#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b6t s ARG 4 N 0.00 3.63 0.14 1.64 0.52 -1.26 -2.21 118.95 121.40 1b6t s ARG 4 Ca 0.00 -0.52 0.08 0.00 -0.52 0.00 0.00 55.73 54.76 1b6t s ARG 4 Cb 0.00 -3.01 -0.04 0.00 0.52 0.00 0.00 34.95 32.42 1b6t s ARG 4 CO 0.00 0.10 -0.08 0.00 0.02 0.00 0.00 175.30 175.34 1b6t s ALA 5 N 0.75 3.01 -0.05 2.13 0.00 0.15 -1.31 121.76 126.44 1b6t s ALA 5 Ca -0.01 -1.32 0.06 0.00 0.00 0.00 0.00 51.96 50.69 1b6t s ALA 5 Cb -0.14 -0.88 -0.01 0.00 0.00 0.00 0.00 23.12 22.09 1b6t s ALA 5 CO 0.02 0.57 -0.22 -1.50 0.00 0.00 0.00 175.76 174.63 1b6t s ILE 6 N -1.44 1.82 -0.51 0.00 2.07 0.41 -0.48 121.20 123.07 1b6t s ILE 6 Ca 0.24 -0.94 0.04 0.00 -1.41 0.00 0.00 60.65 58.57 1b6t s ILE 6 Cb -0.10 -1.54 0.13 0.00 0.13 0.00 0.00 42.46 41.08 1b6t s ILE 6 CO 0.15 0.51 0.27 -0.47 -1.91 0.00 0.00 174.94 173.49 1b6t s TYR 7 N -0.12 2.85 0.44 3.50 5.04 0.47 -0.23 117.35 129.29 1b6t s TYR 7 Ca -0.03 -2.97 -0.11 0.00 -2.44 0.00 0.00 57.07 51.53 1b6t s TYR 7 Cb -0.13 -2.54 -0.06 0.00 0.35 0.00 0.00 41.96 39.59 1b6t s TYR 7 CO 0.03 -0.74 0.81 -1.25 -1.34 0.00 0.00 175.55 173.06 1b6t s PRO 8 N -0.17 3.76 0.00 4.97 0.04 -1.26 -1.59 135.00 140.75 1b6t s PRO 8 Ca 0.18 0.50 0.00 0.00 0.04 0.00 0.00 61.00 61.72 1b6t s PRO 8 Cb -0.24 -2.34 0.00 0.00 0.04 0.00 0.00 34.50 31.95 1b6t s PRO 8 CO -0.01 -0.11 0.00 0.41 0.04 0.00 0.00 177.00 177.33 1b6t n GLY 9 N -1.53 -0.66 0.09 0.56 0.00 -0.56 -4.93 105.19 98.16 1b6t n GLY 9 Ca 0.03 -1.05 -0.06 0.00 0.00 0.00 0.00 46.02 44.94 1b6t n GLY 9 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1b6t n THR 10 N -0.27 1.44 -4.02 2.61 -1.04 -1.26 -1.02 114.28 110.71 1b6t n THR 10 Ca 0.00 -0.76 -0.42 0.00 -2.04 0.00 0.00 64.05 60.82 1b6t n THR 10 Cb 0.00 -0.89 0.02 0.00 -1.82 0.00 0.00 70.33 67.64 1b6t n THR 10 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1b6t n PHE 11 N -2.96 -1.52 -3.68 -1.42 3.01 -1.26 -4.71 117.46 104.91 1b6t n PHE 11 Ca -0.16 0.23 -0.29 0.00 1.01 0.00 0.00 57.45 58.25 1b6t n PHE 11 Cb 0.99 -2.76 -0.10 0.00 -0.01 0.00 0.00 39.48 37.60 1b6t n PHE 11 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1b6t n ASP 12 N -2.25 3.49 -5.00 4.37 2.03 -1.26 -3.06 116.55 114.87 1b6t n ASP 12 Ca -0.16 -3.30 -0.19 0.00 0.52 0.00 0.00 54.79 51.66 1b6t n ASP 12 Cb 0.59 -0.76 0.04 0.00 -0.72 0.00 0.00 41.12 40.27 1b6t n ASP 12 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1b6t s PRO 13 N -1.88 2.49 0.31 -0.67 0.04 -1.26 -4.70 135.00 129.32 1b6t s PRO 13 Ca 0.31 -1.41 -0.29 0.00 0.04 0.00 0.00 61.00 59.65 1b6t s PRO 13 Cb 0.03 -2.67 -0.10 0.00 0.04 0.00 0.00 34.50 31.80 1b6t s PRO 13 CO -0.10 -0.66 1.31 -1.50 0.04 0.00 0.00 177.00 176.09 1b6t s ILE 14 N -2.58 2.80 0.45 0.56 2.07 -1.17 -4.72 121.20 118.62 1b6t s ILE 14 Ca 0.59 0.78 0.05 0.00 -1.41 0.00 0.00 60.65 60.65 1b6t s ILE 14 Cb -0.08 -3.49 -0.05 0.00 0.13 0.00 0.00 42.46 38.97 1b6t s ILE 14 CO 0.37 0.17 0.01 0.42 -1.91 0.00 0.00 174.94 174.00 1b6t s THR 15 N -0.90 1.66 0.50 4.00 -4.23 -1.26 -4.67 115.64 110.74 1b6t s THR 15 Ca 0.50 -2.00 0.33 0.00 -1.18 0.00 0.00 61.69 59.35 1b6t s THR 15 Cb -0.39 -2.66 0.36 0.00 1.34 0.00 0.00 72.50 71.15 1b6t s THR 15 CO 0.50 0.00 2.19 0.78 -0.54 0.00 0.00 174.62 177.55 1b6t h ASN 16 N 1.59 0.00 -0.31 3.99 -0.26 -1.39 -1.13 115.58 118.07 1b6t h ASN 16 Ca -0.44 0.00 -0.10 0.00 -0.56 0.00 0.00 56.30 55.20 1b6t h ASN 16 Cb 1.27 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.52 1b6t h ASN 16 CO 0.78 0.05 -0.19 1.23 -1.06 0.00 0.00 177.43 178.24 1b6t h GLY 17 N 0.49 0.74 1.03 2.83 0.00 -1.88 -0.38 103.07 105.90 1b6t h GLY 17 Ca -0.00 -0.69 -0.06 0.00 0.00 0.00 0.00 47.33 46.58 1b6t h GLY 17 CO 0.01 0.63 0.20 0.45 0.00 0.00 0.00 176.54 177.82 1b6t h HIS 18 N 0.44 1.08 -0.84 5.60 3.86 -1.64 -2.17 115.15 121.47 1b6t h HIS 18 Ca 0.06 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 59.14 1b6t h HIS 18 Cb 0.73 -0.31 -0.04 0.00 1.06 0.00 0.00 27.41 28.85 1b6t h HIS 18 CO 0.06 0.87 0.42 0.82 0.86 0.00 0.00 177.93 180.97 1b6t h ILE 19 N 0.97 1.25 -0.12 2.45 1.08 -1.15 -0.78 117.51 121.22 1b6t h ILE 19 Ca 0.21 -0.69 0.00 0.00 -0.39 0.00 0.00 64.86 63.99 1b6t h ILE 19 Cb 0.31 0.16 -0.01 0.00 -3.07 0.00 0.00 36.82 34.21 1b6t h ILE 19 CO -0.01 0.30 0.08 -0.78 -0.69 0.00 0.00 178.15 177.05 1b6t h ASP 20 N 1.19 0.14 -0.11 1.72 1.82 -0.70 -1.23 116.42 119.26 1b6t h ASP 20 Ca 0.29 -0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 56.91 1b6t h ASP 20 Cb 0.09 -0.04 -0.00 0.00 0.68 0.00 0.00 39.33 40.06 1b6t h ASP 20 CO -0.04 0.11 0.03 0.40 -1.61 0.00 0.00 179.24 178.13 1b6t h ILE 21 N 0.16 1.19 -0.28 2.25 1.08 -1.01 -2.03 117.51 118.86 1b6t h ILE 21 Ca 0.04 -0.58 -0.03 0.00 -0.39 0.00 0.00 64.86 63.90 1b6t h ILE 21 Cb -0.01 1.37 -0.02 0.00 -3.07 0.00 0.00 36.82 35.09 1b6t h ILE 21 CO -0.01 0.17 0.02 1.62 -0.69 0.00 0.00 178.15 179.26 1b6t h VAL 22 N -0.02 1.16 -0.35 1.67 3.04 -1.12 -1.06 116.25 119.58 1b6t h VAL 22 Ca 0.04 -0.61 -0.05 0.00 -1.01 0.00 0.00 66.70 65.07 1b6t h VAL 22 Cb 0.24 0.93 -0.01 0.00 -2.01 0.00 0.00 31.29 30.44 1b6t h VAL 22 CO -0.00 0.21 0.04 0.74 -1.01 0.00 0.00 177.57 177.55 1b6t h THR 23 N 0.40 1.24 -0.39 3.17 2.02 -1.02 -1.85 112.91 116.49 1b6t h THR 23 Ca 0.09 -0.88 -0.03 0.00 0.77 0.00 0.00 66.41 66.36 1b6t h THR 23 Cb 0.24 1.14 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 1b6t h THR 23 CO 0.00 0.29 0.10 0.03 0.37 0.00 0.00 175.52 176.32 1b6t h ARG 24 N 0.42 0.57 -0.76 6.66 3.08 -0.80 -2.43 114.38 121.11 1b6t h ARG 24 Ca 0.10 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 1b6t h ARG 24 Cb 0.39 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 1b6t h ARG 24 CO 0.01 0.51 0.34 0.00 -1.07 0.00 0.00 179.97 179.76 1b6t h ALA 25 N 1.56 0.99 0.00 0.04 0.00 -0.68 -2.41 119.26 118.75 1b6t h ALA 25 Ca 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1b6t h ALA 25 Cb 0.20 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1b6t h ALA 25 CO -0.01 0.58 -0.05 1.79 0.00 0.00 0.00 179.25 181.57 1b6t h THR 26 N 1.09 0.16 0.00 0.00 1.35 -0.86 -1.86 112.91 112.79 1b6t h THR 26 Ca 0.26 -0.47 -0.13 0.00 -0.55 0.00 0.00 66.41 65.52 1b6t h THR 26 Cb 0.17 1.40 -0.02 0.00 -1.73 0.00 0.00 68.15 67.97 1b6t h THR 26 CO -0.03 0.05 -0.60 1.56 -0.25 0.00 0.00 175.52 176.25 1b6t h GLN 27 N 0.00 0.00 0.00 4.72 4.20 -1.27 -3.33 115.11 119.43 1b6t h GLN 27 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1b6t h GLN 27 Cb 0.39 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.17 1b6t h GLN 27 CO 0.01 0.60 -0.49 0.00 -0.67 0.00 0.00 178.83 178.28 1b6t n MET 28 N -3.81 3.71 -4.64 1.46 0.00 -1.04 -5.01 117.12 107.79 1b6t n MET 28 Ca -0.01 -0.00 -0.24 0.00 0.00 0.00 0.00 57.70 57.44 1b6t n MET 28 Cb 0.60 -0.96 -0.14 0.00 0.00 0.00 0.00 33.22 32.72 1b6t n MET 28 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 1b6t s PHE 29 N -1.93 1.66 0.12 3.17 0.40 -0.73 -5.06 117.98 115.61 1b6t s PHE 29 Ca 0.03 -0.35 -0.23 0.00 -0.60 0.00 0.00 56.93 55.78 1b6t s PHE 29 Cb 0.07 -1.01 -0.07 0.00 0.51 0.00 0.00 43.02 42.53 1b6t s PHE 29 CO 0.40 0.05 1.68 -0.44 0.70 0.00 0.00 175.22 177.61 1b6t h ASP 30 N 5.07 -0.37 -3.89 1.36 3.32 -1.82 -3.42 116.42 116.67 1b6t h ASP 30 Ca -0.40 0.06 -0.41 0.00 0.02 0.00 0.00 57.03 56.30 1b6t h ASP 30 Cb 1.16 0.17 -0.30 0.00 0.22 0.00 0.00 39.33 40.58 1b6t h ASP 30 CO 0.45 -0.18 -0.78 -2.28 -1.72 0.00 0.00 179.24 174.73 1b6t s HIS 31 N -6.15 0.86 -0.11 4.55 2.46 -0.94 -4.85 115.29 111.11 1b6t s HIS 31 Ca -0.14 -0.19 0.02 0.00 0.47 0.00 0.00 55.06 55.21 1b6t s HIS 31 Cb 0.09 -0.60 0.01 0.00 -0.13 0.00 0.00 32.58 31.96 1b6t s HIS 31 CO 0.67 -0.07 -0.15 0.08 -2.47 0.00 0.00 174.74 172.80 1b6t s VAL 32 N 0.05 1.51 -0.35 0.89 1.01 -0.22 -0.67 120.40 122.62 1b6t s VAL 32 Ca -0.01 -0.65 -0.12 0.00 0.00 0.00 0.00 61.98 61.20 1b6t s VAL 32 Cb -0.07 -1.37 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 1b6t s VAL 32 CO 0.00 0.44 0.23 -0.63 0.00 0.00 0.00 175.10 175.14 1b6t s ILE 33 N 0.95 5.11 -0.49 2.22 1.01 0.37 -0.64 121.20 129.73 1b6t s ILE 33 Ca -0.07 -0.36 -0.23 0.00 0.00 0.00 0.00 60.65 59.99 1b6t s ILE 33 Cb -0.15 -3.67 0.03 0.00 0.01 0.00 0.00 42.46 38.69 1b6t s ILE 33 CO -0.01 -0.05 0.84 -0.22 0.00 0.00 0.00 174.94 175.49 1b6t s LEU 34 N 1.69 4.25 -0.30 2.97 0.20 0.54 -0.40 118.68 127.63 1b6t s LEU 34 Ca 0.05 -0.25 -0.10 0.00 0.69 0.00 0.00 54.13 54.52 1b6t s LEU 34 Cb -0.18 -2.89 -0.02 0.00 -0.43 0.00 0.00 46.19 42.68 1b6t s LEU 34 CO 0.09 -1.03 0.15 0.00 -0.29 0.00 0.00 176.35 175.27 1b6t s ALA 35 N 3.50 3.32 -0.34 5.97 0.00 -0.62 -1.14 121.76 132.45 1b6t s ALA 35 Ca 0.29 -1.29 -0.14 0.00 0.00 0.00 0.00 51.96 50.83 1b6t s ALA 35 Cb -0.13 -2.37 -0.01 0.00 0.00 0.00 0.00 23.12 20.61 1b6t s ALA 35 CO 0.21 -0.77 0.29 0.42 0.00 0.00 0.00 175.76 175.91 1b6t s ILE 36 N 1.65 5.24 0.30 0.00 1.01 0.13 -1.50 121.20 128.03 1b6t s ILE 36 Ca 0.05 -0.13 -0.27 0.00 0.00 0.00 0.00 60.65 60.30 1b6t s ILE 36 Cb -0.17 -3.76 -0.09 0.00 0.01 0.00 0.00 42.46 38.45 1b6t s ILE 36 CO 0.07 -0.05 0.97 0.00 0.00 0.00 0.00 174.94 175.93 1b6t s ALA 37 N 1.83 3.26 0.20 9.38 0.00 -0.19 -0.90 121.76 135.34 1b6t s ALA 37 Ca 0.08 0.61 -0.10 0.00 0.00 0.00 0.00 51.96 52.55 1b6t s ALA 37 Cb -0.17 -3.22 0.19 0.00 0.00 0.00 0.00 23.12 19.92 1b6t s ALA 37 CO 0.11 0.10 1.84 0.00 0.00 0.00 0.00 175.76 177.81 1b6t h ALA 38 N 3.46 0.89 -6.46 0.00 0.00 -1.61 -3.43 119.26 112.11 1b6t h ALA 38 Ca -0.46 -0.02 -0.49 0.00 0.00 0.00 0.00 54.91 53.94 1b6t h ALA 38 Cb 1.20 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1b6t h ALA 38 CO 0.66 0.18 -0.90 0.43 0.00 0.00 0.00 179.25 179.62 1b6t n SER 39 N -4.69 -1.31 0.10 0.00 7.64 -1.26 -4.82 113.62 109.29 1b6t n SER 39 Ca 0.07 -1.02 0.11 0.00 1.01 0.00 0.00 58.87 59.05 1b6t n SER 39 Cb 0.09 -3.07 0.60 0.00 -1.01 0.00 0.00 64.21 60.83 1b6t n SER 39 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1b6t h PRO 40 N -1.88 0.13 0.00 1.43 0.13 -2.00 -1.27 132.00 128.55 1b6t h PRO 40 Ca -0.64 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.48 1b6t h PRO 40 Cb 1.37 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.47 1b6t h PRO 40 CO 0.59 0.09 -0.03 0.66 -0.23 0.00 0.00 178.00 179.09 1b6t h SER 41 N 0.14 0.00 -0.13 1.44 4.64 -2.03 -1.10 113.55 116.52 1b6t h SER 41 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1b6t h SER 41 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1b6t h SER 41 CO -0.02 0.03 0.00 0.29 -0.87 0.00 0.00 176.83 176.26 1b6t n LYS 42 N -3.36 2.06 -3.91 4.77 5.02 -0.48 -4.99 118.16 117.27 1b6t n LYS 42 Ca -0.02 -1.56 -0.35 0.00 -2.02 0.00 0.00 58.31 54.36 1b6t n LYS 42 Cb 0.14 -1.46 0.01 0.00 -0.02 0.00 0.00 35.03 33.70 1b6t n LYS 42 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1b6t n LYS 43 N 0.84 -0.93 -1.67 1.97 5.02 -0.42 -4.84 118.16 118.13 1b6t n LYS 43 Ca 0.17 0.44 -0.39 0.00 -2.02 0.00 0.00 58.31 56.51 1b6t n LYS 43 Cb 0.48 -2.49 0.04 0.00 -0.02 0.00 0.00 35.03 33.03 1b6t n LYS 43 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1b6t n PRO 44 N -3.79 1.42 -0.17 1.97 -0.02 -1.26 -4.94 135.00 128.21 1b6t n PRO 44 Ca -0.21 0.52 -0.11 0.00 -2.02 0.00 0.00 63.50 61.68 1b6t n PRO 44 Cb 0.63 -2.33 0.01 0.00 -0.02 0.00 0.00 33.50 31.79 1b6t n PRO 44 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1b6t h MET 45 N 1.26 1.01 -6.21 -0.52 1.85 -1.88 -3.43 114.93 107.01 1b6t h MET 45 Ca -0.49 -0.40 -0.65 0.00 -0.61 0.00 0.00 59.70 57.55 1b6t h MET 45 Cb 1.33 -0.05 -0.11 0.00 0.43 0.00 0.00 31.60 33.19 1b6t h MET 45 CO 0.55 1.08 -0.63 -0.06 -0.40 0.00 0.00 176.91 177.46 1b6t s PHE 46 N -4.78 3.11 0.85 1.39 0.40 -1.26 -5.11 117.98 112.59 1b6t s PHE 46 Ca -0.12 0.06 -0.11 0.00 -0.60 0.00 0.00 56.93 56.16 1b6t s PHE 46 Cb 0.12 -1.62 0.10 0.00 0.51 0.00 0.00 43.02 42.14 1b6t s PHE 46 CO 0.87 0.50 1.09 0.95 0.70 0.00 0.00 175.22 179.32 1b6t s THR 47 N -1.27 2.88 0.23 0.64 -4.23 -1.26 -4.75 115.64 107.87 1b6t s THR 47 Ca 0.25 0.29 -0.07 0.00 -1.18 0.00 0.00 61.69 60.97 1b6t s THR 47 Cb -0.12 -2.80 0.19 0.00 1.34 0.00 0.00 72.50 71.11 1b6t s THR 47 CO 0.17 -0.37 1.86 0.25 -0.54 0.00 0.00 174.62 175.98 1b6t h LEU 48 N -1.39 0.81 -0.94 4.79 5.85 -1.94 -0.14 115.31 122.36 1b6t h LEU 48 Ca -0.48 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 1b6t h LEU 48 Cb 1.27 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 1b6t h LEU 48 CO 0.54 0.54 0.52 -0.33 -0.34 0.00 0.00 178.44 179.37 1b6t h GLU 49 N 0.95 1.26 -0.35 1.25 3.07 -1.99 -0.07 114.58 118.70 1b6t h GLU 49 Ca 0.34 -0.14 -0.09 0.00 -0.50 0.00 0.00 59.36 58.97 1b6t h GLU 49 Cb 0.08 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 27.73 1b6t h GLU 49 CO -0.14 0.91 -0.14 0.93 -1.40 0.00 0.00 179.01 179.16 1b6t h GLU 50 N 1.27 0.72 -0.65 2.33 5.08 -1.66 -1.81 114.58 119.86 1b6t h GLU 50 Ca 0.32 -0.30 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 1b6t h GLU 50 Cb -0.00 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 1b6t h GLU 50 CO -0.05 0.91 0.13 0.00 -1.00 0.00 0.00 179.01 179.00 1b6t h ARG 51 N 0.51 1.05 -0.25 2.33 3.08 -0.67 -0.95 114.38 119.47 1b6t h ARG 51 Ca 0.08 -0.25 -0.03 0.00 0.07 0.00 0.00 59.98 59.84 1b6t h ARG 51 Cb 0.67 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.58 1b6t h ARG 51 CO 0.05 0.94 0.02 0.28 -1.07 0.00 0.00 179.97 180.19 1b6t h VAL 52 N 0.99 1.24 -0.27 2.04 2.07 -0.95 -0.74 116.25 120.64 1b6t h VAL 52 Ca 0.20 -0.84 0.02 0.00 0.82 0.00 0.00 66.70 66.90 1b6t h VAL 52 Cb 0.39 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 1b6t h VAL 52 CO 0.01 0.27 0.12 0.00 0.02 0.00 0.00 177.57 177.98 1b6t h ALA 53 N 0.83 0.32 -0.45 1.67 0.00 -1.15 0.88 119.26 121.36 1b6t h ALA 53 Ca 0.07 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1b6t h ALA 53 Cb 0.37 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1b6t h ALA 53 CO 0.01 -0.28 0.28 -0.07 0.00 0.00 0.00 179.25 179.18 1b6t h LEU 54 N 0.25 0.46 -0.80 0.00 3.38 -1.08 -2.14 115.31 115.39 1b6t h LEU 54 Ca 0.11 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 1b6t h LEU 54 Cb 0.05 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1b6t h LEU 54 CO -0.09 0.33 -0.05 0.00 0.09 0.00 0.00 178.44 178.72 1b6t h ALA 55 N 1.19 0.99 -0.24 1.53 0.00 -0.81 -1.66 119.26 120.26 1b6t h ALA 55 Ca 0.17 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1b6t h ALA 55 Cb -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1b6t h ALA 55 CO -0.07 0.61 0.15 1.96 0.00 0.00 0.00 179.25 181.90 1b6t h GLN 56 N 0.78 0.33 -0.21 0.00 4.20 -0.46 -1.84 115.11 117.91 1b6t h GLN 56 Ca 0.14 -0.03 -0.13 0.00 0.06 0.00 0.00 58.65 58.69 1b6t h GLN 56 Cb 0.54 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1b6t h GLN 56 CO 0.03 0.26 -0.42 0.37 -0.67 0.00 0.00 178.83 178.40 1b6t h GLN 57 N 0.31 0.50 0.00 1.46 5.75 -1.30 -1.28 115.11 120.55 1b6t h GLN 57 Ca 0.09 -0.26 0.00 0.00 -0.15 0.00 0.00 58.65 58.33 1b6t h GLN 57 Cb 0.01 0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.57 1b6t h GLN 57 CO -0.02 0.83 0.00 0.00 -2.65 0.00 0.00 178.83 176.99 1b6t h ALA 58 N 1.14 1.00 0.00 3.38 0.00 -1.08 -3.11 119.26 120.59 1b6t h ALA 58 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1b6t h ALA 58 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1b6t h ALA 58 CO 0.08 0.00 -0.00 0.25 0.00 0.00 0.00 179.25 179.57 1b6t n THR 59 N -2.58 1.14 -0.03 0.00 -2.24 -0.71 -4.75 114.28 105.12 1b6t n THR 59 Ca 0.02 -1.22 0.13 0.00 -2.27 0.00 0.00 64.05 60.71 1b6t n THR 59 Cb 0.29 0.36 0.55 0.00 -2.10 0.00 0.00 70.33 69.44 1b6t n THR 59 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b6t h ALA 60 N 0.00 2.12 0.00 6.98 0.00 -1.17 -0.09 119.26 127.11 1b6t h ALA 60 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1b6t h ALA 60 Cb 0.63 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1b6t h ALA 60 CO 0.00 -0.25 0.00 -2.39 0.00 0.00 0.00 179.25 176.61 1b6t n HIS 61 N -4.46 0.13 -3.33 0.00 1.44 -1.26 -4.45 115.22 103.29 1b6t n HIS 61 Ca 0.09 0.04 -0.46 0.00 -2.01 0.00 0.00 57.72 55.38 1b6t n HIS 61 Cb 0.40 -0.57 -0.04 0.00 0.12 0.00 0.00 29.99 29.89 1b6t n HIS 61 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1b6t s LEU 62 N -3.22 6.35 0.58 2.39 1.43 -0.05 -4.93 118.68 121.24 1b6t s LEU 62 Ca 0.10 -2.08 0.29 0.00 -1.03 0.00 0.00 54.13 51.40 1b6t s LEU 62 Cb 0.13 -2.20 1.78 0.00 0.03 0.00 0.00 46.19 45.93 1b6t s LEU 62 CO 0.39 -0.76 2.25 1.23 0.23 0.00 0.00 176.35 179.69 1b6t h GLY 63 N 8.52 0.00 -0.28 -3.19 0.00 -1.82 -2.11 103.07 104.20 1b6t h GLY 63 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1b6t h GLY 63 CO 0.94 0.00 0.00 0.70 0.00 0.00 0.00 176.54 178.18 1b6t n ASN 64 N -3.90 1.19 -4.69 0.19 5.03 -1.26 -4.87 115.26 106.94 1b6t n ASN 64 Ca -0.03 -1.50 -0.35 0.00 0.87 0.00 0.00 54.58 53.57 1b6t n ASN 64 Cb 0.08 -0.04 -0.09 0.00 -1.02 0.00 0.00 39.78 38.71 1b6t n ASN 64 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1b6t s VAL 65 N -1.92 4.50 -0.17 2.41 1.01 -0.79 -1.06 120.40 124.38 1b6t s VAL 65 Ca 0.36 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.17 1b6t s VAL 65 Cb 0.19 -2.93 0.04 0.00 0.00 0.00 0.00 36.38 33.68 1b6t s VAL 65 CO 0.30 0.58 -0.08 -0.70 0.00 0.00 0.00 175.10 175.19 1b6t s GLU 66 N -0.66 1.78 -0.13 2.72 2.12 0.19 -4.98 118.70 119.74 1b6t s GLU 66 Ca 0.11 -0.62 -0.18 0.00 0.36 0.00 0.00 54.97 54.64 1b6t s GLU 66 Cb -0.12 -2.13 -0.04 0.00 0.26 0.00 0.00 34.13 32.10 1b6t s GLU 66 CO 0.02 -0.39 0.49 0.08 -0.54 0.00 0.00 175.26 174.92 1b6t s VAL 67 N 1.53 5.17 0.01 3.70 1.01 -1.26 -0.34 120.40 130.23 1b6t s VAL 67 Ca 0.01 0.97 -0.09 0.00 0.00 0.00 0.00 61.98 62.87 1b6t s VAL 67 Cb -0.15 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.41 1b6t s VAL 67 CO -0.08 0.30 0.18 -0.69 0.00 0.00 0.00 175.10 174.81 1b6t s VAL 68 N 0.77 0.09 0.17 2.92 1.01 -0.29 -4.96 120.40 120.11 1b6t s VAL 68 Ca 0.26 -0.72 0.06 0.00 0.00 0.00 0.00 61.98 61.57 1b6t s VAL 68 Cb -0.15 -0.59 -0.04 0.00 0.00 0.00 0.00 36.38 35.60 1b6t s VAL 68 CO 0.10 -0.40 0.12 -0.83 0.00 0.00 0.00 175.10 174.09 1b6t s GLY 69 N -1.58 1.70 -0.04 4.51 0.00 -1.26 0.18 107.32 110.83 1b6t s GLY 69 Ca -0.12 -1.25 -0.24 0.00 0.00 0.00 0.00 44.72 43.11 1b6t s GLY 69 CO 0.01 -1.27 0.53 -0.11 0.00 0.00 0.00 173.10 172.25 1b6t s PHE 70 N -1.78 -0.47 0.00 1.90 -0.71 -0.08 -4.86 117.98 111.99 1b6t s PHE 70 Ca 0.31 0.80 0.00 0.00 -1.04 0.00 0.00 56.93 56.99 1b6t s PHE 70 Cb -0.10 0.28 0.00 0.00 -1.21 0.00 0.00 43.02 41.99 1b6t s PHE 70 CO 0.23 -0.51 0.66 -1.13 -1.34 0.00 0.00 175.22 173.12 1b6t n SER 71 N 1.13 1.30 -4.08 1.98 3.41 -1.26 -1.50 113.62 114.61 1b6t n SER 71 Ca -0.20 -1.32 -0.29 0.00 -0.26 0.00 0.00 58.87 56.80 1b6t n SER 71 Cb 0.57 0.00 0.19 0.00 -0.26 0.00 0.00 64.21 64.71 1b6t n SER 71 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1b6t s ASP 72 N -0.32 3.04 0.23 4.04 1.01 -1.26 -4.96 116.67 118.44 1b6t s ASP 72 Ca 0.00 0.07 -0.30 0.00 0.71 0.00 0.00 52.55 53.03 1b6t s ASP 72 Cb 0.00 -0.07 -0.10 0.00 1.01 0.00 0.00 42.92 43.76 1b6t s ASP 72 CO 0.00 -2.76 1.40 -0.22 0.21 0.00 0.00 175.17 173.79 1b6t s LEU 73 N -5.84 4.40 0.25 1.23 2.96 -1.26 -4.88 118.68 115.53 1b6t s LEU 73 Ca 0.75 2.56 -0.04 0.00 -0.22 0.00 0.00 54.13 57.18 1b6t s LEU 73 Cb -0.03 -3.62 0.36 0.00 0.50 0.00 0.00 46.19 43.40 1b6t s LEU 73 CO 0.53 -0.64 1.87 -0.03 -1.32 0.00 0.00 176.35 176.75 1b6t h MET 74 N 5.25 1.07 -0.86 1.98 1.85 -1.98 -1.58 114.93 120.65 1b6t h MET 74 Ca -0.45 -0.06 -0.01 0.00 -0.61 0.00 0.00 59.70 58.56 1b6t h MET 74 Cb 1.22 -0.24 -0.04 0.00 0.43 0.00 0.00 31.60 32.96 1b6t h MET 74 CO 0.78 0.71 0.50 0.00 -0.40 0.00 0.00 176.91 178.50 1b6t h ALA 75 N 1.42 1.26 -0.32 0.39 0.00 -1.94 1.00 119.26 121.07 1b6t h ALA 75 Ca 0.40 -0.11 -0.17 0.00 0.00 0.00 0.00 54.91 55.03 1b6t h ALA 75 Cb 0.14 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1b6t h ALA 75 CO -0.16 0.62 -0.47 -0.91 0.00 0.00 0.00 179.25 178.33 1b6t h ASN 76 N 1.19 0.92 -0.62 0.00 2.35 -1.79 -1.76 115.58 115.87 1b6t h ASN 76 Ca 0.31 -0.46 -0.02 0.00 -0.55 0.00 0.00 56.30 55.58 1b6t h ASN 76 Cb -0.02 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.06 1b6t h ASN 76 CO -0.05 1.24 0.30 0.15 -1.65 0.00 0.00 177.43 177.41 1b6t h PHE 77 N 0.67 0.89 -0.27 1.19 3.57 -0.74 0.55 116.94 122.80 1b6t h PHE 77 Ca 0.04 -0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 1b6t h PHE 77 Cb 1.06 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.51 1b6t h PHE 77 CO 0.06 0.68 0.15 0.00 -2.23 0.00 0.00 178.31 176.97 1b6t h ALA 78 N 1.13 0.35 -0.65 2.41 0.00 -0.71 0.07 119.26 121.85 1b6t h ALA 78 Ca 0.21 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1b6t h ALA 78 Cb 0.12 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1b6t h ALA 78 CO -0.03 -0.13 0.39 -0.09 0.00 0.00 0.00 179.25 179.40 1b6t h ARG 79 N 0.33 0.89 0.00 0.00 2.43 -1.00 -1.06 114.38 115.97 1b6t h ARG 79 Ca 0.10 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1b6t h ARG 79 Cb 0.05 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.42 1b6t h ARG 79 CO -0.02 0.64 0.00 -0.91 -1.51 0.00 0.00 179.97 178.17 1b6t h ASN 80 N 0.89 0.00 -0.08 -3.80 -0.26 -0.54 -1.63 115.58 110.15 1b6t h ASN 80 Ca 0.23 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.97 1b6t h ASN 80 Cb -0.02 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.24 1b6t h ASN 80 CO -0.04 0.00 0.00 0.00 -1.06 0.00 0.00 177.43 176.33 1b6t n GLN 81 N -2.59 2.24 -2.45 0.81 1.13 -0.02 -4.96 117.38 111.54 1b6t n GLN 81 Ca 0.02 -1.81 -0.16 0.00 -1.94 0.00 0.00 57.00 53.11 1b6t n GLN 81 Cb 0.27 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 29.16 1b6t n GLN 81 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1b6t n HIS 82 N 1.16 -0.95 -3.20 1.08 8.25 -0.61 -5.00 115.22 115.95 1b6t n HIS 82 Ca 0.16 0.11 -0.34 0.00 -0.26 0.00 0.00 57.72 57.39 1b6t n HIS 82 Cb 0.56 -3.33 -0.06 0.00 1.12 0.00 0.00 29.99 28.28 1b6t n HIS 82 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1b6t s ALA 83 N -2.84 3.42 0.00 -1.41 0.00 -0.48 -4.58 121.76 115.86 1b6t s ALA 83 Ca 0.06 0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1b6t s ALA 83 Cb -0.03 -2.70 0.00 0.00 0.00 0.00 0.00 23.12 20.39 1b6t s ALA 83 CO 0.08 0.37 0.32 0.25 0.00 0.00 0.00 175.76 176.78 1b6t n THR 84 N 0.15 0.05 -4.45 0.00 -2.24 -0.43 -4.63 114.28 102.73 1b6t n THR 84 Ca 0.00 -0.30 -0.22 0.00 -2.27 0.00 0.00 64.05 61.26 1b6t n THR 84 Cb 0.52 1.38 -0.16 0.00 -2.10 0.00 0.00 70.33 69.98 1b6t n THR 84 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1b6t s VAL 85 N -0.05 0.90 -0.30 2.28 1.01 -1.18 -1.21 120.40 121.84 1b6t s VAL 85 Ca 0.00 -0.40 -0.02 0.00 0.00 0.00 0.00 61.98 61.57 1b6t s VAL 85 Cb 0.00 -0.81 0.05 0.00 0.00 0.00 0.00 36.38 35.62 1b6t s VAL 85 CO 0.00 0.28 0.01 -0.22 0.00 0.00 0.00 175.10 175.17 1b6t s LEU 86 N 0.36 3.94 -0.02 3.92 2.96 0.52 -0.45 118.68 129.91 1b6t s LEU 86 Ca -0.07 -1.29 -0.22 0.00 -0.22 0.00 0.00 54.13 52.34 1b6t s LEU 86 Cb -0.11 -1.72 -0.05 0.00 0.50 0.00 0.00 46.19 44.81 1b6t s LEU 86 CO 0.01 -0.27 0.64 -0.63 -1.32 0.00 0.00 176.35 174.78 1b6t s ILE 87 N 1.25 4.95 0.04 6.68 -1.09 0.68 -0.16 121.20 133.54 1b6t s ILE 87 Ca -0.05 1.32 0.02 0.00 -2.23 0.00 0.00 60.65 59.71 1b6t s ILE 87 Cb -0.20 -3.98 -0.02 0.00 -1.58 0.00 0.00 42.46 36.68 1b6t s ILE 87 CO -0.01 0.36 -0.07 -0.13 -1.23 0.00 0.00 174.94 173.86 1b6t s ARG 88 N 0.17 0.48 -0.04 2.79 1.81 -0.40 -4.26 118.95 119.49 1b6t s ARG 88 Ca 0.33 -0.69 -0.01 0.00 -1.72 0.00 0.00 55.73 53.65 1b6t s ARG 88 Cb -0.18 -0.23 -0.04 0.00 -0.45 0.00 0.00 34.95 34.06 1b6t s ARG 88 CO 0.18 0.04 0.03 0.20 -0.68 0.00 0.00 175.30 175.06 1b6t s GLY 89 N -1.45 1.92 -0.18 -3.53 0.00 -1.26 -1.09 107.32 101.72 1b6t s GLY 89 Ca -0.10 -0.85 0.01 0.00 0.00 0.00 0.00 44.72 43.77 1b6t s GLY 89 CO 0.00 -0.67 -0.17 1.08 0.00 0.00 0.00 173.10 173.34 1b6t s LEU 90 N -1.30 2.15 -0.16 0.66 1.43 -0.59 -4.91 118.68 115.96 1b6t s LEU 90 Ca 0.18 -0.70 -0.03 0.00 -1.03 0.00 0.00 54.13 52.55 1b6t s LEU 90 Cb -0.12 -1.39 -0.23 0.00 0.03 0.00 0.00 46.19 44.48 1b6t s LEU 90 CO 0.08 -0.04 0.17 0.54 0.23 0.00 0.00 176.35 177.33 1b6t n ARG 91 N 4.64 0.72 -1.04 1.70 1.74 -1.26 -4.35 116.66 118.81 1b6t n ARG 91 Ca -0.19 0.22 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 1b6t n ARG 91 Cb 0.49 -1.65 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 1b6t n ARG 91 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1b6t n ALA 92 N -3.07 0.00 -0.19 7.54 0.00 -1.26 -4.96 120.51 118.56 1b6t n ALA 92 Ca -0.36 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 52.95 1b6t n ALA 92 Cb 1.03 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 20.39 1b6t n ALA 92 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1b6t h VAL 93 N 0.80 0.01 -0.79 0.00 2.07 -2.00 -1.91 116.25 114.43 1b6t h VAL 93 Ca 0.00 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.67 1b6t h VAL 93 Cb 0.00 0.01 -0.15 0.00 -1.52 0.00 0.00 31.29 29.63 1b6t h VAL 93 CO 0.00 0.00 -0.26 0.00 0.02 0.00 0.00 177.57 177.33 1b6t h ALA 94 N 0.13 0.35 0.03 1.67 0.00 -2.00 0.76 119.26 120.20 1b6t h ALA 94 Ca 0.10 0.28 0.03 0.00 0.00 0.00 0.00 54.91 55.32 1b6t h ALA 94 Cb 0.56 0.72 -0.04 0.00 0.00 0.00 0.00 17.79 19.03 1b6t h ALA 94 CO -0.66 -0.50 -0.27 -0.44 0.00 0.00 0.00 179.25 177.38 1b6t h ASP 95 N -0.04 -0.80 -0.46 0.00 5.19 -1.76 -2.60 116.42 115.96 1b6t h ASP 95 Ca 0.35 0.10 0.09 0.00 -0.62 0.00 0.00 57.03 56.96 1b6t h ASP 95 Cb 0.59 0.32 -0.10 0.00 0.18 0.00 0.00 39.33 40.32 1b6t h ASP 95 CO -0.83 -0.34 -0.24 0.15 -3.12 0.00 0.00 179.24 174.86 1b6t h PHE 96 N -0.43 -0.61 -0.07 4.55 3.57 -0.35 0.39 116.94 123.99 1b6t h PHE 96 Ca 0.05 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 1b6t h PHE 96 Cb 0.50 0.34 -0.00 0.00 2.79 0.00 0.00 35.95 39.58 1b6t h PHE 96 CO -0.29 -0.31 0.04 0.93 -2.23 0.00 0.00 178.31 176.45 1b6t h GLU 97 N -0.14 0.10 -0.55 1.11 4.39 -1.20 -1.25 114.58 117.04 1b6t h GLU 97 Ca 0.21 -0.01 -0.10 0.00 0.34 0.00 0.00 59.36 59.81 1b6t h GLU 97 Cb 0.48 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 1b6t h GLU 97 CO -0.54 0.11 -0.04 -0.92 -1.16 0.00 0.00 179.01 176.46 1b6t h TYR 98 N 0.06 1.07 0.00 4.33 5.03 -1.13 -2.76 116.97 123.56 1b6t h TYR 98 Ca 0.03 -0.19 -0.06 0.00 2.58 0.00 0.00 58.73 61.09 1b6t h TYR 98 Cb 0.04 -0.28 -0.01 0.00 1.55 0.00 0.00 36.73 38.03 1b6t h TYR 98 CO -0.06 0.97 -0.26 0.93 -1.32 0.00 0.00 178.16 178.42 1b6t h GLU 99 N 0.89 0.00 -0.33 1.82 4.39 -0.05 -1.94 114.58 119.36 1b6t h GLU 99 Ca 0.15 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.70 1b6t h GLU 99 Cb 0.58 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.22 1b6t h GLU 99 CO 0.03 0.26 -0.42 0.52 -1.16 0.00 0.00 179.01 178.25 1b6t h MET 100 N 0.00 0.82 -0.14 2.33 2.86 -0.94 0.25 114.93 120.11 1b6t h MET 100 Ca -0.00 -0.44 -0.02 0.00 -2.06 0.00 0.00 59.70 57.17 1b6t h MET 100 Cb 0.50 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 1b6t h MET 100 CO 0.03 1.08 0.00 1.96 1.06 0.00 0.00 176.91 181.04 1b6t h GLN 101 N 0.66 0.24 -0.50 1.72 4.20 -1.32 -1.06 115.11 119.06 1b6t h GLN 101 Ca 0.05 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 1b6t h GLN 101 Cb 0.99 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.73 1b6t h GLN 101 CO 0.10 0.47 0.25 1.25 -0.67 0.00 0.00 178.83 180.23 1b6t h LEU 102 N -0.02 0.64 -0.70 1.46 5.85 -1.31 -1.55 115.31 119.68 1b6t h LEU 102 Ca 0.04 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 1b6t h LEU 102 Cb 0.36 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 1b6t h LEU 102 CO 0.01 0.58 0.30 0.00 -0.34 0.00 0.00 178.44 178.99 1b6t h ALA 103 N 1.09 0.91 -0.09 1.25 0.00 -0.41 -0.84 119.26 121.17 1b6t h ALA 103 Ca 0.17 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1b6t h ALA 103 Cb 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1b6t h ALA 103 CO -0.02 0.51 -0.49 0.45 0.00 0.00 0.00 179.25 179.69 1b6t h HIS 104 N 1.00 0.28 -0.27 0.00 3.86 -1.01 -0.63 115.15 118.37 1b6t h HIS 104 Ca 0.24 -0.09 -0.09 0.00 -1.16 0.00 0.00 60.37 59.27 1b6t h HIS 104 Cb 0.17 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.58 1b6t h HIS 104 CO 0.01 0.68 -0.18 1.98 0.86 0.00 0.00 177.93 181.28 1b6t h MET 105 N 0.18 0.61 -0.19 2.45 -1.53 -0.95 -2.04 114.93 113.46 1b6t h MET 105 Ca 0.01 -0.29 -0.06 0.00 -3.44 0.00 0.00 59.70 55.92 1b6t h MET 105 Cb 0.94 -0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 31.97 1b6t h MET 105 CO 0.08 0.87 -0.14 -0.91 0.14 0.00 0.00 176.91 176.95 1b6t h ASN 106 N 0.34 0.30 0.22 1.39 2.35 -1.01 -1.31 115.58 117.85 1b6t h ASN 106 Ca 0.05 -0.07 -0.11 0.00 -0.55 0.00 0.00 56.30 55.63 1b6t h ASN 106 Cb 0.72 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 39.00 1b6t h ASN 106 CO 0.05 0.47 -0.41 -0.09 -1.65 0.00 0.00 177.43 175.80 1b6t h ARG 107 N 0.29 0.26 -0.24 0.81 2.43 -0.96 0.43 114.38 117.40 1b6t h ARG 107 Ca 0.06 -0.12 -0.16 0.00 -0.81 0.00 0.00 59.98 58.94 1b6t h ARG 107 Cb 0.43 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1b6t h ARG 107 CO 0.03 0.63 -0.50 1.25 -1.51 0.00 0.00 179.97 179.87 1b6t h HIS 108 N 0.22 0.83 0.06 2.20 2.76 -0.61 -1.80 115.15 118.81 1b6t h HIS 108 Ca 0.02 -0.28 -0.24 0.00 -2.20 0.00 0.00 60.37 57.67 1b6t h HIS 108 Cb 0.82 -0.16 -0.00 0.00 1.55 0.00 0.00 27.41 29.62 1b6t h HIS 108 CO 0.02 1.03 -1.08 -0.07 -1.30 0.00 0.00 177.93 176.53 1b6t h LEU 109 N 0.53 0.40 -6.12 0.26 3.38 -0.89 -3.42 115.31 109.45 1b6t h LEU 109 Ca 0.02 -0.38 -0.34 0.00 0.09 0.00 0.00 57.88 57.27 1b6t h LEU 109 Cb 1.06 -0.13 -0.29 0.00 0.09 0.00 0.00 40.66 41.39 1b6t h LEU 109 CO 0.10 1.24 -0.68 -0.32 0.09 0.00 0.00 178.44 178.86 1b6t s MET 110 N -2.94 0.77 0.57 1.13 0.00 0.15 -4.98 119.30 114.00 1b6t s MET 110 Ca -0.04 -1.05 0.26 0.00 0.00 0.00 0.00 55.69 54.86 1b6t s MET 110 Cb 0.08 -0.66 1.62 0.00 0.00 0.00 0.00 34.83 35.87 1b6t s MET 110 CO 0.87 -1.25 2.16 -1.00 0.00 0.00 0.00 175.02 175.80 1b6t h PRO 111 N 6.50 0.00 -0.06 4.11 0.13 -1.52 -2.03 132.00 139.14 1b6t h PRO 111 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1b6t h PRO 111 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1b6t h PRO 111 CO 0.19 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.11 1b6t n GLU 112 N -4.02 1.27 -3.47 0.86 0.00 -1.26 -4.57 120.64 109.44 1b6t n GLU 112 Ca -0.01 -0.41 -0.43 0.00 0.00 0.00 0.00 57.16 56.32 1b6t n GLU 112 Cb 0.20 -1.33 -0.10 0.00 0.00 0.00 0.00 31.44 30.21 1b6t n GLU 112 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 1b6t s LEU 113 N -1.59 5.11 -0.24 -1.84 2.96 -0.76 -4.64 118.68 117.67 1b6t s LEU 113 Ca 0.30 -0.96 -0.16 0.00 -0.22 0.00 0.00 54.13 53.09 1b6t s LEU 113 Cb 0.15 -2.14 -0.03 0.00 0.50 0.00 0.00 46.19 44.66 1b6t s LEU 113 CO 0.24 -0.46 0.43 -0.70 -1.32 0.00 0.00 176.35 174.53 1b6t s GLU 114 N 1.66 4.09 0.30 1.98 2.56 -0.35 -4.76 118.70 124.18 1b6t s GLU 114 Ca 0.04 0.19 -0.29 0.00 0.00 0.00 0.00 54.97 54.92 1b6t s GLU 114 Cb -0.20 -3.61 -0.10 0.00 2.00 0.00 0.00 34.13 32.23 1b6t s GLU 114 CO 0.09 -0.22 1.12 -1.12 -0.56 0.00 0.00 175.26 174.57 1b6t s SER 115 N 1.40 7.14 -0.03 -1.70 0.01 -1.26 -0.35 113.70 118.91 1b6t s SER 115 Ca 0.18 2.29 0.00 0.00 1.31 0.00 0.00 55.95 59.74 1b6t s SER 115 Cb -0.15 -2.62 0.03 0.00 0.21 0.00 0.00 66.02 63.48 1b6t s SER 115 CO 0.09 -0.24 0.01 -0.69 0.41 0.00 0.00 173.24 172.83 1b6t s VAL 116 N -1.22 0.08 -0.13 3.43 1.01 0.77 -4.86 120.40 119.48 1b6t s VAL 116 Ca 0.47 0.14 -0.03 0.00 0.00 0.00 0.00 61.98 62.56 1b6t s VAL 116 Cb -0.32 -0.19 -0.03 0.00 0.00 0.00 0.00 36.38 35.84 1b6t s VAL 116 CO 0.41 0.12 -0.02 -0.36 0.00 0.00 0.00 175.10 175.25 1b6t s PHE 117 N 1.06 3.06 0.19 5.22 0.08 -1.26 -1.27 117.98 125.07 1b6t s PHE 117 Ca -0.09 -0.10 0.10 0.00 0.12 0.00 0.00 56.93 56.96 1b6t s PHE 117 Cb -0.13 -1.89 -0.04 0.00 -0.57 0.00 0.00 43.02 40.38 1b6t s PHE 117 CO -0.02 0.15 -0.16 -0.51 -0.10 0.00 0.00 175.22 174.58 1b6t s LEU 118 N -0.10 2.73 -0.14 -0.37 1.43 -0.25 -4.97 118.68 117.01 1b6t s LEU 118 Ca 0.03 -0.72 -0.01 0.00 -1.03 0.00 0.00 54.13 52.39 1b6t s LEU 118 Cb -0.13 -1.43 -0.02 0.00 0.03 0.00 0.00 46.19 44.65 1b6t s LEU 118 CO 0.02 0.11 -0.11 -0.04 0.23 0.00 0.00 176.35 176.56 1b6t s MET 119 N -2.81 3.45 1.07 1.70 -1.94 -1.26 -1.54 119.30 117.97 1b6t s MET 119 Ca 0.24 -0.65 -0.16 0.00 -1.71 0.00 0.00 55.69 53.41 1b6t s MET 119 Cb -0.08 -2.70 0.23 0.00 2.01 0.00 0.00 34.83 34.29 1b6t s MET 119 CO 0.13 0.22 1.13 -1.25 -0.01 0.00 0.00 175.02 175.24 1b6t s PRO 120 N 0.36 -0.20 0.87 2.03 0.04 -1.26 -5.00 135.00 131.84 1b6t s PRO 120 Ca -0.09 0.10 -0.11 0.00 0.04 0.00 0.00 61.00 60.94 1b6t s PRO 120 Cb -0.15 -1.70 0.11 0.00 0.04 0.00 0.00 34.50 32.80 1b6t s PRO 120 CO 0.05 -3.06 1.09 -1.54 0.04 0.00 0.00 177.00 173.58 1b6t s SER 121 N -3.91 3.74 0.41 6.66 1.04 -1.26 -4.84 113.70 115.54 1b6t s SER 121 Ca 0.69 1.48 0.08 0.00 0.48 0.00 0.00 55.95 58.67 1b6t s SER 121 Cb -0.12 -2.17 0.86 0.00 0.10 0.00 0.00 66.02 64.69 1b6t s SER 121 CO 0.56 -2.47 2.02 0.11 0.98 0.00 0.00 173.24 174.44 1b6t h LYS 122 N -1.43 0.42 -0.76 4.02 1.57 -1.99 -2.45 116.57 115.95 1b6t h LYS 122 Ca -0.49 -0.04 0.08 0.00 -1.87 0.00 0.00 60.65 58.33 1b6t h LYS 122 Cb 1.28 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 33.45 1b6t h LYS 122 CO 0.55 0.34 0.50 1.49 -0.57 0.00 0.00 179.45 181.76 1b6t h GLU 123 N 0.43 0.72 -0.30 3.15 4.81 -2.04 -2.58 114.58 118.76 1b6t h GLU 123 Ca 0.11 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1b6t h GLU 123 Cb 0.07 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.29 1b6t h GLU 123 CO -0.01 0.48 0.00 0.91 -0.73 0.00 0.00 179.01 179.65 1b6t n TRP 124 N -4.49 0.83 1.21 0.92 5.03 -0.96 -4.65 117.44 115.33 1b6t n TRP 124 Ca 0.12 -0.75 0.12 0.00 3.03 0.00 0.00 57.50 60.01 1b6t n TRP 124 Cb 0.28 -0.23 0.63 0.00 -1.03 0.00 0.00 31.31 30.96 1b6t n TRP 124 CO 0.00 0.00 0.00 0.43 -0.03 0.00 0.00 177.69 178.09 1b6t n SER 125 N -0.15 0.00 -0.01 -0.99 7.64 -0.97 -3.58 113.62 115.56 1b6t n SER 125 Ca 0.18 -0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1b6t n SER 125 Cb 0.76 -0.22 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 1b6t n SER 125 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1b6t n PHE 126 N -1.22 0.00 -4.14 1.43 3.01 -1.26 -4.81 117.46 110.47 1b6t n PHE 126 Ca 0.13 -0.38 -0.22 0.00 1.01 0.00 0.00 57.45 57.99 1b6t n PHE 126 Cb 0.16 -0.04 -0.05 0.00 -0.01 0.00 0.00 39.48 39.55 1b6t n PHE 126 CO 0.00 0.00 0.00 0.96 1.01 0.00 0.00 176.76 178.73 1b6t s ILE 127 N -0.78 4.31 0.10 4.37 -0.00 -1.23 -5.08 121.20 122.88 1b6t s ILE 127 Ca 0.01 -1.46 -0.17 0.00 -0.00 0.00 0.00 60.65 59.04 1b6t s ILE 127 Cb 0.01 -3.32 0.04 0.00 -0.00 0.00 0.00 42.46 39.19 1b6t s ILE 127 CO 0.00 -0.34 0.41 -0.94 -0.00 0.00 0.00 174.94 174.07 1b6t s SER 128 N -3.77 -0.25 0.21 4.36 1.04 -1.26 -4.99 113.70 109.03 1b6t s SER 128 Ca 0.32 -0.22 -0.10 0.00 0.48 0.00 0.00 55.95 56.43 1b6t s SER 128 Cb -0.08 0.46 0.21 0.00 0.10 0.00 0.00 66.02 66.71 1b6t s SER 128 CO 0.24 -0.80 1.84 0.28 0.98 0.00 0.00 173.24 175.78 1b6t h SER 129 N 2.53 0.68 -0.48 7.02 0.02 -1.88 -1.78 113.55 119.66 1b6t h SER 129 Ca -0.33 0.01 0.04 0.00 -0.84 0.00 0.00 61.79 60.67 1b6t h SER 129 Cb 1.24 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 63.60 1b6t h SER 129 CO 0.46 0.47 0.24 -1.28 -1.14 0.00 0.00 176.83 175.57 1b6t h SER 130 N 0.82 0.34 -0.27 3.07 0.87 -1.95 -0.84 113.55 115.59 1b6t h SER 130 Ca 0.29 0.03 -0.04 0.00 -1.23 0.00 0.00 61.79 60.84 1b6t h SER 130 Cb 0.07 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 61.98 1b6t h SER 130 CO -0.13 0.24 0.03 0.25 -0.53 0.00 0.00 176.83 176.69 1b6t h LEU 131 N 0.47 0.45 -0.70 2.23 6.46 -1.88 -1.65 115.31 120.69 1b6t h LEU 131 Ca 0.21 -0.28 0.01 0.00 -0.12 0.00 0.00 57.88 57.70 1b6t h LEU 131 Cb 0.13 -0.12 -0.04 0.00 -0.73 0.00 0.00 40.66 39.90 1b6t h LEU 131 CO -0.15 0.62 0.46 0.58 -0.62 0.00 0.00 178.44 179.32 1b6t h VAL 132 N 0.26 1.17 -0.59 1.05 2.07 -1.12 -1.47 116.25 117.63 1b6t h VAL 132 Ca 0.08 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 1b6t h VAL 132 Cb 0.37 0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 1b6t h VAL 132 CO 0.01 0.17 0.24 0.11 0.02 0.00 0.00 177.57 178.12 1b6t h LYS 133 N 0.93 0.87 -0.64 1.57 1.57 -1.03 -0.17 116.57 119.67 1b6t h LYS 133 Ca 0.26 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1b6t h LYS 133 Cb -0.09 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.05 1b6t h LYS 133 CO -0.06 0.75 0.40 1.49 -0.57 0.00 0.00 179.45 181.45 1b6t h GLU 134 N 0.81 0.87 -0.42 3.15 4.81 -0.85 0.13 114.58 123.08 1b6t h GLU 134 Ca 0.20 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.31 1b6t h GLU 134 Cb 0.20 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1b6t h GLU 134 CO -0.02 0.61 0.08 0.28 -0.73 0.00 0.00 179.01 179.23 1b6t h VAL 135 N 0.87 1.24 -0.33 0.32 2.07 -1.04 -2.84 116.25 116.54 1b6t h VAL 135 Ca 0.23 -0.85 -0.04 0.00 0.82 0.00 0.00 66.70 66.86 1b6t h VAL 135 Cb -0.04 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1b6t h VAL 135 CO -0.04 0.30 0.03 0.00 0.02 0.00 0.00 177.57 177.87 1b6t h ALA 136 N 0.94 1.43 0.00 1.67 0.00 -0.58 -0.61 119.26 122.11 1b6t h ALA 136 Ca 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1b6t h ALA 136 Cb 0.36 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1b6t h ALA 136 CO 0.01 0.41 0.00 0.00 0.00 0.00 0.00 179.25 179.66 1b6t h ARG 137 N 0.49 0.00 -0.26 0.00 3.08 -0.50 -0.65 114.38 116.54 1b6t h ARG 137 Ca 0.11 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 1b6t h ARG 137 Cb 0.27 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1b6t h ARG 137 CO 0.00 0.00 -0.00 0.72 -1.07 0.00 0.00 179.97 179.62 1b6t n HIS 138 N -2.89 0.93 -1.52 3.04 8.25 -0.47 -4.96 115.22 117.61 1b6t n HIS 138 Ca -0.02 -0.96 -0.18 0.00 -0.26 0.00 0.00 57.72 56.31 1b6t n HIS 138 Cb 0.13 -0.33 -0.08 0.00 1.12 0.00 0.00 29.99 30.83 1b6t n HIS 138 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1b6t n GLN 139 N -0.62 -1.24 -2.32 -0.41 3.00 -0.25 -4.99 117.38 110.56 1b6t n GLN 139 Ca 0.23 1.13 -0.34 0.00 -0.01 0.00 0.00 57.00 58.00 1b6t n GLN 139 Cb 0.90 -5.38 -0.01 0.00 0.00 0.00 0.00 30.24 25.75 1b6t n GLN 139 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1b6t s GLY 140 N -2.81 2.42 -0.46 1.08 0.00 -0.36 -4.96 107.32 102.23 1b6t s GLY 140 Ca 0.00 0.59 -0.28 0.00 0.00 0.00 0.00 44.72 45.03 1b6t s GLY 140 CO 0.00 0.92 1.42 -0.35 0.00 0.00 0.00 173.10 175.09 1b6t s ASP 141 N -2.18 6.25 -0.09 1.64 3.68 -1.26 -4.42 116.67 120.30 1b6t s ASP 141 Ca 0.67 0.68 0.13 0.00 2.13 0.00 0.00 52.55 56.16 1b6t s ASP 141 Cb -0.18 -2.54 0.34 0.00 -1.45 0.00 0.00 42.92 39.09 1b6t s ASP 141 CO 0.27 -1.53 1.26 1.33 0.13 0.00 0.00 175.17 176.63 1b6t n VAL 142 N 7.04 1.61 -0.25 1.11 0.24 -1.26 -4.69 118.33 122.13 1b6t n VAL 142 Ca 0.16 -1.52 0.13 0.00 -2.04 0.00 0.00 64.34 61.06 1b6t n VAL 142 Cb 0.48 0.11 0.40 0.00 -1.47 0.00 0.00 33.84 33.36 1b6t n VAL 142 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 1b6t h THR 143 N 1.31 0.83 0.00 3.34 1.35 -1.91 -1.78 112.91 116.05 1b6t h THR 143 Ca 0.00 -0.22 -0.02 0.00 -0.55 0.00 0.00 66.41 65.62 1b6t h THR 143 Cb 1.00 0.14 -0.00 0.00 -1.73 0.00 0.00 68.15 67.56 1b6t h THR 143 CO 0.08 0.12 -0.10 -0.74 -0.25 0.00 0.00 175.52 174.63 1b6t h HIS 144 N 0.63 0.00 -0.03 4.73 6.17 -2.01 -3.16 115.15 121.49 1b6t h HIS 144 Ca 0.43 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.51 1b6t h HIS 144 Cb 0.74 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.67 1b6t h HIS 144 CO -0.00 0.10 -0.13 1.19 0.71 0.00 0.00 177.93 179.80 1b6t n PHE 145 N -3.96 0.00 -4.16 5.26 3.01 -0.67 -4.97 117.46 111.97 1b6t n PHE 145 Ca -0.02 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.28 1b6t n PHE 145 Cb 0.19 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.55 1b6t n PHE 145 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1b6t s LEU 146 N -2.12 2.34 0.58 4.37 1.43 -1.19 -0.95 118.68 123.14 1b6t s LEU 146 Ca 0.25 -0.70 -0.20 0.00 -1.03 0.00 0.00 54.13 52.45 1b6t s LEU 146 Cb 0.19 -0.35 -0.04 0.00 0.03 0.00 0.00 46.19 46.02 1b6t s LEU 146 CO 0.37 -0.19 1.29 -2.84 0.23 0.00 0.00 176.35 175.21 1b6t s PRO 147 N -2.23 2.98 0.19 1.29 0.02 -1.26 -4.71 135.00 131.28 1b6t s PRO 147 Ca 0.00 2.05 -0.20 0.00 0.02 0.00 0.00 61.00 62.87 1b6t s PRO 147 Cb -0.07 -2.07 0.13 0.00 0.02 0.00 0.00 34.50 32.52 1b6t s PRO 147 CO 0.01 -1.26 1.59 1.49 -0.33 0.00 0.00 177.00 178.50 1b6t h GLU 148 N 1.10 -0.15 -0.49 5.54 4.81 -1.99 -0.71 114.58 122.69 1b6t h GLU 148 Ca -0.51 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 58.78 1b6t h GLU 148 Cb 1.31 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.69 1b6t h GLU 148 CO 0.56 -0.10 0.33 -2.95 -0.73 0.00 0.00 179.01 176.11 1b6t h ASN 149 N -0.16 0.44 -0.19 1.04 -1.07 -1.96 -2.15 115.58 111.53 1b6t h ASN 149 Ca 0.23 -0.00 -0.22 0.00 0.07 0.00 0.00 56.30 56.38 1b6t h ASN 149 Cb 0.54 -0.10 0.01 0.00 -2.07 0.00 0.00 38.32 36.70 1b6t h ASN 149 CO -0.66 0.30 -0.72 0.58 0.07 0.00 0.00 177.43 177.00 1b6t h VAL 150 N 0.50 1.27 -0.49 6.14 2.07 -1.50 -2.26 116.25 121.98 1b6t h VAL 150 Ca 0.20 -1.91 -0.01 0.00 0.82 0.00 0.00 66.70 65.81 1b6t h VAL 150 Cb 0.18 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1b6t h VAL 150 CO -0.05 0.61 0.27 -0.74 0.02 0.00 0.00 177.57 177.68 1b6t h HIS 151 N 0.58 0.68 0.03 1.57 -0.00 -0.84 -0.32 115.15 116.86 1b6t h HIS 151 Ca -0.04 -0.02 0.01 0.00 -0.00 0.00 0.00 60.37 60.33 1b6t h HIS 151 Cb 1.35 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 28.52 1b6t h HIS 151 CO 0.08 0.50 -0.11 1.96 -0.00 0.00 0.00 177.93 180.36 1b6t h GLN 152 N 0.65 -0.20 -0.86 5.26 4.20 -1.38 0.12 115.11 122.90 1b6t h GLN 152 Ca 0.17 0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.94 1b6t h GLN 152 Cb 0.05 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.83 1b6t h GLN 152 CO -0.03 -0.13 0.57 0.00 -0.67 0.00 0.00 178.83 178.56 1b6t h ALA 153 N 0.73 1.49 -0.41 3.87 0.00 -1.17 -1.46 119.26 122.30 1b6t h ALA 153 Ca 0.03 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1b6t h ALA 153 Cb 0.24 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1b6t h ALA 153 CO -0.09 0.41 -0.27 1.25 0.00 0.00 0.00 179.25 180.55 1b6t h LEU 154 N 1.04 0.96 0.03 0.00 5.85 -0.58 -0.32 115.31 122.28 1b6t h LEU 154 Ca 0.35 -0.43 0.03 0.00 0.84 0.00 0.00 57.88 58.67 1b6t h LEU 154 Cb 0.08 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.81 1b6t h LEU 154 CO -0.11 1.18 -0.22 0.24 -0.34 0.00 0.00 178.44 179.19 1b6t h MET 155 N 0.74 -0.35 -0.07 1.25 2.86 -0.24 -2.24 114.93 116.88 1b6t h MET 155 Ca 0.08 0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.76 1b6t h MET 155 Cb 0.85 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.58 1b6t h MET 155 CO 0.07 -0.23 -0.02 0.00 1.06 0.00 0.00 176.91 177.79 1b6t h ALA 156 N 0.50 0.04 -0.99 6.32 0.00 -1.21 -2.80 119.26 121.11 1b6t h ALA 156 Ca 0.05 0.03 0.19 0.00 0.00 0.00 0.00 54.91 55.18 1b6t h ALA 156 Cb 0.42 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.18 1b6t h ALA 156 CO -0.18 -0.50 0.61 -0.22 0.00 0.00 0.00 179.25 178.97 1b6t h LYS 157 N -0.01 0.68 -6.63 0.00 1.63 -0.84 -3.42 116.57 107.99 1b6t h LYS 157 Ca 0.03 -0.04 -0.43 0.00 -0.85 0.00 0.00 60.65 59.36 1b6t h LYS 157 Cb 0.07 -0.15 0.03 0.00 -0.60 0.00 0.00 32.23 31.57 1b6t h LYS 157 CO -0.08 0.45 -0.15 -0.51 -3.45 0.00 0.00 179.45 175.72 1b6t s LEU 158 N -10.09 3.45 0.00 5.20 1.43 -0.86 -5.10 118.68 112.70 1b6t s LEU 158 Ca -0.11 -0.31 0.26 0.00 -1.03 0.00 0.00 54.13 52.94 1b6t s LEU 158 Cb 0.24 -2.61 0.70 0.00 0.03 0.00 0.00 46.19 44.55 1b6t s LEU 158 CO 0.80 -0.99 1.55 0.00 0.23 0.00 0.00 176.35 177.93