#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rbl n MET 3 N 0.00 -0.15 -4.29 -1.46 3.85 -1.26 -5.05 117.12 108.76 1rbl n MET 3 Ca 0.00 0.11 -0.33 0.00 -1.00 0.00 0.00 57.70 56.48 1rbl n MET 3 Cb 0.00 -0.12 -0.09 0.00 -1.05 0.00 0.00 33.22 31.96 1rbl n MET 3 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 1rbl s LYS 4 N -4.00 2.78 -0.07 3.17 -0.14 -1.26 -5.09 119.74 115.13 1rbl s LYS 4 Ca 0.00 -0.61 -0.30 0.00 -1.36 0.00 0.00 55.97 53.70 1rbl s LYS 4 Cb 0.00 -2.66 -0.04 0.00 -1.68 0.00 0.00 37.83 33.45 1rbl s LYS 4 CO 0.00 0.62 1.31 0.99 -0.76 0.00 0.00 175.35 177.51 1rbl s THR 5 N -1.08 4.06 0.16 2.17 2.01 -1.26 -5.01 115.64 116.69 1rbl s THR 5 Ca 0.19 1.37 -0.32 0.00 0.31 0.00 0.00 61.69 63.25 1rbl s THR 5 Cb -0.11 -3.88 -0.10 0.00 0.01 0.00 0.00 72.50 68.41 1rbl s THR 5 CO 0.10 -0.04 1.63 -0.22 -0.69 0.00 0.00 174.62 175.40 1rbl s LEU 6 N 2.75 4.37 0.78 4.42 2.96 -1.26 -4.99 118.68 127.71 1rbl s LEU 6 Ca 0.59 2.67 -0.11 0.00 -0.22 0.00 0.00 54.13 57.06 1rbl s LEU 6 Cb -0.26 -3.59 0.06 0.00 0.50 0.00 0.00 46.19 42.90 1rbl s LEU 6 CO 0.22 -0.88 1.09 -2.84 -1.32 0.00 0.00 176.35 172.62 1rbl s PRO 7 N 1.42 2.23 -0.22 0.98 0.02 -1.26 -5.04 135.00 133.12 1rbl s PRO 7 Ca 0.72 1.15 -0.15 0.00 0.02 0.00 0.00 61.00 62.74 1rbl s PRO 7 Cb -0.45 -1.89 -0.04 0.00 0.02 0.00 0.00 34.50 32.14 1rbl s PRO 7 CO 0.32 -1.66 0.36 0.15 -0.33 0.00 0.00 177.00 175.84 1rbl s LYS 8 N -4.91 4.13 -0.13 5.54 1.02 -1.26 -5.04 119.74 119.08 1rbl s LYS 8 Ca 0.61 0.11 -0.08 0.00 0.02 0.00 0.00 55.97 56.63 1rbl s LYS 8 Cb -0.17 -3.56 0.05 0.00 -0.52 0.00 0.00 37.83 33.62 1rbl s LYS 8 CO 0.56 -0.08 0.33 -2.00 -0.92 0.00 0.00 175.35 173.24 1rbl s GLU 9 N 1.45 0.32 0.37 1.68 2.12 -1.26 -5.14 118.70 118.22 1rbl s GLU 9 Ca 0.17 0.61 -0.27 0.00 0.36 0.00 0.00 54.97 55.83 1rbl s GLU 9 Cb -0.15 -0.01 -0.09 0.00 0.26 0.00 0.00 34.13 34.13 1rbl s GLU 9 CO 0.08 -0.13 1.29 0.50 -0.54 0.00 0.00 175.26 176.45 1rbl s ARG 10 N 1.06 4.18 0.47 4.30 3.52 -1.26 -5.05 118.95 126.17 1rbl s ARG 10 Ca -0.07 2.15 0.04 0.00 -0.13 0.00 0.00 55.73 57.72 1rbl s ARG 10 Cb -0.08 -2.91 -0.03 0.00 -1.56 0.00 0.00 34.95 30.36 1rbl s ARG 10 CO -0.08 -0.31 0.03 1.03 -0.81 0.00 0.00 175.30 175.16 1rbl s ARG 11 N -2.01 2.12 -0.28 5.12 1.81 -1.26 -5.09 118.95 119.36 1rbl s ARG 11 Ca 0.53 -2.26 0.21 0.00 -1.72 0.00 0.00 55.73 52.48 1rbl s ARG 11 Cb -0.38 -1.62 0.49 0.00 -0.45 0.00 0.00 34.95 32.99 1rbl s ARG 11 CO 0.50 -0.26 1.16 1.19 -0.68 0.00 0.00 175.30 177.21 1rbl n PHE 12 N -1.19 0.66 -4.89 -0.53 3.72 -1.26 -5.11 117.46 108.86 1rbl n PHE 12 Ca -0.13 -2.16 0.00 0.00 -0.05 0.00 0.00 57.45 55.12 1rbl n PHE 12 Cb 0.67 0.06 0.00 0.00 -0.94 0.00 0.00 39.48 39.27 1rbl n PHE 12 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1rbl n GLU 13 N -0.67 0.00 -1.69 -1.08 -0.58 -1.26 -4.61 120.64 110.75 1rbl n GLU 13 Ca 0.03 0.00 -0.44 0.00 -0.42 0.00 0.00 57.16 56.34 1rbl n GLU 13 Cb 0.82 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 31.65 1rbl n GLU 13 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1rbl n THR 14 N 0.00 0.18 -0.70 2.62 -1.04 -1.26 -1.37 114.28 112.71 1rbl n THR 14 Ca 0.00 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 1rbl n THR 14 Cb 0.00 -1.92 0.00 0.00 -1.82 0.00 0.00 70.33 66.59 1rbl n THR 14 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1rbl n PHE 15 N 4.66 0.00 1.77 -1.42 3.72 -1.26 -4.60 117.46 120.33 1rbl n PHE 15 Ca 0.17 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.73 1rbl n PHE 15 Cb 0.34 0.00 0.87 0.00 -0.94 0.00 0.00 39.48 39.75 1rbl n PHE 15 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1rbl n SER 16 N 0.00 0.00 -0.81 4.37 3.41 -0.47 -1.74 113.62 118.37 1rbl n SER 16 Ca 0.00 -0.66 0.11 0.00 -0.26 0.00 0.00 58.87 58.06 1rbl n SER 16 Cb 0.00 -0.11 0.07 0.00 -0.26 0.00 0.00 64.21 63.91 1rbl n SER 16 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1rbl n TYR 17 N -1.11 0.00 -3.21 7.33 4.02 -1.26 -4.80 117.16 118.12 1rbl n TYR 17 Ca 0.20 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.85 1rbl n TYR 17 Cb 0.16 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.47 1rbl n TYR 17 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1rbl s LEU 18 N -1.99 3.91 0.28 7.72 1.43 -0.71 -5.06 118.68 124.26 1rbl s LEU 18 Ca 0.24 0.53 -0.27 0.00 -1.03 0.00 0.00 54.13 53.61 1rbl s LEU 18 Cb 0.18 -3.41 -0.15 0.00 0.03 0.00 0.00 46.19 42.85 1rbl s LEU 18 CO 0.34 -0.38 0.78 -2.65 0.23 0.00 0.00 176.35 174.67 1rbl n PRO 19 N -1.90 0.80 -1.57 1.29 -0.02 -1.26 -4.84 135.00 127.50 1rbl n PRO 19 Ca -0.03 0.28 -0.51 0.00 -2.02 0.00 0.00 63.50 61.22 1rbl n PRO 19 Cb 0.56 -1.52 -0.05 0.00 -0.02 0.00 0.00 33.50 32.47 1rbl n PRO 19 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1rbl n PRO 20 N 0.78 1.01 -2.38 0.52 -0.02 -1.26 -4.87 135.00 128.78 1rbl n PRO 20 Ca 0.12 0.36 -0.42 0.00 -2.02 0.00 0.00 63.50 61.55 1rbl n PRO 20 Cb 0.31 -1.88 -0.03 0.00 -0.02 0.00 0.00 33.50 31.88 1rbl n PRO 20 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1rbl s LEU 21 N 0.64 4.38 0.81 2.45 1.43 -1.26 -5.02 118.68 122.11 1rbl s LEU 21 Ca 0.78 2.10 -0.10 0.00 -1.03 0.00 0.00 54.13 55.87 1rbl s LEU 21 Cb -0.92 -3.58 0.08 0.00 0.03 0.00 0.00 46.19 41.79 1rbl s LEU 21 CO 0.51 -0.48 1.10 -0.94 0.23 0.00 0.00 176.35 176.78 1rbl s SER 22 N 0.92 4.09 0.53 2.29 1.04 -1.26 -4.79 113.70 116.52 1rbl s SER 22 Ca 0.59 1.91 0.35 0.00 0.48 0.00 0.00 55.95 59.28 1rbl s SER 22 Cb -0.31 -2.53 1.72 0.00 0.10 0.00 0.00 66.02 65.01 1rbl s SER 22 CO 0.30 -2.32 2.07 0.44 0.98 0.00 0.00 173.24 174.71 1rbl h ASP 23 N -1.32 0.00 0.88 7.02 5.19 -1.99 0.19 116.42 126.39 1rbl h ASP 23 Ca -0.44 0.00 -0.23 0.00 -0.62 0.00 0.00 57.03 55.74 1rbl h ASP 23 Cb 1.24 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.73 1rbl h ASP 23 CO 0.49 0.00 -1.12 0.03 -3.12 0.00 0.00 179.24 175.52 1rbl h ARG 24 N 0.00 0.05 -0.15 3.56 3.08 -1.99 -1.88 114.38 117.06 1rbl h ARG 24 Ca 0.00 -0.09 -0.17 0.00 0.07 0.00 0.00 59.98 59.80 1rbl h ARG 24 Cb 0.23 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1rbl h ARG 24 CO 0.00 0.99 -0.60 1.96 -1.07 0.00 0.00 179.97 181.26 1rbl h GLN 25 N 0.01 0.50 -0.35 0.04 4.20 -1.08 -1.95 115.11 116.48 1rbl h GLN 25 Ca -0.06 -0.34 -0.02 0.00 0.06 0.00 0.00 58.65 58.29 1rbl h GLN 25 Cb 1.83 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 29.65 1rbl h GLN 25 CO 0.14 0.95 0.14 0.82 -0.67 0.00 0.00 178.83 180.21 1rbl h ILE 26 N 0.37 1.19 -0.37 2.54 2.04 -0.96 -2.62 117.51 119.71 1rbl h ILE 26 Ca -0.00 -0.59 -0.04 0.00 1.00 0.00 0.00 64.86 65.23 1rbl h ILE 26 Cb 1.15 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 1rbl h ILE 26 CO 0.11 0.21 0.07 0.00 0.00 0.00 0.00 178.15 178.54 1rbl h ALA 27 N 0.98 1.44 -0.48 1.87 0.00 -1.24 -1.53 119.26 120.30 1rbl h ALA 27 Ca 0.12 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1rbl h ALA 27 Cb 0.19 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1rbl h ALA 27 CO -0.01 0.41 -0.03 0.00 0.00 0.00 0.00 179.25 179.62 1rbl h ALA 28 N 1.55 1.04 -0.33 0.00 0.00 -1.14 0.12 119.26 120.50 1rbl h ALA 28 Ca 0.12 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.60 1rbl h ALA 28 Cb 0.23 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1rbl h ALA 28 CO -0.00 0.59 -0.38 1.96 0.00 0.00 0.00 179.25 181.42 1rbl h GLN 29 N 0.76 0.79 -0.09 0.00 1.08 -1.00 -2.16 115.11 114.49 1rbl h GLN 29 Ca 0.14 -0.40 -0.12 0.00 -1.45 0.00 0.00 58.65 56.82 1rbl h GLN 29 Cb 0.50 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.93 1rbl h GLN 29 CO 0.03 1.03 -0.48 0.82 -0.95 0.00 0.00 178.83 179.28 1rbl h ILE 30 N 0.65 1.34 -0.64 2.54 2.04 -0.92 -2.07 117.51 120.44 1rbl h ILE 30 Ca 0.06 -1.68 -0.04 0.00 1.00 0.00 0.00 64.86 64.20 1rbl h ILE 30 Cb 0.93 1.80 -0.03 0.00 -0.74 0.00 0.00 36.82 38.79 1rbl h ILE 30 CO 0.09 0.50 0.24 -0.33 0.00 0.00 0.00 178.15 178.64 1rbl h GLU 31 N 0.17 0.96 -0.25 2.37 5.08 -0.67 -1.85 114.58 120.39 1rbl h GLU 31 Ca 0.01 -0.18 0.01 0.00 -1.00 0.00 0.00 59.36 58.20 1rbl h GLU 31 Cb 0.91 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 1rbl h GLU 31 CO 0.07 0.82 0.14 -0.92 -1.00 0.00 0.00 179.01 178.12 1rbl h TYR 32 N 0.90 0.26 -0.15 4.33 3.20 -1.07 -0.96 116.97 123.48 1rbl h TYR 32 Ca 0.21 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.12 1rbl h TYR 32 Cb 0.23 -0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.36 1rbl h TYR 32 CO 0.01 0.15 -0.49 0.52 -1.64 0.00 0.00 178.16 176.72 1rbl h MET 33 N 0.29 -0.48 -0.48 1.82 2.86 -1.20 0.30 114.93 118.04 1rbl h MET 33 Ca 0.10 0.03 0.07 0.00 -2.06 0.00 0.00 59.70 57.84 1rbl h MET 33 Cb 0.01 0.11 -0.06 0.00 0.06 0.00 0.00 31.60 31.72 1rbl h MET 33 CO -0.06 -0.32 0.15 0.82 1.06 0.00 0.00 176.91 178.57 1rbl h ILE 34 N -0.50 0.82 -0.51 -1.22 1.08 -1.17 -0.66 117.51 115.35 1rbl h ILE 34 Ca 0.03 -0.11 -0.03 0.00 -0.39 0.00 0.00 64.86 64.36 1rbl h ILE 34 Cb 0.59 0.47 -0.02 0.00 -3.07 0.00 0.00 36.82 34.79 1rbl h ILE 34 CO -0.41 0.06 0.18 -0.08 -0.69 0.00 0.00 178.15 177.21 1rbl h GLU 35 N 0.31 0.74 0.00 2.37 4.81 -0.87 -1.18 114.58 120.77 1rbl h GLU 35 Ca 0.23 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1rbl h GLU 35 Cb 0.25 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1rbl h GLU 35 CO -0.25 0.63 0.00 0.94 -0.73 0.00 0.00 179.01 179.60 1rbl n GLN 36 N -4.33 0.23 -0.46 1.92 -0.06 0.07 -4.91 117.38 109.83 1rbl n GLN 36 Ca 0.04 0.21 0.00 0.00 -2.00 0.00 0.00 57.00 55.25 1rbl n GLN 36 Cb 0.17 -1.78 0.00 0.00 -4.06 0.00 0.00 30.24 24.57 1rbl n GLN 36 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1rbl n GLY 37 N 1.19 0.77 3.82 1.69 0.00 -0.35 -5.06 105.19 107.24 1rbl n GLY 37 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 1rbl n GLY 37 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rbl s PHE 38 N -2.07 3.22 -0.21 1.61 0.08 -0.63 -4.92 117.98 115.05 1rbl s PHE 38 Ca 0.00 1.57 -0.14 0.00 0.12 0.00 0.00 56.93 58.48 1rbl s PHE 38 Cb 0.00 -2.91 -0.04 0.00 -0.57 0.00 0.00 43.02 39.49 1rbl s PHE 38 CO 0.00 -0.43 0.32 -1.01 -0.10 0.00 0.00 175.22 174.01 1rbl s HIS 39 N -2.21 3.37 0.34 0.36 3.76 -0.32 -4.46 115.29 116.13 1rbl s HIS 39 Ca 0.63 0.51 -0.27 0.00 -0.15 0.00 0.00 55.06 55.78 1rbl s HIS 39 Cb -0.12 -2.44 -0.09 0.00 1.11 0.00 0.00 32.58 31.04 1rbl s HIS 39 CO 0.19 0.04 1.13 -2.14 -0.85 0.00 0.00 174.74 173.11 1rbl s PRO 40 N 1.15 4.37 -0.01 8.40 0.02 -1.25 -0.51 135.00 147.16 1rbl s PRO 40 Ca 0.16 1.79 0.00 0.00 0.02 0.00 0.00 61.00 62.97 1rbl s PRO 40 Cb -0.14 -2.92 0.02 0.00 0.02 0.00 0.00 34.50 31.48 1rbl s PRO 40 CO 0.07 -0.03 0.01 -1.17 -0.33 0.00 0.00 177.00 175.54 1rbl s LEU 41 N -1.99 1.44 -0.17 -5.54 2.96 0.77 -0.98 118.68 115.18 1rbl s LEU 41 Ca 0.51 0.00 -0.03 0.00 -0.22 0.00 0.00 54.13 54.39 1rbl s LEU 41 Cb -0.30 -0.10 -0.02 0.00 0.50 0.00 0.00 46.19 46.27 1rbl s LEU 41 CO 0.39 -0.07 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.67 1rbl s ILE 42 N 0.65 3.71 0.14 6.68 1.01 -1.26 -0.40 121.20 131.73 1rbl s ILE 42 Ca -0.06 -0.42 0.06 0.00 0.00 0.00 0.00 60.65 60.24 1rbl s ILE 42 Cb -0.08 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.72 1rbl s ILE 42 CO -0.02 0.48 -0.14 -1.61 0.00 0.00 0.00 174.94 173.66 1rbl s GLU 43 N 0.60 1.08 0.04 2.79 2.02 -0.82 -0.80 118.70 123.61 1rbl s GLU 43 Ca -0.03 -1.32 0.01 0.00 0.02 0.00 0.00 54.97 53.64 1rbl s GLU 43 Cb -0.15 -0.92 -0.03 0.00 0.10 0.00 0.00 34.13 33.14 1rbl s GLU 43 CO 0.03 0.17 -0.05 -0.59 0.02 0.00 0.00 175.26 174.83 1rbl s PHE 44 N -2.41 0.50 -0.07 1.61 -0.71 0.05 -1.06 117.98 115.89 1rbl s PHE 44 Ca 0.12 -0.68 -0.12 0.00 -1.04 0.00 0.00 56.93 55.21 1rbl s PHE 44 Cb -0.03 -0.33 0.03 0.00 -1.21 0.00 0.00 43.02 41.47 1rbl s PHE 44 CO 0.03 -0.20 0.30 1.21 -1.34 0.00 0.00 175.22 175.23 1rbl s ASN 45 N -1.99 -0.26 0.26 1.98 3.04 -0.54 -1.17 114.94 116.27 1rbl s ASN 45 Ca -0.06 0.38 0.25 0.00 0.04 0.00 0.00 52.86 53.48 1rbl s ASN 45 Cb -0.04 0.50 0.89 0.00 -1.54 0.00 0.00 41.25 41.05 1rbl s ASN 45 CO -0.03 -0.24 1.75 1.05 -3.04 0.00 0.00 177.10 176.59 1rbl h GLU 46 N 4.94 0.00 -4.64 0.43 9.09 -1.88 0.18 114.58 122.71 1rbl h GLU 46 Ca -0.28 0.00 -0.22 0.00 0.05 0.00 0.00 59.36 58.91 1rbl h GLU 46 Cb 1.18 0.00 -0.15 0.00 -1.65 0.00 0.00 28.75 28.14 1rbl h GLU 46 CO 0.35 0.00 -0.70 -1.01 0.05 0.00 0.00 179.01 177.70 1rbl s HIS 47 N -3.23 0.87 -0.68 2.06 3.76 -1.26 -4.74 115.29 112.07 1rbl s HIS 47 Ca 0.07 -0.92 0.05 0.00 -0.15 0.00 0.00 55.06 54.12 1rbl s HIS 47 Cb 0.10 -0.51 0.24 0.00 1.11 0.00 0.00 32.58 33.53 1rbl s HIS 47 CO 0.51 -0.16 0.77 0.45 -0.85 0.00 0.00 174.74 175.46 1rbl n SER 48 N -0.02 3.87 -4.58 1.40 2.88 -1.26 -4.90 113.62 111.00 1rbl n SER 48 Ca -0.12 -3.42 -0.39 0.00 -1.33 0.00 0.00 58.87 53.61 1rbl n SER 48 Cb 0.61 -0.72 -0.10 0.00 -0.75 0.00 0.00 64.21 63.25 1rbl n SER 48 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1rbl s ASN 49 N -2.29 6.17 0.55 -3.46 0.01 -1.26 -4.97 114.94 109.68 1rbl s ASN 49 Ca 0.38 0.05 0.28 0.00 -0.71 0.00 0.00 52.86 52.86 1rbl s ASN 49 Cb 0.12 -2.18 1.61 0.00 0.41 0.00 0.00 41.25 41.21 1rbl s ASN 49 CO -0.02 -0.19 2.15 1.55 -1.51 0.00 0.00 177.10 179.08 1rbl h PRO 50 N 8.31 0.00 0.00 -0.60 0.13 -1.99 -2.63 132.00 135.22 1rbl h PRO 50 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1rbl h PRO 50 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1rbl h PRO 50 CO 0.63 0.07 0.00 0.93 -0.23 0.00 0.00 178.00 179.40 1rbl h GLU 51 N 0.00 0.00 -6.10 0.86 3.07 -2.04 -3.44 114.58 106.93 1rbl h GLU 51 Ca -0.00 0.00 -0.57 0.00 -0.50 0.00 0.00 59.36 58.29 1rbl h GLU 51 Cb 0.19 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.05 1rbl h GLU 51 CO 0.01 0.00 -0.03 -1.21 -1.40 0.00 0.00 179.01 176.38 1rbl s GLU 64 N -3.24 4.29 0.01 2.33 0.41 -0.99 -4.98 118.70 116.52 1rbl s GLU 64 Ca 0.07 0.72 -0.10 0.00 -0.41 0.00 0.00 54.97 55.25 1rbl s GLU 64 Cb 0.10 -3.32 -0.32 0.00 -1.78 0.00 0.00 34.13 28.81 1rbl s GLU 64 CO 0.54 0.42 0.90 0.74 -0.49 0.00 0.00 175.26 177.37 1rbl h PHE 65 N 5.43 0.73 -3.32 1.61 0.04 -1.88 -3.47 116.94 116.08 1rbl h PHE 65 Ca -0.46 -0.53 -0.65 0.00 2.80 0.00 0.00 57.97 59.13 1rbl h PHE 65 Cb 1.20 -0.03 -0.25 0.00 2.20 0.00 0.00 35.95 39.07 1rbl h PHE 65 CO 0.66 1.52 -0.73 0.71 -0.60 0.00 0.00 178.31 179.87 1rbl s TYR 66 N -2.61 2.89 0.43 -0.55 2.02 -1.26 -5.11 117.35 113.17 1rbl s TYR 66 Ca -0.10 -0.54 0.08 0.00 -0.37 0.00 0.00 57.07 56.14 1rbl s TYR 66 Cb 0.05 -1.90 0.01 0.00 -0.40 0.00 0.00 41.96 39.72 1rbl s TYR 66 CO 0.89 -0.17 0.53 -1.58 -1.57 0.00 0.00 175.55 173.66 1rbl s TRP 67 N 0.41 2.69 0.00 2.71 0.52 -1.26 -5.06 118.94 118.95 1rbl s TRP 67 Ca -0.08 -0.45 -0.20 0.00 0.02 0.00 0.00 56.10 55.40 1rbl s TRP 67 Cb -0.15 -2.31 -0.06 0.00 -1.15 0.00 0.00 33.47 29.80 1rbl s TRP 67 CO 0.04 -0.38 0.56 0.99 0.02 0.00 0.00 176.95 178.18 1rbl s THR 68 N -2.41 4.90 0.05 2.01 2.01 -0.32 -4.88 115.64 117.01 1rbl s THR 68 Ca 0.53 1.18 -0.30 0.00 0.31 0.00 0.00 61.69 63.41 1rbl s THR 68 Cb -0.08 -3.90 -0.05 0.00 0.01 0.00 0.00 72.50 68.49 1rbl s THR 68 CO 0.32 0.45 1.09 -0.32 -0.69 0.00 0.00 174.62 175.48 1rbl s MET 69 N -0.40 4.50 -0.34 4.92 1.75 -1.26 -0.77 119.30 127.71 1rbl s MET 69 Ca 0.30 1.61 -0.26 0.00 -1.25 0.00 0.00 55.69 56.09 1rbl s MET 69 Cb -0.18 -3.39 0.01 0.00 2.84 0.00 0.00 34.83 34.11 1rbl s MET 69 CO 0.17 -0.14 0.92 -0.46 -0.65 0.00 0.00 175.02 174.86 1rbl s TRP 70 N 0.92 3.13 0.00 4.11 -0.11 0.02 -4.89 118.94 122.12 1rbl s TRP 70 Ca 0.55 0.88 0.00 0.00 1.22 0.00 0.00 56.10 58.75 1rbl s TRP 70 Cb -0.26 -3.52 0.00 0.00 -1.50 0.00 0.00 33.47 28.19 1rbl s TRP 70 CO 0.29 -0.73 0.00 1.63 -4.62 0.00 0.00 176.95 173.52 1rbl n LYS 71 N 6.61 0.00 -4.29 5.86 5.02 -1.26 -4.63 118.16 125.47 1rbl n LYS 71 Ca 0.07 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.21 1rbl n LYS 71 Cb 0.48 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.39 1rbl n LYS 71 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1rbl s LEU 72 N 0.00 2.27 0.52 -0.35 1.43 -1.26 -5.13 118.68 116.16 1rbl s LEU 72 Ca 0.00 -1.15 -0.23 0.00 -1.03 0.00 0.00 54.13 51.72 1rbl s LEU 72 Cb 0.00 -0.25 -0.06 0.00 0.03 0.00 0.00 46.19 45.91 1rbl s LEU 72 CO 0.00 -0.47 1.35 -2.65 0.23 0.00 0.00 176.35 174.81 1rbl n PRO 73 N -0.32 1.79 -2.72 1.29 -0.02 -1.26 -4.85 135.00 128.91 1rbl n PRO 73 Ca -0.07 0.65 -0.43 0.00 -2.02 0.00 0.00 63.50 61.63 1rbl n PRO 73 Cb 0.63 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1rbl n PRO 73 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1rbl n LEU 74 N -0.74 5.11 0.11 2.45 4.77 -0.15 -4.84 117.00 123.71 1rbl n LEU 74 Ca 0.09 -4.16 0.02 0.00 -0.03 0.00 0.00 56.01 51.93 1rbl n LEU 74 Cb 0.44 -1.69 0.37 0.00 -2.33 0.00 0.00 43.42 40.21 1rbl n LEU 74 CO 0.55 0.42 0.88 -0.26 -1.33 0.00 0.00 177.39 177.64 1rbl h PHE 75 N 7.34 0.27 -1.35 -1.77 0.04 -1.90 -2.48 116.94 117.09 1rbl h PHE 75 Ca 0.40 -0.03 -0.58 0.00 2.80 0.00 0.00 57.97 60.56 1rbl h PHE 75 Cb 0.86 -0.08 -0.42 0.00 2.20 0.00 0.00 35.95 38.52 1rbl h PHE 75 CO 1.29 0.40 -0.76 0.00 -0.60 0.00 0.00 178.31 178.64 1rbl n ALA 76 N -2.49 5.03 -2.23 2.45 0.00 -1.26 -4.87 120.51 117.14 1rbl n ALA 76 Ca -0.01 -4.20 -0.42 0.00 0.00 0.00 0.00 53.44 48.81 1rbl n ALA 76 Cb 0.28 -0.50 -0.03 0.00 0.00 0.00 0.00 19.45 19.20 1rbl n ALA 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rbl n ALA 78 N 6.27 2.05 -3.06 0.00 0.00 -1.26 -4.93 120.51 119.57 1rbl n ALA 78 Ca 0.14 -0.63 -0.34 0.00 0.00 0.00 0.00 53.44 52.61 1rbl n ALA 78 Cb 0.44 -0.23 -0.13 0.00 0.00 0.00 0.00 19.45 19.53 1rbl n ALA 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rbl s ALA 79 N -2.61 2.89 0.42 0.00 0.00 -1.26 -4.98 121.76 116.22 1rbl s ALA 79 Ca -0.06 -0.90 0.18 0.00 0.00 0.00 0.00 51.96 51.19 1rbl s ALA 79 Cb 0.06 -1.51 1.10 0.00 0.00 0.00 0.00 23.12 22.78 1rbl s ALA 79 CO 0.56 0.11 1.85 -1.35 0.00 0.00 0.00 175.76 176.92 1rbl h PRO 80 N 6.95 0.38 -0.71 0.00 0.11 -1.93 -2.11 132.00 134.68 1rbl h PRO 80 Ca -0.31 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.71 1rbl h PRO 80 Cb 1.19 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 1rbl h PRO 80 CO 0.60 0.25 0.18 0.37 -0.21 0.00 0.00 178.00 179.19 1rbl h GLN 81 N 0.39 1.14 -0.74 1.05 5.75 -1.97 -0.37 115.11 120.35 1rbl h GLN 81 Ca 0.48 -0.27 0.08 0.00 -0.15 0.00 0.00 58.65 58.80 1rbl h GLN 81 Cb 1.24 -0.15 -0.07 0.00 1.07 0.00 0.00 27.48 29.57 1rbl h GLN 81 CO -0.18 1.00 0.40 0.37 -2.65 0.00 0.00 178.83 177.76 1rbl h GLN 82 N 1.07 0.68 -0.15 1.69 4.15 -1.80 0.29 115.11 121.05 1rbl h GLN 82 Ca 0.22 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.58 1rbl h GLN 82 Cb 0.36 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 1rbl h GLN 82 CO 0.00 0.45 -0.01 0.28 -1.93 0.00 0.00 178.83 177.62 1rbl h VAL 83 N 0.70 1.26 -0.34 2.39 2.07 -1.36 -2.73 116.25 118.24 1rbl h VAL 83 Ca 0.35 -0.87 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 1rbl h VAL 83 Cb 0.31 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1rbl h VAL 83 CO -0.24 0.26 0.12 -0.07 0.02 0.00 0.00 177.57 177.66 1rbl h LEU 84 N -0.01 0.43 -0.72 2.57 3.38 -0.33 -0.86 115.31 119.77 1rbl h LEU 84 Ca 0.04 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1rbl h LEU 84 Cb 0.39 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1rbl h LEU 84 CO 0.01 0.40 -0.07 0.44 0.09 0.00 0.00 178.44 179.31 1rbl h ASP 85 N 0.47 0.89 -0.09 -0.43 3.32 -0.32 -0.84 116.42 119.42 1rbl h ASP 85 Ca 0.12 -0.27 -0.16 0.00 0.02 0.00 0.00 57.03 56.74 1rbl h ASP 85 Cb 0.12 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 1rbl h ASP 85 CO -0.01 0.99 -0.50 -0.33 -1.72 0.00 0.00 179.24 177.68 1rbl h GLU 86 N 0.82 0.66 -0.86 3.56 4.39 -1.02 -1.21 114.58 120.92 1rbl h GLU 86 Ca 0.14 -0.39 -0.00 0.00 0.34 0.00 0.00 59.36 59.45 1rbl h GLU 86 Cb 0.59 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.23 1rbl h GLU 86 CO 0.04 1.01 0.53 0.28 -1.16 0.00 0.00 179.01 179.70 1rbl h VAL 87 N 0.52 1.23 -0.22 3.13 2.07 -0.82 0.12 116.25 122.28 1rbl h VAL 87 Ca 0.02 -0.49 -0.03 0.00 0.82 0.00 0.00 66.70 67.02 1rbl h VAL 87 Cb 1.05 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1rbl h VAL 87 CO 0.10 0.24 0.01 0.03 0.02 0.00 0.00 177.57 177.97 1rbl h ARG 88 N 1.19 0.38 -0.56 1.57 2.47 -0.93 -1.61 114.38 116.88 1rbl h ARG 88 Ca 0.31 -0.12 0.04 0.00 -1.26 0.00 0.00 59.98 58.96 1rbl h ARG 88 Cb -0.07 -0.04 -0.04 0.00 -1.65 0.00 0.00 29.97 28.17 1rbl h ARG 88 CO -0.06 0.56 0.31 0.93 0.56 0.00 0.00 179.97 182.26 1rbl h GLU 89 N 0.15 0.57 -0.81 0.04 5.08 -0.85 -2.19 114.58 116.59 1rbl h GLU 89 Ca 0.06 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1rbl h GLU 89 Cb 0.38 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 1rbl h GLU 89 CO 0.01 0.38 0.37 0.00 -1.00 0.00 0.00 179.01 178.77 1rbl h ARG 91 N 1.16 0.94 0.00 0.00 -0.00 -0.83 0.42 114.38 116.05 1rbl h ARG 91 Ca 0.28 -0.27 -0.09 0.00 -0.50 0.00 0.00 59.98 59.39 1rbl h ARG 91 Cb 0.14 -0.10 -0.01 0.00 0.00 0.00 0.00 29.97 30.00 1rbl h ARG 91 CO -0.03 0.93 -0.42 0.66 0.00 0.00 0.00 179.97 181.10 1rbl h SER 92 N 0.86 0.00 0.52 7.04 4.64 -1.19 -0.96 113.55 124.46 1rbl h SER 92 Ca 0.16 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.19 1rbl h SER 92 Cb 0.51 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.57 1rbl h SER 92 CO 0.02 0.42 -1.57 -0.08 -0.87 0.00 0.00 176.83 174.75 1rbl h GLU 93 N 0.00 0.10 -1.29 4.77 4.57 -1.19 -3.40 114.58 118.14 1rbl h GLU 93 Ca -0.00 -0.17 -0.44 0.00 -1.18 0.00 0.00 59.36 57.56 1rbl h GLU 93 Cb 0.76 0.06 -0.41 0.00 -0.16 0.00 0.00 28.75 29.01 1rbl h GLU 93 CO 0.06 0.84 -1.05 0.66 -1.18 0.00 0.00 179.01 178.33 1rbl n TYR 94 N -3.26 1.77 0.39 0.92 4.01 0.14 -4.88 117.16 116.25 1rbl n TYR 94 Ca -0.16 -3.04 0.13 0.00 -0.16 0.00 0.00 57.90 54.68 1rbl n TYR 94 Cb 1.03 -0.31 0.52 0.00 -0.31 0.00 0.00 39.34 40.27 1rbl n TYR 94 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1rbl h GLY 95 N 2.89 0.00 -0.80 2.72 0.00 -1.39 -1.18 103.07 105.32 1rbl h GLY 95 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1rbl h GLY 95 CO 0.60 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.23 1rbl n ASP 96 N -2.42 1.37 -4.51 0.19 5.75 -1.26 -3.51 116.55 112.16 1rbl n ASP 96 Ca 0.02 -1.87 -0.25 0.00 -0.01 0.00 0.00 54.79 52.69 1rbl n ASP 96 Cb 0.27 -0.14 -0.10 0.00 -1.03 0.00 0.00 41.12 40.12 1rbl n ASP 96 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1rbl s TYR 98 N -2.19 3.39 -0.05 0.00 1.51 0.65 -3.55 117.35 117.11 1rbl s TYR 98 Ca 0.28 1.65 0.02 0.00 -1.01 0.00 0.00 57.07 58.01 1rbl s TYR 98 Cb -0.06 -3.29 0.01 0.00 -0.11 0.00 0.00 41.96 38.51 1rbl s TYR 98 CO 0.15 -0.78 -0.11 0.42 -1.11 0.00 0.00 175.55 174.12 1rbl s ILE 99 N -1.32 1.03 -0.01 2.71 1.01 -0.03 -1.47 121.20 123.11 1rbl s ILE 99 Ca 0.50 -0.44 0.04 0.00 0.00 0.00 0.00 60.65 60.75 1rbl s ILE 99 Cb -0.30 -0.93 -0.01 0.00 0.01 0.00 0.00 42.46 41.23 1rbl s ILE 99 CO 0.38 0.32 -0.14 -0.60 0.00 0.00 0.00 174.94 174.91 1rbl s ARG 100 N 0.51 1.15 -0.19 2.79 3.52 -0.23 -0.45 118.95 126.05 1rbl s ARG 100 Ca -0.10 -0.48 -0.10 0.00 -0.13 0.00 0.00 55.73 54.91 1rbl s ARG 100 Cb -0.14 -1.10 -0.05 0.00 -1.56 0.00 0.00 34.95 32.11 1rbl s ARG 100 CO 0.02 0.28 0.14 0.08 -0.81 0.00 0.00 175.30 175.01 1rbl s VAL 101 N -0.26 5.41 0.08 7.11 1.01 -0.16 -1.94 120.40 131.66 1rbl s VAL 101 Ca 0.04 0.21 0.07 0.00 0.00 0.00 0.00 61.98 62.30 1rbl s VAL 101 Cb -0.06 -3.47 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 1rbl s VAL 101 CO -0.00 0.45 -0.19 0.00 0.00 0.00 0.00 175.10 175.36 1rbl s ALA 102 N 0.25 1.63 -0.04 5.51 0.00 0.47 -1.61 121.76 127.97 1rbl s ALA 102 Ca 0.09 -1.14 0.03 0.00 0.00 0.00 0.00 51.96 50.94 1rbl s ALA 102 Cb -0.11 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.75 1rbl s ALA 102 CO -0.01 0.32 -0.11 0.20 0.00 0.00 0.00 175.76 176.15 1rbl s GLY 103 N -1.72 1.61 -0.14 0.00 0.00 -0.65 -0.16 107.32 106.25 1rbl s GLY 103 Ca 0.05 -0.97 0.02 0.00 0.00 0.00 0.00 44.72 43.82 1rbl s GLY 103 CO 0.03 -0.78 -0.21 -0.12 0.00 0.00 0.00 173.10 172.02 1rbl s PHE 104 N -0.80 2.68 -0.37 1.90 5.36 0.33 -0.23 117.98 126.85 1rbl s PHE 104 Ca 0.13 -1.33 -0.20 0.00 -0.96 0.00 0.00 56.93 54.56 1rbl s PHE 104 Cb -0.11 -1.82 0.01 0.00 -0.34 0.00 0.00 43.02 40.75 1rbl s PHE 104 CO 0.02 -0.61 0.64 0.34 -1.46 0.00 0.00 175.22 174.15 1rbl s ASP 105 N 0.83 6.41 0.07 6.13 -1.08 -0.03 -1.17 116.67 127.83 1rbl s ASP 105 Ca -0.07 0.07 0.26 0.00 -0.52 0.00 0.00 52.55 52.29 1rbl s ASP 105 Cb -0.15 -2.33 0.71 0.00 -1.46 0.00 0.00 42.92 39.69 1rbl s ASP 105 CO -0.02 -0.63 1.60 -0.46 0.52 0.00 0.00 175.17 176.18 1rbl n ASN 106 N 6.09 0.49 -0.02 -0.34 0.23 -1.26 -0.39 115.26 120.05 1rbl n ASN 106 Ca -0.01 0.21 -0.19 0.00 -0.53 0.00 0.00 54.58 54.06 1rbl n ASN 106 Cb 0.48 -0.18 -0.13 0.00 -2.08 0.00 0.00 39.78 37.87 1rbl n ASN 106 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 1rbl h ILE 107 N 0.00 1.30 -0.00 1.53 2.04 -1.95 -3.23 117.51 117.20 1rbl h ILE 107 Ca 0.00 -2.38 0.00 0.00 1.00 0.00 0.00 64.86 63.48 1rbl h ILE 107 Cb 0.62 2.90 0.00 0.00 -0.74 0.00 0.00 36.82 39.60 1rbl h ILE 107 CO 0.00 0.62 -0.13 0.29 0.00 0.00 0.00 178.15 178.93 1rbl n LYS 108 N -4.22 0.07 -3.89 2.37 4.76 -1.25 -4.96 118.16 111.04 1rbl n LYS 108 Ca -0.20 -0.02 -0.34 0.00 -2.87 0.00 0.00 58.31 54.88 1rbl n LYS 108 Cb 0.75 -1.50 0.01 0.00 -1.84 0.00 0.00 35.03 32.45 1rbl n LYS 108 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1rbl n GLU 109 N -1.45 -1.45 -3.92 1.97 2.13 0.47 -5.01 120.64 113.38 1rbl n GLU 109 Ca 0.08 0.32 -0.10 0.00 0.66 0.00 0.00 57.16 58.12 1rbl n GLU 109 Cb 0.33 -3.77 -0.09 0.00 0.27 0.00 0.00 31.44 28.17 1rbl n GLU 109 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1rbl s GLN 111 N -2.56 4.41 -0.15 0.00 0.74 -1.26 -0.86 119.66 119.99 1rbl s GLN 111 Ca -0.05 1.57 0.10 0.00 0.05 0.00 0.00 55.36 57.03 1rbl s GLN 111 Cb -0.01 -3.51 -0.16 0.00 1.10 0.00 0.00 33.01 30.42 1rbl s GLN 111 CO -0.04 -0.33 -0.01 0.25 -0.55 0.00 0.00 175.29 174.61 1rbl n THR 112 N 4.39 1.02 -4.27 -0.34 -2.24 0.68 -4.93 114.28 108.59 1rbl n THR 112 Ca 0.09 -0.56 -0.21 0.00 -2.27 0.00 0.00 64.05 61.11 1rbl n THR 112 Cb 0.48 -0.76 -0.12 0.00 -2.10 0.00 0.00 70.33 67.83 1rbl n THR 112 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1rbl s SER 113 N -5.06 2.31 -0.30 3.42 0.01 -1.18 -4.93 113.70 107.97 1rbl s SER 113 Ca -0.12 -0.78 -0.15 0.00 1.31 0.00 0.00 55.95 56.21 1rbl s SER 113 Cb 0.05 -0.11 0.18 0.00 0.21 0.00 0.00 66.02 66.34 1rbl s SER 113 CO 0.55 -0.06 1.07 -0.55 0.41 0.00 0.00 173.24 174.66 1rbl s SER 114 N -2.33 -0.43 -0.10 2.44 0.15 -1.25 -1.64 113.70 110.54 1rbl s SER 114 Ca 0.09 0.44 -0.19 0.00 0.70 0.00 0.00 55.95 57.00 1rbl s SER 114 Cb -0.07 1.43 0.04 0.00 -1.71 0.00 0.00 66.02 65.72 1rbl s SER 114 CO 0.04 -0.08 0.46 0.72 1.20 0.00 0.00 173.24 175.58 1rbl s PHE 115 N 2.59 -0.44 -0.00 3.44 -0.71 -0.63 -4.34 117.98 117.88 1rbl s PHE 115 Ca -0.01 0.94 -0.30 0.00 -1.04 0.00 0.00 56.93 56.51 1rbl s PHE 115 Cb -0.07 0.19 -0.05 0.00 -1.21 0.00 0.00 43.02 41.89 1rbl s PHE 115 CO -0.14 -0.36 1.30 0.42 -1.34 0.00 0.00 175.22 175.09 1rbl s ILE 116 N -0.50 3.93 -0.51 -4.49 -1.09 -1.26 -0.99 121.20 116.29 1rbl s ILE 116 Ca -0.06 1.32 0.14 0.00 -2.23 0.00 0.00 60.65 59.81 1rbl s ILE 116 Cb -0.03 -3.85 -0.16 0.00 -1.58 0.00 0.00 42.46 36.84 1rbl s ILE 116 CO 0.03 0.02 0.52 1.33 -1.23 0.00 0.00 174.94 175.62 1rbl n VAL 117 N 4.48 0.00 -3.72 2.92 0.24 0.40 -4.92 118.33 117.72 1rbl n VAL 117 Ca 0.12 -0.21 -0.12 0.00 -2.04 0.00 0.00 64.34 62.09 1rbl n VAL 117 Cb 0.45 0.82 -0.11 0.00 -1.47 0.00 0.00 33.84 33.53 1rbl n VAL 117 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1rbl s HIS 118 N -2.44 -0.47 0.06 6.34 5.65 -0.94 -4.96 115.29 118.53 1rbl s HIS 118 Ca 0.03 1.06 0.06 0.00 0.25 0.00 0.00 55.06 56.46 1rbl s HIS 118 Cb 0.10 0.17 -0.04 0.00 -1.18 0.00 0.00 32.58 31.63 1rbl s HIS 118 CO 0.57 -0.27 -0.11 1.03 -0.65 0.00 0.00 174.74 175.31 1rbl s ARG 119 N 0.98 2.23 0.85 2.88 3.00 -1.26 -0.85 118.95 126.79 1rbl s ARG 119 Ca -0.06 -0.93 -0.11 0.00 0.00 0.00 0.00 55.73 54.62 1rbl s ARG 119 Cb -0.07 -2.33 0.10 0.00 0.00 0.00 0.00 34.95 32.65 1rbl s ARG 119 CO -0.08 0.54 1.10 -1.25 0.00 0.00 0.00 175.30 175.61 1rbl s PRO 120 N -1.82 1.59 -0.58 3.54 0.04 -1.23 -4.86 135.00 131.67 1rbl s PRO 120 Ca 0.19 1.10 -0.29 0.00 0.04 0.00 0.00 61.00 62.04 1rbl s PRO 120 Cb -0.11 -1.83 -0.11 0.00 0.04 0.00 0.00 34.50 32.49 1rbl s PRO 120 CO 0.10 -2.09 2.44 0.41 0.04 0.00 0.00 177.00 177.91 1rbl n GLY 121 N -0.87 0.11 2.07 0.56 0.00 -1.23 -5.01 105.19 100.81 1rbl n GLY 121 Ca 0.09 0.83 0.00 0.00 0.00 0.00 0.00 46.02 46.94 1rbl n GLY 121 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36