#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bk0 s VAL 4 N 0.00 3.67 0.55 -3.33 1.01 -1.26 -5.11 120.40 115.93 1bk0 s VAL 4 Ca 0.00 -0.47 -0.19 0.00 0.00 0.00 0.00 61.98 61.32 1bk0 s VAL 4 Cb 0.00 -2.53 -0.05 0.00 0.00 0.00 0.00 36.38 33.79 1bk0 s VAL 4 CO 0.00 0.56 1.10 -0.44 0.00 0.00 0.00 175.10 176.32 1bk0 s SER 5 N -0.37 5.80 0.03 3.32 0.01 -1.26 -4.78 113.70 116.45 1bk0 s SER 5 Ca 0.05 2.05 -0.28 0.00 1.31 0.00 0.00 55.95 59.08 1bk0 s SER 5 Cb -0.12 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.50 1bk0 s SER 5 CO 0.02 -1.16 0.89 -0.75 0.41 0.00 0.00 173.24 172.66 1bk0 s LYS 6 N -3.47 4.57 0.40 12.44 2.20 -1.26 -1.13 119.74 133.50 1bk0 s LYS 6 Ca 0.70 1.28 -0.24 0.00 -0.36 0.00 0.00 55.97 57.35 1bk0 s LYS 6 Cb -0.21 -3.41 -0.09 0.00 -1.51 0.00 0.00 37.83 32.61 1bk0 s LYS 6 CO 0.28 0.11 1.07 0.00 -0.36 0.00 0.00 175.35 176.46 1bk0 s ALA 7 N 0.46 3.08 -0.52 3.13 0.00 0.26 -4.82 121.76 123.35 1bk0 s ALA 7 Ca 0.46 0.75 -0.28 0.00 0.00 0.00 0.00 51.96 52.89 1bk0 s ALA 7 Cb -0.21 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 19.63 1bk0 s ALA 7 CO 0.26 -0.29 1.42 1.21 0.00 0.00 0.00 175.76 178.37 1bk0 s ASN 8 N -1.49 6.16 -0.42 0.00 2.47 -1.26 -4.79 114.94 115.60 1bk0 s ASN 8 Ca 0.58 0.44 0.02 0.00 0.42 0.00 0.00 52.86 54.32 1bk0 s ASN 8 Cb -0.24 -2.54 0.13 0.00 -1.45 0.00 0.00 41.25 37.15 1bk0 s ASN 8 CO 0.29 -1.65 0.23 -0.69 -3.72 0.00 0.00 177.10 171.56 1bk0 s VAL 9 N 5.96 1.28 0.65 -5.21 1.01 -1.26 -4.59 120.40 118.24 1bk0 s VAL 9 Ca 0.55 -2.42 -0.16 0.00 0.00 0.00 0.00 61.98 59.95 1bk0 s VAL 9 Cb -0.12 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.35 1bk0 s VAL 9 CO 0.27 -0.89 1.16 -2.16 0.00 0.00 0.00 175.10 173.48 1bk0 s PRO 10 N 0.49 2.74 -0.28 2.72 0.04 -1.26 -4.59 135.00 134.87 1bk0 s PRO 10 Ca 0.17 1.61 -0.14 0.00 0.04 0.00 0.00 61.00 62.68 1bk0 s PRO 10 Cb -0.24 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 1bk0 s PRO 10 CO -0.01 -1.34 0.35 0.15 0.04 0.00 0.00 177.00 176.20 1bk0 s LYS 11 N -3.77 3.96 -0.19 4.56 1.02 -1.26 -0.65 119.74 123.42 1bk0 s LYS 11 Ca 0.72 -0.04 -0.02 0.00 0.02 0.00 0.00 55.97 56.64 1bk0 s LYS 11 Cb -0.25 -3.67 -0.01 0.00 -0.52 0.00 0.00 37.83 33.38 1bk0 s LYS 11 CO 0.38 -0.29 -0.09 0.42 -0.92 0.00 0.00 175.35 174.86 1bk0 s ILE 12 N 2.03 3.12 -0.45 2.17 1.01 0.46 -4.96 121.20 124.58 1bk0 s ILE 12 Ca 0.14 -0.59 -0.28 0.00 0.00 0.00 0.00 60.65 59.91 1bk0 s ILE 12 Cb -0.16 -2.38 0.01 0.00 0.01 0.00 0.00 42.46 39.94 1bk0 s ILE 12 CO 0.10 0.46 1.48 -0.62 0.00 0.00 0.00 174.94 176.37 1bk0 s ASP 13 N 1.18 6.17 0.00 3.58 -1.08 -1.26 -1.20 116.67 124.06 1bk0 s ASP 13 Ca 0.02 0.72 0.21 0.00 -0.52 0.00 0.00 52.55 52.98 1bk0 s ASP 13 Cb -0.14 -2.54 0.54 0.00 -1.46 0.00 0.00 42.92 39.32 1bk0 s ASP 13 CO -0.03 -1.59 1.45 1.33 0.52 0.00 0.00 175.17 176.86 1bk0 n VAL 14 N 7.08 0.44 -0.20 1.11 0.24 -0.78 -4.49 118.33 121.72 1bk0 n VAL 14 Ca 0.16 -0.60 0.10 0.00 -2.04 0.00 0.00 64.34 61.96 1bk0 n VAL 14 Cb 0.48 0.65 0.39 0.00 -1.47 0.00 0.00 33.84 33.90 1bk0 n VAL 14 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1bk0 h SER 15 N 3.44 0.60 0.13 -1.34 4.64 -1.74 -1.08 113.55 118.20 1bk0 h SER 15 Ca 0.00 0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1bk0 h SER 15 Cb 0.76 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1bk0 h SER 15 CO 0.00 0.35 -0.02 -0.65 -0.87 0.00 0.00 176.83 175.64 1bk0 h PRO 16 N 0.66 0.00 0.00 4.77 0.11 -1.93 -2.07 132.00 133.54 1bk0 h PRO 16 Ca 0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.47 1bk0 h PRO 16 Cb 0.51 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.62 1bk0 h PRO 16 CO -0.13 0.02 0.00 1.28 -0.21 0.00 0.00 178.00 178.95 1bk0 n LEU 17 N -3.41 0.00 -0.20 2.35 4.77 -0.41 -1.67 117.00 118.43 1bk0 n LEU 17 Ca -0.03 0.49 0.12 0.00 -0.03 0.00 0.00 56.01 56.56 1bk0 n LEU 17 Cb 0.12 -0.49 0.18 0.00 -2.33 0.00 0.00 43.42 40.89 1bk0 n LEU 17 CO 0.24 -0.26 0.41 0.49 -1.33 0.00 0.00 177.39 176.94 1bk0 n PHE 18 N -1.49 0.00 -3.04 -1.77 3.72 -0.78 -4.75 117.46 109.35 1bk0 n PHE 18 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 1bk0 n PHE 18 Cb 0.15 -0.10 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 1bk0 n PHE 18 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bk0 n GLY 19 N 1.42 6.41 0.54 1.37 0.00 -0.67 -5.08 105.19 109.18 1bk0 n GLY 19 Ca 0.09 -2.06 0.08 0.00 0.00 0.00 0.00 46.02 44.13 1bk0 n GLY 19 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bk0 n ASP 20 N -0.24 3.03 -4.45 1.61 8.00 -1.26 -4.91 116.55 118.33 1bk0 n ASP 20 Ca 0.00 -3.14 -0.44 0.00 0.71 0.00 0.00 54.79 51.93 1bk0 n ASP 20 Cb 0.00 -0.50 -0.03 0.00 -0.02 0.00 0.00 41.12 40.57 1bk0 n ASP 20 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1bk0 s ASP 21 N -2.45 6.42 0.25 -2.24 -1.08 -1.26 -4.90 116.67 111.41 1bk0 s ASP 21 Ca 0.38 -1.58 -0.06 0.00 -0.52 0.00 0.00 52.55 50.77 1bk0 s ASP 21 Cb 0.32 -2.40 0.27 0.00 -1.46 0.00 0.00 42.92 39.65 1bk0 s ASP 21 CO 0.05 -1.22 1.90 1.56 0.52 0.00 0.00 175.17 177.98 1bk0 h GLN 22 N 9.16 1.26 -0.64 4.34 1.08 -1.95 -1.40 115.11 126.97 1bk0 h GLN 22 Ca -0.05 -0.11 -0.05 0.00 -1.45 0.00 0.00 58.65 56.99 1bk0 h GLN 22 Cb 1.05 -0.27 -0.03 0.00 -0.05 0.00 0.00 27.48 28.18 1bk0 h GLN 22 CO 1.14 0.87 0.19 0.00 -0.95 0.00 0.00 178.83 180.08 1bk0 h ALA 23 N 1.35 0.83 -0.53 3.87 0.00 -2.00 -1.38 119.26 121.40 1bk0 h ALA 23 Ca 0.34 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1bk0 h ALA 23 Cb -0.07 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1bk0 h ALA 23 CO -0.06 0.52 0.09 0.00 0.00 0.00 0.00 179.25 179.79 1bk0 h ALA 24 N 1.07 1.16 -0.69 0.00 0.00 -1.88 -2.04 119.26 116.87 1bk0 h ALA 24 Ca 0.20 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1bk0 h ALA 24 Cb 0.31 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1bk0 h ALA 24 CO -0.00 0.56 0.18 0.87 0.00 0.00 0.00 179.25 180.86 1bk0 h LYS 25 N 0.80 1.09 -0.80 0.00 1.57 -0.84 -2.07 116.57 116.31 1bk0 h LYS 25 Ca 0.17 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 1bk0 h LYS 25 Cb 0.35 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.47 1bk0 h LYS 25 CO 0.01 0.95 0.42 0.52 -0.57 0.00 0.00 179.45 180.78 1bk0 h MET 26 N 1.04 1.12 -0.15 3.15 2.86 -0.74 0.16 114.93 122.37 1bk0 h MET 26 Ca 0.22 -0.13 -0.07 0.00 -2.06 0.00 0.00 59.70 57.65 1bk0 h MET 26 Cb 0.34 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 1bk0 h MET 26 CO -0.00 0.83 -0.24 0.00 1.06 0.00 0.00 176.91 178.56 1bk0 h ARG 27 N 1.12 0.26 -0.33 1.72 3.08 -0.97 -0.59 114.38 118.69 1bk0 h ARG 27 Ca 0.28 -0.08 -0.13 0.00 0.07 0.00 0.00 59.98 60.12 1bk0 h ARG 27 Cb 0.05 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1bk0 h ARG 27 CO -0.04 0.49 -0.31 0.28 -1.07 0.00 0.00 179.97 179.32 1bk0 h VAL 28 N 0.24 1.29 -0.92 2.04 2.07 -0.86 -3.01 116.25 117.09 1bk0 h VAL 28 Ca 0.04 -1.48 0.06 0.00 0.82 0.00 0.00 66.70 66.14 1bk0 h VAL 28 Cb 0.55 1.50 -0.06 0.00 -1.52 0.00 0.00 31.29 31.76 1bk0 h VAL 28 CO 0.04 0.48 0.60 0.00 0.02 0.00 0.00 177.57 178.71 1bk0 h ALA 29 N 0.73 1.48 -0.78 1.67 0.00 -0.46 -0.85 119.26 121.06 1bk0 h ALA 29 Ca 0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1bk0 h ALA 29 Cb 0.89 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1bk0 h ALA 29 CO 0.08 0.39 0.44 0.37 0.00 0.00 0.00 179.25 180.52 1bk0 h GLN 30 N 1.07 1.08 -0.77 0.00 -0.00 -1.05 0.85 115.11 116.30 1bk0 h GLN 30 Ca 0.39 -0.12 -0.04 0.00 -0.00 0.00 0.00 58.65 58.88 1bk0 h GLN 30 Cb 0.16 -0.21 -0.03 0.00 0.00 0.00 0.00 27.48 27.39 1bk0 h GLN 30 CO -0.14 0.79 0.32 1.96 0.00 0.00 0.00 178.83 181.76 1bk0 h GLN 31 N 1.08 1.14 -0.43 1.69 4.20 -1.07 -0.49 115.11 121.24 1bk0 h GLN 31 Ca 0.28 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 1bk0 h GLN 31 Cb 0.02 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.59 1bk0 h GLN 31 CO -0.05 0.92 0.18 0.82 -0.67 0.00 0.00 178.83 180.03 1bk0 h ILE 32 N 1.11 1.20 -0.18 2.54 2.04 -0.77 -1.55 117.51 121.90 1bk0 h ILE 32 Ca 0.26 -0.60 0.03 0.00 1.00 0.00 0.00 64.86 65.55 1bk0 h ILE 32 Cb 0.20 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 1bk0 h ILE 32 CO -0.02 0.22 -0.02 -0.78 0.00 0.00 0.00 178.15 177.54 1bk0 h ASP 33 N 0.55 -0.12 -0.50 1.72 3.58 -0.49 0.18 116.42 121.34 1bk0 h ASP 33 Ca 0.14 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.64 1bk0 h ASP 33 Cb 0.18 0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.30 1bk0 h ASP 33 CO -0.01 -0.04 0.32 0.00 -2.88 0.00 0.00 179.24 176.63 1bk0 h ALA 34 N 1.17 0.63 -0.27 -0.78 0.00 -0.90 -1.30 119.26 117.82 1bk0 h ALA 34 Ca 0.09 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1bk0 h ALA 34 Cb 0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1bk0 h ALA 34 CO -0.17 0.09 -0.30 0.00 0.00 0.00 0.00 179.25 178.88 1bk0 h ALA 35 N 1.17 0.99 0.00 0.00 0.00 -1.07 -1.67 119.26 118.67 1bk0 h ALA 35 Ca 0.18 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 1bk0 h ALA 35 Cb -0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1bk0 h ALA 35 CO -0.04 0.60 -0.42 0.77 0.00 0.00 0.00 179.25 180.17 1bk0 h SER 36 N 0.47 0.00 1.05 0.00 0.02 -0.60 -0.03 113.55 114.46 1bk0 h SER 36 Ca 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1bk0 h SER 36 Cb 0.76 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.30 1bk0 h SER 36 CO 0.06 0.42 -0.53 0.03 -1.14 0.00 0.00 176.83 175.67 1bk0 h ARG 37 N 0.00 0.00 0.00 3.45 3.08 -0.96 -3.39 114.38 116.56 1bk0 h ARG 37 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1bk0 h ARG 37 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.87 1bk0 h ARG 37 CO 0.05 0.00 0.00 -3.47 -1.07 0.00 0.00 179.97 175.48 1bk0 n ASP 38 N -2.25 0.00 0.21 7.04 2.03 -0.65 -4.88 116.55 118.04 1bk0 n ASP 38 Ca 0.03 0.00 0.10 0.00 0.52 0.00 0.00 54.79 55.44 1bk0 n ASP 38 Cb 0.45 0.00 0.21 0.00 -0.72 0.00 0.00 41.12 41.06 1bk0 n ASP 38 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1bk0 h THR 39 N 0.00 0.24 0.00 5.18 1.35 -1.80 -3.47 112.91 114.41 1bk0 h THR 39 Ca 0.00 -1.25 0.00 0.00 -0.55 0.00 0.00 66.41 64.61 1bk0 h THR 39 Cb 0.00 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 68.46 1bk0 h THR 39 CO 0.00 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 176.01 1bk0 n GLY 40 N 0.96 0.67 3.24 5.82 0.00 -0.07 -4.81 105.19 111.00 1bk0 n GLY 40 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 1bk0 n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bk0 s PHE 41 N -2.36 1.61 0.09 1.61 0.40 -1.26 -4.22 117.98 113.85 1bk0 s PHE 41 Ca 0.00 -0.41 -0.13 0.00 -0.60 0.00 0.00 56.93 55.79 1bk0 s PHE 41 Cb 0.00 -0.91 0.02 0.00 0.51 0.00 0.00 43.02 42.64 1bk0 s PHE 41 CO 0.00 0.14 0.30 -0.59 0.70 0.00 0.00 175.22 175.77 1bk0 s PHE 42 N -1.09 -0.05 -0.22 0.36 -0.71 -0.96 -4.21 117.98 111.10 1bk0 s PHE 42 Ca 0.04 -0.26 -0.11 0.00 -1.04 0.00 0.00 56.93 55.56 1bk0 s PHE 42 Cb -0.10 0.11 -0.05 0.00 -1.21 0.00 0.00 43.02 41.77 1bk0 s PHE 42 CO 0.03 -0.60 0.18 0.71 -1.34 0.00 0.00 175.22 174.20 1bk0 s TYR 43 N -3.54 3.36 -0.19 3.49 2.02 0.18 -0.75 117.35 121.91 1bk0 s TYR 43 Ca 0.02 0.31 -0.24 0.00 -0.37 0.00 0.00 57.07 56.78 1bk0 s TYR 43 Cb 0.02 -2.26 -0.01 0.00 -0.40 0.00 0.00 41.96 39.31 1bk0 s TYR 43 CO -0.10 0.14 0.80 0.00 -1.57 0.00 0.00 175.55 174.83 1bk0 s ALA 44 N 0.83 3.56 0.29 3.71 0.00 0.78 -0.40 121.76 130.52 1bk0 s ALA 44 Ca 0.09 -0.05 0.12 0.00 0.00 0.00 0.00 51.96 52.11 1bk0 s ALA 44 Cb -0.13 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 19.73 1bk0 s ALA 44 CO 0.03 -0.72 -0.19 0.14 0.00 0.00 0.00 175.76 175.02 1bk0 s VAL 45 N 2.32 2.44 -1.26 0.00 -7.23 -0.34 -1.93 120.40 114.40 1bk0 s VAL 45 Ca 0.36 -2.38 -0.08 0.00 -1.81 0.00 0.00 61.98 58.07 1bk0 s VAL 45 Cb -0.16 -2.34 0.01 0.00 0.56 0.00 0.00 36.38 34.45 1bk0 s VAL 45 CO 0.11 -0.38 1.10 0.59 -0.31 0.00 0.00 175.10 176.21 1bk0 n ASN 46 N -0.64 -5.81 0.02 4.85 3.02 -1.26 -1.87 115.26 113.57 1bk0 n ASN 46 Ca -0.05 -0.51 0.12 0.00 -0.03 0.00 0.00 54.58 54.11 1bk0 n ASN 46 Cb 0.60 -4.76 0.28 0.00 -0.61 0.00 0.00 39.78 35.30 1bk0 n ASN 46 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bk0 n HIS 47 N -4.79 0.21 -0.98 3.10 1.44 -1.26 -3.66 115.22 109.28 1bk0 n HIS 47 Ca -0.01 0.06 0.00 0.00 -2.01 0.00 0.00 57.72 55.76 1bk0 n HIS 47 Cb 0.56 -0.44 0.00 0.00 0.12 0.00 0.00 29.99 30.23 1bk0 n HIS 47 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1bk0 n GLY 48 N 1.44 0.90 3.85 -1.39 0.00 -1.26 -4.91 105.19 103.82 1bk0 n GLY 48 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1bk0 n GLY 48 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bk0 s ILE 49 N -3.64 5.18 -1.09 -0.61 1.01 -1.26 -5.01 121.20 115.77 1bk0 s ILE 49 Ca 0.00 0.64 -0.21 0.00 0.00 0.00 0.00 60.65 61.08 1bk0 s ILE 49 Cb 0.00 -3.62 0.06 0.00 0.01 0.00 0.00 42.46 38.92 1bk0 s ILE 49 CO 0.00 0.59 1.50 0.21 0.00 0.00 0.00 174.94 177.24 1bk0 s ASN 50 N -1.03 6.61 0.32 3.58 3.84 -1.26 -4.81 114.94 122.20 1bk0 s ASN 50 Ca 0.21 -1.80 0.16 0.00 0.21 0.00 0.00 52.86 51.64 1bk0 s ASN 50 Cb -0.15 -2.56 0.41 0.00 -0.55 0.00 0.00 41.25 38.40 1bk0 s ASN 50 CO 0.10 -1.37 1.60 -0.37 -2.79 0.00 0.00 177.10 174.28 1bk0 h VAL 51 N 6.35 1.00 -0.60 -5.21 -1.51 -1.94 -2.32 116.25 112.03 1bk0 h VAL 51 Ca 0.27 -1.93 -0.06 0.00 -1.23 0.00 0.00 66.70 63.74 1bk0 h VAL 51 Cb 0.97 2.16 -0.02 0.00 -2.13 0.00 0.00 31.29 32.27 1bk0 h VAL 51 CO 1.41 0.48 0.15 -0.61 -1.23 0.00 0.00 177.57 177.77 1bk0 h GLN 52 N 0.00 0.96 -0.39 5.19 -0.00 -1.88 -0.25 115.11 118.74 1bk0 h GLN 52 Ca -0.00 -0.23 -0.14 0.00 -0.00 0.00 0.00 58.65 58.27 1bk0 h GLN 52 Cb 1.13 -0.13 -0.01 0.00 0.00 0.00 0.00 27.48 28.47 1bk0 h GLN 52 CO 0.06 0.88 -0.32 -0.09 0.00 0.00 0.00 178.83 179.36 1bk0 h ARG 53 N 0.87 0.88 -0.35 1.69 2.43 -1.94 -0.85 114.38 117.12 1bk0 h ARG 53 Ca 0.19 -0.42 0.05 0.00 -0.81 0.00 0.00 59.98 58.99 1bk0 h ARG 53 Cb 0.35 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.84 1bk0 h ARG 53 CO 0.00 1.07 0.05 1.25 -1.51 0.00 0.00 179.97 180.83 1bk0 h LEU 54 N 0.74 -0.03 -0.73 3.80 5.85 -1.18 0.04 115.31 123.80 1bk0 h LEU 54 Ca 0.08 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 1bk0 h LEU 54 Cb 0.89 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 1bk0 h LEU 54 CO 0.08 0.02 0.38 -1.28 -0.34 0.00 0.00 178.44 177.30 1bk0 h SER 55 N 0.16 0.93 -0.13 1.25 0.87 -0.76 -1.28 113.55 114.59 1bk0 h SER 55 Ca 0.17 -0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 60.60 1bk0 h SER 55 Cb 0.20 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 1bk0 h SER 55 CO -0.24 0.78 0.03 -0.61 -0.53 0.00 0.00 176.83 176.26 1bk0 h GLN 56 N 1.01 0.20 -0.60 2.24 5.75 -0.73 -0.46 115.11 122.52 1bk0 h GLN 56 Ca 0.25 -0.05 -0.06 0.00 -0.15 0.00 0.00 58.65 58.65 1bk0 h GLN 56 Cb 0.07 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.57 1bk0 h GLN 56 CO -0.04 0.36 0.14 0.87 -2.65 0.00 0.00 178.83 177.52 1bk0 h LYS 57 N 0.01 0.94 -0.44 1.69 1.79 -0.93 -1.27 116.57 118.36 1bk0 h LYS 57 Ca 0.04 -0.20 -0.06 0.00 -2.18 0.00 0.00 60.65 58.25 1bk0 h LYS 57 Cb 0.24 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 30.74 1bk0 h LYS 57 CO -0.00 0.84 0.05 1.15 -1.08 0.00 0.00 179.45 180.41 1bk0 h THR 58 N 0.90 1.25 -0.56 -0.16 2.02 -1.11 -2.29 112.91 112.95 1bk0 h THR 58 Ca 0.19 -0.93 -0.01 0.00 0.77 0.00 0.00 66.41 66.43 1bk0 h THR 58 Cb 0.32 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.70 1bk0 h THR 58 CO -0.00 0.32 0.31 0.50 0.37 0.00 0.00 175.52 177.03 1bk0 h LYS 59 N 0.60 0.79 -0.69 6.66 3.64 -0.82 -0.31 116.57 126.44 1bk0 h LYS 59 Ca 0.13 -0.09 0.05 0.00 -1.27 0.00 0.00 60.65 59.47 1bk0 h LYS 59 Cb 0.41 -0.15 -0.05 0.00 -0.41 0.00 0.00 32.23 32.02 1bk0 h LYS 59 CO 0.01 0.60 0.40 0.93 -2.27 0.00 0.00 179.45 179.12 1bk0 h GLU 60 N 0.76 0.73 0.38 1.90 5.08 -1.07 -0.88 114.58 121.48 1bk0 h GLU 60 Ca 0.20 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1bk0 h GLU 60 Cb 0.04 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.13 1bk0 h GLU 60 CO -0.03 0.48 -0.18 0.35 -1.00 0.00 0.00 179.01 178.63 1bk0 h PHE 61 N 0.75 -0.47 -0.71 4.33 3.57 -1.05 -2.80 116.94 120.57 1bk0 h PHE 61 Ca 0.30 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.83 1bk0 h PHE 61 Cb 0.14 0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.99 1bk0 h PHE 61 CO -0.06 -0.16 0.47 0.45 -2.23 0.00 0.00 178.31 176.77 1bk0 h HIS 62 N -0.77 0.80 0.00 0.41 3.86 -0.85 -1.56 115.15 117.03 1bk0 h HIS 62 Ca -0.05 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 1bk0 h HIS 62 Cb 0.52 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.72 1bk0 h HIS 62 CO 0.01 0.45 -0.41 -1.33 0.86 0.00 0.00 177.93 177.51 1bk0 n MET 63 N -4.46 0.10 -0.00 2.45 2.81 -0.35 -4.06 117.12 113.59 1bk0 n MET 63 Ca 0.09 0.04 0.06 0.00 -1.81 0.00 0.00 57.70 56.08 1bk0 n MET 63 Cb 0.16 -1.57 -0.09 0.00 -0.71 0.00 0.00 33.22 31.01 1bk0 n MET 63 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1bk0 n SER 64 N -1.72 1.93 -4.77 7.83 3.41 -1.01 -5.00 113.62 114.30 1bk0 n SER 64 Ca 0.05 -0.13 -0.40 0.00 -0.26 0.00 0.00 58.87 58.13 1bk0 n SER 64 Cb 0.37 1.46 -0.02 0.00 -0.26 0.00 0.00 64.21 65.76 1bk0 n SER 64 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1bk0 s ILE 65 N -2.72 2.79 0.31 -1.33 2.07 -0.62 -5.01 121.20 116.70 1bk0 s ILE 65 Ca -0.03 0.77 0.07 0.00 -1.41 0.00 0.00 60.65 60.05 1bk0 s ILE 65 Cb 0.08 -3.48 -0.02 0.00 0.13 0.00 0.00 42.46 39.17 1bk0 s ILE 65 CO 0.50 0.16 0.36 0.42 -1.91 0.00 0.00 174.94 174.47 1bk0 s THR 66 N -1.19 4.04 0.33 4.00 -4.23 -1.26 -4.98 115.64 112.35 1bk0 s THR 66 Ca 0.51 -1.19 0.05 0.00 -1.18 0.00 0.00 61.69 59.88 1bk0 s THR 66 Cb -0.38 -3.37 0.30 0.00 1.34 0.00 0.00 72.50 70.39 1bk0 s THR 66 CO 0.50 -0.21 1.89 -0.65 -0.54 0.00 0.00 174.62 175.61 1bk0 h PRO 67 N 1.13 0.82 -0.40 3.99 0.11 -2.00 -1.43 132.00 134.23 1bk0 h PRO 67 Ca -0.46 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1bk0 h PRO 67 Cb 1.25 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1bk0 h PRO 67 CO 0.57 0.55 0.26 1.49 -0.21 0.00 0.00 178.00 180.66 1bk0 h GLU 68 N 0.85 0.52 -0.42 1.05 4.81 -2.01 -2.36 114.58 117.02 1bk0 h GLU 68 Ca 0.42 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.55 1bk0 h GLU 68 Cb 0.46 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 1bk0 h GLU 68 CO -0.18 0.34 -0.02 0.93 -0.73 0.00 0.00 179.01 179.35 1bk0 h GLU 69 N 0.54 0.69 -0.52 1.92 5.08 -1.72 -2.17 114.58 118.40 1bk0 h GLU 69 Ca 0.14 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 1bk0 h GLU 69 Cb -0.06 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1bk0 h GLU 69 CO -0.03 0.72 0.22 0.87 -1.00 0.00 0.00 179.01 179.80 1bk0 h LYS 70 N 0.65 0.76 -0.78 2.33 1.57 -0.92 -0.81 116.57 119.38 1bk0 h LYS 70 Ca 0.13 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1bk0 h LYS 70 Cb 0.44 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 1bk0 h LYS 70 CO 0.02 0.65 0.30 -1.49 -0.57 0.00 0.00 179.45 178.36 1bk0 h TRP 71 N 0.69 1.20 0.00 -1.35 -0.00 -1.24 -0.85 115.95 114.41 1bk0 h TRP 71 Ca 0.17 -0.10 -0.02 0.00 -0.00 0.00 0.00 58.89 58.95 1bk0 h TRP 71 Cb 0.16 -0.36 -0.00 0.00 -0.00 0.00 0.00 29.16 28.96 1bk0 h TRP 71 CO 0.00 0.92 -0.09 -0.44 -0.00 0.00 0.00 178.44 178.82 1bk0 h ASP 72 N 1.14 0.00 -0.02 -3.49 3.32 -0.88 -2.65 116.42 113.84 1bk0 h ASP 72 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 1bk0 h ASP 72 Cb 0.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 1bk0 h ASP 72 CO -0.02 0.09 -0.04 0.18 -1.72 0.00 0.00 179.24 177.73 1bk0 n LEU 73 N -3.33 2.32 -4.77 1.55 4.77 -0.35 -5.05 117.00 112.14 1bk0 n LEU 73 Ca -0.01 -0.97 -0.40 0.00 -0.03 0.00 0.00 56.01 54.61 1bk0 n LEU 73 Cb 0.29 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.39 1bk0 n LEU 73 CO 0.29 0.41 1.03 0.00 -1.33 0.00 0.00 177.39 177.79 1bk0 s ALA 74 N -1.48 3.24 0.94 -1.18 0.00 -0.35 -1.03 121.76 121.91 1bk0 s ALA 74 Ca 0.19 1.38 -0.12 0.00 0.00 0.00 0.00 51.96 53.42 1bk0 s ALA 74 Cb 0.14 -3.55 0.16 0.00 0.00 0.00 0.00 23.12 19.86 1bk0 s ALA 74 CO 0.24 -1.07 1.09 0.96 0.00 0.00 0.00 175.76 176.98 1bk0 s ILE 75 N -1.22 2.46 0.47 0.00 -4.36 -0.63 -4.66 121.20 113.25 1bk0 s ILE 75 Ca 0.60 0.15 0.18 0.00 -0.26 0.00 0.00 60.65 61.32 1bk0 s ILE 75 Cb -0.42 -2.57 0.36 0.00 1.25 0.00 0.00 42.46 41.08 1bk0 s ILE 75 CO 0.54 -0.20 1.97 0.08 0.24 0.00 0.00 174.94 177.57 1bk0 h ARG 76 N -1.73 0.25 0.00 0.37 0.11 -0.89 -0.60 114.38 111.89 1bk0 h ARG 76 Ca -0.51 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 59.54 1bk0 h ARG 76 Cb 1.30 -0.06 -0.00 0.00 1.11 0.00 0.00 29.97 32.32 1bk0 h ARG 76 CO 0.54 0.17 -0.05 0.00 0.10 0.00 0.00 179.97 180.72 1bk0 h ALA 77 N 1.71 1.60 0.00 0.08 0.00 -1.91 -2.99 119.26 117.74 1bk0 h ALA 77 Ca 0.29 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1bk0 h ALA 77 Cb 0.77 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1bk0 h ALA 77 CO -0.06 0.06 -1.68 0.66 0.00 0.00 0.00 179.25 178.23 1bk0 n TYR 78 N -4.01 0.00 -3.59 0.00 4.01 -0.35 -4.93 117.16 108.29 1bk0 n TYR 78 Ca -0.03 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.44 1bk0 n TYR 78 Cb 0.14 -0.39 -0.16 0.00 -0.31 0.00 0.00 39.34 38.61 1bk0 n TYR 78 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1bk0 s ASN 79 N -3.82 2.73 0.51 7.72 3.84 -0.51 -5.01 114.94 120.40 1bk0 s ASN 79 Ca -0.05 -0.83 0.34 0.00 0.21 0.00 0.00 52.86 52.53 1bk0 s ASN 79 Cb 0.08 -0.28 1.77 0.00 -0.55 0.00 0.00 41.25 42.26 1bk0 s ASN 79 CO 0.56 -0.38 2.05 0.11 -2.79 0.00 0.00 177.10 176.65 1bk0 h LYS 80 N 8.41 0.00 0.00 0.43 1.57 -1.86 -1.82 116.57 123.30 1bk0 h LYS 80 Ca -0.17 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.59 1bk0 h LYS 80 Cb 1.11 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.41 1bk0 h LYS 80 CO 0.34 0.00 -0.11 0.93 -0.57 0.00 0.00 179.45 180.04 1bk0 h GLU 81 N 0.00 0.00 -2.59 3.15 5.08 -1.95 -3.35 114.58 114.93 1bk0 h GLU 81 Ca 0.00 0.00 -0.80 0.00 -1.00 0.00 0.00 59.36 57.56 1bk0 h GLU 81 Cb 0.12 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 29.08 1bk0 h GLU 81 CO 0.00 0.11 0.81 0.72 -1.00 0.00 0.00 179.01 179.65 1bk0 n HIS 82 N -3.23 2.55 0.29 4.33 8.25 -0.68 -4.83 115.22 121.90 1bk0 n HIS 82 Ca 0.01 -2.65 0.16 0.00 -0.26 0.00 0.00 57.72 54.98 1bk0 n HIS 82 Cb 0.39 -1.19 0.90 0.00 1.12 0.00 0.00 29.99 31.22 1bk0 n HIS 82 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1bk0 h GLN 83 N 4.79 0.00 0.00 -0.41 1.08 -1.81 -1.93 115.11 116.83 1bk0 h GLN 83 Ca 0.34 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.54 1bk0 h GLN 83 Cb 0.48 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.91 1bk0 h GLN 83 CO 1.24 0.04 -0.19 -0.25 -0.95 0.00 0.00 178.83 178.73 1bk0 n ASP 84 N -3.54 0.54 -4.41 1.46 8.00 -1.26 -4.60 116.55 112.74 1bk0 n ASP 84 Ca -0.02 0.37 -0.45 0.00 0.71 0.00 0.00 54.79 55.40 1bk0 n ASP 84 Cb 0.15 -0.40 -0.01 0.00 -0.02 0.00 0.00 41.12 40.84 1bk0 n ASP 84 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1bk0 s GLN 85 N -3.08 3.88 -0.17 -1.24 -0.21 -0.72 -4.76 119.66 113.35 1bk0 s GLN 85 Ca 0.11 -2.46 -0.18 0.00 0.02 0.00 0.00 55.36 52.84 1bk0 s GLN 85 Cb 0.15 -4.78 -0.22 0.00 1.00 0.00 0.00 33.01 29.16 1bk0 s GLN 85 CO 0.62 -1.56 0.31 0.28 -2.12 0.00 0.00 175.29 172.82 1bk0 h VAL 86 N 4.81 0.91 0.00 1.09 2.07 -1.83 0.89 116.25 124.17 1bk0 h VAL 86 Ca 0.20 -2.25 -0.44 0.00 0.82 0.00 0.00 66.70 65.03 1bk0 h VAL 86 Cb 0.95 2.39 -0.07 0.00 -1.52 0.00 0.00 31.29 33.04 1bk0 h VAL 86 CO 1.05 0.50 -2.49 0.54 0.02 0.00 0.00 177.57 177.19 1bk0 n ARG 87 N -4.18 0.58 -3.26 1.57 1.74 -1.26 -4.77 116.66 107.08 1bk0 n ARG 87 Ca -0.30 0.23 -0.38 0.00 -0.77 0.00 0.00 57.85 56.63 1bk0 n ARG 87 Cb 0.78 -1.46 -0.06 0.00 -1.02 0.00 0.00 32.46 30.70 1bk0 n ARG 87 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1bk0 s ALA 88 N -2.49 3.45 0.00 7.54 0.00 -1.26 -4.66 121.76 124.33 1bk0 s ALA 88 Ca -0.37 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1bk0 s ALA 88 Cb 0.13 -2.71 0.00 0.00 0.00 0.00 0.00 23.12 20.55 1bk0 s ALA 88 CO 0.49 -0.00 0.00 0.41 0.00 0.00 0.00 175.76 176.66 1bk0 n GLY 89 N 3.17 0.91 3.80 0.00 0.00 -0.40 -4.64 105.19 108.03 1bk0 n GLY 89 Ca -0.06 -1.95 -0.38 0.00 0.00 0.00 0.00 46.02 43.63 1bk0 n GLY 89 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1bk0 s TYR 90 N -2.43 3.66 -0.36 1.61 6.14 -0.20 -1.21 117.35 124.57 1bk0 s TYR 90 Ca 0.00 0.95 -0.02 0.00 0.64 0.00 0.00 57.07 58.64 1bk0 s TYR 90 Cb 0.00 -2.37 0.08 0.00 0.42 0.00 0.00 41.96 40.10 1bk0 s TYR 90 CO 0.00 0.50 0.11 0.71 0.64 0.00 0.00 175.55 177.51 1bk0 s TYR 91 N -0.55 3.47 0.47 4.97 1.51 0.59 -1.60 117.35 126.20 1bk0 s TYR 91 Ca 0.24 -2.23 -0.20 0.00 -1.01 0.00 0.00 57.07 53.87 1bk0 s TYR 91 Cb -0.16 -2.75 -0.09 0.00 -0.11 0.00 0.00 41.96 38.84 1bk0 s TYR 91 CO 0.12 -0.90 0.99 -0.51 -1.11 0.00 0.00 175.55 174.14 1bk0 s LEU 92 N 1.17 3.84 0.73 -1.29 1.02 -1.26 -1.54 118.68 121.35 1bk0 s LEU 92 Ca 0.03 1.77 -0.11 0.00 0.02 0.00 0.00 54.13 55.83 1bk0 s LEU 92 Cb -0.21 -4.54 0.03 0.00 0.02 0.00 0.00 46.19 41.49 1bk0 s LEU 92 CO -0.03 -0.59 1.12 -0.94 0.02 0.00 0.00 176.35 175.93 1bk0 s SER 93 N -2.26 5.19 -0.41 2.29 1.04 -1.25 -4.80 113.70 113.50 1bk0 s SER 93 Ca 0.64 1.02 0.01 0.00 0.48 0.00 0.00 55.95 58.10 1bk0 s SER 93 Cb -0.12 -1.74 0.13 0.00 0.10 0.00 0.00 66.02 64.39 1bk0 s SER 93 CO 0.19 -1.49 0.22 -0.63 0.98 0.00 0.00 173.24 172.52 1bk0 s ILE 94 N -3.41 1.07 0.10 -1.02 1.01 -0.36 -4.99 121.20 113.60 1bk0 s ILE 94 Ca 0.59 -2.30 -0.36 0.00 0.00 0.00 0.00 60.65 58.59 1bk0 s ILE 94 Cb -0.11 -1.76 -0.17 0.00 0.01 0.00 0.00 42.46 40.43 1bk0 s ILE 94 CO 0.51 -0.91 1.29 -2.65 0.00 0.00 0.00 174.94 173.18 1bk0 n PRO 95 N 3.73 1.11 0.00 2.79 -0.02 -1.26 -0.47 135.00 140.87 1bk0 n PRO 95 Ca 0.09 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1bk0 n PRO 95 Cb 0.35 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 1bk0 n PRO 95 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bk0 n GLY 96 N 2.38 1.98 0.03 -1.23 0.00 -1.26 -4.76 105.19 102.32 1bk0 n GLY 96 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1bk0 n GLY 96 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bk0 n LYS 97 N -2.00 0.00 -3.67 1.61 4.76 0.33 -4.55 118.16 114.65 1bk0 n LYS 97 Ca 0.00 0.00 -0.20 0.00 -2.87 0.00 0.00 58.31 55.24 1bk0 n LYS 97 Cb 0.00 -0.64 -0.18 0.00 -1.84 0.00 0.00 35.03 32.37 1bk0 n LYS 97 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1bk0 s LYS 98 N -1.31 -0.07 -0.07 1.97 2.20 0.37 -2.86 119.74 119.98 1bk0 s LYS 98 Ca 0.00 0.35 -0.13 0.00 -0.36 0.00 0.00 55.97 55.82 1bk0 s LYS 98 Cb 0.00 -0.61 -0.30 0.00 -1.51 0.00 0.00 37.83 35.42 1bk0 s LYS 98 CO 0.00 -0.35 0.64 0.00 -0.36 0.00 0.00 175.35 175.27 1bk0 h ALA 99 N 8.44 0.14 -2.72 3.13 0.00 -1.86 -0.95 119.26 125.44 1bk0 h ALA 99 Ca -0.12 -1.10 -0.51 0.00 0.00 0.00 0.00 54.91 53.18 1bk0 h ALA 99 Cb 1.12 0.45 0.09 0.00 0.00 0.00 0.00 17.79 19.45 1bk0 h ALA 99 CO 0.16 0.92 0.47 0.54 0.00 0.00 0.00 179.25 181.33 1bk0 s VAL 100 N -2.53 2.90 0.06 0.00 0.11 -1.26 -4.53 120.40 115.15 1bk0 s VAL 100 Ca -0.17 0.59 -0.11 0.00 -2.93 0.00 0.00 61.98 59.36 1bk0 s VAL 100 Cb 0.05 -3.25 0.01 0.00 -1.53 0.00 0.00 36.38 31.65 1bk0 s VAL 100 CO 0.82 -0.09 0.25 -1.83 -3.33 0.00 0.00 175.10 170.91 1bk0 s GLU 101 N -3.17 0.81 0.26 1.54 -1.05 -1.00 -3.76 118.70 112.34 1bk0 s GLU 101 Ca 0.73 -0.70 -0.22 0.00 -0.15 0.00 0.00 54.97 54.63 1bk0 s GLU 101 Cb -0.28 0.34 0.03 0.00 -0.44 0.00 0.00 34.13 33.78 1bk0 s GLU 101 CO 0.32 -0.26 0.77 -1.54 0.95 0.00 0.00 175.26 175.49 1bk0 s SER 102 N -2.38 -0.25 -0.09 0.83 1.04 -0.59 -0.67 113.70 111.59 1bk0 s SER 102 Ca -0.01 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 55.85 1bk0 s SER 102 Cb 0.01 0.68 0.02 0.00 0.10 0.00 0.00 66.02 66.84 1bk0 s SER 102 CO -0.07 -1.26 -0.07 0.12 0.98 0.00 0.00 173.24 172.94 1bk0 s PHE 103 N -3.80 1.29 -0.08 5.02 5.36 -0.84 -0.30 117.98 124.63 1bk0 s PHE 103 Ca 0.11 -0.56 0.01 0.00 -0.96 0.00 0.00 56.93 55.53 1bk0 s PHE 103 Cb -0.05 -1.08 -0.03 0.00 -0.34 0.00 0.00 43.02 41.53 1bk0 s PHE 103 CO 0.06 -0.40 -0.09 0.00 -1.46 0.00 0.00 175.22 173.33 1bk0 s TYR 105 N -0.59 0.51 0.08 0.00 1.13 -0.60 -1.27 117.35 116.61 1bk0 s TYR 105 Ca 0.09 -0.68 0.01 0.00 -1.41 0.00 0.00 57.07 55.07 1bk0 s TYR 105 Cb -0.12 -0.33 0.01 0.00 -1.10 0.00 0.00 41.96 40.42 1bk0 s TYR 105 CO 0.02 -0.19 0.07 1.28 -2.51 0.00 0.00 175.55 174.21 1bk0 n LEU 106 N 1.04 0.00 -4.67 -3.49 4.77 -1.26 -1.30 117.00 112.09 1bk0 n LEU 106 Ca -0.20 -0.43 -0.55 0.00 -0.03 0.00 0.00 56.01 54.80 1bk0 n LEU 106 Cb 0.57 -0.02 -0.07 0.00 -2.33 0.00 0.00 43.42 41.58 1bk0 n LEU 106 CO 0.23 -0.34 1.22 -3.20 -1.33 0.00 0.00 177.39 173.97 1bk0 n ASN 107 N -2.13 2.29 0.32 -1.43 2.85 -1.24 -4.84 115.26 111.09 1bk0 n ASN 107 Ca 0.00 1.08 0.21 0.00 -0.11 0.00 0.00 54.58 55.76 1bk0 n ASN 107 Cb 0.09 -1.18 1.12 0.00 1.24 0.00 0.00 39.78 41.05 1bk0 n ASN 107 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1bk0 h PRO 108 N 6.59 0.00 0.00 1.20 0.11 -1.94 -1.11 132.00 136.85 1bk0 h PRO 108 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1bk0 h PRO 108 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1bk0 h PRO 108 CO 0.91 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.79 1bk0 n ASN 109 N -3.26 0.00 -4.41 -2.05 3.02 -1.26 -4.32 115.26 102.98 1bk0 n ASN 109 Ca -0.03 0.22 -0.42 0.00 -0.03 0.00 0.00 54.58 54.32 1bk0 n ASN 109 Cb 0.09 -0.39 -0.01 0.00 -0.61 0.00 0.00 39.78 38.86 1bk0 n ASN 109 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1bk0 n PHE 110 N -1.39 4.29 -2.87 3.10 3.72 -0.42 -4.75 117.46 119.14 1bk0 n PHE 110 Ca 0.09 -2.76 -0.19 0.00 -0.05 0.00 0.00 57.45 54.54 1bk0 n PHE 110 Cb 0.24 -2.61 0.02 0.00 -0.94 0.00 0.00 39.48 36.19 1bk0 n PHE 110 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1bk0 s THR 111 N 4.52 3.00 0.51 4.37 -4.23 -1.26 -4.17 115.64 118.37 1bk0 s THR 111 Ca 0.54 -0.81 0.22 0.00 -1.18 0.00 0.00 61.69 60.46 1bk0 s THR 111 Cb 0.06 -3.07 0.37 0.00 1.34 0.00 0.00 72.50 71.20 1bk0 s THR 111 CO 0.05 -0.04 2.02 -0.65 -0.54 0.00 0.00 174.62 175.46 1bk0 h PRO 112 N 0.38 0.06 -0.01 3.99 0.11 -1.98 -0.64 132.00 133.92 1bk0 h PRO 112 Ca -0.42 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1bk0 h PRO 112 Cb 1.28 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1bk0 h PRO 112 CO 0.50 0.04 -0.11 -0.40 -0.21 0.00 0.00 178.00 177.82 1bk0 n ASP 113 N -4.42 0.79 -4.77 -2.05 5.68 -1.26 -4.36 116.55 106.15 1bk0 n ASP 113 Ca 0.08 -0.90 -0.41 0.00 -0.50 0.00 0.00 54.79 53.06 1bk0 n ASP 113 Cb 0.49 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.46 1bk0 n ASP 113 CO 0.00 0.00 0.00 -2.28 -1.33 0.00 0.00 177.20 173.59 1bk0 s HIS 114 N -2.33 2.86 0.50 2.11 2.46 -0.25 -4.84 115.29 115.81 1bk0 s HIS 114 Ca 0.32 1.24 0.17 0.00 0.47 0.00 0.00 55.06 57.26 1bk0 s HIS 114 Cb 0.20 -3.84 1.23 0.00 -0.13 0.00 0.00 32.58 30.04 1bk0 s HIS 114 CO 0.44 -2.46 2.09 -1.35 -2.47 0.00 0.00 174.74 171.00 1bk0 h PRO 115 N 3.53 0.10 0.00 2.88 0.11 -1.91 -0.16 132.00 136.54 1bk0 h PRO 115 Ca -0.49 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.45 1bk0 h PRO 115 Cb 1.23 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1bk0 h PRO 115 CO 0.67 0.06 -0.77 0.00 -0.21 0.00 0.00 178.00 177.76 1bk0 h ARG 116 N 0.10 0.00 -0.19 1.05 2.47 -1.95 -1.49 114.38 114.36 1bk0 h ARG 116 Ca 0.10 0.00 -0.19 0.00 -1.26 0.00 0.00 59.98 58.63 1bk0 h ARG 116 Cb 0.27 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.59 1bk0 h ARG 116 CO -0.01 0.77 -0.61 0.82 0.56 0.00 0.00 179.97 181.50 1bk0 h ILE 117 N 0.00 1.30 -0.74 2.04 1.08 -1.57 -1.56 117.51 118.05 1bk0 h ILE 117 Ca -0.01 -1.82 -0.06 0.00 -0.39 0.00 0.00 64.86 62.58 1bk0 h ILE 117 Cb 1.53 1.90 -0.03 0.00 -3.07 0.00 0.00 36.82 37.15 1bk0 h ILE 117 CO 0.10 0.58 0.23 1.56 -0.69 0.00 0.00 178.15 179.93 1bk0 h GLN 118 N 0.47 1.16 0.00 2.37 1.08 -1.04 -2.12 115.11 117.02 1bk0 h GLN 118 Ca -0.02 -0.25 0.00 0.00 -1.45 0.00 0.00 58.65 56.93 1bk0 h GLN 118 Cb 1.23 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 28.49 1bk0 h GLN 118 CO 0.13 0.98 0.00 0.00 -0.95 0.00 0.00 178.83 178.99 1bk0 n ALA 119 N -2.45 2.04 -3.17 3.87 0.00 -0.57 -4.90 120.51 115.33 1bk0 n ALA 119 Ca 0.06 -0.05 -0.20 0.00 0.00 0.00 0.00 53.44 53.25 1bk0 n ALA 119 Cb 0.23 -1.39 0.05 0.00 0.00 0.00 0.00 19.45 18.34 1bk0 n ALA 119 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1bk0 n LYS 120 N -1.71 -5.54 -2.12 0.00 4.76 -0.80 -4.94 118.16 107.81 1bk0 n LYS 120 Ca 0.05 0.75 -0.42 0.00 -2.87 0.00 0.00 58.31 55.83 1bk0 n LYS 120 Cb 0.29 -5.40 -0.03 0.00 -1.84 0.00 0.00 35.03 28.05 1bk0 n LYS 120 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1bk0 s THR 121 N -3.18 3.05 0.51 -0.18 2.01 -0.65 -4.94 115.64 112.25 1bk0 s THR 121 Ca 0.38 0.82 -0.20 0.00 0.31 0.00 0.00 61.69 63.00 1bk0 s THR 121 Cb -0.17 -3.52 -0.09 0.00 0.01 0.00 0.00 72.50 68.73 1bk0 s THR 121 CO 0.47 0.10 0.66 -2.65 -0.69 0.00 0.00 174.62 172.51 1bk0 n PRO 122 N 3.15 0.71 -0.32 4.92 -0.02 -1.26 -2.66 135.00 139.51 1bk0 n PRO 122 Ca 0.09 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 1bk0 n PRO 122 Cb 0.42 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 1bk0 n PRO 122 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1bk0 n THR 123 N -1.29 0.00 -3.86 3.45 -2.24 -1.26 -5.01 114.28 104.07 1bk0 n THR 123 Ca 0.11 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.54 1bk0 n THR 123 Cb 0.44 -0.02 -0.09 0.00 -2.10 0.00 0.00 70.33 68.56 1bk0 n THR 123 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1bk0 s HIS 124 N -3.10 3.30 0.05 4.78 3.76 -1.09 -5.02 115.29 117.96 1bk0 s HIS 124 Ca 0.00 0.14 -0.09 0.00 -0.15 0.00 0.00 55.06 54.97 1bk0 s HIS 124 Cb 0.00 -2.14 0.00 0.00 1.11 0.00 0.00 32.58 31.55 1bk0 s HIS 124 CO 0.00 0.15 0.18 -1.21 -0.85 0.00 0.00 174.74 173.01 1bk0 s GLU 125 N 0.53 0.70 -0.15 1.40 2.02 -1.26 -4.82 118.70 117.12 1bk0 s GLU 125 Ca 0.05 -0.69 -0.25 0.00 0.02 0.00 0.00 54.97 54.10 1bk0 s GLU 125 Cb -0.12 0.29 -0.02 0.00 0.10 0.00 0.00 34.13 34.37 1bk0 s GLU 125 CO 0.00 -0.20 0.79 0.08 0.02 0.00 0.00 175.26 175.96 1bk0 s VAL 126 N -2.74 4.92 0.61 2.63 1.01 -1.26 -4.80 120.40 120.77 1bk0 s VAL 126 Ca -0.04 1.56 -0.19 0.00 0.00 0.00 0.00 61.98 63.32 1bk0 s VAL 126 Cb -0.00 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 1bk0 s VAL 126 CO -0.05 0.08 1.15 0.59 0.00 0.00 0.00 175.10 176.87 1bk0 n ASN 127 N 4.93 1.56 -4.59 3.32 3.02 -1.26 -4.99 115.26 117.24 1bk0 n ASN 127 Ca 0.03 0.85 -0.33 0.00 -0.03 0.00 0.00 54.58 55.09 1bk0 n ASN 127 Cb 0.49 -1.48 -0.11 0.00 -0.61 0.00 0.00 39.78 38.08 1bk0 n ASN 127 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1bk0 s VAL 128 N -1.42 3.72 0.06 2.41 -7.23 -1.26 -5.11 120.40 111.55 1bk0 s VAL 128 Ca 0.77 -0.58 0.04 0.00 -1.81 0.00 0.00 61.98 60.40 1bk0 s VAL 128 Cb -0.41 -2.56 -0.03 0.00 0.56 0.00 0.00 36.38 33.95 1bk0 s VAL 128 CO 0.45 0.52 -0.11 0.26 -0.31 0.00 0.00 175.10 175.90 1bk0 s TRP 129 N -0.89 0.99 1.05 2.82 0.52 -1.26 -4.82 118.94 117.34 1bk0 s TRP 129 Ca 0.14 -0.47 -0.13 0.00 0.02 0.00 0.00 56.10 55.67 1bk0 s TRP 129 Cb -0.11 -0.57 0.22 0.00 -1.15 0.00 0.00 33.47 31.86 1bk0 s TRP 129 CO 0.04 -0.00 1.08 -1.25 0.02 0.00 0.00 176.95 176.84 1bk0 s PRO 130 N -1.65 0.02 0.22 4.98 0.04 -1.26 -4.94 135.00 132.42 1bk0 s PRO 130 Ca -0.05 0.55 -0.30 0.00 0.04 0.00 0.00 61.00 61.24 1bk0 s PRO 130 Cb -0.10 -1.69 -0.10 0.00 0.04 0.00 0.00 34.50 32.65 1bk0 s PRO 130 CO 0.01 -3.02 1.49 -0.51 0.04 0.00 0.00 177.00 175.02 1bk0 s ASP 131 N -3.25 6.61 0.31 6.66 1.11 -1.26 -4.91 116.67 121.94 1bk0 s ASP 131 Ca 0.66 2.67 -0.00 0.00 0.18 0.00 0.00 52.55 56.06 1bk0 s ASP 131 Cb -0.20 -2.61 0.52 0.00 1.07 0.00 0.00 42.92 41.69 1bk0 s ASP 131 CO 0.59 -0.76 1.96 -0.08 1.18 0.00 0.00 175.17 178.07 1bk0 h GLU 132 N 5.59 1.00 -0.26 8.23 4.57 -1.92 -1.61 114.58 130.18 1bk0 h GLU 132 Ca -0.45 -0.06 -0.05 0.00 -1.18 0.00 0.00 59.36 57.62 1bk0 h GLU 132 Cb 1.21 -0.23 -0.02 0.00 -0.16 0.00 0.00 28.75 29.56 1bk0 h GLU 132 CO 0.82 0.66 -0.04 1.79 -1.18 0.00 0.00 179.01 181.06 1bk0 h THR 133 N 1.03 1.18 0.00 0.32 1.35 -1.99 -1.39 112.91 113.41 1bk0 h THR 133 Ca 0.32 -0.75 -0.20 0.00 -0.55 0.00 0.00 66.41 65.23 1bk0 h THR 133 Cb -0.01 1.03 -0.03 0.00 -1.73 0.00 0.00 68.15 67.41 1bk0 h THR 133 CO -0.09 0.25 -0.95 0.11 -0.25 0.00 0.00 175.52 174.59 1bk0 h LYS 134 N 0.39 0.00 -2.11 4.72 1.57 -1.76 -3.38 116.57 116.00 1bk0 h LYS 134 Ca 0.08 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.31 1bk0 h LYS 134 Cb 0.33 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.23 1bk0 h LYS 134 CO 0.01 0.92 -0.90 0.72 -0.57 0.00 0.00 179.45 179.63 1bk0 n HIS 135 N -3.32 1.77 -1.68 -1.35 8.25 -0.68 -5.03 115.22 113.19 1bk0 n HIS 135 Ca -0.00 -3.87 -0.45 0.00 -0.26 0.00 0.00 57.72 53.13 1bk0 n HIS 135 Cb 0.91 -0.45 -0.04 0.00 1.12 0.00 0.00 29.99 31.53 1bk0 n HIS 135 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1bk0 n PRO 136 N 0.58 2.28 -0.38 -0.41 -0.04 -0.54 -1.89 135.00 134.61 1bk0 n PRO 136 Ca 0.27 0.82 0.00 0.00 -0.04 0.00 0.00 63.50 64.55 1bk0 n PRO 136 Cb 0.50 -2.61 0.00 0.00 -0.04 0.00 0.00 33.50 31.35 1bk0 n PRO 136 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bk0 n GLY 137 N 3.58 1.96 0.17 0.55 0.00 -1.26 -4.92 105.19 105.27 1bk0 n GLY 137 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 1bk0 n GLY 137 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1bk0 h PHE 138 N 0.00 -0.31 -0.56 1.61 3.57 -1.74 -0.75 116.94 118.76 1bk0 h PHE 138 Ca 0.00 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.56 1bk0 h PHE 138 Cb 0.00 0.10 -0.06 0.00 2.79 0.00 0.00 35.95 38.79 1bk0 h PHE 138 CO 0.00 -0.00 0.25 0.37 -2.23 0.00 0.00 178.31 176.70 1bk0 h GLN 139 N -0.63 0.46 -0.54 1.11 4.15 -1.92 0.52 115.11 118.26 1bk0 h GLN 139 Ca -0.03 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.33 1bk0 h GLN 139 Cb 0.45 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.01 1bk0 h GLN 139 CO 0.06 0.30 0.22 -0.44 -1.93 0.00 0.00 178.83 177.04 1bk0 h ASP 140 N 0.47 0.75 -0.17 -0.69 3.32 -1.94 -0.61 116.42 117.56 1bk0 h ASP 140 Ca 0.26 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1bk0 h ASP 140 Cb 0.24 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1bk0 h ASP 140 CO -0.22 0.71 0.11 0.15 -1.72 0.00 0.00 179.24 178.28 1bk0 h PHE 141 N 0.74 0.22 -0.73 4.55 3.57 -0.75 -1.65 116.94 122.90 1bk0 h PHE 141 Ca 0.18 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.62 1bk0 h PHE 141 Cb 0.20 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 1bk0 h PHE 141 CO 0.01 0.14 0.21 0.00 -2.23 0.00 0.00 178.31 176.43 1bk0 h ALA 142 N 1.06 0.96 -0.36 2.41 0.00 -0.62 -0.04 119.26 122.67 1bk0 h ALA 142 Ca 0.06 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 1bk0 h ALA 142 Cb -0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1bk0 h ALA 142 CO -0.01 0.66 -0.03 0.93 0.00 0.00 0.00 179.25 180.80 1bk0 h GLU 143 N 1.09 0.65 -0.64 0.00 5.08 -1.06 -1.58 114.58 118.12 1bk0 h GLU 143 Ca 0.23 -0.22 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 1bk0 h GLU 143 Cb 0.34 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 1bk0 h GLU 143 CO -0.00 0.78 0.28 0.37 -1.00 0.00 0.00 179.01 179.44 1bk0 h GLN 144 N 0.46 0.92 -0.70 2.33 5.75 -1.05 -2.52 115.11 120.29 1bk0 h GLN 144 Ca 0.10 -0.13 -0.02 0.00 -0.15 0.00 0.00 58.65 58.44 1bk0 h GLN 144 Cb 0.50 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.85 1bk0 h GLN 144 CO 0.02 0.73 0.35 -0.92 -2.65 0.00 0.00 178.83 176.37 1bk0 h TYR 145 N 0.91 1.00 -0.46 3.99 3.20 -0.76 -0.34 116.97 124.51 1bk0 h TYR 145 Ca 0.22 -0.04 0.09 0.00 3.14 0.00 0.00 58.73 62.14 1bk0 h TYR 145 Cb 0.13 -0.31 -0.08 0.00 1.54 0.00 0.00 36.73 38.02 1bk0 h TYR 145 CO 0.01 0.73 -0.01 -0.92 -1.64 0.00 0.00 178.16 176.33 1bk0 h TYR 146 N 0.98 -0.05 -0.08 -3.82 5.03 -0.87 0.13 116.97 118.28 1bk0 h TYR 146 Ca 0.24 0.03 -0.13 0.00 2.58 0.00 0.00 58.73 61.46 1bk0 h TYR 146 Cb 0.09 0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.45 1bk0 h TYR 146 CO 0.00 -0.11 -0.53 -1.49 -1.32 0.00 0.00 178.16 174.71 1bk0 h TRP 147 N 0.10 0.29 -0.25 -3.82 -0.00 -1.09 0.39 115.95 111.57 1bk0 h TRP 147 Ca 0.23 -0.10 -0.04 0.00 -0.00 0.00 0.00 58.89 58.98 1bk0 h TRP 147 Cb 0.34 -0.06 -0.01 0.00 -0.00 0.00 0.00 29.16 29.44 1bk0 h TRP 147 CO -0.31 0.71 -0.00 -0.44 -0.00 0.00 0.00 178.44 178.41 1bk0 h ASP 148 N 0.18 0.43 0.76 -3.49 3.32 -0.24 -1.32 116.42 116.07 1bk0 h ASP 148 Ca 0.00 -0.31 -0.13 0.00 0.02 0.00 0.00 57.03 56.61 1bk0 h ASP 148 Cb 1.00 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.41 1bk0 h ASP 148 CO 0.08 0.63 -0.62 1.62 -1.72 0.00 0.00 179.24 179.23 1bk0 h VAL 149 N 0.21 1.35 -0.51 -1.35 3.04 -0.94 -2.18 116.25 115.87 1bk0 h VAL 149 Ca 0.07 -2.21 0.02 0.00 -1.01 0.00 0.00 66.70 63.57 1bk0 h VAL 149 Cb 0.41 2.22 -0.03 0.00 -2.01 0.00 0.00 31.29 31.89 1bk0 h VAL 149 CO 0.01 0.61 0.31 0.15 -1.01 0.00 0.00 177.57 177.64 1bk0 h PHE 150 N 0.00 0.58 -0.58 3.17 3.04 -0.78 0.00 116.94 122.37 1bk0 h PHE 150 Ca -0.01 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.95 1bk0 h PHE 150 Cb 1.17 -0.19 -0.03 0.00 2.56 0.00 0.00 35.95 39.47 1bk0 h PHE 150 CO 0.00 0.34 0.31 0.78 -2.02 0.00 0.00 178.31 177.71 1bk0 h GLY 151 N 0.62 0.88 1.00 2.40 0.00 -0.82 0.18 103.07 107.33 1bk0 h GLY 151 Ca 0.20 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 47.08 1bk0 h GLY 151 CO -0.08 0.40 0.24 -2.00 0.00 0.00 0.00 176.54 175.10 1bk0 h LEU 152 N 0.79 0.84 -0.90 3.11 5.85 -1.23 -2.30 115.31 121.48 1bk0 h LEU 152 Ca 0.20 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.69 1bk0 h LEU 152 Cb 0.07 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 1bk0 h LEU 152 CO -0.03 0.79 0.13 0.28 -0.34 0.00 0.00 178.44 179.27 1bk0 h SER 153 N 0.85 0.89 -0.49 1.25 0.02 -0.51 -0.17 113.55 115.39 1bk0 h SER 153 Ca 0.20 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 60.96 1bk0 h SER 153 Cb 0.21 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 1bk0 h SER 153 CO -0.02 0.87 0.23 0.28 -1.14 0.00 0.00 176.83 177.05 1bk0 h SER 154 N 0.90 0.65 -0.51 3.07 0.02 -0.75 0.32 113.55 117.24 1bk0 h SER 154 Ca 0.19 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1bk0 h SER 154 Cb 0.34 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.69 1bk0 h SER 154 CO 0.00 0.60 0.33 0.00 -1.14 0.00 0.00 176.83 176.62 1bk0 h ALA 155 N 1.07 0.65 -0.85 3.77 0.00 -0.83 -2.14 119.26 120.92 1bk0 h ALA 155 Ca 0.17 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1bk0 h ALA 155 Cb 0.13 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1bk0 h ALA 155 CO -0.02 0.12 0.56 -0.07 0.00 0.00 0.00 179.25 179.84 1bk0 h LEU 156 N 0.69 0.98 -1.54 0.00 3.38 -0.65 -1.70 115.31 116.47 1bk0 h LEU 156 Ca 0.19 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1bk0 h LEU 156 Cb -0.05 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 1bk0 h LEU 156 CO -0.04 0.71 -0.02 -0.07 0.09 0.00 0.00 178.44 179.12 1bk0 h LEU 157 N 1.16 0.24 -0.71 1.67 3.38 -0.60 -0.58 115.31 119.87 1bk0 h LEU 157 Ca 0.31 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.18 1bk0 h LEU 157 Cb -0.13 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1bk0 h LEU 157 CO -0.07 0.31 0.14 0.11 0.09 0.00 0.00 178.44 179.02 1bk0 h LYS 158 N 0.26 1.13 -0.44 1.13 1.57 -0.67 -1.40 116.57 118.15 1bk0 h LYS 158 Ca 0.06 -0.29 -0.04 0.00 -1.87 0.00 0.00 60.65 58.51 1bk0 h LYS 158 Cb 0.21 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 1bk0 h LYS 158 CO 0.01 1.01 0.10 0.78 -0.57 0.00 0.00 179.45 180.78 1bk0 h GLY 159 N 1.07 0.77 1.02 3.86 0.00 -0.84 -1.64 103.07 107.31 1bk0 h GLY 159 Ca 0.21 -0.49 -0.05 0.00 0.00 0.00 0.00 47.33 47.01 1bk0 h GLY 159 CO 0.01 0.45 0.23 -0.97 0.00 0.00 0.00 176.54 176.26 1bk0 h TYR 160 N 0.59 1.04 -0.10 5.60 0.05 -1.03 -0.63 116.97 122.49 1bk0 h TYR 160 Ca 0.14 -0.10 -0.00 0.00 0.05 0.00 0.00 58.73 58.82 1bk0 h TYR 160 Cb 0.33 -0.30 -0.00 0.00 1.01 0.00 0.00 36.73 37.76 1bk0 h TYR 160 CO 0.02 0.83 0.06 0.00 -1.05 0.00 0.00 178.16 178.02 1bk0 h ALA 161 N 1.09 0.12 -0.93 3.88 0.00 -1.10 -2.01 119.26 120.31 1bk0 h ALA 161 Ca 0.21 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1bk0 h ALA 161 Cb 0.26 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1bk0 h ALA 161 CO -0.01 -0.36 0.57 -0.07 0.00 0.00 0.00 179.25 179.38 1bk0 h LEU 162 N 0.09 1.12 -1.56 0.00 3.38 -1.18 -1.02 115.31 116.14 1bk0 h LEU 162 Ca 0.03 -0.07 0.06 0.00 0.09 0.00 0.00 57.88 58.00 1bk0 h LEU 162 Cb 0.04 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 1bk0 h LEU 162 CO -0.01 0.85 0.39 0.00 0.09 0.00 0.00 178.44 179.77 1bk0 h ALA 163 N 1.31 1.85 -0.23 1.53 0.00 -0.80 -1.98 119.26 120.95 1bk0 h ALA 163 Ca 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1bk0 h ALA 163 Cb -0.06 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1bk0 h ALA 163 CO -0.06 0.05 0.00 1.28 0.00 0.00 0.00 179.25 180.52 1bk0 n LEU 164 N -4.48 1.55 0.00 0.00 4.77 -0.78 -4.90 117.00 113.17 1bk0 n LEU 164 Ca 0.08 -0.72 0.00 0.00 -0.03 0.00 0.00 56.01 55.35 1bk0 n LEU 164 Cb 0.25 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1bk0 n LEU 164 CO 0.34 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 1bk0 n GLY 165 N 1.04 0.44 3.90 -0.72 0.00 -0.74 -4.92 105.19 104.20 1bk0 n GLY 165 Ca 0.13 -0.93 -0.21 0.00 0.00 0.00 0.00 46.02 45.01 1bk0 n GLY 165 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bk0 s LYS 166 N -1.70 2.48 0.63 1.61 -0.14 -0.45 -5.01 119.74 117.15 1bk0 s LYS 166 Ca 0.00 -1.61 -0.15 0.00 -1.36 0.00 0.00 55.97 52.85 1bk0 s LYS 166 Cb 0.00 -2.38 -0.02 0.00 -1.68 0.00 0.00 37.83 33.76 1bk0 s LYS 166 CO 0.00 -0.33 1.09 -1.83 -0.76 0.00 0.00 175.35 173.52 1bk0 s GLU 167 N -4.22 3.02 0.61 1.68 4.04 -1.26 -3.88 118.70 118.70 1bk0 s GLU 167 Ca 0.47 1.32 0.39 0.00 0.04 0.00 0.00 54.97 57.19 1bk0 s GLU 167 Cb -0.04 -1.98 1.96 0.00 0.02 0.00 0.00 34.13 34.09 1bk0 s GLU 167 CO 0.28 -1.07 2.21 1.05 -1.84 0.00 0.00 175.26 175.89 1bk0 h GLU 168 N 0.21 0.00 -0.43 -4.83 4.11 -1.90 -2.04 114.58 109.70 1bk0 h GLU 168 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1bk0 h GLU 168 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1bk0 h GLU 168 CO 0.55 0.01 0.00 0.09 0.07 0.00 0.00 179.01 179.73 1bk0 n ASN 169 N -3.12 2.40 -0.24 3.06 5.03 -1.26 -4.06 115.26 117.06 1bk0 n ASN 169 Ca -0.02 -1.98 0.04 0.00 0.87 0.00 0.00 54.58 53.50 1bk0 n ASN 169 Cb 0.17 -0.29 0.17 0.00 -1.02 0.00 0.00 39.78 38.81 1bk0 n ASN 169 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.26 175.58 1bk0 h PHE 170 N 2.68 0.44 0.05 3.10 3.57 -1.71 -1.20 116.94 123.87 1bk0 h PHE 170 Ca 0.00 0.04 -0.38 0.00 3.53 0.00 0.00 57.97 61.16 1bk0 h PHE 170 Cb 0.61 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 39.22 1bk0 h PHE 170 CO 0.29 0.04 -2.26 1.19 -2.23 0.00 0.00 178.31 175.34 1bk0 n PHE 171 N -5.03 0.51 0.25 0.41 3.72 -1.26 -4.53 117.46 111.53 1bk0 n PHE 171 Ca 0.13 0.12 0.11 0.00 -0.05 0.00 0.00 57.45 57.75 1bk0 n PHE 171 Cb 0.39 -1.07 0.71 0.00 -0.94 0.00 0.00 39.48 38.57 1bk0 n PHE 171 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1bk0 h ALA 172 N -0.04 1.93 0.00 4.37 0.00 -1.77 -0.70 119.26 123.05 1bk0 h ALA 172 Ca -0.52 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1bk0 h ALA 172 Cb 1.92 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.71 1bk0 h ALA 172 CO -0.04 -0.06 0.00 0.07 0.00 0.00 0.00 179.25 179.22 1bk0 h ARG 173 N 0.00 0.00 -0.24 0.00 0.11 -1.45 -1.42 114.38 111.37 1bk0 h ARG 173 Ca 0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.10 1bk0 h ARG 173 Cb 0.09 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.17 1bk0 h ARG 173 CO -0.00 0.00 0.00 0.72 0.10 0.00 0.00 179.97 180.79 1bk0 n HIS 174 N -2.94 0.29 -3.87 4.08 8.25 -0.27 -4.77 115.22 115.99 1bk0 n HIS 174 Ca -0.01 -0.15 -0.33 0.00 -0.26 0.00 0.00 57.72 56.98 1bk0 n HIS 174 Cb 0.16 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.14 1bk0 n HIS 174 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1bk0 s PHE 175 N -1.71 3.34 0.04 4.41 5.36 -0.54 -3.12 117.98 125.76 1bk0 s PHE 175 Ca 0.34 -2.97 0.08 0.00 -0.96 0.00 0.00 56.93 53.42 1bk0 s PHE 175 Cb 0.22 -2.98 -0.03 0.00 -0.34 0.00 0.00 43.02 39.89 1bk0 s PHE 175 CO 0.31 -0.81 -0.22 0.15 -1.46 0.00 0.00 175.22 173.20 1bk0 s LYS 176 N -0.02 1.47 0.41 10.12 1.02 -1.26 -4.93 119.74 126.55 1bk0 s LYS 176 Ca 0.16 -0.96 0.09 0.00 0.02 0.00 0.00 55.97 55.28 1bk0 s LYS 176 Cb -0.23 -1.59 0.90 0.00 -0.52 0.00 0.00 37.83 36.38 1bk0 s LYS 176 CO -0.02 0.41 2.02 -1.35 -0.92 0.00 0.00 175.35 175.49 1bk0 h PRO 177 N 4.88 0.52 0.00 -1.68 0.11 -1.98 -0.77 132.00 133.10 1bk0 h PRO 177 Ca -0.43 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1bk0 h PRO 177 Cb 1.16 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1bk0 h PRO 177 CO 0.44 0.35 0.00 -0.44 -0.21 0.00 0.00 178.00 178.14 1bk0 h ASP 178 N 0.54 0.00 0.00 -2.05 3.32 -1.98 -3.39 116.42 112.86 1bk0 h ASP 178 Ca 0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1bk0 h ASP 178 Cb 0.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1bk0 h ASP 178 CO -0.06 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 176.56 1bk0 n ASP 179 N -3.05 0.00 -4.74 6.45 5.68 -0.94 -4.88 116.55 115.07 1bk0 n ASP 179 Ca 0.02 -1.00 -0.42 0.00 -0.50 0.00 0.00 54.79 52.89 1bk0 n ASP 179 Cb 0.39 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.37 1bk0 n ASP 179 CO 0.00 0.00 0.00 1.07 -1.33 0.00 0.00 177.20 176.94 1bk0 n THR 180 N 0.00 1.98 0.68 2.12 5.66 -0.34 -4.45 114.28 119.92 1bk0 n THR 180 Ca 0.00 -0.49 0.06 0.00 -3.05 0.00 0.00 64.05 60.56 1bk0 n THR 180 Cb 0.30 -1.77 0.17 0.00 -1.55 0.00 0.00 70.33 67.48 1bk0 n THR 180 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1bk0 n LEU 181 N 0.65 2.24 -4.74 1.09 4.77 -0.60 -4.52 117.00 115.89 1bk0 n LEU 181 Ca 0.03 -1.12 -0.37 0.00 -0.03 0.00 0.00 56.01 54.51 1bk0 n LEU 181 Cb 0.37 -0.30 0.05 0.00 -2.33 0.00 0.00 43.42 41.21 1bk0 n LEU 181 CO 0.63 0.50 0.93 0.00 -1.33 0.00 0.00 177.39 178.12 1bk0 s ALA 182 N -1.55 2.62 0.10 -1.18 0.00 -1.25 -4.71 121.76 115.79 1bk0 s ALA 182 Ca 0.26 1.23 0.05 0.00 0.00 0.00 0.00 51.96 53.49 1bk0 s ALA 182 Cb 0.14 -3.54 -0.03 0.00 0.00 0.00 0.00 23.12 19.69 1bk0 s ALA 182 CO 0.16 -1.39 -0.12 -1.54 0.00 0.00 0.00 175.76 172.86 1bk0 s SER 183 N -1.23 1.66 -0.10 0.00 1.04 -1.12 -3.67 113.70 110.29 1bk0 s SER 183 Ca 0.76 -0.74 -0.02 0.00 0.48 0.00 0.00 55.95 56.43 1bk0 s SER 183 Cb -0.37 -0.03 -0.03 0.00 0.10 0.00 0.00 66.02 65.68 1bk0 s SER 183 CO 0.42 -0.17 -0.02 -0.69 0.98 0.00 0.00 173.24 173.76 1bk0 s VAL 184 N -1.96 4.07 -0.13 5.02 1.01 -0.42 -1.20 120.40 126.79 1bk0 s VAL 184 Ca 0.04 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.70 1bk0 s VAL 184 Cb -0.06 -2.72 0.02 0.00 0.00 0.00 0.00 36.38 33.62 1bk0 s VAL 184 CO 0.02 0.57 -0.16 -0.69 0.00 0.00 0.00 175.10 174.84 1bk0 s VAL 185 N -0.50 1.62 -0.73 2.92 1.01 -0.64 -1.55 120.40 122.52 1bk0 s VAL 185 Ca 0.08 -0.70 -0.16 0.00 0.00 0.00 0.00 61.98 61.21 1bk0 s VAL 185 Cb -0.12 -1.48 0.17 0.00 0.00 0.00 0.00 36.38 34.95 1bk0 s VAL 185 CO 0.02 0.46 0.73 -0.76 0.00 0.00 0.00 175.10 175.56 1bk0 s LEU 186 N 1.12 6.23 -0.15 3.92 1.43 0.23 -3.15 118.68 128.29 1bk0 s LEU 186 Ca -0.03 -2.21 -0.13 0.00 -1.03 0.00 0.00 54.13 50.73 1bk0 s LEU 186 Cb -0.14 -2.25 -0.05 0.00 0.03 0.00 0.00 46.19 43.79 1bk0 s LEU 186 CO -0.05 -0.78 0.28 -0.63 0.23 0.00 0.00 176.35 175.40 1bk0 s ILE 187 N 1.17 5.31 -0.25 -0.59 1.01 -0.46 -1.98 121.20 125.42 1bk0 s ILE 187 Ca 0.15 0.52 -0.08 0.00 0.00 0.00 0.00 60.65 61.24 1bk0 s ILE 187 Cb -0.16 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.66 1bk0 s ILE 187 CO -0.04 0.41 0.08 -0.60 0.00 0.00 0.00 174.94 174.80 1bk0 s ARG 188 N 0.32 3.69 -0.30 2.79 3.52 0.16 -1.95 118.95 127.17 1bk0 s ARG 188 Ca 0.16 -0.46 -0.08 0.00 -0.13 0.00 0.00 55.73 55.22 1bk0 s ARG 188 Cb -0.13 -3.36 -0.00 0.00 -1.56 0.00 0.00 34.95 29.90 1bk0 s ARG 188 CO 0.04 -0.19 0.12 0.71 -0.81 0.00 0.00 175.30 175.17 1bk0 s TYR 189 N 1.63 3.16 0.48 5.12 2.02 -0.72 -2.37 117.35 126.68 1bk0 s TYR 189 Ca 0.06 -0.73 -0.04 0.00 -0.37 0.00 0.00 57.07 55.99 1bk0 s TYR 189 Cb -0.15 -2.31 -0.03 0.00 -0.40 0.00 0.00 41.96 39.07 1bk0 s TYR 189 CO 0.04 -0.50 0.77 -1.25 -1.57 0.00 0.00 175.55 173.04 1bk0 s PRO 190 N 1.57 3.44 -0.06 -1.71 0.04 -1.26 -0.67 135.00 136.35 1bk0 s PRO 190 Ca 0.04 0.09 -0.24 0.00 0.04 0.00 0.00 61.00 60.94 1bk0 s PRO 190 Cb -0.17 -2.40 -0.04 0.00 0.04 0.00 0.00 34.50 31.93 1bk0 s PRO 190 CO 0.05 -0.23 0.71 -0.47 0.04 0.00 0.00 177.00 177.09 1bk0 s TYR 191 N -2.72 3.59 -0.01 0.56 5.04 -1.25 -4.21 117.35 118.35 1bk0 s TYR 191 Ca 0.47 1.27 0.01 0.00 -2.44 0.00 0.00 57.07 56.39 1bk0 s TYR 191 Cb -0.10 -2.80 0.00 0.00 0.35 0.00 0.00 41.96 39.41 1bk0 s TYR 191 CO 0.44 0.11 -0.04 -0.51 -1.34 0.00 0.00 175.55 174.20 1bk0 s LEU 192 N 0.71 1.77 -0.45 6.97 1.43 -1.26 -4.91 118.68 122.95 1bk0 s LEU 192 Ca 0.38 -0.09 0.05 0.00 -1.03 0.00 0.00 54.13 53.44 1bk0 s LEU 192 Cb -0.18 -0.29 0.20 0.00 0.03 0.00 0.00 46.19 45.95 1bk0 s LEU 192 CO 0.19 0.02 0.43 -0.67 0.23 0.00 0.00 176.35 176.55 1bk0 n ASP 193 N 3.31 0.29 -4.80 2.29 2.03 -1.26 -2.92 116.55 115.50 1bk0 n ASP 193 Ca -0.17 -2.61 -0.31 0.00 0.52 0.00 0.00 54.79 52.21 1bk0 n ASP 193 Cb 0.56 -0.61 -0.06 0.00 -0.72 0.00 0.00 41.12 40.29 1bk0 n ASP 193 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1bk0 s PRO 194 N -0.62 3.01 -0.20 -0.67 0.04 -1.26 -5.13 135.00 130.16 1bk0 s PRO 194 Ca 0.33 -0.60 -0.21 0.00 0.04 0.00 0.00 61.00 60.56 1bk0 s PRO 194 Cb 0.08 -2.81 -0.02 0.00 0.04 0.00 0.00 34.50 31.79 1bk0 s PRO 194 CO -0.16 0.60 0.66 -0.47 0.04 0.00 0.00 177.00 177.66 1bk0 s TYR 195 N -1.34 3.37 0.16 0.56 6.14 -1.15 -5.01 117.35 120.07 1bk0 s TYR 195 Ca 0.28 0.95 -0.31 0.00 0.64 0.00 0.00 57.07 58.63 1bk0 s TYR 195 Cb -0.12 -2.83 -0.10 0.00 0.42 0.00 0.00 41.96 39.32 1bk0 s TYR 195 CO 0.20 -0.21 1.67 -1.25 0.64 0.00 0.00 175.55 176.61 1bk0 s PRO 196 N 2.04 4.17 0.47 4.97 0.04 -1.26 -4.89 135.00 140.53 1bk0 s PRO 196 Ca 0.30 2.47 0.13 0.00 0.04 0.00 0.00 61.00 63.94 1bk0 s PRO 196 Cb -0.16 -3.26 1.09 0.00 0.04 0.00 0.00 34.50 32.21 1bk0 s PRO 196 CO 0.10 -0.71 2.08 1.05 0.04 0.00 0.00 177.00 179.56 1bk0 h GLU 197 N 7.31 0.14 0.00 4.56 9.09 -1.93 -0.98 114.58 132.76 1bk0 h GLU 197 Ca -0.43 -0.01 -0.00 0.00 0.05 0.00 0.00 59.36 58.96 1bk0 h GLU 197 Cb 1.20 -0.03 -0.00 0.00 -1.65 0.00 0.00 28.75 28.28 1bk0 h GLU 197 CO 0.94 0.15 -0.02 0.00 0.05 0.00 0.00 179.01 180.12 1bk0 h ALA 198 N 1.88 1.05 -0.22 1.06 0.00 -1.85 -0.72 119.26 120.45 1bk0 h ALA 198 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1bk0 h ALA 198 Cb 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1bk0 h ALA 198 CO 0.00 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.28 1bk0 n ALA 199 N -2.12 2.50 -3.63 0.00 0.00 -0.37 -4.78 120.51 112.10 1bk0 n ALA 199 Ca -0.01 -0.61 -0.34 0.00 0.00 0.00 0.00 53.44 52.48 1bk0 n ALA 199 Cb 0.19 -1.04 -0.15 0.00 0.00 0.00 0.00 19.45 18.45 1bk0 n ALA 199 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bk0 s ILE 200 N -1.72 2.81 0.34 0.00 1.01 -0.28 -4.77 121.20 118.58 1bk0 s ILE 200 Ca 0.33 -0.70 0.04 0.00 0.00 0.00 0.00 60.65 60.31 1bk0 s ILE 200 Cb 0.18 -2.22 -0.02 0.00 0.01 0.00 0.00 42.46 40.41 1bk0 s ILE 200 CO 0.26 0.49 0.50 -0.54 0.00 0.00 0.00 174.94 175.65 1bk0 s LYS 201 N 1.18 3.27 -0.11 2.79 1.02 -0.01 -4.92 119.74 122.96 1bk0 s LYS 201 Ca 0.02 -0.69 0.01 0.00 0.02 0.00 0.00 55.97 55.33 1bk0 s LYS 201 Cb -0.14 -2.75 0.02 0.00 -0.52 0.00 0.00 37.83 34.44 1bk0 s LYS 201 CO -0.05 0.11 -0.12 0.99 -0.92 0.00 0.00 175.35 175.37 1bk0 s THR 202 N -2.23 1.30 0.87 2.17 2.01 -1.26 -0.18 115.64 118.32 1bk0 s THR 202 Ca 0.42 -0.50 -0.12 0.00 0.31 0.00 0.00 61.69 61.80 1bk0 s THR 202 Cb -0.09 -1.23 0.11 0.00 0.01 0.00 0.00 72.50 71.30 1bk0 s THR 202 CO 0.33 0.41 1.10 0.00 -0.69 0.00 0.00 174.62 175.77 1bk0 s ALA 203 N 1.27 1.82 0.52 7.40 0.00 0.36 -4.90 121.76 128.23 1bk0 s ALA 203 Ca -0.02 -0.27 0.23 0.00 0.00 0.00 0.00 51.96 51.90 1bk0 s ALA 203 Cb -0.14 -3.11 1.47 0.00 0.00 0.00 0.00 23.12 21.34 1bk0 s ALA 203 CO -0.05 -2.13 2.15 0.00 0.00 0.00 0.00 175.76 175.73 1bk0 h ALA 204 N -1.39 1.66 -0.11 0.00 0.00 -2.01 -0.15 119.26 117.26 1bk0 h ALA 204 Ca -0.49 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1bk0 h ALA 204 Cb 1.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1bk0 h ALA 204 CO 0.59 0.06 0.00 -0.40 0.00 0.00 0.00 179.25 179.50 1bk0 n ASP 205 N -4.10 1.21 0.00 0.00 5.68 -1.26 -4.91 116.55 113.16 1bk0 n ASP 205 Ca -0.03 -1.60 0.00 0.00 -0.50 0.00 0.00 54.79 52.66 1bk0 n ASP 205 Cb 0.13 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 1bk0 n ASP 205 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1bk0 n GLY 206 N 1.05 0.87 3.73 6.12 0.00 -0.07 -5.04 105.19 111.85 1bk0 n GLY 206 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1bk0 n GLY 206 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bk0 s THR 207 N -2.37 2.79 -0.03 2.61 2.01 -1.26 -4.65 115.64 114.75 1bk0 s THR 207 Ca 0.00 0.61 -0.30 0.00 0.31 0.00 0.00 61.69 62.31 1bk0 s THR 207 Cb 0.00 -3.39 -0.03 0.00 0.01 0.00 0.00 72.50 69.10 1bk0 s THR 207 CO 0.00 0.07 1.00 -0.54 -0.69 0.00 0.00 174.62 174.46 1bk0 s LYS 208 N 0.42 4.51 0.19 4.92 1.02 -1.26 -0.49 119.74 129.05 1bk0 s LYS 208 Ca 0.64 1.43 0.09 0.00 0.02 0.00 0.00 55.97 58.15 1bk0 s LYS 208 Cb -0.41 -3.48 -0.04 0.00 -0.52 0.00 0.00 37.83 33.37 1bk0 s LYS 208 CO 0.37 -0.14 -0.18 -0.51 -0.92 0.00 0.00 175.35 173.97 1bk0 s LEU 209 N 1.31 2.49 -0.09 3.17 1.43 0.75 -0.74 118.68 127.00 1bk0 s LEU 209 Ca 0.51 -0.93 0.18 0.00 -1.03 0.00 0.00 54.13 52.86 1bk0 s LEU 209 Cb -0.21 -0.83 -0.26 0.00 0.03 0.00 0.00 46.19 44.92 1bk0 s LEU 209 CO 0.25 -0.06 0.25 -1.20 0.23 0.00 0.00 176.35 175.83 1bk0 n SER 210 N -0.02 0.65 -3.70 2.29 7.64 0.31 -0.83 113.62 119.95 1bk0 n SER 210 Ca -0.11 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.66 1bk0 n SER 210 Cb 0.58 1.44 -0.11 0.00 -1.01 0.00 0.00 64.21 65.11 1bk0 n SER 210 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1bk0 s PHE 211 N -2.91 -0.52 0.98 1.43 5.36 -1.08 -4.90 117.98 116.35 1bk0 s PHE 211 Ca -0.08 1.14 -0.14 0.00 -0.96 0.00 0.00 56.93 56.89 1bk0 s PHE 211 Cb 0.09 0.20 0.18 0.00 -0.34 0.00 0.00 43.02 43.15 1bk0 s PHE 211 CO 0.76 -0.31 1.16 -1.21 -1.46 0.00 0.00 175.22 174.16 1bk0 s GLU 212 N 1.36 0.54 0.44 10.12 0.41 -1.26 -1.48 118.70 128.83 1bk0 s GLU 212 Ca -0.09 0.13 -0.24 0.00 -0.41 0.00 0.00 54.97 54.35 1bk0 s GLU 212 Cb -0.09 -1.78 -0.09 0.00 -1.78 0.00 0.00 34.13 30.38 1bk0 s GLU 212 CO -0.12 -2.57 1.20 -2.67 -0.49 0.00 0.00 175.26 170.61 1bk0 n TRP 213 N -3.99 1.84 -3.65 1.61 4.27 -1.26 -4.57 117.44 111.69 1bk0 n TRP 213 Ca 0.09 0.51 -0.05 0.00 -3.89 0.00 0.00 57.50 54.16 1bk0 n TRP 213 Cb 0.59 -2.33 -0.01 0.00 -1.36 0.00 0.00 31.31 28.20 1bk0 n TRP 213 CO 0.00 0.00 0.00 -3.38 -2.29 0.00 0.00 177.69 172.02 1bk0 s HIS 214 N -1.24 -0.19 0.09 -2.67 -3.43 -0.70 -4.96 115.29 102.19 1bk0 s HIS 214 Ca 0.63 -0.02 0.03 0.00 -0.80 0.00 0.00 55.06 54.91 1bk0 s HIS 214 Cb -0.51 0.59 -0.04 0.00 -1.43 0.00 0.00 32.58 31.19 1bk0 s HIS 214 CO 0.56 -0.63 0.07 -1.21 -2.00 0.00 0.00 174.74 171.53 1bk0 s GLU 215 N -3.08 2.82 0.41 -0.38 2.02 -1.26 -1.89 118.70 117.35 1bk0 s GLU 215 Ca 0.10 -0.73 -0.22 0.00 0.02 0.00 0.00 54.97 54.14 1bk0 s GLU 215 Cb -0.00 -2.69 -0.10 0.00 0.10 0.00 0.00 34.13 31.44 1bk0 s GLU 215 CO -0.03 0.56 0.98 -0.51 0.02 0.00 0.00 175.26 176.28 1bk0 s ASP 216 N -2.42 6.88 -0.81 -0.19 1.01 -1.26 -4.90 116.67 114.98 1bk0 s ASP 216 Ca 0.29 1.83 -0.16 0.00 0.71 0.00 0.00 52.55 55.22 1bk0 s ASP 216 Cb -0.12 -2.56 0.18 0.00 1.01 0.00 0.00 42.92 41.43 1bk0 s ASP 216 CO 0.21 -0.40 0.83 -0.69 0.21 0.00 0.00 175.17 175.33 1bk0 s VAL 217 N -1.93 5.31 -0.05 -1.27 1.01 -1.26 -0.81 120.40 121.39 1bk0 s VAL 217 Ca 0.60 -2.06 -0.31 0.00 0.00 0.00 0.00 61.98 60.20 1bk0 s VAL 217 Cb -0.15 -4.54 0.13 0.00 0.00 0.00 0.00 36.38 31.82 1bk0 s VAL 217 CO 0.19 -1.14 1.31 -0.94 0.00 0.00 0.00 175.10 174.52 1bk0 s SER 218 N 2.74 -0.05 -0.10 3.32 1.04 -1.26 -4.93 113.70 114.45 1bk0 s SER 218 Ca 0.20 -0.10 -0.03 0.00 0.48 0.00 0.00 55.95 56.50 1bk0 s SER 218 Cb -0.11 0.13 -0.03 0.00 0.10 0.00 0.00 66.02 66.11 1bk0 s SER 218 CO -0.07 -0.24 0.10 0.25 0.98 0.00 0.00 173.24 174.26 1bk0 h LEU 219 N 2.00 -0.02 -8.44 2.42 5.85 -1.46 -2.66 115.31 113.00 1bk0 h LEU 219 Ca -0.29 -0.08 -0.22 0.00 0.84 0.00 0.00 57.88 58.13 1bk0 h LEU 219 Cb 1.20 0.01 -0.15 0.00 0.37 0.00 0.00 40.66 42.08 1bk0 h LEU 219 CO 0.28 0.52 -0.69 0.27 -0.34 0.00 0.00 178.44 178.47 1bk0 s ILE 220 N -1.70 0.65 -0.08 4.05 -4.36 -1.24 -1.23 121.20 117.29 1bk0 s ILE 220 Ca -0.02 -1.93 0.05 0.00 -0.26 0.00 0.00 60.65 58.49 1bk0 s ILE 220 Cb -0.00 -1.69 -0.00 0.00 1.25 0.00 0.00 42.46 42.01 1bk0 s ILE 220 CO 0.07 -0.86 -0.24 -0.89 0.24 0.00 0.00 174.94 173.26 1bk0 s THR 221 N -3.65 2.02 -0.32 8.37 2.01 0.08 -1.01 115.64 123.14 1bk0 s THR 221 Ca 0.12 -1.02 0.03 0.00 0.31 0.00 0.00 61.69 61.13 1bk0 s THR 221 Cb 0.06 -1.74 0.10 0.00 0.01 0.00 0.00 72.50 70.92 1bk0 s THR 221 CO -0.05 0.56 0.05 -0.69 -0.69 0.00 0.00 174.62 173.80 1bk0 s VAL 222 N 0.18 1.90 -0.11 3.82 1.01 -0.46 -2.47 120.40 124.28 1bk0 s VAL 222 Ca -0.14 -2.03 0.03 0.00 0.00 0.00 0.00 61.98 59.84 1bk0 s VAL 222 Cb -0.16 -2.38 -0.00 0.00 0.00 0.00 0.00 36.38 33.83 1bk0 s VAL 222 CO 0.07 -0.56 -0.22 -0.22 0.00 0.00 0.00 175.10 174.17 1bk0 s LEU 223 N 1.11 2.23 -0.14 3.92 2.96 -0.17 -1.24 118.68 127.34 1bk0 s LEU 223 Ca 0.09 -0.51 -0.07 0.00 -0.22 0.00 0.00 54.13 53.42 1bk0 s LEU 223 Cb -0.19 -1.45 -0.04 0.00 0.50 0.00 0.00 46.19 45.01 1bk0 s LEU 223 CO -0.12 0.16 0.09 -0.47 -1.32 0.00 0.00 176.35 174.70 1bk0 s TYR 224 N 0.32 3.39 0.04 5.38 5.04 -1.04 -0.58 117.35 129.91 1bk0 s TYR 224 Ca -0.17 0.31 0.01 0.00 -2.44 0.00 0.00 57.07 54.78 1bk0 s TYR 224 Cb -0.17 -1.99 -0.03 0.00 0.35 0.00 0.00 41.96 40.12 1bk0 s TYR 224 CO 0.08 0.46 -0.05 -0.65 -1.34 0.00 0.00 175.55 174.05 1bk0 s GLN 225 N -0.39 0.49 1.17 4.97 -0.21 -1.26 -0.43 119.66 124.00 1bk0 s GLN 225 Ca 0.10 -0.82 -0.13 0.00 0.02 0.00 0.00 55.36 54.53 1bk0 s GLN 225 Cb -0.12 -0.06 0.28 0.00 1.00 0.00 0.00 33.01 34.12 1bk0 s GLN 225 CO 0.02 -0.02 0.99 0.43 -2.12 0.00 0.00 175.29 174.59 1bk0 n SER 226 N 1.17 -1.71 -3.13 5.90 7.64 -0.82 -4.14 113.62 118.53 1bk0 n SER 226 Ca -0.21 -0.15 -0.35 0.00 1.01 0.00 0.00 58.87 59.17 1bk0 n SER 226 Cb 0.56 -1.26 -0.05 0.00 -1.01 0.00 0.00 64.21 62.46 1bk0 n SER 226 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1bk0 n ASN 227 N -4.88 8.21 -3.79 6.43 4.05 -1.26 -4.73 115.26 119.29 1bk0 n ASN 227 Ca 0.03 -2.62 -0.27 0.00 0.45 0.00 0.00 54.58 52.18 1bk0 n ASN 227 Cb 0.54 -1.52 -0.17 0.00 1.23 0.00 0.00 39.78 39.86 1bk0 n ASN 227 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1bk0 s VAL 228 N 1.67 0.66 0.29 3.44 1.01 -1.26 -5.04 120.40 121.17 1bk0 s VAL 228 Ca 0.68 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.96 1bk0 s VAL 228 Cb 0.20 -0.98 -0.11 0.00 0.00 0.00 0.00 36.38 35.49 1bk0 s VAL 228 CO -0.06 0.01 1.56 -1.58 0.00 0.00 0.00 175.10 175.04 1bk0 s GLN 229 N 1.82 4.14 0.00 2.72 -0.44 -1.26 -4.84 119.66 121.81 1bk0 s GLN 229 Ca 0.01 2.53 0.00 0.00 -2.50 0.00 0.00 55.36 55.40 1bk0 s GLN 229 Cb -0.15 -3.03 0.00 0.00 -1.64 0.00 0.00 33.01 28.18 1bk0 s GLN 229 CO -0.07 -0.59 0.00 0.27 0.50 0.00 0.00 175.29 175.40 1bk0 n ASN 230 N 2.06 0.00 -4.81 6.67 0.23 -1.26 -4.96 115.26 113.19 1bk0 n ASN 230 Ca 0.07 0.00 -0.36 0.00 -0.53 0.00 0.00 54.58 53.77 1bk0 n ASN 230 Cb 0.38 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.02 1bk0 n ASN 230 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1bk0 s LEU 231 N -0.94 4.27 0.02 -4.53 1.43 -1.26 -0.53 118.68 117.14 1bk0 s LEU 231 Ca 0.00 1.59 0.04 0.00 -1.03 0.00 0.00 54.13 54.73 1bk0 s LEU 231 Cb 0.00 -3.90 -0.02 0.00 0.03 0.00 0.00 46.19 42.31 1bk0 s LEU 231 CO 0.00 -0.07 -0.12 -1.10 0.23 0.00 0.00 176.35 175.29 1bk0 s GLN 232 N -2.24 0.83 -0.05 1.70 -0.21 -0.57 -1.05 119.66 118.07 1bk0 s GLN 232 Ca 0.49 -0.61 0.06 0.00 0.02 0.00 0.00 55.36 55.32 1bk0 s GLN 232 Cb -0.16 -0.80 -0.02 0.00 1.00 0.00 0.00 33.01 33.04 1bk0 s GLN 232 CO 0.21 0.20 -0.22 0.54 -2.12 0.00 0.00 175.29 173.90 1bk0 s VAL 233 N -0.68 2.33 -0.05 1.09 0.11 -0.31 -1.26 120.40 121.63 1bk0 s VAL 233 Ca 0.01 -0.98 -0.28 0.00 -2.93 0.00 0.00 61.98 57.80 1bk0 s VAL 233 Cb -0.07 -1.86 -0.03 0.00 -1.53 0.00 0.00 36.38 32.90 1bk0 s VAL 233 CO 0.01 0.57 0.91 -0.70 -3.33 0.00 0.00 175.10 172.56 1bk0 s GLU 234 N -0.33 4.49 0.15 1.54 2.12 -0.08 -0.92 118.70 125.66 1bk0 s GLU 234 Ca 0.02 1.26 0.01 0.00 0.36 0.00 0.00 54.97 56.62 1bk0 s GLU 234 Cb -0.12 -3.48 -0.00 0.00 0.26 0.00 0.00 34.13 30.78 1bk0 s GLU 234 CO 0.02 -0.10 0.04 0.25 -0.54 0.00 0.00 175.26 174.93 1bk0 n THR 235 N 4.06 0.00 0.22 -1.70 -2.24 -0.05 -4.64 114.28 109.94 1bk0 n THR 235 Ca 0.05 -0.80 0.07 0.00 -2.27 0.00 0.00 64.05 61.10 1bk0 n THR 235 Cb 0.50 0.26 0.53 0.00 -2.10 0.00 0.00 70.33 69.52 1bk0 n THR 235 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bk0 h ALA 236 N 1.19 1.37 -0.36 6.98 0.00 -1.98 -0.57 119.26 125.89 1bk0 h ALA 236 Ca -0.12 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1bk0 h ALA 236 Cb 0.42 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1bk0 h ALA 236 CO 0.19 0.29 0.00 0.00 0.00 0.00 0.00 179.25 179.72 1bk0 n ALA 237 N -2.38 2.55 0.00 0.00 0.00 -1.26 -5.05 120.51 114.37 1bk0 n ALA 237 Ca -0.02 -0.70 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1bk0 n ALA 237 Cb 0.32 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.78 1bk0 n ALA 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bk0 n GLY 238 N 0.98 -1.68 3.72 0.00 0.00 -0.22 -4.93 105.19 103.05 1bk0 n GLY 238 Ca 0.13 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.67 1bk0 n GLY 238 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bk0 s TYR 239 N 0.00 3.54 0.05 1.61 2.02 -1.26 -0.88 117.35 122.44 1bk0 s TYR 239 Ca 0.00 1.49 0.08 0.00 -0.37 0.00 0.00 57.07 58.27 1bk0 s TYR 239 Cb 0.00 -3.30 -0.03 0.00 -0.40 0.00 0.00 41.96 38.24 1bk0 s TYR 239 CO 0.00 -0.74 -0.22 -0.65 -1.57 0.00 0.00 175.55 172.36 1bk0 s GLN 240 N 0.73 1.49 0.09 -0.62 -0.21 -0.10 -4.61 119.66 116.44 1bk0 s GLN 240 Ca 0.55 -1.01 -0.30 0.00 0.02 0.00 0.00 55.36 54.62 1bk0 s GLN 240 Cb -0.27 -1.64 -0.06 0.00 1.00 0.00 0.00 33.01 32.04 1bk0 s GLN 240 CO 0.30 0.42 1.10 -0.51 -2.12 0.00 0.00 175.29 174.48 1bk0 s ASP 241 N -1.24 7.23 -0.26 5.90 1.01 -0.28 -1.16 116.67 127.86 1bk0 s ASP 241 Ca 0.09 1.96 -0.18 0.00 0.71 0.00 0.00 52.55 55.12 1bk0 s ASP 241 Cb -0.09 -2.59 -0.02 0.00 1.01 0.00 0.00 42.92 41.23 1bk0 s ASP 241 CO 0.02 -0.31 0.54 -0.63 0.21 0.00 0.00 175.17 175.00 1bk0 s ILE 242 N 0.52 5.05 0.55 0.77 1.01 -0.21 -0.57 121.20 128.31 1bk0 s ILE 242 Ca 0.53 0.90 -0.21 0.00 0.00 0.00 0.00 60.65 61.88 1bk0 s ILE 242 Cb -0.27 -3.86 -0.05 0.00 0.01 0.00 0.00 42.46 38.29 1bk0 s ILE 242 CO 0.31 0.06 1.23 -1.83 0.00 0.00 0.00 174.94 174.71 1bk0 s GLU 243 N 2.36 3.22 0.51 2.79 4.04 -1.26 -4.42 118.70 125.94 1bk0 s GLU 243 Ca 0.22 1.92 -0.17 0.00 0.04 0.00 0.00 54.97 56.98 1bk0 s GLU 243 Cb -0.16 -2.14 -0.08 0.00 0.02 0.00 0.00 34.13 31.78 1bk0 s GLU 243 CO 0.09 -1.03 0.98 0.00 -1.84 0.00 0.00 175.26 173.46 1bk0 s ALA 244 N -1.51 3.07 -0.31 -0.84 0.00 -1.26 -5.02 121.76 115.90 1bk0 s ALA 244 Ca 0.72 0.18 0.04 0.00 0.00 0.00 0.00 51.96 52.90 1bk0 s ALA 244 Cb -0.32 -3.11 0.18 0.00 0.00 0.00 0.00 23.12 19.87 1bk0 s ALA 244 CO 0.37 -0.21 0.50 0.34 0.00 0.00 0.00 175.76 176.75 1bk0 s ASP 245 N -3.04 -0.49 -0.01 0.00 -1.08 -1.26 -5.01 116.67 105.77 1bk0 s ASP 245 Ca 0.59 -0.30 0.02 0.00 -0.52 0.00 0.00 52.55 52.34 1bk0 s ASP 245 Cb -0.10 1.50 0.07 0.00 -1.46 0.00 0.00 42.92 42.93 1bk0 s ASP 245 CO 0.31 -0.31 0.87 -0.90 0.52 0.00 0.00 175.17 175.66 1bk0 n ASP 246 N 5.21 0.86 -0.00 -0.34 5.75 -1.26 -2.65 116.55 124.11 1bk0 n ASP 246 Ca 0.04 -2.04 0.07 0.00 -0.01 0.00 0.00 54.79 52.84 1bk0 n ASP 246 Cb 0.52 -0.25 -0.09 0.00 -1.03 0.00 0.00 41.12 40.27 1bk0 n ASP 246 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1bk0 n THR 247 N -0.13 0.00 -4.52 2.12 -2.24 -1.26 -4.84 114.28 103.40 1bk0 n THR 247 Ca 0.03 -0.26 -0.30 0.00 -2.27 0.00 0.00 64.05 61.24 1bk0 n THR 247 Cb 0.18 0.51 -0.07 0.00 -2.10 0.00 0.00 70.33 68.86 1bk0 n THR 247 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1bk0 s GLY 248 N -3.02 2.79 -0.17 3.38 0.00 -1.09 -4.88 107.32 104.33 1bk0 s GLY 248 Ca -0.01 -0.89 -0.04 0.00 0.00 0.00 0.00 44.72 43.78 1bk0 s GLY 248 CO 0.55 -2.12 -0.03 -0.19 0.00 0.00 0.00 173.10 171.31 1bk0 s TYR 249 N -2.82 3.01 -0.13 1.90 2.02 -0.81 -4.72 117.35 115.80 1bk0 s TYR 249 Ca 0.17 -0.42 -0.28 0.00 -0.37 0.00 0.00 57.07 56.18 1bk0 s TYR 249 Cb 0.02 -2.00 -0.01 0.00 -0.40 0.00 0.00 41.96 39.56 1bk0 s TYR 249 CO 0.10 -0.15 0.93 -1.17 -1.57 0.00 0.00 175.55 173.68 1bk0 s LEU 250 N 0.65 4.22 -0.06 -1.29 2.96 0.25 -0.15 118.68 125.26 1bk0 s LEU 250 Ca -0.02 1.37 0.05 0.00 -0.22 0.00 0.00 54.13 55.31 1bk0 s LEU 250 Cb -0.14 -3.41 -0.02 0.00 0.50 0.00 0.00 46.19 43.12 1bk0 s LEU 250 CO 0.02 -0.42 -0.19 -0.63 -1.32 0.00 0.00 176.35 173.81 1bk0 s ILE 251 N 2.04 2.62 0.15 6.68 -1.09 0.07 -1.00 121.20 130.68 1bk0 s ILE 251 Ca 0.44 -0.87 -0.13 0.00 -2.23 0.00 0.00 60.65 57.86 1bk0 s ILE 251 Cb -0.17 -2.00 0.01 0.00 -1.58 0.00 0.00 42.46 38.72 1bk0 s ILE 251 CO 0.15 0.57 0.36 0.54 -1.23 0.00 0.00 174.94 175.34 1bk0 s ASN 252 N -0.41 -0.09 0.33 3.58 4.22 -1.03 -2.26 114.94 119.28 1bk0 s ASN 252 Ca 0.04 -0.60 -0.14 0.00 -2.14 0.00 0.00 52.86 50.03 1bk0 s ASN 252 Cb -0.12 0.47 -0.08 0.00 1.28 0.00 0.00 41.25 42.79 1bk0 s ASN 252 CO 0.02 -0.90 0.73 0.00 -2.04 0.00 0.00 177.10 174.91 1bk0 s GLY 254 N -2.44 1.99 0.36 0.00 0.00 -0.37 -4.08 107.32 102.78 1bk0 s GLY 254 Ca 0.53 -1.79 0.27 0.00 0.00 0.00 0.00 44.72 43.73 1bk0 s GLY 254 CO 0.20 -1.79 1.81 1.48 0.00 0.00 0.00 173.10 174.80 1bk0 h SER 255 N 0.40 0.00 -0.34 1.64 4.64 -0.92 -1.98 113.55 117.00 1bk0 h SER 255 Ca -0.32 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.84 1bk0 h SER 255 Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.38 1bk0 h SER 255 CO 0.47 0.00 -0.38 0.22 -0.87 0.00 0.00 176.83 176.27 1bk0 h TYR 256 N 0.00 1.06 -0.75 4.77 3.20 -1.73 -1.08 116.97 122.43 1bk0 h TYR 256 Ca 0.00 -0.31 -0.05 0.00 3.14 0.00 0.00 58.73 61.51 1bk0 h TYR 256 Cb 0.39 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 1bk0 h TYR 256 CO 0.00 1.12 0.28 1.98 -1.64 0.00 0.00 178.16 179.90 1bk0 h MET 257 N 0.73 1.14 -0.56 1.82 4.05 -1.52 -1.18 114.93 119.41 1bk0 h MET 257 Ca 0.06 -0.22 -0.01 0.00 -0.28 0.00 0.00 59.70 59.25 1bk0 h MET 257 Cb 0.96 -0.18 -0.03 0.00 -0.80 0.00 0.00 31.60 31.55 1bk0 h MET 257 CO 0.09 0.94 0.29 0.00 0.23 0.00 0.00 176.91 178.47 1bk0 h ALA 258 N 1.14 0.71 -0.02 0.39 0.00 -1.31 -1.56 119.26 118.62 1bk0 h ALA 258 Ca 0.25 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1bk0 h ALA 258 Cb 0.25 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1bk0 h ALA 258 CO -0.02 0.25 0.01 1.25 0.00 0.00 0.00 179.25 180.74 1bk0 h HIS 259 N 0.75 0.02 -0.29 0.00 6.17 -0.89 0.78 115.15 121.70 1bk0 h HIS 259 Ca 0.19 -0.00 -0.02 0.00 0.71 0.00 0.00 60.37 61.26 1bk0 h HIS 259 Cb 0.08 -0.01 -0.02 0.00 2.52 0.00 0.00 27.41 29.98 1bk0 h HIS 259 CO -0.01 0.06 0.10 -0.07 0.71 0.00 0.00 177.93 178.72 1bk0 h LEU 260 N -0.03 0.36 -2.66 0.26 3.38 -1.00 -2.70 115.31 112.92 1bk0 h LEU 260 Ca 0.01 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1bk0 h LEU 260 Cb 0.05 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1bk0 h LEU 260 CO -0.00 0.35 0.00 0.35 0.09 0.00 0.00 178.44 179.23 1bk0 n THR 261 N -4.40 0.88 -3.77 0.22 -2.24 -0.61 -0.73 114.28 103.62 1bk0 n THR 261 Ca 0.01 -0.94 -0.26 0.00 -2.27 0.00 0.00 64.05 60.59 1bk0 n THR 261 Cb 0.14 0.62 0.04 0.00 -2.10 0.00 0.00 70.33 69.03 1bk0 n THR 261 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1bk0 n ASN 262 N 1.49 -4.17 -0.58 3.42 5.15 -0.79 -1.63 115.26 118.15 1bk0 n ASN 262 Ca 0.22 -0.73 -0.08 0.00 -0.60 0.00 0.00 54.58 53.40 1bk0 n ASN 262 Cb 0.60 -4.25 -0.03 0.00 -0.53 0.00 0.00 39.78 35.56 1bk0 n ASN 262 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1bk0 n ASN 263 N -2.94 -4.63 -0.10 1.20 5.15 0.20 -4.87 115.26 109.26 1bk0 n ASN 263 Ca -0.06 0.19 -0.11 0.00 -0.60 0.00 0.00 54.58 54.00 1bk0 n ASN 263 Cb 0.58 -2.80 -0.03 0.00 -0.53 0.00 0.00 39.78 36.99 1bk0 n ASN 263 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1bk0 h TYR 264 N 0.00 0.54 -3.42 1.20 3.20 -1.57 -3.27 116.97 113.65 1bk0 h TYR 264 Ca -0.16 -0.08 -0.73 0.00 3.14 0.00 0.00 58.73 60.91 1bk0 h TYR 264 Cb 0.73 -0.15 -0.30 0.00 1.54 0.00 0.00 36.73 38.56 1bk0 h TYR 264 CO 0.36 0.60 -0.31 0.71 -1.64 0.00 0.00 178.16 177.88 1bk0 s TYR 265 N -5.16 3.48 0.63 -3.82 2.02 -1.26 -4.69 117.35 108.54 1bk0 s TYR 265 Ca -0.13 -2.06 -0.16 0.00 -0.37 0.00 0.00 57.07 54.34 1bk0 s TYR 265 Cb 0.08 -3.49 -0.02 0.00 -0.40 0.00 0.00 41.96 38.14 1bk0 s TYR 265 CO 0.75 -0.96 1.11 0.15 -1.57 0.00 0.00 175.55 175.03 1bk0 s LYS 266 N 0.90 2.96 -0.52 -0.62 1.02 -1.24 -3.33 119.74 118.91 1bk0 s LYS 266 Ca 0.10 1.45 -0.24 0.00 0.02 0.00 0.00 55.97 57.29 1bk0 s LYS 266 Cb -0.23 -1.97 0.04 0.00 -0.52 0.00 0.00 37.83 35.15 1bk0 s LYS 266 CO -0.03 -1.14 0.93 0.00 -0.92 0.00 0.00 175.35 174.20 1bk0 s ALA 267 N -2.19 3.19 0.35 5.17 0.00 -1.26 -4.63 121.76 122.38 1bk0 s ALA 267 Ca 0.68 -1.12 -0.28 0.00 0.00 0.00 0.00 51.96 51.24 1bk0 s ALA 267 Cb -0.21 -3.70 -0.11 0.00 0.00 0.00 0.00 23.12 19.10 1bk0 s ALA 267 CO 0.38 -2.28 1.37 -1.25 0.00 0.00 0.00 175.76 173.98 1bk0 s PRO 268 N 3.86 4.26 0.02 0.00 0.04 -1.26 -4.88 135.00 137.04 1bk0 s PRO 268 Ca 0.32 2.35 -0.30 0.00 0.04 0.00 0.00 61.00 63.41 1bk0 s PRO 268 Cb -0.12 -3.03 -0.03 0.00 0.04 0.00 0.00 34.50 31.36 1bk0 s PRO 268 CO 0.21 -0.32 0.99 0.42 0.04 0.00 0.00 177.00 178.34 1bk0 s ILE 269 N -1.14 4.79 0.16 0.56 1.01 -1.26 -4.59 121.20 120.74 1bk0 s ILE 269 Ca 0.50 2.03 -0.09 0.00 0.00 0.00 0.00 60.65 63.10 1bk0 s ILE 269 Cb -0.42 -4.30 -0.01 0.00 0.01 0.00 0.00 42.46 37.74 1bk0 s ILE 269 CO 0.57 0.18 0.28 -1.38 0.00 0.00 0.00 174.94 174.58 1bk0 s HIS 270 N 0.90 0.40 0.17 3.97 -3.43 -0.79 -0.90 115.29 115.61 1bk0 s HIS 270 Ca 0.52 -0.77 -0.10 0.00 -0.80 0.00 0.00 55.06 53.91 1bk0 s HIS 270 Cb -0.22 -0.07 -0.00 0.00 -1.43 0.00 0.00 32.58 30.86 1bk0 s HIS 270 CO 0.28 -0.71 0.32 -0.98 -2.00 0.00 0.00 174.74 171.65 1bk0 s ARG 271 N -3.97 1.19 -0.26 -0.38 1.70 -0.39 -1.71 118.95 115.13 1bk0 s ARG 271 Ca 0.17 -1.14 -0.04 0.00 -0.47 0.00 0.00 55.73 54.25 1bk0 s ARG 271 Cb 0.03 0.40 0.01 0.00 -0.57 0.00 0.00 34.95 34.82 1bk0 s ARG 271 CO -0.00 -0.45 -0.01 0.08 -1.08 0.00 0.00 175.30 173.84 1bk0 s VAL 272 N -3.96 3.31 0.58 4.99 1.01 -0.55 -1.51 120.40 124.27 1bk0 s VAL 272 Ca 0.16 -0.83 -0.18 0.00 0.00 0.00 0.00 61.98 61.13 1bk0 s VAL 272 Cb 0.03 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1bk0 s VAL 272 CO -0.00 0.20 1.12 -0.54 0.00 0.00 0.00 175.10 175.88 1bk0 s LYS 273 N 1.41 3.19 0.01 2.72 1.02 0.31 -0.53 119.74 127.87 1bk0 s LYS 273 Ca 0.02 1.54 -0.30 0.00 0.02 0.00 0.00 55.97 57.24 1bk0 s LYS 273 Cb -0.16 -1.99 -0.04 0.00 -0.52 0.00 0.00 37.83 35.11 1bk0 s LYS 273 CO -0.02 -0.96 1.15 -0.46 -0.92 0.00 0.00 175.35 174.14 1bk0 s TRP 274 N -1.95 3.41 -0.02 3.18 -0.00 0.08 -4.14 118.94 119.50 1bk0 s TRP 274 Ca 0.71 1.36 0.00 0.00 -0.00 0.00 0.00 56.10 58.17 1bk0 s TRP 274 Cb -0.23 -3.36 0.03 0.00 -0.00 0.00 0.00 33.47 29.91 1bk0 s TRP 274 CO 0.31 -1.02 0.02 0.08 -0.00 0.00 0.00 176.95 176.34 1bk0 s VAL 275 N 1.39 0.04 -1.12 5.86 1.01 -1.26 -4.86 120.40 121.46 1bk0 s VAL 275 Ca 0.56 0.16 -0.16 0.00 0.00 0.00 0.00 61.98 62.55 1bk0 s VAL 275 Cb -0.26 -0.16 0.15 0.00 0.00 0.00 0.00 36.38 36.11 1bk0 s VAL 275 CO 0.27 0.11 1.36 0.21 0.00 0.00 0.00 175.10 177.04 1bk0 s ASN 276 N 1.04 6.92 -0.15 3.32 2.47 -1.26 -4.90 114.94 122.38 1bk0 s ASN 276 Ca -0.09 -2.66 -0.19 0.00 0.42 0.00 0.00 52.86 50.34 1bk0 s ASN 276 Cb -0.13 -2.41 0.05 0.00 -1.45 0.00 0.00 41.25 37.30 1bk0 s ASN 276 CO -0.02 -0.88 0.50 0.00 -3.72 0.00 0.00 177.10 172.98 1bk0 s ALA 277 N 2.10 -1.25 -0.29 1.71 0.00 -1.26 -4.88 121.76 117.88 1bk0 s ALA 277 Ca 0.40 1.26 -0.29 0.00 0.00 0.00 0.00 51.96 53.34 1bk0 s ALA 277 Cb -0.03 -0.61 -0.00 0.00 0.00 0.00 0.00 23.12 22.48 1bk0 s ALA 277 CO -0.03 -0.26 1.33 -2.00 0.00 0.00 0.00 175.76 174.81 1bk0 s GLU 278 N -0.12 3.90 0.26 0.00 2.56 -1.26 -3.77 118.70 120.27 1bk0 s GLU 278 Ca -0.03 1.28 -0.12 0.00 0.00 0.00 0.00 54.97 56.10 1bk0 s GLU 278 Cb -0.03 -3.90 -0.00 0.00 2.00 0.00 0.00 34.13 32.20 1bk0 s GLU 278 CO 0.02 -1.14 0.49 -0.98 -0.56 0.00 0.00 175.26 173.09 1bk0 s ARG 279 N 4.23 1.60 0.02 4.30 1.70 0.16 -4.91 118.95 126.04 1bk0 s ARG 279 Ca 0.58 -1.28 0.09 0.00 -0.47 0.00 0.00 55.73 54.64 1bk0 s ARG 279 Cb -0.17 0.48 -0.03 0.00 -0.57 0.00 0.00 34.95 34.66 1bk0 s ARG 279 CO 0.24 -0.67 -0.26 -0.65 -1.08 0.00 0.00 175.30 172.88 1bk0 s GLN 280 N -3.91 1.88 -0.21 3.89 -0.21 -1.26 -1.75 119.66 118.08 1bk0 s GLN 280 Ca 0.23 -1.05 -0.03 0.00 0.02 0.00 0.00 55.36 54.53 1bk0 s GLN 280 Cb -0.01 -1.98 0.07 0.00 1.00 0.00 0.00 33.01 32.09 1bk0 s GLN 280 CO 0.10 0.52 0.06 0.45 -2.12 0.00 0.00 175.29 174.30 1bk0 s SER 281 N -1.04 3.04 -0.71 5.90 0.15 -0.82 -1.94 113.70 118.28 1bk0 s SER 281 Ca 0.11 -0.94 0.05 0.00 0.70 0.00 0.00 55.95 55.87 1bk0 s SER 281 Cb -0.10 -0.56 0.20 0.00 -1.71 0.00 0.00 66.02 63.84 1bk0 s SER 281 CO 0.01 -0.34 0.60 0.18 1.20 0.00 0.00 173.24 174.89 1bk0 n LEU 282 N 5.07 3.37 -4.82 3.45 4.77 0.43 -1.35 117.00 127.92 1bk0 n LEU 282 Ca -0.08 -5.27 -0.33 0.00 -0.03 0.00 0.00 56.01 50.30 1bk0 n LEU 282 Cb 0.46 -0.77 -0.05 0.00 -2.33 0.00 0.00 43.42 40.73 1bk0 n LEU 282 CO 0.12 1.82 0.67 -2.16 -1.33 0.00 0.00 177.39 176.51 1bk0 s PRO 283 N -1.75 4.06 -0.24 3.23 0.04 -1.19 -2.50 135.00 136.65 1bk0 s PRO 283 Ca 0.29 1.17 -0.00 0.00 0.04 0.00 0.00 61.00 62.50 1bk0 s PRO 283 Cb 0.01 -2.15 0.03 0.00 0.04 0.00 0.00 34.50 32.43 1bk0 s PRO 283 CO -0.12 -0.18 -0.09 0.12 0.04 0.00 0.00 177.00 176.76 1bk0 s PHE 284 N -2.18 3.07 -0.38 0.56 5.36 -0.37 -1.62 117.98 122.42 1bk0 s PHE 284 Ca 0.63 -1.76 -0.21 0.00 -0.96 0.00 0.00 56.93 54.64 1bk0 s PHE 284 Cb -0.11 -2.01 0.01 0.00 -0.34 0.00 0.00 43.02 40.57 1bk0 s PHE 284 CO 0.17 -0.78 0.64 -0.06 -1.46 0.00 0.00 175.22 173.74 1bk0 s PHE 285 N 1.27 3.12 -0.72 10.12 0.08 -0.34 -1.36 117.98 130.15 1bk0 s PHE 285 Ca -0.01 0.23 -0.27 0.00 0.12 0.00 0.00 56.93 57.00 1bk0 s PHE 285 Cb -0.17 -3.21 0.03 0.00 -0.57 0.00 0.00 43.02 39.10 1bk0 s PHE 285 CO -0.06 -0.70 1.24 0.08 -0.10 0.00 0.00 175.22 175.68 1bk0 s VAL 286 N 2.76 3.80 0.04 -0.44 1.01 -0.18 -2.77 120.40 124.62 1bk0 s VAL 286 Ca 0.24 0.38 0.05 0.00 0.00 0.00 0.00 61.98 62.65 1bk0 s VAL 286 Cb -0.14 -4.88 -0.04 0.00 0.00 0.00 0.00 36.38 31.32 1bk0 s VAL 286 CO 0.16 -1.78 -0.09 0.20 0.00 0.00 0.00 175.10 173.60 1bk0 s ASN 287 N 3.67 4.48 0.17 3.32 0.01 -1.26 -1.19 114.94 124.13 1bk0 s ASN 287 Ca 0.34 -0.24 0.00 0.00 -0.71 0.00 0.00 52.86 52.25 1bk0 s ASN 287 Cb -0.09 -0.97 0.00 0.00 0.41 0.00 0.00 41.25 40.61 1bk0 s ASN 287 CO 0.15 0.25 0.00 0.18 -1.51 0.00 0.00 177.10 176.17 1bk0 n LEU 288 N 1.30 0.00 -4.90 0.60 4.77 -1.26 -3.77 117.00 113.74 1bk0 n LEU 288 Ca -0.15 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.55 1bk0 n LEU 288 Cb 0.52 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.66 1bk0 n LEU 288 CO 0.31 -0.13 0.65 -0.83 -1.33 0.00 0.00 177.39 176.06 1bk0 s GLY 289 N -1.42 1.62 0.28 -0.72 0.00 -1.18 -1.55 107.32 104.34 1bk0 s GLY 289 Ca 0.00 -0.54 -0.02 0.00 0.00 0.00 0.00 44.72 44.16 1bk0 s GLY 289 CO 0.00 -0.20 1.92 -1.82 0.00 0.00 0.00 173.10 173.00 1bk0 h TYR 290 N -0.45 1.13 -0.38 1.90 3.20 -1.94 -2.12 116.97 118.31 1bk0 h TYR 290 Ca -0.45 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.45 1bk0 h TYR 290 Cb 1.26 -0.38 0.00 0.00 1.54 0.00 0.00 36.73 39.15 1bk0 h TYR 290 CO 0.47 0.65 0.00 -0.25 -1.64 0.00 0.00 178.16 177.39 1bk0 n ASP 291 N -4.45 3.08 -4.72 -2.11 8.00 -1.26 -0.88 116.55 114.22 1bk0 n ASP 291 Ca 0.13 -1.94 -0.42 0.00 0.71 0.00 0.00 54.79 53.26 1bk0 n ASP 291 Cb 0.11 -0.24 -0.03 0.00 -0.02 0.00 0.00 41.12 40.94 1bk0 n ASP 291 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1bk0 s SER 292 N -1.44 6.59 -0.07 -2.24 0.01 -0.80 -4.77 113.70 110.98 1bk0 s SER 292 Ca 0.38 2.61 0.00 0.00 1.31 0.00 0.00 55.95 60.25 1bk0 s SER 292 Cb 0.22 -2.59 0.02 0.00 0.21 0.00 0.00 66.02 63.88 1bk0 s SER 292 CO 0.30 -0.83 -0.06 -0.69 0.41 0.00 0.00 173.24 172.37 1bk0 s VAL 293 N 1.29 0.75 -0.15 3.43 1.01 -1.26 -0.37 120.40 125.09 1bk0 s VAL 293 Ca 0.70 -0.19 -0.01 0.00 0.00 0.00 0.00 61.98 62.49 1bk0 s VAL 293 Cb -0.43 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.16 1bk0 s VAL 293 CO 0.31 0.29 -0.12 -0.63 0.00 0.00 0.00 175.10 174.96 1bk0 s ILE 294 N 1.25 3.09 0.00 2.22 1.01 -1.26 -5.08 121.20 122.43 1bk0 s ILE 294 Ca -0.05 -0.64 -0.30 0.00 0.00 0.00 0.00 60.65 59.66 1bk0 s ILE 294 Cb -0.14 -2.32 -0.05 0.00 0.01 0.00 0.00 42.46 39.96 1bk0 s ILE 294 CO -0.02 0.51 1.30 -1.81 0.00 0.00 0.00 174.94 174.91 1bk0 s ASP 295 N 0.59 6.96 0.58 3.58 1.01 -1.26 -4.61 116.67 123.51 1bk0 s ASP 295 Ca -0.07 2.01 -0.21 0.00 0.71 0.00 0.00 52.55 54.99 1bk0 s ASP 295 Cb -0.15 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.17 1bk0 s ASP 295 CO 0.03 -0.62 1.34 -2.65 0.21 0.00 0.00 175.17 173.48 1bk0 n PRO 296 N 4.95 1.54 -4.15 8.23 -0.02 -1.26 -5.01 135.00 139.27 1bk0 n PRO 296 Ca 0.11 0.57 -0.15 0.00 -2.02 0.00 0.00 63.50 62.02 1bk0 n PRO 296 Cb 0.45 -2.57 -0.06 0.00 -0.02 0.00 0.00 33.50 31.30 1bk0 n PRO 296 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1bk0 s PHE 297 N -1.31 1.17 -0.23 6.00 -0.71 0.09 -4.45 117.98 118.54 1bk0 s PHE 297 Ca 0.75 -1.34 -0.04 0.00 -1.04 0.00 0.00 56.93 55.26 1bk0 s PHE 297 Cb -0.41 -0.30 0.09 0.00 -1.21 0.00 0.00 43.02 41.19 1bk0 s PHE 297 CO 0.47 -0.96 0.14 0.34 -1.34 0.00 0.00 175.22 173.87 1bk0 s ASP 298 N -3.23 2.56 0.00 1.98 -1.08 0.03 -3.26 116.67 113.67 1bk0 s ASP 298 Ca 0.34 -0.81 0.13 0.00 -0.52 0.00 0.00 52.55 51.69 1bk0 s ASP 298 Cb 0.02 -0.12 0.78 0.00 -1.46 0.00 0.00 42.92 42.14 1bk0 s ASP 298 CO 0.19 -0.38 1.24 -2.65 0.52 0.00 0.00 175.17 174.09 1bk0 n PRO 299 N 5.28 0.59 -0.00 4.34 -0.02 -1.26 -1.64 135.00 142.29 1bk0 n PRO 299 Ca -0.06 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.52 1bk0 n PRO 299 Cb 0.46 -1.35 -0.13 0.00 -0.02 0.00 0.00 33.50 32.47 1bk0 n PRO 299 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1bk0 n ARG 300 N -0.85 0.24 -3.87 -0.52 1.74 -1.26 -4.95 116.66 107.19 1bk0 n ARG 300 Ca 0.10 -0.05 -0.36 0.00 -0.77 0.00 0.00 57.85 56.78 1bk0 n ARG 300 Cb 0.05 -1.49 -0.08 0.00 -1.02 0.00 0.00 32.46 29.92 1bk0 n ARG 300 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1bk0 s GLU 301 N -3.09 3.82 0.28 5.56 0.41 -0.65 -5.02 118.70 120.02 1bk0 s GLU 301 Ca 0.04 -0.23 0.02 0.00 -0.41 0.00 0.00 54.97 54.40 1bk0 s GLU 301 Cb 0.15 -3.26 0.66 0.00 -1.78 0.00 0.00 34.13 29.90 1bk0 s GLU 301 CO 0.86 0.48 1.74 -1.35 -0.49 0.00 0.00 175.26 176.51 1bk0 h PRO 302 N 6.01 0.55 -0.04 0.39 0.11 -1.92 0.99 132.00 138.09 1bk0 h PRO 302 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1bk0 h PRO 302 Cb 1.18 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1bk0 h PRO 302 CO 0.68 0.36 0.00 0.27 -0.21 0.00 0.00 178.00 179.10 1bk0 n ASN 303 N -4.92 1.43 0.00 -2.05 0.23 -1.26 -4.93 115.26 103.77 1bk0 n ASN 303 Ca 0.20 -1.51 0.00 0.00 -0.53 0.00 0.00 54.58 52.75 1bk0 n ASN 303 Cb 0.55 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 38.24 1bk0 n ASN 303 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1bk0 n GLY 304 N 1.15 0.36 3.86 4.83 0.00 0.34 -4.99 105.19 110.74 1bk0 n GLY 304 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1bk0 n GLY 304 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bk0 s LYS 305 N -0.79 3.92 0.14 1.61 1.02 -1.26 -0.79 119.74 123.59 1bk0 s LYS 305 Ca 0.00 0.61 0.06 0.00 0.02 0.00 0.00 55.97 56.65 1bk0 s LYS 305 Cb 0.00 -2.41 -0.04 0.00 -0.52 0.00 0.00 37.83 34.86 1bk0 s LYS 305 CO 0.00 0.08 -0.13 -1.54 -0.92 0.00 0.00 175.35 172.84 1bk0 s SER 306 N -2.61 2.00 -0.25 2.83 1.04 -1.26 -4.29 113.70 111.16 1bk0 s SER 306 Ca 0.53 -0.89 0.05 0.00 0.48 0.00 0.00 55.95 56.13 1bk0 s SER 306 Cb -0.10 -0.06 0.50 0.00 0.10 0.00 0.00 66.02 66.46 1bk0 s SER 306 CO 0.23 -0.20 1.53 0.47 0.98 0.00 0.00 173.24 176.25 1bk0 n ASP 307 N 0.23 3.82 -4.85 7.02 8.00 -1.26 -4.89 116.55 124.63 1bk0 n ASP 307 Ca -0.13 -2.93 -0.30 0.00 0.71 0.00 0.00 54.79 52.13 1bk0 n ASP 307 Cb 0.58 -0.69 -0.05 0.00 -0.02 0.00 0.00 41.12 40.94 1bk0 n ASP 307 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1bk0 s ARG 308 N -2.25 3.17 0.03 -1.24 0.52 -1.26 -5.11 118.95 112.79 1bk0 s ARG 308 Ca 0.39 -0.58 -0.08 0.00 -0.52 0.00 0.00 55.73 54.94 1bk0 s ARG 308 Cb 0.31 -2.88 -0.05 0.00 0.52 0.00 0.00 34.95 32.86 1bk0 s ARG 308 CO 0.09 0.58 0.31 -1.21 0.02 0.00 0.00 175.30 175.09 1bk0 s GLU 309 N -2.52 3.64 0.40 3.54 0.41 -1.26 -4.76 118.70 118.14 1bk0 s GLU 309 Ca 0.32 0.01 -0.26 0.00 -0.41 0.00 0.00 54.97 54.63 1bk0 s GLU 309 Cb -0.12 -3.06 -0.11 0.00 -1.78 0.00 0.00 34.13 29.06 1bk0 s GLU 309 CO 0.25 0.63 1.32 -2.30 -0.49 0.00 0.00 175.26 174.67 1bk0 n PRO 310 N 1.09 2.11 -4.09 0.39 -0.02 -1.26 -4.87 135.00 128.36 1bk0 n PRO 310 Ca -0.10 0.75 -0.24 0.00 -2.02 0.00 0.00 63.50 61.88 1bk0 n PRO 310 Cb 0.53 -2.43 -0.17 0.00 -0.02 0.00 0.00 33.50 31.41 1bk0 n PRO 310 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1bk0 s LEU 311 N -1.64 1.22 0.44 2.45 2.96 -1.26 -5.10 118.68 117.75 1bk0 s LEU 311 Ca 0.58 -0.23 -0.24 0.00 -0.22 0.00 0.00 54.13 54.02 1bk0 s LEU 311 Cb -0.51 -0.70 -0.08 0.00 0.50 0.00 0.00 46.19 45.40 1bk0 s LEU 311 CO 0.60 -0.08 1.15 -0.94 -1.32 0.00 0.00 176.35 175.76 1bk0 s SER 312 N 1.36 6.32 0.25 3.68 1.04 -1.26 -4.53 113.70 120.56 1bk0 s SER 312 Ca -0.03 2.28 -0.04 0.00 0.48 0.00 0.00 55.95 58.65 1bk0 s SER 312 Cb -0.14 -2.60 0.31 0.00 0.10 0.00 0.00 66.02 63.69 1bk0 s SER 312 CO -0.03 -0.81 1.81 0.22 0.98 0.00 0.00 173.24 175.41 1bk0 h TYR 313 N 2.23 1.01 -0.62 5.02 5.03 -0.82 -1.79 116.97 127.02 1bk0 h TYR 313 Ca -0.49 -0.08 -0.03 0.00 2.58 0.00 0.00 58.73 60.71 1bk0 h TYR 313 Cb 1.24 -0.30 -0.03 0.00 1.55 0.00 0.00 36.73 39.19 1bk0 h TYR 313 CO 0.54 0.80 0.27 0.78 -1.32 0.00 0.00 178.16 179.23 1bk0 h GLY 314 N 1.05 0.98 0.89 1.82 0.00 -1.15 0.63 103.07 107.29 1bk0 h GLY 314 Ca 0.22 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 1bk0 h GLY 314 CO -0.01 0.48 0.07 -0.55 0.00 0.00 0.00 176.54 176.53 1bk0 h ASP 315 N 0.86 0.22 -0.27 0.19 5.19 -1.72 -1.68 116.42 119.21 1bk0 h ASP 315 Ca 0.21 -0.15 0.06 0.00 -0.62 0.00 0.00 57.03 56.54 1bk0 h ASP 315 Cb 0.16 -0.06 -0.06 0.00 0.18 0.00 0.00 39.33 39.56 1bk0 h ASP 315 CO -0.02 0.31 -0.13 0.22 -3.12 0.00 0.00 179.24 176.49 1bk0 h TYR 316 N 0.12 -0.32 0.03 4.55 3.20 -0.98 -2.63 116.97 120.95 1bk0 h TYR 316 Ca 0.06 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 1bk0 h TYR 316 Cb 0.15 0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.60 1bk0 h TYR 316 CO -0.02 -0.20 -0.02 1.25 -1.64 0.00 0.00 178.16 177.54 1bk0 h LEU 317 N -0.09 -0.04 -0.50 2.82 5.85 -0.75 0.44 115.31 123.03 1bk0 h LEU 317 Ca 0.14 -0.29 0.04 0.00 0.84 0.00 0.00 57.88 58.61 1bk0 h LEU 317 Cb 0.31 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 1bk0 h LEU 317 CO -0.33 0.27 0.27 -0.61 -0.34 0.00 0.00 178.44 177.69 1bk0 h GLN 318 N -0.35 0.51 -0.12 1.25 4.15 -1.30 -0.92 115.11 118.34 1bk0 h GLN 318 Ca -0.00 -0.03 -0.19 0.00 0.77 0.00 0.00 58.65 59.19 1bk0 h GLN 318 Cb 0.33 -0.12 -0.00 0.00 0.21 0.00 0.00 27.48 27.90 1bk0 h GLN 318 CO 0.01 0.34 -0.71 -0.91 -1.93 0.00 0.00 178.83 175.63 1bk0 h ASN 319 N 0.53 0.62 -0.66 -0.69 2.35 -1.49 -2.98 115.58 113.27 1bk0 h ASN 319 Ca 0.21 -0.40 -0.05 0.00 -0.55 0.00 0.00 56.30 55.51 1bk0 h ASN 319 Cb 0.09 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.24 1bk0 h ASN 319 CO -0.13 1.15 0.20 1.23 -1.65 0.00 0.00 177.43 178.23 1bk0 h GLY 320 N 1.06 1.10 1.36 2.83 0.00 -0.46 -1.10 103.07 107.87 1bk0 h GLY 320 Ca -0.03 -0.66 -0.12 0.00 0.00 0.00 0.00 47.33 46.52 1bk0 h GLY 320 CO 0.13 0.62 -0.30 1.41 0.00 0.00 0.00 176.54 178.40 1bk0 h LEU 321 N 0.96 0.74 -0.40 3.11 3.38 -1.20 -0.89 115.31 121.02 1bk0 h LEU 321 Ca 0.21 -0.29 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 1bk0 h LEU 321 Cb 0.31 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1bk0 h LEU 321 CO -0.01 0.99 -0.03 0.58 0.09 0.00 0.00 178.44 180.07 1bk0 h VAL 322 N 0.61 1.27 -0.70 1.22 2.07 -1.37 -2.46 116.25 116.90 1bk0 h VAL 322 Ca 0.07 -1.07 -0.04 0.00 0.82 0.00 0.00 66.70 66.49 1bk0 h VAL 322 Cb 0.81 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.71 1bk0 h VAL 322 CO 0.07 0.36 0.28 0.28 0.02 0.00 0.00 177.57 178.58 1bk0 h SER 323 N 0.54 0.95 -0.42 0.57 0.02 -0.97 -0.95 113.55 113.28 1bk0 h SER 323 Ca 0.11 -0.14 -0.10 0.00 -0.84 0.00 0.00 61.79 60.83 1bk0 h SER 323 Cb 0.52 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 1bk0 h SER 323 CO 0.03 0.84 -0.08 0.25 -1.14 0.00 0.00 176.83 176.73 1bk0 h LEU 324 N 1.01 0.86 -0.43 5.07 5.85 -1.05 -0.49 115.31 126.13 1bk0 h LEU 324 Ca 0.24 -0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 1bk0 h LEU 324 Cb 0.19 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 1bk0 h LEU 324 CO -0.02 0.97 0.09 0.40 -0.34 0.00 0.00 178.44 179.53 1bk0 h ILE 325 N 0.79 1.24 -0.68 4.05 2.04 -1.11 -0.17 117.51 123.67 1bk0 h ILE 325 Ca 0.14 -0.84 -0.05 0.00 1.00 0.00 0.00 64.86 65.11 1bk0 h ILE 325 Cb 0.59 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 1bk0 h ILE 325 CO 0.04 0.29 0.24 0.78 0.00 0.00 0.00 178.15 179.50 1bk0 h ASN 326 N 0.56 0.95 0.06 1.72 2.35 -0.86 0.60 115.58 120.95 1bk0 h ASN 326 Ca 0.13 -0.15 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1bk0 h ASN 326 Cb 0.34 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1bk0 h ASN 326 CO 0.00 0.87 -0.03 0.50 -1.65 0.00 0.00 177.43 177.13 1bk0 h LYS 327 N 1.00 -0.07 -0.08 0.81 3.64 -0.96 -3.39 116.57 117.51 1bk0 h LYS 327 Ca 0.23 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 1bk0 h LYS 327 Cb 0.24 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1bk0 h LYS 327 CO -0.01 0.52 0.00 0.09 -2.27 0.00 0.00 179.45 177.78 1bk0 n ASN 328 N -4.81 2.10 0.00 4.20 4.13 -0.09 -5.08 115.26 115.71 1bk0 n ASN 328 Ca -0.08 -1.56 0.00 0.00 1.68 0.00 0.00 54.58 54.62 1bk0 n ASN 328 Cb 0.31 -0.05 0.00 0.00 -1.54 0.00 0.00 39.78 38.50 1bk0 n ASN 328 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1bk0 n GLY 329 N 0.58 1.29 3.67 7.41 0.00 0.20 -4.83 105.19 113.51 1bk0 n GLY 329 Ca 0.07 -1.76 -0.42 0.00 0.00 0.00 0.00 46.02 43.91 1bk0 n GLY 329 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1bk0 s GLN 330 N -3.33 4.24 0.00 1.61 2.00 -1.26 -4.55 119.66 118.38 1bk0 s GLN 330 Ca 0.00 1.97 0.31 0.00 -2.00 0.00 0.00 55.36 55.64 1bk0 s GLN 330 Cb 0.00 -3.73 1.70 0.00 0.80 0.00 0.00 33.01 31.77 1bk0 s GLN 330 CO 0.00 -0.68 2.11 0.25 -0.50 0.00 0.00 175.29 176.47