#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 3.62 0.14 1.64 0.52 -1.26 -2.13 118.95 121.48 1b6t s ARG 4 Ca 0.00 -0.51 0.07 0.00 -0.52 0.00 0.00 55.73 54.77 1b6t s ARG 4 Cb 0.00 -3.16 -0.04 0.00 0.52 0.00 0.00 34.95 32.27 1b6t s ARG 4 CO 0.00 -0.07 -0.05 0.00 0.02 0.00 0.00 175.30 175.20 1b6t s ALA 5 N 1.25 3.10 -0.05 2.13 0.00 0.05 -1.25 121.76 126.99 1b6t s ALA 5 Ca 0.04 -1.30 0.05 0.00 0.00 0.00 0.00 51.96 50.74 1b6t s ALA 5 Cb -0.15 -0.95 -0.00 0.00 0.00 0.00 0.00 23.12 22.02 1b6t s ALA 5 CO 0.02 0.57 -0.19 -1.50 0.00 0.00 0.00 175.76 174.65 1b6t s ILE 6 N -1.49 1.58 -0.48 0.00 2.07 0.47 -0.39 121.20 122.96 1b6t s ILE 6 Ca 0.25 -0.80 0.03 0.00 -1.41 0.00 0.00 60.65 58.72 1b6t s ILE 6 Cb -0.10 -1.35 0.13 0.00 0.13 0.00 0.00 42.46 41.26 1b6t s ILE 6 CO 0.16 0.45 0.24 -0.47 -1.91 0.00 0.00 174.94 173.41 1b6t s TYR 7 N 0.02 2.86 0.34 3.50 5.04 0.51 -0.21 117.35 129.41 1b6t s TYR 7 Ca -0.05 -2.94 -0.07 0.00 -2.44 0.00 0.00 57.07 51.58 1b6t s TYR 7 Cb -0.12 -2.55 -0.06 0.00 0.35 0.00 0.00 41.96 39.58 1b6t s TYR 7 CO 0.03 -0.77 0.64 -1.25 -1.34 0.00 0.00 175.55 172.87 1b6t s PRO 8 N -0.02 3.68 0.00 4.97 0.04 -1.26 -1.68 135.00 140.73 1b6t s PRO 8 Ca 0.17 0.18 0.00 0.00 0.04 0.00 0.00 61.00 61.39 1b6t s PRO 8 Cb -0.25 -2.54 0.00 0.00 0.04 0.00 0.00 34.50 31.75 1b6t s PRO 8 CO -0.01 0.10 0.00 0.41 0.04 0.00 0.00 177.00 177.54 1b6t n GLY 9 N -1.15 -1.76 0.09 0.56 0.00 -0.69 -4.95 105.19 97.28 1b6t n GLY 9 Ca -0.00 -1.11 -0.05 0.00 0.00 0.00 0.00 46.02 44.86 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 0.23 1.43 -4.07 2.61 -1.04 -1.26 -0.55 114.28 111.62 1b6t n THR 10 Ca 0.00 -0.75 -0.47 0.00 -2.04 0.00 0.00 64.05 60.79 1b6t n THR 10 Cb 0.00 -0.91 0.02 0.00 -1.82 0.00 0.00 70.33 67.62 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 -2.98 -1.40 -3.73 -1.42 3.01 -1.26 -4.64 117.46 105.05 1b6t n PHE 11 Ca -0.14 0.08 -0.28 0.00 1.01 0.00 0.00 57.45 58.12 1b6t n PHE 11 Cb 0.96 -2.79 -0.11 0.00 -0.01 0.00 0.00 39.48 37.53 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 -2.16 3.14 -4.99 4.37 2.03 -1.26 -3.12 116.55 114.57 1b6t n ASP 12 Ca -0.11 -3.26 -0.20 0.00 0.52 0.00 0.00 54.79 51.74 1b6t n ASP 12 Cb 0.56 -0.72 0.03 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 -1.75 2.45 0.27 -0.67 0.04 -1.26 -4.77 135.00 129.31 1b6t s PRO 13 Ca 0.30 -1.59 -0.30 0.00 0.04 0.00 0.00 61.00 59.46 1b6t s PRO 13 Cb 0.02 -2.57 -0.10 0.00 0.04 0.00 0.00 34.50 31.90 1b6t s PRO 13 CO -0.12 -0.60 1.35 -1.50 0.04 0.00 0.00 177.00 176.17 1b6t s ILE 14 N -2.58 2.82 0.46 0.56 2.07 -1.18 -5.00 121.20 118.35 1b6t s ILE 14 Ca 0.55 0.73 0.05 0.00 -1.41 0.00 0.00 60.65 60.57 1b6t s ILE 14 Cb -0.06 -3.47 -0.03 0.00 0.13 0.00 0.00 42.46 39.04 1b6t s ILE 14 CO 0.34 0.14 0.17 0.42 -1.91 0.00 0.00 174.94 174.09 1b6t s THR 15 N -0.42 1.87 0.50 4.00 -4.23 -1.26 -4.63 115.64 111.47 1b6t s THR 15 Ca 0.55 -1.75 0.18 0.00 -1.18 0.00 0.00 61.69 59.48 1b6t s THR 15 Cb -0.40 -2.63 0.25 0.00 1.34 0.00 0.00 72.50 71.07 1b6t s THR 15 CO 0.46 0.00 2.11 0.78 -0.54 0.00 0.00 174.62 177.42 1b6t h ASN 16 N 1.30 0.00 -0.47 3.99 -0.26 -1.22 -1.16 115.58 117.76 1b6t h ASN 16 Ca -0.42 0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 55.23 1b6t h ASN 16 Cb 1.28 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 38.52 1b6t h ASN 16 CO 0.69 0.07 -0.07 1.23 -1.06 0.00 0.00 177.43 178.29 1b6t h GLY 17 N 0.22 0.95 1.05 2.83 0.00 -1.90 0.34 103.07 106.56 1b6t h GLY 17 Ca -0.00 -0.75 -0.09 0.00 0.00 0.00 0.00 47.33 46.49 1b6t h GLY 17 CO 0.01 0.69 0.02 0.45 0.00 0.00 0.00 176.54 177.71 1b6t h HIS 18 N 0.73 1.08 -0.71 5.60 3.86 -1.68 -1.85 115.15 122.18 1b6t h HIS 18 Ca 0.13 -0.18 -0.05 0.00 -1.16 0.00 0.00 60.37 59.11 1b6t h HIS 18 Cb 0.60 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.76 1b6t h HIS 18 CO 0.05 0.97 0.26 0.82 0.86 0.00 0.00 177.93 180.88 1b6t h ILE 19 N 0.89 1.25 -0.07 2.45 1.08 -1.08 -0.63 117.51 121.40 1b6t h ILE 19 Ca 0.16 -0.81 0.01 0.00 -0.39 0.00 0.00 64.86 63.83 1b6t h ILE 19 Cb 0.52 0.43 -0.01 0.00 -3.07 0.00 0.00 36.82 34.69 1b6t h ILE 19 CO 0.03 0.32 0.02 -0.78 -0.69 0.00 0.00 178.15 177.05 1b6t h ASP 20 N 1.04 0.03 -0.11 1.72 1.82 -0.60 -1.32 116.42 119.00 1b6t h ASP 20 Ca 0.24 0.01 -0.01 0.00 -0.39 0.00 0.00 57.03 56.87 1b6t h ASP 20 Cb 0.24 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.25 1b6t h ASP 20 CO -0.02 0.03 0.03 0.40 -1.61 0.00 0.00 179.24 178.07 1b6t h ILE 21 N 0.06 1.19 -0.10 2.25 1.08 -1.00 -2.39 117.51 118.61 1b6t h ILE 21 Ca 0.03 -0.58 -0.05 0.00 -0.39 0.00 0.00 64.86 63.87 1b6t h ILE 21 Cb 0.01 1.37 -0.01 0.00 -3.07 0.00 0.00 36.82 35.12 1b6t h ILE 21 CO -0.03 0.17 -0.15 1.62 -0.69 0.00 0.00 178.15 179.07 1b6t h VAL 22 N -0.02 1.16 -0.37 1.67 3.04 -1.09 -0.92 116.25 119.72 1b6t h VAL 22 Ca 0.04 -0.73 -0.05 0.00 -1.01 0.00 0.00 66.70 64.94 1b6t h VAL 22 Cb 0.24 1.26 -0.01 0.00 -2.01 0.00 0.00 31.29 30.77 1b6t h VAL 22 CO -0.00 0.22 0.03 0.74 -1.01 0.00 0.00 177.57 177.55 1b6t h THR 23 N 0.14 1.25 -0.56 3.17 2.02 -1.09 -1.29 112.91 116.56 1b6t h THR 23 Ca 0.03 -0.93 -0.05 0.00 0.77 0.00 0.00 66.41 66.23 1b6t h THR 23 Cb 0.36 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 1b6t h THR 23 CO 0.02 0.31 0.14 0.03 0.37 0.00 0.00 175.52 176.39 1b6t h ARG 24 N 0.47 0.85 -0.64 6.66 3.08 -0.88 -2.69 114.38 121.24 1b6t h ARG 24 Ca 0.11 -0.17 -0.07 0.00 0.07 0.00 0.00 59.98 59.92 1b6t h ARG 24 Cb 0.42 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 1b6t h ARG 24 CO 0.01 0.76 0.13 0.00 -1.07 0.00 0.00 179.97 179.80 1b6t h ALA 25 N 1.33 1.01 0.00 0.04 0.00 -0.82 -2.50 119.26 118.32 1b6t h ALA 25 Ca 0.18 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1b6t h ALA 25 Cb 0.29 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1b6t h ALA 25 CO -0.00 0.64 0.00 1.79 0.00 0.00 0.00 179.25 181.67 1b6t h THR 26 N 0.98 0.00 0.00 0.00 1.35 -0.91 -1.49 112.91 112.84 1b6t h THR 26 Ca 0.20 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 1b6t h THR 26 Cb 0.39 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.06 1b6t h THR 26 CO 0.01 0.00 -0.37 1.56 -0.25 0.00 0.00 175.52 176.46 1b6t h GLN 27 N 0.00 0.00 0.00 4.72 4.20 -1.27 -3.36 115.11 119.40 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 0.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 1b6t h GLN 27 CO 0.00 0.00 -0.35 0.00 -0.67 0.00 0.00 178.83 177.81 1b6t n MET 28 N -2.35 4.79 -4.66 1.46 0.00 -0.98 -5.03 117.12 110.35 1b6t n MET 28 Ca 0.04 -0.01 -0.25 0.00 0.00 0.00 0.00 57.70 57.48 1b6t n MET 28 Cb 0.46 -0.73 -0.14 0.00 0.00 0.00 0.00 33.22 32.81 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 -1.48 1.76 0.12 3.17 0.40 -0.60 -5.06 117.98 116.29 1b6t s PHE 29 Ca 0.01 -0.37 -0.26 0.00 -0.60 0.00 0.00 56.93 55.71 1b6t s PHE 29 Cb 0.02 -1.06 -0.07 0.00 0.51 0.00 0.00 43.02 42.43 1b6t s PHE 29 CO 0.13 0.07 1.64 0.22 0.70 0.00 0.00 175.22 177.98 1b6t h ASP 30 N 4.97 -0.71 -3.66 1.36 3.58 -1.86 -3.43 116.42 116.67 1b6t h ASP 30 Ca -0.42 0.09 -0.42 0.00 0.42 0.00 0.00 57.03 56.70 1b6t h ASP 30 Cb 1.16 0.28 -0.32 0.00 1.72 0.00 0.00 39.33 42.17 1b6t h ASP 30 CO 0.44 -0.32 -0.78 -2.28 -2.88 0.00 0.00 179.24 173.42 1b6t s HIS 31 N -6.07 0.91 -0.14 0.28 2.46 -0.90 -4.80 115.29 107.03 1b6t s HIS 31 Ca -0.15 -0.25 0.02 0.00 0.47 0.00 0.00 55.06 55.15 1b6t s HIS 31 Cb 0.09 -0.69 0.01 0.00 -0.13 0.00 0.00 32.58 31.85 1b6t s HIS 31 CO 0.66 -0.14 -0.20 0.08 -2.47 0.00 0.00 174.74 172.67 1b6t s VAL 32 N 0.45 1.92 -0.38 0.89 1.01 -0.01 -0.77 120.40 123.51 1b6t s VAL 32 Ca -0.07 -0.89 -0.15 0.00 0.00 0.00 0.00 61.98 60.87 1b6t s VAL 32 Cb -0.11 -1.71 0.00 0.00 0.00 0.00 0.00 36.38 34.56 1b6t s VAL 32 CO 0.01 0.52 0.31 -0.63 0.00 0.00 0.00 175.10 175.31 1b6t s ILE 33 N 0.93 5.22 -0.61 2.22 1.01 0.48 -0.81 121.20 129.65 1b6t s ILE 33 Ca -0.05 -0.35 -0.23 0.00 0.00 0.00 0.00 60.65 60.01 1b6t s ILE 33 Cb -0.15 -3.86 0.05 0.00 0.01 0.00 0.00 42.46 38.51 1b6t s ILE 33 CO -0.03 -0.20 0.95 -0.22 0.00 0.00 0.00 174.94 175.44 1b6t s LEU 34 N 1.83 4.22 -0.30 2.97 0.20 0.11 -0.36 118.68 127.35 1b6t s LEU 34 Ca 0.08 -0.67 -0.15 0.00 0.69 0.00 0.00 54.13 54.08 1b6t s LEU 34 Cb -0.18 -2.61 -0.03 0.00 -0.43 0.00 0.00 46.19 42.94 1b6t s LEU 34 CO 0.11 -1.34 0.37 0.00 -0.29 0.00 0.00 176.35 175.20 1b6t s ALA 35 N 4.03 3.53 -0.32 5.97 0.00 -0.67 -1.22 121.76 133.07 1b6t s ALA 35 Ca 0.26 -1.01 -0.12 0.00 0.00 0.00 0.00 51.96 51.10 1b6t s ALA 35 Cb -0.15 -2.76 -0.03 0.00 0.00 0.00 0.00 23.12 20.19 1b6t s ALA 35 CO 0.15 -0.85 0.22 0.42 0.00 0.00 0.00 175.76 175.69 1b6t s ILE 36 N 2.05 5.25 0.07 0.00 1.01 0.91 -1.71 121.20 128.78 1b6t s ILE 36 Ca 0.13 -0.10 -0.31 0.00 0.00 0.00 0.00 60.65 60.38 1b6t s ILE 36 Cb -0.16 -3.63 -0.09 0.00 0.01 0.00 0.00 42.46 38.59 1b6t s ILE 36 CO 0.11 0.08 1.76 0.00 0.00 0.00 0.00 174.94 176.89 1b6t s ALA 37 N 1.73 3.69 0.00 9.38 0.00 0.29 -1.31 121.76 135.54 1b6t s ALA 37 Ca 0.06 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.30 1b6t s ALA 37 Cb -0.17 -3.75 0.00 0.00 0.00 0.00 0.00 23.12 19.20 1b6t s ALA 37 CO 0.10 -1.25 0.71 0.00 0.00 0.00 0.00 175.76 175.33 1b6t n ALA 38 N 6.08 -0.33 -3.56 0.00 0.00 0.27 -4.63 120.51 118.33 1b6t n ALA 38 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.20 1b6t n ALA 38 Cb 0.40 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.77 1b6t n ALA 38 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1b6t s SER 39 N -2.18 5.72 0.58 0.00 0.15 -1.26 -4.72 113.70 111.99 1b6t s SER 39 Ca 0.00 -2.05 -0.14 0.00 0.70 0.00 0.00 55.95 54.47 1b6t s SER 39 Cb 0.00 -2.01 -0.05 0.00 -1.71 0.00 0.00 66.02 62.25 1b6t s SER 39 CO 0.00 -0.66 1.02 -2.16 1.20 0.00 0.00 173.24 172.64 1b6t s PRO 40 N 1.16 3.67 0.54 5.44 0.04 -1.26 -4.92 135.00 139.67 1b6t s PRO 40 Ca 0.07 0.89 0.32 0.00 0.04 0.00 0.00 61.00 62.33 1b6t s PRO 40 Cb -0.25 -2.09 1.49 0.00 0.04 0.00 0.00 34.50 33.69 1b6t s PRO 40 CO -0.02 -0.51 1.87 0.66 0.04 0.00 0.00 177.00 179.04 1b6t h SER 41 N 0.24 0.00 -4.59 6.66 4.64 -2.01 -3.39 113.55 115.09 1b6t h SER 41 Ca -0.45 0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 60.17 1b6t h SER 41 Cb 1.19 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.98 1b6t h SER 41 CO 0.61 0.00 -0.89 -0.75 -0.87 0.00 0.00 176.83 174.93 1b6t s LYS 42 N -4.93 2.07 -0.29 4.77 2.20 -1.26 -5.07 119.74 117.23 1b6t s LYS 42 Ca -0.05 -0.92 -0.36 0.00 -0.36 0.00 0.00 55.97 54.28 1b6t s LYS 42 Cb 0.21 -2.01 -0.12 0.00 -1.51 0.00 0.00 37.83 34.40 1b6t s LYS 42 CO 0.76 0.55 2.06 1.63 -0.36 0.00 0.00 175.35 179.99 1b6t n LYS 43 N 2.43 1.32 -1.88 4.03 5.02 -1.26 -4.94 118.16 122.89 1b6t n LYS 43 Ca -0.16 0.41 -0.32 0.00 -2.02 0.00 0.00 58.31 56.22 1b6t n LYS 43 Cb 0.51 -2.47 0.03 0.00 -0.02 0.00 0.00 35.03 33.08 1b6t n LYS 43 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1b6t s PRO 44 N 5.42 3.14 0.10 1.97 0.04 -1.26 -4.98 135.00 139.43 1b6t s PRO 44 Ca 1.04 1.15 -0.19 0.00 0.04 0.00 0.00 61.00 63.05 1b6t s PRO 44 Cb -0.84 -2.01 -0.07 0.00 0.04 0.00 0.00 34.50 31.62 1b6t s PRO 44 CO 0.52 -0.95 1.63 1.98 0.04 0.00 0.00 177.00 180.22 1b6t h MET 45 N 0.06 0.36 -6.19 4.56 1.85 -1.92 -3.43 114.93 110.22 1b6t h MET 45 Ca -0.46 -0.07 -0.61 0.00 -0.61 0.00 0.00 59.70 57.95 1b6t h MET 45 Cb 1.22 -0.06 -0.08 0.00 0.43 0.00 0.00 31.60 33.11 1b6t h MET 45 CO 0.57 0.41 -0.59 -0.06 -0.40 0.00 0.00 176.91 176.84 1b6t s PHE 46 N -5.51 3.18 0.71 1.39 0.40 -1.26 -5.11 117.98 111.77 1b6t s PHE 46 Ca -0.14 0.04 -0.11 0.00 -0.60 0.00 0.00 56.93 56.12 1b6t s PHE 46 Cb 0.08 -1.58 0.01 0.00 0.51 0.00 0.00 43.02 42.04 1b6t s PHE 46 CO 0.72 0.52 1.07 0.95 0.70 0.00 0.00 175.22 179.18 1b6t s THR 47 N -1.53 3.77 0.24 0.64 -4.23 -1.26 -4.77 115.64 108.50 1b6t s THR 47 Ca 0.30 0.58 -0.05 0.00 -1.18 0.00 0.00 61.69 61.33 1b6t s THR 47 Cb -0.11 -3.46 0.20 0.00 1.34 0.00 0.00 72.50 70.46 1b6t s THR 47 CO 0.23 -0.75 1.77 0.25 -0.54 0.00 0.00 174.62 175.57 1b6t h LEU 48 N -0.69 0.47 -0.76 4.79 7.12 -1.93 0.18 115.31 124.49 1b6t h LEU 48 Ca -0.45 0.07 -0.04 0.00 0.13 0.00 0.00 57.88 57.60 1b6t h LEU 48 Cb 1.23 -0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 41.33 1b6t h LEU 48 CO 0.61 0.24 0.33 -0.33 -0.13 0.00 0.00 178.44 179.17 1b6t h GLU 49 N 0.60 1.11 -0.14 1.25 3.07 -1.98 0.10 114.58 118.60 1b6t h GLU 49 Ca 0.39 -0.18 -0.03 0.00 -0.50 0.00 0.00 59.36 59.04 1b6t h GLU 49 Cb 0.46 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 28.18 1b6t h GLU 49 CO -0.31 0.89 -0.02 0.93 -1.40 0.00 0.00 179.01 179.10 1b6t h GLU 50 N 1.08 0.25 -0.85 2.33 5.08 -1.59 -1.27 114.58 119.60 1b6t h GLU 50 Ca 0.26 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1b6t h GLU 50 Cb 0.16 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 1b6t h GLU 50 CO -0.03 0.53 0.53 0.00 -1.00 0.00 0.00 179.01 179.04 1b6t h ARG 51 N -0.04 1.15 -0.34 2.33 3.08 -0.40 0.32 114.38 120.48 1b6t h ARG 51 Ca 0.04 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 59.91 1b6t h ARG 51 Cb 0.43 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1b6t h ARG 51 CO 0.01 0.79 -0.11 0.28 -1.07 0.00 0.00 179.97 179.87 1b6t h VAL 52 N 1.17 1.28 -0.24 2.04 2.07 -0.72 -1.18 116.25 120.67 1b6t h VAL 52 Ca 0.31 -1.20 -0.01 0.00 0.82 0.00 0.00 66.70 66.63 1b6t h VAL 52 Cb -0.07 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1b6t h VAL 52 CO -0.06 0.39 0.13 0.00 0.02 0.00 0.00 177.57 178.05 1b6t h ALA 53 N 0.79 0.31 -0.35 1.67 0.00 -0.72 0.13 119.26 121.09 1b6t h ALA 53 Ca 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1b6t h ALA 53 Cb 0.63 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1b6t h ALA 53 CO 0.04 -0.16 0.22 -0.07 0.00 0.00 0.00 179.25 179.29 1b6t h LEU 54 N 0.27 0.41 -0.72 0.00 3.38 -0.91 -1.25 115.31 116.50 1b6t h LEU 54 Ca 0.08 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1b6t h LEU 54 Cb 0.08 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1b6t h LEU 54 CO -0.01 0.32 0.21 0.00 0.09 0.00 0.00 178.44 179.05 1b6t h ALA 55 N 1.11 0.94 -0.37 1.53 0.00 -1.01 -0.83 119.26 120.64 1b6t h ALA 55 Ca 0.13 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1b6t h ALA 55 Cb -0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1b6t h ALA 55 CO -0.03 0.64 0.22 1.96 0.00 0.00 0.00 179.25 182.04 1b6t h GLN 56 N 1.07 0.50 -0.56 0.00 4.20 -0.44 -1.84 115.11 118.05 1b6t h GLN 56 Ca 0.23 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.86 1b6t h GLN 56 Cb 0.33 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 1b6t h GLN 56 CO -0.00 0.39 0.22 0.37 -0.67 0.00 0.00 178.83 179.13 1b6t h GLN 57 N 0.47 0.84 0.00 1.46 5.75 -1.00 -0.41 115.11 122.22 1b6t h GLN 57 Ca 0.13 -0.15 -0.01 0.00 -0.15 0.00 0.00 58.65 58.47 1b6t h GLN 57 Cb 0.02 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 28.43 1b6t h GLN 57 CO -0.02 0.73 -0.05 0.00 -2.65 0.00 0.00 178.83 176.83 1b6t h ALA 58 N 1.07 1.05 -0.13 3.38 0.00 -0.92 -2.96 119.26 120.74 1b6t h ALA 58 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1b6t h ALA 58 Cb 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1b6t h ALA 58 CO -0.01 0.07 0.00 0.25 0.00 0.00 0.00 179.25 179.55 1b6t n THR 59 N -3.23 1.05 -0.15 0.00 -2.24 -0.71 -4.70 114.28 104.31 1b6t n THR 59 Ca -0.01 -1.06 0.23 0.00 -2.27 0.00 0.00 64.05 60.95 1b6t n THR 59 Cb 0.27 0.46 0.65 0.00 -2.10 0.00 0.00 70.33 69.61 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 0.77 2.56 0.00 6.98 0.00 -0.90 0.12 119.26 128.80 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 0.62 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1b6t h ALA 60 CO 0.00 -0.79 0.00 1.12 0.00 0.00 0.00 179.25 179.58 1b6t h HIS 61 N 0.13 0.00 -3.13 0.00 2.07 -1.84 -3.41 115.15 108.96 1b6t h HIS 61 Ca 0.39 0.00 -0.70 0.00 -2.85 0.00 0.00 60.37 57.21 1b6t h HIS 61 Cb 1.35 0.00 -0.19 0.00 2.57 0.00 0.00 27.41 31.14 1b6t h HIS 61 CO -0.00 0.00 0.04 -0.51 -3.07 0.00 0.00 177.93 174.39 1b6t s LEU 62 N -4.65 5.18 0.19 6.12 1.43 0.42 -4.96 118.68 122.41 1b6t s LEU 62 Ca 0.08 -1.14 -0.12 0.00 -1.03 0.00 0.00 54.13 51.93 1b6t s LEU 62 Cb 0.11 -2.37 0.19 0.00 0.03 0.00 0.00 46.19 44.14 1b6t s LEU 62 CO 0.53 -0.95 1.78 1.23 0.23 0.00 0.00 176.35 179.17 1b6t h GLY 63 N 9.71 0.79 -2.37 -3.19 0.00 -1.82 -2.85 103.07 103.34 1b6t h GLY 63 Ca -0.28 -0.18 -0.11 0.00 0.00 0.00 0.00 47.33 46.76 1b6t h GLY 63 CO 1.01 0.09 0.14 1.16 0.00 0.00 0.00 176.54 178.94 1b6t n ASN 64 N -4.89 3.02 -4.43 0.19 6.94 -1.26 -4.82 115.26 110.01 1b6t n ASN 64 Ca 0.06 -2.47 -0.33 0.00 -0.02 0.00 0.00 54.58 51.82 1b6t n ASN 64 Cb 0.17 -0.60 -0.13 0.00 -2.36 0.00 0.00 39.78 36.86 1b6t n ASN 64 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1b6t s VAL 65 N -1.35 3.47 -0.17 3.53 1.01 -1.08 -0.83 120.40 124.99 1b6t s VAL 65 Ca 0.20 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1b6t s VAL 65 Cb 0.16 -2.49 0.02 0.00 0.00 0.00 0.00 36.38 34.07 1b6t s VAL 65 CO 0.05 0.51 -0.18 -0.70 0.00 0.00 0.00 175.10 174.77 1b6t s GLU 66 N 0.39 2.73 -0.19 2.72 2.12 0.01 -4.99 118.70 121.50 1b6t s GLU 66 Ca -0.07 -0.73 -0.17 0.00 0.36 0.00 0.00 54.97 54.36 1b6t s GLU 66 Cb -0.15 -2.40 -0.04 0.00 0.26 0.00 0.00 34.13 31.81 1b6t s GLU 66 CO 0.04 -0.22 0.44 0.08 -0.54 0.00 0.00 175.26 175.06 1b6t s VAL 67 N 1.36 5.17 0.02 3.70 1.01 -1.26 0.09 120.40 130.49 1b6t s VAL 67 Ca 0.05 0.80 -0.02 0.00 0.00 0.00 0.00 61.98 62.81 1b6t s VAL 67 Cb -0.13 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.47 1b6t s VAL 67 CO -0.12 0.24 0.03 -0.69 0.00 0.00 0.00 175.10 174.56 1b6t s VAL 68 N 1.32 0.11 0.17 2.92 1.01 -0.35 -4.96 120.40 120.61 1b6t s VAL 68 Ca 0.21 -0.92 0.04 0.00 0.00 0.00 0.00 61.98 61.32 1b6t s VAL 68 Cb -0.15 -0.43 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 1b6t s VAL 68 CO 0.09 -0.50 0.20 -0.83 0.00 0.00 0.00 175.10 174.06 1b6t s GLY 69 N -1.58 1.67 0.01 4.51 0.00 -1.26 -0.06 107.32 110.61 1b6t s GLY 69 Ca -0.13 -1.16 -0.15 0.00 0.00 0.00 0.00 44.72 43.28 1b6t s GLY 69 CO -0.01 -1.17 0.32 -0.11 0.00 0.00 0.00 173.10 172.13 1b6t s PHE 70 N -1.78 -0.17 0.00 1.90 -0.71 -0.42 -4.84 117.98 111.96 1b6t s PHE 70 Ca 0.32 0.16 0.00 0.00 -1.04 0.00 0.00 56.93 56.38 1b6t s PHE 70 Cb -0.10 0.11 0.00 0.00 -1.21 0.00 0.00 43.02 41.82 1b6t s PHE 70 CO 0.26 -0.45 0.00 -1.13 -1.34 0.00 0.00 175.22 172.55 1b6t n SER 71 N 0.93 3.47 -4.11 1.98 3.41 -1.26 0.94 113.62 118.98 1b6t n SER 71 Ca -0.20 -0.15 -0.28 0.00 -0.26 0.00 0.00 58.87 57.98 1b6t n SER 71 Cb 0.58 1.00 0.18 0.00 -0.26 0.00 0.00 64.21 65.70 1b6t n SER 71 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1b6t n ASP 72 N -1.35 0.49 -4.67 4.04 4.64 -1.26 -4.82 116.55 113.63 1b6t n ASP 72 Ca 0.00 -1.69 -0.44 0.00 -1.38 0.00 0.00 54.79 51.28 1b6t n ASP 72 Cb 0.00 -0.91 -0.02 0.00 -1.04 0.00 0.00 41.12 39.16 1b6t n ASP 72 CO 0.00 0.00 0.00 -0.11 -0.82 0.00 0.00 177.20 176.27 1b6t n LEU 73 N 0.00 3.05 -0.25 -2.67 7.94 -1.26 -4.82 117.00 118.99 1b6t n LEU 73 Ca 0.17 1.18 0.03 0.00 -1.11 0.00 0.00 56.01 56.27 1b6t n LEU 73 Cb 0.58 -1.42 0.16 0.00 0.53 0.00 0.00 43.42 43.27 1b6t n LEU 73 CO 0.42 -0.65 1.05 -0.03 -1.11 0.00 0.00 177.39 177.06 1b6t h MET 74 N 3.11 0.53 -0.67 1.96 1.85 -1.99 -1.57 114.93 118.15 1b6t h MET 74 Ca -0.45 -0.03 -0.01 0.00 -0.61 0.00 0.00 59.70 58.60 1b6t h MET 74 Cb 1.29 -0.12 -0.03 0.00 0.43 0.00 0.00 31.60 33.17 1b6t h MET 74 CO 0.67 0.35 0.38 0.00 -0.40 0.00 0.00 176.91 177.92 1b6t h ALA 75 N 1.47 1.41 -0.66 0.39 0.00 -1.96 0.14 119.26 120.04 1b6t h ALA 75 Ca 0.37 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 1b6t h ALA 75 Cb 0.46 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1b6t h ALA 75 CO -0.31 0.50 0.10 -0.91 0.00 0.00 0.00 179.25 178.62 1b6t h ASN 76 N 0.93 1.05 -0.14 0.00 2.35 -1.65 -0.80 115.58 117.32 1b6t h ASN 76 Ca 0.24 -0.25 -0.05 0.00 -0.55 0.00 0.00 56.30 55.69 1b6t h ASN 76 Cb -0.00 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.09 1b6t h ASN 76 CO -0.04 1.04 -0.11 0.15 -1.65 0.00 0.00 177.43 176.82 1b6t h PHE 77 N 1.02 0.39 -0.94 1.19 3.57 -0.97 -2.37 116.94 118.83 1b6t h PHE 77 Ca 0.20 -0.11 0.09 0.00 3.53 0.00 0.00 57.97 61.68 1b6t h PHE 77 Cb 0.45 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 39.03 1b6t h PHE 77 CO 0.03 0.70 0.58 0.00 -2.23 0.00 0.00 178.31 177.40 1b6t h ALA 78 N 0.63 1.34 0.03 2.41 0.00 -0.60 -0.17 119.26 122.90 1b6t h ALA 78 Ca 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1b6t h ALA 78 Cb 0.62 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1b6t h ALA 78 CO 0.03 0.28 -0.02 -0.09 0.00 0.00 0.00 179.25 179.45 1b6t h ARG 79 N 1.00 -0.04 0.00 0.00 2.43 -1.05 -1.30 114.38 115.42 1b6t h ARG 79 Ca 0.43 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.59 1b6t h ARG 79 Cb 0.30 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1b6t h ARG 79 CO -0.22 0.13 -0.10 -0.91 -1.51 0.00 0.00 179.97 177.37 1b6t h ASN 80 N -0.21 0.00 0.25 -3.80 -0.26 -0.92 -1.31 115.58 109.33 1b6t h ASN 80 Ca -0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1b6t h ASN 80 Cb 0.20 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.46 1b6t h ASN 80 CO 0.01 0.10 -0.18 0.00 -1.06 0.00 0.00 177.43 176.30 1b6t n GLN 81 N -3.67 0.87 -3.30 0.81 1.13 -0.12 -4.95 117.38 108.15 1b6t n GLN 81 Ca -0.02 -0.45 -0.21 0.00 -1.94 0.00 0.00 57.00 54.38 1b6t n GLN 81 Cb 0.21 -1.49 0.06 0.00 0.11 0.00 0.00 30.24 29.13 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 -0.67 -2.33 -3.06 1.08 8.25 -0.49 -4.99 115.22 113.00 1b6t n HIS 82 Ca 0.14 0.76 -0.36 0.00 -0.26 0.00 0.00 57.72 58.00 1b6t n HIS 82 Cb 0.32 -4.50 -0.06 0.00 1.12 0.00 0.00 29.99 26.87 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 -3.23 3.39 0.00 -1.41 0.00 -0.66 -4.69 121.76 115.16 1b6t s ALA 83 Ca 0.44 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.61 1b6t s ALA 83 Cb -0.19 -2.86 0.00 0.00 0.00 0.00 0.00 23.12 20.06 1b6t s ALA 83 CO 0.55 0.31 0.17 0.25 0.00 0.00 0.00 175.76 177.04 1b6t n THR 84 N 0.73 0.00 -4.83 0.00 -2.24 -0.38 -4.65 114.28 102.91 1b6t n THR 84 Ca -0.02 -0.47 -0.27 0.00 -2.27 0.00 0.00 64.05 61.03 1b6t n THR 84 Cb 0.51 1.03 -0.16 0.00 -2.10 0.00 0.00 70.33 69.60 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 -0.59 1.45 -0.30 2.28 1.01 -1.11 -0.61 120.40 122.52 1b6t s VAL 85 Ca 0.00 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.26 1b6t s VAL 85 Cb 0.00 -1.27 0.05 0.00 0.00 0.00 0.00 36.38 35.16 1b6t s VAL 85 CO 0.00 0.42 0.01 -0.22 0.00 0.00 0.00 175.10 175.31 1b6t s LEU 86 N 0.29 3.87 -0.09 3.92 2.96 0.22 -0.40 118.68 129.46 1b6t s LEU 86 Ca -0.10 -1.21 -0.27 0.00 -0.22 0.00 0.00 54.13 52.33 1b6t s LEU 86 Cb -0.14 -1.73 -0.02 0.00 0.50 0.00 0.00 46.19 44.80 1b6t s LEU 86 CO 0.04 -0.25 0.88 -0.63 -1.32 0.00 0.00 176.35 175.07 1b6t s ILE 87 N 1.28 4.89 -0.06 6.68 -1.09 0.70 -0.72 121.20 132.89 1b6t s ILE 87 Ca -0.04 1.80 0.03 0.00 -2.23 0.00 0.00 60.65 60.21 1b6t s ILE 87 Cb -0.19 -4.21 0.00 0.00 -1.58 0.00 0.00 42.46 36.48 1b6t s ILE 87 CO -0.01 0.11 -0.15 -0.13 -1.23 0.00 0.00 174.94 173.52 1b6t s ARG 88 N 1.52 1.82 -0.12 2.79 1.81 -0.17 -4.36 118.95 122.23 1b6t s ARG 88 Ca 0.44 -0.54 -0.17 0.00 -1.72 0.00 0.00 55.73 53.75 1b6t s ARG 88 Cb -0.18 -1.52 -0.04 0.00 -0.45 0.00 0.00 34.95 32.75 1b6t s ARG 88 CO 0.19 0.14 0.42 0.20 -0.68 0.00 0.00 175.30 175.57 1b6t s GLY 89 N 0.33 2.35 -0.42 -3.53 0.00 -1.26 -1.21 107.32 103.58 1b6t s GLY 89 Ca -0.10 -0.26 -0.04 0.00 0.00 0.00 0.00 44.72 44.32 1b6t s GLY 89 CO 0.03 0.63 0.23 1.08 0.00 0.00 0.00 173.10 175.08 1b6t s LEU 90 N 0.47 5.34 0.77 0.66 1.43 0.04 -4.92 118.68 122.47 1b6t s LEU 90 Ca 0.23 -2.01 -0.12 0.00 -1.03 0.00 0.00 54.13 51.20 1b6t s LEU 90 Cb -0.15 -1.86 0.05 0.00 0.03 0.00 0.00 46.19 44.27 1b6t s LEU 90 CO 0.09 -0.57 1.12 -0.13 0.23 0.00 0.00 176.35 177.08 1b6t s ARG 91 N 1.18 2.32 0.54 1.70 0.52 -1.26 -4.30 118.95 119.65 1b6t s ARG 91 Ca 0.08 0.43 0.31 0.00 -0.52 0.00 0.00 55.73 56.02 1b6t s ARG 91 Cb -0.23 -1.96 1.51 0.00 0.52 0.00 0.00 34.95 34.78 1b6t s ARG 91 CO -0.04 -1.41 2.06 0.00 0.02 0.00 0.00 175.30 175.94 1b6t h ALA 92 N -0.93 1.13 -0.49 2.13 0.00 -1.47 -2.24 119.26 117.39 1b6t h ALA 92 Ca -0.46 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.36 1b6t h ALA 92 Cb 1.28 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 1b6t h ALA 92 CO 0.63 0.11 0.00 1.33 0.00 0.00 0.00 179.25 181.32 1b6t n VAL 93 N -3.39 2.66 -2.19 0.00 0.24 -1.20 -5.00 118.33 109.46 1b6t n VAL 93 Ca -0.01 -1.55 -0.34 0.00 -2.04 0.00 0.00 64.34 60.41 1b6t n VAL 93 Cb 0.26 -0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.35 1b6t n VAL 93 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1b6t s ALA 94 N -2.80 2.72 -0.84 2.33 0.00 -0.85 -4.95 121.76 117.38 1b6t s ALA 94 Ca 0.52 0.59 -0.20 0.00 0.00 0.00 0.00 51.96 52.86 1b6t s ALA 94 Cb 0.40 -3.28 0.10 0.00 0.00 0.00 0.00 23.12 20.34 1b6t s ALA 94 CO 0.14 -0.74 1.10 0.34 0.00 0.00 0.00 175.76 176.60 1b6t s ASP 95 N -2.27 6.46 0.24 0.00 3.68 -1.26 -4.87 116.67 118.65 1b6t s ASP 95 Ca 0.67 -1.63 -0.06 0.00 2.13 0.00 0.00 52.55 53.66 1b6t s ASP 95 Cb -0.19 -2.42 0.29 0.00 -1.45 0.00 0.00 42.92 39.15 1b6t s ASP 95 CO 0.30 -1.23 1.89 0.15 0.13 0.00 0.00 175.17 176.41 1b6t h PHE 96 N 9.17 1.12 -0.80 -5.34 3.57 -1.96 -2.02 116.94 120.68 1b6t h PHE 96 Ca 0.01 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.58 1b6t h PHE 96 Cb 1.04 -0.37 -0.05 0.00 2.79 0.00 0.00 35.95 39.35 1b6t h PHE 96 CO 1.11 0.64 0.51 0.93 -2.23 0.00 0.00 178.31 179.27 1b6t h GLU 97 N 1.16 0.94 -0.63 1.11 3.07 -2.00 -0.85 114.58 117.38 1b6t h GLU 97 Ca 0.37 -0.06 -0.08 0.00 -0.50 0.00 0.00 59.36 59.09 1b6t h GLU 97 Cb 0.01 -0.21 -0.03 0.00 -0.84 0.00 0.00 28.75 27.68 1b6t h GLU 97 CO -0.12 0.62 0.09 -0.92 -1.40 0.00 0.00 179.01 177.28 1b6t h TYR 98 N 0.97 1.11 -0.48 4.33 5.03 -1.82 -1.55 116.97 124.55 1b6t h TYR 98 Ca 0.33 -0.15 -0.04 0.00 2.58 0.00 0.00 58.73 61.45 1b6t h TYR 98 Cb 0.06 -0.30 -0.02 0.00 1.55 0.00 0.00 36.73 38.01 1b6t h TYR 98 CO -0.03 0.94 0.14 0.93 -1.32 0.00 0.00 178.16 178.82 1b6t h GLU 99 N 0.98 0.71 -0.43 1.82 4.39 -0.63 -0.43 114.58 120.98 1b6t h GLU 99 Ca 0.19 -0.12 -0.14 0.00 0.34 0.00 0.00 59.36 59.63 1b6t h GLU 99 Cb 0.44 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 1b6t h GLU 99 CO 0.01 0.63 -0.26 0.52 -1.16 0.00 0.00 179.01 178.75 1b6t h MET 100 N 0.70 0.93 0.03 2.33 2.86 -0.70 -0.54 114.93 120.53 1b6t h MET 100 Ca 0.16 -0.43 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 1b6t h MET 100 Cb 0.23 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1b6t h MET 100 CO -0.01 1.09 -0.04 1.96 1.06 0.00 0.00 176.91 180.97 1b6t h GLN 101 N 0.77 -0.09 -0.22 1.72 4.20 -0.70 -1.58 115.11 119.21 1b6t h GLN 101 Ca 0.09 0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.82 1b6t h GLN 101 Cb 0.84 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.62 1b6t h GLN 101 CO 0.07 -0.06 0.12 1.25 -0.67 0.00 0.00 178.83 179.54 1b6t h LEU 102 N -0.09 0.18 -0.83 1.46 5.85 -1.02 -0.34 115.31 120.52 1b6t h LEU 102 Ca 0.01 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 1b6t h LEU 102 Cb 0.09 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 1b6t h LEU 102 CO -0.02 0.13 0.35 0.00 -0.34 0.00 0.00 178.44 178.56 1b6t h ALA 103 N 1.11 1.08 -0.15 1.25 0.00 -1.00 0.11 119.26 121.66 1b6t h ALA 103 Ca 0.09 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.65 1b6t h ALA 103 Cb 0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1b6t h ALA 103 CO -0.06 0.67 -0.59 0.45 0.00 0.00 0.00 179.25 179.72 1b6t h HIS 104 N 1.18 0.61 -0.26 0.00 3.86 -1.06 0.15 115.15 119.63 1b6t h HIS 104 Ca 0.27 -0.23 -0.06 0.00 -1.16 0.00 0.00 60.37 59.20 1b6t h HIS 104 Cb 0.18 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 1b6t h HIS 104 CO 0.02 0.95 -0.06 1.98 0.86 0.00 0.00 177.93 181.67 1b6t h MET 105 N 0.36 0.51 -0.30 2.45 -1.53 -0.69 -0.82 114.93 114.92 1b6t h MET 105 Ca -0.00 -0.19 -0.03 0.00 -3.44 0.00 0.00 59.70 56.04 1b6t h MET 105 Cb 1.13 -0.03 -0.02 0.00 -0.55 0.00 0.00 31.60 32.13 1b6t h MET 105 CO 0.11 0.72 0.07 -0.91 0.14 0.00 0.00 176.91 177.04 1b6t h ASN 106 N 0.26 0.39 -0.22 1.39 2.35 -0.69 -0.85 115.58 118.21 1b6t h ASN 106 Ca 0.07 -0.05 -0.14 0.00 -0.55 0.00 0.00 56.30 55.63 1b6t h ASN 106 Cb 0.53 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.79 1b6t h ASN 106 CO 0.03 0.40 -0.35 -0.09 -1.65 0.00 0.00 177.43 175.77 1b6t h ARG 107 N 0.42 0.74 -0.27 0.81 2.43 -0.68 0.49 114.38 118.34 1b6t h ARG 107 Ca 0.10 -0.36 -0.01 0.00 -0.81 0.00 0.00 59.98 58.90 1b6t h ARG 107 Cb 0.17 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1b6t h ARG 107 CO -0.00 0.98 0.11 1.25 -1.51 0.00 0.00 179.97 180.80 1b6t h HIS 108 N 0.62 0.40 -0.43 2.20 2.76 -0.34 -1.85 115.15 118.53 1b6t h HIS 108 Ca 0.06 -0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.13 1b6t h HIS 108 Cb 0.88 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 29.71 1b6t h HIS 108 CO 0.05 0.40 -0.04 -0.07 -1.30 0.00 0.00 177.93 176.96 1b6t h LEU 109 N 0.29 0.78 -6.29 0.26 3.38 -1.03 -3.40 115.31 109.29 1b6t h LEU 109 Ca 0.09 -0.33 -0.45 0.00 0.09 0.00 0.00 57.88 57.28 1b6t h LEU 109 Cb 0.16 -0.21 -0.33 0.00 0.09 0.00 0.00 40.66 40.37 1b6t h LEU 109 CO -0.01 0.92 -0.77 -0.32 0.09 0.00 0.00 178.44 178.35 1b6t s MET 110 N -4.91 0.72 0.60 1.13 0.00 0.15 -5.00 119.30 111.98 1b6t s MET 110 Ca -0.13 -1.28 0.34 0.00 0.00 0.00 0.00 55.69 54.62 1b6t s MET 110 Cb 0.11 -0.95 1.90 0.00 0.00 0.00 0.00 34.83 35.88 1b6t s MET 110 CO 0.81 -1.26 2.24 -1.00 0.00 0.00 0.00 175.02 175.81 1b6t h PRO 111 N 6.53 0.00 0.00 4.11 0.13 -1.53 -1.70 132.00 139.54 1b6t h PRO 111 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1b6t h PRO 111 Cb 1.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.14 1b6t h PRO 111 CO 0.23 0.03 0.00 -0.85 -0.23 0.00 0.00 178.00 177.18 1b6t n GLU 112 N -3.53 0.34 -3.61 0.86 0.00 -1.26 -4.50 120.64 108.95 1b6t n GLU 112 Ca -0.03 0.07 -0.40 0.00 0.00 0.00 0.00 57.16 56.81 1b6t n GLU 112 Cb 0.13 -1.50 -0.11 0.00 0.00 0.00 0.00 31.44 29.96 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 -2.52 4.60 -0.22 -1.84 2.96 -0.64 -4.54 118.68 116.48 1b6t s LEU 113 Ca 0.22 -0.89 -0.17 0.00 -0.22 0.00 0.00 54.13 53.06 1b6t s LEU 113 Cb 0.15 -2.02 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 1b6t s LEU 113 CO 0.33 -0.35 0.46 -0.70 -1.32 0.00 0.00 176.35 174.77 1b6t s GLU 114 N 1.57 4.14 0.16 1.98 2.56 0.21 -4.76 118.70 124.56 1b6t s GLU 114 Ca 0.03 0.28 -0.30 0.00 0.00 0.00 0.00 54.97 54.98 1b6t s GLU 114 Cb -0.19 -3.58 -0.08 0.00 2.00 0.00 0.00 34.13 32.28 1b6t s GLU 114 CO 0.07 -0.17 1.21 -1.12 -0.56 0.00 0.00 175.26 174.68 1b6t s SER 115 N 1.26 7.07 -0.07 -1.70 0.01 -1.26 -0.61 113.70 118.41 1b6t s SER 115 Ca 0.21 2.19 0.01 0.00 1.31 0.00 0.00 55.95 59.67 1b6t s SER 115 Cb -0.15 -2.60 0.02 0.00 0.21 0.00 0.00 66.02 63.50 1b6t s SER 115 CO 0.09 -0.40 -0.06 -0.69 0.41 0.00 0.00 173.24 172.58 1b6t s VAL 116 N 0.21 0.77 -0.21 3.43 1.01 0.10 -4.90 120.40 120.82 1b6t s VAL 116 Ca 0.54 -0.20 -0.08 0.00 0.00 0.00 0.00 61.98 62.25 1b6t s VAL 116 Cb -0.32 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 1b6t s VAL 116 CO 0.35 0.30 0.07 -0.36 0.00 0.00 0.00 175.10 175.46 1b6t s PHE 117 N 1.23 3.20 0.15 5.22 0.08 -1.26 -1.00 117.98 125.60 1b6t s PHE 117 Ca -0.05 -0.05 0.07 0.00 0.12 0.00 0.00 56.93 57.01 1b6t s PHE 117 Cb -0.14 -2.14 -0.04 0.00 -0.57 0.00 0.00 43.02 40.13 1b6t s PHE 117 CO -0.02 -0.01 -0.01 -0.51 -0.10 0.00 0.00 175.22 174.58 1b6t s LEU 118 N 0.81 3.33 -0.16 -0.37 1.43 -0.35 -4.94 118.68 118.43 1b6t s LEU 118 Ca 0.04 -0.33 -0.03 0.00 -1.03 0.00 0.00 54.13 52.78 1b6t s LEU 118 Cb -0.13 -2.02 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 1b6t s LEU 118 CO 0.02 0.12 -0.06 -0.04 0.23 0.00 0.00 176.35 176.62 1b6t s MET 119 N -2.71 3.53 0.96 1.70 -1.94 -1.26 -0.78 119.30 118.80 1b6t s MET 119 Ca 0.26 -0.59 -0.13 0.00 -1.71 0.00 0.00 55.69 53.52 1b6t s MET 119 Cb -0.10 -2.86 0.17 0.00 2.01 0.00 0.00 34.83 34.05 1b6t s MET 119 CO 0.18 0.14 1.13 -1.25 -0.01 0.00 0.00 175.02 175.21 1b6t s PRO 120 N 0.60 0.71 0.83 2.03 0.04 -1.26 -4.98 135.00 132.98 1b6t s PRO 120 Ca -0.04 0.27 -0.11 0.00 0.04 0.00 0.00 61.00 61.16 1b6t s PRO 120 Cb -0.15 -1.79 0.09 0.00 0.04 0.00 0.00 34.50 32.69 1b6t s PRO 120 CO 0.03 -2.48 1.10 -1.54 0.04 0.00 0.00 177.00 174.14 1b6t s SER 121 N -3.93 3.92 0.43 6.66 1.04 -1.26 -4.80 113.70 115.76 1b6t s SER 121 Ca 0.65 1.79 0.13 0.00 0.48 0.00 0.00 55.95 59.00 1b6t s SER 121 Cb -0.15 -2.44 1.01 0.00 0.10 0.00 0.00 66.02 64.54 1b6t s SER 121 CO 0.55 -2.40 1.97 0.11 0.98 0.00 0.00 173.24 174.44 1b6t h LYS 122 N -1.38 0.43 -0.87 4.02 1.57 -1.99 -2.12 116.57 116.23 1b6t h LYS 122 Ca -0.45 -0.03 0.12 0.00 -1.87 0.00 0.00 60.65 58.42 1b6t h LYS 122 Cb 1.25 -0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.40 1b6t h LYS 122 CO 0.51 0.29 0.56 1.49 -0.57 0.00 0.00 179.45 181.72 1b6t h GLU 123 N 0.44 0.73 -0.33 3.15 4.57 -2.04 -2.44 114.58 118.68 1b6t h GLU 123 Ca 0.30 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.44 1b6t h GLU 123 Cb 0.58 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 1b6t h GLU 123 CO -0.09 0.49 0.00 0.91 -1.18 0.00 0.00 179.01 179.14 1b6t n TRP 124 N -4.54 0.66 0.77 0.92 5.03 -0.83 -4.67 117.44 114.77 1b6t n TRP 124 Ca 0.16 -0.63 0.12 0.00 3.03 0.00 0.00 57.50 60.18 1b6t n TRP 124 Cb 0.39 -0.13 0.50 0.00 -1.03 0.00 0.00 31.31 31.04 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 0.18 0.17 -0.03 -0.99 7.64 -0.92 -3.65 113.62 116.02 1b6t n SER 125 Ca 0.15 0.52 0.02 0.00 1.01 0.00 0.00 58.87 60.58 1b6t n SER 125 Cb 0.60 -0.57 0.03 0.00 -1.01 0.00 0.00 64.21 63.26 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 -1.67 0.02 -4.62 1.43 3.01 -1.26 -1.11 117.46 113.26 1b6t n PHE 126 Ca 0.05 -0.59 -0.33 0.00 1.01 0.00 0.00 57.45 57.59 1b6t n PHE 126 Cb 0.30 -0.07 -0.13 0.00 -0.01 0.00 0.00 39.48 39.57 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 -1.34 3.48 0.06 4.37 -4.36 -1.24 -4.96 121.20 117.21 1b6t s ILE 127 Ca 0.06 -0.52 0.06 0.00 -0.26 0.00 0.00 60.65 59.99 1b6t s ILE 127 Cb 0.05 -2.47 -0.04 0.00 1.25 0.00 0.00 42.46 41.25 1b6t s ILE 127 CO 0.01 0.53 -0.11 -0.94 0.24 0.00 0.00 174.94 174.67 1b6t s SER 128 N 0.11 4.35 0.32 4.36 1.04 -1.26 -5.01 113.70 117.61 1b6t s SER 128 Ca -0.04 -0.32 0.02 0.00 0.48 0.00 0.00 55.95 56.09 1b6t s SER 128 Cb -0.14 -0.87 0.58 0.00 0.10 0.00 0.00 66.02 65.69 1b6t s SER 128 CO 0.04 0.23 1.94 0.28 0.98 0.00 0.00 173.24 176.71 1b6t h SER 129 N 4.08 0.83 -0.30 7.02 0.02 -1.96 -1.62 113.55 121.62 1b6t h SER 129 Ca -0.48 -0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.50 1b6t h SER 129 Cb 1.16 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 63.49 1b6t h SER 129 CO 0.52 0.55 0.11 -1.28 -1.14 0.00 0.00 176.83 175.59 1b6t h SER 130 N 0.96 0.12 -0.58 3.07 0.87 -1.95 -0.65 113.55 115.38 1b6t h SER 130 Ca 0.34 0.03 -0.11 0.00 -1.23 0.00 0.00 61.79 60.82 1b6t h SER 130 Cb 0.13 0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.09 1b6t h SER 130 CO -0.11 0.10 -0.06 0.25 -0.53 0.00 0.00 176.83 176.48 1b6t h LEU 131 N 0.24 1.05 -0.51 2.23 6.46 -1.83 -1.54 115.31 121.41 1b6t h LEU 131 Ca 0.13 -0.33 0.04 0.00 -0.12 0.00 0.00 57.88 57.60 1b6t h LEU 131 Cb 0.10 -0.28 -0.04 0.00 -0.73 0.00 0.00 40.66 39.71 1b6t h LEU 131 CO -0.14 1.13 0.28 0.58 -0.62 0.00 0.00 178.44 179.67 1b6t h VAL 132 N 0.95 1.00 -0.26 1.05 2.07 -0.86 -0.81 116.25 119.39 1b6t h VAL 132 Ca 0.16 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.46 1b6t h VAL 132 Cb 0.63 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1b6t h VAL 132 CO 0.04 0.10 0.04 0.11 0.02 0.00 0.00 177.57 177.88 1b6t h LYS 133 N 0.54 0.43 -0.32 1.57 1.57 -0.92 -1.31 116.57 118.13 1b6t h LYS 133 Ca 0.22 -0.12 0.04 0.00 -1.87 0.00 0.00 60.65 58.92 1b6t h LYS 133 Cb 0.09 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 1b6t h LYS 133 CO -0.13 0.56 0.08 1.49 -0.57 0.00 0.00 179.45 180.88 1b6t h GLU 134 N 0.24 0.19 -0.26 3.15 4.81 -1.02 0.13 114.58 121.82 1b6t h GLU 134 Ca 0.08 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1b6t h GLU 134 Cb 0.34 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 1b6t h GLU 134 CO 0.01 0.13 0.15 0.28 -0.73 0.00 0.00 179.01 178.84 1b6t h VAL 135 N 0.20 1.11 -0.46 0.32 2.07 -1.09 -1.72 116.25 116.68 1b6t h VAL 135 Ca 0.15 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.40 1b6t h VAL 135 Cb 0.15 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1b6t h VAL 135 CO -0.19 0.11 0.30 0.00 0.02 0.00 0.00 177.57 177.81 1b6t h ALA 136 N 1.03 0.58 0.00 1.67 0.00 -0.80 -0.25 119.26 121.48 1b6t h ALA 136 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1b6t h ALA 136 Cb 0.04 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1b6t h ALA 136 CO -0.02 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1b6t h ARG 137 N 0.61 0.00 -0.60 0.00 3.08 -0.52 -2.75 114.38 114.19 1b6t h ARG 137 Ca 0.17 0.00 -0.38 0.00 0.07 0.00 0.00 59.98 59.84 1b6t h ARG 137 Cb -0.06 0.00 -0.23 0.00 0.08 0.00 0.00 29.97 29.76 1b6t h ARG 137 CO -0.04 0.00 -0.05 0.72 -1.07 0.00 0.00 179.97 179.53 1b6t n HIS 138 N -3.02 1.99 -2.96 3.04 8.25 -0.53 -4.96 115.22 117.02 1b6t n HIS 138 Ca -0.01 -2.03 -0.17 0.00 -0.26 0.00 0.00 57.72 55.25 1b6t n HIS 138 Cb 0.17 -0.65 0.04 0.00 1.12 0.00 0.00 29.99 30.66 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 -0.99 -4.34 -4.18 -0.41 6.02 -1.04 -4.99 117.38 107.45 1b6t n GLN 139 Ca 0.43 0.68 -0.26 0.00 -0.01 0.00 0.00 57.00 57.83 1b6t n GLN 139 Cb 0.99 -5.09 -0.07 0.00 1.02 0.00 0.00 30.24 27.10 1b6t n GLN 139 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1b6t s GLY 140 N -2.90 1.72 -0.33 1.08 0.00 -0.22 -5.02 107.32 101.64 1b6t s GLY 140 Ca 0.29 -1.35 -0.23 0.00 0.00 0.00 0.00 44.72 43.42 1b6t s GLY 140 CO 0.35 -1.37 0.80 -0.35 0.00 0.00 0.00 173.10 172.53 1b6t s ASP 141 N -3.02 6.62 -0.07 1.64 3.68 -1.26 -4.24 116.67 120.02 1b6t s ASP 141 Ca 0.28 0.55 0.10 0.00 2.13 0.00 0.00 52.55 55.61 1b6t s ASP 141 Cb -0.09 -2.41 0.15 0.00 -1.45 0.00 0.00 42.92 39.12 1b6t s ASP 141 CO 0.20 -0.67 1.06 1.33 0.13 0.00 0.00 175.17 177.21 1b6t n VAL 142 N 5.66 1.37 -0.32 1.11 0.24 -1.26 -4.78 118.33 120.35 1b6t n VAL 142 Ca 0.04 -1.57 0.11 0.00 -2.04 0.00 0.00 64.34 60.88 1b6t n VAL 142 Cb 0.48 0.13 0.28 0.00 -1.47 0.00 0.00 33.84 33.27 1b6t n VAL 142 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1b6t h THR 143 N 0.54 0.66 -0.48 3.34 2.02 -1.93 -1.67 112.91 115.39 1b6t h THR 143 Ca 0.00 -0.22 0.12 0.00 0.77 0.00 0.00 66.41 67.09 1b6t h THR 143 Cb 0.84 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1b6t h THR 143 CO 0.00 0.11 0.34 -0.74 0.37 0.00 0.00 175.52 175.60 1b6t h HIS 144 N 0.63 0.10 -0.01 3.16 6.17 -2.01 -2.53 115.15 120.66 1b6t h HIS 144 Ca 0.53 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.62 1b6t h HIS 144 Cb 0.86 -0.03 0.00 0.00 2.52 0.00 0.00 27.41 30.75 1b6t h HIS 144 CO -0.06 0.05 -0.12 1.19 0.71 0.00 0.00 177.93 179.69 1b6t n PHE 145 N -4.42 0.00 -4.27 5.26 3.01 -0.63 -4.94 117.46 111.47 1b6t n PHE 145 Ca 0.08 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.32 1b6t n PHE 145 Cb 0.48 -0.05 -0.12 0.00 -0.01 0.00 0.00 39.48 39.78 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 -2.22 2.28 0.62 4.37 1.43 -0.95 -0.64 118.68 123.58 1b6t s LEU 146 Ca 0.31 -0.65 -0.18 0.00 -1.03 0.00 0.00 54.13 52.58 1b6t s LEU 146 Cb 0.20 -0.76 -0.02 0.00 0.03 0.00 0.00 46.19 45.64 1b6t s LEU 146 CO 0.41 0.02 1.22 -2.84 0.23 0.00 0.00 176.35 175.39 1b6t s PRO 147 N -1.80 2.77 0.30 1.29 0.02 -1.26 -4.73 135.00 131.60 1b6t s PRO 147 Ca 0.04 1.84 0.05 0.00 0.02 0.00 0.00 61.00 62.94 1b6t s PRO 147 Cb -0.10 -1.90 0.67 0.00 0.02 0.00 0.00 34.50 33.19 1b6t s PRO 147 CO 0.03 -1.36 1.82 1.49 -0.33 0.00 0.00 177.00 178.65 1b6t h GLU 148 N 0.62 0.83 -0.76 5.54 4.57 -2.00 -0.97 114.58 122.41 1b6t h GLU 148 Ca -0.50 -0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 57.60 1b6t h GLU 148 Cb 1.30 -0.19 -0.04 0.00 -0.16 0.00 0.00 28.75 29.67 1b6t h GLU 148 CO 0.54 0.55 0.36 -2.95 -1.18 0.00 0.00 179.01 176.33 1b6t h ASN 149 N 0.86 0.99 -0.24 1.04 -1.07 -1.98 -2.00 115.58 113.18 1b6t h ASN 149 Ca 0.52 -0.12 -0.15 0.00 0.07 0.00 0.00 56.30 56.63 1b6t h ASN 149 Cb 0.69 -0.25 -0.01 0.00 -2.07 0.00 0.00 38.32 36.68 1b6t h ASN 149 CO -0.30 0.84 -0.40 0.58 0.07 0.00 0.00 177.43 178.23 1b6t h VAL 150 N 1.08 1.28 -0.24 6.14 2.07 -1.57 -2.43 116.25 122.58 1b6t h VAL 150 Ca 0.26 -1.57 0.02 0.00 0.82 0.00 0.00 66.70 66.23 1b6t h VAL 150 Cb 0.12 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 1b6t h VAL 150 CO -0.03 0.51 0.09 -0.74 0.02 0.00 0.00 177.57 177.42 1b6t h HIS 151 N 0.65 0.16 -0.69 1.57 6.17 -0.81 0.42 115.15 122.61 1b6t h HIS 151 Ca 0.05 0.01 -0.02 0.00 0.71 0.00 0.00 60.37 61.12 1b6t h HIS 151 Cb 0.96 -0.04 -0.03 0.00 2.52 0.00 0.00 27.41 30.82 1b6t h HIS 151 CO 0.05 0.08 0.34 1.96 0.71 0.00 0.00 177.93 181.07 1b6t h GLN 152 N 0.20 0.98 -0.37 5.26 1.08 -1.32 -1.85 115.11 119.08 1b6t h GLN 152 Ca 0.10 -0.14 -0.09 0.00 -1.45 0.00 0.00 58.65 57.07 1b6t h GLN 152 Cb 0.07 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.30 1b6t h GLN 152 CO -0.10 0.76 -0.15 0.00 -0.95 0.00 0.00 178.83 178.38 1b6t h ALA 153 N 1.16 1.03 -0.56 3.87 0.00 -1.10 -2.85 119.26 120.81 1b6t h ALA 153 Ca 0.24 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1b6t h ALA 153 Cb 0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1b6t h ALA 153 CO -0.03 0.58 0.00 1.25 0.00 0.00 0.00 179.25 181.05 1b6t h LEU 154 N 0.61 0.97 -0.51 0.00 5.85 -0.54 -1.60 115.31 120.10 1b6t h LEU 154 Ca 0.10 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 1b6t h LEU 154 Cb 0.61 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1b6t h LEU 154 CO 0.04 1.04 0.24 0.24 -0.34 0.00 0.00 178.44 179.66 1b6t h MET 155 N 0.87 0.73 -0.75 1.25 2.86 -1.24 -1.34 114.93 117.30 1b6t h MET 155 Ca 0.16 -0.11 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 1b6t h MET 155 Cb 0.54 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 32.03 1b6t h MET 155 CO 0.03 0.61 0.43 0.00 1.06 0.00 0.00 176.91 179.04 1b6t h ALA 156 N 1.08 0.96 -0.70 6.32 0.00 -1.38 -0.19 119.26 125.36 1b6t h ALA 156 Ca 0.17 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1b6t h ALA 156 Cb 0.12 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1b6t h ALA 156 CO -0.02 0.46 0.28 -0.22 0.00 0.00 0.00 179.25 179.75 1b6t h LYS 157 N 1.04 1.03 0.00 0.00 1.63 -0.91 -2.91 116.57 116.45 1b6t h LYS 157 Ca 0.27 -0.18 0.00 0.00 -0.85 0.00 0.00 60.65 59.89 1b6t h LYS 157 Cb 0.01 -0.17 0.00 0.00 -0.60 0.00 0.00 32.23 31.47 1b6t h LYS 157 CO -0.05 0.84 -0.53 1.28 -3.45 0.00 0.00 179.45 177.55 1b6t n LEU 158 N -4.29 0.61 0.00 5.20 4.77 -0.54 -5.10 117.00 117.64 1b6t n LEU 158 Ca 0.06 0.20 0.05 0.00 -0.03 0.00 0.00 56.01 56.29 1b6t n LEU 158 Cb 0.18 -0.23 0.28 0.00 -2.33 0.00 0.00 43.42 41.33 1b6t n LEU 158 CO 0.40 -0.01 0.51 0.00 -1.33 0.00 0.00 177.39 176.96