52 0.51 0.01 0.00 0.00 0.00 0.00 51.96 53.00 2ol5 s ALA 56 Cb -0.10 -3.17 0.55 0.00 0.00 0.00 0.00 23.12 20.40 2ol5 s ALA 56 CO 0.34 0.18 1.93 0.00 0.00 0.00 0.00 175.76 178.21 2ol5 h ARG 57 N 3.15 0.97 0.00 0.00 2.47 -1.55 -1.66 114.38 117.77 2ol5 h ARG 57 Ca -0.47 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.19 2ol5 h ARG 57 Cb 1.19 -0.22 0.00 0.00 -1.65 0.00 0.00 29.97 29.29 2ol5 h ARG 57 CO 0.65 0.64 0.00 -1.13 0.56 0.00 0.00 179.97 180.69 2ol5 n SER 58 N -4.48 0.41 -4.57 7.04 3.41 -1.26 -4.43 113.62 109.75 2ol5 n SER 58 Ca 0.13 0.66 -0.43 0.00 -0.26 0.00 0.00 58.87 58.97 2ol5 n SER 58 Cb 0.18 -0.73 -0.05 0.00 -0.26 0.00 0.00 64.21 63.36 2ol5 n SER 58 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2ol5 s ASN 59 N -3.76 6.52 0.00 4.04 2.47 -0.62 -4.93 114.94 118.65 2ol5 s ASN 59 Ca 0.00 0.21 0.24 0.00 0.42 0.00 0.00 52.86 53.74 2ol5 s ASN 59 Cb 0.06 -2.42 1.37 0.00 -1.45 0.00 0.00 41.25 38.81 2ol5 s ASN 59 CO 0.20 -0.88 1.82 -0.81 -3.72 0.00 0.00 177.10 173.71 2ol5 n PRO 60 N 6.76 0.60 0.18 0.43 -0.04 -1.26 -3.85 135.00 137.81 2ol5 n PRO 60 Ca 0.04 0.02 0.08 0.00 -0.04 0.00 0.00 63.50 63.61 2ol5 n PRO 60 Cb 0.48 -1.50 0.59 0.00 -0.04 0.00 0.00 33.50 33.03 2ol5 n PRO 60 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2ol5 h GLN 61 N 0.00 0.13 0.00 0.54 4.15 -1.93 -1.28 115.11 116.72 2ol5 h GLN 61 Ca 0.00 -0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.36 2ol5 h GLN 61 Cb 0.09 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 2ol5 h GLN 61 CO 0.00 0.09 -0.24 0.11 -1.93 0.00 0.00 178.83 176.85 2ol5 h TRP 62 N 0.13 0.00 -1.08 3.99 5.08 -1.94 -3.18 115.95 118.95 2ol5 h TRP 62 Ca 0.06 0.00 0.32 0.00 1.08 0.00 0.00 58.89 60.35 2ol5 h TRP 62 Cb 0.07 0.00 -0.13 0.00 -3.00 0.00 0.00 29.16 26.10 2ol5 h TRP 62 CO -0.00 0.24 0.66 -0.91 -1.28 0.00 0.00 178.44 177.15 2ol5 h ASN 63 N 0.00 0.45 -0.30 0.11 2.35 -1.51 -2.62 115.58 114.06 2ol5 h ASN 63 Ca -0.00 0.14 -0.23 0.00 -0.55 0.00 0.00 56.30 55.66 2ol5 h ASN 63 Cb 0.55 0.09 -0.39 0.00 0.05 0.00 0.00 38.32 38.62 2ol5 h ASN 63 CO 0.03 -0.06 -1.07 -0.90 -1.65 0.00 0.00 177.43 173.78 2ol5 n ASP 64 N -4.84 1.55 0.10 5.81 5.68 -1.24 -4.87 116.55 118.74 2ol5 n ASP 64 Ca 0.31 -2.14 0.12 0.00 -0.50 0.00 0.00 54.79 52.58 2ol5 n ASP 64 Cb 1.03 -0.42 0.19 0.00 -1.14 0.00 0.00 41.12 40.78 2ol5 n ASP 64 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 2ol5 h ILE 65 N 5.78 0.00 -4.38 2.12 2.10 -1.44 -3.47 117.51 118.22 2ol5 h ILE 65 Ca -0.14 -0.65 -0.50 0.00 1.08 0.00 0.00 64.86 64.66 2ol5 h ILE 65 Cb 1.48 1.35 0.07 0.00 -1.09 0.00 0.00 36.82 38.62 2ol5 h ILE 65 CO 0.18 0.00 0.40 -1.10 -1.08 0.00 0.00 178.15 176.55 2ol5 s GLN 66 N -3.20 3.11 -1.17 2.19 -0.21 -1.26 -4.14 119.66 114.99 2ol5 s GLN 66 Ca 0.06 0.52 0.00 0.00 0.02 0.00 0.00 55.36 55.96 2ol5 s GLN 66 Cb 0.11 -2.06 0.00 0.00 1.00 0.00 0.00 33.01 32.06 2ol5 s GLN 66 CO 0.70 -0.85 0.00 0.72 -2.12 0.00 0.00 175.29 173.74 2ol5 n HIS 67 N -2.89 0.00 -3.88 0.91 8.25 -1.26 -5.00 115.22 111.35 2ol5 n HIS 67 Ca 0.06 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.42 2ol5 n HIS 67 Cb 0.56 -2.08 -0.09 0.00 1.12 0.00 0.00 29.99 29.50 2ol5 n HIS 67 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 2ol5 s GLN 68 N -2.91 0.65 -0.54 -0.41 -2.07 -1.26 -5.11 119.66 108.01 2ol5 s GLN 68 Ca 0.00 -0.67 -0.27 0.00 -1.82 0.00 0.00 55.36 52.60 2ol5 s GLN 68 Cb 0.00 0.26 0.03 0.00 -1.09 0.00 0.00 33.01 32.22 2ol5 s GLN 68 CO 0.00 -0.18 1.08 0.99 -1.32 0.00 0.00 175.29 175.86 2ol5 s THR 69 N -2.56 4.21 0.75 3.63 2.01 -1.26 -4.40 115.64 118.02 2ol5 s THR 69 Ca -0.05 0.76 -0.03 0.00 0.31 0.00 0.00 61.69 62.67 2ol5 s THR 69 Cb -0.01 -4.62 0.13 0.00 0.01 0.00 0.00 72.50 68.01 2ol5 s THR 69 CO -0.04 -1.16 1.03 0.68 -0.69 0.00 0.00 174.62 174.45 2ol5 s VAL 70 N 4.43 2.14 -0.12 3.82 -7.23 -0.39 -4.88 120.40 118.18 2ol5 s VAL 70 Ca 0.39 -0.50 -0.01 0.00 -1.81 0.00 0.00 61.98 60.05 2ol5 s VAL 70 Cb -0.09 -2.64 0.03 0.00 0.56 0.00 0.00 36.38 34.24 2ol5 s VAL 70 CO 0.25 0.00 -0.03 -0.22 -0.31 0.00 0.00 175.10 174.79 2ol5 s LEU 71 N -5.24 1.05 -0.18 1.32 2.96 -0.45 -3.18 118.68 114.95 2ol5 s LEU 71 Ca 0.67 -0.35 -0.05 0.00 -0.22 0.00 0.00 54.13 54.18 2ol5 s LEU 71 Cb -0.05 -0.69 -0.03 0.00 0.50 0.00 0.00 46.19 45.92 2ol5 s LEU 71 CO 0.45 -0.18 -0.01 0.00 -1.32 0.00 0.00 176.35 175.29 2ol5 s ALA 72 N 1.80 3.03 -0.18 5.97 0.00 0.10 -1.04 121.76 131.45 2ol5 s ALA 72 Ca 0.04 -0.92 -0.05 0.00 0.00 0.00 0.00 51.96 51.03 2ol5 s ALA 72 Cb -0.13 -1.70 -0.03 0.00 0.00 0.00 0.00 23.12 21.26 2ol5 s ALA 72 CO -0.07 -0.00 -0.01 0.42 0.00 0.00 0.00 175.76 176.10 2ol5 s ILE 73 N 0.74 4.04 -0.20 0.00 1.01 -0.22 0.12 121.20 126.69 2ol5 s ILE 73 Ca -0.00 -0.29 -0.05 0.00 0.00 0.00 0.00 60.65 60.30 2ol5 s ILE 73 Cb -0.14 -2.80 -0.02 0.00 0.01 0.00 0.00 42.46 39.50 2ol5 s ILE 73 CO 0.02 0.46 -0.01 -0.36 0.00 0.00 0.00 174.94 175.04 2ol5 s PHE 74 N 0.67 3.02 -0.34 3.97 0.40 0.03 -1.26 117.98 124.47 2ol5 s PHE 74 Ca -0.01 -0.53 -0.17 0.00 -0.60 0.00 0.00 56.93 55.62 2ol5 s PHE 74 Cb -0.14 -2.07 -0.01 0.00 0.51 0.00 0.00 43.02 41.31 2ol5 s PHE 74 CO 0.02 -0.28 0.48 -1.01 0.70 0.00 0.00 175.22 175.14 2ol5 s HIS 75 N 1.03 3.19 0.00 0.36 3.76 -1.26 -2.36 115.29 120.01 2ol5 s HIS 75 Ca 0.02 0.20 0.00 0.00 -0.15 0.00 0.00 55.06 55.12 2ol5 s HIS 75 Cb -0.14 -2.85 0.00 0.00 1.11 0.00 0.00 32.58 30.69 2ol5 s HIS 75 CO 0.01 -0.49 0.00 0.41 -0.85 0.00 0.00 174.74 173.82 2ol5 n GLY 76 N 4.78 -1.68 3.81 -2.22 0.00 -0.16 -4.77 105.19 104.94 2ol5 n GLY 76 Ca -0.06 -1.52 -0.33 0.00 0.00 0.00 0.00 46.02 44.11 2ol5 n GLY 76 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ol5 s PRO 77 N -1.43 3.52 0.21 1.61 0.04 -1.26 -4.72 135.00 132.98 2ol5 s PRO 77 Ca 0.00 1.22 -0.02 0.00 0.04 0.00 0.00 61.00 62.24 2ol5 s PRO 77 Cb 0.00 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 2ol5 s PRO 77 CO 0.00 -0.64 0.17 -3.38 0.04 0.00 0.00 177.00 173.18 2ol5 s HIS 78 N -2.34 1.12 0.00 0.56 -3.43 -1.25 -1.96 115.29 107.98 2ol5 s HIS 78 Ca 0.64 -1.34 0.00 0.00 -0.80 0.00 0.00 55.06 53.56 2ol5 s HIS 78 Cb -0.15 -0.50 0.00 0.00 -1.43 0.00 0.00 32.58 30.49 2ol5 s HIS 78 CO 0.32 -0.68 0.00 0.00 -2.00 0.00 0.00 174.74 172.37 2ol5 s TYR 80 N -2.00 2.92 -0.19 0.00 5.04 -1.26 -1.38 117.35 120.48 2ol5 s TYR 80 Ca 0.00 1.45 -0.01 0.00 -2.44 0.00 0.00 57.07 56.07 2ol5 s TYR 80 Cb 0.00 -3.60 0.01 0.00 0.35 0.00 0.00 41.96 38.72 2ol5 s TYR 80 CO 0.00 -1.85 -0.13 0.42 -1.34 0.00 0.00 175.55 172.65 2ol5 s ILE 81 N -1.28 2.70 -0.15 3.14 -1.09 0.29 -4.86 121.20 119.95 2ol5 s ILE 81 Ca 0.56 -0.73 -0.16 0.00 -2.23 0.00 0.00 60.65 58.09 2ol5 s ILE 81 Cb -0.36 -2.18 -0.04 0.00 -1.58 0.00 0.00 42.46 38.29 2ol5 s ILE 81 CO 0.47 0.49 0.39 -0.55 -1.23 0.00 0.00 174.94 174.51 2ol5 s SER 82 N 1.30 6.55 0.00 3.58 0.15 -1.26 -3.14 113.70 120.88 2ol5 s SER 82 Ca 0.04 0.66 0.06 0.00 0.70 0.00 0.00 55.95 57.40 2ol5 s SER 82 Cb -0.14 -2.24 0.28 0.00 -1.71 0.00 0.00 66.02 62.21 2ol5 s SER 82 CO -0.07 0.03 1.08 -0.81 1.20 0.00 0.00 173.24 174.67 2ol5 n PRO 83 N 3.73 0.05 0.00 5.44 -0.04 -1.26 -1.58 135.00 141.34 2ol5 n PRO 83 Ca -0.09 0.29 0.14 0.00 -0.04 0.00 0.00 63.50 63.79 2ol5 n PRO 83 Cb 0.52 -1.50 0.66 0.00 -0.04 0.00 0.00 33.50 33.13 2ol5 n PRO 83 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2ol5 n SER 84 N -1.36 0.00 0.05 3.54 3.41 -1.26 -3.19 113.62 114.81 2ol5 n SER 84 Ca 0.02 0.15 0.13 0.00 -0.26 0.00 0.00 58.87 58.91 2ol5 n SER 84 Cb 0.05 -0.38 0.31 0.00 -0.26 0.00 0.00 64.21 63.94 2ol5 n SER 84 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2ol5 n TRP 85 N -1.38 0.44 -2.47 7.33 8.01 -0.62 -4.95 117.44 123.80 2ol5 n TRP 85 Ca 0.10 0.13 -0.23 0.00 -1.31 0.00 0.00 57.50 56.19 2ol5 n TRP 85 Cb 0.27 -0.61 0.05 0.00 -2.01 0.00 0.00 31.31 29.00 2ol5 n TRP 85 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 2ol5 s TYR 86 N -3.09 2.93 -1.33 -5.99 2.02 -1.19 -4.76 117.35 105.93 2ol5 s TYR 86 Ca 0.09 0.23 0.10 0.00 -0.37 0.00 0.00 57.07 57.12 2ol5 s TYR 86 Cb 0.15 -2.90 0.49 0.00 -0.40 0.00 0.00 41.96 39.30 2ol5 s TYR 86 CO 0.66 -1.05 1.24 0.39 -1.57 0.00 0.00 175.55 175.21 2ol5 n GLU 87 N -2.57 0.11 -4.09 -0.62 4.71 -1.26 -4.84 120.64 112.08 2ol5 n GLU 87 Ca 0.07 0.22 -0.12 0.00 -0.01 0.00 0.00 57.16 57.32 2ol5 n GLU 87 Cb 0.60 -1.50 -0.11 0.00 -1.01 0.00 0.00 31.44 29.42 2ol5 n GLU 87 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 2ol5 s THR 88 N -2.67 0.55 0.54 2.62 -4.23 -1.26 -4.98 115.64 106.21 2ol5 s THR 88 Ca 0.09 -1.33 0.21 0.00 -1.18 0.00 0.00 61.69 59.47 2ol5 s THR 88 Cb 0.07 -0.91 0.30 0.00 1.34 0.00 0.00 72.50 73.30 2ol5 s THR 88 CO 0.16 -0.54 2.17 0.78 -0.54 0.00 0.00 174.62 176.64 2ol5 h ASN 89 N 4.05 0.00 -1.36 3.99 2.35 -1.89 -3.38 115.58 119.34 2ol5 h ASN 89 Ca -0.35 0.00 -0.72 0.00 -0.55 0.00 0.00 56.30 54.67 2ol5 h ASN 89 Cb 1.19 0.00 -0.13 0.00 0.05 0.00 0.00 38.32 39.43 2ol5 h ASN 89 CO 0.48 0.00 1.97 0.00 -1.65 0.00 0.00 177.43 178.23 2ol5 n GLN 90 N -4.32 3.32 -3.55 0.81 1.13 -1.26 -4.88 117.38 108.62 2ol5 n GLN 90 Ca -0.02 -3.46 -0.14 0.00 -1.94 0.00 0.00 57.00 51.44 2ol5 n GLN 90 Cb 0.13 -3.16 -0.05 0.00 0.11 0.00 0.00 30.24 27.27 2ol5 n GLN 90 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2ol5 s ALA 91 N 2.17 -1.42 -0.10 -1.58 0.00 -1.26 -5.09 121.76 114.48 2ol5 s ALA 91 Ca 0.45 0.67 0.02 0.00 0.00 0.00 0.00 51.96 53.10 2ol5 s ALA 91 Cb 0.04 0.41 -0.01 0.00 0.00 0.00 0.00 23.12 23.56 2ol5 s ALA 91 CO 0.01 -0.53 -0.17 0.08 0.00 0.00 0.00 175.76 175.15 2ol5 s VAL 92 N -2.48 2.72 0.78 0.00 1.01 -1.26 -4.92 120.40 116.25 2ol5 s VAL 92 Ca -0.05 -0.80 -0.13 0.00 0.00 0.00 0.00 61.98 61.00 2ol5 s VAL 92 Cb -0.01 -2.09 0.07 0.00 0.00 0.00 0.00 36.38 34.35 2ol5 s VAL 92 CO -0.02 0.55 1.17 -2.16 0.00 0.00 0.00 175.10 174.64 2ol5 s PRO 93 N 0.12 1.87 0.19 2.72 0.04 -1.26 -4.72 135.00 133.97 2ol5 s PRO 93 Ca -0.08 1.59 -0.24 0.00 0.04 0.00 0.00 61.00 62.31 2ol5 s PRO 93 Cb -0.15 -1.82 0.05 0.00 0.04 0.00 0.00 34.50 32.62 2ol5 s PRO 93 CO 0.05 -2.00 0.83 -0.08 0.04 0.00 0.00 177.00 175.84 2ol5 s THR 94 N -2.33 0.00 -0.02 1.26 -1.32 -1.19 -5.03 115.64 107.02 2ol5 s THR 94 Ca 0.70 -0.67 0.05 0.00 -1.21 0.00 0.00 61.69 60.55 2ol5 s THR 94 Cb -0.25 -1.82 -0.03 0.00 -1.51 0.00 0.00 72.50 68.90 2ol5 s THR 94 CO 0.50 0.00 -0.15 0.26 -2.21 0.00 0.00 174.62 173.02 2ol5 s TRP 95 N -3.55 2.66 -0.12 9.09 0.52 -1.26 -0.55 118.94 125.73 2ol5 s TRP 95 Ca 0.10 -0.19 -0.05 0.00 0.02 0.00 0.00 56.10 55.99 2ol5 s TRP 95 Cb -0.03 -1.58 -0.04 0.00 -1.15 0.00 0.00 33.47 30.67 2ol5 s TRP 95 CO 0.02 0.20 0.06 -0.80 0.02 0.00 0.00 176.95 176.45 2ol5 s ASN 96 N -0.94 5.67 0.31 2.95 -0.87 -0.48 -4.91 114.94 116.67 2ol5 s ASN 96 Ca 0.13 0.23 -0.15 0.00 -1.57 0.00 0.00 52.86 51.49 2ol5 s ASN 96 Cb -0.11 -1.76 0.02 0.00 -0.02 0.00 0.00 41.25 39.38 2ol5 s ASN 96 CO 0.02 0.35 0.65 -0.72 -2.57 0.00 0.00 177.10 174.82 2ol5 s TYR 97 N -0.67 0.18 0.00 2.20 -0.85 -0.94 -0.61 117.35 116.67 2ol5 s TYR 97 Ca 0.12 -0.64 0.01 0.00 -0.52 0.00 0.00 57.07 56.03 2ol5 s TYR 97 Cb -0.12 0.52 -0.01 0.00 0.38 0.00 0.00 41.96 42.73 2ol5 s TYR 97 CO 0.02 -1.25 -0.03 0.08 -1.52 0.00 0.00 175.55 172.85 2ol5 s VAL 98 N -3.44 0.23 -0.14 -3.49 1.01 -0.83 -1.74 120.40 112.00 2ol5 s VAL 98 Ca 0.17 -0.26 -0.27 0.00 0.00 0.00 0.00 61.98 61.62 2ol5 s VAL 98 Cb -0.04 -0.23 0.07 0.00 0.00 0.00 0.00 36.38 36.18 2ol5 s VAL 98 CO 0.10 -0.02 0.66 0.00 0.00 0.00 0.00 175.10 175.84 2ol5 s ALA 99 N -0.29 -1.69 -0.12 5.51 0.00 0.40 -0.99 121.76 124.59 2ol5 s ALA 99 Ca -0.01 1.56 0.02 0.00 0.00 0.00 0.00 51.96 53.52 2ol5 s ALA 99 Cb -0.03 -0.52 0.01 0.00 0.00 0.00 0.00 23.12 22.59 2ol5 s ALA 99 CO -0.00 -0.34 -0.16 0.08 0.00 0.00 0.00 175.76 175.34 2ol5 s VAL 100 N -0.48 1.58 -0.20 0.00 1.01 -0.99 -0.54 120.40 120.77 2ol5 s VAL 100 Ca -0.06 -0.69 -0.07 0.00 0.00 0.00 0.00 61.98 61.17 2ol5 s VAL 100 Cb -0.02 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.88 2ol5 s VAL 100 CO 0.06 0.46 0.05 -1.00 0.00 0.00 0.00 175.10 174.66 2ol5 s HIS 101 N 1.02 3.14 -0.17 5.22 3.76 0.61 -0.79 115.29 128.08 2ol5 s HIS 101 Ca -0.05 -0.19 -0.01 0.00 -0.15 0.00 0.00 55.06 54.66 2ol5 s HIS 101 Cb -0.15 -2.12 -0.01 0.00 1.11 0.00 0.00 32.58 31.42 2ol5 s HIS 101 CO -0.03 -0.08 -0.11 0.08 -0.85 0.00 0.00 174.74 173.75 2ol5 s VAL 102 N 0.86 3.02 -0.04 -0.90 1.01 0.34 -1.42 120.40 123.27 2ol5 s VAL 102 Ca 0.03 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.35 2ol5 s VAL 102 Cb -0.14 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.90 2ol5 s VAL 102 CO 0.02 0.49 0.06 -0.31 0.00 0.00 0.00 175.10 175.37 2ol5 s TYR 103 N 0.90 3.27 0.02 5.22 1.51 0.37 0.02 117.35 128.65 2ol5 s TYR 103 Ca -0.03 0.23 -0.15 0.00 -1.01 0.00 0.00 57.07 56.11 2ol5 s TYR 103 Cb -0.15 -1.77 0.05 0.00 -0.11 0.00 0.00 41.96 39.99 2ol5 s TYR 103 CO -0.00 0.55 0.71 0.41 -1.11 0.00 0.00 175.55 176.10 2ol5 n GLY 104 N 1.51 0.51 3.85 0.71 0.00 -1.19 0.12 105.19 110.69 2ol5 n GLY 104 Ca -0.15 -0.98 -0.27 0.00 0.00 0.00 0.00 46.02 44.62 2ol5 n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ol5 s ASN 105 N -2.58 5.80 0.05 1.61 4.22 -0.94 -1.26 114.94 121.84 2ol5 s ASN 105 Ca 0.16 -0.01 -0.15 0.00 -2.14 0.00 0.00 52.86 50.72 2ol5 s ASN 105 Cb -0.01 -1.61 -0.06 0.00 1.28 0.00 0.00 41.25 40.85 2ol5 s ASN 105 CO 0.00 0.08 0.47 -0.69 -2.04 0.00 0.00 177.10 174.92 2ol5 s VAL 106 N -1.71 4.94 -0.15 3.54 1.01 -1.26 -1.36 120.40 125.41 2ol5 s VAL 106 Ca 0.32 0.90 0.02 0.00 0.00 0.00 0.00 61.98 63.22 2ol5 s VAL 106 Cb -0.11 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.53 2ol5 s VAL 106 CO 0.25 0.50 -0.21 -1.61 0.00 0.00 0.00 175.10 174.03 2ol5 s GLU 107 N -1.29 2.94 0.36 2.72 2.02 -0.22 -4.48 118.70 120.74 2ol5 s GLU 107 Ca 0.28 -0.82 -0.26 0.00 0.02 0.00 0.00 54.97 54.19 2ol5 s GLU 107 Cb -0.17 -2.42 -0.09 0.00 0.10 0.00 0.00 34.13 31.56 2ol5 s GLU 107 CO 0.16 -0.07 1.10 -0.51 0.02 0.00 0.00 175.26 175.96 2ol5 s LEU 108 N 0.95 4.29 -0.20 1.80 1.43 -1.26 -0.88 118.68 124.80 2ol5 s LEU 108 Ca -0.04 2.20 0.00 0.00 -1.03 0.00 0.00 54.13 55.26 2ol5 s LEU 108 Cb -0.15 -3.96 0.02 0.00 0.03 0.00 0.00 46.19 42.13 2ol5 s LEU 108 CO -0.05 -0.43 -0.16 -0.63 0.23 0.00 0.00 176.35 175.32 2ol5 s ILE 109 N -1.43 2.35 -0.20 -0.59 1.01 -1.02 -4.90 121.20 116.41 2ol5 s ILE 109 Ca 0.53 -0.93 0.08 0.00 0.00 0.00 0.00 60.65 60.33 2ol5 s ILE 109 Cb -0.28 -2.05 -0.10 0.00 0.01 0.00 0.00 42.46 40.04 2ol5 s ILE 109 CO 0.35 0.45 0.26 0.59 0.00 0.00 0.00 174.94 176.58 2ol5 n ASN 110 N 4.64 1.64 -4.63 3.58 5.03 -1.26 -3.99 115.26 120.27 2ol5 n ASN 110 Ca -0.20 -0.37 -0.50 0.00 0.87 0.00 0.00 54.58 54.38 2ol5 n ASN 110 Cb 0.49 1.16 -0.05 0.00 -1.02 0.00 0.00 39.78 40.36 2ol5 n ASN 110 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 2ol5 n ASP 111 N -1.45 2.24 0.22 6.41 2.03 -1.26 -4.85 116.55 119.90 2ol5 n ASP 111 Ca 0.00 1.10 0.14 0.00 0.52 0.00 0.00 54.79 56.55 2ol5 n ASP 111 Cb 0.16 -1.28 0.40 0.00 -0.72 0.00 0.00 41.12 39.68 2ol5 n ASP 111 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 2ol5 h GLN 112 N 5.31 0.00 -0.03 -0.67 1.08 -2.00 -2.08 115.11 116.72 2ol5 h GLN 112 Ca -0.47 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 56.53 2ol5 h GLN 112 Cb 1.30 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.75 2ol5 h GLN 112 CO 0.83 0.00 -0.78 0.78 -0.95 0.00 0.00 178.83 178.71 2ol5 h GLY 113 N 3.25 0.65 0.81 3.46 0.00 -2.03 -3.33 103.07 105.88 2ol5 h GLY 113 Ca 0.00 -1.08 -0.04 0.00 0.00 0.00 0.00 47.33 46.21 2ol5 h GLY 113 CO 0.00 0.96 -0.03 0.83 0.00 0.00 0.00 176.54 178.30 2ol5 h GLU 114 N 0.20 0.38 0.00 4.80 5.08 -1.90 -1.32 114.58 121.81 2ol5 h GLU 114 Ca -0.09 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 2ol5 h GLU 114 Cb 1.45 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.67 2ol5 h GLU 114 CO 0.15 0.61 0.00 0.28 -1.00 0.00 0.00 179.01 179.05 2ol5 n VAL 115 N -4.65 0.00 0.00 3.13 0.31 -0.80 -1.54 118.33 114.78 2ol5 n VAL 115 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 2ol5 n VAL 115 Cb 0.26 -0.25 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2ol5 n VAL 115 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2ol5 n GLN 117 N -0.00 0.00 0.22 5.55 -0.06 -0.50 -1.23 117.38 121.35 2ol5 n GLN 117 Ca 0.00 0.00 0.10 0.00 -2.00 0.00 0.00 57.00 55.10 2ol5 n GLN 117 Cb 0.00 0.00 0.41 0.00 -4.06 0.00 0.00 30.24 26.59 2ol5 n GLN 117 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 2ol5 h SER 118 N 0.00 0.00 0.05 1.69 4.64 -1.56 -1.55 113.55 116.82 2ol5 h SER 118 Ca 0.00 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.12 2ol5 h SER 118 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2ol5 h SER 118 CO 0.00 0.23 -0.73 -0.07 -0.87 0.00 0.00 176.83 175.39 2ol5 h LEU 119 N 0.00 0.71 0.35 5.97 3.38 -1.43 -3.31 115.31 120.98 2ol5 h LEU 119 Ca -0.00 -0.46 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 2ol5 h LEU 119 Cb 0.82 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 2ol5 h LEU 119 CO 0.03 1.22 -0.28 -0.74 0.09 0.00 0.00 178.44 178.77 2ol5 h HIS 120 N 0.42 -0.73 0.00 1.13 2.76 -1.74 -0.72 115.15 116.26 2ol5 h HIS 120 Ca -0.04 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.13 2ol5 h HIS 120 Cb 1.33 0.27 0.00 0.00 1.55 0.00 0.00 27.41 30.56 2ol5 h HIS 120 CO 0.06 -0.41 0.00 -0.25 -1.30 0.00 0.00 177.93 176.03 2ol5 n ASP 121 N -5.40 0.00 0.00 3.26 9.92 -0.61 -1.54 116.55 122.18 2ol5 n ASP 121 Ca -0.10 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.16 2ol5 n ASP 121 Cb 0.30 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.78 2ol5 n ASP 121 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2ol5 n VAL 123 N 0.75 0.00 0.11 2.53 0.31 -0.28 -2.43 118.33 119.33 2ol5 n VAL 123 Ca 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 64.34 64.48 2ol5 n VAL 123 Cb 0.00 0.00 0.66 0.00 -0.91 0.00 0.00 33.84 33.59 2ol5 n VAL 123 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2ol5 h GLU 124 N 0.00 0.02 -0.03 5.55 4.39 -1.55 0.20 114.58 123.15 2ol5 h GLU 124 Ca 0.00 -0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.46 2ol5 h GLU 124 Cb 0.00 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.66 2ol5 h GLU 124 CO 0.00 0.01 -0.94 -0.22 -1.16 0.00 0.00 179.01 176.70 2ol5 h LYS 125 N 0.02 0.60 0.00 2.33 1.63 -1.74 -3.38 116.57 116.03 2ol5 h LYS 125 Ca 0.14 -0.61 -0.11 0.00 -0.85 0.00 0.00 60.65 59.22 2ol5 h LYS 125 Cb 0.55 0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 32.32 2ol5 h LYS 125 CO -0.00 1.22 -1.79 0.66 -3.45 0.00 0.00 179.45 176.09 2ol5 n TYR 126 N -3.83 0.00 -2.06 1.91 4.01 -0.88 -4.97 117.16 111.34 2ol5 n TYR 126 Ca -0.08 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.27 2ol5 n TYR 126 Cb 0.83 -0.49 0.00 0.00 -0.31 0.00 0.00 39.34 39.38 2ol5 n TYR 126 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2ol5 s GLU 127 N -2.70 3.70 0.34 -0.72 0.41 0.65 -4.98 118.70 115.40 2ol5 s GLU 127 Ca -0.06 2.04 -0.27 0.00 -0.41 0.00 0.00 54.97 56.27 2ol5 s GLU 127 Cb 0.07 -2.51 -0.09 0.00 -1.78 0.00 0.00 34.13 29.81 2ol5 s GLU 127 CO 0.58 -0.68 1.10 0.00 -0.49 0.00 0.00 175.26 175.77 2ol5 s ALA 128 N -1.37 3.26 0.26 5.21 0.00 -1.26 -4.91 121.76 122.96 2ol5 s ALA 128 Ca 0.63 0.85 0.16 0.00 0.00 0.00 0.00 51.96 53.59 2ol5 s ALA 128 Cb -0.35 -3.32 0.93 0.00 0.00 0.00 0.00 23.12 20.38 2ol5 s ALA 128 CO 0.44 -0.24 1.07 -2.30 0.00 0.00 0.00 175.76 174.73 2ol5 n PRO 129 N 0.61 -0.04 -0.82 0.00 -0.02 -1.26 0.25 135.00 133.72 2ol5 n PRO 129 Ca 0.02 0.93 0.07 0.00 -2.02 0.00 0.00 63.50 62.49 2ol5 n PRO 129 Cb 0.47 -1.69 0.37 0.00 -0.02 0.00 0.00 33.50 32.63 2ol5 n PRO 129 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ol5 n GLY 130 N -1.20 3.25 3.74 -1.23 0.00 -1.26 -4.96 105.19 103.53 2ol5 n GLY 130 Ca 0.26 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.91 2ol5 n GLY 130 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ol5 s SER 131 N -1.04 7.40 0.00 1.61 0.15 0.69 -4.91 113.70 117.61 2ol5 s SER 131 Ca 0.52 1.97 0.20 0.00 0.70 0.00 0.00 55.95 59.34 2ol5 s SER 131 Cb 0.40 -2.60 0.55 0.00 -1.71 0.00 0.00 66.02 62.66 2ol5 s SER 131 CO 0.14 -0.11 1.44 0.54 1.20 0.00 0.00 173.24 176.45 2ol5 n ARG 132 N 2.36 2.13 -2.50 5.44 5.12 -1.26 -4.94 116.66 123.01 2ol5 n ARG 132 Ca 0.02 -1.72 -0.41 0.00 -1.93 0.00 0.00 57.85 53.81 2ol5 n ARG 132 Cb 0.47 -1.43 -0.04 0.00 -1.16 0.00 0.00 32.46 30.30 2ol5 n ARG 132 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 2ol5 s TYR 133 N -1.54 3.59 0.00 -1.55 5.04 -1.26 -4.86 117.35 116.78 2ol5 s TYR 133 Ca 0.35 1.64 0.00 0.00 -2.44 0.00 0.00 57.07 56.62 2ol5 s TYR 133 Cb 0.19 -3.28 0.00 0.00 0.35 0.00 0.00 41.96 39.22 2ol5 s TYR 133 CO 0.27 -0.58 0.00 0.00 -1.34 0.00 0.00 175.55 173.90 2ol5 n GLN 134 N 1.84 0.00 0.00 4.97 10.64 -1.26 -5.04 117.38 128.53 2ol5 n GLN 134 Ca 0.01 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.18 2ol5 n GLN 134 Cb 0.45 -0.11 0.00 0.00 -0.86 0.00 0.00 30.24 29.73 2ol5 n GLN 134 CO 0.00 0.00 0.00 1.47 -1.83 0.00 0.00 177.06 176.70 2ol5 n LEU 135 N -1.16 0.00 0.00 2.61 -0.00 -1.26 -5.03 117.00 112.15 2ol5 n LEU 135 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2ol5 n LEU 135 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2ol5 n LEU 135 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 177.39 177.28 2ol5 n LEU 143 N 0.00 0.00 0.14 1.47 0.00 -1.26 -5.27 117.00 112.09 2ol5 n LEU 143 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 56.01 56.14 2ol5 n LEU 143 Cb 0.00 0.00 0.42 0.00 0.00 0.00 0.00 43.42 43.84 2ol5 n LEU 143 CO 0.00 0.00 0.88 0.77 0.00 0.00 0.00 177.39 179.04 2ol5 h SER 144 N 0.04 0.00 0.00 1.96 4.64 -2.07 -2.89 113.55 115.23 2ol5 h SER 144 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ol5 h SER 144 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2ol5 h SER 144 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2ol5 n GLY 145 N 0.82 1.56 0.00 -0.77 0.00 -1.26 -0.05 105.19 105.50 2ol5 n GLY 145 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2ol5 n GLY 145 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ol5 n ASN 147 N 1.58 0.00 -0.22 1.61 5.15 -1.09 -1.51 115.26 120.79 2ol5 n ASN 147 Ca 0.00 0.00 0.03 0.00 -0.60 0.00 0.00 54.58 54.01 2ol5 n ASN 147 Cb 0.28 0.00 0.29 0.00 -0.53 0.00 0.00 39.78 39.82 2ol5 n ASN 147 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 2ol5 h LYS 148 N 0.00 0.89 0.00 1.20 1.57 -0.79 -3.28 116.57 116.17 2ol5 h LYS 148 Ca 0.00 -0.05 -0.19 0.00 -1.87 0.00 0.00 60.65 58.54 2ol5 h LYS 148 Cb 0.00 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.08 2ol5 h LYS 148 CO 0.00 0.59 -0.94 0.78 -0.57 0.00 0.00 179.45 179.31 2ol5 h GLY 149 N 0.92 0.00 -2.05 3.86 0.00 -1.50 -3.45 103.07 100.84 2ol5 h GLY 149 Ca 0.31 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 47.03 2ol5 h GLY 149 CO -0.09 0.00 -0.68 -0.26 0.00 0.00 0.00 176.54 175.51 2ol5 s ILE 150 N -2.78 2.42 -0.42 2.60 -4.36 -1.24 -1.50 121.20 115.91 2ol5 s ILE 150 Ca 0.01 -2.18 0.02 0.00 -0.26 0.00 0.00 60.65 58.24 2ol5 s ILE 150 Cb 0.09 -2.62 0.14 0.00 1.25 0.00 0.00 42.46 41.32 2ol5 s ILE 150 CO 0.80 -0.25 0.23 -1.58 0.24 0.00 0.00 174.94 174.39 2ol5 s GLN 151 N -3.62 1.17 0.98 0.37 2.00 -0.44 -4.71 119.66 115.41 2ol5 s GLN 151 Ca 0.32 -1.90 -0.11 0.00 -2.00 0.00 0.00 55.36 51.68 2ol5 s GLN 151 Cb 0.00 -2.18 0.16 0.00 0.80 0.00 0.00 33.01 31.79 2ol5 s GLN 151 CO 0.17 -1.17 1.00 0.00 -0.50 0.00 0.00 175.29 174.79 2ol5 n ALA 152 N 3.63 -1.54 -3.76 1.58 0.00 -1.26 -1.90 120.51 117.26 2ol5 n ALA 152 Ca 0.09 -0.71 -0.04 0.00 0.00 0.00 0.00 53.44 52.78 2ol5 n ALA 152 Cb 0.35 -2.09 -0.01 0.00 0.00 0.00 0.00 19.45 17.69 2ol5 n ALA 152 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2ol5 s PHE 153 N -2.55 -0.15 0.06 0.00 -0.12 -0.68 -2.44 117.98 112.09 2ol5 s PHE 153 Ca 0.66 -0.17 0.03 0.00 -0.05 0.00 0.00 56.93 57.40 2ol5 s PHE 153 Cb -0.23 0.65 -0.03 0.00 -0.63 0.00 0.00 43.02 42.78 2ol5 s PHE 153 CO 0.61 -0.89 -0.10 -1.59 -0.05 0.00 0.00 175.22 173.19 2ol5 s LYS 154 N -3.40 0.70 -0.36 1.99 -2.85 -0.06 -2.24 119.74 113.52 2ol5 s LYS 154 Ca 0.12 -0.92 -0.04 0.00 -1.00 0.00 0.00 55.97 54.12 2ol5 s LYS 154 Cb -0.02 -0.52 0.07 0.00 -2.06 0.00 0.00 37.83 35.30 2ol5 s LYS 154 CO 0.02 0.10 0.13 0.42 0.10 0.00 0.00 175.35 176.13 2ol5 s ILE 155 N -1.61 3.47 0.05 3.79 1.01 0.67 -1.06 121.20 127.52 2ol5 s ILE 155 Ca -0.04 -1.56 -0.31 0.00 0.00 0.00 0.00 60.65 58.75 2ol5 s ILE 155 Cb -0.08 -3.14 -0.08 0.00 0.01 0.00 0.00 42.46 39.17 2ol5 s ILE 155 CO 0.01 -0.39 1.61 -0.63 0.00 0.00 0.00 174.94 175.54 2ol5 s ILE 156 N 1.28 3.17 -0.04 2.92 1.01 -0.46 -1.51 121.20 127.56 2ol5 s ILE 156 Ca 0.01 0.60 -0.28 0.00 0.00 0.00 0.00 60.65 60.98 2ol5 s ILE 156 Cb -0.21 -3.39 -0.03 0.00 0.01 0.00 0.00 42.46 38.84 2ol5 s ILE 156 CO -0.01 -0.00 0.90 -0.63 0.00 0.00 0.00 174.94 175.20 2ol5 s ILE 157 N 2.62 4.91 -0.22 2.92 1.01 -0.87 -2.21 121.20 129.36 2ol5 s ILE 157 Ca 0.72 1.87 -0.10 0.00 0.00 0.00 0.00 60.65 63.14 2ol5 s ILE 157 Cb -0.38 -4.23 -0.10 0.00 0.01 0.00 0.00 42.46 37.76 2ol5 s ILE 157 CO 0.31 0.16 -0.27 0.29 0.00 0.00 0.00 174.94 175.43 2ol5 n LYS 158 N 4.05 0.47 -3.83 2.79 5.02 0.32 -4.92 118.16 122.06 2ol5 n LYS 158 Ca 0.04 0.20 -0.10 0.00 -2.02 0.00 0.00 58.31 56.43 2ol5 n LYS 158 Cb 0.51 -1.28 -0.07 0.00 -0.02 0.00 0.00 35.03 34.16 2ol5 n LYS 158 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2ol5 s ARG 159 N -2.40 0.80 -0.07 1.97 1.70 -0.83 -4.99 118.95 115.13 2ol5 s ARG 159 Ca -0.30 -0.79 0.02 0.00 -0.47 0.00 0.00 55.73 54.19 2ol5 s ARG 159 Cb 0.11 0.33 0.01 0.00 -0.57 0.00 0.00 34.95 34.84 2ol5 s ARG 159 CO 0.39 -0.25 -0.12 0.42 -1.08 0.00 0.00 175.30 174.66 2ol5 s ILE 160 N -3.30 1.12 -0.10 4.99 1.01 -1.26 -0.48 121.20 123.18 2ol5 s ILE 160 Ca 0.01 -0.47 0.02 0.00 0.00 0.00 0.00 60.65 60.21 2ol5 s ILE 160 Cb 0.02 -1.03 0.01 0.00 0.01 0.00 0.00 42.46 41.47 2ol5 s ILE 160 CO -0.08 0.35 -0.15 -1.61 0.00 0.00 0.00 174.94 173.46 2ol5 s GLU 161 N 0.70 2.10 -0.05 2.79 2.02 -0.51 -4.99 118.70 120.76 2ol5 s GLU 161 Ca -0.14 -0.52 0.02 0.00 0.02 0.00 0.00 54.97 54.35 2ol5 s GLU 161 Cb -0.16 -1.78 -0.03 0.00 0.10 0.00 0.00 34.13 32.27 2ol5 s GLU 161 CO 0.03 -0.04 -0.10 0.20 0.02 0.00 0.00 175.26 175.37 2ol5 s GLY 162 N 0.92 1.63 -0.04 -1.39 0.00 -1.26 -0.28 107.32 106.90 2ol5 s GLY 162 Ca -0.09 -0.95 0.05 0.00 0.00 0.00 0.00 44.72 43.73 2ol5 s GLY 162 CO -0.00 -0.75 -0.18 0.54 0.00 0.00 0.00 173.10 172.71 2ol5 s LYS 163 N -0.87 1.80 -0.42 2.90 3.01 0.29 -4.66 119.74 121.79 2ol5 s LYS 163 Ca 0.13 -0.66 0.07 0.00 -1.01 0.00 0.00 55.97 54.50 2ol5 s LYS 163 Cb -0.11 -1.60 0.22 0.00 -1.01 0.00 0.00 37.83 35.34 2ol5 s LYS 163 CO 0.02 0.30 0.54 0.00 0.51 0.00 0.00 175.35 176.72 2ol5 n ALA 164 N 2.99 1.70 -2.02 5.17 0.00 -1.26 -0.45 120.51 126.63 2ol5 n ALA 164 Ca -0.17 -2.88 -0.43 0.00 0.00 0.00 0.00 53.44 49.96 2ol5 n ALA 164 Cb 0.53 -0.92 -0.03 0.00 0.00 0.00 0.00 19.45 19.04 2ol5 n ALA 164 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2ol5 s LYS 165 N -0.47 3.70 -0.02 0.00 2.20 -0.71 -4.80 119.74 119.63 2ol5 s LYS 165 Ca 0.34 1.72 0.14 0.00 -0.36 0.00 0.00 55.97 57.81 2ol5 s LYS 165 Cb 0.14 -4.10 0.25 0.00 -1.51 0.00 0.00 37.83 32.60 2ol5 s LYS 165 CO -0.15 -1.42 1.10 1.28 -0.36 0.00 0.00 175.35 175.80 2ol5 n LEU 166 N 8.92 0.81 -0.96 5.43 4.77 -1.26 -2.20 117.00 132.52 2ol5 n LEU 166 Ca 0.20 -1.81 -0.12 0.00 -0.03 0.00 0.00 56.01 54.25 2ol5 n LEU 166 Cb 0.45 -0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.42 2ol5 n LEU 166 CO 0.66 0.48 -0.12 -1.20 -1.33 0.00 0.00 177.39 175.88 2ol5 n SER 167 N 0.04 -5.46 0.00 -1.43 7.64 -1.26 -4.83 113.62 108.32 2ol5 n SER 167 Ca 0.05 0.31 0.06 0.00 1.01 0.00 0.00 58.87 60.30 2ol5 n SER 167 Cb 0.90 -4.06 0.35 0.00 -1.01 0.00 0.00 64.21 60.39 2ol5 n SER 167 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ol5 n GLN 168 N -1.36 0.31 0.17 1.43 0.00 -1.26 -1.48 117.38 115.19 2ol5 n GLN 168 Ca -0.12 0.07 0.12 0.00 0.00 0.00 0.00 57.00 57.07 2ol5 n GLN 168 Cb 0.57 -1.50 0.27 0.00 0.00 0.00 0.00 30.24 29.58 2ol5 n GLN 168 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.06 176.09 2ol5 h ASN 169 N 0.00 0.00 -2.78 2.61 -0.73 -2.00 -3.47 115.58 109.21 2ol5 h ASN 169 Ca 0.00 -0.00 -0.45 0.00 1.87 0.00 0.00 56.30 57.72 2ol5 h ASN 169 Cb 0.04 0.00 0.04 0.00 0.27 0.00 0.00 38.32 38.67 2ol5 h ASN 169 CO 0.00 0.00 -0.04 -1.00 -0.37 0.00 0.00 177.43 176.02 2ol5 s HIS 170 N -3.16 3.09 0.69 0.67 3.76 -0.55 -5.08 115.29 114.71 2ol5 s HIS 170 Ca 0.09 0.19 -0.15 0.00 -0.15 0.00 0.00 55.06 55.04 2ol5 s HIS 170 Cb 0.08 -2.53 0.01 0.00 1.11 0.00 0.00 32.58 31.25 2ol5 s HIS 170 CO 0.64 -0.62 1.13 -2.14 -0.85 0.00 0.00 174.74 172.90 2ol5 s PRO 171 N -4.69 2.60 0.45 8.40 0.02 -1.26 -4.89 135.00 135.63 2ol5 s PRO 171 Ca 0.52 1.44 0.19 0.00 0.02 0.00 0.00 61.00 63.18 2ol5 s PRO 171 Cb -0.10 -1.92 1.15 0.00 0.02 0.00 0.00 34.50 33.65 2ol5 s PRO 171 CO 0.39 -1.42 1.92 0.00 -0.33 0.00 0.00 177.00 177.56 2ol5 h ALA 172 N -0.15 2.26 -0.13 -1.55 0.00 -1.96 -2.63 119.26 115.10 2ol5 h ALA 172 Ca -0.47 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.39 2ol5 h ALA 172 Cb 1.25 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 2ol5 h ALA 172 CO 0.53 -0.47 -0.14 1.12 0.00 0.00 0.00 179.25 180.29 2ol5 h HIS 173 N 0.31 0.38 -0.81 0.00 -0.00 -2.00 -2.23 115.15 110.80 2ol5 h HIS 173 Ca 0.37 -0.12 0.06 0.00 -0.00 0.00 0.00 60.37 60.69 2ol5 h HIS 173 Cb 1.01 -0.08 -0.05 0.00 -0.00 0.00 0.00 27.41 28.28 2ol5 h HIS 173 CO -0.00 0.73 0.53 -0.09 -0.00 0.00 0.00 177.93 179.10 2ol5 h ARG 174 N -0.08 0.86 -0.87 5.12 2.43 -1.86 -1.10 114.38 118.88 2ol5 h ARG 174 Ca 0.02 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.11 2ol5 h ARG 174 Cb 0.67 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.98 2ol5 h ARG 174 CO 0.03 0.57 0.44 1.96 -1.51 0.00 0.00 179.97 181.46 2ol5 h GLN 175 N 0.89 1.24 -0.35 0.20 4.20 -1.36 -2.04 115.11 117.88 2ol5 h GLN 175 Ca 0.35 -0.17 -0.08 0.00 0.06 0.00 0.00 58.65 58.81 2ol5 h GLN 175 Cb 0.23 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 2ol5 h GLN 175 CO -0.12 0.93 -0.13 0.93 -0.67 0.00 0.00 178.83 179.77 2ol5 h GLU 176 N 1.23 0.63 -0.01 1.46 5.08 -0.60 -1.34 114.58 121.03 2ol5 h GLU 176 Ca 0.30 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2ol5 h GLU 176 Cb 0.08 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 2ol5 h GLU 176 CO -0.04 0.74 0.01 0.00 -1.00 0.00 0.00 179.01 178.71 2ol5 h ARG 177 N 0.57 0.02 -0.45 2.33 3.08 -0.94 0.06 114.38 119.04 2ol5 h ARG 177 Ca 0.10 -0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.21 2ol5 h ARG 177 Cb 0.56 -0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.55 2ol5 h ARG 177 CO 0.04 0.13 0.13 0.82 -1.07 0.00 0.00 179.97 180.02 2ol5 h ILE 178 N -0.10 0.81 0.09 2.04 2.04 -1.21 -1.49 117.51 119.70 2ol5 h ILE 178 Ca 0.00 -0.10 0.01 0.00 1.00 0.00 0.00 64.86 65.77 2ol5 h ILE 178 Cb 0.12 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2ol5 h ILE 178 CO -0.00 0.05 -0.11 0.40 0.00 0.00 0.00 178.15 178.50 2ol5 h ILE 179 N 0.29 0.76 -0.69 -0.67 2.04 -1.11 -0.01 117.51 118.12 2ol5 h ILE 179 Ca 0.22 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.20 2ol5 h ILE 179 Cb 0.24 0.76 -0.09 0.00 -0.74 0.00 0.00 36.82 36.99 2ol5 h ILE 179 CO -0.25 0.00 0.24 0.11 0.00 0.00 0.00 178.15 178.26 2ol5 h LYS 180 N -0.23 0.38 -0.13 2.37 1.57 -0.58 -0.30 116.57 119.65 2ol5 h LYS 180 Ca 0.01 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.67 2ol5 h LYS 180 Cb 0.23 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.45 2ol5 h LYS 180 CO -0.04 0.25 -0.28 0.37 -0.57 0.00 0.00 179.45 179.19 2ol5 h GLN 181 N 0.39 0.42 -0.23 3.15 5.75 -1.10 -3.25 115.11 120.25 2ol5 h GLN 181 Ca 0.37 -0.28 -0.10 0.00 -0.15 0.00 0.00 58.65 58.49 2ol5 h GLN 181 Cb 0.53 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.10 2ol5 h GLN 181 CO -0.38 0.88 -0.30 -0.07 -2.65 0.00 0.00 178.83 176.31 2ol5 h LEU 182 N 0.01 0.46 -0.57 -2.39 3.38 -0.42 -3.14 115.31 112.63 2ol5 h LEU 182 Ca 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2ol5 h LEU 182 Cb 0.87 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2ol5 h LEU 182 CO 0.06 0.75 0.00 1.05 0.09 0.00 0.00 178.44 180.39 2ol5 h GLU 183 N 0.40 0.00 -4.00 1.13 4.11 -1.13 -3.37 114.58 111.72 2ol5 h GLU 183 Ca 0.05 0.00 -0.78 0.00 0.07 0.00 0.00 59.36 58.71 2ol5 h GLU 183 Cb 0.73 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 29.73 2ol5 h GLU 183 CO 0.06 0.00 0.71 -0.65 0.07 0.00 0.00 179.01 179.20 2ol5 s GLN 184 N -3.37 4.10 -0.37 1.06 -0.21 -1.19 -4.95 119.66 114.73 2ol5 s GLN 184 Ca 0.05 -2.92 0.11 0.00 0.02 0.00 0.00 55.36 52.63 2ol5 s GLN 184 Cb 0.07 -4.71 0.33 0.00 1.00 0.00 0.00 33.01 29.70 2ol5 s GLN 184 CO 0.60 -1.42 0.71 -0.35 -2.12 0.00 0.00 175.29 172.70 2ol5 n PRO 186 N 3.84 0.93 -3.86 2.91 -0.04 -1.26 -5.08 135.00 132.43 2ol5 n PRO 186 Ca 0.27 -3.33 -0.12 0.00 -0.04 0.00 0.00 63.50 60.28 2ol5 n PRO 186 Cb 0.41 -1.63 -0.13 0.00 -0.04 0.00 0.00 33.50 32.11 2ol5 n PRO 186 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2ol5 s PHE 187 N -2.20 -0.03 0.12 0.54 0.40 -1.26 -5.08 117.98 110.46 2ol5 s PHE 187 Ca 0.39 0.08 -0.22 0.00 -0.60 0.00 0.00 56.93 56.58 2ol5 s PHE 187 Cb 0.32 0.00 -0.07 0.00 0.51 0.00 0.00 43.02 43.79 2ol5 s PHE 187 CO -0.08 -0.04 1.70 0.93 0.70 0.00 0.00 175.22 178.42 2ol5 h GLU 188 N 5.95 -0.11 0.11 0.44 5.08 -1.99 -2.61 114.58 121.44 2ol5 h GLU 188 Ca -0.25 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.11 2ol5 h GLU 188 Cb 1.21 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2ol5 h GLU 188 CO 0.47 -0.08 -0.05 -0.91 -1.00 0.00 0.00 179.01 177.45 2ol5 h ASN 189 N -0.12 -0.12 -0.30 1.42 2.35 -1.99 0.17 115.58 117.00 2ol5 h ASN 189 Ca 0.06 -0.01 0.07 0.00 -0.55 0.00 0.00 56.30 55.87 2ol5 h ASN 189 Cb 0.20 0.03 -0.07 0.00 0.05 0.00 0.00 38.32 38.53 2ol5 h ASN 189 CO -0.14 -0.07 -0.15 -0.33 -1.65 0.00 0.00 177.43 175.08 2ol5 h GLU 190 N -0.16 -0.11 -0.58 0.81 3.07 -1.73 0.12 114.58 115.99 2ol5 h GLU 190 Ca -0.01 0.01 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 2ol5 h GLU 190 Cb 0.12 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.03 2ol5 h GLU 190 CO 0.02 -0.07 0.18 0.87 -1.40 0.00 0.00 179.01 178.61 2ol5 h LYS 191 N -0.11 0.91 -0.22 2.33 1.57 -1.20 0.71 116.57 120.55 2ol5 h LYS 191 Ca 0.16 -0.20 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 2ol5 h LYS 191 Cb 0.35 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 2ol5 h LYS 191 CO -0.37 0.82 0.03 0.00 -0.57 0.00 0.00 179.45 179.35 2ol5 h ARG 192 N 0.83 0.36 -0.71 3.15 3.08 -0.25 0.20 114.38 121.03 2ol5 h ARG 192 Ca 0.19 -0.10 0.09 0.00 0.07 0.00 0.00 59.98 60.23 2ol5 h ARG 192 Cb 0.29 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.25 2ol5 h ARG 192 CO -0.01 0.52 0.47 0.82 -1.07 0.00 0.00 179.97 180.70 2ol5 h ILE 193 N 0.15 0.94 -0.25 2.04 1.08 -0.67 -1.40 117.51 119.40 2ol5 h ILE 193 Ca 0.06 -0.21 -0.12 0.00 -0.39 0.00 0.00 64.86 64.20 2ol5 h ILE 193 Cb 0.34 0.27 -0.01 0.00 -3.07 0.00 0.00 36.82 34.35 2ol5 h ILE 193 CO 0.01 0.11 -0.36 0.00 -0.69 0.00 0.00 178.15 177.22 2ol5 h ALA 194 N 1.64 0.92 -0.14 1.87 0.00 0.02 -2.92 119.26 120.64 2ol5 h ALA 194 Ca 0.32 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 2ol5 h ALA 194 Cb 0.45 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2ol5 h ALA 194 CO -0.11 0.62 -0.37 0.77 0.00 0.00 0.00 179.25 180.17 2ol5 h SER 195 N 0.46 0.31 0.00 0.00 0.02 0.05 -3.24 113.55 111.16 2ol5 h SER 195 Ca 0.05 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 2ol5 h SER 195 Cb 0.83 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.29 2ol5 h SER 195 CO 0.07 0.66 0.00 0.18 -1.14 0.00 0.00 176.83 176.60 2ol5 n LEU 196 N -4.06 0.34 0.00 5.07 4.77 -0.75 -3.40 117.00 118.97 2ol5 n LEU 196 Ca -0.01 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 2ol5 n LEU 196 Cb 0.46 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2ol5 n LEU 196 CO 0.42 0.09 0.00 0.29 -1.33 0.00 0.00 177.39 176.85 2ol5 n LYS 198 N 0.30 0.00 0.00 3.23 5.02 -1.22 -5.12 118.16 120.36 2ol5 n LYS 198 Ca 0.00 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.32 2ol5 n LYS 198 Cb 0.09 0.00 0.18 0.00 -0.02 0.00 0.00 35.03 35.28 2ol5 n LYS 198 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51