#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xx6 n ARG 3 N 0.00 -4.74 -0.34 2.98 5.12 -1.26 -4.96 116.66 113.46 1xx6 n ARG 3 Ca 0.00 0.58 -0.09 0.00 -1.93 0.00 0.00 57.85 56.41 1xx6 n ARG 3 Cb 0.00 -5.13 0.07 0.00 -1.16 0.00 0.00 32.46 26.24 1xx6 n ARG 3 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 1xx6 n PRO 4 N -4.37 -1.46 -1.60 5.56 -0.04 -1.26 -4.80 135.00 127.03 1xx6 n PRO 4 Ca -0.24 -0.52 -0.53 0.00 -0.04 0.00 0.00 63.50 62.17 1xx6 n PRO 4 Cb 0.65 -0.47 -0.06 0.00 -0.04 0.00 0.00 33.50 33.58 1xx6 n PRO 4 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1xx6 n LYS 5 N -2.39 1.05 -2.22 0.54 4.76 -1.26 -2.13 118.16 116.51 1xx6 n LYS 5 Ca 0.04 0.38 -0.20 0.00 -2.87 0.00 0.00 58.31 55.67 1xx6 n LYS 5 Cb 0.17 -2.01 -0.02 0.00 -1.84 0.00 0.00 35.03 31.32 1xx6 n LYS 5 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1xx6 n ASP 6 N 2.72 -5.59 -4.18 4.39 8.00 -1.26 -4.98 116.55 115.65 1xx6 n ASP 6 Ca 0.19 0.08 -0.35 0.00 0.71 0.00 0.00 54.79 55.42 1xx6 n ASP 6 Cb 0.17 -4.66 -0.13 0.00 -0.02 0.00 0.00 41.12 36.48 1xx6 n ASP 6 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1xx6 s HIS 7 N -2.93 3.29 0.50 1.24 3.76 -0.91 -4.50 115.29 115.74 1xx6 s HIS 7 Ca 0.00 -1.87 -0.02 0.00 -0.15 0.00 0.00 55.06 53.02 1xx6 s HIS 7 Cb 0.00 -2.20 0.00 0.00 1.11 0.00 0.00 32.58 31.49 1xx6 s HIS 7 CO 0.00 -0.81 0.75 0.20 -0.85 0.00 0.00 174.74 174.04 1xx6 s GLY 8 N 1.30 1.58 0.25 -2.22 0.00 -1.23 -4.71 107.32 102.30 1xx6 s GLY 8 Ca -0.04 -0.92 -0.21 0.00 0.00 0.00 0.00 44.72 43.54 1xx6 s GLY 8 CO -0.01 -0.71 0.82 0.66 0.00 0.00 0.00 173.10 173.86 1xx6 s TRP 9 N -2.71 -0.10 -0.10 1.90 -2.14 -0.92 -4.85 118.94 110.02 1xx6 s TRP 9 Ca 0.50 -0.34 0.03 0.00 2.66 0.00 0.00 56.10 58.95 1xx6 s TRP 9 Cb -0.10 0.71 0.01 0.00 -3.10 0.00 0.00 33.47 30.99 1xx6 s TRP 9 CO 0.41 -1.16 -0.19 0.08 -2.66 0.00 0.00 176.95 173.43 1xx6 s VAL 10 N -3.36 1.70 -0.02 -0.66 1.01 -1.26 -1.62 120.40 116.19 1xx6 s VAL 10 Ca 0.13 -0.79 0.06 0.00 0.00 0.00 0.00 61.98 61.38 1xx6 s VAL 10 Cb -0.04 -1.50 -0.01 0.00 0.00 0.00 0.00 36.38 34.82 1xx6 s VAL 10 CO 0.06 0.48 -0.21 -1.83 0.00 0.00 0.00 175.10 173.60 1xx6 s GLU 11 N 0.61 1.80 0.04 2.72 -1.05 -0.18 -0.39 118.70 122.25 1xx6 s GLU 11 Ca -0.14 -0.76 0.09 0.00 -0.15 0.00 0.00 54.97 54.01 1xx6 s GLU 11 Cb -0.16 -1.70 -0.03 0.00 -0.44 0.00 0.00 34.13 31.80 1xx6 s GLU 11 CO 0.04 0.43 -0.25 0.08 0.95 0.00 0.00 175.26 176.52 1xx6 s VAL 12 N -0.42 1.98 -0.25 1.83 1.01 0.44 -0.77 120.40 124.22 1xx6 s VAL 12 Ca 0.06 -1.29 0.02 0.00 0.00 0.00 0.00 61.98 60.77 1xx6 s VAL 12 Cb -0.09 -1.70 0.06 0.00 0.00 0.00 0.00 36.38 34.65 1xx6 s VAL 12 CO -0.00 0.35 -0.09 -0.63 0.00 0.00 0.00 175.10 174.72 1xx6 s ILE 13 N -0.77 1.98 0.21 2.22 1.01 0.15 -1.10 121.20 124.90 1xx6 s ILE 13 Ca 0.10 -1.51 0.08 0.00 0.00 0.00 0.00 60.65 59.33 1xx6 s ILE 13 Cb -0.10 -2.13 -0.05 0.00 0.01 0.00 0.00 42.46 40.20 1xx6 s ILE 13 CO 0.02 -0.04 -0.15 0.68 0.00 0.00 0.00 174.94 175.44 1xx6 s VAL 14 N 1.19 1.79 0.00 2.92 -7.23 -0.21 -1.41 120.40 117.45 1xx6 s VAL 14 Ca -0.08 -2.23 0.00 0.00 -1.81 0.00 0.00 61.98 57.87 1xx6 s VAL 14 Cb -0.20 -2.06 0.00 0.00 0.56 0.00 0.00 36.38 34.68 1xx6 s VAL 14 CO -0.05 -0.58 0.00 0.61 -0.31 0.00 0.00 175.10 174.76 1xx6 n GLY 15 N -0.40 1.49 0.00 2.32 0.00 -1.23 -0.15 105.19 107.22 1xx6 n GLY 15 Ca -0.08 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.79 1xx6 n GLY 15 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1xx6 n PRO 16 N -1.02 0.00 0.00 1.61 -0.04 -1.26 -3.82 135.00 130.47 1xx6 n PRO 16 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1xx6 n PRO 16 Cb 0.00 -0.15 0.00 0.00 -0.04 0.00 0.00 33.50 33.31 1xx6 n PRO 16 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1xx6 n TYR 18 N 0.00 0.00 0.32 0.54 4.01 -1.26 -4.63 117.16 116.14 1xx6 n TYR 18 Ca 0.00 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.89 1xx6 n TYR 18 Cb 0.00 -0.16 0.55 0.00 -0.31 0.00 0.00 39.34 39.42 1xx6 n TYR 18 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1xx6 h SER 19 N 0.00 0.00 0.00 7.72 4.64 -1.90 -3.42 113.55 120.60 1xx6 h SER 19 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xx6 h SER 19 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1xx6 h SER 19 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1xx6 n GLY 20 N 0.27 1.41 0.14 -0.77 0.00 -1.26 -4.39 105.19 100.59 1xx6 n GLY 20 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 1xx6 n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xx6 h LYS 21 N 0.00 0.41 -0.58 1.61 1.57 -1.90 -0.75 116.57 116.93 1xx6 h LYS 21 Ca 0.00 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.67 1xx6 h LYS 21 Cb 0.00 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.20 1xx6 h LYS 21 CO 0.00 0.28 0.04 0.77 -0.57 0.00 0.00 179.45 179.98 1xx6 h SER 22 N 0.41 0.96 -0.54 0.86 0.02 -1.97 0.11 113.55 113.39 1xx6 h SER 22 Ca 0.11 -0.29 -0.01 0.00 -0.84 0.00 0.00 61.79 60.77 1xx6 h SER 22 Cb -0.03 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.23 1xx6 h SER 22 CO -0.02 1.01 0.31 -0.08 -1.14 0.00 0.00 176.83 176.90 1xx6 h GLU 23 N 0.88 0.75 -0.25 3.45 4.81 -1.95 0.12 114.58 122.40 1xx6 h GLU 23 Ca 0.17 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.26 1xx6 h GLU 23 Cb 0.49 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 1xx6 h GLU 23 CO 0.02 0.57 -0.06 1.49 -0.73 0.00 0.00 179.01 180.31 1xx6 h GLU 24 N 0.73 0.47 -0.22 1.92 4.57 -0.91 -1.16 114.58 119.97 1xx6 h GLU 24 Ca 0.19 -0.18 0.02 0.00 -1.18 0.00 0.00 59.36 58.22 1xx6 h GLU 24 Cb 0.03 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.57 1xx6 h GLU 24 CO -0.03 0.70 0.07 1.25 -1.18 0.00 0.00 179.01 179.81 1xx6 h LEU 25 N 0.22 0.06 -1.39 1.64 5.85 -0.52 -1.07 115.31 120.10 1xx6 h LEU 25 Ca 0.06 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 1xx6 h LEU 25 Cb 0.52 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 1xx6 h LEU 25 CO 0.02 0.07 0.35 0.40 -0.34 0.00 0.00 178.44 178.94 1xx6 h ILE 26 N 0.16 1.16 -0.47 4.05 2.04 -0.71 -0.78 117.51 122.96 1xx6 h ILE 26 Ca 0.10 -0.34 -0.05 0.00 1.00 0.00 0.00 64.86 65.57 1xx6 h ILE 26 Cb 0.08 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.49 1xx6 h ILE 26 CO -0.11 0.16 0.09 -0.09 0.00 0.00 0.00 178.15 178.20 1xx6 h ARG 27 N 0.77 0.77 -0.06 2.37 2.43 -0.46 -1.59 114.38 118.62 1xx6 h ARG 27 Ca 0.20 -0.20 -0.11 0.00 -0.81 0.00 0.00 59.98 59.07 1xx6 h ARG 27 Cb -0.04 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 1xx6 h ARG 27 CO -0.04 0.77 -0.46 0.00 -1.51 0.00 0.00 179.97 178.73 1xx6 h ARG 28 N 0.64 0.14 -0.37 0.20 3.08 -0.55 -2.15 114.38 115.35 1xx6 h ARG 28 Ca 0.14 -0.07 -0.13 0.00 0.07 0.00 0.00 59.98 59.99 1xx6 h ARG 28 Cb 0.37 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 1xx6 h ARG 28 CO 0.01 0.57 -0.31 0.82 -1.07 0.00 0.00 179.97 179.99 1xx6 h ILE 29 N 0.11 1.28 -0.16 2.04 2.04 -0.87 -1.86 117.51 120.08 1xx6 h ILE 29 Ca 0.01 -1.46 -0.12 0.00 1.00 0.00 0.00 64.86 64.29 1xx6 h ILE 29 Cb 0.86 1.31 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 1xx6 h ILE 29 CO 0.07 0.48 -0.42 0.03 0.00 0.00 0.00 178.15 178.31 1xx6 h ARG 30 N 0.69 0.37 -0.31 2.37 3.08 -1.07 -2.40 114.38 117.11 1xx6 h ARG 30 Ca 0.08 -0.19 -0.09 0.00 0.07 0.00 0.00 59.98 59.85 1xx6 h ARG 30 Cb 0.85 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.90 1xx6 h ARG 30 CO 0.07 0.73 -0.17 0.00 -1.07 0.00 0.00 179.97 179.54 1xx6 h ARG 31 N 0.31 0.66 -0.45 0.04 3.08 -1.21 -2.05 114.38 114.76 1xx6 h ARG 31 Ca 0.03 -0.29 -0.03 0.00 0.07 0.00 0.00 59.98 59.75 1xx6 h ARG 31 Cb 0.87 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.88 1xx6 h ARG 31 CO 0.07 0.89 0.14 0.00 -1.07 0.00 0.00 179.97 180.00 1xx6 h ALA 32 N 0.76 1.41 -0.51 0.04 0.00 -1.26 -0.59 119.26 119.10 1xx6 h ALA 32 Ca 0.07 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1xx6 h ALA 32 Cb 0.70 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1xx6 h ALA 32 CO 0.05 0.44 -0.11 0.87 0.00 0.00 0.00 179.25 180.49 1xx6 h LYS 33 N 0.64 0.96 0.00 0.00 1.57 -1.25 -0.48 116.57 118.01 1xx6 h LYS 33 Ca 0.15 -0.35 -0.08 0.00 -1.87 0.00 0.00 60.65 58.50 1xx6 h LYS 33 Cb 0.19 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1xx6 h LYS 33 CO -0.01 1.01 -0.39 0.82 -0.57 0.00 0.00 179.45 180.31 1xx6 h ILE 34 N 0.85 1.19 -0.00 1.86 2.04 -0.64 -0.46 117.51 122.35 1xx6 h ILE 34 Ca 0.13 -1.38 0.00 0.00 1.00 0.00 0.00 64.86 64.62 1xx6 h ILE 34 Cb 0.66 1.76 0.00 0.00 -0.74 0.00 0.00 36.82 38.50 1xx6 h ILE 34 CO 0.05 0.38 0.00 0.00 0.00 0.00 0.00 178.15 178.58 1xx6 n ALA 35 N -2.43 2.61 -3.12 1.87 0.00 -0.30 -4.88 120.51 114.27 1xx6 n ALA 35 Ca -0.02 -0.12 -0.17 0.00 0.00 0.00 0.00 53.44 53.13 1xx6 n ALA 35 Cb 0.44 -1.30 0.05 0.00 0.00 0.00 0.00 19.45 18.63 1xx6 n ALA 35 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1xx6 n LYS 36 N -0.78 -4.98 -4.25 0.00 5.02 -0.18 -5.02 118.16 107.97 1xx6 n LYS 36 Ca 0.14 0.63 -0.34 0.00 -2.02 0.00 0.00 58.31 56.72 1xx6 n LYS 36 Cb 0.07 -4.98 -0.11 0.00 -0.02 0.00 0.00 35.03 29.99 1xx6 n LYS 36 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1xx6 s GLN 37 N -5.74 3.65 0.03 1.97 -0.21 -0.24 -5.03 119.66 114.09 1xx6 s GLN 37 Ca 0.35 -0.43 -0.30 0.00 0.02 0.00 0.00 55.36 55.00 1xx6 s GLN 37 Cb -0.15 -3.00 -0.06 0.00 1.00 0.00 0.00 33.01 30.79 1xx6 s GLN 37 CO 0.43 0.35 1.35 0.21 -2.12 0.00 0.00 175.29 175.52 1xx6 s LYS 38 N 0.11 4.32 0.01 2.91 2.20 -1.26 -4.36 119.74 123.66 1xx6 s LYS 38 Ca 0.02 1.94 0.04 0.00 -0.36 0.00 0.00 55.97 57.61 1xx6 s LYS 38 Cb -0.13 -3.47 -0.01 0.00 -1.51 0.00 0.00 37.83 32.71 1xx6 s LYS 38 CO 0.02 -0.49 -0.13 -1.50 -0.36 0.00 0.00 175.35 172.89 1xx6 s ILE 39 N 1.90 0.99 -0.08 5.43 2.07 -1.26 -0.56 121.20 129.69 1xx6 s ILE 39 Ca 0.63 -0.73 0.05 0.00 -1.41 0.00 0.00 60.65 59.18 1xx6 s ILE 39 Cb -0.32 -0.87 -0.01 0.00 0.13 0.00 0.00 42.46 41.40 1xx6 s ILE 39 CO 0.27 0.13 -0.24 -1.10 -1.91 0.00 0.00 174.94 172.10 1xx6 s GLN 40 N -0.68 2.84 -0.07 3.50 -0.21 -0.47 -4.95 119.66 119.61 1xx6 s GLN 40 Ca 0.03 -0.88 0.02 0.00 0.02 0.00 0.00 55.36 54.55 1xx6 s GLN 40 Cb -0.06 -2.26 -0.03 0.00 1.00 0.00 0.00 33.01 31.67 1xx6 s GLN 40 CO 0.00 0.28 -0.10 0.08 -2.12 0.00 0.00 175.29 173.43 1xx6 s VAL 41 N 0.10 3.40 0.12 1.09 1.01 -1.26 -1.04 120.40 123.82 1xx6 s VAL 41 Ca -0.11 -0.59 0.05 0.00 0.00 0.00 0.00 61.98 61.33 1xx6 s VAL 41 Cb -0.16 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 1xx6 s VAL 41 CO 0.06 0.59 -0.12 -0.36 0.00 0.00 0.00 175.10 175.27 1xx6 s PHE 42 N -0.65 1.29 0.17 5.22 0.08 0.12 -0.94 117.98 123.28 1xx6 s PHE 42 Ca 0.10 -0.61 -0.07 0.00 0.12 0.00 0.00 56.93 56.46 1xx6 s PHE 42 Cb -0.11 -0.68 -0.02 0.00 -0.57 0.00 0.00 43.02 41.64 1xx6 s PHE 42 CO 0.01 0.10 0.25 0.15 -0.10 0.00 0.00 175.22 175.64 1xx6 s LYS 43 N -2.90 1.17 0.00 0.44 1.02 -1.19 -1.71 119.74 116.56 1xx6 s LYS 43 Ca 0.10 -1.28 0.00 0.00 0.02 0.00 0.00 55.97 54.81 1xx6 s LYS 43 Cb -0.03 0.35 0.00 0.00 -0.52 0.00 0.00 37.83 37.63 1xx6 s LYS 43 CO 0.02 -0.42 0.73 -2.30 -0.92 0.00 0.00 175.35 172.46 1xx6 n PRO 44 N -0.22 0.90 -1.15 -1.68 -0.02 -1.26 -1.95 135.00 129.62 1xx6 n PRO 44 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1xx6 n PRO 44 Cb 0.63 -1.17 0.00 0.00 -0.02 0.00 0.00 33.50 32.94 1xx6 n PRO 44 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1xx6 n GLU 45 N -0.29 0.00 -1.94 -0.52 2.13 -1.05 -4.66 120.64 114.30 1xx6 n GLU 45 Ca 0.00 0.38 -0.33 0.00 0.66 0.00 0.00 57.16 57.88 1xx6 n GLU 45 Cb 0.08 -0.77 -0.05 0.00 0.27 0.00 0.00 31.44 30.97 1xx6 n GLU 45 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1xx6 n ALA 65 N 0.04 2.33 -3.62 4.31 0.00 -1.22 -4.89 120.51 117.45 1xx6 n ALA 65 Ca 0.00 -3.17 -0.29 0.00 0.00 0.00 0.00 53.44 49.97 1xx6 n ALA 65 Cb 0.00 -3.52 -0.14 0.00 0.00 0.00 0.00 19.45 15.79 1xx6 n ALA 65 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1xx6 s VAL 66 N 9.11 0.62 0.36 0.00 1.01 -0.12 -4.97 120.40 126.41 1xx6 s VAL 66 Ca 0.65 -1.62 -0.28 0.00 0.00 0.00 0.00 61.98 60.72 1xx6 s VAL 66 Cb 0.03 -1.46 -0.11 0.00 0.00 0.00 0.00 36.38 34.84 1xx6 s VAL 66 CO 0.12 -0.82 1.45 0.00 0.00 0.00 0.00 175.10 175.85 1xx6 s ALA 67 N 1.28 3.57 0.20 5.51 0.00 -1.26 -3.20 121.76 127.86 1xx6 s ALA 67 Ca 0.14 1.49 -0.12 0.00 0.00 0.00 0.00 51.96 53.47 1xx6 s ALA 67 Cb -0.20 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.34 1xx6 s ALA 67 CO -0.15 -0.95 0.40 0.96 0.00 0.00 0.00 175.76 176.03 1xx6 s ILE 68 N -1.02 0.03 0.00 0.00 -4.36 -0.82 -4.84 121.20 110.19 1xx6 s ILE 68 Ca 0.53 -1.25 0.00 0.00 -0.26 0.00 0.00 60.65 59.67 1xx6 s ILE 68 Cb -0.45 -1.90 0.00 0.00 1.25 0.00 0.00 42.46 41.37 1xx6 s ILE 68 CO 0.59 -0.16 0.00 0.29 0.24 0.00 0.00 174.94 175.91 1xx6 n LYS 69 N -0.30 0.00 -0.26 0.37 5.02 -1.26 -2.54 118.16 119.19 1xx6 n LYS 69 Ca -0.06 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.07 1xx6 n LYS 69 Cb 0.63 0.00 0.16 0.00 -0.02 0.00 0.00 35.03 35.79 1xx6 n LYS 69 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1xx6 n ASN 70 N 0.00 -3.02 0.07 4.39 0.23 -1.26 -4.78 115.26 110.88 1xx6 n ASN 70 Ca 0.00 -0.46 -0.06 0.00 -0.53 0.00 0.00 54.58 53.52 1xx6 n ASN 70 Cb 0.00 -0.63 -0.11 0.00 -2.08 0.00 0.00 39.78 36.97 1xx6 n ASN 70 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1xx6 h SER 71 N -2.81 0.00 0.55 0.53 0.02 -1.96 -3.23 113.55 106.66 1xx6 h SER 71 Ca -0.21 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 1xx6 h SER 71 Cb 0.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1xx6 h SER 71 CO 0.13 0.95 0.00 -1.14 -1.14 0.00 0.00 176.83 175.63 1xx6 n ARG 72 N -3.33 0.09 0.00 3.45 0.63 -1.26 -2.28 116.66 113.95 1xx6 n ARG 72 Ca -0.00 0.35 0.15 0.00 -0.92 0.00 0.00 57.85 57.43 1xx6 n ARG 72 Cb 0.92 -1.68 0.68 0.00 0.45 0.00 0.00 32.46 32.83 1xx6 n ARG 72 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1xx6 n GLU 73 N -1.85 1.39 0.09 -0.14 2.13 -1.22 -3.64 120.64 117.41 1xx6 n GLU 73 Ca 0.02 -0.59 -0.22 0.00 0.66 0.00 0.00 57.16 57.03 1xx6 n GLU 73 Cb 0.18 -1.49 -0.15 0.00 0.27 0.00 0.00 31.44 30.25 1xx6 n GLU 73 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 1xx6 h ILE 74 N 1.45 1.40 -0.67 6.31 2.04 -1.66 -3.22 117.51 123.16 1xx6 h ILE 74 Ca 0.00 -2.57 0.05 0.00 1.00 0.00 0.00 64.86 63.34 1xx6 h ILE 74 Cb 0.32 3.08 -0.04 0.00 -0.74 0.00 0.00 36.82 39.44 1xx6 h ILE 74 CO 0.00 0.75 0.44 -0.07 0.00 0.00 0.00 178.15 179.27 1xx6 h LEU 75 N -0.11 0.64 0.56 1.44 3.38 -1.76 -0.19 115.31 119.26 1xx6 h LEU 75 Ca -0.19 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 1xx6 h LEU 75 Cb 1.85 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 42.46 1xx6 h LEU 75 CO 0.21 0.42 -0.34 0.50 0.09 0.00 0.00 178.44 179.32 1xx6 h LYS 76 N 0.73 -0.81 0.00 1.13 3.64 -1.70 -2.96 116.57 116.60 1xx6 h LYS 76 Ca 0.28 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.72 1xx6 h LYS 76 Cb 0.19 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1xx6 h LYS 76 CO -0.09 -0.54 0.00 0.66 -2.27 0.00 0.00 179.45 177.22 1xx6 n TYR 77 N -4.51 0.61 -1.69 1.91 4.02 -1.10 -4.83 117.16 111.57 1xx6 n TYR 77 Ca -0.10 0.25 -0.42 0.00 -0.01 0.00 0.00 57.90 57.61 1xx6 n TYR 77 Cb 0.35 -0.90 -0.03 0.00 -0.02 0.00 0.00 39.34 38.74 1xx6 n TYR 77 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 176.86 175.97 1xx6 s PHE 78 N -3.25 1.32 -0.27 -0.72 5.36 -0.10 -4.98 117.98 115.34 1xx6 s PHE 78 Ca 0.04 -0.40 -0.11 0.00 -0.96 0.00 0.00 56.93 55.51 1xx6 s PHE 78 Cb 0.09 -4.22 -0.05 0.00 -0.34 0.00 0.00 43.02 38.50 1xx6 s PHE 78 CO 0.35 -5.44 0.19 -1.21 -1.46 0.00 0.00 175.22 167.65 1xx6 s GLU 79 N 4.49 3.99 0.32 10.12 2.02 -1.26 -4.96 118.70 133.42 1xx6 s GLU 79 Ca 0.88 -0.29 0.16 0.00 0.02 0.00 0.00 54.97 55.74 1xx6 s GLU 79 Cb -0.42 -3.62 0.88 0.00 0.10 0.00 0.00 34.13 31.07 1xx6 s GLU 79 CO 0.41 -0.10 1.43 0.39 0.02 0.00 0.00 175.26 177.40 1xx6 n GLU 80 N 4.81 0.11 0.17 1.61 1.02 -1.26 -0.77 120.64 126.33 1xx6 n GLU 80 Ca -0.14 0.59 0.05 0.00 -0.02 0.00 0.00 57.16 57.64 1xx6 n GLU 80 Cb 0.52 -2.03 0.25 0.00 -0.02 0.00 0.00 31.44 30.15 1xx6 n GLU 80 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1xx6 h ASP 81 N 0.00 0.00 -3.87 1.62 1.82 -1.99 -3.45 116.42 110.54 1xx6 h ASP 81 Ca 0.00 0.00 -0.49 0.00 -0.39 0.00 0.00 57.03 56.15 1xx6 h ASP 81 Cb 0.36 0.00 0.01 0.00 0.68 0.00 0.00 39.33 40.39 1xx6 h ASP 81 CO 0.00 0.41 0.43 0.42 -1.61 0.00 0.00 179.24 178.89 1xx6 s THR 82 N -3.39 3.65 -0.10 2.25 -4.23 0.05 -4.74 115.64 109.13 1xx6 s THR 82 Ca 0.01 1.49 0.16 0.00 -1.18 0.00 0.00 61.69 62.17 1xx6 s THR 82 Cb 0.10 -3.88 -0.24 0.00 1.34 0.00 0.00 72.50 69.83 1xx6 s THR 82 CO 0.70 0.22 0.21 -0.62 -0.54 0.00 0.00 174.62 174.59 1xx6 n GLU 83 N 0.67 0.96 -4.48 3.99 -0.58 0.28 -4.96 120.64 116.53 1xx6 n GLU 83 Ca 0.01 -0.08 -0.25 0.00 -0.42 0.00 0.00 57.16 56.43 1xx6 n GLU 83 Cb 0.47 -1.42 -0.17 0.00 -0.57 0.00 0.00 31.44 29.75 1xx6 n GLU 83 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1xx6 s VAL 84 N -2.77 1.11 -0.20 2.62 1.01 -0.69 -1.72 120.40 119.76 1xx6 s VAL 84 Ca -0.07 -0.44 -0.01 0.00 0.00 0.00 0.00 61.98 61.45 1xx6 s VAL 84 Cb 0.08 -1.03 0.01 0.00 0.00 0.00 0.00 36.38 35.43 1xx6 s VAL 84 CO 0.70 0.35 -0.13 -0.63 0.00 0.00 0.00 175.10 175.40 1xx6 s ILE 85 N 0.82 2.68 -0.15 2.22 -1.09 0.81 -1.37 121.20 125.12 1xx6 s ILE 85 Ca -0.12 -0.73 -0.04 0.00 -2.23 0.00 0.00 60.65 57.53 1xx6 s ILE 85 Cb -0.15 -2.18 -0.03 0.00 -1.58 0.00 0.00 42.46 38.52 1xx6 s ILE 85 CO 0.02 0.49 -0.02 0.00 -1.23 0.00 0.00 174.94 174.19 1xx6 s ALA 86 N 1.37 3.07 -0.18 9.38 0.00 -0.21 -0.17 121.76 135.03 1xx6 s ALA 86 Ca 0.05 -0.81 0.01 0.00 0.00 0.00 0.00 51.96 51.21 1xx6 s ALA 86 Cb -0.14 -1.60 0.04 0.00 0.00 0.00 0.00 23.12 21.42 1xx6 s ALA 86 CO -0.08 0.24 -0.11 0.42 0.00 0.00 0.00 175.76 176.23 1xx6 s ILE 87 N 0.26 1.55 0.23 0.00 1.01 0.14 -0.70 121.20 123.69 1xx6 s ILE 87 Ca -0.02 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 59.81 1xx6 s ILE 87 Cb -0.14 -1.59 -0.03 0.00 0.01 0.00 0.00 42.46 40.71 1xx6 s ILE 87 CO 0.02 0.25 0.38 -0.62 0.00 0.00 0.00 174.94 174.98 1xx6 s ASP 88 N 1.45 6.34 -1.54 3.58 2.15 -0.69 -0.67 116.67 127.28 1xx6 s ASP 88 Ca 0.01 0.23 -0.14 0.00 0.43 0.00 0.00 52.55 53.08 1xx6 s ASP 88 Cb -0.15 -1.93 0.09 0.00 -0.30 0.00 0.00 42.92 40.63 1xx6 s ASP 88 CO -0.09 -0.07 0.95 -0.62 -0.17 0.00 0.00 175.17 175.17 1xx6 n GLU 89 N -1.09 -5.30 0.15 4.34 1.02 -0.20 -4.24 120.64 115.33 1xx6 n GLU 89 Ca -0.07 0.58 0.18 0.00 -0.02 0.00 0.00 57.16 57.83 1xx6 n GLU 89 Cb 0.55 -5.46 0.78 0.00 -0.02 0.00 0.00 31.44 27.29 1xx6 n GLU 89 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 1xx6 h VAL 90 N -2.00 0.54 0.00 2.62 -1.51 -1.26 -2.41 116.25 112.22 1xx6 h VAL 90 Ca -0.57 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.90 1xx6 h VAL 90 Cb 1.37 0.80 0.00 0.00 -2.13 0.00 0.00 31.29 31.33 1xx6 h VAL 90 CO 0.67 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 177.01 1xx6 n GLN 91 N -3.94 0.04 0.06 5.19 0.00 -1.26 -2.01 117.38 115.45 1xx6 n GLN 91 Ca 0.04 0.43 0.12 0.00 0.00 0.00 0.00 57.00 57.58 1xx6 n GLN 91 Cb 0.41 -1.59 0.12 0.00 0.00 0.00 0.00 30.24 29.18 1xx6 n GLN 91 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.06 177.80 1xx6 h PHE 92 N 0.00 0.00 -4.35 2.61 0.04 -1.80 -3.38 116.94 110.06 1xx6 h PHE 92 Ca 0.00 0.00 -0.51 0.00 2.80 0.00 0.00 57.97 60.26 1xx6 h PHE 92 Cb 0.12 0.00 0.07 0.00 2.20 0.00 0.00 35.95 38.34 1xx6 h PHE 92 CO 0.00 0.00 0.40 -0.06 -0.60 0.00 0.00 178.31 178.05 1xx6 s PHE 93 N -3.20 3.43 1.04 -0.55 0.08 -0.85 -5.06 117.98 112.87 1xx6 s PHE 93 Ca 0.05 1.34 -0.14 0.00 0.12 0.00 0.00 56.93 58.30 1xx6 s PHE 93 Cb 0.13 -2.79 0.21 0.00 -0.57 0.00 0.00 43.02 40.00 1xx6 s PHE 93 CO 0.75 -0.91 1.11 0.16 -0.10 0.00 0.00 175.22 176.23 1xx6 s ASP 94 N -4.03 2.30 0.39 1.36 1.47 -1.26 -4.52 116.67 112.38 1xx6 s ASP 94 Ca 0.56 0.99 0.28 0.00 1.18 0.00 0.00 52.55 55.56 1xx6 s ASP 94 Cb -0.12 -1.54 1.36 0.00 -0.34 0.00 0.00 42.92 42.29 1xx6 s ASP 94 CO 0.54 -3.31 1.85 0.44 0.68 0.00 0.00 175.17 175.37 1xx6 h ASP 95 N -2.02 0.00 0.02 2.11 3.32 -1.97 -2.71 116.42 115.17 1xx6 h ASP 95 Ca -0.52 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.53 1xx6 h ASP 95 Cb 1.32 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.87 1xx6 h ASP 95 CO 0.53 0.00 -0.01 -0.33 -1.72 0.00 0.00 179.24 177.71 1xx6 h GLU 96 N 0.00 0.00 -1.04 3.56 5.08 -2.00 -2.56 114.58 117.62 1xx6 h GLU 96 Ca 0.00 0.00 0.27 0.00 -1.00 0.00 0.00 59.36 58.63 1xx6 h GLU 96 Cb 0.18 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.34 1xx6 h GLU 96 CO 0.00 0.01 0.67 0.97 -1.00 0.00 0.00 179.01 179.66 1xx6 h ILE 97 N 0.00 0.52 -0.10 3.13 6.09 -1.83 0.10 117.51 125.41 1xx6 h ILE 97 Ca -0.00 -0.14 0.00 0.00 -1.37 0.00 0.00 64.86 63.36 1xx6 h ILE 97 Cb 0.02 0.10 -0.01 0.00 0.47 0.00 0.00 36.82 37.40 1xx6 h ILE 97 CO 0.00 0.07 0.06 0.58 -3.07 0.00 0.00 178.15 175.80 1xx6 h VAL 98 N 0.39 1.02 -0.04 2.19 2.07 -1.71 -0.07 116.25 120.10 1xx6 h VAL 98 Ca 0.59 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 68.07 1xx6 h VAL 98 Cb 1.50 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 32.15 1xx6 h VAL 98 CO -0.30 0.02 0.02 -0.08 0.02 0.00 0.00 177.57 177.26 1xx6 h GLU 99 N 0.13 0.06 -0.04 1.57 4.81 -1.18 -1.21 114.58 118.72 1xx6 h GLU 99 Ca 0.04 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1xx6 h GLU 99 Cb -0.01 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 1xx6 h GLU 99 CO -0.02 0.13 -0.10 0.82 -0.73 0.00 0.00 179.01 179.12 1xx6 h ILE 100 N -0.02 0.74 -0.40 2.32 5.03 -1.25 0.54 117.51 124.46 1xx6 h ILE 100 Ca 0.02 0.00 0.03 0.00 -0.12 0.00 0.00 64.86 64.79 1xx6 h ILE 100 Cb 0.09 0.74 -0.04 0.00 -3.03 0.00 0.00 36.82 34.58 1xx6 h ILE 100 CO -0.00 0.00 0.19 0.58 -0.68 0.00 0.00 178.15 178.24 1xx6 h VAL 101 N -0.15 0.96 -0.82 1.67 2.07 -0.94 -0.18 116.25 118.86 1xx6 h VAL 101 Ca 0.05 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1xx6 h VAL 101 Cb 0.22 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.49 1xx6 h VAL 101 CO -0.13 0.07 0.52 0.78 0.02 0.00 0.00 177.57 178.83 1xx6 h ASN 102 N 0.39 0.96 -0.62 0.57 2.35 -0.89 -1.81 115.58 116.53 1xx6 h ASN 102 Ca 0.17 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1xx6 h ASN 102 Cb 0.09 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.19 1xx6 h ASN 102 CO -0.13 0.72 0.40 0.11 -1.65 0.00 0.00 177.43 176.88 1xx6 h LYS 103 N 1.12 0.82 -0.62 0.81 1.57 -0.06 0.22 116.57 120.43 1xx6 h LYS 103 Ca 0.30 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.97 1xx6 h LYS 103 Cb -0.09 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.01 1xx6 h LYS 103 CO -0.06 0.55 0.16 0.82 -0.57 0.00 0.00 179.45 180.36 1xx6 h ILE 104 N 0.84 1.24 -0.17 1.86 2.04 -0.64 -1.83 117.51 120.85 1xx6 h ILE 104 Ca 0.22 -0.87 -0.16 0.00 1.00 0.00 0.00 64.86 65.06 1xx6 h ILE 104 Cb -0.08 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1xx6 h ILE 104 CO -0.05 0.33 -0.56 0.00 0.00 0.00 0.00 178.15 177.88 1xx6 h ALA 105 N 1.25 0.71 0.00 1.87 0.00 -0.82 -2.63 119.26 119.64 1xx6 h ALA 105 Ca 0.20 -0.52 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 1xx6 h ALA 105 Cb 0.31 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1xx6 h ALA 105 CO -0.00 0.69 -0.17 1.49 0.00 0.00 0.00 179.25 181.26 1xx6 h GLU 106 N 0.41 0.00 -0.14 0.00 4.57 -0.17 -1.48 114.58 117.77 1xx6 h GLU 106 Ca 0.01 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1xx6 h GLU 106 Cb 1.10 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.69 1xx6 h GLU 106 CO 0.10 0.17 0.00 -1.13 -1.18 0.00 0.00 179.01 176.97 1xx6 n SER 107 N -3.68 0.80 0.00 1.04 3.41 -0.72 -4.88 113.62 109.59 1xx6 n SER 107 Ca -0.02 -1.90 0.00 0.00 -0.26 0.00 0.00 58.87 56.69 1xx6 n SER 107 Cb 0.29 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 1xx6 n SER 107 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xx6 n GLY 108 N 0.79 0.65 3.63 5.00 0.00 -0.56 -4.92 105.19 109.78 1xx6 n GLY 108 Ca 0.07 -0.69 -0.24 0.00 0.00 0.00 0.00 46.02 45.16 1xx6 n GLY 108 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xx6 s ARG 109 N -1.53 2.10 -0.14 1.61 0.52 -1.10 -3.90 118.95 116.50 1xx6 s ARG 109 Ca 0.00 -1.70 -0.12 0.00 -0.52 0.00 0.00 55.73 53.40 1xx6 s ARG 109 Cb 0.00 -1.96 -0.05 0.00 0.52 0.00 0.00 34.95 33.46 1xx6 s ARG 109 CO 0.00 0.17 0.24 0.50 0.02 0.00 0.00 175.30 176.23 1xx6 s ARG 110 N -3.71 4.04 -0.13 3.54 3.52 -0.70 -2.17 118.95 123.35 1xx6 s ARG 110 Ca 0.34 0.01 0.02 0.00 -0.13 0.00 0.00 55.73 55.98 1xx6 s ARG 110 Cb -0.01 -3.35 0.01 0.00 -1.56 0.00 0.00 34.95 30.03 1xx6 s ARG 110 CO 0.19 0.41 -0.20 0.08 -0.81 0.00 0.00 175.30 174.98 1xx6 s VAL 111 N -0.04 1.87 -0.24 7.11 1.01 -0.64 -0.13 120.40 129.34 1xx6 s VAL 111 Ca 0.15 -0.87 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 1xx6 s VAL 111 Cb -0.13 -1.67 0.01 0.00 0.00 0.00 0.00 36.38 34.59 1xx6 s VAL 111 CO 0.04 0.51 -0.02 -0.63 0.00 0.00 0.00 175.10 175.00 1xx6 s ILE 112 N 0.86 3.35 -0.08 2.22 1.01 0.76 -1.02 121.20 128.30 1xx6 s ILE 112 Ca -0.07 -0.70 0.01 0.00 0.00 0.00 0.00 60.65 59.89 1xx6 s ILE 112 Cb -0.15 -2.62 -0.03 0.00 0.01 0.00 0.00 42.46 39.67 1xx6 s ILE 112 CO -0.01 0.28 -0.09 0.00 0.00 0.00 0.00 174.94 175.11 1xx6 s ALA 114 N -0.54 1.21 -0.17 0.00 0.00 0.15 0.31 121.76 122.72 1xx6 s ALA 114 Ca 0.08 -0.48 -0.35 0.00 0.00 0.00 0.00 51.96 51.21 1xx6 s ALA 114 Cb -0.12 -0.45 0.14 0.00 0.00 0.00 0.00 23.12 22.69 1xx6 s ALA 114 CO 0.02 0.18 1.22 0.20 0.00 0.00 0.00 175.76 177.38 1xx6 s GLY 115 N 0.25 -0.31 0.33 0.00 0.00 -0.50 -0.97 107.32 106.13 1xx6 s GLY 115 Ca -0.06 1.50 -0.29 0.00 0.00 0.00 0.00 44.72 45.87 1xx6 s GLY 115 CO 0.02 0.49 1.31 1.08 0.00 0.00 0.00 173.10 176.00 1xx6 s LEU 116 N -2.27 4.42 0.00 0.66 1.43 -1.26 -3.47 118.68 118.19 1xx6 s LEU 116 Ca 0.10 2.70 0.23 0.00 -1.03 0.00 0.00 54.13 56.13 1xx6 s LEU 116 Cb -0.00 -3.65 0.97 0.00 0.03 0.00 0.00 46.19 43.53 1xx6 s LEU 116 CO -0.04 -0.55 1.67 -0.90 0.23 0.00 0.00 176.35 176.76 1xx6 n ASP 117 N 0.84 1.27 -2.95 2.29 5.75 -1.25 -4.70 116.55 117.81 1xx6 n ASP 117 Ca 0.00 -1.56 -0.11 0.00 -0.01 0.00 0.00 54.79 53.12 1xx6 n ASP 117 Cb 0.42 -0.05 -0.02 0.00 -1.03 0.00 0.00 41.12 40.44 1xx6 n ASP 117 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1xx6 n ASP 119 N 0.03 2.24 0.30 -1.12 5.68 -0.03 -1.41 116.55 122.24 1xx6 n ASP 119 Ca 0.17 -1.74 0.18 0.00 -0.50 0.00 0.00 54.79 52.90 1xx6 n ASP 119 Cb 0.28 0.08 0.95 0.00 -1.14 0.00 0.00 41.12 41.30 1xx6 n ASP 119 CO 0.00 0.00 0.00 2.19 -1.33 0.00 0.00 177.20 178.06 1xx6 h PHE 120 N 0.94 0.00 -0.00 2.11 -0.00 -1.91 0.62 116.94 118.71 1xx6 h PHE 120 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.83 1xx6 h PHE 120 Cb 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.39 1xx6 h PHE 120 CO 0.00 0.03 -0.18 0.54 -0.00 0.00 0.00 178.31 178.71 1xx6 n ARG 121 N -3.41 0.25 -0.92 6.09 3.00 -1.26 -4.69 116.66 115.72 1xx6 n ARG 121 Ca -0.02 -0.08 0.00 0.00 -0.01 0.00 0.00 57.85 57.74 1xx6 n ARG 121 Cb 0.15 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.11 1xx6 n ARG 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1xx6 n GLY 122 N 1.42 0.60 3.88 -0.13 0.00 0.21 -5.01 105.19 106.16 1xx6 n GLY 122 Ca 0.09 -0.78 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 1xx6 n GLY 122 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xx6 s LYS 123 N -1.90 3.50 -0.12 1.61 -0.14 -1.26 -4.78 119.74 116.64 1xx6 s LYS 123 Ca 0.00 -0.14 -0.40 0.00 -1.36 0.00 0.00 55.97 54.08 1xx6 s LYS 123 Cb 0.00 -3.15 -0.17 0.00 -1.68 0.00 0.00 37.83 32.83 1xx6 s LYS 123 CO 0.00 0.72 1.47 -2.30 -0.76 0.00 0.00 175.35 174.48 1xx6 n PRO 124 N 1.53 0.84 -3.13 -1.68 -0.02 -1.26 -0.85 135.00 130.43 1xx6 n PRO 124 Ca -0.16 0.31 -0.42 0.00 -2.02 0.00 0.00 63.50 61.21 1xx6 n PRO 124 Cb 0.54 -1.93 -0.07 0.00 -0.02 0.00 0.00 33.50 32.02 1xx6 n PRO 124 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1xx6 s PHE 125 N 1.77 3.14 0.00 6.00 2.19 -0.50 -4.76 117.98 125.82 1xx6 s PHE 125 Ca 0.93 0.24 0.00 0.00 0.33 0.00 0.00 56.93 58.43 1xx6 s PHE 125 Cb -1.11 -3.16 0.00 0.00 -1.31 0.00 0.00 43.02 37.44 1xx6 s PHE 125 CO 0.59 -0.67 0.00 0.41 1.83 0.00 0.00 175.22 177.38 1xx6 n GLY 126 N 4.76 2.78 0.21 13.12 0.00 -1.26 -2.13 105.19 122.67 1xx6 n GLY 126 Ca -0.02 -0.15 0.03 0.00 0.00 0.00 0.00 46.02 45.88 1xx6 n GLY 126 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1xx6 n PRO 127 N 14.00 1.27 -0.16 1.61 -0.04 -1.26 -4.32 135.00 146.10 1xx6 n PRO 127 Ca 0.00 -0.42 -0.03 0.00 -0.04 0.00 0.00 63.50 63.01 1xx6 n PRO 127 Cb 0.00 -1.14 0.06 0.00 -0.04 0.00 0.00 33.50 32.38 1xx6 n PRO 127 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1xx6 h ILE 128 N 0.71 0.79 -0.43 0.52 1.08 -1.77 -1.47 117.51 116.93 1xx6 h ILE 128 Ca 0.00 -0.11 0.06 0.00 -0.39 0.00 0.00 64.86 64.43 1xx6 h ILE 128 Cb 0.16 0.46 -0.05 0.00 -3.07 0.00 0.00 36.82 34.32 1xx6 h ILE 128 CO 0.00 0.06 0.12 -0.65 -0.69 0.00 0.00 178.15 176.99 1xx6 h PRO 129 N 0.31 0.26 -0.24 2.37 0.11 -1.80 -2.52 132.00 130.48 1xx6 h PRO 129 Ca 0.24 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 66.24 1xx6 h PRO 129 Cb 0.28 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 1xx6 h PRO 129 CO -0.27 0.17 -0.25 0.93 -0.21 0.00 0.00 178.00 178.37 1xx6 h GLU 130 N 0.27 0.46 -1.14 1.05 3.07 -1.79 -1.66 114.58 114.84 1xx6 h GLU 130 Ca 0.21 -0.17 0.00 0.00 -0.50 0.00 0.00 59.36 58.90 1xx6 h GLU 130 Cb 0.23 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.11 1xx6 h GLU 130 CO -0.24 0.68 0.00 1.28 -1.40 0.00 0.00 179.01 179.33 1xx6 n LEU 131 N -4.12 1.03 0.00 1.33 4.77 -0.59 -2.00 117.00 117.43 1xx6 n LEU 131 Ca -0.00 -0.52 0.00 0.00 -0.03 0.00 0.00 56.01 55.46 1xx6 n LEU 131 Cb 0.40 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1xx6 n LEU 131 CO 0.42 0.19 0.00 0.00 -1.33 0.00 0.00 177.39 176.66 1xx6 n ALA 133 N 0.58 0.00 0.43 -1.18 0.00 -0.63 -1.14 120.51 118.58 1xx6 n ALA 133 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1xx6 n ALA 133 Cb 0.19 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.76 1xx6 n ALA 133 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 1xx6 h ILE 134 N 0.00 0.00 -3.88 0.00 3.07 -1.69 -3.48 117.51 111.54 1xx6 h ILE 134 Ca 0.00 -0.65 -0.52 0.00 1.55 0.00 0.00 64.86 65.25 1xx6 h ILE 134 Cb 0.00 1.22 0.05 0.00 -0.27 0.00 0.00 36.82 37.83 1xx6 h ILE 134 CO 0.00 0.00 0.57 0.00 -1.05 0.00 0.00 178.15 177.67 1xx6 s ALA 135 N -3.22 3.40 0.17 0.16 0.00 -0.29 -4.86 121.76 117.12 1xx6 s ALA 135 Ca 0.04 1.12 -0.01 0.00 0.00 0.00 0.00 51.96 53.11 1xx6 s ALA 135 Cb 0.12 -3.42 0.02 0.00 0.00 0.00 0.00 23.12 19.83 1xx6 s ALA 135 CO 0.74 -0.51 1.39 0.93 0.00 0.00 0.00 175.76 178.32 1xx6 h GLU 136 N 3.33 0.33 -5.02 0.00 3.07 -1.07 -3.44 114.58 111.79 1xx6 h GLU 136 Ca -0.48 -0.31 -0.62 0.00 -0.50 0.00 0.00 59.36 57.45 1xx6 h GLU 136 Cb 1.22 0.08 -0.33 0.00 -0.84 0.00 0.00 28.75 28.88 1xx6 h GLU 136 CO 0.65 0.98 -0.85 -0.06 -1.40 0.00 0.00 179.01 178.33 1xx6 s PHE 137 N -3.42 2.15 -0.12 4.33 0.08 -1.03 -5.04 117.98 114.93 1xx6 s PHE 137 Ca -0.05 -0.88 -0.01 0.00 0.12 0.00 0.00 56.93 56.12 1xx6 s PHE 137 Cb 0.10 -1.48 0.03 0.00 -0.57 0.00 0.00 43.02 41.10 1xx6 s PHE 137 CO 0.84 -0.38 -0.07 0.08 -0.10 0.00 0.00 175.22 175.59 1xx6 s VAL 138 N 0.52 0.99 -0.24 -0.44 1.01 -1.26 -0.42 120.40 120.55 1xx6 s VAL 138 Ca -0.16 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.52 1xx6 s VAL 138 Cb -0.17 -1.05 0.04 0.00 0.00 0.00 0.00 36.38 35.21 1xx6 s VAL 138 CO 0.06 0.32 -0.11 -1.81 0.00 0.00 0.00 175.10 173.56 1xx6 s ASP 139 N 1.72 4.18 -0.28 3.32 1.01 -0.26 -4.99 116.67 121.37 1xx6 s ASP 139 Ca 0.04 -1.13 -0.11 0.00 0.71 0.00 0.00 52.55 52.06 1xx6 s ASP 139 Cb -0.13 -1.57 -0.04 0.00 1.01 0.00 0.00 42.92 42.19 1xx6 s ASP 139 CO -0.08 -0.14 0.18 -0.75 0.21 0.00 0.00 175.17 174.59 1xx6 s LYS 140 N 1.20 3.86 0.26 8.23 2.20 -1.26 -1.04 119.74 133.19 1xx6 s LYS 140 Ca -0.04 -0.38 0.09 0.00 -0.36 0.00 0.00 55.97 55.28 1xx6 s LYS 140 Cb -0.18 -3.64 -0.04 0.00 -1.51 0.00 0.00 37.83 32.46 1xx6 s LYS 140 CO -0.06 -0.21 0.03 0.96 -0.36 0.00 0.00 175.35 175.70 1xx6 s ILE 141 N 1.74 3.60 0.21 5.43 -4.36 0.78 -4.97 121.20 123.62 1xx6 s ILE 141 Ca 0.07 -1.84 0.11 0.00 -0.26 0.00 0.00 60.65 58.73 1xx6 s ILE 141 Cb -0.16 -2.93 -0.04 0.00 1.25 0.00 0.00 42.46 40.58 1xx6 s ILE 141 CO 0.10 -0.37 -0.19 -1.10 0.24 0.00 0.00 174.94 173.62 1xx6 s GLN 142 N -3.70 1.71 0.00 0.37 -0.21 -1.26 -4.30 119.66 112.27 1xx6 s GLN 142 Ca 0.32 -1.49 0.00 0.00 0.02 0.00 0.00 55.36 54.20 1xx6 s GLN 142 Cb -0.07 -1.93 0.00 0.00 1.00 0.00 0.00 33.01 32.02 1xx6 s GLN 142 CO 0.21 0.40 0.00 0.00 -2.12 0.00 0.00 175.29 173.77 1xx6 n ALA 143 N 0.04 0.00 -2.89 6.09 0.00 -0.53 -4.64 120.51 118.56 1xx6 n ALA 143 Ca -0.11 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.00 1xx6 n ALA 143 Cb 0.57 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.88 1xx6 n ALA 143 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1xx6 s ILE 144 N 1.09 3.22 -0.20 0.00 -1.09 -1.26 0.05 121.20 123.01 1xx6 s ILE 144 Ca 0.00 -0.62 -0.29 0.00 -2.23 0.00 0.00 60.65 57.51 1xx6 s ILE 144 Cb 0.00 -2.34 -0.02 0.00 -1.58 0.00 0.00 42.46 38.52 1xx6 s ILE 144 CO 0.00 0.54 1.46 0.00 -1.23 0.00 0.00 174.94 175.71 1xx6 n VAL 146 N 5.95 1.19 -0.08 0.00 0.24 -1.13 -0.85 118.33 123.64 1xx6 n VAL 146 Ca 0.16 0.45 -0.23 0.00 -2.04 0.00 0.00 64.34 62.69 1xx6 n VAL 146 Cb 0.45 -1.38 -0.12 0.00 -1.47 0.00 0.00 33.84 31.32 1xx6 n VAL 146 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1xx6 n VAL 147 N -1.94 1.60 0.00 3.34 0.31 -1.26 -4.77 118.33 115.61 1xx6 n VAL 147 Ca 0.01 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 1xx6 n VAL 147 Cb 0.11 -1.91 0.00 0.00 -0.91 0.00 0.00 33.84 31.13 1xx6 n VAL 147 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xx6 n GLY 149 N 1.34 1.53 3.76 0.00 0.00 -0.03 -5.02 105.19 106.77 1xx6 n GLY 149 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1xx6 n GLY 149 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xx6 s ASN 150 N -2.05 2.91 0.35 1.61 0.02 -1.26 -4.50 114.94 112.02 1xx6 s ASN 150 Ca 0.00 0.84 -0.29 0.00 -1.02 0.00 0.00 52.86 52.39 1xx6 s ASN 150 Cb 0.00 -1.30 -0.11 0.00 0.02 0.00 0.00 41.25 39.86 1xx6 s ASN 150 CO 0.00 -2.91 1.53 -2.84 0.02 0.00 0.00 177.10 172.90 1xx6 s PRO 151 N -5.34 4.10 -0.15 -0.60 0.02 -1.26 -0.78 135.00 130.98 1xx6 s PRO 151 Ca 0.66 2.60 -0.07 0.00 0.02 0.00 0.00 61.00 64.22 1xx6 s PRO 151 Cb -0.13 -2.98 -0.04 0.00 0.02 0.00 0.00 34.50 31.37 1xx6 s PRO 151 CO 0.54 -0.59 0.09 0.00 -0.33 0.00 0.00 177.00 176.71 1xx6 s ALA 152 N -0.77 3.58 0.00 -1.55 0.00 0.11 -4.37 121.76 118.76 1xx6 s ALA 152 Ca 0.56 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.81 1xx6 s ALA 152 Cb -0.47 -1.89 0.00 0.00 0.00 0.00 0.00 23.12 20.75 1xx6 s ALA 152 CO 0.59 0.39 0.47 0.25 0.00 0.00 0.00 175.76 177.47 1xx6 n THR 153 N 2.77 0.15 -4.29 0.00 -2.24 -0.19 -1.46 114.28 109.02 1xx6 n THR 153 Ca -0.18 -0.45 -0.19 0.00 -2.27 0.00 0.00 64.05 60.96 1xx6 n THR 153 Cb 0.53 1.13 -0.11 0.00 -2.10 0.00 0.00 70.33 69.79 1xx6 n THR 153 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1xx6 s ARG 154 N -0.15 1.17 -0.30 -0.78 1.81 -0.44 -4.37 118.95 115.89 1xx6 s ARG 154 Ca 0.00 -1.37 -0.07 0.00 -1.72 0.00 0.00 55.73 52.57 1xx6 s ARG 154 Cb 0.00 -1.09 0.01 0.00 -0.45 0.00 0.00 34.95 33.41 1xx6 s ARG 154 CO 0.00 0.21 0.10 0.99 -0.68 0.00 0.00 175.30 175.92 1xx6 s THR 155 N -2.28 4.11 -0.20 0.02 2.01 -1.26 -0.74 115.64 117.29 1xx6 s THR 155 Ca 0.14 -0.64 -0.17 0.00 0.31 0.00 0.00 61.69 61.33 1xx6 s THR 155 Cb -0.04 -3.12 -0.03 0.00 0.01 0.00 0.00 72.50 69.32 1xx6 s THR 155 CO 0.05 0.07 0.47 -1.58 -0.69 0.00 0.00 174.62 172.94 1xx6 s GLN 156 N 1.52 4.18 -0.14 4.92 2.00 0.93 -4.33 119.66 128.74 1xx6 s GLN 156 Ca 0.03 0.32 -0.12 0.00 -2.00 0.00 0.00 55.36 53.59 1xx6 s GLN 156 Cb -0.17 -3.56 -0.05 0.00 0.80 0.00 0.00 33.01 30.04 1xx6 s GLN 156 CO 0.03 -0.11 0.25 0.50 -0.50 0.00 0.00 175.29 175.46 1xx6 s ARG 157 N 1.53 4.04 -0.02 1.67 3.52 -1.26 -1.67 118.95 126.75 1xx6 s ARG 157 Ca 0.22 0.03 0.05 0.00 -0.13 0.00 0.00 55.73 55.90 1xx6 s ARG 157 Cb -0.15 -3.35 -0.01 0.00 -1.56 0.00 0.00 34.95 29.88 1xx6 s ARG 157 CO 0.09 0.41 -0.16 -0.51 -0.81 0.00 0.00 175.30 174.33 1xx6 s LEU 158 N -0.05 1.97 -0.20 -0.88 1.43 0.13 -2.10 118.68 118.99 1xx6 s LEU 158 Ca 0.16 -0.30 0.01 0.00 -1.03 0.00 0.00 54.13 52.96 1xx6 s LEU 158 Cb -0.13 -0.86 0.04 0.00 0.03 0.00 0.00 46.19 45.28 1xx6 s LEU 158 CO 0.04 0.17 -0.12 -0.63 0.23 0.00 0.00 176.35 176.04 1xx6 s ILE 159 N -0.19 1.78 -1.66 -0.59 1.01 0.83 -0.31 121.20 122.06 1xx6 s ILE 159 Ca 0.02 -1.05 0.00 0.00 0.00 0.00 0.00 60.65 59.62 1xx6 s ILE 159 Cb -0.08 -1.80 0.00 0.00 0.01 0.00 0.00 42.46 40.59 1xx6 s ILE 159 CO 0.00 0.23 0.00 0.59 0.00 0.00 0.00 174.94 175.76 1xx6 n ASN 160 N 4.65 -5.50 -0.09 3.58 5.03 -1.26 -1.35 115.26 120.32 1xx6 n ASN 160 Ca -0.16 0.01 -0.01 0.00 0.87 0.00 0.00 54.58 55.29 1xx6 n ASN 160 Cb 0.47 -4.55 -0.01 0.00 -1.02 0.00 0.00 39.78 34.67 1xx6 n ASN 160 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1xx6 n GLY 161 N -1.00 0.50 3.35 7.41 0.00 -1.26 -5.03 105.19 109.16 1xx6 n GLY 161 Ca -0.23 -0.48 -0.29 0.00 0.00 0.00 0.00 46.02 45.03 1xx6 n GLY 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xx6 s LYS 162 N -1.21 1.55 0.14 1.61 -0.14 -0.46 -5.05 119.74 116.18 1xx6 s LYS 162 Ca 0.00 -1.20 -0.31 0.00 -1.36 0.00 0.00 55.97 53.10 1xx6 s LYS 162 Cb 0.00 -1.86 -0.11 0.00 -1.68 0.00 0.00 37.83 34.19 1xx6 s LYS 162 CO 0.00 0.46 1.80 -2.14 -0.76 0.00 0.00 175.35 174.71 1xx6 s PRO 163 N -1.62 4.14 0.41 -1.68 0.02 -1.26 -0.12 135.00 134.89 1xx6 s PRO 163 Ca 0.12 2.58 -0.26 0.00 0.02 0.00 0.00 61.00 63.47 1xx6 s PRO 163 Cb -0.10 -3.48 -0.08 0.00 0.02 0.00 0.00 34.50 30.85 1xx6 s PRO 163 CO 0.04 -0.82 1.25 0.00 -0.33 0.00 0.00 177.00 177.14 1xx6 s ALA 164 N 2.40 3.21 0.67 -1.55 0.00 -0.89 -4.75 121.76 120.83 1xx6 s ALA 164 Ca 0.79 1.12 -0.14 0.00 0.00 0.00 0.00 51.96 53.74 1xx6 s ALA 164 Cb -0.46 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.21 1xx6 s ALA 164 CO 0.35 -0.71 1.08 -0.06 0.00 0.00 0.00 175.76 176.42 1xx6 s PHE 165 N -1.32 2.83 0.29 0.00 0.40 -1.26 -4.11 117.98 114.80 1xx6 s PHE 165 Ca 0.57 1.51 0.03 0.00 -0.60 0.00 0.00 56.93 58.45 1xx6 s PHE 165 Cb -0.35 -3.04 0.68 0.00 0.51 0.00 0.00 43.02 40.82 1xx6 s PHE 165 CO 0.45 -1.43 1.73 -0.92 0.70 0.00 0.00 175.22 175.75 1xx6 h TYR 166 N -0.19 0.79 -0.95 0.36 3.20 -0.57 -2.22 116.97 117.38 1xx6 h TYR 166 Ca -0.46 0.04 -0.52 0.00 3.14 0.00 0.00 58.73 60.93 1xx6 h TYR 166 Cb 1.23 -0.21 -0.29 0.00 1.54 0.00 0.00 36.73 39.00 1xx6 h TYR 166 CO 0.58 0.08 0.66 -0.25 -1.64 0.00 0.00 178.16 177.59 1xx6 n ASP 167 N -4.93 4.27 -4.70 -2.11 9.92 -1.26 -4.96 116.55 112.79 1xx6 n ASP 167 Ca 0.21 -3.56 -0.41 0.00 -0.53 0.00 0.00 54.79 50.50 1xx6 n ASP 167 Cb 0.58 -0.85 -0.04 0.00 -0.64 0.00 0.00 41.12 40.17 1xx6 n ASP 167 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1xx6 s ASP 168 N -1.25 7.12 1.19 -2.24 1.01 -0.84 -5.05 116.67 116.61 1xx6 s ASP 168 Ca 0.55 1.36 -0.20 0.00 0.71 0.00 0.00 52.55 54.98 1xx6 s ASP 168 Cb 0.46 -2.49 0.29 0.00 1.01 0.00 0.00 42.92 42.19 1xx6 s ASP 168 CO 0.09 -0.30 1.15 -2.16 0.21 0.00 0.00 175.17 174.16 1xx6 s PRO 169 N 1.48 -1.15 -0.14 8.23 0.04 -1.26 -5.02 135.00 137.18 1xx6 s PRO 169 Ca 0.43 -0.20 -0.29 0.00 0.04 0.00 0.00 61.00 60.98 1xx6 s PRO 169 Cb -0.18 -1.62 -0.04 0.00 0.04 0.00 0.00 34.50 32.70 1xx6 s PRO 169 CO 0.19 -3.64 1.64 0.14 0.04 0.00 0.00 177.00 175.37 1xx6 s VAL 170 N -3.15 3.64 0.00 -0.36 -7.23 -1.26 -5.15 120.40 106.89 1xx6 s VAL 170 Ca 0.72 0.75 0.00 0.00 -1.81 0.00 0.00 61.98 61.64 1xx6 s VAL 170 Cb -0.08 -3.57 0.00 0.00 0.56 0.00 0.00 36.38 33.29 1xx6 s VAL 170 CO 0.55 -0.16 0.00 1.21 -0.31 0.00 0.00 175.10 176.39 1xx6 n GLU 177 N 7.39 0.00 -4.00 4.82 2.13 -1.26 -5.31 120.64 124.41 1xx6 n GLU 177 Ca 0.18 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.91 1xx6 n GLU 177 Cb 0.44 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 32.07 1xx6 n GLU 177 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1xx6 s SER 178 N 0.00 0.11 0.06 4.31 1.04 0.57 -4.98 113.70 114.81 1xx6 s SER 178 Ca 0.00 -0.94 0.05 0.00 0.48 0.00 0.00 55.95 55.54 1xx6 s SER 178 Cb 0.00 0.40 -0.03 0.00 0.10 0.00 0.00 66.02 66.49 1xx6 s SER 178 CO 0.00 -0.84 -0.13 -0.31 0.98 0.00 0.00 173.24 172.93 1xx6 s TYR 179 N -3.98 1.14 0.03 5.02 2.02 -1.26 0.21 117.35 120.53 1xx6 s TYR 179 Ca 0.18 -0.43 -0.26 0.00 -0.37 0.00 0.00 57.07 56.19 1xx6 s TYR 179 Cb 0.04 -0.65 0.06 0.00 -0.40 0.00 0.00 41.96 41.01 1xx6 s TYR 179 CO -0.00 0.03 0.60 -1.83 -1.57 0.00 0.00 175.55 172.78 1xx6 s GLU 180 N -1.55 1.08 0.18 -0.62 -1.05 -0.67 -4.98 118.70 111.09 1xx6 s GLU 180 Ca -0.02 -0.06 -0.24 0.00 -0.15 0.00 0.00 54.97 54.50 1xx6 s GLU 180 Cb -0.09 0.50 -0.08 0.00 -0.44 0.00 0.00 34.13 34.02 1xx6 s GLU 180 CO 0.02 -0.39 0.76 0.00 0.95 0.00 0.00 175.26 176.60 1xx6 s ALA 181 N -2.12 3.44 0.13 -0.84 0.00 -1.26 -0.04 121.76 121.06 1xx6 s ALA 181 Ca -0.07 0.30 -0.05 0.00 0.00 0.00 0.00 51.96 52.14 1xx6 s ALA 181 Cb -0.01 -2.91 -0.02 0.00 0.00 0.00 0.00 23.12 20.18 1xx6 s ALA 181 CO 0.01 0.30 0.14 1.03 0.00 0.00 0.00 175.76 177.25 1xx6 s ARG 182 N -1.40 0.96 0.77 0.00 0.52 0.08 -2.83 118.95 117.05 1xx6 s ARG 182 Ca 0.38 -1.26 -0.11 0.00 -0.52 0.00 0.00 55.73 54.22 1xx6 s ARG 182 Cb -0.21 0.30 0.05 0.00 0.52 0.00 0.00 34.95 35.61 1xx6 s ARG 182 CO 0.24 -0.30 1.08 0.00 0.02 0.00 0.00 175.30 176.35 1xx6 h ARG 184 N -0.99 -0.03 -0.67 0.00 2.43 -1.94 -0.52 114.38 112.66 1xx6 h ARG 184 Ca -0.46 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 58.75 1xx6 h ARG 184 Cb 1.25 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.77 1xx6 h ARG 184 CO 0.58 -0.02 0.44 -0.22 -1.51 0.00 0.00 179.97 179.24 1xx6 h LYS 185 N -0.03 0.77 0.00 0.20 3.64 -1.99 -2.80 116.57 116.37 1xx6 h LYS 185 Ca 0.01 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1xx6 h LYS 185 Cb 0.04 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.69 1xx6 h LYS 185 CO -0.02 0.51 -0.68 0.00 -2.27 0.00 0.00 179.45 176.99 1xx6 s HIS 187 N -3.31 3.12 -0.14 0.00 5.65 -0.22 -4.88 115.29 115.51 1xx6 s HIS 187 Ca 0.02 0.84 0.00 0.00 0.25 0.00 0.00 55.06 56.17 1xx6 s HIS 187 Cb 0.08 -3.81 0.02 0.00 -1.18 0.00 0.00 32.58 27.69 1xx6 s HIS 187 CO 0.75 -2.87 -0.12 0.08 -0.65 0.00 0.00 174.74 171.93 1xx6 s VAL 188 N 0.84 1.40 -0.54 0.89 1.01 -1.26 -4.98 120.40 117.76 1xx6 s VAL 188 Ca 0.65 -0.54 0.04 0.00 0.00 0.00 0.00 61.98 62.13 1xx6 s VAL 188 Cb -0.41 -1.35 0.15 0.00 0.00 0.00 0.00 36.38 34.78 1xx6 s VAL 188 CO 0.34 0.42 0.35 -0.69 0.00 0.00 0.00 175.10 175.51 1xx6 s VAL 189 N 1.56 1.88 0.64 2.92 1.01 -1.26 -4.64 120.40 122.49 1xx6 s VAL 189 Ca 0.05 -3.27 -0.18 0.00 0.00 0.00 0.00 61.98 58.58 1xx6 s VAL 189 Cb -0.13 -2.27 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 1xx6 s VAL 189 CO -0.10 -0.98 1.27 -2.16 0.00 0.00 0.00 175.10 173.13 1xx6 s PRO 190 N -0.41 2.63 0.00 2.72 0.04 -1.26 -4.68 135.00 134.05 1xx6 s PRO 190 Ca 0.23 2.00 0.00 0.00 0.04 0.00 0.00 61.00 63.27 1xx6 s PRO 190 Cb -0.13 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1xx6 s PRO 190 CO -0.09 -1.52 0.26 0.94 0.04 0.00 0.00 177.00 176.63