#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 6rhn s PRO 13 N 0.00 2.30 0.00 5.56 0.04 -1.26 -3.46 135.00 138.19 6rhn s PRO 13 Ca 0.00 1.37 0.00 0.00 0.04 0.00 0.00 61.00 62.41 6rhn s PRO 13 Cb 0.00 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.65 6rhn s PRO 13 CO 0.00 -1.63 0.00 0.41 0.04 0.00 0.00 177.00 175.82 6rhn n GLY 14 N -0.60 1.53 0.00 0.56 0.00 -1.24 -4.79 105.19 100.66 6rhn n GLY 14 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 6rhn n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 6rhn n GLY 15 N -2.00 -0.95 2.65 -0.02 0.00 -1.22 -3.54 105.19 100.11 6rhn n GLY 15 Ca 0.00 -1.65 -0.28 0.00 0.00 0.00 0.00 46.02 44.08 6rhn n GLY 15 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 6rhn n ASP 16 N -0.87 4.91 -3.22 1.61 8.00 -1.26 -4.38 116.55 121.33 6rhn n ASP 16 Ca 0.00 -3.72 -0.16 0.00 0.71 0.00 0.00 54.79 51.63 6rhn n ASP 16 Cb 0.00 -0.55 -0.03 0.00 -0.02 0.00 0.00 41.12 40.52 6rhn n ASP 16 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 6rhn n THR 17 N -0.40 0.00 -0.03 -3.53 -2.24 -1.26 -4.97 114.28 101.84 6rhn n THR 17 Ca 0.38 -1.21 -0.01 0.00 -2.27 0.00 0.00 64.05 60.95 6rhn n THR 17 Cb 0.54 0.28 0.28 0.00 -2.10 0.00 0.00 70.33 69.33 6rhn n THR 17 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 6rhn h ILE 18 N 1.17 1.20 -0.19 2.28 2.04 -1.97 -2.12 117.51 119.93 6rhn h ILE 18 Ca -0.20 -0.76 -0.06 0.00 1.00 0.00 0.00 64.86 64.85 6rhn h ILE 18 Cb 0.64 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 6rhn h ILE 18 CO 0.33 0.27 -0.13 -0.26 0.00 0.00 0.00 178.15 178.36 6rhn h PHE 19 N 0.57 0.32 -0.86 1.37 0.04 -1.95 -2.77 116.94 113.67 6rhn h PHE 19 Ca 0.13 -0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.85 6rhn h PHE 19 Cb 0.30 -0.09 -0.04 0.00 2.20 0.00 0.00 35.95 38.32 6rhn h PHE 19 CO 0.01 0.44 0.51 0.78 -0.60 0.00 0.00 178.31 179.45 6rhn h GLY 20 N 0.81 1.25 1.60 -1.45 0.00 -1.43 -0.46 103.07 103.40 6rhn h GLY 20 Ca 0.06 -0.53 -0.06 0.00 0.00 0.00 0.00 47.33 46.80 6rhn h GLY 20 CO 0.02 0.51 -0.09 0.50 0.00 0.00 0.00 176.54 177.48 6rhn h LYS 21 N 1.18 0.49 -0.29 4.80 1.57 -1.46 -0.94 116.57 121.92 6rhn h LYS 21 Ca 0.31 -0.13 -0.16 0.00 -1.87 0.00 0.00 60.65 58.79 6rhn h LYS 21 Cb -0.04 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.22 6rhn h LYS 21 CO -0.06 0.59 -0.46 0.82 -0.57 0.00 0.00 179.45 179.78 6rhn h ILE 22 N 0.46 1.29 -0.19 1.86 2.04 -1.25 0.55 117.51 122.26 6rhn h ILE 22 Ca 0.09 -1.65 -0.01 0.00 1.00 0.00 0.00 64.86 64.30 6rhn h ILE 22 Cb 0.45 1.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 6rhn h ILE 22 CO 0.02 0.53 0.10 0.40 0.00 0.00 0.00 178.15 179.21 6rhn h ILE 23 N 0.58 1.12 -0.00 -0.67 2.04 -0.66 -1.93 117.51 117.99 6rhn h ILE 23 Ca 0.02 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.55 6rhn h ILE 23 Cb 1.06 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 38.13 6rhn h ILE 23 CO 0.10 0.11 0.00 0.54 0.00 0.00 0.00 178.15 178.91 6rhn n ARG 24 N -4.89 1.02 -1.77 2.37 1.74 -0.40 -4.88 116.66 109.85 6rhn n ARG 24 Ca -0.04 -0.02 -0.18 0.00 -0.77 0.00 0.00 57.85 56.84 6rhn n ARG 24 Cb 0.08 -1.34 -0.06 0.00 -1.02 0.00 0.00 32.46 30.13 6rhn n ARG 24 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 6rhn n LYS 25 N -0.81 -1.31 0.23 5.56 4.01 -0.73 -4.84 118.16 120.27 6rhn n LYS 25 Ca 0.16 1.06 0.09 0.00 -0.51 0.00 0.00 58.31 59.11 6rhn n LYS 25 Cb 0.08 -5.39 0.53 0.00 -0.51 0.00 0.00 35.03 29.73 6rhn n LYS 25 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 6rhn h GLU 26 N 0.00 0.00 -4.09 1.97 5.08 -0.18 -3.41 114.58 113.95 6rhn h GLU 26 Ca -0.39 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 57.64 6rhn h GLU 26 Cb 1.22 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 30.17 6rhn h GLU 26 CO 0.53 0.24 -0.75 0.96 -1.00 0.00 0.00 179.01 178.99 6rhn s ILE 27 N -3.97 0.34 0.74 3.13 -4.36 -1.05 -5.01 121.20 111.02 6rhn s ILE 27 Ca -0.02 -0.12 -0.11 0.00 -0.26 0.00 0.00 60.65 60.14 6rhn s ILE 27 Cb 0.12 -0.33 0.04 0.00 1.25 0.00 0.00 42.46 43.54 6rhn s ILE 27 CO 0.64 0.13 1.09 -2.16 0.24 0.00 0.00 174.94 174.88 6rhn s PRO 28 N 0.27 2.55 0.17 0.37 0.04 -1.26 -4.25 135.00 132.88 6rhn s PRO 28 Ca -0.03 0.57 -0.19 0.00 0.04 0.00 0.00 61.00 61.40 6rhn s PRO 28 Cb -0.06 -1.98 0.04 0.00 0.04 0.00 0.00 34.50 32.54 6rhn s PRO 28 CO -0.00 -1.28 0.52 0.00 0.04 0.00 0.00 177.00 176.28 6rhn s ALA 29 N -3.25 -1.14 -1.28 8.56 0.00 -1.26 -5.02 121.76 118.37 6rhn s ALA 29 Ca 0.59 0.02 -0.19 0.00 0.00 0.00 0.00 51.96 52.39 6rhn s ALA 29 Cb -0.13 0.82 0.04 0.00 0.00 0.00 0.00 23.12 23.85 6rhn s ALA 29 CO 0.53 -0.76 1.80 1.63 0.00 0.00 0.00 175.76 178.96 6rhn n LYS 30 N -0.33 2.87 -2.27 0.00 5.02 -1.26 -4.93 118.16 117.26 6rhn n LYS 30 Ca -0.13 -3.08 -0.42 0.00 -2.02 0.00 0.00 58.31 52.66 6rhn n LYS 30 Cb 0.63 -3.52 -0.03 0.00 -0.02 0.00 0.00 35.03 32.09 6rhn n LYS 30 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 6rhn s ILE 31 N 5.45 3.63 -0.22 -0.18 1.01 -1.26 -2.13 121.20 127.49 6rhn s ILE 31 Ca 0.56 1.15 0.11 0.00 0.00 0.00 0.00 60.65 62.47 6rhn s ILE 31 Cb 0.04 -3.73 -0.21 0.00 0.01 0.00 0.00 42.46 38.56 6rhn s ILE 31 CO 0.08 0.07 -0.05 -0.38 0.00 0.00 0.00 174.94 174.66 6rhn n ILE 32 N 4.07 1.44 -3.52 2.92 5.41 0.96 -4.96 119.36 125.68 6rhn n ILE 32 Ca 0.11 -0.73 -0.15 0.00 1.00 0.00 0.00 62.75 62.98 6rhn n ILE 32 Cb 0.44 -0.90 -0.05 0.00 -0.71 0.00 0.00 39.64 38.42 6rhn n ILE 32 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 176.55 176.67 6rhn s PHE 33 N -2.51 -0.56 -0.24 1.39 2.19 -1.15 -4.98 117.98 112.13 6rhn s PHE 33 Ca -0.21 0.83 -0.22 0.00 0.33 0.00 0.00 56.93 57.66 6rhn s PHE 33 Cb 0.07 0.45 0.06 0.00 -1.31 0.00 0.00 43.02 42.30 6rhn s PHE 33 CO 0.73 -0.58 0.64 -2.00 1.83 0.00 0.00 175.22 175.84 6rhn s GLU 34 N -1.72 0.74 0.00 10.12 2.12 -1.26 -0.53 118.70 128.18 6rhn s GLU 34 Ca -0.06 0.91 0.00 0.00 0.36 0.00 0.00 54.97 56.18 6rhn s GLU 34 Cb -0.00 0.35 0.00 0.00 0.26 0.00 0.00 34.13 34.73 6rhn s GLU 34 CO 0.03 -0.09 0.00 -0.40 -0.54 0.00 0.00 175.26 174.26 6rhn n ASP 35 N 2.85 0.00 0.27 -1.70 5.68 -0.50 -5.01 116.55 118.14 6rhn n ASP 35 Ca -0.14 -0.79 0.16 0.00 -0.50 0.00 0.00 54.79 53.52 6rhn n ASP 35 Cb 0.56 0.00 0.71 0.00 -1.14 0.00 0.00 41.12 41.25 6rhn n ASP 35 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 6rhn h ASP 36 N 0.00 0.00 0.00 -1.12 2.03 -2.04 -3.30 116.42 111.99 6rhn h ASP 36 Ca 0.00 0.00 -0.15 0.00 -0.73 0.00 0.00 57.03 56.15 6rhn h ASP 36 Cb 0.00 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.47 6rhn h ASP 36 CO 0.00 0.05 -2.02 0.00 -1.03 0.00 0.00 179.24 176.24 6rhn n GLN 37 N -3.18 0.82 -3.50 4.15 6.02 -1.26 -4.86 117.38 115.57 6rhn n GLN 37 Ca -0.00 -0.10 -0.09 0.00 -0.01 0.00 0.00 57.00 56.80 6rhn n GLN 37 Cb 0.30 -1.45 0.01 0.00 1.02 0.00 0.00 30.24 30.12 6rhn n GLN 37 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 6rhn s LEU 39 N 0.00 0.54 -0.05 0.00 2.96 -0.72 -1.41 118.68 120.00 6rhn s LEU 39 Ca 0.17 0.75 0.06 0.00 -0.22 0.00 0.00 54.13 54.89 6rhn s LEU 39 Cb -0.04 1.27 -0.01 0.00 0.50 0.00 0.00 46.19 47.92 6rhn s LEU 39 CO 0.12 -0.13 -0.23 0.00 -1.32 0.00 0.00 176.35 174.79 6rhn s ALA 40 N 0.28 1.99 0.04 5.97 0.00 0.31 -1.41 121.76 128.95 6rhn s ALA 40 Ca -0.01 -0.97 -0.17 0.00 0.00 0.00 0.00 51.96 50.82 6rhn s ALA 40 Cb -0.03 -0.61 0.03 0.00 0.00 0.00 0.00 23.12 22.51 6rhn s ALA 40 CO -0.00 0.40 0.39 -0.59 0.00 0.00 0.00 175.76 175.95 6rhn s PHE 41 N -0.18 -0.23 0.49 0.00 -0.71 -0.53 -0.03 117.98 116.80 6rhn s PHE 41 Ca -0.02 0.17 -0.22 0.00 -1.04 0.00 0.00 56.93 55.82 6rhn s PHE 41 Cb -0.13 0.19 -0.07 0.00 -1.21 0.00 0.00 43.02 41.81 6rhn s PHE 41 CO 0.03 -0.55 1.19 -1.01 -1.34 0.00 0.00 175.22 173.54 6rhn s HIS 42 N -2.47 2.74 0.22 3.49 3.76 -0.90 -0.28 115.29 121.84 6rhn s HIS 42 Ca -0.05 1.51 -0.30 0.00 -0.15 0.00 0.00 55.06 56.07 6rhn s HIS 42 Cb -0.01 -3.44 -0.08 0.00 1.11 0.00 0.00 32.58 30.15 6rhn s HIS 42 CO -0.02 -1.77 1.14 0.34 -0.85 0.00 0.00 174.74 173.57 6rhn s ASP 43 N -1.35 7.20 0.55 1.40 -1.08 0.07 -4.76 116.67 118.70 6rhn s ASP 43 Ca 0.67 2.21 0.35 0.00 -0.52 0.00 0.00 52.55 55.25 6rhn s ASP 43 Cb -0.30 -2.61 1.55 0.00 -1.46 0.00 0.00 42.92 40.09 6rhn s ASP 43 CO 0.36 -0.25 2.04 -0.29 0.52 0.00 0.00 175.17 177.55 6rhn h ILE 44 N 3.52 0.00 -2.07 4.11 6.09 -1.94 -3.29 117.51 123.93 6rhn h ILE 44 Ca -0.45 -0.39 -0.56 0.00 -1.37 0.00 0.00 64.86 62.08 6rhn h ILE 44 Cb 1.21 1.37 -0.40 0.00 0.47 0.00 0.00 36.82 39.47 6rhn h ILE 44 CO 0.71 0.00 -0.94 -1.20 -3.07 0.00 0.00 178.15 173.65 6rhn n SER 45 N -3.03 1.55 -4.69 2.19 7.64 -1.26 -5.12 113.62 110.90 6rhn n SER 45 Ca -0.00 -3.01 -0.42 0.00 1.01 0.00 0.00 58.87 56.45 6rhn n SER 45 Cb 0.25 -0.64 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 6rhn n SER 45 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 6rhn n PRO 46 N 1.02 2.00 -0.08 1.43 -0.04 -1.24 -4.92 135.00 133.17 6rhn n PRO 46 Ca 0.25 0.71 0.06 0.00 -0.04 0.00 0.00 63.50 64.47 6rhn n PRO 46 Cb 0.50 -2.32 0.10 0.00 -0.04 0.00 0.00 33.50 31.74 6rhn n PRO 46 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 6rhn n GLN 47 N 0.35 1.59 -3.56 0.54 1.13 -1.26 -4.98 117.38 111.18 6rhn n GLN 47 Ca 0.06 -1.59 -0.11 0.00 -1.94 0.00 0.00 57.00 53.42 6rhn n GLN 47 Cb 0.37 -1.26 -0.03 0.00 0.11 0.00 0.00 30.24 29.43 6rhn n GLN 47 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 6rhn s ALA 48 N -1.01 -1.21 0.31 -1.58 0.00 -1.26 -5.04 121.76 111.97 6rhn s ALA 48 Ca 0.19 0.14 0.06 0.00 0.00 0.00 0.00 51.96 52.36 6rhn s ALA 48 Cb 0.11 0.80 0.86 0.00 0.00 0.00 0.00 23.12 24.89 6rhn s ALA 48 CO 0.16 -0.72 1.62 -1.35 0.00 0.00 0.00 175.76 175.47 6rhn h PRO 49 N 2.19 0.14 -5.21 0.00 0.11 -1.83 -3.33 132.00 124.07 6rhn h PRO 49 Ca -0.33 -0.01 -0.67 0.00 0.11 0.00 0.00 66.00 65.10 6rhn h PRO 49 Cb 1.28 -0.03 -0.33 0.00 0.11 0.00 0.00 31.00 32.03 6rhn h PRO 49 CO 0.42 0.09 -0.86 0.99 -0.21 0.00 0.00 178.00 178.44 6rhn s THR 50 N -5.86 2.20 -0.27 -1.15 2.01 -0.59 -5.02 115.64 106.97 6rhn s THR 50 Ca -0.12 -0.94 0.00 0.00 0.31 0.00 0.00 61.69 60.95 6rhn s THR 50 Cb 0.28 -1.89 0.16 0.00 0.01 0.00 0.00 72.50 71.06 6rhn s THR 50 CO 0.78 0.54 0.44 -2.28 -0.69 0.00 0.00 174.62 173.41 6rhn s HIS 51 N 0.76 -1.09 0.26 4.92 5.04 -1.25 -0.81 115.29 123.12 6rhn s HIS 51 Ca -0.08 0.74 0.05 0.00 -1.54 0.00 0.00 55.06 54.23 6rhn s HIS 51 Cb -0.16 0.03 -0.06 0.00 0.04 0.00 0.00 32.58 32.44 6rhn s HIS 51 CO -0.00 -0.89 -0.03 -0.59 -2.34 0.00 0.00 174.74 170.89 6rhn s PHE 52 N 2.61 1.77 0.11 3.88 -0.71 -0.78 -0.75 117.98 124.11 6rhn s PHE 52 Ca 0.12 -0.81 0.09 0.00 -1.04 0.00 0.00 56.93 55.29 6rhn s PHE 52 Cb -0.14 -1.03 -0.04 0.00 -1.21 0.00 0.00 43.02 40.61 6rhn s PHE 52 CO -0.24 0.12 -0.20 -0.51 -1.34 0.00 0.00 175.22 173.06 6rhn s LEU 53 N -3.38 2.61 -0.16 -1.99 1.43 0.62 -1.10 118.68 116.71 6rhn s LEU 53 Ca 0.29 -0.58 0.00 0.00 -1.03 0.00 0.00 54.13 52.82 6rhn s LEU 53 Cb 0.05 -1.48 0.02 0.00 0.03 0.00 0.00 46.19 44.82 6rhn s LEU 53 CO 0.11 0.19 -0.14 -0.69 0.23 0.00 0.00 176.35 176.05 6rhn s VAL 54 N -1.09 1.60 0.08 -1.59 1.01 -0.58 -1.46 120.40 118.37 6rhn s VAL 54 Ca 0.17 -0.69 0.07 0.00 0.00 0.00 0.00 61.98 61.53 6rhn s VAL 54 Cb -0.10 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.73 6rhn s VAL 54 CO 0.09 0.43 -0.20 0.27 0.00 0.00 0.00 175.10 175.68 6rhn s ILE 55 N 1.47 1.61 0.46 2.22 -4.36 -0.50 -1.53 121.20 120.58 6rhn s ILE 55 Ca 0.04 -1.38 -0.20 0.00 -0.26 0.00 0.00 60.65 58.85 6rhn s ILE 55 Cb -0.13 -1.45 -0.10 0.00 1.25 0.00 0.00 42.46 42.03 6rhn s ILE 55 CO -0.11 0.02 0.98 -2.16 0.24 0.00 0.00 174.94 173.91 6rhn s PRO 56 N -1.61 4.06 0.22 0.37 0.04 -1.26 -1.75 135.00 135.07 6rhn s PRO 56 Ca 0.06 1.15 0.11 0.00 0.04 0.00 0.00 61.00 62.35 6rhn s PRO 56 Cb -0.09 -2.15 0.12 0.00 0.04 0.00 0.00 34.50 32.41 6rhn s PRO 56 CO 0.03 -0.18 1.46 0.87 0.04 0.00 0.00 177.00 179.22 6rhn h LYS 57 N 1.61 0.00 -6.67 4.56 1.57 -1.57 -3.44 116.57 112.63 6rhn h LYS 57 Ca -0.49 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 57.77 6rhn h LYS 57 Cb 1.19 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.52 6rhn h LYS 57 CO 0.61 0.73 0.56 0.21 -0.57 0.00 0.00 179.45 180.98 6rhn s LYS 58 N -3.14 4.50 -0.56 3.15 2.20 -1.26 -3.64 119.74 120.99 6rhn s LYS 58 Ca 0.01 1.88 -0.28 0.00 -0.36 0.00 0.00 55.97 57.21 6rhn s LYS 58 Cb 0.11 -3.23 0.03 0.00 -1.51 0.00 0.00 37.83 33.22 6rhn s LYS 58 CO 0.77 -0.08 1.25 -1.58 -0.36 0.00 0.00 175.35 175.36 6rhn s HIS 59 N -0.13 2.53 -0.21 4.03 5.65 -1.26 -4.94 115.29 120.97 6rhn s HIS 59 Ca 0.52 0.46 0.01 0.00 0.25 0.00 0.00 55.06 56.30 6rhn s HIS 59 Cb -0.33 -4.48 0.03 0.00 -1.18 0.00 0.00 32.58 26.63 6rhn s HIS 59 CO 0.37 -1.68 -0.17 0.42 -0.65 0.00 0.00 174.74 173.03 6rhn s ILE 60 N 5.21 2.15 0.34 0.89 1.01 -1.26 -5.02 121.20 124.52 6rhn s ILE 60 Ca 0.46 -1.13 0.07 0.00 0.00 0.00 0.00 60.65 60.06 6rhn s ILE 60 Cb -0.08 -2.02 0.10 0.00 0.01 0.00 0.00 42.46 40.47 6rhn s ILE 60 CO 0.26 0.37 1.80 0.77 0.00 0.00 0.00 174.94 178.14 6rhn h SER 61 N 7.90 0.27 -4.79 3.58 4.64 -1.93 0.17 113.55 123.39 6rhn h SER 61 Ca -0.38 -0.08 0.08 0.00 -0.47 0.00 0.00 61.79 60.94 6rhn h SER 61 Cb 1.11 -0.07 -0.14 0.00 -0.31 0.00 0.00 62.40 62.99 6rhn h SER 61 CO 0.59 0.53 0.41 0.00 -0.87 0.00 0.00 176.83 177.49 6rhn s GLN 62 N -4.46 0.99 0.32 4.77 -2.07 -1.26 -2.33 119.66 115.62 6rhn s GLN 62 Ca -0.05 -0.38 0.00 0.00 -1.82 0.00 0.00 55.36 53.11 6rhn s GLN 62 Cb 0.14 0.44 0.54 0.00 -1.09 0.00 0.00 33.01 33.04 6rhn s GLN 62 CO 0.76 -0.43 1.96 0.97 -1.32 0.00 0.00 175.29 177.23 6rhn h ILE 63 N 2.00 1.19 0.00 3.63 6.09 -1.90 -1.43 117.51 127.10 6rhn h ILE 63 Ca -0.25 -0.42 0.00 0.00 -1.37 0.00 0.00 64.86 62.81 6rhn h ILE 63 Cb 1.26 0.25 0.00 0.00 0.47 0.00 0.00 36.82 38.80 6rhn h ILE 63 CO 0.32 0.20 0.00 -1.54 -3.07 0.00 0.00 178.15 174.06 6rhn n SER 64 N -4.40 0.19 -0.77 2.19 3.41 -1.26 -1.57 113.62 111.42 6rhn n SER 64 Ca 0.07 0.57 0.09 0.00 -0.26 0.00 0.00 58.87 59.33 6rhn n SER 64 Cb 0.07 -0.60 0.11 0.00 -0.26 0.00 0.00 64.21 63.53 6rhn n SER 64 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 6rhn n ALA 65 N -1.59 2.43 -1.77 7.33 0.00 -0.54 -4.99 120.51 121.38 6rhn n ALA 65 Ca 0.01 -0.76 -0.38 0.00 0.00 0.00 0.00 53.44 52.32 6rhn n ALA 65 Cb 0.11 -0.62 -0.03 0.00 0.00 0.00 0.00 19.45 18.91 6rhn n ALA 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 6rhn s ALA 66 N -1.38 3.14 0.46 0.00 0.00 -0.61 -4.94 121.76 118.43 6rhn s ALA 66 Ca 0.24 0.85 0.02 0.00 0.00 0.00 0.00 51.96 53.07 6rhn s ALA 66 Cb 0.16 -3.33 0.01 0.00 0.00 0.00 0.00 23.12 19.96 6rhn s ALA 66 CO 0.23 -0.36 0.66 -1.21 0.00 0.00 0.00 175.76 175.08 6rhn s GLU 67 N -2.30 2.88 0.43 0.00 2.02 -1.26 -4.98 118.70 115.50 6rhn s GLU 67 Ca 0.56 -0.74 0.09 0.00 0.02 0.00 0.00 54.97 54.91 6rhn s GLU 67 Cb -0.27 -2.60 0.95 0.00 0.10 0.00 0.00 34.13 32.31 6rhn s GLU 67 CO 0.34 -0.36 2.06 -0.44 0.02 0.00 0.00 175.26 176.88 6rhn h ASP 68 N 0.40 0.33 0.50 -0.19 3.32 -2.01 0.33 116.42 119.09 6rhn h ASP 68 Ca -0.44 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.59 6rhn h ASP 68 Cb 1.27 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.74 6rhn h ASP 68 CO 0.54 0.27 0.00 0.00 -1.72 0.00 0.00 179.24 178.32 6rhn h ALA 69 N 1.79 1.00 -0.00 3.45 0.00 -2.03 -2.50 119.26 120.96 6rhn h ALA 69 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 6rhn h ALA 69 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 6rhn h ALA 69 CO -0.02 0.00 -0.00 -0.25 0.00 0.00 0.00 179.25 178.98 6rhn n ASP 70 N -2.88 0.23 -0.03 0.00 8.00 0.11 -4.42 116.55 117.55 6rhn n ASP 70 Ca -0.01 -0.99 -0.12 0.00 0.71 0.00 0.00 54.79 54.38 6rhn n ASP 70 Cb 0.18 -0.02 -0.06 0.00 -0.02 0.00 0.00 41.12 41.20 6rhn n ASP 70 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 6rhn h GLU 71 N 0.35 -0.44 -0.59 -1.24 5.08 -1.57 -0.87 114.58 115.30 6rhn h GLU 71 Ca 0.00 0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.44 6rhn h GLU 71 Cb 0.10 0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.40 6rhn h GLU 71 CO 0.00 -0.29 0.31 0.77 -1.00 0.00 0.00 179.01 178.79 6rhn h SER 72 N -0.46 0.44 -0.68 1.42 0.02 -1.86 0.84 113.55 113.27 6rhn h SER 72 Ca 0.09 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 6rhn h SER 72 Cb 0.62 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 63.08 6rhn h SER 72 CO -0.44 0.29 0.33 0.25 -1.14 0.00 0.00 176.83 176.12 6rhn h LEU 73 N 0.58 0.89 -0.67 5.07 5.85 -1.78 0.31 115.31 125.56 6rhn h LEU 73 Ca 0.26 -0.13 -0.11 0.00 0.84 0.00 0.00 57.88 58.74 6rhn h LEU 73 Cb 0.18 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 6rhn h LEU 73 CO -0.18 0.76 -0.18 -0.07 -0.34 0.00 0.00 178.44 178.44 6rhn h LEU 74 N 0.94 0.86 -1.08 2.25 3.38 -0.77 -2.13 115.31 118.76 6rhn h LEU 74 Ca 0.23 -0.30 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 6rhn h LEU 74 Cb 0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 6rhn h LEU 74 CO -0.03 1.02 -0.46 1.23 0.09 0.00 0.00 178.44 180.29 6rhn h GLY 75 N 0.95 0.00 1.46 0.83 0.00 -0.45 -2.94 103.07 102.92 6rhn h GLY 75 Ca 0.11 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.38 6rhn h GLY 75 CO 0.05 0.00 0.03 0.84 0.00 0.00 0.00 176.54 177.46 6rhn h HIS 76 N 0.00 0.69 -0.79 5.60 6.17 0.28 -2.65 115.15 124.45 6rhn h HIS 76 Ca -0.00 -0.08 -0.05 0.00 0.71 0.00 0.00 60.37 60.95 6rhn h HIS 76 Cb 0.82 -0.20 -0.03 0.00 2.52 0.00 0.00 27.41 30.52 6rhn h HIS 76 CO 0.00 0.64 0.31 -0.07 0.71 0.00 0.00 177.93 179.52 6rhn h LEU 77 N 0.63 1.09 -0.55 0.26 3.38 -1.29 -0.59 115.31 118.24 6rhn h LEU 77 Ca 0.13 -0.17 -0.15 0.00 0.09 0.00 0.00 57.88 57.78 6rhn h LEU 77 Cb 0.35 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 6rhn h LEU 77 CO 0.01 0.97 -0.52 0.24 0.09 0.00 0.00 178.44 179.24 6rhn h MET 78 N 1.15 0.56 -0.36 1.13 2.86 -1.57 -0.15 114.93 118.55 6rhn h MET 78 Ca 0.26 -0.34 -0.09 0.00 -2.06 0.00 0.00 59.70 57.48 6rhn h MET 78 Cb 0.23 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 6rhn h MET 78 CO -0.02 0.94 -0.13 0.82 1.06 0.00 0.00 176.91 179.58 6rhn h ILE 79 N 0.44 1.28 -0.37 -1.22 1.08 -1.17 0.18 117.51 117.73 6rhn h ILE 79 Ca 0.02 -1.23 -0.14 0.00 -0.39 0.00 0.00 64.86 63.12 6rhn h ILE 79 Cb 1.05 1.32 -0.01 0.00 -3.07 0.00 0.00 36.82 36.11 6rhn h ILE 79 CO 0.10 0.40 -0.33 0.58 -0.69 0.00 0.00 178.15 178.21 6rhn h VAL 80 N 0.52 1.28 -0.45 1.67 2.07 -1.11 -1.92 116.25 118.31 6rhn h VAL 80 Ca 0.09 -1.49 -0.01 0.00 0.82 0.00 0.00 66.70 66.11 6rhn h VAL 80 Cb 0.66 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 6rhn h VAL 80 CO 0.04 0.49 0.24 1.23 0.02 0.00 0.00 177.57 179.59 6rhn h GLY 81 N 0.90 0.68 2.00 2.17 0.00 -0.81 0.40 103.07 108.41 6rhn h GLY 81 Ca 0.07 -0.32 -0.09 0.00 0.00 0.00 0.00 47.33 46.99 6rhn h GLY 81 CO 0.08 0.30 -0.43 0.07 0.00 0.00 0.00 176.54 176.56 6rhn h LYS 82 N 0.58 0.00 -0.10 4.80 5.09 -0.83 -1.39 116.57 124.72 6rhn h LYS 82 Ca 0.16 -0.00 -0.08 0.00 0.09 0.00 0.00 60.65 60.82 6rhn h LYS 82 Cb 0.07 -0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.41 6rhn h LYS 82 CO -0.02 0.43 -0.24 0.87 -2.09 0.00 0.00 179.45 178.40 6rhn h LYS 83 N 0.00 0.34 -0.63 0.07 1.57 -0.84 -2.51 116.57 114.57 6rhn h LYS 83 Ca -0.00 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.50 6rhn h LYS 83 Cb 0.76 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.08 6rhn h LYS 83 CO 0.06 0.84 0.20 0.00 -0.57 0.00 0.00 179.45 179.98 6rhn h ALA 85 N 1.30 1.42 -0.19 0.00 0.00 -1.24 -0.71 119.26 119.84 6rhn h ALA 85 Ca 0.21 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 6rhn h ALA 85 Cb 0.26 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 6rhn h ALA 85 CO -0.01 0.53 -0.01 0.00 0.00 0.00 0.00 179.25 179.75 6rhn h ALA 86 N 1.49 0.25 -0.84 0.00 0.00 -0.90 -1.25 119.26 118.01 6rhn h ALA 86 Ca 0.28 -0.22 0.06 0.00 0.00 0.00 0.00 54.91 55.03 6rhn h ALA 86 Cb -0.09 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 6rhn h ALA 86 CO -0.06 -0.02 0.55 -0.44 0.00 0.00 0.00 179.25 179.29 6rhn h ASP 87 N 0.08 0.84 0.00 0.00 3.32 -0.78 0.69 116.42 120.56 6rhn h ASP 87 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 6rhn h ASP 87 Cb 0.42 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.79 6rhn h ASP 87 CO 0.01 0.55 0.00 0.18 -1.72 0.00 0.00 179.24 178.26 6rhn n LEU 88 N -4.48 0.00 -1.03 1.55 4.77 -0.32 -4.90 117.00 112.59 6rhn n LEU 88 Ca 0.12 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.02 6rhn n LEU 88 Cb 0.19 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.28 6rhn n LEU 88 CO 0.33 0.00 -0.10 0.61 -1.33 0.00 0.00 177.39 176.90 6rhn n GLY 89 N 0.77 0.03 3.18 -0.72 0.00 0.24 -4.92 105.19 103.77 6rhn n GLY 89 Ca 0.21 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 6rhn n GLY 89 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 6rhn n LEU 90 N -1.30 5.81 -0.04 0.99 4.77 -0.51 -4.70 117.00 122.03 6rhn n LEU 90 Ca -0.10 -4.01 -0.08 0.00 -0.03 0.00 0.00 56.01 51.80 6rhn n LEU 90 Cb 0.58 -1.70 0.09 0.00 -2.33 0.00 0.00 43.42 40.06 6rhn n LEU 90 CO 0.13 0.58 0.63 0.11 -1.33 0.00 0.00 177.39 177.50 6rhn h LYS 91 N 6.86 0.66 -0.07 3.23 1.57 -1.91 -3.20 116.57 123.72 6rhn h LYS 91 Ca 0.50 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 6rhn h LYS 91 Cb 0.76 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.06 6rhn h LYS 91 CO 1.66 0.91 0.00 1.63 -0.57 0.00 0.00 179.45 183.08 6rhn n LYS 92 N -4.06 1.29 0.00 3.15 5.02 -1.26 -5.03 118.16 117.27 6rhn n LYS 92 Ca -0.01 -0.44 0.00 0.00 -2.02 0.00 0.00 58.31 55.84 6rhn n LYS 92 Cb 0.49 -1.33 0.00 0.00 -0.02 0.00 0.00 35.03 34.17 6rhn n LYS 92 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 6rhn n GLY 93 N 0.92 -0.21 3.78 0.72 0.00 -1.21 -5.08 105.19 104.11 6rhn n GLY 93 Ca 0.15 -2.27 -0.00 0.00 0.00 0.00 0.00 46.02 43.89 6rhn n GLY 93 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 6rhn s TYR 94 N -0.54 -0.02 -0.05 1.61 1.13 -1.26 -4.45 117.35 113.77 6rhn s TYR 94 Ca 0.00 -0.19 0.04 0.00 -1.41 0.00 0.00 57.07 55.51 6rhn s TYR 94 Cb 0.00 0.60 -0.00 0.00 -1.10 0.00 0.00 41.96 41.46 6rhn s TYR 94 CO 0.00 -0.51 -0.16 0.50 -2.51 0.00 0.00 175.55 172.87 6rhn s ARG 95 N -2.45 1.73 -0.12 -3.49 3.52 -0.17 -4.96 118.95 113.02 6rhn s ARG 95 Ca 0.19 -0.57 -0.04 0.00 -0.13 0.00 0.00 55.73 55.18 6rhn s ARG 95 Cb 0.01 -1.50 -0.03 0.00 -1.56 0.00 0.00 34.95 31.87 6rhn s ARG 95 CO -0.00 0.21 0.02 -1.64 -0.81 0.00 0.00 175.30 173.07 6rhn s MET 96 N 0.13 3.36 -0.02 5.12 -1.94 -1.26 -1.01 119.30 123.67 6rhn s MET 96 Ca -0.05 -0.39 0.00 0.00 -1.71 0.00 0.00 55.69 53.54 6rhn s MET 96 Cb -0.12 -2.93 0.02 0.00 2.01 0.00 0.00 34.83 33.81 6rhn s MET 96 CO 0.02 0.53 0.00 0.08 -0.01 0.00 0.00 175.02 175.65 6rhn s VAL 97 N -0.40 0.11 -0.15 -6.03 1.01 -0.12 -4.94 120.40 109.88 6rhn s VAL 97 Ca 0.08 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.14 6rhn s VAL 97 Cb -0.12 -0.18 0.02 0.00 0.00 0.00 0.00 36.38 36.10 6rhn s VAL 97 CO 0.02 0.10 -0.17 -0.69 0.00 0.00 0.00 175.10 174.36 6rhn s VAL 98 N 0.69 1.76 -0.14 2.92 1.01 -1.26 -0.08 120.40 125.29 6rhn s VAL 98 Ca -0.06 -0.77 -0.08 0.00 0.00 0.00 0.00 61.98 61.07 6rhn s VAL 98 Cb -0.09 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 6rhn s VAL 98 CO -0.01 0.49 0.12 0.20 0.00 0.00 0.00 175.10 175.90 6rhn s ASN 99 N 1.24 6.22 -0.11 3.32 0.01 -1.26 -5.08 114.94 119.28 6rhn s ASN 99 Ca 0.01 0.36 0.02 0.00 -0.71 0.00 0.00 52.86 52.54 6rhn s ASN 99 Cb -0.14 -2.03 0.02 0.00 0.41 0.00 0.00 41.25 39.51 6rhn s ASN 99 CO -0.08 0.33 -0.15 -0.70 -1.51 0.00 0.00 177.10 174.99 6rhn s GLU 100 N -0.55 2.19 1.76 -0.60 2.56 -1.26 -4.57 118.70 118.22 6rhn s GLU 100 Ca 0.12 -0.55 0.00 0.00 0.00 0.00 0.00 54.97 54.55 6rhn s GLU 100 Cb -0.12 -1.88 0.00 0.00 2.00 0.00 0.00 34.13 34.14 6rhn s GLU 100 CO 0.02 -0.08 0.00 0.41 -0.56 0.00 0.00 175.26 175.05 6rhn n GLY 101 N 4.24 -1.20 0.22 -1.50 0.00 -1.26 -2.15 105.19 103.54 6rhn n GLY 101 Ca -0.19 -1.11 -0.10 0.00 0.00 0.00 0.00 46.02 44.62 6rhn n GLY 101 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 6rhn h SER 102 N 0.00 0.71 0.05 1.61 4.64 -1.96 0.07 113.55 118.67 6rhn h SER 102 Ca 0.00 -0.31 -0.10 0.00 -0.47 0.00 0.00 61.79 60.91 6rhn h SER 102 Cb 0.00 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 6rhn h SER 102 CO 0.00 0.85 -0.32 0.44 -0.87 0.00 0.00 176.83 176.92 6rhn h ASP 103 N 0.55 0.40 1.01 4.97 3.32 -1.96 -2.54 116.42 122.16 6rhn h ASP 103 Ca 0.11 -0.15 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 6rhn h ASP 103 Cb 0.49 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 6rhn h ASP 103 CO 0.02 0.71 -0.24 1.23 -1.72 0.00 0.00 179.24 179.24 6rhn h GLY 104 N 1.08 0.00 0.00 2.75 0.00 -1.14 -3.47 103.07 102.29 6rhn h GLY 104 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 6rhn h GLY 104 CO 0.06 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.21 6rhn n GLY 105 N 0.28 0.91 3.67 4.60 0.00 -0.32 -4.47 105.19 109.87 6rhn n GLY 105 Ca 0.00 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 6rhn n GLY 105 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 6rhn s GLN 106 N -0.34 4.32 -0.14 1.61 0.74 -0.14 -4.90 119.66 120.80 6rhn s GLN 106 Ca 0.00 1.42 0.07 0.00 0.05 0.00 0.00 55.36 56.90 6rhn s GLN 106 Cb 0.00 -3.61 -0.14 0.00 1.10 0.00 0.00 33.01 30.36 6rhn s GLN 106 CO 0.00 -0.51 -0.04 0.43 -0.55 0.00 0.00 175.29 174.62 6rhn n SER 107 N 5.80 2.20 -4.49 6.67 7.64 -1.26 -4.59 113.62 125.59 6rhn n SER 107 Ca 0.11 -0.04 -0.38 0.00 1.01 0.00 0.00 58.87 59.57 6rhn n SER 107 Cb 0.47 0.35 -0.12 0.00 -1.01 0.00 0.00 64.21 63.90 6rhn n SER 107 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 6rhn s VAL 108 N -2.32 4.81 -1.43 0.44 1.01 -1.26 -5.03 120.40 116.62 6rhn s VAL 108 Ca -0.13 -0.19 -0.11 0.00 0.00 0.00 0.00 61.98 61.54 6rhn s VAL 108 Cb 0.05 -3.37 0.05 0.00 0.00 0.00 0.00 36.38 33.11 6rhn s VAL 108 CO 0.47 0.16 2.30 -1.22 0.00 0.00 0.00 175.10 176.81 6rhn n TYR 109 N 5.01 3.07 -3.63 5.22 4.02 -1.26 -4.67 117.16 124.92 6rhn n TYR 109 Ca -0.14 -2.94 -0.05 0.00 -0.01 0.00 0.00 57.90 54.76 6rhn n TYR 109 Cb 0.50 -2.32 -0.07 0.00 -0.02 0.00 0.00 39.34 37.44 6rhn n TYR 109 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 6rhn s HIS 110 N 1.85 -1.08 0.16 -0.72 2.46 -0.98 -4.29 115.29 112.68 6rhn s HIS 110 Ca 0.50 1.89 -0.33 0.00 0.47 0.00 0.00 55.06 57.58 6rhn s HIS 110 Cb 0.14 0.54 -0.15 0.00 -0.13 0.00 0.00 32.58 32.98 6rhn s HIS 110 CO -0.06 -0.59 1.26 0.28 -2.47 0.00 0.00 174.74 173.16 6rhn n VAL 111 N 5.42 0.65 -3.78 0.89 0.31 0.61 -4.90 118.33 117.52 6rhn n VAL 111 Ca -0.10 -0.16 -0.13 0.00 -0.01 0.00 0.00 64.34 63.94 6rhn n VAL 111 Cb 0.49 -0.97 -0.11 0.00 -0.91 0.00 0.00 33.84 32.34 6rhn n VAL 111 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 6rhn s HIS 112 N 0.04 -0.28 -0.18 3.52 -3.43 -1.26 -4.15 115.29 109.54 6rhn s HIS 112 Ca 0.75 0.69 -0.05 0.00 -0.80 0.00 0.00 55.06 55.65 6rhn s HIS 112 Cb -0.84 0.10 -0.03 0.00 -1.43 0.00 0.00 32.58 30.38 6rhn s HIS 112 CO 0.50 -0.15 0.01 -1.17 -2.00 0.00 0.00 174.74 171.93 6rhn s LEU 113 N 0.09 3.43 0.02 5.38 2.96 -0.58 -4.46 118.68 125.53 6rhn s LEU 113 Ca -0.00 -0.09 -0.15 0.00 -0.22 0.00 0.00 54.13 53.67 6rhn s LEU 113 Cb -0.02 -1.86 -0.06 0.00 0.50 0.00 0.00 46.19 44.75 6rhn s LEU 113 CO 0.00 0.13 0.44 -1.00 -1.32 0.00 0.00 176.35 174.60 6rhn s HIS 114 N 0.60 3.72 -0.19 5.38 3.76 0.88 -1.52 115.29 127.92 6rhn s HIS 114 Ca -0.00 1.02 -0.00 0.00 -0.15 0.00 0.00 55.06 55.93 6rhn s HIS 114 Cb -0.14 -2.31 0.05 0.00 1.11 0.00 0.00 32.58 31.29 6rhn s HIS 114 CO 0.02 0.62 -0.06 0.08 -0.85 0.00 0.00 174.74 174.55 6rhn s VAL 115 N -1.13 1.31 -0.01 -0.90 1.01 -0.26 -0.95 120.40 119.47 6rhn s VAL 115 Ca 0.26 -0.87 0.07 0.00 0.00 0.00 0.00 61.98 61.43 6rhn s VAL 115 Cb -0.17 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 6rhn s VAL 115 CO 0.15 0.05 -0.22 -0.76 0.00 0.00 0.00 175.10 174.32 6rhn s LEU 116 N 1.53 2.34 0.00 3.92 1.02 -0.18 -1.86 118.68 125.45 6rhn s LEU 116 Ca -0.02 -0.41 -0.12 0.00 0.02 0.00 0.00 54.13 53.61 6rhn s LEU 116 Cb -0.17 -1.42 0.04 0.00 0.02 0.00 0.00 46.19 44.67 6rhn s LEU 116 CO -0.07 0.31 0.59 0.61 0.02 0.00 0.00 176.35 177.81 6rhn n GLY 117 N 2.18 1.00 1.13 -3.19 0.00 0.01 -1.00 105.19 105.32 6rhn n GLY 117 Ca -0.16 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.77 6rhn n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 6rhn n GLY 118 N -0.41 0.70 3.47 -0.02 0.00 -1.26 -1.54 105.19 106.13 6rhn n GLY 118 Ca -0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 6rhn n GLY 118 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 6rhn s ARG 119 N -0.61 1.33 -0.09 1.61 1.70 -1.26 -4.69 118.95 116.94 6rhn s ARG 119 Ca 0.00 -0.63 -0.30 0.00 -0.47 0.00 0.00 55.73 54.34 6rhn s ARG 119 Cb 0.00 0.57 -0.04 0.00 -0.57 0.00 0.00 34.95 34.90 6rhn s ARG 119 CO 0.00 -0.58 1.50 -1.14 -1.08 0.00 0.00 175.30 174.01 6rhn s GLN 120 N -3.80 4.21 0.23 3.89 2.00 -1.26 -4.98 119.66 119.95 6rhn s GLN 120 Ca 0.04 1.99 -0.25 0.00 -2.00 0.00 0.00 55.36 55.14 6rhn s GLN 120 Cb -0.01 -3.88 -0.09 0.00 0.80 0.00 0.00 33.01 29.83 6rhn s GLN 120 CO -0.09 -0.78 0.83 -1.64 -0.50 0.00 0.00 175.29 173.11 6rhn s MET 121 N 3.74 4.56 0.63 1.67 -1.94 -1.26 -5.06 119.30 121.64 6rhn s MET 121 Ca 0.66 1.20 0.07 0.00 -1.71 0.00 0.00 55.69 55.91 6rhn s MET 121 Cb -0.29 -3.08 0.11 0.00 2.01 0.00 0.00 34.83 33.57 6rhn s MET 121 CO 0.24 0.46 0.87 1.21 -0.01 0.00 0.00 175.02 177.79 6rhn s ASN 122 N -1.36 4.82 -0.00 3.03 3.04 -1.26 -5.13 114.94 118.08 6rhn s ASN 122 Ca 0.41 -0.77 0.02 0.00 0.04 0.00 0.00 52.86 52.56 6rhn s ASN 122 Cb -0.21 0.32 -0.01 0.00 -1.54 0.00 0.00 41.25 39.82 6rhn s ASN 122 CO 0.26 -1.55 -0.05 0.86 -3.04 0.00 0.00 177.10 173.57 6rhn s TRP 123 N -2.83 0.46 0.82 0.43 -0.11 -1.26 -4.26 118.94 112.19 6rhn s TRP 123 Ca 0.64 -0.12 -0.11 0.00 1.22 0.00 0.00 56.10 57.73 6rhn s TRP 123 Cb -0.05 -0.29 0.09 0.00 -1.50 0.00 0.00 33.47 31.71 6rhn s TRP 123 CO 0.41 -0.01 1.09 -1.25 -4.62 0.00 0.00 176.95 172.57 6rhn s PRO 124 N -0.23 1.85 -1.61 5.86 0.04 -1.26 -5.02 135.00 134.63 6rhn s PRO 124 Ca 0.01 1.04 -0.10 0.00 0.04 0.00 0.00 61.00 61.98 6rhn s PRO 124 Cb -0.03 -1.86 -0.07 0.00 0.04 0.00 0.00 34.50 32.58 6rhn s PRO 124 CO -0.00 -1.89 2.90 -0.35 0.04 0.00 0.00 177.00 177.69 6rhn n PRO 125 N -3.67 3.65 -0.41 0.56 -0.04 -1.26 -5.22 135.00 128.61 6rhn n PRO 125 Ca 0.08 -2.26 0.00 0.00 -0.04 0.00 0.00 63.50 61.28 6rhn n PRO 125 Cb 0.54 -2.84 0.00 0.00 -0.04 0.00 0.00 33.50 31.16 6rhn n PRO 125 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87