#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rm6 n THR 10 N 0.00 0.00 -2.24 2.61 -2.24 -1.26 -4.90 114.28 106.25 1rm6 n THR 10 Ca 0.00 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 1rm6 n THR 10 Cb 0.00 -0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 67.55 1rm6 n THR 10 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1rm6 s VAL 11 N -1.99 3.29 0.00 2.28 1.01 -1.26 -2.42 120.40 121.31 1rm6 s VAL 11 Ca 0.00 1.04 0.00 0.00 0.00 0.00 0.00 61.98 63.02 1rm6 s VAL 11 Cb 0.00 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.71 1rm6 s VAL 11 CO 0.00 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.86 1rm6 n GLY 12 N 2.47 0.94 3.79 4.51 0.00 0.46 -5.04 105.19 112.31 1rm6 n GLY 12 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 1rm6 n GLY 12 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rm6 s VAL 13 N -3.23 5.02 -0.07 1.61 1.01 -1.01 -4.65 120.40 119.08 1rm6 s VAL 13 Ca 0.00 0.96 -0.30 0.00 0.00 0.00 0.00 61.98 62.64 1rm6 s VAL 13 Cb 0.00 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 1rm6 s VAL 13 CO 0.00 0.49 1.64 -0.13 0.00 0.00 0.00 175.10 177.10 1rm6 s ARG 14 N -0.48 4.14 -0.10 2.72 0.52 -1.26 -4.31 118.95 120.18 1rm6 s ARG 14 Ca 0.26 2.13 -0.01 0.00 -0.52 0.00 0.00 55.73 57.59 1rm6 s ARG 14 Cb -0.17 -3.99 0.03 0.00 0.52 0.00 0.00 34.95 31.34 1rm6 s ARG 14 CO 0.13 -0.89 -0.04 0.99 0.02 0.00 0.00 175.30 175.51 1rm6 s THR 15 N 4.15 0.76 0.62 0.02 2.01 -1.26 -4.96 115.64 116.99 1rm6 s THR 15 Ca 0.73 -0.14 -0.19 0.00 0.31 0.00 0.00 61.69 62.40 1rm6 s THR 15 Cb -0.32 -0.85 -0.02 0.00 0.01 0.00 0.00 72.50 71.32 1rm6 s THR 15 CO 0.29 0.31 1.28 -2.84 -0.69 0.00 0.00 174.62 172.98 1rm6 s PRO 16 N 1.81 2.75 0.45 4.92 0.02 -1.26 -4.72 135.00 138.97 1rm6 s PRO 16 Ca 0.05 2.04 -0.24 0.00 0.02 0.00 0.00 61.00 62.86 1rm6 s PRO 16 Cb -0.13 -1.93 -0.08 0.00 0.02 0.00 0.00 34.50 32.38 1rm6 s PRO 16 CO -0.07 -1.44 1.26 -0.51 -0.33 0.00 0.00 177.00 175.92 1rm6 s LEU 17 N -4.15 4.09 0.47 -5.54 1.43 -1.26 -4.88 118.68 108.84 1rm6 s LEU 17 Ca 0.80 2.55 0.32 0.00 -1.03 0.00 0.00 54.13 56.77 1rm6 s LEU 17 Cb -0.36 -4.07 1.60 0.00 0.03 0.00 0.00 46.19 43.38 1rm6 s LEU 17 CO 0.39 -0.99 1.97 -0.37 0.23 0.00 0.00 176.35 177.59 1rm6 h VAL 18 N 2.11 0.00 -0.50 -1.59 -1.51 -1.92 -1.38 116.25 111.45 1rm6 h VAL 18 Ca -0.50 -0.15 0.00 0.00 -1.23 0.00 0.00 66.70 64.82 1rm6 h VAL 18 Cb 1.26 0.95 0.00 0.00 -2.13 0.00 0.00 31.29 31.37 1rm6 h VAL 18 CO 0.61 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 176.05 1rm6 n ASP 19 N -2.70 3.48 0.21 4.19 5.68 -1.26 -4.68 116.55 121.47 1rm6 n ASP 19 Ca -0.01 -2.08 0.05 0.00 -0.50 0.00 0.00 54.79 52.25 1rm6 n ASP 19 Cb 0.14 -0.36 0.46 0.00 -1.14 0.00 0.00 41.12 40.21 1rm6 n ASP 19 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1rm6 h GLY 20 N 2.96 0.00 0.99 6.12 0.00 -1.61 -2.90 103.07 108.63 1rm6 h GLY 20 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.34 1rm6 h GLY 20 CO 0.03 0.00 0.46 -2.08 0.00 0.00 0.00 176.54 174.95 1rm6 h VAL 21 N 0.00 1.17 0.00 4.60 2.07 -1.83 -1.89 116.25 120.37 1rm6 h VAL 21 Ca -0.00 -0.32 -0.08 0.00 0.82 0.00 0.00 66.70 67.11 1rm6 h VAL 21 Cb 0.51 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 1rm6 h VAL 21 CO 0.04 0.17 -0.40 -0.33 0.02 0.00 0.00 177.57 177.06 1rm6 h GLU 22 N 0.94 0.00 -0.24 1.57 3.07 -1.88 -2.90 114.58 115.13 1rm6 h GLU 22 Ca 0.26 0.00 -0.15 0.00 -0.50 0.00 0.00 59.36 58.97 1rm6 h GLU 22 Cb -0.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 1rm6 h GLU 22 CO -0.06 0.40 -0.43 0.87 -1.40 0.00 0.00 179.01 178.39 1rm6 h LYS 23 N 0.00 0.71 0.00 2.33 1.57 -1.36 -1.14 116.57 118.68 1rm6 h LYS 23 Ca -0.00 -0.45 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1rm6 h LYS 23 Cb 0.72 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.08 1rm6 h LYS 23 CO 0.05 1.07 0.00 1.33 -0.57 0.00 0.00 179.45 181.33 1rm6 n VAL 24 N -4.18 0.26 0.85 0.50 0.24 -0.94 -3.20 118.33 111.86 1rm6 n VAL 24 Ca -0.05 -0.06 0.09 0.00 -2.04 0.00 0.00 64.34 62.27 1rm6 n VAL 24 Cb 0.55 -0.58 -0.08 0.00 -1.47 0.00 0.00 33.84 32.27 1rm6 n VAL 24 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1rm6 n THR 25 N -1.75 0.00 -1.00 3.34 -2.24 -1.11 -4.97 114.28 106.55 1rm6 n THR 25 Ca 0.06 -0.12 -0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1rm6 n THR 25 Cb 0.35 1.05 -0.00 0.00 -2.10 0.00 0.00 70.33 69.63 1rm6 n THR 25 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rm6 n GLY 26 N 1.40 0.48 0.13 3.38 0.00 -1.07 -4.91 105.19 104.61 1rm6 n GLY 26 Ca 0.04 -0.03 0.01 0.00 0.00 0.00 0.00 46.02 46.05 1rm6 n GLY 26 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rm6 h LYS 27 N 0.95 0.00 -6.54 1.61 1.57 -1.67 -3.45 116.57 109.04 1rm6 h LYS 27 Ca -0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 1rm6 h LYS 27 Cb 0.03 0.00 0.04 0.00 0.08 0.00 0.00 32.23 32.38 1rm6 h LYS 27 CO 0.00 0.58 1.01 0.00 -0.57 0.00 0.00 179.45 180.48 1rm6 s ALA 28 N -3.09 3.77 -0.33 3.86 0.00 -0.50 -4.96 121.76 120.52 1rm6 s ALA 28 Ca 0.02 1.38 -0.12 0.00 0.00 0.00 0.00 51.96 53.24 1rm6 s ALA 28 Cb 0.09 -3.70 -0.02 0.00 0.00 0.00 0.00 23.12 19.49 1rm6 s ALA 28 CO 0.75 -1.05 0.22 0.15 0.00 0.00 0.00 175.76 175.84 1rm6 s LYS 29 N 2.12 3.52 0.72 0.00 -0.14 -1.26 -5.00 119.74 119.70 1rm6 s LYS 29 Ca 0.76 -0.62 -0.05 0.00 -1.36 0.00 0.00 55.97 54.69 1rm6 s LYS 29 Cb -0.44 -3.76 0.10 0.00 -1.68 0.00 0.00 37.83 32.04 1rm6 s LYS 29 CO 0.33 -0.42 1.01 0.71 -0.76 0.00 0.00 175.35 176.23 1rm6 s TYR 30 N 1.71 2.25 0.22 3.18 1.51 -1.26 -2.41 117.35 122.55 1rm6 s TYR 30 Ca 0.06 0.10 -0.08 0.00 -1.01 0.00 0.00 57.07 56.14 1rm6 s TYR 30 Cb -0.17 -3.19 0.34 0.00 -0.11 0.00 0.00 41.96 38.82 1rm6 s TYR 30 CO 0.10 -1.61 1.71 1.15 -1.11 0.00 0.00 175.55 175.78 1rm6 h THR 31 N -0.62 0.63 0.00 -0.71 2.02 -1.93 0.08 112.91 112.38 1rm6 h THR 31 Ca -0.41 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 66.67 1rm6 h THR 31 Cb 1.28 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 68.01 1rm6 h THR 31 CO 0.49 0.05 0.00 0.00 0.37 0.00 0.00 175.52 176.43 1rm6 n ALA 32 N -2.59 2.14 0.75 6.16 0.00 -1.26 -2.63 120.51 123.08 1rm6 n ALA 32 Ca 0.10 -0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.56 1rm6 n ALA 32 Cb 0.35 -1.37 0.08 0.00 0.00 0.00 0.00 19.45 18.51 1rm6 n ALA 32 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1rm6 n ASP 33 N -1.33 0.64 -4.69 0.00 8.00 0.01 -4.92 116.55 114.25 1rm6 n ASP 33 Ca 0.10 -0.32 -0.42 0.00 0.71 0.00 0.00 54.79 54.86 1rm6 n ASP 33 Cb 0.20 0.63 -0.03 0.00 -0.02 0.00 0.00 41.12 41.90 1rm6 n ASP 33 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1rm6 s ILE 34 N -3.11 3.50 0.25 0.53 1.01 -1.08 -4.92 121.20 117.39 1rm6 s ILE 34 Ca 0.07 0.95 -0.30 0.00 0.00 0.00 0.00 60.65 61.37 1rm6 s ILE 34 Cb 0.15 -3.61 -0.09 0.00 0.01 0.00 0.00 42.46 38.92 1rm6 s ILE 34 CO 0.78 0.01 1.17 0.00 0.00 0.00 0.00 174.94 176.90 1rm6 s ALA 35 N 2.19 3.44 -0.44 9.38 0.00 -1.26 -4.98 121.76 130.09 1rm6 s ALA 35 Ca 0.66 0.98 0.06 0.00 0.00 0.00 0.00 51.96 53.66 1rm6 s ALA 35 Cb -0.34 -3.39 0.19 0.00 0.00 0.00 0.00 23.12 19.58 1rm6 s ALA 35 CO 0.28 -0.32 0.70 0.00 0.00 0.00 0.00 175.76 176.42 1rm6 s ALA 36 N -0.72 -2.45 0.25 0.00 0.00 -1.26 -5.06 121.76 112.53 1rm6 s ALA 36 Ca 0.48 0.05 -0.02 0.00 0.00 0.00 0.00 51.96 52.47 1rm6 s ALA 36 Cb -0.34 -2.75 0.49 0.00 0.00 0.00 0.00 23.12 20.52 1rm6 s ALA 36 CO 0.41 -2.25 1.75 -1.35 0.00 0.00 0.00 175.76 174.33 1rm6 h PRO 37 N 6.11 0.55 0.00 0.00 0.11 -2.03 -1.78 132.00 134.96 1rm6 h PRO 37 Ca 0.05 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1rm6 h PRO 37 Cb 1.16 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1rm6 h PRO 37 CO 0.05 0.36 0.00 -0.40 -0.21 0.00 0.00 178.00 177.81 1rm6 n ASP 38 N -4.91 0.00 -4.73 -2.05 3.85 -1.26 -4.92 116.55 102.53 1rm6 n ASP 38 Ca 0.16 -0.95 -0.42 0.00 -0.71 0.00 0.00 54.79 52.87 1rm6 n ASP 38 Cb 0.41 0.00 -0.03 0.00 -1.35 0.00 0.00 41.12 40.16 1rm6 n ASP 38 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1rm6 s ALA 39 N -2.00 3.61 0.54 2.12 0.00 -0.67 -4.59 121.76 120.77 1rm6 s ALA 39 Ca 0.38 1.23 -0.06 0.00 0.00 0.00 0.00 51.96 53.50 1rm6 s ALA 39 Cb 0.17 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 1rm6 s ALA 39 CO 0.29 -0.66 0.87 -0.51 0.00 0.00 0.00 175.76 175.75 1rm6 s LEU 40 N 0.24 3.42 -0.18 0.00 1.43 0.38 -4.83 118.68 119.14 1rm6 s LEU 40 Ca 0.61 0.94 -0.18 0.00 -1.03 0.00 0.00 54.13 54.48 1rm6 s LEU 40 Cb -0.40 -3.87 -0.04 0.00 0.03 0.00 0.00 46.19 41.92 1rm6 s LEU 40 CO 0.37 -0.79 0.49 -0.69 0.23 0.00 0.00 176.35 175.96 1rm6 s VAL 41 N -2.90 5.14 -0.02 -1.59 1.01 0.66 -0.70 120.40 122.00 1rm6 s VAL 41 Ca 0.51 0.91 -0.04 0.00 0.00 0.00 0.00 61.98 63.37 1rm6 s VAL 41 Cb -0.10 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 1rm6 s VAL 41 CO 0.47 0.22 0.19 -0.83 0.00 0.00 0.00 175.10 175.15 1rm6 s GLY 42 N 1.01 2.18 -0.04 4.51 0.00 -0.33 -0.94 107.32 113.72 1rm6 s GLY 42 Ca 0.24 -0.73 -0.08 0.00 0.00 0.00 0.00 44.72 44.15 1rm6 s GLY 42 CO 0.09 -0.59 0.18 0.50 0.00 0.00 0.00 173.10 173.29 1rm6 s ARG 43 N -1.84 0.37 -0.11 2.90 1.81 -0.36 -4.38 118.95 117.35 1rm6 s ARG 43 Ca 0.26 -0.03 -0.02 0.00 -1.72 0.00 0.00 55.73 54.21 1rm6 s ARG 43 Cb -0.13 0.16 -0.03 0.00 -0.45 0.00 0.00 34.95 34.51 1rm6 s ARG 43 CO 0.17 -0.08 -0.01 0.42 -0.68 0.00 0.00 175.30 175.12 1rm6 s ILE 44 N -0.62 4.15 -0.30 1.52 1.01 -1.26 -0.85 121.20 124.86 1rm6 s ILE 44 Ca -0.07 -0.29 -0.19 0.00 0.00 0.00 0.00 60.65 60.09 1rm6 s ILE 44 Cb -0.04 -2.77 -0.01 0.00 0.01 0.00 0.00 42.46 39.65 1rm6 s ILE 44 CO 0.01 0.56 0.59 -0.22 0.00 0.00 0.00 174.94 175.88 1rm6 s LEU 45 N -0.43 4.14 -0.04 2.97 2.96 0.13 -4.97 118.68 123.45 1rm6 s LEU 45 Ca 0.07 0.40 -0.01 0.00 -0.22 0.00 0.00 54.13 54.38 1rm6 s LEU 45 Cb -0.12 -2.75 -0.04 0.00 0.50 0.00 0.00 46.19 43.78 1rm6 s LEU 45 CO 0.02 -0.43 0.03 -0.13 -1.32 0.00 0.00 176.35 174.52 1rm6 s ARG 46 N 2.51 2.96 0.16 1.98 0.52 -1.26 -0.59 118.95 125.23 1rm6 s ARG 46 Ca 0.24 -0.48 -0.33 0.00 -0.52 0.00 0.00 55.73 54.64 1rm6 s ARG 46 Cb -0.15 -2.79 -0.13 0.00 0.52 0.00 0.00 34.95 32.40 1rm6 s ARG 46 CO 0.11 0.67 1.66 0.45 0.02 0.00 0.00 175.30 178.21 1rm6 n SER 47 N 1.66 3.50 -0.27 0.23 2.88 0.13 -4.75 113.62 117.00 1rm6 n SER 47 Ca -0.16 1.06 0.14 0.00 -1.33 0.00 0.00 58.87 58.59 1rm6 n SER 47 Cb 0.53 -1.49 0.61 0.00 -0.75 0.00 0.00 64.21 63.12 1rm6 n SER 47 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1rm6 n PRO 48 N 3.93 1.21 -4.56 -1.46 -0.04 -1.26 -0.85 135.00 131.97 1rm6 n PRO 48 Ca 0.17 -0.55 -0.33 0.00 -0.04 0.00 0.00 63.50 62.75 1rm6 n PRO 48 Cb 0.32 -1.49 -0.11 0.00 -0.04 0.00 0.00 33.50 32.18 1rm6 n PRO 48 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1rm6 s HIS 49 N -2.17 2.92 -0.20 0.54 3.76 -1.26 -4.94 115.29 113.94 1rm6 s HIS 49 Ca 0.36 -0.00 0.22 0.00 -0.15 0.00 0.00 55.06 55.49 1rm6 s HIS 49 Cb 0.21 -1.67 0.48 0.00 1.11 0.00 0.00 32.58 32.71 1rm6 s HIS 49 CO 0.40 0.35 1.64 0.00 -0.85 0.00 0.00 174.74 176.28 1rm6 h ALA 50 N 4.93 0.91 -2.12 -1.40 0.00 -1.88 -3.18 119.26 116.52 1rm6 h ALA 50 Ca -0.49 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.29 1rm6 h ALA 50 Cb 1.17 -0.03 -0.22 0.00 0.00 0.00 0.00 17.79 18.71 1rm6 h ALA 50 CO 0.53 0.23 -0.15 -1.58 0.00 0.00 0.00 179.25 178.28 1rm6 s HIS 51 N -3.27 -1.16 -0.09 0.00 5.65 -1.26 -1.95 115.29 113.22 1rm6 s HIS 51 Ca 0.04 2.10 -0.30 0.00 0.25 0.00 0.00 55.06 57.16 1rm6 s HIS 51 Cb 0.07 0.66 0.11 0.00 -1.18 0.00 0.00 32.58 32.24 1rm6 s HIS 51 CO 0.67 -0.59 0.93 0.00 -0.65 0.00 0.00 174.74 175.10 1rm6 s ALA 52 N 2.51 -1.88 0.11 1.58 0.00 -0.81 -0.86 121.76 122.42 1rm6 s ALA 52 Ca -0.06 1.33 -0.15 0.00 0.00 0.00 0.00 51.96 53.07 1rm6 s ALA 52 Cb -0.10 -0.17 -0.07 0.00 0.00 0.00 0.00 23.12 22.78 1rm6 s ALA 52 CO -0.18 -0.48 0.53 1.03 0.00 0.00 0.00 175.76 176.66 1rm6 s ARG 53 N -2.00 4.00 -0.29 0.00 0.52 0.14 -0.96 118.95 120.35 1rm6 s ARG 53 Ca 0.01 0.50 -0.15 0.00 -0.52 0.00 0.00 55.73 55.57 1rm6 s ARG 53 Cb -0.01 -3.03 -0.03 0.00 0.52 0.00 0.00 34.95 32.41 1rm6 s ARG 53 CO -0.02 0.54 0.38 0.42 0.02 0.00 0.00 175.30 176.64 1rm6 s ILE 54 N -1.35 5.16 -0.13 1.52 1.01 0.15 -1.06 121.20 126.49 1rm6 s ILE 54 Ca 0.34 0.42 0.18 0.00 0.00 0.00 0.00 60.65 61.60 1rm6 s ILE 54 Cb -0.16 -3.75 -0.24 0.00 0.01 0.00 0.00 42.46 38.32 1rm6 s ILE 54 CO 0.18 0.06 0.39 0.18 0.00 0.00 0.00 174.94 175.76 1rm6 n LEU 55 N 5.38 0.28 -3.55 2.97 4.77 0.60 -4.72 117.00 122.74 1rm6 n LEU 55 Ca -0.08 0.13 -0.09 0.00 -0.03 0.00 0.00 56.01 55.93 1rm6 n LEU 55 Cb 0.50 0.26 -0.04 0.00 -2.33 0.00 0.00 43.42 41.82 1rm6 n LEU 55 CO 0.39 0.30 0.76 0.00 -1.33 0.00 0.00 177.39 177.50 1rm6 s ALA 56 N -2.83 -1.90 -0.01 -1.18 0.00 -1.19 -4.98 121.76 109.68 1rm6 s ALA 56 Ca -0.07 1.34 -0.01 0.00 0.00 0.00 0.00 51.96 53.22 1rm6 s ALA 56 Cb 0.09 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 23.03 1rm6 s ALA 56 CO 0.84 -0.49 0.02 0.42 0.00 0.00 0.00 175.76 176.55 1rm6 s ILE 57 N -2.08 -0.00 -0.16 0.00 1.01 -1.26 -1.00 121.20 117.71 1rm6 s ILE 57 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 60.65 60.66 1rm6 s ILE 57 Cb -0.01 -0.04 0.05 0.00 0.01 0.00 0.00 42.46 42.47 1rm6 s ILE 57 CO -0.03 0.00 -0.01 -0.62 0.00 0.00 0.00 174.94 174.28 1rm6 s ASP 58 N 0.03 2.67 0.00 3.58 2.15 0.09 -4.99 116.67 120.20 1rm6 s ASP 58 Ca -0.00 -0.64 0.14 0.00 0.43 0.00 0.00 52.55 52.48 1rm6 s ASP 58 Cb -0.00 -0.71 0.29 0.00 -0.30 0.00 0.00 42.92 42.20 1rm6 s ASP 58 CO -0.00 -0.24 1.19 0.35 -0.17 0.00 0.00 175.17 176.30 1rm6 n THR 59 N 4.99 0.58 -0.21 1.71 -2.24 -1.26 -1.27 114.28 116.58 1rm6 n THR 59 Ca -0.10 -0.79 0.02 0.00 -2.27 0.00 0.00 64.05 60.91 1rm6 n THR 59 Cb 0.48 0.84 0.13 0.00 -2.10 0.00 0.00 70.33 69.67 1rm6 n THR 59 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1rm6 h SER 60 N 2.79 0.11 0.17 3.42 4.64 -1.94 -0.54 113.55 122.20 1rm6 h SER 60 Ca 0.00 0.11 -0.13 0.00 -0.47 0.00 0.00 61.79 61.30 1rm6 h SER 60 Cb 0.73 0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.93 1rm6 h SER 60 CO 0.00 0.05 -0.48 0.00 -0.87 0.00 0.00 176.83 175.54 1rm6 h ALA 61 N 1.49 0.92 -0.45 5.18 0.00 -1.84 -1.45 119.26 123.11 1rm6 h ALA 61 Ca 0.34 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 1rm6 h ALA 61 Cb 0.49 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1rm6 h ALA 61 CO -0.39 0.65 -0.21 0.00 0.00 0.00 0.00 179.25 179.31 1rm6 h ALA 62 N 1.21 0.63 -0.05 0.00 0.00 -1.55 -2.85 119.26 116.64 1rm6 h ALA 62 Ca 0.02 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 1rm6 h ALA 62 Cb 0.95 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1rm6 h ALA 62 CO 0.08 0.61 -0.28 0.93 0.00 0.00 0.00 179.25 180.59 1rm6 h GLU 63 N 0.77 0.09 0.00 0.00 5.08 -0.88 -2.59 114.58 117.05 1rm6 h GLU 63 Ca 0.10 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1rm6 h GLU 63 Cb 0.78 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1rm6 h GLU 63 CO 0.06 0.36 0.00 0.00 -1.00 0.00 0.00 179.01 178.44 1rm6 h ALA 64 N 1.64 1.00 -2.64 3.43 0.00 -1.08 -3.46 119.26 118.16 1rm6 h ALA 64 Ca 0.01 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.40 1rm6 h ALA 64 Cb 0.54 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.37 1rm6 h ALA 64 CO 0.04 0.00 0.84 -1.17 0.00 0.00 0.00 179.25 178.96 1rm6 s LEU 65 N -5.07 4.37 0.14 0.00 2.96 -0.98 -4.94 118.68 115.17 1rm6 s LEU 65 Ca 0.08 2.61 -0.31 0.00 -0.22 0.00 0.00 54.13 56.29 1rm6 s LEU 65 Cb 0.10 -3.60 -0.10 0.00 0.50 0.00 0.00 46.19 43.09 1rm6 s LEU 65 CO 0.59 -0.79 1.61 -0.70 -1.32 0.00 0.00 176.35 175.73 1rm6 s GLU 66 N 0.79 4.20 0.00 1.98 2.56 -1.26 -2.00 118.70 124.97 1rm6 s GLU 66 Ca 0.67 2.37 0.00 0.00 0.00 0.00 0.00 54.97 58.01 1rm6 s GLU 66 Cb -0.43 -3.29 0.00 0.00 2.00 0.00 0.00 34.13 32.41 1rm6 s GLU 66 CO 0.34 -0.65 0.00 0.41 -0.56 0.00 0.00 175.26 174.80 1rm6 n GLY 67 N 3.85 0.81 3.64 -1.50 0.00 -1.26 -5.00 105.19 105.72 1rm6 n GLY 67 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 1rm6 n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rm6 s VAL 68 N -2.16 5.09 -0.17 1.61 1.01 -0.85 -0.64 120.40 124.30 1rm6 s VAL 68 Ca 0.00 0.88 0.16 0.00 0.00 0.00 0.00 61.98 63.02 1rm6 s VAL 68 Cb 0.00 -3.82 -0.24 0.00 0.00 0.00 0.00 36.38 32.32 1rm6 s VAL 68 CO 0.00 0.13 0.18 -0.38 0.00 0.00 0.00 175.10 175.03 1rm6 n ILE 69 N 4.89 1.45 -3.69 2.22 2.08 -0.14 -4.90 119.36 121.27 1rm6 n ILE 69 Ca -0.05 -0.83 -0.14 0.00 0.56 0.00 0.00 62.75 62.29 1rm6 n ILE 69 Cb 0.50 -0.65 -0.09 0.00 -0.75 0.00 0.00 39.64 38.65 1rm6 n ILE 69 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1rm6 s ALA 70 N -2.51 -1.18 -0.02 -1.39 0.00 -1.09 -4.70 121.76 110.87 1rm6 s ALA 70 Ca -0.11 1.06 0.00 0.00 0.00 0.00 0.00 51.96 52.92 1rm6 s ALA 70 Cb 0.07 -0.41 0.02 0.00 0.00 0.00 0.00 23.12 22.80 1rm6 s ALA 70 CO 0.81 -0.26 0.01 0.08 0.00 0.00 0.00 175.76 176.40 1rm6 s VAL 71 N -0.45 0.06 0.12 0.00 1.01 -1.26 -1.21 120.40 118.68 1rm6 s VAL 71 Ca -0.06 0.13 0.06 0.00 0.00 0.00 0.00 61.98 62.11 1rm6 s VAL 71 Cb -0.03 -0.16 -0.04 0.00 0.00 0.00 0.00 36.38 36.15 1rm6 s VAL 71 CO 0.03 0.10 -0.15 0.00 0.00 0.00 0.00 175.10 175.08 1rm6 s THR 73 N -1.95 0.19 0.67 0.00 -4.23 -1.26 -1.45 115.64 107.60 1rm6 s THR 73 Ca 0.09 -2.00 0.41 0.00 -1.18 0.00 0.00 61.69 59.01 1rm6 s THR 73 Cb -0.06 -2.44 0.41 0.00 1.34 0.00 0.00 72.50 71.75 1rm6 s THR 73 CO 0.04 0.00 2.25 1.23 -0.54 0.00 0.00 174.62 177.60 1rm6 h GLY 74 N 2.03 0.00 2.00 3.99 0.00 -1.70 -1.02 103.07 108.37 1rm6 h GLY 74 Ca -0.29 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 1rm6 h GLY 74 CO 0.44 0.00 -0.03 0.00 0.00 0.00 0.00 176.54 176.94 1rm6 h ALA 75 N 1.82 1.36 -0.09 3.60 0.00 -1.89 -1.44 119.26 122.62 1rm6 h ALA 75 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1rm6 h ALA 75 Cb 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1rm6 h ALA 75 CO 0.00 0.04 0.00 0.39 0.00 0.00 0.00 179.25 179.68 1rm6 n GLU 76 N -3.65 2.08 -3.40 0.00 1.02 -0.38 -4.54 120.64 111.76 1rm6 n GLU 76 Ca -0.03 -1.58 -0.26 0.00 -0.02 0.00 0.00 57.16 55.27 1rm6 n GLU 76 Cb 0.13 -1.47 -0.08 0.00 -0.02 0.00 0.00 31.44 29.99 1rm6 n GLU 76 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1rm6 n THR 77 N 0.89 0.65 1.80 2.62 -2.24 -0.54 -4.95 114.28 112.51 1rm6 n THR 77 Ca 0.17 -4.48 0.16 0.00 -2.27 0.00 0.00 64.05 57.62 1rm6 n THR 77 Cb 0.49 -2.00 0.88 0.00 -2.10 0.00 0.00 70.33 67.61 1rm6 n THR 77 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1rm6 n PRO 78 N 1.48 0.80 -3.96 -0.78 -0.04 -1.26 -4.66 135.00 126.59 1rm6 n PRO 78 Ca 0.25 -0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.36 1rm6 n PRO 78 Cb 0.46 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.28 1rm6 n PRO 78 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1rm6 s VAL 79 N -2.20 3.56 0.69 0.52 1.01 -1.26 -5.11 120.40 117.62 1rm6 s VAL 79 Ca 0.41 -0.43 -0.10 0.00 0.00 0.00 0.00 61.98 61.86 1rm6 s VAL 79 Cb 0.21 -2.62 0.03 0.00 0.00 0.00 0.00 36.38 34.00 1rm6 s VAL 79 CO 0.40 0.42 1.05 -2.16 0.00 0.00 0.00 175.10 174.81 1rm6 s PRO 80 N 1.37 2.64 0.15 2.72 0.04 -1.26 -4.60 135.00 136.05 1rm6 s PRO 80 Ca 0.04 0.19 0.01 0.00 0.04 0.00 0.00 61.00 61.29 1rm6 s PRO 80 Cb -0.14 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.26 1rm6 s PRO 80 CO -0.01 -1.07 -0.01 -0.59 0.04 0.00 0.00 177.00 175.35 1rm6 s PHE 81 N -3.29 1.08 -0.18 0.56 -0.12 0.70 -4.88 117.98 111.86 1rm6 s PHE 81 Ca 0.58 -1.01 -0.30 0.00 -0.05 0.00 0.00 56.93 56.15 1rm6 s PHE 81 Cb -0.11 -0.62 0.13 0.00 -0.63 0.00 0.00 43.02 41.80 1rm6 s PHE 81 CO 0.49 -0.22 1.03 0.20 -0.05 0.00 0.00 175.22 176.66 1rm6 s GLY 82 N -3.12 -0.23 0.44 1.99 0.00 -1.26 -2.47 107.32 102.66 1rm6 s GLY 82 Ca 0.20 2.13 0.21 0.00 0.00 0.00 0.00 44.72 47.27 1rm6 s GLY 82 CO 0.01 1.09 1.88 -0.24 0.00 0.00 0.00 173.10 175.84 1rm6 h VAL 83 N 2.58 0.79 -3.24 1.40 3.04 -1.82 -3.41 116.25 115.59 1rm6 h VAL 83 Ca -0.18 -1.07 -0.60 0.00 -1.01 0.00 0.00 66.70 63.83 1rm6 h VAL 83 Cb 1.16 1.66 -0.12 0.00 -2.01 0.00 0.00 31.29 31.98 1rm6 h VAL 83 CO 0.29 0.26 -0.49 -0.76 -1.01 0.00 0.00 177.57 175.85 1rm6 s LEU 84 N -7.29 4.19 0.56 3.16 1.43 -1.26 -4.99 118.68 114.48 1rm6 s LEU 84 Ca -0.01 0.23 0.25 0.00 -1.03 0.00 0.00 54.13 53.57 1rm6 s LEU 84 Cb 0.12 -2.08 1.53 0.00 0.03 0.00 0.00 46.19 45.79 1rm6 s LEU 84 CO 0.65 0.19 2.11 -0.65 0.23 0.00 0.00 176.35 178.88 1rm6 h PRO 85 N 6.59 0.00 -0.00 1.29 0.11 -1.86 -1.45 132.00 136.67 1rm6 h PRO 85 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1rm6 h PRO 85 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1rm6 h PRO 85 CO 0.75 0.00 -0.12 0.44 -0.21 0.00 0.00 178.00 178.86 1rm6 n ILE 86 N -4.12 0.00 -3.15 4.15 -5.35 -1.26 -4.48 119.36 105.15 1rm6 n ILE 86 Ca 0.01 -0.05 -0.22 0.00 -0.27 0.00 0.00 62.75 62.22 1rm6 n ILE 86 Cb 0.29 -0.12 -0.06 0.00 -1.74 0.00 0.00 39.64 38.01 1rm6 n ILE 86 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1rm6 n ALA 87 N -1.04 2.08 -3.52 -1.28 0.00 -0.55 -5.05 120.51 111.16 1rm6 n ALA 87 Ca 0.13 -3.24 -0.42 0.00 0.00 0.00 0.00 53.44 49.92 1rm6 n ALA 87 Cb 0.28 -0.86 -0.07 0.00 0.00 0.00 0.00 19.45 18.80 1rm6 n ALA 87 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1rm6 s GLU 88 N -1.14 2.67 -0.05 0.00 2.02 -1.25 -4.39 118.70 116.56 1rm6 s GLU 88 Ca 0.35 -1.94 0.07 0.00 0.02 0.00 0.00 54.97 53.47 1rm6 s GLU 88 Cb 0.19 -4.00 0.10 0.00 0.10 0.00 0.00 34.13 30.52 1rm6 s GLU 88 CO -0.12 -1.22 0.99 0.27 0.02 0.00 0.00 175.26 175.21 1rm6 n ASN 89 N 4.65 1.04 -4.55 -0.19 0.23 -1.19 -4.53 115.26 110.72 1rm6 n ASN 89 Ca -0.04 -2.26 -0.34 0.00 -0.53 0.00 0.00 54.58 51.41 1rm6 n ASN 89 Cb 0.41 -0.24 -0.11 0.00 -2.08 0.00 0.00 39.78 37.76 1rm6 n ASN 89 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1rm6 s GLU 90 N -1.13 3.52 0.01 -3.83 2.12 -1.03 -4.92 118.70 113.44 1rm6 s GLU 90 Ca 0.11 -0.48 -0.03 0.00 0.36 0.00 0.00 54.97 54.93 1rm6 s GLU 90 Cb 0.10 -2.90 -0.04 0.00 0.26 0.00 0.00 34.13 31.54 1rm6 s GLU 90 CO 0.01 0.36 0.21 0.71 -0.54 0.00 0.00 175.26 176.01 1rm6 s TYR 91 N 0.06 3.55 0.20 5.30 2.02 -1.26 -0.21 117.35 127.00 1rm6 s TYR 91 Ca 0.01 0.39 -0.10 0.00 -0.37 0.00 0.00 57.07 56.99 1rm6 s TYR 91 Cb -0.13 -1.85 0.26 0.00 -0.40 0.00 0.00 41.96 39.84 1rm6 s TYR 91 CO 0.02 0.62 1.73 -1.35 -1.57 0.00 0.00 175.55 175.01 1rm6 h PRO 92 N 3.69 0.34 -5.98 -1.71 0.11 -1.83 -3.39 132.00 123.23 1rm6 h PRO 92 Ca -0.48 -0.02 -0.60 0.00 0.11 0.00 0.00 66.00 65.01 1rm6 h PRO 92 Cb 1.18 -0.08 -0.29 0.00 0.11 0.00 0.00 31.00 31.92 1rm6 h PRO 92 CO 0.70 0.23 -0.85 -0.51 -0.21 0.00 0.00 178.00 177.35 1rm6 s LEU 93 N -10.43 2.05 0.44 2.35 1.43 -1.26 -4.75 118.68 108.51 1rm6 s LEU 93 Ca -0.13 -0.38 -0.25 0.00 -1.03 0.00 0.00 54.13 52.34 1rm6 s LEU 93 Cb 0.17 -1.04 -0.09 0.00 0.03 0.00 0.00 46.19 45.26 1rm6 s LEU 93 CO 0.74 0.24 1.31 0.00 0.23 0.00 0.00 176.35 178.87 1rm6 n ALA 94 N 2.53 1.48 -3.69 4.21 0.00 0.16 -4.31 120.51 120.89 1rm6 n ALA 94 Ca -0.15 0.24 -0.26 0.00 0.00 0.00 0.00 53.44 53.27 1rm6 n ALA 94 Cb 0.53 -2.30 -0.17 0.00 0.00 0.00 0.00 19.45 17.51 1rm6 n ALA 94 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1rm6 s ARG 95 N -2.32 1.77 0.00 0.00 0.52 -1.26 -3.88 118.95 113.77 1rm6 s ARG 95 Ca 0.62 -0.39 0.00 0.00 -0.52 0.00 0.00 55.73 55.44 1rm6 s ARG 95 Cb -0.48 -1.60 0.00 0.00 0.52 0.00 0.00 34.95 33.38 1rm6 s ARG 95 CO 0.57 -0.11 0.00 -0.25 0.02 0.00 0.00 175.30 175.53 1rm6 n ASP 96 N 4.35 0.00 -3.81 0.23 8.00 -1.26 -4.83 116.55 119.23 1rm6 n ASP 96 Ca -0.18 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.22 1rm6 n ASP 96 Cb 0.51 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.54 1rm6 n ASP 96 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 1rm6 s LYS 97 N 0.00 0.86 0.05 -1.24 -2.85 -1.26 -0.67 119.74 114.62 1rm6 s LYS 97 Ca 0.00 -0.83 0.05 0.00 -1.00 0.00 0.00 55.97 54.19 1rm6 s LYS 97 Cb 0.00 0.36 -0.04 0.00 -2.06 0.00 0.00 37.83 36.09 1rm6 s LYS 97 CO 0.00 -0.28 -0.08 0.14 0.10 0.00 0.00 175.35 175.22 1rm6 s VAL 98 N -3.57 3.51 0.00 1.79 -7.23 -0.13 -4.86 120.40 109.91 1rm6 s VAL 98 Ca 0.02 -0.99 0.00 0.00 -1.81 0.00 0.00 61.98 59.21 1rm6 s VAL 98 Cb 0.03 -2.57 0.00 0.00 0.56 0.00 0.00 36.38 34.40 1rm6 s VAL 98 CO -0.10 0.28 0.38 0.54 -0.31 0.00 0.00 175.10 175.89 1rm6 n ARG 99 N 1.20 -0.42 -3.61 4.82 1.74 -1.26 -1.92 116.66 117.22 1rm6 n ARG 99 Ca -0.14 -0.38 -0.12 0.00 -0.77 0.00 0.00 57.85 56.44 1rm6 n ARG 99 Cb 0.52 -0.87 -0.05 0.00 -1.02 0.00 0.00 32.46 31.04 1rm6 n ARG 99 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 1rm6 s TYR 100 N -0.05 -0.32 -0.26 -1.55 1.13 -0.82 -4.03 117.35 111.45 1rm6 s TYR 100 Ca 0.00 0.20 -0.29 0.00 -1.41 0.00 0.00 57.07 55.57 1rm6 s TYR 100 Cb 0.00 0.30 -0.01 0.00 -1.10 0.00 0.00 41.96 41.15 1rm6 s TYR 100 CO 0.00 -0.66 1.35 0.50 -2.51 0.00 0.00 175.55 174.24 1rm6 s ARG 101 N -2.99 3.94 0.00 -3.49 3.52 -1.20 -1.82 118.95 116.92 1rm6 s ARG 101 Ca -0.02 1.39 0.00 0.00 -0.13 0.00 0.00 55.73 56.97 1rm6 s ARG 101 Cb 0.00 -3.89 0.00 0.00 -1.56 0.00 0.00 34.95 29.50 1rm6 s ARG 101 CO -0.06 -1.09 0.00 0.41 -0.81 0.00 0.00 175.30 173.75 1rm6 n GLY 102 N 4.27 1.66 3.69 8.12 0.00 -0.03 -4.83 105.19 118.06 1rm6 n GLY 102 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1rm6 n GLY 102 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1rm6 n ASP 103 N 0.00 3.99 -4.74 1.61 4.64 -0.76 -4.35 116.55 116.94 1rm6 n ASP 103 Ca 0.00 0.98 -0.42 0.00 -1.38 0.00 0.00 54.79 53.98 1rm6 n ASP 103 Cb 0.00 -1.53 -0.02 0.00 -1.04 0.00 0.00 41.12 38.53 1rm6 n ASP 103 CO 0.00 0.00 0.00 -2.84 -0.82 0.00 0.00 177.20 173.54 1rm6 s PRO 104 N 2.90 4.14 -0.06 -0.67 0.02 -1.26 -0.69 135.00 139.37 1rm6 s PRO 104 Ca 0.83 2.55 0.02 0.00 0.02 0.00 0.00 61.00 64.42 1rm6 s PRO 104 Cb -0.50 -3.06 -0.05 0.00 0.02 0.00 0.00 34.50 30.92 1rm6 s PRO 104 CO 0.39 -0.65 -0.03 0.28 -0.33 0.00 0.00 177.00 176.66 1rm6 n VAL 105 N 2.85 0.37 -3.95 3.83 0.31 0.24 -0.66 118.33 121.31 1rm6 n VAL 105 Ca 0.11 -0.17 -0.10 0.00 -0.01 0.00 0.00 64.34 64.16 1rm6 n VAL 105 Cb 0.37 -0.78 -0.03 0.00 -0.91 0.00 0.00 33.84 32.49 1rm6 n VAL 105 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1rm6 s ALA 106 N -2.13 -0.24 0.06 3.52 0.00 -1.11 -4.03 121.76 117.84 1rm6 s ALA 106 Ca -0.07 -0.94 -0.17 0.00 0.00 0.00 0.00 51.96 50.79 1rm6 s ALA 106 Cb 0.02 0.96 0.03 0.00 0.00 0.00 0.00 23.12 24.13 1rm6 s ALA 106 CO 0.17 -0.90 0.38 0.00 0.00 0.00 0.00 175.76 175.42 1rm6 s ALA 107 N -3.31 -0.90 0.06 0.00 0.00 -0.53 0.21 121.76 117.29 1rm6 s ALA 107 Ca 0.21 0.14 0.02 0.00 0.00 0.00 0.00 51.96 52.33 1rm6 s ALA 107 Cb -0.02 0.42 -0.03 0.00 0.00 0.00 0.00 23.12 23.49 1rm6 s ALA 107 CO 0.12 -0.49 -0.07 0.14 0.00 0.00 0.00 175.76 175.46 1rm6 s VAL 108 N -2.83 0.53 -0.12 0.00 -7.23 -0.03 -1.15 120.40 109.58 1rm6 s VAL 108 Ca -0.03 -1.36 0.01 0.00 -1.81 0.00 0.00 61.98 58.79 1rm6 s VAL 108 Cb -0.00 -0.95 0.02 0.00 0.56 0.00 0.00 36.38 36.01 1rm6 s VAL 108 CO -0.05 -0.57 -0.13 0.00 -0.31 0.00 0.00 175.10 174.04 1rm6 s ALA 109 N -2.19 1.63 0.21 1.32 0.00 -0.35 -1.23 121.76 121.15 1rm6 s ALA 109 Ca -0.03 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.22 1rm6 s ALA 109 Cb -0.04 -0.91 -0.05 0.00 0.00 0.00 0.00 23.12 22.12 1rm6 s ALA 109 CO -0.02 -0.25 0.06 0.00 0.00 0.00 0.00 175.76 175.55 1rm6 s ALA 110 N 1.31 1.45 0.39 0.00 0.00 -0.12 -0.96 121.76 123.83 1rm6 s ALA 110 Ca -0.00 -1.71 0.23 0.00 0.00 0.00 0.00 51.96 50.48 1rm6 s ALA 110 Cb -0.14 0.86 1.23 0.00 0.00 0.00 0.00 23.12 25.07 1rm6 s ALA 110 CO -0.06 -0.42 2.00 0.97 0.00 0.00 0.00 175.76 178.26 1rm6 h ILE 111 N 2.57 0.76 -3.47 0.00 2.10 -1.19 0.19 117.51 118.47 1rm6 h ILE 111 Ca -0.37 -0.71 -0.06 0.00 1.08 0.00 0.00 64.86 64.80 1rm6 h ILE 111 Cb 1.23 1.43 -0.06 0.00 -1.09 0.00 0.00 36.82 38.32 1rm6 h ILE 111 CO 0.61 0.17 0.01 1.51 -1.08 0.00 0.00 178.15 179.37 1rm6 s ASP 112 N -6.41 0.06 0.19 2.19 1.47 -1.26 -4.57 116.67 108.33 1rm6 s ASP 112 Ca -0.03 -0.99 -0.10 0.00 1.18 0.00 0.00 52.55 52.61 1rm6 s ASP 112 Cb 0.13 0.68 0.10 0.00 -0.34 0.00 0.00 42.92 43.49 1rm6 s ASP 112 CO 0.63 -1.31 1.73 -0.33 0.68 0.00 0.00 175.17 176.57 1rm6 h GLU 113 N 2.13 1.01 -0.70 2.11 3.07 -1.94 -1.19 114.58 119.07 1rm6 h GLU 113 Ca -0.26 -0.20 -0.04 0.00 -0.50 0.00 0.00 59.36 58.36 1rm6 h GLU 113 Cb 1.25 -0.15 -0.03 0.00 -0.84 0.00 0.00 28.75 28.97 1rm6 h GLU 113 CO 0.34 0.86 0.29 -0.39 -1.40 0.00 0.00 179.01 178.71 1rm6 h VAL 114 N 0.94 1.24 -0.45 3.13 -1.51 -1.99 -0.93 116.25 116.69 1rm6 h VAL 114 Ca 0.22 -0.75 -0.14 0.00 -1.23 0.00 0.00 66.70 64.80 1rm6 h VAL 114 Cb 0.25 0.42 -0.01 0.00 -2.13 0.00 0.00 31.29 29.82 1rm6 h VAL 114 CO -0.01 0.30 -0.27 0.74 -1.23 0.00 0.00 177.57 177.10 1rm6 h THR 115 N 1.00 1.27 -0.65 7.19 2.02 -1.91 -1.65 112.91 120.18 1rm6 h THR 115 Ca 0.24 -1.44 -0.06 0.00 0.77 0.00 0.00 66.41 65.92 1rm6 h THR 115 Cb 0.19 1.22 -0.03 0.00 -1.74 0.00 0.00 68.15 67.79 1rm6 h THR 115 CO -0.02 0.49 0.18 0.00 0.37 0.00 0.00 175.52 176.54 1rm6 h ALA 116 N 0.83 1.09 -0.42 6.16 0.00 -0.93 -0.67 119.26 125.33 1rm6 h ALA 116 Ca 0.09 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1rm6 h ALA 116 Cb 0.86 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1rm6 h ALA 116 CO 0.08 0.61 0.12 1.49 0.00 0.00 0.00 179.25 181.55 1rm6 h GLU 117 N 0.97 0.65 -0.76 0.00 4.57 -0.95 -1.80 114.58 117.26 1rm6 h GLU 117 Ca 0.21 -0.15 -0.03 0.00 -1.18 0.00 0.00 59.36 58.21 1rm6 h GLU 117 Cb 0.31 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.77 1rm6 h GLU 117 CO -0.00 0.65 0.36 0.87 -1.18 0.00 0.00 179.01 179.71 1rm6 h LYS 118 N 0.53 1.10 -0.84 1.92 1.79 -0.96 -2.76 116.57 117.35 1rm6 h LYS 118 Ca 0.13 -0.17 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 1rm6 h LYS 118 Cb 0.28 -0.20 -0.04 0.00 -1.58 0.00 0.00 32.23 30.69 1rm6 h LYS 118 CO -0.00 0.86 0.47 0.00 -1.08 0.00 0.00 179.45 179.70 1rm6 h ALA 119 N 1.18 1.07 -0.97 3.86 0.00 -0.85 -2.13 119.26 121.42 1rm6 h ALA 119 Ca 0.26 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.08 1rm6 h ALA 119 Cb 0.13 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 17.53 1rm6 h ALA 119 CO -0.03 0.57 0.64 -0.07 0.00 0.00 0.00 179.25 180.35 1rm6 h LEU 120 N 1.16 1.07 -0.95 0.00 3.38 -1.05 -1.63 115.31 117.28 1rm6 h LEU 120 Ca 0.30 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1rm6 h LEU 120 Cb 0.01 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.51 1rm6 h LEU 120 CO -0.05 0.74 0.00 0.00 0.09 0.00 0.00 178.44 179.22 1rm6 h ALA 121 N 1.43 1.00 0.00 1.53 0.00 -1.20 -2.94 119.26 119.08 1rm6 h ALA 121 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1rm6 h ALA 121 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1rm6 h ALA 121 CO -0.11 0.00 -0.67 1.28 0.00 0.00 0.00 179.25 179.75 1rm6 n LEU 122 N -2.60 0.61 -4.70 0.00 4.77 -0.63 -4.86 117.00 109.59 1rm6 n LEU 122 Ca 0.02 0.08 -0.42 0.00 -0.03 0.00 0.00 56.01 55.65 1rm6 n LEU 122 Cb 0.28 -0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.15 1rm6 n LEU 122 CO 0.24 0.04 0.81 -0.63 -1.33 0.00 0.00 177.39 176.51 1rm6 s ILE 123 N -3.11 4.56 -0.23 -0.08 1.01 -1.11 -4.27 121.20 117.96 1rm6 s ILE 123 Ca 0.07 1.84 -0.08 0.00 0.00 0.00 0.00 60.65 62.49 1rm6 s ILE 123 Cb 0.15 -4.18 -0.04 0.00 0.01 0.00 0.00 42.46 38.40 1rm6 s ILE 123 CO 0.73 0.07 0.09 -0.75 0.00 0.00 0.00 174.94 175.08 1rm6 s LYS 124 N 1.58 3.81 -0.13 2.79 2.20 -0.39 -4.97 119.74 124.63 1rm6 s LYS 124 Ca 0.53 -0.41 0.03 0.00 -0.36 0.00 0.00 55.97 55.76 1rm6 s LYS 124 Cb -0.23 -3.36 0.01 0.00 -1.51 0.00 0.00 37.83 32.75 1rm6 s LYS 124 CO 0.24 -0.05 -0.23 0.08 -0.36 0.00 0.00 175.35 175.04 1rm6 s VAL 125 N 1.26 2.06 -0.21 4.02 1.01 -1.26 -0.73 120.40 126.55 1rm6 s VAL 125 Ca 0.05 -0.99 -0.12 0.00 0.00 0.00 0.00 61.98 60.92 1rm6 s VAL 125 Cb -0.14 -1.81 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 1rm6 s VAL 125 CO 0.04 0.55 0.23 -1.81 0.00 0.00 0.00 175.10 174.11 1rm6 s ASP 126 N 0.66 6.25 0.24 3.32 1.01 -0.17 -5.00 116.67 122.98 1rm6 s ASP 126 Ca -0.11 0.27 0.11 0.00 0.71 0.00 0.00 52.55 53.53 1rm6 s ASP 126 Cb -0.16 -2.14 -0.05 0.00 1.01 0.00 0.00 42.92 41.58 1rm6 s ASP 126 CO 0.02 0.06 -0.20 -0.31 0.21 0.00 0.00 175.17 174.94 1rm6 s TYR 127 N 0.93 2.17 -0.27 4.23 1.51 -1.26 -0.29 117.35 124.37 1rm6 s TYR 127 Ca 0.11 -0.38 0.02 0.00 -1.01 0.00 0.00 57.07 55.81 1rm6 s TYR 127 Cb -0.13 -0.98 0.06 0.00 -0.11 0.00 0.00 41.96 40.79 1rm6 s TYR 127 CO 0.04 0.60 -0.09 -2.00 -1.11 0.00 0.00 175.55 172.99 1rm6 s GLU 128 N -3.31 2.29 0.15 -0.62 2.12 -0.22 -4.89 118.70 114.22 1rm6 s GLU 128 Ca 0.26 -1.33 -0.30 0.00 0.36 0.00 0.00 54.97 53.96 1rm6 s GLU 128 Cb -0.05 -2.96 -0.07 0.00 0.26 0.00 0.00 34.13 31.31 1rm6 s GLU 128 CO 0.12 -0.58 1.23 0.08 -0.54 0.00 0.00 175.26 175.57 1rm6 s VAL 129 N 1.14 3.63 0.28 3.70 1.01 -1.26 -0.69 120.40 128.21 1rm6 s VAL 129 Ca -0.08 1.29 0.10 0.00 0.00 0.00 0.00 61.98 63.29 1rm6 s VAL 129 Cb -0.20 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.31 1rm6 s VAL 129 CO -0.04 0.17 -0.01 -0.76 0.00 0.00 0.00 175.10 174.45 1rm6 s LEU 130 N 0.23 3.10 0.52 3.92 1.43 -0.03 -4.95 118.68 122.90 1rm6 s LEU 130 Ca 0.56 -0.75 -0.22 0.00 -1.03 0.00 0.00 54.13 52.69 1rm6 s LEU 130 Cb -0.33 -1.60 -0.06 0.00 0.03 0.00 0.00 46.19 44.24 1rm6 s LEU 130 CO 0.34 -0.05 1.35 -2.84 0.23 0.00 0.00 176.35 175.38 1rm6 s PRO 131 N -3.67 3.27 0.04 1.29 0.02 -1.26 -4.50 135.00 130.19 1rm6 s PRO 131 Ca 0.32 2.21 0.09 0.00 0.02 0.00 0.00 61.00 63.64 1rm6 s PRO 131 Cb -0.05 -2.33 -0.03 0.00 0.02 0.00 0.00 34.50 32.12 1rm6 s PRO 131 CO 0.19 -1.08 -0.25 0.00 -0.33 0.00 0.00 177.00 175.54 1rm6 s ALA 132 N -1.31 2.13 -0.21 -1.55 0.00 -1.26 -4.83 121.76 114.74 1rm6 s ALA 132 Ca 0.69 -1.20 -0.02 0.00 0.00 0.00 0.00 51.96 51.43 1rm6 s ALA 132 Cb -0.40 -0.46 -0.00 0.00 0.00 0.00 0.00 23.12 22.26 1rm6 s ALA 132 CO 0.48 0.50 -0.09 0.71 0.00 0.00 0.00 175.76 177.36 1rm6 s TYR 133 N -0.77 2.90 -0.15 0.00 1.51 -1.26 -4.97 117.35 114.62 1rm6 s TYR 133 Ca 0.11 -1.11 0.19 0.00 -1.01 0.00 0.00 57.07 55.25 1rm6 s TYR 133 Cb -0.10 -2.04 -0.13 0.00 -0.11 0.00 0.00 41.96 39.58 1rm6 s TYR 133 CO 0.02 -0.60 0.79 -1.33 -1.11 0.00 0.00 175.55 173.32 1rm6 n MET 134 N 4.69 0.63 -4.43 -0.62 2.81 -1.26 -0.40 117.12 118.54 1rm6 n MET 134 Ca -0.19 0.14 -0.24 0.00 -1.81 0.00 0.00 57.70 55.60 1rm6 n MET 134 Cb 0.51 -1.76 -0.11 0.00 -0.71 0.00 0.00 33.22 31.15 1rm6 n MET 134 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1rm6 s THR 135 N -3.07 2.27 0.22 2.03 -4.23 -1.26 -4.89 115.64 106.72 1rm6 s THR 135 Ca -0.03 -2.24 -0.08 0.00 -1.18 0.00 0.00 61.69 58.15 1rm6 s THR 135 Cb 0.09 -2.17 0.19 0.00 1.34 0.00 0.00 72.50 71.95 1rm6 s THR 135 CO 0.82 -0.35 1.87 -0.65 -0.54 0.00 0.00 174.62 175.76 1rm6 h PRO 136 N 2.63 1.16 -0.44 3.99 0.11 -1.92 -0.97 132.00 136.56 1rm6 h PRO 136 Ca -0.41 -0.11 0.02 0.00 0.11 0.00 0.00 66.00 65.61 1rm6 h PRO 136 Cb 1.24 -0.24 -0.03 0.00 0.11 0.00 0.00 31.00 32.08 1rm6 h PRO 136 CO 0.57 0.82 0.26 0.87 -0.21 0.00 0.00 178.00 180.30 1rm6 h LYS 137 N 1.17 0.51 -0.67 1.05 1.57 -1.97 -0.48 116.57 117.75 1rm6 h LYS 137 Ca 0.31 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 59.02 1rm6 h LYS 137 Cb -0.04 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.13 1rm6 h LYS 137 CO -0.06 0.34 0.27 0.00 -0.57 0.00 0.00 179.45 179.43 1rm6 h ALA 138 N 1.20 0.86 0.00 3.86 0.00 -1.88 -2.73 119.26 120.58 1rm6 h ALA 138 Ca 0.18 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1rm6 h ALA 138 Cb 0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1rm6 h ALA 138 CO -0.08 0.48 -0.26 0.00 0.00 0.00 0.00 179.25 179.39 1rm6 h ALA 139 N 1.12 1.10 -0.01 0.00 0.00 -0.66 -3.10 119.26 117.71 1rm6 h ALA 139 Ca 0.22 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1rm6 h ALA 139 Cb 0.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1rm6 h ALA 139 CO -0.02 0.32 -0.42 -1.33 0.00 0.00 0.00 179.25 177.80 1rm6 n MET 140 N -3.55 0.69 -1.74 0.00 2.81 -0.24 -4.54 117.12 110.56 1rm6 n MET 140 Ca -0.01 -0.47 -0.42 0.00 -1.81 0.00 0.00 57.70 54.99 1rm6 n MET 140 Cb 0.41 -1.49 -0.00 0.00 -0.71 0.00 0.00 33.22 31.42 1rm6 n MET 140 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1rm6 n LYS 141 N -0.74 2.43 -1.75 0.03 4.81 -1.05 -4.89 118.16 117.00 1rm6 n LYS 141 Ca 0.10 0.85 -0.42 0.00 -0.87 0.00 0.00 58.31 57.97 1rm6 n LYS 141 Cb 0.37 -2.52 -0.01 0.00 0.02 0.00 0.00 35.03 32.89 1rm6 n LYS 141 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1rm6 n ALA 142 N 0.46 2.60 0.00 3.14 0.00 -1.26 -1.49 120.51 123.95 1rm6 n ALA 142 Ca 0.03 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1rm6 n ALA 142 Cb 0.37 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.35 1rm6 n ALA 142 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rm6 n GLY 143 N 2.13 3.07 3.76 0.00 0.00 -1.26 -5.05 105.19 107.84 1rm6 n GLY 143 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 1rm6 n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rm6 s ALA 144 N -2.83 3.05 0.14 4.61 0.00 -0.56 -4.95 121.76 121.21 1rm6 s ALA 144 Ca 0.00 1.15 -0.30 0.00 0.00 0.00 0.00 51.96 52.80 1rm6 s ALA 144 Cb 0.00 -3.47 -0.07 0.00 0.00 0.00 0.00 23.12 19.58 1rm6 s ALA 144 CO 0.00 -0.90 1.25 0.42 0.00 0.00 0.00 175.76 176.53 1rm6 s ILE 145 N -1.37 3.61 0.12 0.00 1.01 -1.26 -4.98 121.20 118.32 1rm6 s ILE 145 Ca 0.63 1.25 -0.30 0.00 0.00 0.00 0.00 60.65 62.22 1rm6 s ILE 145 Cb -0.35 -3.80 -0.07 0.00 0.01 0.00 0.00 42.46 38.25 1rm6 s ILE 145 CO 0.43 0.15 1.19 0.00 0.00 0.00 0.00 174.94 176.71 1rm6 s ALA 146 N 0.53 3.41 0.13 9.38 0.00 -1.26 -4.92 121.76 129.03 1rm6 s ALA 146 Ca 0.57 0.88 -0.14 0.00 0.00 0.00 0.00 51.96 53.28 1rm6 s ALA 146 Cb -0.33 -3.43 -0.01 0.00 0.00 0.00 0.00 23.12 19.36 1rm6 s ALA 146 CO 0.33 -0.39 1.57 -0.07 0.00 0.00 0.00 175.76 177.21 1rm6 h LEU 147 N 6.07 0.77 -8.16 0.00 4.07 -1.92 -3.42 115.31 112.72 1rm6 h LEU 147 Ca -0.43 -0.32 -0.63 0.00 0.08 0.00 0.00 57.88 56.58 1rm6 h LEU 147 Cb 1.21 -0.21 -0.34 0.00 1.08 0.00 0.00 40.66 42.41 1rm6 h LEU 147 CO 0.78 0.90 -0.86 -1.00 -1.08 0.00 0.00 178.44 177.19 1rm6 s HIS 148 N -4.96 2.31 0.58 1.13 3.76 -1.26 -5.03 115.29 111.83 1rm6 s HIS 148 Ca -0.13 -1.06 0.34 0.00 -0.15 0.00 0.00 55.06 54.07 1rm6 s HIS 148 Cb 0.11 -1.60 1.95 0.00 1.11 0.00 0.00 32.58 34.15 1rm6 s HIS 148 CO 0.81 -0.48 2.27 -0.44 -0.85 0.00 0.00 174.74 176.04 1rm6 h ASP 149 N 7.13 0.00 0.48 1.40 3.32 -2.00 -1.52 116.42 125.24 1rm6 h ASP 149 Ca -0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.77 1rm6 h ASP 149 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1rm6 h ASP 149 CO 0.50 0.01 0.00 -0.90 -1.72 0.00 0.00 179.24 177.14 1rm6 n ASP 150 N -3.59 0.00 -3.47 6.45 5.75 -1.26 -3.96 116.55 116.46 1rm6 n ASP 150 Ca -0.03 -0.25 -0.27 0.00 -0.01 0.00 0.00 54.79 54.24 1rm6 n ASP 150 Cb 0.10 -0.25 -0.10 0.00 -1.03 0.00 0.00 41.12 39.85 1rm6 n ASP 150 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1rm6 n LYS 151 N -1.25 0.88 0.02 0.11 4.76 -0.57 -5.00 118.16 117.12 1rm6 n LYS 151 Ca 0.15 -3.63 0.21 0.00 -2.87 0.00 0.00 58.31 52.18 1rm6 n LYS 151 Cb 0.22 -1.78 0.73 0.00 -1.84 0.00 0.00 35.03 32.35 1rm6 n LYS 151 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 1rm6 h PRO 152 N 5.13 0.00 -0.68 1.97 0.11 -1.70 -1.10 132.00 135.73 1rm6 h PRO 152 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1rm6 h PRO 152 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1rm6 h PRO 152 CO 0.51 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.57 1rm6 n ASN 153 N -4.06 3.89 -0.70 -2.05 6.94 -1.26 -4.43 115.26 113.59 1rm6 n ASN 153 Ca 0.10 -2.11 -0.09 0.00 -0.02 0.00 0.00 54.58 52.46 1rm6 n ASN 153 Cb 0.65 -0.49 -0.04 0.00 -2.36 0.00 0.00 39.78 37.55 1rm6 n ASN 153 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1rm6 n ASN 154 N 1.39 -5.11 -4.42 0.53 3.02 -0.42 -4.43 115.26 105.83 1rm6 n ASN 154 Ca 0.23 0.23 -0.42 0.00 -0.03 0.00 0.00 54.58 54.59 1rm6 n ASN 154 Cb 0.65 -3.41 -0.10 0.00 -0.61 0.00 0.00 39.78 36.31 1rm6 n ASN 154 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1rm6 s ILE 155 N -2.00 5.00 0.11 2.41 1.01 -1.26 -0.17 121.20 126.30 1rm6 s ILE 155 Ca 0.00 -0.80 -0.17 0.00 0.00 0.00 0.00 60.65 59.68 1rm6 s ILE 155 Cb 0.00 -3.82 -0.04 0.00 0.01 0.00 0.00 42.46 38.61 1rm6 s ILE 155 CO 0.00 -0.33 1.63 0.25 0.00 0.00 0.00 174.94 176.50 1rm6 h LEU 156 N 8.57 0.48 -7.16 2.97 5.85 -1.20 -3.46 115.31 121.36 1rm6 h LEU 156 Ca -0.26 -0.20 -0.08 0.00 0.84 0.00 0.00 57.88 58.17 1rm6 h LEU 156 Cb 1.11 -0.12 -0.22 0.00 0.37 0.00 0.00 40.66 41.79 1rm6 h LEU 156 CO 0.73 0.55 -0.05 -0.60 -0.34 0.00 0.00 178.44 178.73 1rm6 s ARG 157 N -5.41 0.68 0.17 1.25 6.06 -1.17 -5.02 118.95 115.51 1rm6 s ARG 157 Ca -0.13 0.72 0.10 0.00 -2.50 0.00 0.00 55.73 53.92 1rm6 s ARG 157 Cb 0.09 0.33 -0.04 0.00 0.06 0.00 0.00 34.95 35.39 1rm6 s ARG 157 CO 0.74 -0.09 -0.21 -1.21 -2.50 0.00 0.00 175.30 172.03 1rm6 s GLU 158 N 0.17 1.65 -0.04 5.12 2.02 -1.26 -1.02 118.70 125.34 1rm6 s GLU 158 Ca -0.01 -1.39 0.02 0.00 0.02 0.00 0.00 54.97 53.62 1rm6 s GLU 158 Cb -0.04 -1.96 0.01 0.00 0.10 0.00 0.00 34.13 32.24 1rm6 s GLU 158 CO 0.01 0.43 -0.09 0.08 0.02 0.00 0.00 175.26 175.71 1rm6 s VAL 159 N -1.48 0.83 -0.20 2.63 1.01 -0.05 -4.97 120.40 118.17 1rm6 s VAL 159 Ca 0.20 -0.34 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 1rm6 s VAL 159 Cb -0.09 -0.77 0.07 0.00 0.00 0.00 0.00 36.38 35.59 1rm6 s VAL 159 CO 0.10 0.27 0.10 -1.00 0.00 0.00 0.00 175.10 174.58 1rm6 s HIS 160 N 0.51 0.20 0.07 5.22 3.76 -1.26 -1.06 115.29 122.73 1rm6 s HIS 160 Ca -0.09 -0.42 0.01 0.00 -0.15 0.00 0.00 55.06 54.41 1rm6 s HIS 160 Cb -0.12 -0.73 -0.04 0.00 1.11 0.00 0.00 32.58 32.80 1rm6 s HIS 160 CO 0.01 -0.59 -0.06 0.00 -0.85 0.00 0.00 174.74 173.26 1rm6 s ALA 161 N 2.14 0.69 -0.03 -1.40 0.00 0.31 -5.02 121.76 118.44 1rm6 s ALA 161 Ca 0.04 -1.12 -0.03 0.00 0.00 0.00 0.00 51.96 50.84 1rm6 s ALA 161 Cb -0.16 0.16 0.01 0.00 0.00 0.00 0.00 23.12 23.13 1rm6 s ALA 161 CO -0.15 -0.22 0.10 -1.21 0.00 0.00 0.00 175.76 174.27 1rm6 s GLU 162 N -3.17 0.13 -0.11 0.00 2.02 -1.26 -1.24 118.70 115.07 1rm6 s GLU 162 Ca 0.03 0.10 -0.00 0.00 0.02 0.00 0.00 54.97 55.13 1rm6 s GLU 162 Cb 0.01 0.06 0.02 0.00 0.10 0.00 0.00 34.13 34.33 1rm6 s GLU 162 CO -0.05 -0.02 -0.07 -0.06 0.02 0.00 0.00 175.26 175.08 1rm6 s PHE 163 N -0.03 1.43 0.00 1.61 0.08 0.41 -5.00 117.98 116.48 1rm6 s PHE 163 Ca -0.01 -0.69 0.00 0.00 0.12 0.00 0.00 56.93 56.35 1rm6 s PHE 163 Cb -0.01 -1.19 0.00 0.00 -0.57 0.00 0.00 43.02 41.25 1rm6 s PHE 163 CO 0.00 -0.49 0.00 0.41 -0.10 0.00 0.00 175.22 175.05 1rm6 n GLY 164 N 4.87 -2.43 3.35 4.36 0.00 -1.26 -1.00 105.19 113.08 1rm6 n GLY 164 Ca -0.13 -1.64 -0.47 0.00 0.00 0.00 0.00 46.02 43.79 1rm6 n GLY 164 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rm6 s ASP 165 N -2.68 6.75 0.08 1.61 3.68 -1.26 -4.85 116.67 120.00 1rm6 s ASP 165 Ca 0.00 -2.61 -0.20 0.00 2.13 0.00 0.00 52.55 51.87 1rm6 s ASP 165 Cb 0.00 -2.24 -0.10 0.00 -1.45 0.00 0.00 42.92 39.14 1rm6 s ASP 165 CO 0.00 -0.64 1.57 0.58 0.13 0.00 0.00 175.17 176.81 1rm6 h VAL 166 N 4.92 1.20 -0.41 1.11 2.07 -1.92 -1.95 116.25 121.27 1rm6 h VAL 166 Ca 0.11 -0.65 0.03 0.00 0.82 0.00 0.00 66.70 67.02 1rm6 h VAL 166 Cb 1.04 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 32.05 1rm6 h VAL 166 CO 0.80 0.20 0.20 0.00 0.02 0.00 0.00 177.57 178.79 1rm6 h ALA 167 N 0.86 0.50 -0.53 1.67 0.00 -1.99 -1.66 119.26 118.12 1rm6 h ALA 167 Ca 0.06 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1rm6 h ALA 167 Cb 0.27 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1rm6 h ALA 167 CO 0.00 -0.16 -0.11 0.00 0.00 0.00 0.00 179.25 178.98 1rm6 h ALA 168 N 1.22 0.72 -0.39 0.00 0.00 -1.98 -1.47 119.26 117.35 1rm6 h ALA 168 Ca 0.18 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.76 1rm6 h ALA 168 Cb 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1rm6 h ALA 168 CO -0.13 0.64 0.22 0.00 0.00 0.00 0.00 179.25 179.98 1rm6 h ALA 169 N 0.91 0.49 -0.41 0.00 0.00 -1.04 -1.44 119.26 117.76 1rm6 h ALA 169 Ca 0.14 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 1rm6 h ALA 169 Cb 0.68 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1rm6 h ALA 169 CO 0.05 -0.13 -0.20 0.74 0.00 0.00 0.00 179.25 179.71 1rm6 h PHE 170 N 0.44 1.00 -0.18 0.00 0.04 -1.22 -2.81 116.94 114.21 1rm6 h PHE 170 Ca 0.16 -0.25 0.03 0.00 2.80 0.00 0.00 57.97 60.71 1rm6 h PHE 170 Cb 0.03 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 37.94 1rm6 h PHE 170 CO -0.08 1.02 0.13 0.00 -0.60 0.00 0.00 178.31 178.78 1rm6 h ALA 171 N 0.82 2.03 -0.07 2.45 0.00 -0.86 -1.40 119.26 122.24 1rm6 h ALA 171 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1rm6 h ALA 171 Cb 0.76 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1rm6 h ALA 171 CO 0.06 -0.07 0.00 0.39 0.00 0.00 0.00 179.25 179.63 1rm6 n GLU 172 N -4.50 1.89 -1.67 0.00 1.02 -0.58 -4.95 120.64 111.85 1rm6 n GLU 172 Ca 0.01 -1.31 -0.31 0.00 -0.02 0.00 0.00 57.16 55.52 1rm6 n GLU 172 Cb 0.18 -1.46 0.04 0.00 -0.02 0.00 0.00 31.44 30.18 1rm6 n GLU 172 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1rm6 s ALA 173 N -1.93 2.70 -0.10 0.62 0.00 -0.53 -4.98 121.76 117.53 1rm6 s ALA 173 Ca 0.35 0.14 0.15 0.00 0.00 0.00 0.00 51.96 52.61 1rm6 s ALA 173 Cb 0.20 -3.19 -0.16 0.00 0.00 0.00 0.00 23.12 19.97 1rm6 s ALA 173 CO 0.31 -1.14 0.78 -0.25 0.00 0.00 0.00 175.76 175.46 1rm6 n ASP 174 N -2.91 0.87 -3.74 0.00 8.00 -0.16 -4.90 116.55 113.71 1rm6 n ASP 174 Ca 0.08 0.39 -0.13 0.00 0.71 0.00 0.00 54.79 55.84 1rm6 n ASP 174 Cb 0.53 0.08 -0.14 0.00 -0.02 0.00 0.00 41.12 41.58 1rm6 n ASP 174 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1rm6 s LEU 175 N -5.88 0.65 -0.07 0.64 2.96 -0.55 -4.93 118.68 111.51 1rm6 s LEU 175 Ca -0.03 0.36 0.02 0.00 -0.22 0.00 0.00 54.13 54.25 1rm6 s LEU 175 Cb 0.08 0.46 0.01 0.00 0.50 0.00 0.00 46.19 47.25 1rm6 s LEU 175 CO 0.82 -0.15 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.94 1rm6 s ILE 176 N 1.17 1.14 0.04 6.68 1.01 -1.26 -0.54 121.20 129.45 1rm6 s ILE 176 Ca -0.09 -0.48 0.00 0.00 0.00 0.00 0.00 60.65 60.08 1rm6 s ILE 176 Cb -0.11 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.29 1rm6 s ILE 176 CO -0.06 0.36 -0.04 -0.13 0.00 0.00 0.00 174.94 175.06 1rm6 s ARG 177 N 0.67 0.50 0.02 2.79 1.81 -0.92 -5.02 118.95 118.80 1rm6 s ARG 177 Ca -0.15 -0.90 0.01 0.00 -1.72 0.00 0.00 55.73 52.97 1rm6 s ARG 177 Cb -0.16 0.02 -0.02 0.00 -0.45 0.00 0.00 34.95 34.35 1rm6 s ARG 177 CO 0.04 -0.04 -0.04 -2.00 -0.68 0.00 0.00 175.30 172.57 1rm6 s GLU 178 N -2.47 0.33 -0.03 3.54 2.12 -1.26 -1.88 118.70 119.05 1rm6 s GLU 178 Ca -0.05 -0.54 -0.22 0.00 0.36 0.00 0.00 54.97 54.52 1rm6 s GLU 178 Cb -0.03 -0.03 0.04 0.00 0.26 0.00 0.00 34.13 34.37 1rm6 s GLU 178 CO -0.04 -0.01 0.47 0.21 -0.54 0.00 0.00 175.26 175.35 1rm6 s LYS 179 N -1.23 0.83 -0.14 4.30 2.20 -0.04 -4.99 119.74 120.68 1rm6 s LYS 179 Ca -0.12 0.01 -0.03 0.00 -0.36 0.00 0.00 55.97 55.48 1rm6 s LYS 179 Cb -0.08 0.38 -0.03 0.00 -1.51 0.00 0.00 37.83 36.59 1rm6 s LYS 179 CO -0.00 -0.24 -0.05 0.99 -0.36 0.00 0.00 175.35 175.68 1rm6 s THR 180 N -1.24 3.80 0.05 3.43 2.01 -1.26 -0.45 115.64 121.98 1rm6 s THR 180 Ca -0.12 -0.40 0.09 0.00 0.31 0.00 0.00 61.69 61.57 1rm6 s THR 180 Cb -0.03 -2.64 -0.03 0.00 0.01 0.00 0.00 72.50 69.81 1rm6 s THR 180 CO 0.07 0.52 -0.25 -0.31 -0.69 0.00 0.00 174.62 173.95 1rm6 s TYR 181 N 0.14 2.19 0.06 4.92 2.02 0.05 -4.90 117.35 121.83 1rm6 s TYR 181 Ca -0.02 -0.40 0.08 0.00 -0.37 0.00 0.00 57.07 56.36 1rm6 s TYR 181 Cb -0.14 -1.30 -0.03 0.00 -0.40 0.00 0.00 41.96 40.10 1rm6 s TYR 181 CO 0.03 0.13 -0.21 0.95 -1.57 0.00 0.00 175.55 174.88 1rm6 s THR 182 N -0.83 1.70 -0.10 -0.71 -4.23 -0.75 -0.52 115.64 110.20 1rm6 s THR 182 Ca 0.11 -1.33 0.00 0.00 -1.18 0.00 0.00 61.69 59.29 1rm6 s THR 182 Cb -0.10 -1.50 0.02 0.00 1.34 0.00 0.00 72.50 72.26 1rm6 s THR 182 CO 0.02 0.12 -0.10 -0.36 -0.54 0.00 0.00 174.62 173.76 1rm6 s PHE 183 N -0.93 1.56 0.77 3.99 0.40 0.20 -1.05 117.98 122.92 1rm6 s PHE 183 Ca 0.07 -0.74 -0.14 0.00 -0.60 0.00 0.00 56.93 55.53 1rm6 s PHE 183 Cb -0.09 -1.23 0.06 0.00 0.51 0.00 0.00 43.02 42.27 1rm6 s PHE 183 CO 0.03 -0.46 1.19 0.00 0.70 0.00 0.00 175.22 176.67 1rm6 s ALA 184 N 1.37 2.00 0.33 5.36 0.00 -0.56 -1.58 121.76 128.68 1rm6 s ALA 184 Ca -0.01 0.79 -0.28 0.00 0.00 0.00 0.00 51.96 52.46 1rm6 s ALA 184 Cb -0.14 -3.46 -0.09 0.00 0.00 0.00 0.00 23.12 19.44 1rm6 s ALA 184 CO -0.05 -2.05 1.16 -2.00 0.00 0.00 0.00 175.76 172.82 1rm6 s GLU 185 N -4.11 4.39 0.20 0.00 2.12 -1.26 -4.53 118.70 115.50 1rm6 s GLU 185 Ca 0.72 1.89 0.06 0.00 0.36 0.00 0.00 54.97 57.99 1rm6 s GLU 185 Cb -0.27 -2.98 -0.05 0.00 0.26 0.00 0.00 34.13 31.09 1rm6 s GLU 185 CO 0.48 -0.04 -0.09 0.14 -0.54 0.00 0.00 175.26 175.21 1rm6 s VAL 186 N -1.26 1.39 0.16 3.70 -7.23 -0.90 -1.79 120.40 114.48 1rm6 s VAL 186 Ca 0.50 -2.12 0.11 0.00 -1.81 0.00 0.00 61.98 58.66 1rm6 s VAL 186 Cb -0.33 -2.07 -0.04 0.00 0.56 0.00 0.00 36.38 34.50 1rm6 s VAL 186 CO 0.42 -0.57 -0.24 0.21 -0.31 0.00 0.00 175.10 174.61 1rm6 s ASN 187 N -3.28 3.24 0.39 4.85 3.84 -1.26 -1.85 114.94 120.87 1rm6 s ASN 187 Ca 0.22 -0.81 0.14 0.00 0.21 0.00 0.00 52.86 52.63 1rm6 s ASN 187 Cb 0.02 -0.22 0.79 0.00 -0.55 0.00 0.00 41.25 41.29 1rm6 s ASN 187 CO 0.05 0.12 1.85 0.45 -2.79 0.00 0.00 177.10 176.79 1rm6 h HIS 188 N 3.54 0.00 -6.95 0.43 3.86 -1.90 -3.47 115.15 110.65 1rm6 h HIS 188 Ca -0.48 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 58.17 1rm6 h HIS 188 Cb 1.19 0.00 -0.12 0.00 1.06 0.00 0.00 27.41 29.54 1rm6 h HIS 188 CO 0.65 0.34 -0.91 0.28 0.86 0.00 0.00 177.93 179.15 1rm6 n VAL 189 N -4.08 -1.50 -1.95 2.45 0.31 -1.26 -4.90 118.33 107.40 1rm6 n VAL 189 Ca -0.02 -0.49 -0.39 0.00 -0.01 0.00 0.00 64.34 63.43 1rm6 n VAL 189 Cb 0.38 -1.36 0.01 0.00 -0.91 0.00 0.00 33.84 31.96 1rm6 n VAL 189 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 1rm6 s HIS 190 N -4.02 2.66 0.11 3.52 -3.43 -1.26 -4.90 115.29 107.97 1rm6 s HIS 190 Ca 0.18 1.36 0.22 0.00 -0.80 0.00 0.00 55.06 56.01 1rm6 s HIS 190 Cb -0.10 -3.76 0.76 0.00 -1.43 0.00 0.00 32.58 28.05 1rm6 s HIS 190 CO 0.91 -2.43 1.76 0.52 -2.00 0.00 0.00 174.74 173.50 1rm6 h MET 191 N 2.47 0.00 -6.51 -0.38 0.00 -1.91 -3.42 114.93 105.18 1rm6 h MET 191 Ca -0.50 0.00 -0.53 0.00 0.00 0.00 0.00 59.70 58.67 1rm6 h MET 191 Cb 1.26 0.00 -0.02 0.00 0.00 0.00 0.00 31.60 32.84 1rm6 h MET 191 CO 0.62 0.29 0.38 -2.00 0.00 0.00 0.00 176.91 176.19 1rm6 s GLU 192 N -3.58 4.63 0.50 1.72 2.12 -1.23 -5.04 118.70 117.84 1rm6 s GLU 192 Ca 0.01 1.46 -0.21 0.00 0.36 0.00 0.00 54.97 56.60 1rm6 s GLU 192 Cb 0.10 -3.40 -0.07 0.00 0.26 0.00 0.00 34.13 31.02 1rm6 s GLU 192 CO 0.66 0.10 1.09 -0.51 -0.54 0.00 0.00 175.26 176.06 1rm6 s LEU 193 N 0.38 3.85 0.54 2.70 1.43 -1.26 -4.96 118.68 121.36 1rm6 s LEU 193 Ca 0.49 2.09 -0.21 0.00 -1.03 0.00 0.00 54.13 55.47 1rm6 s LEU 193 Cb -0.23 -4.50 -0.05 0.00 0.03 0.00 0.00 46.19 41.44 1rm6 s LEU 193 CO 0.29 -0.96 1.30 0.20 0.23 0.00 0.00 176.35 177.41 1rm6 s ASN 194 N -1.78 5.37 -0.09 2.29 0.01 -1.26 -4.88 114.94 114.59 1rm6 s ASN 194 Ca 0.68 2.62 -0.30 0.00 -0.71 0.00 0.00 52.86 55.16 1rm6 s ASN 194 Cb -0.21 -2.62 0.11 0.00 0.41 0.00 0.00 41.25 38.93 1rm6 s ASN 194 CO 0.25 -1.49 0.89 0.00 -1.51 0.00 0.00 177.10 175.25 1rm6 s ALA 195 N -1.39 -1.86 -0.07 0.60 0.00 -1.26 -1.57 121.76 116.21 1rm6 s ALA 195 Ca 0.72 1.37 -0.04 0.00 0.00 0.00 0.00 51.96 54.01 1rm6 s ALA 195 Cb -0.37 -0.27 0.03 0.00 0.00 0.00 0.00 23.12 22.52 1rm6 s ALA 195 CO 0.43 -0.42 0.17 0.99 0.00 0.00 0.00 175.76 176.93 1rm6 s THR 196 N -1.63 -0.03 -0.25 0.00 2.01 -0.65 -2.30 115.64 112.79 1rm6 s THR 196 Ca -0.02 0.10 -0.04 0.00 0.31 0.00 0.00 61.69 62.03 1rm6 s THR 196 Cb -0.00 -0.26 0.00 0.00 0.01 0.00 0.00 72.50 72.25 1rm6 s THR 196 CO 0.01 0.04 -0.01 -0.22 -0.69 0.00 0.00 174.62 173.75 1rm6 s LEU 197 N 0.71 3.24 -0.21 4.42 2.96 0.10 -0.59 118.68 129.32 1rm6 s LEU 197 Ca -0.05 -0.59 -0.01 0.00 -0.22 0.00 0.00 54.13 53.25 1rm6 s LEU 197 Cb -0.07 -1.76 0.01 0.00 0.50 0.00 0.00 46.19 44.87 1rm6 s LEU 197 CO -0.04 -0.09 -0.12 0.00 -1.32 0.00 0.00 176.35 174.78 1rm6 s ALA 198 N 1.45 2.58 -0.32 5.97 0.00 -0.02 -1.12 121.76 130.30 1rm6 s ALA 198 Ca 0.04 -1.23 -0.08 0.00 0.00 0.00 0.00 51.96 50.69 1rm6 s ALA 198 Cb -0.16 -1.46 0.02 0.00 0.00 0.00 0.00 23.12 21.52 1rm6 s ALA 198 CO -0.02 -0.44 0.11 -1.21 0.00 0.00 0.00 175.76 174.20 1rm6 s GLU 199 N 1.37 2.93 -0.19 0.00 2.02 0.39 -0.56 118.70 124.66 1rm6 s GLU 199 Ca 0.05 -0.98 -0.05 0.00 0.02 0.00 0.00 54.97 54.01 1rm6 s GLU 199 Cb -0.14 -3.47 -0.03 0.00 0.10 0.00 0.00 34.13 30.59 1rm6 s GLU 199 CO -0.08 -0.55 0.00 -0.47 0.02 0.00 0.00 175.26 174.18 1rm6 s TYR 200 N 1.49 3.06 -0.45 1.61 5.04 -0.21 -0.52 117.35 127.37 1rm6 s TYR 200 Ca 0.01 -0.35 -0.14 0.00 -2.44 0.00 0.00 57.07 54.16 1rm6 s TYR 200 Cb -0.18 -2.05 0.07 0.00 0.35 0.00 0.00 41.96 40.14 1rm6 s TYR 200 CO 0.04 -0.14 0.35 0.34 -1.34 0.00 0.00 175.55 174.80 1rm6 s ASP 201 N 0.77 6.03 0.31 4.32 -1.08 0.93 -3.81 116.67 124.14 1rm6 s ASP 201 Ca 0.00 -1.29 0.26 0.00 -0.52 0.00 0.00 52.55 51.00 1rm6 s ASP 201 Cb -0.14 -2.14 0.88 0.00 -1.46 0.00 0.00 42.92 40.06 1rm6 s ASP 201 CO 0.02 -0.59 1.76 1.55 0.52 0.00 0.00 175.17 178.43 1rm6 h PRO 202 N 8.66 0.00 -0.17 4.34 0.13 -1.85 0.26 132.00 143.37 1rm6 h PRO 202 Ca -0.27 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.66 1rm6 h PRO 202 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1rm6 h PRO 202 CO 0.83 0.00 -0.69 0.28 -0.23 0.00 0.00 178.00 178.19 1rm6 h VAL 203 N 0.00 1.31 -0.00 1.56 2.07 -1.96 -3.29 116.25 115.94 1rm6 h VAL 203 Ca 0.00 -1.94 0.00 0.00 0.82 0.00 0.00 66.70 65.58 1rm6 h VAL 203 Cb 0.61 1.91 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 1rm6 h VAL 203 CO 0.00 0.61 -0.67 0.54 0.02 0.00 0.00 177.57 178.07 1rm6 n ARG 204 N -3.93 1.92 -3.31 1.57 1.74 -1.17 -5.01 116.66 108.47 1rm6 n ARG 204 Ca -0.05 -0.11 -0.17 0.00 -0.77 0.00 0.00 57.85 56.74 1rm6 n ARG 204 Cb 0.70 -1.23 0.07 0.00 -1.02 0.00 0.00 32.46 30.97 1rm6 n ARG 204 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1rm6 n ASP 205 N -1.19 -6.49 -3.92 0.55 2.03 0.85 -5.03 116.55 103.35 1rm6 n ASP 205 Ca 0.03 -0.74 -0.14 0.00 0.52 0.00 0.00 54.79 54.46 1rm6 n ASP 205 Cb 0.25 -4.96 -0.14 0.00 -0.72 0.00 0.00 41.12 35.55 1rm6 n ASP 205 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1rm6 s MET 206 N -4.59 0.23 -0.08 -0.67 -1.94 -0.86 -4.88 119.30 106.52 1rm6 s MET 206 Ca 0.45 -0.11 0.05 0.00 -1.71 0.00 0.00 55.69 54.38 1rm6 s MET 206 Cb -0.07 -0.22 -0.01 0.00 2.01 0.00 0.00 34.83 36.53 1rm6 s MET 206 CO 0.76 0.06 -0.24 -1.17 -0.01 0.00 0.00 175.02 174.42 1rm6 s LEU 207 N -0.07 2.09 -0.11 -0.03 2.96 -0.03 -0.05 118.68 123.45 1rm6 s LEU 207 Ca 0.01 -0.53 0.02 0.00 -0.22 0.00 0.00 54.13 53.41 1rm6 s LEU 207 Cb -0.01 -1.40 0.01 0.00 0.50 0.00 0.00 46.19 45.29 1rm6 s LEU 207 CO -0.00 0.21 -0.18 -0.89 -1.32 0.00 0.00 176.35 174.17 1rm6 s THR 208 N 0.07 1.64 -0.06 3.68 2.01 0.32 -0.66 115.64 122.65 1rm6 s THR 208 Ca -0.11 -0.74 0.05 0.00 0.31 0.00 0.00 61.69 61.20 1rm6 s THR 208 Cb -0.16 -1.47 -0.01 0.00 0.01 0.00 0.00 72.50 70.87 1rm6 s THR 208 CO 0.06 0.47 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.47 1rm6 s LEU 209 N 0.79 2.21 -0.17 4.42 1.43 0.33 -0.46 118.68 127.23 1rm6 s LEU 209 Ca -0.10 -0.45 -0.02 0.00 -1.03 0.00 0.00 54.13 52.53 1rm6 s LEU 209 Cb -0.16 -1.41 -0.01 0.00 0.03 0.00 0.00 46.19 44.64 1rm6 s LEU 209 CO 0.01 0.26 -0.09 0.20 0.23 0.00 0.00 176.35 176.96 1rm6 s ASN 210 N -0.23 4.17 0.09 2.29 -0.87 -0.27 -0.65 114.94 119.46 1rm6 s ASN 210 Ca -0.01 -0.34 -0.12 0.00 -1.57 0.00 0.00 52.86 50.82 1rm6 s ASN 210 Cb -0.13 -1.67 0.01 0.00 -0.02 0.00 0.00 41.25 39.44 1rm6 s ASN 210 CO 0.03 0.10 0.28 0.28 -2.57 0.00 0.00 177.10 175.22 1rm6 s THR 211 N 0.76 0.11 -1.30 1.60 -1.32 -1.09 -0.72 115.64 113.68 1rm6 s THR 211 Ca -0.04 -0.88 -0.15 0.00 -1.21 0.00 0.00 61.69 59.42 1rm6 s THR 211 Cb -0.15 -1.20 0.11 0.00 -1.51 0.00 0.00 72.50 69.75 1rm6 s THR 211 CO 0.02 -0.48 1.75 0.35 -2.21 0.00 0.00 174.62 174.04 1rm6 n THR 212 N 0.02 4.01 -4.18 5.08 -2.24 -0.97 -4.47 114.28 111.52 1rm6 n THR 212 Ca -0.16 -4.15 -0.17 0.00 -2.27 0.00 0.00 64.05 57.30 1rm6 n THR 212 Cb 0.62 -2.43 -0.12 0.00 -2.10 0.00 0.00 70.33 66.30 1rm6 n THR 212 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1rm6 s THR 213 N 2.81 0.96 -1.65 4.28 -1.32 -1.26 -4.88 115.64 114.57 1rm6 s THR 213 Ca 0.48 -1.16 0.24 0.00 -1.21 0.00 0.00 61.69 60.04 1rm6 s THR 213 Cb 0.04 -0.93 0.06 0.00 -1.51 0.00 0.00 72.50 70.17 1rm6 s THR 213 CO 0.02 -0.21 1.28 0.00 -2.21 0.00 0.00 174.62 173.50 1rm6 n GLN 214 N 1.49 0.75 -3.21 7.08 6.02 0.11 -4.65 117.38 124.98 1rm6 n GLN 214 Ca -0.21 -0.54 -0.24 0.00 -0.01 0.00 0.00 57.00 56.00 1rm6 n GLN 214 Cb 0.54 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 30.26 1rm6 n GLN 214 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1rm6 n VAL 215 N -0.65 0.60 -0.02 5.09 0.24 -1.20 -1.48 118.33 120.91 1rm6 n VAL 215 Ca 0.09 -4.63 0.17 0.00 -2.04 0.00 0.00 64.34 57.93 1rm6 n VAL 215 Cb 0.39 -1.50 0.62 0.00 -1.47 0.00 0.00 33.84 31.88 1rm6 n VAL 215 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 1rm6 h PRO 216 N 3.66 0.13 -0.08 7.34 0.13 -1.91 -1.02 132.00 140.25 1rm6 h PRO 216 Ca 0.11 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.23 1rm6 h PRO 216 Cb 0.80 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.90 1rm6 h PRO 216 CO 0.60 0.09 0.02 -0.92 -0.23 0.00 0.00 178.00 177.56 1rm6 h TYR 217 N 0.14 0.14 -0.78 1.56 -0.00 -1.90 -0.53 116.97 115.59 1rm6 h TYR 217 Ca 0.25 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.73 58.96 1rm6 h TYR 217 Cb 0.82 -0.04 -0.04 0.00 -0.00 0.00 0.00 36.73 37.47 1rm6 h TYR 217 CO -0.00 0.32 0.45 1.88 -0.00 0.00 0.00 178.16 180.81 1rm6 h TYR 218 N -0.08 1.05 -0.54 -3.82 0.05 -1.57 -1.07 116.97 110.99 1rm6 h TYR 218 Ca 0.03 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.78 1rm6 h TYR 218 Cb 0.25 -0.34 -0.02 0.00 1.01 0.00 0.00 36.73 37.63 1rm6 h TYR 218 CO 0.01 0.71 0.26 0.28 -1.05 0.00 0.00 178.16 178.36 1rm6 h VAL 219 N 1.09 1.20 -0.47 -2.88 2.07 -1.05 -1.18 116.25 115.03 1rm6 h VAL 219 Ca 0.28 -0.57 0.02 0.00 0.82 0.00 0.00 66.70 67.25 1rm6 h VAL 219 Cb -0.01 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 1rm6 h VAL 219 CO -0.05 0.23 0.27 -0.74 0.02 0.00 0.00 177.57 177.30 1rm6 h HIS 220 N 0.72 0.51 -0.60 1.57 6.17 -0.49 0.45 115.15 123.48 1rm6 h HIS 220 Ca 0.18 0.02 -0.04 0.00 0.71 0.00 0.00 60.37 61.25 1rm6 h HIS 220 Cb 0.12 -0.16 -0.03 0.00 2.52 0.00 0.00 27.41 29.87 1rm6 h HIS 220 CO -0.00 0.29 0.23 -0.07 0.71 0.00 0.00 177.93 179.09 1rm6 h LEU 221 N 0.54 0.83 -0.09 0.26 3.38 -0.92 -2.03 115.31 117.28 1rm6 h LEU 221 Ca 0.19 -0.17 -0.23 0.00 0.09 0.00 0.00 57.88 57.76 1rm6 h LEU 221 Cb 0.02 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1rm6 h LEU 221 CO -0.09 0.78 -1.02 0.11 0.09 0.00 0.00 178.44 178.30 1rm6 h LYS 222 N 0.83 0.21 -0.26 1.13 1.79 -0.88 -1.47 116.57 117.93 1rm6 h LYS 222 Ca 0.20 -0.29 -0.03 0.00 -2.18 0.00 0.00 60.65 58.35 1rm6 h LYS 222 Cb 0.21 0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 30.95 1rm6 h LYS 222 CO -0.02 1.07 0.05 0.28 -1.08 0.00 0.00 179.45 179.75 1rm6 h VAL 223 N 0.09 1.22 -0.24 0.50 2.07 -0.92 0.13 116.25 119.11 1rm6 h VAL 223 Ca -0.07 -0.74 0.02 0.00 0.82 0.00 0.00 66.70 66.73 1rm6 h VAL 223 Cb 1.71 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 32.68 1rm6 h VAL 223 CO 0.16 0.24 0.08 0.00 0.02 0.00 0.00 177.57 178.07 1rm6 h ALA 224 N 0.87 0.26 -0.10 1.67 0.00 -1.35 -0.88 119.26 119.74 1rm6 h ALA 224 Ca 0.08 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1rm6 h ALA 224 Cb 0.31 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1rm6 h ALA 224 CO 0.00 -0.33 0.02 0.00 0.00 0.00 0.00 179.25 178.94 1rm6 h ALA 225 N 1.15 0.13 -0.21 0.00 0.00 -1.14 -1.05 119.26 118.14 1rm6 h ALA 225 Ca 0.10 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1rm6 h ALA 225 Cb 0.07 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1rm6 h ALA 225 CO -0.10 -0.23 -0.26 0.00 0.00 0.00 0.00 179.25 178.65 1rm6 n LEU 227 N -4.12 1.22 -3.71 0.00 4.77 -0.34 -4.63 117.00 110.18 1rm6 n LEU 227 Ca -0.01 -0.36 -0.25 0.00 -0.03 0.00 0.00 56.01 55.37 1rm6 n LEU 227 Cb 0.40 -0.08 0.03 0.00 -2.33 0.00 0.00 43.42 41.44 1rm6 n LEU 227 CO 0.41 0.22 -0.10 0.00 -1.33 0.00 0.00 177.39 176.59 1rm6 n GLN 228 N -0.33 -3.20 -4.86 3.23 6.02 -0.60 -4.98 117.38 112.66 1rm6 n GLN 228 Ca 0.15 0.54 -0.26 0.00 -0.01 0.00 0.00 57.00 57.42 1rm6 n GLN 228 Cb 0.35 -4.76 -0.16 0.00 1.02 0.00 0.00 30.24 26.70 1rm6 n GLN 228 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1rm6 s MET 229 N -5.97 1.61 0.23 -1.09 1.75 -0.50 -5.05 119.30 110.28 1rm6 s MET 229 Ca 0.19 -0.63 -0.32 0.00 -1.25 0.00 0.00 55.69 53.68 1rm6 s MET 229 Cb -0.06 -1.48 -0.13 0.00 2.84 0.00 0.00 34.83 36.00 1rm6 s MET 229 CO 0.84 0.33 1.45 -3.47 -0.65 0.00 0.00 175.02 173.52 1rm6 n ASP 230 N 2.85 2.90 0.29 1.11 4.64 -1.26 -4.53 116.55 122.54 1rm6 n ASP 230 Ca -0.16 1.13 0.15 0.00 -1.38 0.00 0.00 54.79 54.53 1rm6 n ASP 230 Cb 0.53 -1.44 0.90 0.00 -1.04 0.00 0.00 41.12 40.07 1rm6 n ASP 230 CO 0.00 0.00 0.00 0.77 -0.82 0.00 0.00 177.20 177.15 1rm6 h SER 231 N 4.52 0.00 0.64 1.67 4.64 -1.93 -0.96 113.55 122.13 1rm6 h SER 231 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1rm6 h SER 231 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1rm6 h SER 231 CO 0.78 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.74 1rm6 n ALA 232 N -2.33 1.79 0.05 5.18 0.00 -1.26 -2.21 120.51 121.73 1rm6 n ALA 232 Ca -0.02 -0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.49 1rm6 n ALA 232 Cb 0.11 -1.30 0.26 0.00 0.00 0.00 0.00 19.45 18.52 1rm6 n ALA 232 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1rm6 n ARG 233 N -1.62 2.59 -4.97 0.00 1.74 -0.36 -4.93 116.66 109.11 1rm6 n ARG 233 Ca 0.04 -2.44 -0.27 0.00 -0.77 0.00 0.00 57.85 54.41 1rm6 n ARG 233 Cb 0.21 -1.54 -0.16 0.00 -1.02 0.00 0.00 32.46 29.95 1rm6 n ARG 233 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1rm6 s ILE 234 N -1.31 1.61 -0.08 0.55 1.01 -0.94 -0.85 121.20 121.19 1rm6 s ILE 234 Ca 0.43 -0.83 0.03 0.00 0.00 0.00 0.00 60.65 60.28 1rm6 s ILE 234 Cb 0.24 -1.36 0.01 0.00 0.01 0.00 0.00 42.46 41.36 1rm6 s ILE 234 CO 0.33 0.46 -0.19 -0.60 0.00 0.00 0.00 174.94 174.94 1rm6 s ARG 235 N -0.18 2.43 -0.11 2.79 3.52 0.17 -4.98 118.95 122.59 1rm6 s ARG 235 Ca 0.00 -0.67 0.03 0.00 -0.13 0.00 0.00 55.73 54.97 1rm6 s ARG 235 Cb -0.11 -1.89 0.00 0.00 -1.56 0.00 0.00 34.95 31.40 1rm6 s ARG 235 CO 0.01 0.11 -0.23 0.08 -0.81 0.00 0.00 175.30 174.47 1rm6 s VAL 236 N 0.48 2.04 -0.04 7.11 1.01 -1.26 -0.51 120.40 129.23 1rm6 s VAL 236 Ca -0.17 -1.00 0.04 0.00 0.00 0.00 0.00 61.98 60.86 1rm6 s VAL 236 Cb -0.17 -1.78 -0.00 0.00 0.00 0.00 0.00 36.38 34.43 1rm6 s VAL 236 CO 0.07 0.55 -0.18 -0.63 0.00 0.00 0.00 175.10 174.91 1rm6 s ILE 237 N 0.51 1.48 -0.30 2.22 1.01 0.17 -1.41 121.20 124.89 1rm6 s ILE 237 Ca -0.15 -0.75 -0.07 0.00 0.00 0.00 0.00 60.65 59.68 1rm6 s ILE 237 Cb -0.17 -1.27 0.00 0.00 0.01 0.00 0.00 42.46 41.03 1rm6 s ILE 237 CO 0.05 0.42 0.10 -0.75 0.00 0.00 0.00 174.94 174.76 1rm6 s LYS 238 N 0.01 3.16 0.00 2.79 2.20 -0.67 -2.67 119.74 124.57 1rm6 s LYS 238 Ca -0.04 -0.82 0.00 0.00 -0.36 0.00 0.00 55.97 54.76 1rm6 s LYS 238 Cb -0.12 -3.42 0.00 0.00 -1.51 0.00 0.00 37.83 32.79 1rm6 s LYS 238 CO 0.02 -0.43 0.00 -0.35 -0.36 0.00 0.00 175.35 174.23 1rm6 n PRO 239 N 4.90 1.33 -1.80 4.03 -0.04 -1.26 -4.85 135.00 137.30 1rm6 n PRO 239 Ca -0.14 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 62.93 1rm6 n PRO 239 Cb 0.48 0.00 0.04 0.00 -0.04 0.00 0.00 33.50 33.98 1rm6 n PRO 239 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1rm6 s PHE 240 N 0.09 2.32 -0.08 0.54 0.08 -1.01 -4.95 117.98 114.97 1rm6 s PHE 240 Ca 0.00 1.37 0.03 0.00 0.12 0.00 0.00 56.93 58.45 1rm6 s PHE 240 Cb 0.00 -3.80 0.01 0.00 -0.57 0.00 0.00 43.02 38.66 1rm6 s PHE 240 CO 0.00 -2.85 -0.17 -1.17 -0.10 0.00 0.00 175.22 170.93 1rm6 s LEU 241 N -3.42 1.82 -1.01 -0.37 2.96 -1.26 -4.01 118.68 113.40 1rm6 s LEU 241 Ca 0.70 -0.41 -0.07 0.00 -0.22 0.00 0.00 54.13 54.13 1rm6 s LEU 241 Cb -0.40 -1.08 -0.05 0.00 0.50 0.00 0.00 46.19 45.15 1rm6 s LEU 241 CO 0.48 0.08 2.94 0.61 -1.32 0.00 0.00 176.35 179.14 1rm6 n GLY 242 N 3.76 4.23 0.08 7.98 0.00 -1.26 -4.48 105.19 115.50 1rm6 n GLY 242 Ca -0.21 -1.63 0.01 0.00 0.00 0.00 0.00 46.02 44.19 1rm6 n GLY 242 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rm6 n GLY 243 N 2.46 -2.25 0.86 -0.02 0.00 -1.19 -3.48 105.19 101.58 1rm6 n GLY 243 Ca 0.62 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1rm6 n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rm6 n GLY 244 N -1.17 -0.38 2.46 -0.02 0.00 -1.26 -4.93 105.19 99.89 1rm6 n GLY 244 Ca 0.00 0.06 -0.20 0.00 0.00 0.00 0.00 46.02 45.88 1rm6 n GLY 244 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1rm6 n PHE 245 N -2.25 -0.59 0.00 1.61 3.72 -1.26 -1.48 117.46 117.20 1rm6 n PHE 245 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1rm6 n PHE 245 Cb 0.00 -3.59 0.00 0.00 -0.94 0.00 0.00 39.48 34.95 1rm6 n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1rm6 n GLY 246 N -0.69 2.19 0.29 1.37 0.00 -1.26 -1.21 105.19 105.87 1rm6 n GLY 246 Ca -0.22 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.87 1rm6 n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rm6 h ALA 247 N 0.00 1.89 -0.61 4.61 0.00 -1.32 -2.55 119.26 121.28 1rm6 h ALA 247 Ca 0.00 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.54 1rm6 h ALA 247 Cb 0.00 -0.08 -0.21 0.00 0.00 0.00 0.00 17.79 17.51 1rm6 h ALA 247 CO 0.00 0.09 0.12 0.54 0.00 0.00 0.00 179.25 180.00 1rm6 n ARG 248 N -4.50 2.20 -0.61 0.00 1.74 -1.26 -4.48 116.66 109.75 1rm6 n ARG 248 Ca 0.01 -3.26 0.09 0.00 -0.77 0.00 0.00 57.85 53.91 1rm6 n ARG 248 Cb 0.11 -2.00 0.35 0.00 -1.02 0.00 0.00 32.46 29.90 1rm6 n ARG 248 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1rm6 n THR 249 N -1.07 1.78 -3.99 0.55 -2.24 -0.96 -0.71 114.28 107.64 1rm6 n THR 249 Ca 0.44 -1.14 -0.09 0.00 -2.27 0.00 0.00 64.05 60.99 1rm6 n THR 249 Cb 1.13 0.10 -0.11 0.00 -2.10 0.00 0.00 70.33 69.36 1rm6 n THR 249 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1rm6 s GLU 250 N -1.85 0.33 0.26 -0.78 -1.05 -1.26 -4.90 118.70 109.45 1rm6 s GLU 250 Ca 0.50 -0.63 -0.30 0.00 -0.15 0.00 0.00 54.97 54.39 1rm6 s GLU 250 Cb 0.32 0.08 -0.10 0.00 -0.44 0.00 0.00 34.13 33.99 1rm6 s GLU 250 CO 0.24 -0.04 1.45 0.00 0.95 0.00 0.00 175.26 177.86 1rm6 s ALA 251 N -1.50 3.63 0.15 -0.84 0.00 -1.26 -4.95 121.76 116.99 1rm6 s ALA 251 Ca -0.15 1.36 0.06 0.00 0.00 0.00 0.00 51.96 53.22 1rm6 s ALA 251 Cb -0.10 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 19.42 1rm6 s ALA 251 CO -0.01 -0.77 0.07 -0.51 0.00 0.00 0.00 175.76 174.54 1rm6 s LEU 252 N -0.47 3.59 0.28 0.00 1.43 -1.26 -4.93 118.68 117.32 1rm6 s LEU 252 Ca 0.59 -0.22 0.02 0.00 -1.03 0.00 0.00 54.13 53.49 1rm6 s LEU 252 Cb -0.42 -2.23 0.62 0.00 0.03 0.00 0.00 46.19 44.18 1rm6 s LEU 252 CO 0.44 0.10 1.79 1.12 0.23 0.00 0.00 176.35 180.03 1rm6 h HIS 253 N 2.70 1.00 0.00 0.29 2.07 -1.94 -2.18 115.15 117.09 1rm6 h HIS 253 Ca -0.47 0.03 -0.04 0.00 -2.85 0.00 0.00 60.37 57.04 1rm6 h HIS 253 Cb 1.19 -0.30 -0.01 0.00 2.57 0.00 0.00 27.41 30.87 1rm6 h HIS 253 CO 0.60 0.28 -0.18 0.27 -3.07 0.00 0.00 177.93 175.83 1rm6 h PHE 254 N 0.79 0.00 -0.28 6.12 -0.00 -1.96 -0.36 116.94 121.25 1rm6 h PHE 254 Ca 0.52 0.00 -0.10 0.00 -0.00 0.00 0.00 57.97 58.39 1rm6 h PHE 254 Cb 0.70 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.64 1rm6 h PHE 254 CO -0.03 0.18 -0.21 0.93 -0.00 0.00 0.00 178.31 179.18 1rm6 h GLU 255 N 0.00 0.64 -0.43 6.09 5.08 -1.78 -0.56 114.58 123.63 1rm6 h GLU 255 Ca -0.00 -0.31 -0.10 0.00 -1.00 0.00 0.00 59.36 57.95 1rm6 h GLU 255 Cb 0.35 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1rm6 h GLU 255 CO 0.02 0.91 -0.10 0.82 -1.00 0.00 0.00 179.01 179.66 1rm6 h ILE 256 N 0.38 1.27 -0.71 3.13 2.04 -1.40 -2.74 117.51 119.47 1rm6 h ILE 256 Ca 0.05 -1.21 -0.05 0.00 1.00 0.00 0.00 64.86 64.65 1rm6 h ILE 256 Cb 0.76 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.97 1rm6 h ILE 256 CO 0.06 0.41 0.24 0.40 0.00 0.00 0.00 178.15 179.26 1rm6 h ILE 257 N 0.66 1.25 -0.68 -0.67 2.04 -1.02 0.07 117.51 119.15 1rm6 h ILE 257 Ca 0.11 -0.85 0.02 0.00 1.00 0.00 0.00 64.86 65.14 1rm6 h ILE 257 Cb 0.64 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.12 1rm6 h ILE 257 CO 0.04 0.34 0.44 0.00 0.00 0.00 0.00 178.15 178.97 1rm6 h ALA 258 N 1.21 0.89 -0.59 1.87 0.00 -0.94 0.13 119.26 121.81 1rm6 h ALA 258 Ca 0.23 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1rm6 h ALA 258 Cb 0.26 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1rm6 h ALA 258 CO -0.01 0.23 0.08 0.78 0.00 0.00 0.00 179.25 180.33 1rm6 h GLY 259 N 0.87 1.07 0.98 0.00 0.00 -1.13 -0.54 103.07 104.32 1rm6 h GLY 259 Ca 0.27 -0.73 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 1rm6 h GLY 259 CO -0.09 0.67 0.25 -2.00 0.00 0.00 0.00 176.54 175.37 1rm6 h LEU 260 N 0.90 0.50 -0.55 3.11 5.85 -0.46 -1.39 115.31 123.26 1rm6 h LEU 260 Ca 0.18 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 1rm6 h LEU 260 Cb 0.44 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 1rm6 h LEU 260 CO 0.01 0.42 0.05 -0.07 -0.34 0.00 0.00 178.44 178.51 1rm6 h LEU 261 N 0.55 0.91 -0.78 2.25 3.38 -0.60 -1.54 115.31 119.47 1rm6 h LEU 261 Ca 0.15 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 1rm6 h LEU 261 Cb 0.01 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 1rm6 h LEU 261 CO -0.03 0.96 0.14 0.00 0.09 0.00 0.00 178.44 179.60 1rm6 h ALA 262 N 0.98 1.00 -0.37 1.53 0.00 -0.91 0.63 119.26 122.12 1rm6 h ALA 262 Ca 0.16 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1rm6 h ALA 262 Cb 0.47 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1rm6 h ALA 262 CO 0.02 0.64 -0.12 -0.09 0.00 0.00 0.00 179.25 179.70 1rm6 h ARG 263 N 1.00 0.74 -0.81 0.00 2.43 -1.12 -0.49 114.38 116.13 1rm6 h ARG 263 Ca 0.21 -0.30 -0.03 0.00 -0.81 0.00 0.00 59.98 59.04 1rm6 h ARG 263 Cb 0.39 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.86 1rm6 h ARG 263 CO 0.01 0.90 0.38 -0.22 -1.51 0.00 0.00 179.97 179.53 1rm6 h LYS 264 N 0.54 1.18 -0.00 0.20 1.63 -0.98 -1.90 116.57 117.23 1rm6 h LYS 264 Ca 0.09 -0.18 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 1rm6 h LYS 264 Cb 0.65 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 32.07 1rm6 h LYS 264 CO 0.04 0.92 -0.04 0.00 -3.45 0.00 0.00 179.45 176.92 1rm6 n ALA 265 N -2.41 2.54 -3.84 5.00 0.00 0.19 -4.90 120.51 117.09 1rm6 n ALA 265 Ca 0.08 -0.16 -0.27 0.00 0.00 0.00 0.00 53.44 53.08 1rm6 n ALA 265 Cb 0.15 -1.45 0.03 0.00 0.00 0.00 0.00 19.45 18.18 1rm6 n ALA 265 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1rm6 n LYS 266 N -1.29 -5.46 0.00 0.00 5.02 -0.30 -4.89 118.16 111.24 1rm6 n LYS 266 Ca 0.12 0.61 0.00 0.00 -2.02 0.00 0.00 58.31 57.03 1rm6 n LYS 266 Cb 0.27 -5.41 0.00 0.00 -0.02 0.00 0.00 35.03 29.87 1rm6 n LYS 266 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1rm6 n GLY 267 N -1.68 3.41 3.50 0.72 0.00 -0.56 -4.62 105.19 105.97 1rm6 n GLY 267 Ca -0.06 -0.39 -0.33 0.00 0.00 0.00 0.00 46.02 45.23 1rm6 n GLY 267 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rm6 s THR 268 N -0.79 3.56 -0.06 2.61 2.01 -1.26 -1.04 115.64 120.66 1rm6 s THR 268 Ca 0.00 -0.51 0.02 0.00 0.31 0.00 0.00 61.69 61.52 1rm6 s THR 268 Cb 0.00 -2.49 0.01 0.00 0.01 0.00 0.00 72.50 70.03 1rm6 s THR 268 CO 0.00 0.55 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.67 1rm6 s VAL 269 N -0.23 1.13 -0.28 3.82 1.01 0.28 -0.47 120.40 125.67 1rm6 s VAL 269 Ca 0.03 -0.49 -0.07 0.00 0.00 0.00 0.00 61.98 61.44 1rm6 s VAL 269 Cb -0.13 -1.02 -0.01 0.00 0.00 0.00 0.00 36.38 35.22 1rm6 s VAL 269 CO 0.03 0.35 0.08 -0.60 0.00 0.00 0.00 175.10 174.95 1rm6 s ARG 270 N 0.56 3.33 -0.41 2.72 3.52 0.12 -0.84 118.95 127.95 1rm6 s ARG 270 Ca -0.12 -0.70 -0.05 0.00 -0.13 0.00 0.00 55.73 54.73 1rm6 s ARG 270 Cb -0.15 -3.35 0.10 0.00 -1.56 0.00 0.00 34.95 29.99 1rm6 s ARG 270 CO 0.03 -0.34 0.22 -1.17 -0.81 0.00 0.00 175.30 173.23 1rm6 s LEU 271 N 1.55 5.21 0.24 -0.88 2.96 0.25 -1.19 118.68 126.82 1rm6 s LEU 271 Ca 0.04 -1.89 -0.04 0.00 -0.22 0.00 0.00 54.13 52.03 1rm6 s LEU 271 Cb -0.16 -1.87 -0.05 0.00 0.50 0.00 0.00 46.19 44.61 1rm6 s LEU 271 CO 0.03 -0.55 0.47 -0.76 -1.32 0.00 0.00 176.35 174.23 1rm6 s LEU 272 N 1.22 4.15 0.04 -0.68 1.43 -1.26 -1.63 118.68 121.95 1rm6 s LEU 272 Ca 0.06 0.60 0.09 0.00 -1.03 0.00 0.00 54.13 53.85 1rm6 s LEU 272 Cb -0.23 -3.38 -0.03 0.00 0.03 0.00 0.00 46.19 42.58 1rm6 s LEU 272 CO -0.03 -0.11 -0.26 -1.10 0.23 0.00 0.00 176.35 175.09 1rm6 s GLN 273 N -3.33 1.80 0.92 1.70 -1.52 -0.61 -4.94 119.66 113.69 1rm6 s GLN 273 Ca 0.42 -1.09 -0.14 0.00 -1.95 0.00 0.00 55.36 52.59 1rm6 s GLN 273 Cb -0.11 -1.96 0.16 0.00 -0.22 0.00 0.00 33.01 30.87 1rm6 s GLN 273 CO 0.28 0.51 1.22 0.95 -0.25 0.00 0.00 175.29 178.01 1rm6 s THR 274 N -0.79 1.97 0.24 -0.19 -4.23 -1.26 -4.46 115.64 106.91 1rm6 s THR 274 Ca 0.11 0.00 -0.04 0.00 -1.18 0.00 0.00 61.69 60.59 1rm6 s THR 274 Cb -0.10 -2.91 0.09 0.00 1.34 0.00 0.00 72.50 70.92 1rm6 s THR 274 CO 0.02 0.00 1.71 -0.09 -0.54 0.00 0.00 174.62 175.72 1rm6 h ARG 275 N -1.50 0.85 -0.45 3.99 9.65 -1.98 -0.55 114.38 124.38 1rm6 h ARG 275 Ca -0.46 -0.26 0.02 0.00 -1.10 0.00 0.00 59.98 58.19 1rm6 h ARG 275 Cb 1.29 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 29.75 1rm6 h ARG 275 CO 0.51 0.87 0.26 1.49 2.80 0.00 0.00 179.97 185.91 1rm6 h GLU 276 N 0.78 0.51 0.00 0.20 4.81 -1.93 -0.93 114.58 118.01 1rm6 h GLU 276 Ca 0.14 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 1rm6 h GLU 276 Cb 0.53 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 1rm6 h GLU 276 CO 0.03 0.34 -0.25 0.93 -0.73 0.00 0.00 179.01 179.32 1rm6 h GLU 277 N 0.52 0.00 -0.43 1.92 5.08 -1.82 -0.49 114.58 119.36 1rm6 h GLU 277 Ca 0.18 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.39 1rm6 h GLU 277 Cb 0.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1rm6 h GLU 277 CO -0.09 0.25 -0.31 1.15 -1.00 0.00 0.00 179.01 179.01 1rm6 h THR 278 N 0.00 1.27 -0.25 1.13 2.02 -0.39 -0.61 112.91 116.08 1rm6 h THR 278 Ca -0.00 -1.48 -0.05 0.00 0.77 0.00 0.00 66.41 65.65 1rm6 h THR 278 Cb 0.46 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 68.11 1rm6 h THR 278 CO 0.03 0.50 -0.05 -0.26 0.37 0.00 0.00 175.52 176.12 1rm6 h PHE 279 N 0.81 0.40 -0.36 3.16 -1.00 -0.39 -2.48 116.94 117.08 1rm6 h PHE 279 Ca 0.08 -0.04 -0.14 0.00 2.81 0.00 0.00 57.97 60.69 1rm6 h PHE 279 Cb 0.90 -0.12 -0.01 0.00 3.61 0.00 0.00 35.95 40.33 1rm6 h PHE 279 CO 0.06 0.44 -0.32 0.82 -1.61 0.00 0.00 178.31 177.70 1rm6 h ILE 280 N 0.37 1.28 -0.44 -0.55 2.04 -0.72 -2.75 117.51 116.74 1rm6 h ILE 280 Ca 0.08 -1.48 0.04 0.00 1.00 0.00 0.00 64.86 64.50 1rm6 h ILE 280 Cb 0.33 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.71 1rm6 h ILE 280 CO 0.01 0.49 0.20 0.00 0.00 0.00 0.00 178.15 178.85 1rm6 h ALA 281 N 0.95 0.54 -0.85 1.87 0.00 -0.78 -3.44 119.26 117.55 1rm6 h ALA 281 Ca 0.07 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1rm6 h ALA 281 Cb 0.87 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1rm6 h ALA 281 CO 0.08 -0.17 0.00 1.58 0.00 0.00 0.00 179.25 180.73 1rm6 n HIS 282 N -4.94 0.00 -2.20 0.00 -0.00 -0.96 -4.66 115.22 102.45 1rm6 n HIS 282 Ca 0.03 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.64 1rm6 n HIS 282 Cb 0.13 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.11 1rm6 n HIS 282 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1rm6 n ARG 283 N 3.49 -0.87 -0.29 1.57 5.12 0.08 -4.80 116.66 120.96 1rm6 n ARG 283 Ca 0.00 0.53 0.00 0.00 -1.93 0.00 0.00 57.85 56.45 1rm6 n ARG 283 Cb 0.00 -4.64 0.00 0.00 -1.16 0.00 0.00 32.46 26.66 1rm6 n ARG 283 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1rm6 n GLY 284 N -1.01 0.27 3.69 -0.13 0.00 -1.26 -1.96 105.19 104.79 1rm6 n GLY 284 Ca -0.13 -1.85 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 1rm6 n GLY 284 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1rm6 s ARG 285 N -1.26 4.43 0.59 1.61 3.52 -0.77 -0.72 118.95 126.35 1rm6 s ARG 285 Ca 0.00 1.52 -0.17 0.00 -0.13 0.00 0.00 55.73 56.95 1rm6 s ARG 285 Cb 0.00 -3.51 -0.04 0.00 -1.56 0.00 0.00 34.95 29.84 1rm6 s ARG 285 CO 0.00 -0.30 1.09 -1.25 -0.81 0.00 0.00 175.30 174.03 1rm6 s PRO 286 N 1.79 3.22 0.29 5.12 0.04 -1.26 -2.11 135.00 142.09 1rm6 s PRO 286 Ca 0.52 1.40 -0.30 0.00 0.04 0.00 0.00 61.00 62.66 1rm6 s PRO 286 Cb -0.22 -2.01 -0.12 0.00 0.04 0.00 0.00 34.50 32.20 1rm6 s PRO 286 CO 0.22 -0.92 1.60 1.87 0.04 0.00 0.00 177.00 179.81 1rm6 n TRP 287 N -1.82 2.83 -3.92 0.56 -0.00 -1.26 -4.51 117.44 109.32 1rm6 n TRP 287 Ca 0.10 0.25 -0.14 0.00 -0.00 0.00 0.00 57.50 57.71 1rm6 n TRP 287 Cb 0.52 -2.60 -0.15 0.00 -0.00 0.00 0.00 31.31 29.09 1rm6 n TRP 287 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 1rm6 s THR 288 N 0.05 0.10 -0.17 5.87 2.01 -0.61 -1.44 115.64 121.44 1rm6 s THR 288 Ca 0.65 -0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.61 1rm6 s THR 288 Cb -0.50 -0.12 -0.02 0.00 0.01 0.00 0.00 72.50 71.87 1rm6 s THR 288 CO 0.48 0.06 -0.05 -0.70 -0.69 0.00 0.00 174.62 173.71 1rm6 s GLU 289 N 0.27 3.54 -0.16 4.92 2.12 -0.49 -0.63 118.70 128.26 1rm6 s GLU 289 Ca -0.02 -0.58 0.01 0.00 0.36 0.00 0.00 54.97 54.74 1rm6 s GLU 289 Cb -0.04 -2.91 0.02 0.00 0.26 0.00 0.00 34.13 31.46 1rm6 s GLU 289 CO -0.01 0.09 -0.18 0.08 -0.54 0.00 0.00 175.26 174.70 1rm6 s VAL 290 N 0.73 1.90 -0.25 3.70 1.01 0.32 -1.24 120.40 126.57 1rm6 s VAL 290 Ca -0.02 -0.85 -0.11 0.00 0.00 0.00 0.00 61.98 61.00 1rm6 s VAL 290 Cb -0.15 -1.73 -0.05 0.00 0.00 0.00 0.00 36.38 34.46 1rm6 s VAL 290 CO 0.02 0.52 0.20 -0.75 0.00 0.00 0.00 175.10 175.08 1rm6 s LYS 291 N 1.27 4.03 -0.12 2.72 2.20 -0.12 -0.77 119.74 128.96 1rm6 s LYS 291 Ca 0.03 -0.25 0.03 0.00 -0.36 0.00 0.00 55.97 55.42 1rm6 s LYS 291 Cb -0.13 -3.59 -0.00 0.00 -1.51 0.00 0.00 37.83 32.59 1rm6 s LYS 291 CO -0.11 -0.05 -0.20 1.41 -0.36 0.00 0.00 175.35 176.04 1rm6 s MET 292 N 1.38 3.14 -0.09 4.03 -2.45 0.40 -1.01 119.30 124.71 1rm6 s MET 292 Ca 0.08 -0.82 -0.00 0.00 -1.25 0.00 0.00 55.69 53.70 1rm6 s MET 292 Cb -0.15 -2.42 0.02 0.00 1.25 0.00 0.00 34.83 33.54 1rm6 s MET 292 CO 0.07 0.16 -0.05 0.21 1.05 0.00 0.00 175.02 176.46 1rm6 s LYS 293 N 0.42 1.21 0.03 4.11 2.20 -0.01 -0.86 119.74 126.84 1rm6 s LYS 293 Ca -0.15 -0.14 0.06 0.00 -0.36 0.00 0.00 55.97 55.38 1rm6 s LYS 293 Cb -0.17 -1.34 -0.02 0.00 -1.51 0.00 0.00 37.83 34.79 1rm6 s LYS 293 CO 0.07 -0.24 -0.18 0.42 -0.36 0.00 0.00 175.35 175.05 1rm6 s ILE 294 N 1.66 1.47 -0.07 5.43 1.01 -0.79 -0.91 121.20 129.01 1rm6 s ILE 294 Ca 0.02 -1.06 0.05 0.00 0.00 0.00 0.00 60.65 59.66 1rm6 s ILE 294 Cb -0.13 -1.28 -0.01 0.00 0.01 0.00 0.00 42.46 41.05 1rm6 s ILE 294 CO -0.06 0.19 -0.22 -0.83 0.00 0.00 0.00 174.94 174.02 1rm6 s GLY 295 N -1.02 1.36 0.19 6.18 0.00 -0.22 -2.17 107.32 111.63 1rm6 s GLY 295 Ca 0.06 -1.01 0.08 0.00 0.00 0.00 0.00 44.72 43.85 1rm6 s GLY 295 CO 0.01 -0.57 -0.17 1.08 0.00 0.00 0.00 173.10 173.45 1rm6 s LEU 296 N -0.11 2.49 0.50 0.66 1.43 0.30 -0.00 118.68 123.95 1rm6 s LEU 296 Ca -0.04 -0.93 -0.07 0.00 -1.03 0.00 0.00 54.13 52.06 1rm6 s LEU 296 Cb -0.14 -0.79 -0.04 0.00 0.03 0.00 0.00 46.19 45.25 1rm6 s LEU 296 CO 0.04 -0.08 0.83 -0.54 0.23 0.00 0.00 176.35 176.83 1rm6 s LYS 297 N -3.15 3.57 0.62 1.70 -0.14 0.72 -0.98 119.74 122.07 1rm6 s LYS 297 Ca 0.19 0.32 0.37 0.00 -1.36 0.00 0.00 55.97 55.49 1rm6 s LYS 297 Cb -0.04 -2.32 2.08 0.00 -1.68 0.00 0.00 37.83 35.87 1rm6 s LYS 297 CO 0.07 -0.27 2.29 1.57 -0.76 0.00 0.00 175.35 178.26 1rm6 h LYS 298 N 0.17 0.00 -0.12 1.68 2.10 -1.91 0.12 116.57 118.61 1rm6 h LYS 298 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 1rm6 h LYS 298 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 1rm6 h LYS 298 CO 0.62 0.01 0.00 -0.40 -2.00 0.00 0.00 179.45 177.68 1rm6 n ASP 299 N -3.42 1.16 0.00 7.07 5.75 -1.26 -4.91 116.55 120.94 1rm6 n ASP 299 Ca -0.03 -1.65 0.00 0.00 -0.01 0.00 0.00 54.79 53.11 1rm6 n ASP 299 Cb 0.10 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.11 1rm6 n ASP 299 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1rm6 n GLY 300 N 1.01 0.10 3.76 6.12 0.00 0.03 -5.06 105.19 111.15 1rm6 n GLY 300 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1rm6 n GLY 300 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rm6 s LYS 301 N -0.97 4.34 0.12 1.61 -0.14 -1.25 -4.73 119.74 118.72 1rm6 s LYS 301 Ca 0.00 2.21 -0.30 0.00 -1.36 0.00 0.00 55.97 56.52 1rm6 s LYS 301 Cb 0.00 -3.10 -0.07 0.00 -1.68 0.00 0.00 37.83 32.99 1rm6 s LYS 301 CO 0.00 -0.25 1.19 0.42 -0.76 0.00 0.00 175.35 175.96 1rm6 s ILE 302 N -0.73 3.82 -0.24 2.17 1.01 -1.26 -0.20 121.20 125.77 1rm6 s ILE 302 Ca 0.52 1.41 0.07 0.00 0.00 0.00 0.00 60.65 62.66 1rm6 s ILE 302 Cb -0.40 -3.90 -0.20 0.00 0.01 0.00 0.00 42.46 37.97 1rm6 s ILE 302 CO 0.49 0.17 -0.11 0.00 0.00 0.00 0.00 174.94 175.49 1rm6 n ALA 303 N 3.21 1.45 -3.55 9.38 0.00 1.00 -4.45 120.51 127.55 1rm6 n ALA 303 Ca 0.07 -1.18 -0.07 0.00 0.00 0.00 0.00 53.44 52.26 1rm6 n ALA 303 Cb 0.46 -0.14 -0.02 0.00 0.00 0.00 0.00 19.45 19.74 1rm6 n ALA 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rm6 s ALA 304 N -2.51 -1.84 -0.01 0.00 0.00 -1.02 -4.08 121.76 112.30 1rm6 s ALA 304 Ca -0.26 0.94 0.00 0.00 0.00 0.00 0.00 51.96 52.64 1rm6 s ALA 304 Cb 0.08 0.39 0.01 0.00 0.00 0.00 0.00 23.12 23.60 1rm6 s ALA 304 CO 0.68 -0.74 0.00 -1.17 0.00 0.00 0.00 175.76 174.54 1rm6 s LEU 305 N -2.53 1.73 -0.03 0.00 2.96 -0.46 -1.06 118.68 119.29 1rm6 s LEU 305 Ca 0.07 0.00 0.00 0.00 -0.22 0.00 0.00 54.13 53.98 1rm6 s LEU 305 Cb -0.01 -0.04 0.03 0.00 0.50 0.00 0.00 46.19 46.66 1rm6 s LEU 305 CO -0.07 -0.03 -0.00 0.00 -1.32 0.00 0.00 176.35 174.93 1rm6 s ALA 306 N 0.31 0.35 0.05 5.97 0.00 -0.08 -0.58 121.76 127.76 1rm6 s ALA 306 Ca -0.03 0.14 0.01 0.00 0.00 0.00 0.00 51.96 52.08 1rm6 s ALA 306 Cb -0.04 -0.35 -0.03 0.00 0.00 0.00 0.00 23.12 22.70 1rm6 s ALA 306 CO -0.01 -0.10 -0.05 -0.48 0.00 0.00 0.00 175.76 175.13 1rm6 s LEU 307 N 1.08 2.35 -0.04 0.00 2.34 -0.34 -0.83 118.68 123.24 1rm6 s LEU 307 Ca -0.09 -0.72 0.04 0.00 0.06 0.00 0.00 54.13 53.42 1rm6 s LEU 307 Cb -0.13 0.02 -0.00 0.00 -0.56 0.00 0.00 46.19 45.52 1rm6 s LEU 307 CO -0.02 -0.38 -0.15 -1.61 -1.06 0.00 0.00 176.35 173.13 1rm6 s GLU 308 N -2.51 1.64 -0.05 1.48 2.02 -0.18 -1.82 118.70 119.29 1rm6 s GLU 308 Ca -0.04 -0.54 0.01 0.00 0.02 0.00 0.00 54.97 54.42 1rm6 s GLU 308 Cb -0.03 -1.43 0.02 0.00 0.10 0.00 0.00 34.13 32.79 1rm6 s GLU 308 CO -0.03 0.20 -0.06 0.00 0.02 0.00 0.00 175.26 175.39 1rm6 s ALA 309 N 0.12 0.79 -0.13 5.21 0.00 -0.49 -0.94 121.76 126.32 1rm6 s ALA 309 Ca -0.05 -0.13 0.03 0.00 0.00 0.00 0.00 51.96 51.81 1rm6 s ALA 309 Cb -0.11 -0.44 0.01 0.00 0.00 0.00 0.00 23.12 22.57 1rm6 s ALA 309 CO 0.02 0.03 -0.22 0.99 0.00 0.00 0.00 175.76 176.58 1rm6 s THR 310 N 0.83 2.04 -0.05 0.00 2.01 -0.37 -0.96 115.64 119.13 1rm6 s THR 310 Ca -0.12 -0.97 0.05 0.00 0.31 0.00 0.00 61.69 60.95 1rm6 s THR 310 Cb -0.15 -1.80 -0.02 0.00 0.01 0.00 0.00 72.50 70.55 1rm6 s THR 310 CO 0.01 0.55 -0.21 -1.10 -0.69 0.00 0.00 174.62 173.18 1rm6 s GLN 311 N 0.77 2.53 -0.50 4.92 -0.21 -0.13 -1.39 119.66 125.64 1rm6 s GLN 311 Ca -0.08 -0.83 -0.23 0.00 0.02 0.00 0.00 55.36 54.24 1rm6 s GLN 311 Cb -0.16 -2.25 0.04 0.00 1.00 0.00 0.00 33.01 31.64 1rm6 s GLN 311 CO -0.01 0.47 0.81 0.00 -2.12 0.00 0.00 175.29 174.44 1rm6 s ALA 312 N -0.37 3.26 -2.55 6.09 0.00 -0.52 -1.43 121.76 126.24 1rm6 s ALA 312 Ca 0.03 -1.25 0.25 0.00 0.00 0.00 0.00 51.96 50.98 1rm6 s ALA 312 Cb -0.12 -3.55 0.69 0.00 0.00 0.00 0.00 23.12 20.14 1rm6 s ALA 312 CO 0.02 -2.12 1.54 0.41 0.00 0.00 0.00 175.76 175.61 1rm6 n GLY 313 N 5.08 0.54 4.52 0.00 0.00 0.78 -4.07 105.19 112.03 1rm6 n GLY 313 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1rm6 n GLY 313 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rm6 n GLY 314 N 1.25 -2.15 0.06 -0.02 0.00 -1.26 -1.21 105.19 101.86 1rm6 n GLY 314 Ca 0.17 -1.58 0.12 0.00 0.00 0.00 0.00 46.02 44.74 1rm6 n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rm6 n ALA 315 N -0.11 2.82 -2.24 4.61 0.00 -0.26 -2.01 120.51 123.32 1rm6 n ALA 315 Ca 0.00 -0.20 -0.14 0.00 0.00 0.00 0.00 53.44 53.10 1rm6 n ALA 315 Cb 0.00 -1.25 -0.10 0.00 0.00 0.00 0.00 19.45 18.10 1rm6 n ALA 315 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1rm6 s TYR 316 N -3.13 1.21 0.03 0.00 1.51 -1.26 -4.93 117.35 110.79 1rm6 s TYR 316 Ca 0.08 -0.88 -0.26 0.00 -1.01 0.00 0.00 57.07 55.00 1rm6 s TYR 316 Cb 0.14 -0.66 -0.17 0.00 -0.11 0.00 0.00 41.96 41.15 1rm6 s TYR 316 CO 0.68 -0.06 1.42 0.00 -1.11 0.00 0.00 175.55 176.48 1rm6 h ALA 317 N 2.76 -0.37 -0.38 3.71 0.00 -1.91 -3.45 119.26 119.63 1rm6 h ALA 317 Ca -0.37 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1rm6 h ALA 317 Cb 1.19 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1rm6 h ALA 317 CO 0.64 -0.60 0.00 0.41 0.00 0.00 0.00 179.25 179.70 1rm6 n GLY 318 N -0.64 2.57 0.00 0.00 0.00 -1.26 -1.09 105.19 104.77 1rm6 n GLY 318 Ca -0.10 -0.13 0.15 0.00 0.00 0.00 0.00 46.02 45.94 1rm6 n GLY 318 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1rm6 n TYR 319 N 14.00 0.00 -0.32 1.61 4.02 -1.26 -4.39 117.16 130.81 1rm6 n TYR 319 Ca 0.00 0.00 0.18 0.00 -0.01 0.00 0.00 57.90 58.07 1rm6 n TYR 319 Cb 0.00 -0.24 0.36 0.00 -0.02 0.00 0.00 39.34 39.44 1rm6 n TYR 319 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1rm6 h GLY 320 N 4.96 1.53 1.02 2.72 0.00 -1.39 0.10 103.07 112.01 1rm6 h GLY 320 Ca 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.33 1rm6 h GLY 320 CO 0.00 -0.52 0.51 -2.22 0.00 0.00 0.00 176.54 174.31 1rm6 h ILE 321 N 0.09 1.25 -0.24 2.60 2.04 -1.80 -1.05 117.51 120.40 1rm6 h ILE 321 Ca 0.64 -0.56 -0.09 0.00 1.00 0.00 0.00 64.86 65.85 1rm6 h ILE 321 Cb 1.41 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 37.53 1rm6 h ILE 321 CO -0.79 0.26 -0.20 0.40 0.00 0.00 0.00 178.15 177.83 1rm6 h ILE 322 N 1.20 1.31 -0.83 -0.67 2.04 -1.20 -2.83 117.51 116.54 1rm6 h ILE 322 Ca 0.31 -1.34 0.02 0.00 1.00 0.00 0.00 64.86 64.85 1rm6 h ILE 322 Cb -0.02 1.65 -0.05 0.00 -0.74 0.00 0.00 36.82 37.66 1rm6 h ILE 322 CO -0.06 0.42 0.54 0.74 0.00 0.00 0.00 178.15 179.79 1rm6 h THR 323 N 0.26 1.17 -0.02 -0.27 2.02 -0.78 -0.93 112.91 114.37 1rm6 h THR 323 Ca 0.04 -0.37 -0.13 0.00 0.77 0.00 0.00 66.41 66.72 1rm6 h THR 323 Cb 0.74 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.13 1rm6 h THR 323 CO 0.05 0.20 -0.62 -0.29 0.37 0.00 0.00 175.52 175.23 1rm6 h ILE 324 N 1.08 1.43 -0.56 3.11 6.09 -1.22 -2.60 117.51 124.83 1rm6 h ILE 324 Ca 0.32 -2.08 -0.11 0.00 -1.37 0.00 0.00 64.86 61.62 1rm6 h ILE 324 Cb -0.06 2.11 -0.02 0.00 0.47 0.00 0.00 36.82 39.32 1rm6 h ILE 324 CO -0.09 0.60 -0.08 -0.07 -3.07 0.00 0.00 178.15 175.44 1rm6 h LEU 325 N 0.05 1.03 -2.43 2.19 3.38 -1.13 -2.78 115.31 115.61 1rm6 h LEU 325 Ca -0.01 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.63 1rm6 h LEU 325 Cb 1.10 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 1rm6 h LEU 325 CO 0.08 1.12 -0.02 1.88 0.09 0.00 0.00 178.44 181.59 1rm6 h TYR 326 N 0.93 0.00 0.00 1.13 0.99 -0.81 -1.98 116.97 117.22 1rm6 h TYR 326 Ca 0.15 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.87 1rm6 h TYR 326 Cb 0.64 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.37 1rm6 h TYR 326 CO 0.04 0.02 -0.03 1.79 -0.00 0.00 0.00 178.16 179.99 1rm6 h THR 327 N 0.00 0.26 0.00 -2.88 1.35 -1.29 -3.18 112.91 107.17 1rm6 h THR 327 Ca -0.00 -0.18 -0.01 0.00 -0.55 0.00 0.00 66.41 65.68 1rm6 h THR 327 Cb 0.16 1.13 -0.00 0.00 -1.73 0.00 0.00 68.15 67.71 1rm6 h THR 327 CO 0.00 0.03 -1.13 0.61 -0.25 0.00 0.00 175.52 174.78 1rm6 n GLY 328 N -0.93 -0.12 0.29 5.82 0.00 -0.93 -4.72 105.19 104.60 1rm6 n GLY 328 Ca -0.02 -0.06 0.03 0.00 0.00 0.00 0.00 46.02 45.96 1rm6 n GLY 328 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rm6 h ALA 329 N 0.23 1.60 -0.79 4.61 0.00 -1.35 -1.84 119.26 121.72 1rm6 h ALA 329 Ca -0.01 -0.09 -0.28 0.00 0.00 0.00 0.00 54.91 54.52 1rm6 h ALA 329 Cb 0.26 -0.15 -0.17 0.00 0.00 0.00 0.00 17.79 17.73 1rm6 h ALA 329 CO 0.00 0.32 0.36 1.28 0.00 0.00 0.00 179.25 181.21 1rm6 n LEU 330 N -4.40 6.19 0.04 0.00 4.32 -1.25 -3.31 117.00 118.59 1rm6 n LEU 330 Ca 0.02 -3.24 0.13 0.00 -0.02 0.00 0.00 56.01 52.90 1rm6 n LEU 330 Cb 0.13 -0.77 0.39 0.00 -1.62 0.00 0.00 43.42 41.56 1rm6 n LEU 330 CO 0.36 0.85 0.71 0.23 -1.22 0.00 0.00 177.39 178.32 1rm6 n MET 331 N -0.35 0.12 -4.00 3.23 2.81 -0.69 -4.84 117.12 113.40 1rm6 n MET 331 Ca 0.45 0.07 -0.23 0.00 -1.81 0.00 0.00 57.70 56.18 1rm6 n MET 331 Cb 1.44 -1.61 -0.03 0.00 -0.71 0.00 0.00 33.22 32.31 1rm6 n MET 331 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 1rm6 s HIS 332 N -3.06 3.37 0.00 2.03 3.76 -1.21 -4.69 115.29 115.50 1rm6 s HIS 332 Ca 0.11 0.00 0.00 0.00 -0.15 0.00 0.00 55.06 55.02 1rm6 s HIS 332 Cb 0.16 -1.56 0.00 0.00 1.11 0.00 0.00 32.58 32.29 1rm6 s HIS 332 CO 0.62 0.48 0.00 0.41 -0.85 0.00 0.00 174.74 175.40 1rm6 n GLY 333 N -1.03 0.80 0.79 -2.22 0.00 -1.26 -4.89 105.19 97.39 1rm6 n GLY 333 Ca -0.08 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.89 1rm6 n GLY 333 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1rm6 n LEU 334 N 0.00 0.98 -4.60 0.99 7.94 -1.26 -5.02 117.00 116.03 1rm6 n LEU 334 Ca 0.00 0.15 -0.25 0.00 -1.11 0.00 0.00 56.01 54.80 1rm6 n LEU 334 Cb 0.00 -0.34 -0.08 0.00 0.53 0.00 0.00 43.42 43.52 1rm6 n LEU 334 CO 0.00 -0.30 -0.38 -0.31 -1.11 0.00 0.00 177.39 175.29 1rm6 s TYR 335 N -2.19 2.64 -0.20 1.96 2.02 -1.26 -4.02 117.35 116.30 1rm6 s TYR 335 Ca -0.09 -0.23 -0.26 0.00 -0.37 0.00 0.00 57.07 56.12 1rm6 s TYR 335 Cb 0.02 -1.23 -0.01 0.00 -0.40 0.00 0.00 41.96 40.35 1rm6 s TYR 335 CO 0.12 0.58 0.90 -1.58 -1.57 0.00 0.00 175.55 173.99 1rm6 s HIS 336 N -2.04 3.38 -0.12 2.71 5.65 -0.50 -4.83 115.29 119.54 1rm6 s HIS 336 Ca 0.28 1.31 0.00 0.00 0.25 0.00 0.00 55.06 56.90 1rm6 s HIS 336 Cb -0.07 -3.11 0.02 0.00 -1.18 0.00 0.00 32.58 28.24 1rm6 s HIS 336 CO 0.17 -0.35 -0.10 0.42 -0.65 0.00 0.00 174.74 174.23 1rm6 s ILE 337 N 2.60 1.22 0.36 0.89 1.01 -1.26 -4.73 121.20 121.29 1rm6 s ILE 337 Ca 0.40 -0.43 0.07 0.00 0.00 0.00 0.00 60.65 60.69 1rm6 s ILE 337 Cb -0.16 -1.18 0.16 0.00 0.01 0.00 0.00 42.46 41.29 1rm6 s ILE 337 CO 0.10 0.40 1.90 -0.65 0.00 0.00 0.00 174.94 176.68 1rm6 h PRO 338 N 7.92 0.37 -2.91 2.79 0.11 -1.78 -3.44 132.00 135.06 1rm6 h PRO 338 Ca -0.32 -0.08 -0.14 0.00 0.11 0.00 0.00 66.00 65.57 1rm6 h PRO 338 Cb 1.14 -0.05 -0.25 0.00 0.11 0.00 0.00 31.00 31.95 1rm6 h PRO 338 CO 0.45 0.46 -0.32 0.00 -0.21 0.00 0.00 178.00 178.37 1rm6 s ALA 339 N -4.84 -0.84 -0.03 -0.75 0.00 -1.26 -4.60 121.76 109.44 1rm6 s ALA 339 Ca -0.06 0.98 0.00 0.00 0.00 0.00 0.00 51.96 52.88 1rm6 s ALA 339 Cb 0.15 -0.57 0.02 0.00 0.00 0.00 0.00 23.12 22.73 1rm6 s ALA 339 CO 0.75 -0.17 0.00 0.42 0.00 0.00 0.00 175.76 176.76 1rm6 s ILE 340 N 0.27 0.15 -0.12 0.00 1.01 -0.17 -1.35 121.20 120.98 1rm6 s ILE 340 Ca -0.01 0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.73 1rm6 s ILE 340 Cb -0.03 -0.24 -0.01 0.00 0.01 0.00 0.00 42.46 42.19 1rm6 s ILE 340 CO -0.00 0.13 -0.14 -0.75 0.00 0.00 0.00 174.94 174.17 1rm6 s LYS 341 N 0.92 3.33 -0.08 2.79 2.20 0.25 -0.45 119.74 128.71 1rm6 s LYS 341 Ca -0.09 -0.70 0.00 0.00 -0.36 0.00 0.00 55.97 54.82 1rm6 s LYS 341 Cb -0.12 -2.59 0.02 0.00 -1.51 0.00 0.00 37.83 33.62 1rm6 s LYS 341 CO -0.02 0.22 -0.06 -1.58 -0.36 0.00 0.00 175.35 173.55 1rm6 s HIS 342 N 0.32 1.16 -0.03 4.03 5.65 -0.37 -1.20 115.29 124.85 1rm6 s HIS 342 Ca -0.11 -0.47 0.03 0.00 0.25 0.00 0.00 55.06 54.76 1rm6 s HIS 342 Cb -0.16 -0.99 -0.00 0.00 -1.18 0.00 0.00 32.58 30.24 1rm6 s HIS 342 CO 0.06 -0.36 -0.13 -0.51 -0.65 0.00 0.00 174.74 173.15 1rm6 s ASP 343 N 1.39 1.65 0.04 9.88 1.01 -0.76 -0.53 116.67 129.35 1rm6 s ASP 343 Ca -0.02 -0.26 -0.19 0.00 0.71 0.00 0.00 52.55 52.78 1rm6 s ASP 343 Cb -0.13 -0.40 0.04 0.00 1.01 0.00 0.00 42.92 43.43 1rm6 s ASP 343 CO -0.04 0.12 0.44 0.00 0.21 0.00 0.00 175.17 175.90 1rm6 s ALA 344 N 0.04 -1.09 -0.05 5.23 0.00 -0.23 -1.39 121.76 124.28 1rm6 s ALA 344 Ca -0.02 0.39 -0.01 0.00 0.00 0.00 0.00 51.96 52.32 1rm6 s ALA 344 Cb -0.09 0.35 0.03 0.00 0.00 0.00 0.00 23.12 23.40 1rm6 s ALA 344 CO 0.01 -0.46 0.02 -1.58 0.00 0.00 0.00 175.76 173.74 1rm6 s TRP 345 N -2.44 0.37 -0.33 0.00 0.51 -0.13 -0.87 118.94 116.04 1rm6 s TRP 345 Ca -0.05 0.01 -0.10 0.00 -2.12 0.00 0.00 56.10 53.83 1rm6 s TRP 345 Cb -0.01 -0.56 0.00 0.00 -0.81 0.00 0.00 33.47 32.10 1rm6 s TRP 345 CO -0.02 -0.21 0.18 0.50 -0.51 0.00 0.00 176.95 176.89 1rm6 s ARG 346 N 1.62 3.19 -0.12 4.98 6.06 -0.18 -0.95 118.95 133.54 1rm6 s ARG 346 Ca -0.01 -0.83 -0.00 0.00 -2.50 0.00 0.00 55.73 52.39 1rm6 s ARG 346 Cb -0.13 -3.63 -0.02 0.00 0.06 0.00 0.00 34.95 31.23 1rm6 s ARG 346 CO -0.03 -0.51 -0.11 0.08 -2.50 0.00 0.00 175.30 172.23 1rm6 s VAL 347 N 1.60 3.27 0.34 7.11 1.01 -0.52 -0.59 120.40 132.63 1rm6 s VAL 347 Ca 0.04 -0.60 -0.28 0.00 0.00 0.00 0.00 61.98 61.15 1rm6 s VAL 347 Cb -0.18 -2.37 -0.09 0.00 0.00 0.00 0.00 36.38 33.74 1rm6 s VAL 347 CO 0.07 0.53 1.20 -0.31 0.00 0.00 0.00 175.10 176.59 1rm6 s TYR 348 N 0.13 3.19 0.04 5.22 2.02 0.77 -0.16 117.35 128.56 1rm6 s TYR 348 Ca -0.05 1.54 -0.01 0.00 -0.37 0.00 0.00 57.07 58.18 1rm6 s TYR 348 Cb -0.15 -3.48 -0.04 0.00 -0.40 0.00 0.00 41.96 37.90 1rm6 s TYR 348 CO 0.04 -1.32 -0.03 0.95 -1.57 0.00 0.00 175.55 173.62 1rm6 s THR 349 N -1.24 0.21 -1.47 -0.71 -4.23 -0.85 -4.78 115.64 102.57 1rm6 s THR 349 Ca 0.51 -1.59 -0.08 0.00 -1.18 0.00 0.00 61.69 59.34 1rm6 s THR 349 Cb -0.35 -1.22 0.02 0.00 1.34 0.00 0.00 72.50 72.30 1rm6 s THR 349 CO 0.45 -0.87 2.63 0.59 -0.54 0.00 0.00 174.62 176.87 1rm6 n ASN 350 N 0.47 8.06 -4.12 3.99 4.13 0.46 -1.72 115.26 126.53 1rm6 n ASN 350 Ca -0.16 -2.86 -0.10 0.00 1.68 0.00 0.00 54.58 53.14 1rm6 n ASN 350 Cb 0.60 -1.47 -0.10 0.00 -1.54 0.00 0.00 39.78 37.26 1rm6 n ASN 350 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1rm6 s THR 351 N 0.69 0.10 0.23 3.41 -4.23 -1.26 -4.49 115.64 110.09 1rm6 s THR 351 Ca 0.61 -1.84 -0.31 0.00 -1.18 0.00 0.00 61.69 58.97 1rm6 s THR 351 Cb 0.18 -2.02 -0.15 0.00 1.34 0.00 0.00 72.50 71.85 1rm6 s THR 351 CO -0.07 -0.44 1.13 -2.65 -0.54 0.00 0.00 174.62 172.05 1rm6 n PRO 352 N -0.11 1.36 -1.68 3.99 -0.02 -1.26 -1.10 135.00 136.18 1rm6 n PRO 352 Ca -0.06 0.48 -0.44 0.00 -2.02 0.00 0.00 63.50 61.46 1rm6 n PRO 352 Cb 0.64 -1.94 -0.02 0.00 -0.02 0.00 0.00 33.50 32.15 1rm6 n PRO 352 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1rm6 n PRO 353 N 1.36 2.08 -2.14 0.52 -0.02 -1.26 -4.37 135.00 131.18 1rm6 n PRO 353 Ca 0.12 0.74 -0.27 0.00 -2.02 0.00 0.00 63.50 62.08 1rm6 n PRO 353 Cb 0.29 -2.39 0.08 0.00 -0.02 0.00 0.00 33.50 31.46 1rm6 n PRO 353 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rm6 n GLY 355 N -3.06 3.17 3.73 0.00 0.00 0.10 -4.53 105.19 104.60 1rm6 n GLY 355 Ca 0.09 -0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 1rm6 n GLY 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rm6 s ALA 356 N -1.00 3.45 -0.01 4.61 0.00 -1.04 -4.48 121.76 123.29 1rm6 s ALA 356 Ca 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 51.96 51.87 1rm6 s ALA 356 Cb 0.00 -2.73 0.01 0.00 0.00 0.00 0.00 23.12 20.41 1rm6 s ALA 356 CO 0.00 0.00 0.02 1.41 0.00 0.00 0.00 175.76 177.19 1rm6 s MET 357 N 0.55 -0.01 0.00 0.00 0.00 -1.26 -3.59 119.30 114.98 1rm6 s MET 357 Ca 0.29 0.08 0.00 0.00 0.00 0.00 0.00 55.69 56.07 1rm6 s MET 357 Cb -0.16 -0.10 0.00 0.00 0.00 0.00 0.00 34.83 34.56 1rm6 s MET 357 CO 0.13 -0.07 0.00 -2.13 0.00 0.00 0.00 175.02 172.95 1rm6 n ARG 358 N 3.55 0.00 -0.26 4.11 0.63 -0.35 -0.88 116.66 123.46 1rm6 n ARG 358 Ca -0.19 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.74 1rm6 n ARG 358 Cb 0.56 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.47 1rm6 n ARG 358 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1rm6 n GLY 359 N 0.00 0.86 0.00 5.14 0.00 -1.26 -4.95 105.19 104.98 1rm6 n GLY 359 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1rm6 n GLY 359 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1rm6 n HIS 360 N -2.26 0.00 -0.25 1.61 -0.00 -0.06 -1.37 115.22 112.89 1rm6 n HIS 360 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1rm6 n HIS 360 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1rm6 n HIS 360 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1rm6 n GLY 361 N 0.00 1.55 0.01 1.57 0.00 -1.26 -4.78 105.19 102.28 1rm6 n GLY 361 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 1rm6 n GLY 361 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rm6 n THR 362 N -2.00 0.00 -0.03 2.61 -2.24 -0.47 -2.80 114.28 109.35 1rm6 n THR 362 Ca 0.00 -0.18 -0.13 0.00 -2.27 0.00 0.00 64.05 61.47 1rm6 n THR 362 Cb 0.00 1.01 -0.08 0.00 -2.10 0.00 0.00 70.33 69.16 1rm6 n THR 362 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1rm6 h VAL 363 N 0.07 1.31 -0.25 2.28 2.07 -1.86 -2.48 116.25 117.39 1rm6 h VAL 363 Ca 0.00 -1.01 -0.17 0.00 0.82 0.00 0.00 66.70 66.33 1rm6 h VAL 363 Cb 0.33 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.94 1rm6 h VAL 363 CO 0.00 0.28 -0.51 0.44 0.02 0.00 0.00 177.57 177.80 1rm6 h ASP 364 N -0.20 0.89 0.38 0.57 3.45 -1.93 -1.20 116.42 118.38 1rm6 h ASP 364 Ca 0.02 -0.54 -0.14 0.00 0.43 0.00 0.00 57.03 56.79 1rm6 h ASP 364 Cb 0.46 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 38.96 1rm6 h ASP 364 CO 0.01 1.27 -0.60 0.71 -1.57 0.00 0.00 179.24 179.06 1rm6 h THR 365 N 0.55 1.39 -0.46 0.35 1.35 -1.84 -1.72 112.91 112.53 1rm6 h THR 365 Ca 0.01 -1.97 -0.02 0.00 -0.55 0.00 0.00 66.41 63.87 1rm6 h THR 365 Cb 1.12 2.00 -0.02 0.00 -1.73 0.00 0.00 68.15 69.52 1rm6 h THR 365 CO 0.11 0.58 0.19 -0.09 -0.25 0.00 0.00 175.52 176.07 1rm6 h ARG 366 N 0.16 0.68 -0.53 4.72 9.65 -1.30 -0.95 114.38 126.81 1rm6 h ARG 366 Ca -0.01 -0.12 0.02 0.00 -1.10 0.00 0.00 59.98 58.78 1rm6 h ARG 366 Cb 1.09 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 29.53 1rm6 h ARG 366 CO 0.09 0.61 0.32 0.00 2.80 0.00 0.00 179.97 183.79 1rm6 h ALA 367 N 1.04 0.68 -0.41 2.80 0.00 -0.96 -1.07 119.26 121.34 1rm6 h ALA 367 Ca 0.15 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1rm6 h ALA 367 Cb 0.18 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1rm6 h ALA 367 CO -0.01 0.04 0.10 0.00 0.00 0.00 0.00 179.25 179.37 1rm6 h ALA 368 N 1.23 0.53 -0.19 0.00 0.00 -1.15 -1.39 119.26 118.30 1rm6 h ALA 368 Ca 0.21 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1rm6 h ALA 368 Cb 0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1rm6 h ALA 368 CO -0.09 0.21 0.12 0.35 0.00 0.00 0.00 179.25 179.84 1rm6 h PHE 369 N 0.51 0.23 -0.67 0.00 3.57 -0.88 -1.60 116.94 118.10 1rm6 h PHE 369 Ca 0.13 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 1rm6 h PHE 369 Cb 0.31 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.94 1rm6 h PHE 369 CO 0.02 0.14 0.26 0.93 -2.23 0.00 0.00 178.31 177.43 1rm6 h GLU 370 N 0.25 1.01 -0.22 1.11 4.39 -1.10 -0.27 114.58 119.74 1rm6 h GLU 370 Ca 0.07 -0.19 -0.03 0.00 0.34 0.00 0.00 59.36 59.55 1rm6 h GLU 370 Cb -0.03 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.45 1rm6 h GLU 370 CO -0.02 0.85 0.03 0.00 -1.16 0.00 0.00 179.01 178.71 1rm6 h ALA 371 N 1.11 0.29 -0.55 3.43 0.00 -1.11 -2.16 119.26 120.27 1rm6 h ALA 371 Ca 0.22 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1rm6 h ALA 371 Cb 0.22 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1rm6 h ALA 371 CO -0.02 -0.02 -0.04 1.25 0.00 0.00 0.00 179.25 180.42 1rm6 h LEU 372 N 0.16 0.95 -0.56 0.00 5.85 -1.11 -1.35 115.31 119.26 1rm6 h LEU 372 Ca 0.07 -0.28 0.05 0.00 0.84 0.00 0.00 57.88 58.56 1rm6 h LEU 372 Cb 0.33 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.06 1rm6 h LEU 372 CO 0.01 1.03 0.28 0.25 -0.34 0.00 0.00 178.44 179.67 1rm6 h LEU 373 N 0.88 0.40 -0.35 2.25 5.85 -0.94 0.89 115.31 124.31 1rm6 h LEU 373 Ca 0.15 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 1rm6 h LEU 373 Cb 0.57 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 1rm6 h LEU 373 CO 0.03 0.27 0.09 0.74 -0.34 0.00 0.00 178.44 179.23 1rm6 h THR 374 N 0.54 1.22 -0.81 1.05 2.02 -1.21 0.03 112.91 115.75 1rm6 h THR 374 Ca 0.25 -0.73 -0.01 0.00 0.77 0.00 0.00 66.41 66.69 1rm6 h THR 374 Cb 0.17 1.04 -0.04 0.00 -1.74 0.00 0.00 68.15 67.58 1rm6 h THR 374 CO -0.18 0.25 0.47 -0.08 0.37 0.00 0.00 175.52 176.35 1rm6 h GLU 375 N 0.41 1.11 -0.23 6.66 4.81 -0.69 -1.11 114.58 125.52 1rm6 h GLU 375 Ca 0.11 -0.11 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 1rm6 h GLU 375 Cb 0.29 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1rm6 h GLU 375 CO 0.00 0.79 -0.40 0.52 -0.73 0.00 0.00 179.01 179.19 1rm6 h MET 376 N 1.11 0.54 -0.74 1.92 2.86 -0.65 -2.62 114.93 117.35 1rm6 h MET 376 Ca 0.29 -0.27 0.01 0.00 -2.06 0.00 0.00 59.70 57.66 1rm6 h MET 376 Cb -0.01 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.61 1rm6 h MET 376 CO -0.05 0.85 0.49 0.78 1.06 0.00 0.00 176.91 180.04 1rm6 h GLY 377 N 1.07 1.04 0.80 8.32 0.00 -0.42 -1.44 103.07 112.44 1rm6 h GLY 377 Ca 0.04 -0.39 0.04 0.00 0.00 0.00 0.00 47.33 47.03 1rm6 h GLY 377 CO 0.08 0.38 0.47 -2.09 0.00 0.00 0.00 176.54 175.37 1rm6 h GLU 378 N 1.00 0.86 -0.19 4.80 4.81 -0.94 0.12 114.58 125.03 1rm6 h GLU 378 Ca 0.27 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.41 1rm6 h GLU 378 Cb -0.11 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.06 1rm6 h GLU 378 CO -0.06 0.57 -0.05 1.49 -0.73 0.00 0.00 179.01 180.23 1rm6 h GLU 379 N 0.89 0.29 -0.01 1.92 4.81 -0.94 -1.51 114.58 120.03 1rm6 h GLU 379 Ca 0.32 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1rm6 h GLU 379 Cb 0.08 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1rm6 h GLU 379 CO -0.14 0.35 -0.08 1.28 -0.73 0.00 0.00 179.01 179.70 1rm6 n LEU 380 N -4.33 0.75 -0.79 1.64 4.77 -0.46 -4.92 117.00 113.66 1rm6 n LEU 380 Ca -0.00 -0.17 -0.07 0.00 -0.03 0.00 0.00 56.01 55.73 1rm6 n LEU 380 Cb 0.22 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.21 1rm6 n LEU 380 CO 0.37 0.13 -0.09 0.61 -1.33 0.00 0.00 177.39 177.08 1rm6 n GLY 381 N 1.21 0.19 3.39 -0.72 0.00 -0.26 -5.03 105.19 103.98 1rm6 n GLY 381 Ca 0.17 -0.60 -0.33 0.00 0.00 0.00 0.00 46.02 45.26 1rm6 n GLY 381 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rm6 s ILE 382 N -2.35 3.29 0.39 -0.61 1.01 0.25 -5.00 121.20 118.17 1rm6 s ILE 382 Ca 0.00 -0.57 -0.26 0.00 0.00 0.00 0.00 60.65 59.82 1rm6 s ILE 382 Cb 0.00 -2.41 -0.11 0.00 0.01 0.00 0.00 42.46 39.95 1rm6 s ILE 382 CO 0.00 0.50 1.17 -0.67 0.00 0.00 0.00 174.94 175.94 1rm6 n ASP 383 N 3.71 2.07 0.24 3.58 2.03 -1.26 -3.79 116.55 123.13 1rm6 n ASP 383 Ca -0.18 1.12 0.09 0.00 0.52 0.00 0.00 54.79 56.34 1rm6 n ASP 383 Cb 0.52 -1.43 0.63 0.00 -0.72 0.00 0.00 41.12 40.12 1rm6 n ASP 383 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1rm6 h SER 384 N 2.01 0.00 0.23 1.67 4.64 -1.94 -1.00 113.55 119.17 1rm6 h SER 384 Ca -0.45 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.54 1rm6 h SER 384 Cb 1.31 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 63.44 1rm6 h SER 384 CO 0.60 0.16 -1.41 0.25 -0.87 0.00 0.00 176.83 175.56 1rm6 h LEU 385 N 0.00 0.85 -0.72 5.97 6.46 -1.94 -3.30 115.31 122.64 1rm6 h LEU 385 Ca -0.00 -0.87 -0.03 0.00 -0.12 0.00 0.00 57.88 56.85 1rm6 h LEU 385 Cb 0.34 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 39.97 1rm6 h LEU 385 CO 0.02 1.67 0.32 0.50 -0.62 0.00 0.00 178.44 180.33 1rm6 h LYS 386 N 0.19 1.05 0.00 1.25 1.63 -1.83 -2.06 116.57 116.80 1rm6 h LYS 386 Ca -0.23 -0.17 -0.02 0.00 -0.85 0.00 0.00 60.65 59.38 1rm6 h LYS 386 Cb 2.09 -0.18 -0.00 0.00 -0.60 0.00 0.00 32.23 33.54 1rm6 h LYS 386 CO 0.26 0.85 -0.07 0.97 -3.45 0.00 0.00 179.45 178.01 1rm6 h ILE 387 N 1.02 0.48 0.20 2.00 2.10 -1.30 -0.35 117.51 121.65 1rm6 h ILE 387 Ca 0.24 -0.36 -0.32 0.00 1.08 0.00 0.00 64.86 65.51 1rm6 h ILE 387 Cb 0.17 1.24 0.03 0.00 -1.09 0.00 0.00 36.82 37.17 1rm6 h ILE 387 CO -0.03 0.07 -1.36 0.03 -1.08 0.00 0.00 178.15 175.79 1rm6 h ARG 388 N 0.00 0.57 -0.94 2.19 3.08 -1.46 -3.07 114.38 114.74 1rm6 h ARG 388 Ca -0.00 -0.88 -0.01 0.00 0.07 0.00 0.00 59.98 59.17 1rm6 h ARG 388 Cb 0.24 0.31 -0.05 0.00 0.08 0.00 0.00 29.97 30.55 1rm6 h ARG 388 CO 0.01 1.41 0.57 1.96 -1.07 0.00 0.00 179.97 182.85 1rm6 h GLN 389 N 0.18 1.28 -0.19 0.04 4.20 -0.80 -1.57 115.11 118.25 1rm6 h GLN 389 Ca -0.23 -0.12 0.02 0.00 0.06 0.00 0.00 58.65 58.39 1rm6 h GLN 389 Cb 2.04 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 29.55 1rm6 h GLN 389 CO 0.26 0.89 0.13 0.82 -0.67 0.00 0.00 178.83 180.26 1rm6 h ILE 390 N 1.30 1.00 -0.61 2.54 2.04 -1.15 -3.03 117.51 119.60 1rm6 h ILE 390 Ca 0.34 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 66.14 1rm6 h ILE 390 Cb -0.05 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 1rm6 h ILE 390 CO -0.06 0.03 0.00 0.59 0.00 0.00 0.00 178.15 178.71 1rm6 n ASN 391 N -4.51 4.59 -4.75 1.72 3.02 -0.60 -4.94 115.26 109.80 1rm6 n ASN 391 Ca 0.00 -2.44 -0.32 0.00 -0.03 0.00 0.00 54.58 51.79 1rm6 n ASN 391 Cb 0.14 -0.55 0.09 0.00 -0.61 0.00 0.00 39.78 38.85 1rm6 n ASN 391 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1rm6 s MET 392 N -1.83 2.19 0.20 3.52 -1.94 -1.13 -1.40 119.30 118.90 1rm6 s MET 392 Ca 0.49 1.34 -0.32 0.00 -1.71 0.00 0.00 55.69 55.49 1rm6 s MET 392 Cb 0.32 -1.88 -0.13 0.00 2.01 0.00 0.00 34.83 35.14 1rm6 s MET 392 CO 0.23 -1.72 1.52 1.28 -0.01 0.00 0.00 175.02 176.32 1rm6 n LEU 393 N -3.28 3.23 0.21 -0.03 4.77 -1.26 -4.33 117.00 116.31 1rm6 n LEU 393 Ca 0.10 1.11 0.08 0.00 -0.03 0.00 0.00 56.01 57.27 1rm6 n LEU 393 Cb 0.52 -1.45 0.44 0.00 -2.33 0.00 0.00 43.42 40.60 1rm6 n LEU 393 CO 0.51 -0.31 0.77 1.55 -1.33 0.00 0.00 177.39 178.57 1rm6 h PRO 394 N 5.21 0.00 -3.02 3.23 0.13 -1.98 -3.46 132.00 132.12 1rm6 h PRO 394 Ca -0.45 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.63 1rm6 h PRO 394 Cb 1.26 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.24 1rm6 h PRO 394 CO 0.83 0.29 0.03 1.14 -0.23 0.00 0.00 178.00 180.06 1rm6 s GLN 395 N -3.76 1.09 -0.03 0.86 0.00 -1.26 -5.16 119.66 111.39 1rm6 s GLN 395 Ca -0.00 -0.43 0.02 0.00 -0.00 0.00 0.00 55.36 54.95 1rm6 s GLN 395 Cb 0.11 0.49 0.01 0.00 0.00 0.00 0.00 33.01 33.62 1rm6 s GLN 395 CO 0.66 -0.42 -0.08 0.42 0.00 0.00 0.00 175.29 175.87 1rm6 s ILE 396 N -3.11 0.75 0.71 3.63 -1.09 -1.26 -3.91 121.20 116.92 1rm6 s ILE 396 Ca -0.02 -0.31 -0.16 0.00 -2.23 0.00 0.00 60.65 57.94 1rm6 s ILE 396 Cb 0.00 -0.69 0.03 0.00 -1.58 0.00 0.00 42.46 40.22 1rm6 s ILE 396 CO -0.07 0.25 1.23 -2.84 -1.23 0.00 0.00 174.94 172.28 1rm6 s PRO 397 N 0.43 2.22 -0.08 2.79 0.02 -1.26 -5.08 135.00 134.04 1rm6 s PRO 397 Ca -0.07 1.85 0.00 0.00 0.02 0.00 0.00 61.00 62.80 1rm6 s PRO 397 Cb -0.11 -1.83 0.02 0.00 0.02 0.00 0.00 34.50 32.60 1rm6 s PRO 397 CO 0.01 -1.79 -0.06 -0.47 -0.33 0.00 0.00 177.00 174.35 1rm6 s TYR 398 N -1.82 1.13 -0.26 6.54 5.04 -0.72 -4.99 117.35 122.26 1rm6 s TYR 398 Ca 0.77 -0.44 -0.09 0.00 -2.44 0.00 0.00 57.07 54.86 1rm6 s TYR 398 Cb -0.31 -0.96 -0.04 0.00 0.35 0.00 0.00 41.96 41.00 1rm6 s TYR 398 CO 0.44 -0.34 0.12 0.08 -1.34 0.00 0.00 175.55 174.51 1rm6 s VAL 399 N 1.30 4.79 0.85 3.14 1.01 -1.26 -0.88 120.40 129.35 1rm6 s VAL 399 Ca -0.04 -0.01 -0.12 0.00 0.00 0.00 0.00 61.98 61.81 1rm6 s VAL 399 Cb -0.14 -3.25 0.10 0.00 0.00 0.00 0.00 36.38 33.09 1rm6 s VAL 399 CO -0.03 0.31 1.12 0.42 0.00 0.00 0.00 175.10 176.93 1rm6 s THR 400 N 1.54 2.49 0.06 3.92 -4.23 -0.30 -4.91 115.64 114.22 1rm6 s THR 400 Ca 0.06 0.16 0.33 0.00 -1.18 0.00 0.00 61.69 61.06 1rm6 s THR 400 Cb -0.15 -2.94 0.37 0.00 1.34 0.00 0.00 72.50 71.12 1rm6 s THR 400 CO 0.06 -0.21 1.98 0.24 -0.54 0.00 0.00 174.62 176.15 1rm6 h MET 401 N -1.26 0.00 -0.01 3.99 2.86 -1.95 -1.19 114.93 117.38 1rm6 h MET 401 Ca -0.48 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 1rm6 h MET 401 Cb 1.30 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.96 1rm6 h MET 401 CO 0.61 0.00 -0.09 0.98 1.06 0.00 0.00 176.91 179.47 1rm6 n TYR 402 N -2.92 0.00 -0.88 -0.22 4.19 -1.26 -4.93 117.16 111.14 1rm6 n TYR 402 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 1rm6 n TYR 402 Cb 0.26 -0.10 0.00 0.00 0.49 0.00 0.00 39.34 39.98 1rm6 n TYR 402 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1rm6 n ALA 403 N -0.64 0.00 -1.85 2.98 0.00 -0.45 -4.64 120.51 115.92 1rm6 n ALA 403 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.24 1rm6 n ALA 403 Cb 0.28 -0.36 -0.06 0.00 0.00 0.00 0.00 19.45 19.31 1rm6 n ALA 403 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1rm6 s GLN 404 N -1.45 4.46 -0.36 0.00 -0.21 -1.26 -4.37 119.66 116.48 1rm6 s GLN 404 Ca 0.00 1.20 -0.04 0.00 0.02 0.00 0.00 55.36 56.54 1rm6 s GLN 404 Cb 0.00 -2.71 0.07 0.00 1.00 0.00 0.00 33.01 31.37 1rm6 s GLN 404 CO 0.00 0.25 0.12 1.03 -2.12 0.00 0.00 175.29 174.57 1rm6 s ARG 405 N -2.23 2.37 -0.37 2.91 0.52 -1.26 -1.15 118.95 119.74 1rm6 s ARG 405 Ca 0.51 -1.43 -0.22 0.00 -0.52 0.00 0.00 55.73 54.06 1rm6 s ARG 405 Cb -0.17 -3.44 0.01 0.00 0.52 0.00 0.00 34.95 31.87 1rm6 s ARG 405 CO 0.22 -0.81 0.72 0.08 0.02 0.00 0.00 175.30 175.53 1rm6 s VAL 406 N 1.28 4.79 -1.22 3.52 1.01 -0.06 -4.75 120.40 124.96 1rm6 s VAL 406 Ca 0.01 0.69 0.17 0.00 0.00 0.00 0.00 61.98 62.85 1rm6 s VAL 406 Cb -0.21 -4.17 -0.08 0.00 0.00 0.00 0.00 36.38 31.92 1rm6 s VAL 406 CO -0.01 -0.42 0.81 0.23 0.00 0.00 0.00 175.10 175.71 1rm6 n MET 407 N 6.30 1.60 -3.71 2.72 0.00 -1.26 -1.76 117.12 121.01 1rm6 n MET 407 Ca 0.01 -0.47 -0.14 0.00 0.00 0.00 0.00 57.70 57.10 1rm6 n MET 407 Cb 0.48 -1.29 -0.09 0.00 0.00 0.00 0.00 33.22 32.32 1rm6 n MET 407 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 1rm6 s SER 408 N -2.24 -0.44 -0.28 7.83 1.04 -1.26 -4.67 113.70 113.68 1rm6 s SER 408 Ca 0.11 0.78 0.01 0.00 0.48 0.00 0.00 55.95 57.33 1rm6 s SER 408 Cb 0.13 0.82 0.16 0.00 0.10 0.00 0.00 66.02 67.23 1rm6 s SER 408 CO 0.54 -0.22 0.45 -0.47 0.98 0.00 0.00 173.24 174.52 1rm6 s TYR 409 N -0.06 -1.18 -1.72 5.02 5.04 -1.26 -4.77 117.35 118.42 1rm6 s TYR 409 Ca -0.03 0.74 0.19 0.00 -2.44 0.00 0.00 57.07 55.54 1rm6 s TYR 409 Cb -0.03 0.05 0.60 0.00 0.35 0.00 0.00 41.96 42.93 1rm6 s TYR 409 CO 0.02 -0.92 1.50 0.41 -1.34 0.00 0.00 175.55 175.22 1rm6 n GLY 410 N 5.38 2.20 0.30 8.97 0.00 -1.26 -4.58 105.19 116.19 1rm6 n GLY 410 Ca 0.00 -0.73 0.05 0.00 0.00 0.00 0.00 46.02 45.34 1rm6 n GLY 410 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1rm6 h VAL 411 N 3.79 0.82 -0.63 1.61 2.07 -1.96 -0.08 116.25 121.87 1rm6 h VAL 411 Ca 0.00 -0.23 0.06 0.00 0.82 0.00 0.00 66.70 67.34 1rm6 h VAL 411 Cb 1.03 0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 1rm6 h VAL 411 CO 0.07 0.12 0.34 -0.65 0.02 0.00 0.00 177.57 177.48 1rm6 h PRO 412 N 0.68 0.61 -0.33 1.57 0.11 -2.00 -0.48 132.00 132.16 1rm6 h PRO 412 Ca 0.42 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 66.35 1rm6 h PRO 412 Cb 0.50 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.46 1rm6 h PRO 412 CO -0.30 0.41 -0.38 1.49 -0.21 0.00 0.00 178.00 179.00 1rm6 h GLU 413 N 0.63 0.77 -0.48 1.05 4.81 -1.73 -2.10 114.58 117.53 1rm6 h GLU 413 Ca 0.28 -0.39 0.04 0.00 -0.13 0.00 0.00 59.36 59.16 1rm6 h GLU 413 Cb 0.19 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.53 1rm6 h GLU 413 CO -0.18 1.02 0.24 0.00 -0.73 0.00 0.00 179.01 179.35 1rm6 h LEU 415 N 0.46 0.88 -0.68 0.00 3.38 -0.98 -1.85 115.31 116.53 1rm6 h LEU 415 Ca 0.21 -0.30 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 1rm6 h LEU 415 Cb 0.13 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 1rm6 h LEU 415 CO -0.15 0.96 0.09 -0.33 0.09 0.00 0.00 178.44 179.09 1rm6 h GLU 416 N 0.78 1.10 -0.29 1.13 4.39 -1.11 -0.84 114.58 119.74 1rm6 h GLU 416 Ca 0.15 -0.31 -0.11 0.00 0.34 0.00 0.00 59.36 59.44 1rm6 h GLU 416 Cb 0.49 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 1rm6 h GLU 416 CO 0.02 1.02 -0.24 0.87 -1.16 0.00 0.00 179.01 179.53 1rm6 h LYS 417 N 1.03 0.68 0.00 2.33 1.79 -0.83 -2.22 116.57 119.34 1rm6 h LYS 417 Ca 0.20 -0.34 -0.09 0.00 -2.18 0.00 0.00 60.65 58.24 1rm6 h LYS 417 Cb 0.47 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.11 1rm6 h LYS 417 CO 0.02 0.94 -0.43 -0.39 -1.08 0.00 0.00 179.45 178.51 1rm6 h VAL 418 N 0.43 0.88 -0.42 0.50 -1.51 -1.29 -1.15 116.25 113.69 1rm6 h VAL 418 Ca 0.05 -1.80 -0.01 0.00 -1.23 0.00 0.00 66.70 63.71 1rm6 h VAL 418 Cb 0.79 2.12 -0.02 0.00 -2.13 0.00 0.00 31.29 32.05 1rm6 h VAL 418 CO 0.06 0.42 0.21 0.50 -1.23 0.00 0.00 177.57 177.53 1rm6 h LYS 419 N 0.00 0.61 -0.11 5.19 3.64 -1.01 -2.01 116.57 122.89 1rm6 h LYS 419 Ca -0.00 -0.09 -0.08 0.00 -1.27 0.00 0.00 60.65 59.21 1rm6 h LYS 419 Cb 1.08 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 1rm6 h LYS 419 CO 0.06 0.52 -0.23 0.00 -2.27 0.00 0.00 179.45 177.52 1rm6 h ALA 420 N 1.06 0.17 -0.56 5.00 0.00 -1.26 -2.40 119.26 121.27 1rm6 h ALA 420 Ca 0.15 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1rm6 h ALA 420 Cb 0.11 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1rm6 h ALA 420 CO -0.02 0.14 0.29 0.00 0.00 0.00 0.00 179.25 179.66 1rm6 h ALA 421 N 0.51 1.46 -0.00 0.00 0.00 -1.14 -2.23 119.26 117.85 1rm6 h ALA 421 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1rm6 h ALA 421 Cb 0.83 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1rm6 h ALA 421 CO 0.05 0.44 -0.26 -1.13 0.00 0.00 0.00 179.25 178.35 1rm6 n SER 422 N -4.38 0.42 -2.01 0.00 3.41 -0.76 -4.93 113.62 105.37 1rm6 n SER 422 Ca 0.05 -0.20 -0.15 0.00 -0.26 0.00 0.00 58.87 58.31 1rm6 n SER 422 Cb 0.11 -0.02 0.01 0.00 -0.26 0.00 0.00 64.21 64.05 1rm6 n SER 422 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rm6 n GLY 423 N 1.43 -0.19 0.32 5.00 0.00 -0.84 -4.89 105.19 106.03 1rm6 n GLY 423 Ca 0.09 -0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 1rm6 n GLY 423 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1rm6 h TRP 424 N -0.64 -0.84 -0.95 1.61 2.91 -1.70 0.08 115.95 116.42 1rm6 h TRP 424 Ca -0.37 0.04 0.06 0.00 1.13 0.00 0.00 58.89 59.76 1rm6 h TRP 424 Cb 1.26 0.40 -0.06 0.00 -0.51 0.00 0.00 29.16 30.25 1rm6 h TRP 424 CO 0.38 -0.38 0.61 1.49 -1.03 0.00 0.00 178.44 179.51 1rm6 h GLU 425 N -0.33 1.09 0.00 2.65 4.81 -1.92 0.18 114.58 121.06 1rm6 h GLU 425 Ca 0.12 -0.07 -0.07 0.00 -0.13 0.00 0.00 59.36 59.21 1rm6 h GLU 425 Cb 0.53 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 1rm6 h GLU 425 CO -0.41 0.72 -0.48 0.93 -0.73 0.00 0.00 179.01 179.04 1rm6 h GLU 426 N 1.12 0.00 0.00 1.92 4.39 -1.86 -3.40 114.58 116.75 1rm6 h GLU 426 Ca 0.41 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.97 1rm6 h GLU 426 Cb 0.14 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 1rm6 h GLU 426 CO -0.16 0.31 -1.56 0.54 -1.16 0.00 0.00 179.01 176.97 1rm6 n ARG 427 N -3.12 2.22 -1.69 2.33 1.74 -0.02 -4.80 116.66 113.32 1rm6 n ARG 427 Ca 0.01 -0.02 -0.43 0.00 -0.77 0.00 0.00 57.85 56.64 1rm6 n ARG 427 Cb 0.67 -1.22 -0.03 0.00 -1.02 0.00 0.00 32.46 30.86 1rm6 n ARG 427 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1rm6 n LYS 428 N -2.24 2.65 -1.00 5.56 3.00 0.60 -0.67 118.16 126.06 1rm6 n LYS 428 Ca -0.12 0.96 0.00 0.00 -0.00 0.00 0.00 58.31 59.15 1rm6 n LYS 428 Cb 0.69 -2.84 0.00 0.00 0.00 0.00 0.00 35.03 32.88 1rm6 n LYS 428 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1rm6 n GLY 429 N 4.17 0.83 1.77 3.14 0.00 -1.26 -4.88 105.19 108.97 1rm6 n GLY 429 Ca 0.19 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.17 1rm6 n GLY 429 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rm6 n LYS 430 N -2.34 1.78 -3.90 1.61 5.02 0.15 -5.08 118.16 115.39 1rm6 n LYS 430 Ca 0.00 -3.27 -0.21 0.00 -2.02 0.00 0.00 58.31 52.81 1rm6 n LYS 430 Cb 0.00 -1.40 -0.02 0.00 -0.02 0.00 0.00 35.03 33.59 1rm6 n LYS 430 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1rm6 s LEU 431 N -2.71 4.19 0.86 -0.35 1.43 -1.23 -4.93 118.68 115.94 1rm6 s LEU 431 Ca 0.38 -0.02 -0.11 0.00 -1.03 0.00 0.00 54.13 53.35 1rm6 s LEU 431 Cb 0.37 -2.77 0.11 0.00 0.03 0.00 0.00 46.19 43.93 1rm6 s LEU 431 CO -0.06 -0.13 1.14 -2.16 0.23 0.00 0.00 176.35 175.37 1rm6 s PRO 432 N -4.00 1.46 0.22 1.29 0.04 -1.26 -4.86 135.00 127.89 1rm6 s PRO 432 Ca 0.36 1.47 -0.32 0.00 0.04 0.00 0.00 61.00 62.55 1rm6 s PRO 432 Cb -0.09 -1.78 -0.13 0.00 0.04 0.00 0.00 34.50 32.53 1rm6 s PRO 432 CO 0.29 -2.29 1.47 1.17 0.04 0.00 0.00 177.00 177.67 1rm6 n LYS 433 N -3.89 2.11 -0.19 4.56 4.81 -1.26 -1.99 118.16 122.30 1rm6 n LYS 433 Ca 0.11 0.75 0.00 0.00 -0.87 0.00 0.00 58.31 58.31 1rm6 n LYS 433 Cb 0.52 -2.45 0.00 0.00 0.02 0.00 0.00 35.03 33.12 1rm6 n LYS 433 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1rm6 n GLY 434 N 2.49 0.71 3.39 3.14 0.00 -1.12 -5.03 105.19 108.77 1rm6 n GLY 434 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 1rm6 n GLY 434 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rm6 s ARG 435 N -0.72 1.43 0.21 1.61 0.52 -0.84 -1.59 118.95 119.57 1rm6 s ARG 435 Ca 0.00 -1.43 -0.15 0.00 -0.52 0.00 0.00 55.73 53.63 1rm6 s ARG 435 Cb 0.00 -1.78 0.01 0.00 0.52 0.00 0.00 34.95 33.71 1rm6 s ARG 435 CO 0.00 0.40 0.49 0.20 0.02 0.00 0.00 175.30 176.41 1rm6 s GLY 436 N -2.42 0.14 0.02 -3.53 0.00 -0.11 -3.65 107.32 97.77 1rm6 s GLY 436 Ca 0.17 -0.48 0.05 0.00 0.00 0.00 0.00 44.72 44.46 1rm6 s GLY 436 CO 0.08 -0.42 -0.15 1.08 0.00 0.00 0.00 173.10 173.68 1rm6 s LEU 437 N -2.92 2.10 0.04 0.66 1.43 -1.26 -1.63 118.68 117.10 1rm6 s LEU 437 Ca 0.14 -0.37 -0.00 0.00 -1.03 0.00 0.00 54.13 52.86 1rm6 s LEU 437 Cb -0.01 -0.72 -0.03 0.00 0.03 0.00 0.00 46.19 45.46 1rm6 s LEU 437 CO 0.01 0.12 -0.03 -0.83 0.23 0.00 0.00 176.35 175.85 1rm6 s GLY 438 N -0.76 0.36 0.04 -3.19 0.00 -0.39 -3.86 107.32 99.52 1rm6 s GLY 438 Ca 0.04 -0.85 0.05 0.00 0.00 0.00 0.00 44.72 43.96 1rm6 s GLY 438 CO 0.00 -0.94 -0.14 -1.50 0.00 0.00 0.00 173.10 170.52 1rm6 s ILE 439 N -2.43 1.13 0.10 0.90 1.10 -1.26 -0.66 121.20 120.08 1rm6 s ILE 439 Ca -0.06 -1.06 -0.22 0.00 -0.51 0.00 0.00 60.65 58.80 1rm6 s ILE 439 Cb -0.03 -1.03 0.06 0.00 0.15 0.00 0.00 42.46 41.61 1rm6 s ILE 439 CO -0.04 -0.03 0.55 0.00 -2.11 0.00 0.00 174.94 173.30 1rm6 s ALA 440 N -0.92 -1.41 0.19 1.50 0.00 -0.52 -4.41 121.76 116.19 1rm6 s ALA 440 Ca 0.01 0.50 0.09 0.00 0.00 0.00 0.00 51.96 52.56 1rm6 s ALA 440 Cb -0.08 0.62 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 1rm6 s ALA 440 CO 0.01 -0.63 -0.07 -0.51 0.00 0.00 0.00 175.76 174.56 1rm6 s LEU 441 N -2.39 3.06 0.18 0.00 1.43 -1.26 -1.43 118.68 118.28 1rm6 s LEU 441 Ca -0.02 -0.55 -0.19 0.00 -1.03 0.00 0.00 54.13 52.34 1rm6 s LEU 441 Cb -0.00 -1.72 0.04 0.00 0.03 0.00 0.00 46.19 44.54 1rm6 s LEU 441 CO -0.07 0.09 0.55 -0.94 0.23 0.00 0.00 176.35 176.21 1rm6 s SER 442 N -2.94 -0.36 0.17 2.29 1.04 -0.59 -4.54 113.70 108.77 1rm6 s SER 442 Ca 0.26 -0.31 -0.17 0.00 0.48 0.00 0.00 55.95 56.21 1rm6 s SER 442 Cb -0.09 0.59 0.03 0.00 0.10 0.00 0.00 66.02 66.65 1rm6 s SER 442 CO 0.16 -1.03 0.47 -1.38 0.98 0.00 0.00 173.24 172.45 1rm6 s HIS 443 N -3.83 -0.15 0.16 5.02 -3.43 -1.15 -1.15 115.29 110.76 1rm6 s HIS 443 Ca 0.06 -0.17 -0.13 0.00 -0.80 0.00 0.00 55.06 54.02 1rm6 s HIS 443 Cb -0.01 0.33 0.01 0.00 -1.43 0.00 0.00 32.58 31.48 1rm6 s HIS 443 CO -0.07 -0.83 0.37 0.12 -2.00 0.00 0.00 174.74 172.34 1rm6 s PHE 444 N -3.84 0.10 0.63 0.38 5.36 -0.75 -4.70 117.98 115.15 1rm6 s PHE 444 Ca 0.07 -0.46 -0.13 0.00 -0.96 0.00 0.00 56.93 55.44 1rm6 s PHE 444 Cb 0.00 0.14 -0.02 0.00 -0.34 0.00 0.00 43.02 42.80 1rm6 s PHE 444 CO -0.07 -0.76 1.05 0.14 -1.46 0.00 0.00 175.22 174.13 1rm6 s VAL 445 N -3.90 4.02 -0.89 3.12 -7.23 -1.26 -1.33 120.40 112.93 1rm6 s VAL 445 Ca 0.11 0.81 -0.00 0.00 -1.81 0.00 0.00 61.98 61.08 1rm6 s VAL 445 Cb 0.02 -3.45 0.34 0.00 0.56 0.00 0.00 36.38 33.85 1rm6 s VAL 445 CO -0.04 -0.71 1.78 -1.20 -0.31 0.00 0.00 175.10 174.62 1rm6 n SER 446 N -2.49 7.02 0.00 4.85 7.64 -0.03 -4.61 113.62 126.00 1rm6 n SER 446 Ca 0.08 -3.75 0.00 0.00 1.01 0.00 0.00 58.87 56.21 1rm6 n SER 446 Cb 0.53 -1.04 0.00 0.00 -1.01 0.00 0.00 64.21 62.69 1rm6 n SER 446 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rm6 n GLY 447 N -0.27 1.85 3.69 0.23 0.00 0.59 -4.47 105.19 106.80 1rm6 n GLY 447 Ca 0.48 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 44.57 1rm6 n GLY 447 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rm6 s THR 448 N -0.73 4.18 -1.51 2.61 2.01 -1.26 -4.33 115.64 116.60 1rm6 s THR 448 Ca 0.00 1.51 0.19 0.00 0.31 0.00 0.00 61.69 63.70 1rm6 s THR 448 Cb 0.00 -3.97 0.36 0.00 0.01 0.00 0.00 72.50 68.90 1rm6 s THR 448 CO 0.00 -0.00 1.58 -1.54 -0.69 0.00 0.00 174.62 173.96 1rm6 n SER 449 N 5.23 0.00 -4.20 3.53 3.41 -1.01 -4.58 113.62 116.00 1rm6 n SER 449 Ca 0.11 -0.07 -0.33 0.00 -0.26 0.00 0.00 58.87 58.32 1rm6 n SER 449 Cb 0.46 -0.24 -0.16 0.00 -0.26 0.00 0.00 64.21 64.00 1rm6 n SER 449 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1rm6 s THR 450 N -2.49 2.24 0.73 6.66 2.01 -1.26 -4.74 115.64 118.79 1rm6 s THR 450 Ca 0.19 -0.92 -0.12 0.00 0.31 0.00 0.00 61.69 61.16 1rm6 s THR 450 Cb 0.13 -1.91 0.04 0.00 0.01 0.00 0.00 72.50 70.76 1rm6 s THR 450 CO 0.28 0.54 1.09 -2.84 -0.69 0.00 0.00 174.62 173.00 1rm6 s PRO 451 N 0.81 2.47 0.27 4.92 0.02 -1.26 -4.95 135.00 137.28 1rm6 s PRO 451 Ca -0.07 1.22 0.05 0.00 0.02 0.00 0.00 61.00 62.22 1rm6 s PRO 451 Cb -0.15 -1.92 0.38 0.00 0.02 0.00 0.00 34.50 32.82 1rm6 s PRO 451 CO -0.01 -1.48 1.66 0.87 -0.33 0.00 0.00 177.00 177.70 1rm6 h LYS 452 N -0.75 0.30 -4.99 5.54 1.57 -1.96 -3.41 116.57 112.87 1rm6 h LYS 452 Ca -0.44 -0.15 -0.65 0.00 -1.87 0.00 0.00 60.65 57.53 1rm6 h LYS 452 Cb 1.23 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 33.29 1rm6 h LYS 452 CO 0.53 0.69 -0.68 -1.01 -0.57 0.00 0.00 179.45 178.40 1rm6 s HIS 453 N -4.10 3.01 -1.24 -1.35 3.76 -1.26 -4.77 115.29 109.34 1rm6 s HIS 453 Ca -0.05 -0.70 -0.14 0.00 -0.15 0.00 0.00 55.06 54.02 1rm6 s HIS 453 Cb 0.13 -2.16 0.15 0.00 1.11 0.00 0.00 32.58 31.82 1rm6 s HIS 453 CO 0.78 -0.45 1.56 0.91 -0.85 0.00 0.00 174.74 176.69 1rm6 n TRP 454 N 4.81 4.64 1.10 1.40 8.01 -1.26 -4.67 117.44 131.46 1rm6 n TRP 454 Ca -0.17 -3.20 0.12 0.00 -1.31 0.00 0.00 57.50 52.94 1rm6 n TRP 454 Cb 0.51 -2.24 0.15 0.00 -2.01 0.00 0.00 31.31 27.72 1rm6 n TRP 454 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.69 176.93 1rm6 n THR 455 N 4.73 0.00 -1.16 -0.99 -2.24 -1.26 -4.96 114.28 108.40 1rm6 n THR 455 Ca 0.40 -0.29 -0.06 0.00 -2.27 0.00 0.00 64.05 61.83 1rm6 n THR 455 Cb 0.42 1.08 -0.02 0.00 -2.10 0.00 0.00 70.33 69.71 1rm6 n THR 455 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rm6 n GLY 456 N 1.36 0.77 3.93 3.38 0.00 -1.26 -5.01 105.19 108.36 1rm6 n GLY 456 Ca 0.12 -0.36 -0.25 0.00 0.00 0.00 0.00 46.02 45.53 1rm6 n GLY 456 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rm6 s GLU 457 N -2.02 2.98 0.87 1.61 2.02 -1.26 -5.04 118.70 117.85 1rm6 s GLU 457 Ca 0.00 -0.17 -0.11 0.00 0.02 0.00 0.00 54.97 54.71 1rm6 s GLU 457 Cb 0.00 -2.37 0.12 0.00 0.10 0.00 0.00 34.13 31.98 1rm6 s GLU 457 CO 0.00 -0.54 1.15 -1.25 0.02 0.00 0.00 175.26 174.64 1rm6 s PRO 458 N -4.84 1.35 0.13 0.39 0.04 -1.26 -4.90 135.00 125.92 1rm6 s PRO 458 Ca 0.52 1.53 0.27 0.00 0.04 0.00 0.00 61.00 63.36 1rm6 s PRO 458 Cb -0.10 -1.77 0.89 0.00 0.04 0.00 0.00 34.50 33.56 1rm6 s PRO 458 CO 0.43 -2.38 1.78 0.72 0.04 0.00 0.00 177.00 177.58 1rm6 n HIS 459 N -3.92 0.60 -3.56 0.56 8.25 0.48 -4.82 115.22 112.81 1rm6 n HIS 459 Ca 0.12 0.17 -0.16 0.00 -0.26 0.00 0.00 57.72 57.59 1rm6 n HIS 459 Cb 0.52 -0.77 -0.06 0.00 1.12 0.00 0.00 29.99 30.80 1rm6 n HIS 459 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1rm6 s ALA 460 N -3.07 -1.79 -0.06 -1.41 0.00 -0.89 -4.65 121.76 109.89 1rm6 s ALA 460 Ca 0.11 1.59 -0.02 0.00 0.00 0.00 0.00 51.96 53.64 1rm6 s ALA 460 Cb 0.15 -0.49 0.04 0.00 0.00 0.00 0.00 23.12 22.81 1rm6 s ALA 460 CO 0.59 -0.35 0.12 0.99 0.00 0.00 0.00 175.76 177.11 1rm6 s THR 461 N -0.62 -0.06 -0.03 0.00 2.01 -1.26 -1.61 115.64 114.07 1rm6 s THR 461 Ca -0.06 0.20 0.04 0.00 0.31 0.00 0.00 61.69 62.18 1rm6 s THR 461 Cb -0.02 -0.21 -0.00 0.00 0.01 0.00 0.00 72.50 72.28 1rm6 s THR 461 CO 0.06 0.08 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.24 1rm6 s VAL 462 N 1.23 1.15 0.05 3.82 1.01 -0.03 -4.62 120.40 123.01 1rm6 s VAL 462 Ca -0.08 -0.57 0.05 0.00 0.00 0.00 0.00 61.98 61.37 1rm6 s VAL 462 Cb -0.12 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 1rm6 s VAL 462 CO -0.05 0.34 -0.08 0.20 0.00 0.00 0.00 175.10 175.51 1rm6 s ASN 463 N 0.03 4.54 0.04 3.32 0.02 -0.80 -0.60 114.94 121.49 1rm6 s ASN 463 Ca -0.02 -0.25 0.06 0.00 -1.02 0.00 0.00 52.86 51.64 1rm6 s ASN 463 Cb -0.09 -0.98 -0.02 0.00 0.02 0.00 0.00 41.25 40.17 1rm6 s ASN 463 CO 0.01 0.23 -0.18 -0.76 0.02 0.00 0.00 177.10 176.42 1rm6 s LEU 464 N -1.78 2.16 -0.04 0.60 1.43 -0.64 -0.49 118.68 119.92 1rm6 s LEU 464 Ca 0.19 -0.49 0.03 0.00 -1.03 0.00 0.00 54.13 52.83 1rm6 s LEU 464 Cb -0.11 -0.84 0.00 0.00 0.03 0.00 0.00 46.19 45.27 1rm6 s LEU 464 CO 0.11 0.12 -0.13 -0.75 0.23 0.00 0.00 176.35 175.93 1rm6 s LYS 465 N -1.13 1.47 -0.04 1.70 2.36 -0.15 -1.46 119.74 122.49 1rm6 s LYS 465 Ca 0.05 -0.45 -0.01 0.00 -2.55 0.00 0.00 55.97 53.02 1rm6 s LYS 465 Cb -0.08 -1.28 0.03 0.00 -1.05 0.00 0.00 37.83 35.44 1rm6 s LYS 465 CO 0.01 0.14 0.02 -1.17 1.55 0.00 0.00 175.35 175.90 1rm6 s LEU 466 N 0.28 0.75 0.00 5.43 2.96 -0.05 -1.35 118.68 126.69 1rm6 s LEU 466 Ca -0.07 -0.02 0.00 0.00 -0.22 0.00 0.00 54.13 53.83 1rm6 s LEU 466 Cb -0.12 -0.27 -0.00 0.00 0.50 0.00 0.00 46.19 46.31 1rm6 s LEU 466 CO 0.02 -0.16 0.00 -0.67 -1.32 0.00 0.00 176.35 174.22 1rm6 n ASP 467 N 4.71 2.00 0.03 3.68 4.64 -1.26 -0.84 116.55 129.53 1rm6 n ASP 467 Ca -0.15 -1.39 0.20 0.00 -1.38 0.00 0.00 54.79 52.07 1rm6 n ASP 467 Cb 0.50 0.09 0.72 0.00 -1.04 0.00 0.00 41.12 41.38 1rm6 n ASP 467 CO 0.00 0.00 0.00 2.19 -0.82 0.00 0.00 177.20 178.57 1rm6 h PHE 468 N 1.06 0.00 0.00 -0.67 -5.15 -1.94 -1.68 116.94 108.56 1rm6 h PHE 468 Ca -0.07 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.70 1rm6 h PHE 468 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.39 1rm6 h PHE 468 CO 0.00 0.00 0.00 0.38 -2.00 0.00 0.00 178.31 176.69 1rm6 h ASP 469 N 0.00 0.00 0.00 -0.68 3.04 -1.98 -3.46 116.42 113.34 1rm6 h ASP 469 Ca 0.23 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.02 1rm6 h ASP 469 Cb 0.98 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.27 1rm6 h ASP 469 CO -0.00 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.81 1rm6 n GLY 470 N 0.23 1.14 3.75 7.15 0.00 -0.63 -5.04 105.19 111.79 1rm6 n GLY 470 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 1rm6 n GLY 470 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rm6 s GLY 471 N -1.92 3.03 -0.22 -0.02 0.00 -1.26 -4.96 107.32 101.96 1rm6 s GLY 471 Ca 0.00 0.52 -0.09 0.00 0.00 0.00 0.00 44.72 45.15 1rm6 s GLY 471 CO 0.00 1.15 0.11 -0.42 0.00 0.00 0.00 173.10 173.93 1rm6 s ILE 472 N -0.89 4.98 -0.20 0.90 1.01 -0.30 -4.19 121.20 122.51 1rm6 s ILE 472 Ca 0.40 0.04 -0.08 0.00 0.00 0.00 0.00 60.65 61.02 1rm6 s ILE 472 Cb -0.24 -3.29 -0.04 0.00 0.01 0.00 0.00 42.46 38.89 1rm6 s ILE 472 CO 0.29 0.39 0.08 -0.89 0.00 0.00 0.00 174.94 174.82 1rm6 s THR 473 N 0.85 4.86 -0.23 2.92 2.01 -0.46 -0.57 115.64 125.01 1rm6 s THR 473 Ca 0.05 -0.00 -0.07 0.00 0.31 0.00 0.00 61.69 61.98 1rm6 s THR 473 Cb -0.13 -3.21 -0.03 0.00 0.01 0.00 0.00 72.50 69.14 1rm6 s THR 473 CO 0.03 0.43 0.06 -0.22 -0.69 0.00 0.00 174.62 174.22 1rm6 s LEU 474 N 0.60 3.45 -0.19 4.42 0.20 0.35 -0.98 118.68 126.53 1rm6 s LEU 474 Ca 0.04 -0.17 -0.04 0.00 0.69 0.00 0.00 54.13 54.66 1rm6 s LEU 474 Cb -0.13 -1.91 -0.02 0.00 -0.43 0.00 0.00 46.19 43.70 1rm6 s LEU 474 CO 0.01 0.01 -0.04 -0.76 -0.29 0.00 0.00 176.35 175.28 1rm6 s LEU 475 N 1.35 3.05 -0.02 -0.68 1.02 0.36 -1.18 118.68 122.57 1rm6 s LEU 475 Ca 0.05 -0.27 -0.03 0.00 0.02 0.00 0.00 54.13 53.90 1rm6 s LEU 475 Cb -0.15 -1.75 0.01 0.00 0.02 0.00 0.00 46.19 44.32 1rm6 s LEU 475 CO 0.03 0.07 0.07 0.28 0.02 0.00 0.00 176.35 176.82 1rm6 s THR 476 N 0.93 0.01 -2.00 5.49 -1.32 -0.71 -1.90 115.64 116.14 1rm6 s THR 476 Ca -0.00 -0.09 0.30 0.00 -1.21 0.00 0.00 61.69 60.69 1rm6 s THR 476 Cb -0.15 -0.14 0.71 0.00 -1.51 0.00 0.00 72.50 71.42 1rm6 s THR 476 CO 0.01 -0.05 2.04 0.61 -2.21 0.00 0.00 174.62 175.02 1rm6 n GLY 477 N 2.87 -0.79 3.77 6.08 0.00 -0.61 -1.29 105.19 115.22 1rm6 n GLY 477 Ca -0.13 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 1rm6 n GLY 477 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rm6 s ALA 478 N -2.14 3.42 -0.37 4.61 0.00 -1.26 -4.18 121.76 121.85 1rm6 s ALA 478 Ca 0.41 1.36 -0.19 0.00 0.00 0.00 0.00 51.96 53.54 1rm6 s ALA 478 Cb 0.21 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1rm6 s ALA 478 CO 0.39 -0.87 0.55 0.00 0.00 0.00 0.00 175.76 175.83 1rm6 s ALA 479 N -1.18 3.45 -0.26 0.00 0.00 -1.26 -4.12 121.76 118.40 1rm6 s ALA 479 Ca 0.54 -1.04 -0.24 0.00 0.00 0.00 0.00 51.96 51.21 1rm6 s ALA 479 Cb -0.42 -3.09 -0.00 0.00 0.00 0.00 0.00 23.12 19.61 1rm6 s ALA 479 CO 0.55 -1.35 0.81 0.34 0.00 0.00 0.00 175.76 176.11 1rm6 s ASP 480 N 1.80 6.78 -0.16 0.00 -1.08 -1.26 -4.77 116.67 117.98 1rm6 s ASP 480 Ca 0.20 0.94 0.17 0.00 -0.52 0.00 0.00 52.55 53.34 1rm6 s ASP 480 Cb -0.15 -2.43 0.48 0.00 -1.46 0.00 0.00 42.92 39.36 1rm6 s ASP 480 CO 0.14 -0.53 1.36 2.30 0.52 0.00 0.00 175.17 178.97 1rm6 n ILE 481 N 5.32 2.18 0.00 4.11 -5.35 -1.26 -4.48 119.36 119.87 1rm6 n ILE 481 Ca 0.05 -1.93 0.00 0.00 -0.27 0.00 0.00 62.75 60.60 1rm6 n ILE 481 Cb 0.48 -0.23 0.00 0.00 -1.74 0.00 0.00 39.64 38.14 1rm6 n ILE 481 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1rm6 n GLY 482 N -0.67 0.67 0.19 3.28 0.00 -1.26 -3.16 105.19 104.24 1rm6 n GLY 482 Ca 0.20 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.32 1rm6 n GLY 482 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1rm6 h GLN 483 N 2.27 0.00 0.00 1.61 -0.00 -1.93 -3.48 115.11 113.58 1rm6 h GLN 483 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1rm6 h GLN 483 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 1rm6 h GLN 483 CO 0.00 0.11 0.00 0.41 -0.00 0.00 0.00 178.83 179.35 1rm6 n GLY 484 N 1.14 1.36 0.29 0.06 0.00 -1.26 -5.00 105.19 101.78 1rm6 n GLY 484 Ca 0.03 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.09 1rm6 n GLY 484 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1rm6 h SER 485 N 0.00 0.34 -0.23 1.61 4.64 -1.93 0.14 113.55 118.12 1rm6 h SER 485 Ca 0.00 -0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.23 1rm6 h SER 485 Cb 0.00 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 61.99 1rm6 h SER 485 CO 0.00 0.28 -0.08 0.78 -0.87 0.00 0.00 176.83 176.94 1rm6 h ASN 486 N 0.39 0.58 -0.06 4.97 2.35 -1.94 -0.27 115.58 121.60 1rm6 h ASN 486 Ca 0.10 -0.15 -0.05 0.00 -0.55 0.00 0.00 56.30 55.66 1rm6 h ASN 486 Cb 0.01 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.23 1rm6 h ASN 486 CO -0.02 0.71 -0.15 0.74 -1.65 0.00 0.00 177.43 177.06 1rm6 h THR 487 N 0.56 1.43 -0.35 2.81 2.02 -1.61 -2.66 112.91 115.11 1rm6 h THR 487 Ca 0.11 -1.50 0.06 0.00 0.77 0.00 0.00 66.41 65.85 1rm6 h THR 487 Cb 0.48 2.25 -0.05 0.00 -1.74 0.00 0.00 68.15 69.09 1rm6 h THR 487 CO 0.03 0.42 0.02 -0.03 0.37 0.00 0.00 175.52 176.33 1rm6 h MET 488 N -0.29 0.12 -0.76 6.66 1.85 -0.63 0.13 114.93 122.02 1rm6 h MET 488 Ca -0.00 -0.01 -0.04 0.00 -0.61 0.00 0.00 59.70 59.04 1rm6 h MET 488 Cb 0.75 -0.03 -0.03 0.00 0.43 0.00 0.00 31.60 32.72 1rm6 h MET 488 CO 0.03 0.08 0.32 0.00 -0.40 0.00 0.00 176.91 176.94 1rm6 h ALA 489 N 1.29 1.14 -0.45 0.39 0.00 -1.10 -1.81 119.26 118.71 1rm6 h ALA 489 Ca 0.17 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1rm6 h ALA 489 Cb 0.22 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1rm6 h ALA 489 CO -0.26 0.63 0.00 0.77 0.00 0.00 0.00 179.25 180.39 1rm6 h SER 490 N 1.09 0.78 -0.20 0.00 0.02 -1.07 -2.49 113.55 111.68 1rm6 h SER 490 Ca 0.26 -0.30 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1rm6 h SER 490 Cb 0.18 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1rm6 h SER 490 CO -0.02 0.90 0.13 1.56 -1.14 0.00 0.00 176.83 178.25 1rm6 h GLN 491 N 0.65 0.27 -0.15 3.45 4.20 -0.25 -0.23 115.11 123.04 1rm6 h GLN 491 Ca 0.13 -0.02 -0.15 0.00 0.06 0.00 0.00 58.65 58.67 1rm6 h GLN 491 Cb 0.49 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 1rm6 h GLN 491 CO 0.02 0.20 -0.53 -0.39 -0.67 0.00 0.00 178.83 177.46 1rm6 h VAL 492 N 0.26 1.34 -0.29 -0.54 -1.51 -1.34 -1.16 116.25 113.00 1rm6 h VAL 492 Ca 0.07 -1.79 -0.17 0.00 -1.23 0.00 0.00 66.70 63.58 1rm6 h VAL 492 Cb -0.01 1.80 -0.00 0.00 -2.13 0.00 0.00 31.29 30.96 1rm6 h VAL 492 CO -0.01 0.55 -0.49 0.00 -1.23 0.00 0.00 177.57 176.38 1rm6 h ALA 493 N 1.09 0.58 -0.53 5.19 0.00 -1.32 -2.51 119.26 121.76 1rm6 h ALA 493 Ca 0.01 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.34 1rm6 h ALA 493 Cb 1.05 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1rm6 h ALA 493 CO 0.09 0.68 -0.02 0.00 0.00 0.00 0.00 179.25 180.00 1rm6 h ALA 494 N 0.81 0.97 -0.24 0.00 0.00 -0.87 -1.69 119.26 118.24 1rm6 h ALA 494 Ca 0.03 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1rm6 h ALA 494 Cb 1.07 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1rm6 h ALA 494 CO 0.11 0.62 0.15 1.49 0.00 0.00 0.00 179.25 181.62 1rm6 h GLU 495 N 0.83 0.32 -0.65 0.00 4.57 -1.08 0.61 114.58 119.18 1rm6 h GLU 495 Ca 0.15 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 1rm6 h GLU 495 Cb 0.52 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.01 1rm6 h GLU 495 CO 0.03 0.23 0.42 0.28 -1.18 0.00 0.00 179.01 178.79 1rm6 h VAL 496 N 0.32 1.17 0.00 0.32 2.07 -1.23 -2.85 116.25 116.05 1rm6 h VAL 496 Ca 0.09 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1rm6 h VAL 496 Cb -0.02 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 29.98 1rm6 h VAL 496 CO -0.02 0.17 0.00 0.18 0.02 0.00 0.00 177.57 177.92 1rm6 n LEU 497 N -4.62 0.43 -0.60 2.57 4.77 -0.66 -4.92 117.00 113.96 1rm6 n LEU 497 Ca 0.05 0.54 -0.06 0.00 -0.03 0.00 0.00 56.01 56.51 1rm6 n LEU 497 Cb 0.02 -0.41 -0.01 0.00 -2.33 0.00 0.00 43.42 40.69 1rm6 n LEU 497 CO 0.36 -0.12 -0.07 0.61 -1.33 0.00 0.00 177.39 176.84 1rm6 n GLY 498 N 1.30 0.46 3.78 -0.72 0.00 0.13 -4.81 105.19 105.33 1rm6 n GLY 498 Ca 0.06 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 45.15 1rm6 n GLY 498 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1rm6 s VAL 499 N -2.27 2.58 0.48 1.61 -7.23 -0.74 -1.12 120.40 113.70 1rm6 s VAL 499 Ca 0.00 -1.59 -0.20 0.00 -1.81 0.00 0.00 61.98 58.38 1rm6 s VAL 499 Cb 0.00 -3.00 -0.09 0.00 0.56 0.00 0.00 36.38 33.85 1rm6 s VAL 499 CO 0.00 -0.04 1.01 -0.13 -0.31 0.00 0.00 175.10 175.63 1rm6 s ARG 500 N -3.96 3.90 0.37 4.82 0.52 -1.26 -4.57 118.95 118.77 1rm6 s ARG 500 Ca 0.42 1.28 0.09 0.00 -0.52 0.00 0.00 55.73 57.01 1rm6 s ARG 500 Cb 0.00 -2.12 0.84 0.00 0.52 0.00 0.00 34.95 34.19 1rm6 s ARG 500 CO 0.24 -0.34 1.92 1.25 0.02 0.00 0.00 175.30 178.40 1rm6 h LEU 501 N 1.60 0.60 -2.19 2.53 5.85 -1.94 -1.31 115.31 120.46 1rm6 h LEU 501 Ca -0.49 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.25 1rm6 h LEU 501 Cb 1.21 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.13 1rm6 h LEU 501 CO 0.60 0.35 0.01 0.77 -0.34 0.00 0.00 178.44 179.82 1rm6 h SER 502 N 0.66 0.00 0.74 1.25 4.64 -1.98 -1.57 113.55 117.28 1rm6 h SER 502 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1rm6 h SER 502 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1rm6 h SER 502 CO -0.14 0.00 -0.08 -1.14 -0.87 0.00 0.00 176.83 174.60 1rm6 n ARG 503 N -2.66 0.20 -3.88 4.77 0.63 -0.49 -4.78 116.66 110.45 1rm6 n ARG 503 Ca -0.02 -0.03 -0.36 0.00 -0.92 0.00 0.00 57.85 56.52 1rm6 n ARG 503 Cb 0.06 -1.50 -0.11 0.00 0.45 0.00 0.00 32.46 31.36 1rm6 n ARG 503 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1rm6 s ILE 504 N -2.82 4.67 -0.18 5.15 -1.09 -0.59 -1.15 121.20 125.18 1rm6 s ILE 504 Ca 0.19 -0.06 -0.05 0.00 -2.23 0.00 0.00 60.65 58.50 1rm6 s ILE 504 Cb 0.19 -3.15 -0.03 0.00 -1.58 0.00 0.00 42.46 37.90 1rm6 s ILE 504 CO 0.53 0.39 -0.00 -0.60 -1.23 0.00 0.00 174.94 174.03 1rm6 s ARG 505 N 0.99 3.69 -0.21 2.79 3.52 0.26 -4.98 118.95 125.01 1rm6 s ARG 505 Ca 0.04 -0.49 -0.09 0.00 -0.13 0.00 0.00 55.73 55.06 1rm6 s ARG 505 Cb -0.14 -3.05 -0.04 0.00 -1.56 0.00 0.00 34.95 30.16 1rm6 s ARG 505 CO 0.03 0.13 0.11 0.08 -0.81 0.00 0.00 175.30 174.83 1rm6 s VAL 506 N 0.69 5.04 -0.20 7.11 1.01 -1.26 -0.49 120.40 132.30 1rm6 s VAL 506 Ca -0.00 0.06 -0.04 0.00 0.00 0.00 0.00 61.98 62.00 1rm6 s VAL 506 Cb -0.14 -3.31 -0.01 0.00 0.00 0.00 0.00 36.38 32.92 1rm6 s VAL 506 CO 0.02 0.41 -0.04 -0.63 0.00 0.00 0.00 175.10 174.86 1rm6 s ILE 507 N 0.68 3.49 0.04 2.22 -1.09 -0.33 -4.97 121.20 121.25 1rm6 s ILE 507 Ca 0.06 -0.46 0.03 0.00 -2.23 0.00 0.00 60.65 58.04 1rm6 s ILE 507 Cb -0.13 -2.57 -0.02 0.00 -1.58 0.00 0.00 42.46 38.16 1rm6 s ILE 507 CO 0.01 0.44 -0.09 -0.94 -1.23 0.00 0.00 174.94 173.14 1rm6 s SER 508 N 1.19 0.97 -1.18 3.58 1.04 -1.26 -1.74 113.70 116.30 1rm6 s SER 508 Ca 0.02 -0.49 -0.15 0.00 0.48 0.00 0.00 55.95 55.82 1rm6 s SER 508 Cb -0.14 0.00 -0.01 0.00 0.10 0.00 0.00 66.02 65.96 1rm6 s SER 508 CO -0.01 -0.14 0.76 0.00 0.98 0.00 0.00 173.24 174.83 1rm6 n ALA 509 N 1.67 -2.42 -3.65 5.32 0.00 -0.41 -4.81 120.51 116.21 1rm6 n ALA 509 Ca -0.21 -0.19 -0.27 0.00 0.00 0.00 0.00 53.44 52.77 1rm6 n ALA 509 Cb 0.55 -3.80 -0.17 0.00 0.00 0.00 0.00 19.45 16.04 1rm6 n ALA 509 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1rm6 s ASP 510 N -3.66 2.68 0.64 0.00 -1.08 -1.26 -1.66 116.67 112.33 1rm6 s ASP 510 Ca 0.37 -0.77 0.35 0.00 -0.52 0.00 0.00 52.55 51.98 1rm6 s ASP 510 Cb -0.12 -0.38 1.93 0.00 -1.46 0.00 0.00 42.92 42.88 1rm6 s ASP 510 CO 0.84 -0.35 2.14 0.77 0.52 0.00 0.00 175.17 179.10 1rm6 h SER 511 N 8.35 0.00 1.54 -0.34 4.64 -1.51 0.63 113.55 126.86 1rm6 h SER 511 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1rm6 h SER 511 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1rm6 h SER 511 CO 0.32 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.28 1rm6 h ALA 512 N 1.72 1.00 0.00 5.18 0.00 -1.94 -3.39 119.26 121.83 1rm6 h ALA 512 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1rm6 h ALA 512 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1rm6 h ALA 512 CO -0.00 0.00 -0.87 1.28 0.00 0.00 0.00 179.25 179.66 1rm6 n LEU 513 N -2.50 0.73 -4.72 0.00 4.77 0.02 -5.08 117.00 110.22 1rm6 n LEU 513 Ca 0.05 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.72 1rm6 n LEU 513 Cb 0.44 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.45 1rm6 n LEU 513 CO 0.30 0.12 -0.30 0.42 -1.33 0.00 0.00 177.39 176.60 1rm6 s THR 514 N -1.87 4.27 0.56 -5.08 -4.23 -0.10 -4.97 115.64 104.22 1rm6 s THR 514 Ca 0.00 -0.81 -0.21 0.00 -1.18 0.00 0.00 61.69 59.49 1rm6 s THR 514 Cb 0.00 -3.01 -0.04 0.00 1.34 0.00 0.00 72.50 70.78 1rm6 s THR 514 CO 0.00 0.18 1.28 -2.16 -0.54 0.00 0.00 174.62 173.37 1rm6 s PRO 515 N -2.18 3.11 0.32 3.99 0.04 -1.26 -4.68 135.00 134.34 1rm6 s PRO 515 Ca 0.26 2.03 -0.29 0.00 0.04 0.00 0.00 61.00 63.03 1rm6 s PRO 515 Cb -0.12 -2.13 -0.12 0.00 0.04 0.00 0.00 34.50 32.17 1rm6 s PRO 515 CO 0.18 -1.15 1.56 1.17 0.04 0.00 0.00 177.00 178.80 1rm6 n LYS 516 N -1.21 2.68 -4.53 4.56 0.00 -1.26 -1.58 118.16 116.82 1rm6 n LYS 516 Ca 0.12 0.95 -0.25 0.00 0.00 0.00 0.00 58.31 59.12 1rm6 n LYS 516 Cb 0.47 -2.71 -0.14 0.00 0.00 0.00 0.00 35.03 32.65 1rm6 n LYS 516 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1rm6 s ASP 517 N 0.30 2.54 0.21 3.14 -1.08 -1.26 -4.50 116.67 116.02 1rm6 s ASP 517 Ca 0.61 -0.58 0.22 0.00 -0.52 0.00 0.00 52.55 52.28 1rm6 s ASP 517 Cb -0.49 -0.19 0.91 0.00 -1.46 0.00 0.00 42.92 41.69 1rm6 s ASP 517 CO 0.53 0.13 1.68 0.59 0.52 0.00 0.00 175.17 178.62 1rm6 n ASN 518 N 1.58 0.56 0.00 -0.34 3.02 -1.26 -4.45 115.26 114.37 1rm6 n ASN 518 Ca -0.18 0.63 0.00 0.00 -0.03 0.00 0.00 54.58 55.00 1rm6 n ASN 518 Cb 0.53 -0.75 0.00 0.00 -0.61 0.00 0.00 39.78 38.95 1rm6 n ASN 518 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rm6 n GLY 519 N 0.14 3.68 3.40 7.41 0.00 -1.26 -4.79 105.19 113.77 1rm6 n GLY 519 Ca 0.03 -1.75 -0.45 0.00 0.00 0.00 0.00 46.02 43.85 1rm6 n GLY 519 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rm6 s SER 520 N 0.00 7.11 0.05 1.61 0.01 -0.55 -4.77 113.70 117.16 1rm6 s SER 520 Ca 0.00 -3.13 -0.08 0.00 1.31 0.00 0.00 55.95 54.05 1rm6 s SER 520 Cb 0.00 -2.31 -0.00 0.00 0.21 0.00 0.00 66.02 63.92 1rm6 s SER 520 CO 0.00 -0.57 0.15 -0.72 0.41 0.00 0.00 173.24 172.51 1rm6 s TYR 521 N 0.41 0.14 -1.54 2.43 -0.85 -1.26 -4.90 117.35 111.78 1rm6 s TYR 521 Ca 0.35 -0.43 0.00 0.00 -0.52 0.00 0.00 57.07 56.47 1rm6 s TYR 521 Cb -0.06 -0.08 0.00 0.00 0.38 0.00 0.00 41.96 42.19 1rm6 s TYR 521 CO -0.05 -0.43 0.00 -1.13 -1.52 0.00 0.00 175.55 172.42 1rm6 n SER 522 N 0.55 -4.47 -3.81 -0.18 3.41 -1.26 -2.56 113.62 105.30 1rm6 n SER 522 Ca -0.18 0.26 -0.27 0.00 -0.26 0.00 0.00 58.87 58.42 1rm6 n SER 522 Cb 0.59 -3.91 0.04 0.00 -0.26 0.00 0.00 64.21 60.67 1rm6 n SER 522 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1rm6 n SER 523 N -1.33 -4.25 0.02 4.04 7.64 -1.26 -0.30 113.62 118.18 1rm6 n SER 523 Ca -0.17 -0.74 0.11 0.00 1.01 0.00 0.00 58.87 59.07 1rm6 n SER 523 Cb 0.58 -4.14 0.04 0.00 -1.01 0.00 0.00 64.21 59.68 1rm6 n SER 523 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1rm6 n ARG 524 N -4.64 0.25 -0.04 1.43 1.85 -1.06 -2.28 116.66 112.17 1rm6 n ARG 524 Ca -0.04 0.00 -0.12 0.00 -1.00 0.00 0.00 57.85 56.69 1rm6 n ARG 524 Cb 0.57 -1.59 -0.07 0.00 -1.05 0.00 0.00 32.46 30.32 1rm6 n ARG 524 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1rm6 h VAL 525 N 0.00 1.29 -0.11 8.89 2.07 -1.86 -1.10 116.25 125.44 1rm6 h VAL 525 Ca 0.00 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.55 1rm6 h VAL 525 Cb 0.70 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 1rm6 h VAL 525 CO 0.00 0.28 0.07 0.74 0.02 0.00 0.00 177.57 178.67 1rm6 h THR 526 N -0.10 1.04 -0.04 2.57 2.02 -1.95 0.16 112.91 116.61 1rm6 h THR 526 Ca 0.03 -0.10 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 1rm6 h THR 526 Cb 0.45 0.92 -0.00 0.00 -1.74 0.00 0.00 68.15 67.77 1rm6 h THR 526 CO 0.01 0.04 0.02 0.15 0.37 0.00 0.00 175.52 176.12 1rm6 h PHE 527 N 0.13 0.06 0.18 3.16 3.57 -1.82 0.03 116.94 122.24 1rm6 h PHE 527 Ca 0.04 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1rm6 h PHE 527 Cb 0.01 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.73 1rm6 h PHE 527 CO -0.06 0.11 -0.09 0.52 -2.23 0.00 0.00 178.31 176.56 1rm6 h MET 528 N -0.01 -0.23 -0.03 1.11 2.86 -1.11 -2.42 114.93 115.10 1rm6 h MET 528 Ca 0.02 0.02 -0.15 0.00 -2.06 0.00 0.00 59.70 57.53 1rm6 h MET 528 Cb 0.07 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.77 1rm6 h MET 528 CO -0.00 -0.05 -0.65 0.28 1.06 0.00 0.00 176.91 177.55 1rm6 h VAL 529 N -1.04 1.44 -0.27 -2.22 2.07 -0.83 -0.84 116.25 114.55 1rm6 h VAL 529 Ca -0.02 -2.16 -0.02 0.00 0.82 0.00 0.00 66.70 65.31 1rm6 h VAL 529 Cb 0.29 2.14 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 1rm6 h VAL 529 CO 0.04 0.63 0.09 1.23 0.02 0.00 0.00 177.57 179.57 1rm6 h GLY 530 N 1.74 0.46 1.38 2.17 0.00 -0.72 0.18 103.07 108.28 1rm6 h GLY 530 Ca -0.01 -0.27 -0.06 0.00 0.00 0.00 0.00 47.33 46.99 1rm6 h GLY 530 CO 0.09 0.25 0.05 3.43 0.00 0.00 0.00 176.54 180.37 1rm6 h ASN 531 N 0.28 0.72 0.09 0.19 2.35 -1.21 -1.53 115.58 116.47 1rm6 h ASN 531 Ca 0.09 -0.15 -0.10 0.00 -0.55 0.00 0.00 56.30 55.58 1rm6 h ASN 531 Cb 0.24 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 1rm6 h ASN 531 CO -0.00 0.76 -0.34 0.00 -1.65 0.00 0.00 177.43 176.20 1rm6 h ALA 532 N 1.33 1.09 -0.49 -0.83 0.00 -0.76 -0.99 119.26 118.62 1rm6 h ALA 532 Ca 0.15 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 1rm6 h ALA 532 Cb 0.37 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1rm6 h ALA 532 CO 0.01 0.57 -0.06 0.77 0.00 0.00 0.00 179.25 180.55 1rm6 h SER 533 N 0.31 0.89 -0.37 0.00 0.02 -0.25 -0.35 113.55 113.81 1rm6 h SER 533 Ca 0.04 -0.33 -0.02 0.00 -0.84 0.00 0.00 61.79 60.64 1rm6 h SER 533 Cb 0.76 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 1rm6 h SER 533 CO 0.06 1.01 0.16 0.40 -1.14 0.00 0.00 176.83 177.33 1rm6 h ILE 534 N 0.75 1.18 -0.67 3.27 2.04 -1.08 -0.47 117.51 122.52 1rm6 h ILE 534 Ca 0.13 -0.53 0.05 0.00 1.00 0.00 0.00 64.86 65.52 1rm6 h ILE 534 Cb 0.59 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 37.46 1rm6 h ILE 534 CO 0.04 0.19 0.38 -1.28 0.00 0.00 0.00 178.15 177.48 1rm6 h SER 535 N 0.46 0.57 -0.51 1.72 0.87 -0.85 0.57 113.55 116.38 1rm6 h SER 535 Ca 0.13 0.03 -0.07 0.00 -1.23 0.00 0.00 61.79 60.64 1rm6 h SER 535 Cb 0.15 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.00 1rm6 h SER 535 CO -0.01 0.37 0.03 0.00 -0.53 0.00 0.00 176.83 176.69 1rm6 h ALA 536 N 1.34 0.68 -0.35 6.23 0.00 -0.77 -2.13 119.26 124.27 1rm6 h ALA 536 Ca 0.30 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1rm6 h ALA 536 Cb 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1rm6 h ALA 536 CO -0.17 0.47 -0.10 0.00 0.00 0.00 0.00 179.25 179.45 1rm6 h ALA 537 N 0.95 1.19 -0.45 0.00 0.00 -0.53 -1.10 119.26 119.31 1rm6 h ALA 537 Ca 0.15 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1rm6 h ALA 537 Cb 0.48 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1rm6 h ALA 537 CO 0.02 0.52 -0.08 0.93 0.00 0.00 0.00 179.25 180.64 1rm6 h GLU 538 N 0.54 0.80 -0.33 0.00 5.08 -0.65 0.93 114.58 120.96 1rm6 h GLU 538 Ca 0.10 -0.25 -0.05 0.00 -1.00 0.00 0.00 59.36 58.16 1rm6 h GLU 538 Cb 0.49 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1rm6 h GLU 538 CO 0.03 0.86 0.02 0.93 -1.00 0.00 0.00 179.01 179.84 1rm6 h GLU 539 N 0.73 0.57 -0.54 2.33 4.39 -0.78 -1.05 114.58 120.23 1rm6 h GLU 539 Ca 0.13 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.60 1rm6 h GLU 539 Cb 0.56 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.13 1rm6 h GLU 539 CO 0.03 0.68 0.12 1.25 -1.16 0.00 0.00 179.01 179.93 1rm6 h LEU 540 N 0.38 0.83 -0.91 1.33 5.85 -0.99 -2.53 115.31 119.26 1rm6 h LEU 540 Ca 0.09 -0.24 0.06 0.00 0.84 0.00 0.00 57.88 58.63 1rm6 h LEU 540 Cb 0.41 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.16 1rm6 h LEU 540 CO 0.01 0.85 0.58 0.50 -0.34 0.00 0.00 178.44 180.04 1rm6 h LYS 541 N 0.76 1.03 -0.75 1.25 3.64 -0.67 -1.80 116.57 120.04 1rm6 h LYS 541 Ca 0.17 -0.06 0.05 0.00 -1.27 0.00 0.00 60.65 59.54 1rm6 h LYS 541 Cb 0.36 -0.23 -0.05 0.00 -0.41 0.00 0.00 32.23 31.89 1rm6 h LYS 541 CO 0.00 0.68 0.45 0.78 -2.27 0.00 0.00 179.45 179.09 1rm6 h GLY 542 N 1.06 1.10 0.97 5.01 0.00 -0.78 0.14 103.07 110.57 1rm6 h GLY 542 Ca 0.39 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 47.35 1rm6 h GLY 542 CO -0.17 0.24 0.13 -2.08 0.00 0.00 0.00 176.54 174.66 1rm6 h VAL 543 N 0.84 1.23 -0.43 4.60 2.07 -1.07 -1.87 116.25 121.64 1rm6 h VAL 543 Ca 0.32 -0.80 -0.14 0.00 0.82 0.00 0.00 66.70 66.90 1rm6 h VAL 543 Cb 0.12 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1rm6 h VAL 543 CO -0.15 0.29 -0.27 -0.07 0.02 0.00 0.00 177.57 177.39 1rm6 h LEU 544 N 0.66 0.97 -0.89 2.57 3.38 -0.78 -2.45 115.31 118.77 1rm6 h LEU 544 Ca 0.15 -0.42 -0.06 0.00 0.09 0.00 0.00 57.88 57.65 1rm6 h LEU 544 Cb 0.30 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1rm6 h LEU 544 CO -0.00 1.19 0.19 0.58 0.09 0.00 0.00 178.44 180.48 1rm6 h VAL 545 N 0.76 1.24 -0.58 1.22 2.07 -0.68 0.01 116.25 120.29 1rm6 h VAL 545 Ca 0.09 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 1rm6 h VAL 545 Cb 0.85 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 1rm6 h VAL 545 CO 0.07 0.33 0.34 0.50 0.02 0.00 0.00 177.57 178.84 1rm6 h LYS 546 N 0.96 0.80 -0.55 1.57 3.64 -1.17 0.26 116.57 122.08 1rm6 h LYS 546 Ca 0.21 -0.08 -0.08 0.00 -1.27 0.00 0.00 60.65 59.43 1rm6 h LYS 546 Cb 0.30 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1rm6 h LYS 546 CO -0.01 0.59 0.01 0.00 -2.27 0.00 0.00 179.45 177.78 1rm6 h ALA 547 N 1.16 0.73 -0.47 5.00 0.00 -0.97 -1.66 119.26 123.07 1rm6 h ALA 547 Ca 0.21 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1rm6 h ALA 547 Cb 0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1rm6 h ALA 547 CO -0.04 0.55 0.08 0.00 0.00 0.00 0.00 179.25 179.84 1rm6 h ALA 548 N 0.96 0.62 -0.76 0.00 0.00 -0.66 -2.16 119.26 117.27 1rm6 h ALA 548 Ca 0.16 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1rm6 h ALA 548 Cb 0.52 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1rm6 h ALA 548 CO 0.03 0.35 0.37 0.00 0.00 0.00 0.00 179.25 179.99 1rm6 h ALA 549 N 0.96 0.97 -0.03 0.00 0.00 -0.39 -0.13 119.26 120.65 1rm6 h ALA 549 Ca 0.14 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1rm6 h ALA 549 Cb 0.39 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1rm6 h ALA 549 CO 0.01 0.54 0.02 -0.22 0.00 0.00 0.00 179.25 179.59 1rm6 h LYS 550 N 1.06 0.04 -0.10 0.00 1.63 -1.16 0.06 116.57 118.10 1rm6 h LYS 550 Ca 0.26 -0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.99 1rm6 h LYS 550 Cb 0.11 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.72 1rm6 h LYS 550 CO -0.03 0.02 -0.26 -0.22 -3.45 0.00 0.00 179.45 175.51 1rm6 h LYS 551 N 0.04 0.18 -0.27 1.90 3.64 -1.07 -2.57 116.57 118.42 1rm6 h LYS 551 Ca 0.01 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1rm6 h LYS 551 Cb -0.00 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1rm6 h LYS 551 CO -0.00 0.43 0.00 1.28 -2.27 0.00 0.00 179.45 178.89 1rm6 n LEU 552 N -4.17 2.47 -3.77 5.20 4.77 -0.09 -4.95 117.00 116.46 1rm6 n LEU 552 Ca -0.01 -1.05 -0.25 0.00 -0.03 0.00 0.00 56.01 54.66 1rm6 n LEU 552 Cb 0.35 -0.17 0.04 0.00 -2.33 0.00 0.00 43.42 41.31 1rm6 n LEU 552 CO 0.39 0.53 0.06 -0.67 -1.33 0.00 0.00 177.39 176.36 1rm6 n ASP 553 N 0.85 -3.43 -4.47 -1.43 -0.08 -0.23 -4.98 116.55 102.78 1rm6 n ASP 553 Ca 0.17 -0.76 -0.24 0.00 -1.51 0.00 0.00 54.79 52.45 1rm6 n ASP 553 Cb 0.45 -4.14 -0.10 0.00 2.34 0.00 0.00 41.12 39.67 1rm6 n ASP 553 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1rm6 s ALA 554 N -3.45 2.74 0.32 -1.67 0.00 -0.16 -5.04 121.76 114.50 1rm6 s ALA 554 Ca 0.37 -1.89 -0.19 0.00 0.00 0.00 0.00 51.96 50.25 1rm6 s ALA 554 Cb -0.18 0.51 -0.09 0.00 0.00 0.00 0.00 23.12 23.36 1rm6 s ALA 554 CO 0.81 -0.25 0.81 1.03 0.00 0.00 0.00 175.76 178.16 1rm6 s ARG 555 N -3.83 4.20 0.22 0.00 0.52 -1.26 -4.50 118.95 114.30 1rm6 s ARG 555 Ca 0.32 0.91 -0.09 0.00 -0.52 0.00 0.00 55.73 56.35 1rm6 s ARG 555 Cb 0.08 -2.55 0.19 0.00 0.52 0.00 0.00 34.95 33.19 1rm6 s ARG 555 CO 0.15 0.20 1.90 0.93 0.02 0.00 0.00 175.30 178.49 1rm6 h GLU 556 N 2.61 1.09 -0.00 3.54 5.08 -1.92 -1.46 114.58 123.51 1rm6 h GLU 556 Ca -0.48 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 57.82 1rm6 h GLU 556 Cb 1.18 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 1rm6 h GLU 556 CO 0.64 0.72 0.01 1.05 -1.00 0.00 0.00 179.01 180.43 1rm6 h GLU 557 N 1.12 0.00 -0.02 2.33 9.09 -1.97 -1.52 114.58 123.61 1rm6 h GLU 557 Ca 0.30 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.71 1rm6 h GLU 557 Cb -0.13 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 26.97 1rm6 h GLU 557 CO -0.07 0.00 -0.00 -0.25 0.05 0.00 0.00 179.01 178.74 1rm6 n ASP 558 N -3.09 1.63 -4.75 3.06 10.43 -0.55 -4.91 116.55 118.36 1rm6 n ASP 558 Ca -0.03 -1.53 -0.39 0.00 2.57 0.00 0.00 54.79 55.40 1rm6 n ASP 558 Cb 0.08 0.00 -0.05 0.00 1.84 0.00 0.00 41.12 42.99 1rm6 n ASP 558 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1rm6 s ILE 559 N -2.01 4.79 -0.07 0.53 -1.09 -0.58 -0.33 121.20 122.44 1rm6 s ILE 559 Ca 0.37 1.48 0.02 0.00 -2.23 0.00 0.00 60.65 60.28 1rm6 s ILE 559 Cb 0.21 -4.04 -0.02 0.00 -1.58 0.00 0.00 42.46 37.02 1rm6 s ILE 559 CO 0.34 0.39 -0.12 -1.61 -1.23 0.00 0.00 174.94 172.71 1rm6 s GLU 560 N -0.16 2.78 -0.21 2.79 2.02 0.92 -4.87 118.70 121.96 1rm6 s GLU 560 Ca 0.35 -0.66 0.02 0.00 0.02 0.00 0.00 54.97 54.70 1rm6 s GLU 560 Cb -0.20 -2.49 0.04 0.00 0.10 0.00 0.00 34.13 31.58 1rm6 s GLU 560 CO 0.21 0.54 -0.16 0.08 0.02 0.00 0.00 175.26 175.94 1rm6 s VAL 561 N -0.49 2.14 -0.11 2.63 1.01 -1.26 -0.81 120.40 123.51 1rm6 s VAL 561 Ca 0.07 -1.21 -0.05 0.00 0.00 0.00 0.00 61.98 60.78 1rm6 s VAL 561 Cb -0.12 -2.05 0.05 0.00 0.00 0.00 0.00 36.38 34.26 1rm6 s VAL 561 CO 0.02 0.30 0.24 0.27 0.00 0.00 0.00 175.10 175.93 1rm6 s ILE 562 N 1.22 -0.15 -1.18 2.22 -4.36 -0.32 -4.83 121.20 113.79 1rm6 s ILE 562 Ca -0.01 0.20 -0.26 0.00 -0.26 0.00 0.00 60.65 60.32 1rm6 s ILE 562 Cb -0.16 -0.39 0.01 0.00 1.25 0.00 0.00 42.46 43.18 1rm6 s ILE 562 CO -0.09 0.08 0.73 0.47 0.24 0.00 0.00 174.94 176.37 1rm6 n ASP 563 N 4.58 -4.65 -2.51 4.36 10.43 -1.21 -1.45 116.55 126.10 1rm6 n ASP 563 Ca -0.19 -1.14 -0.17 0.00 2.57 0.00 0.00 54.79 55.86 1rm6 n ASP 563 Cb 0.52 -2.63 -0.00 0.00 1.84 0.00 0.00 41.12 40.84 1rm6 n ASP 563 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1rm6 n GLU 564 N -4.57 -2.27 -4.51 -1.24 1.02 -0.28 -4.99 120.64 103.81 1rm6 n GLU 564 Ca -0.11 0.77 -0.21 0.00 -0.02 0.00 0.00 57.16 57.60 1rm6 n GLU 564 Cb 0.58 -5.42 -0.15 0.00 -0.02 0.00 0.00 31.44 26.43 1rm6 n GLU 564 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1rm6 s MET 565 N -5.14 1.06 -0.19 3.49 -1.94 -0.53 -0.92 119.30 115.14 1rm6 s MET 565 Ca 0.04 -0.40 -0.02 0.00 -1.71 0.00 0.00 55.69 53.60 1rm6 s MET 565 Cb -0.02 -0.99 -0.01 0.00 2.01 0.00 0.00 34.83 35.82 1rm6 s MET 565 CO 0.05 0.19 -0.09 -0.06 -0.01 0.00 0.00 175.02 175.11 1rm6 s PHE 566 N -0.04 2.90 0.11 -0.03 0.40 0.81 -1.17 117.98 120.95 1rm6 s PHE 566 Ca 0.00 -0.92 -0.06 0.00 -0.60 0.00 0.00 56.93 55.36 1rm6 s PHE 566 Cb -0.07 -2.00 -0.02 0.00 0.51 0.00 0.00 43.02 41.44 1rm6 s PHE 566 CO 0.00 -0.47 0.14 0.00 0.70 0.00 0.00 175.22 175.60 1rm6 s MET 567 N 1.09 0.90 -0.06 0.44 0.23 0.01 -0.56 119.30 121.35 1rm6 s MET 567 Ca 0.01 -1.17 -0.30 0.00 -1.03 0.00 0.00 55.69 53.19 1rm6 s MET 567 Cb -0.15 0.30 -0.02 0.00 -1.53 0.00 0.00 34.83 33.43 1rm6 s MET 567 CO -0.02 -0.28 1.06 0.08 -2.03 0.00 0.00 175.02 173.84 1rm6 s VAL 568 N -3.94 4.61 0.09 5.16 1.01 -1.26 -0.06 120.40 126.01 1rm6 s VAL 568 Ca 0.13 1.89 -0.34 0.00 0.00 0.00 0.00 61.98 63.66 1rm6 s VAL 568 Cb 0.06 -4.21 -0.13 0.00 0.00 0.00 0.00 36.38 32.09 1rm6 s VAL 568 CO -0.05 0.04 1.66 -1.54 0.00 0.00 0.00 175.10 175.21 1rm6 n SER 569 N 4.80 3.20 0.00 3.32 3.41 0.55 -1.46 113.62 127.44 1rm6 n SER 569 Ca 0.09 1.05 0.00 0.00 -0.26 0.00 0.00 58.87 59.75 1rm6 n SER 569 Cb 0.48 -1.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.02 1rm6 n SER 569 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rm6 n GLY 570 N 3.69 0.44 3.87 5.00 0.00 -1.26 -5.02 105.19 111.90 1rm6 n GLY 570 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1rm6 n GLY 570 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1rm6 s SER 571 N -2.09 6.54 0.00 1.61 0.15 -0.53 -4.96 113.70 114.41 1rm6 s SER 571 Ca 0.00 1.26 0.28 0.00 0.70 0.00 0.00 55.95 58.20 1rm6 s SER 571 Cb 0.00 -2.38 1.15 0.00 -1.71 0.00 0.00 66.02 63.09 1rm6 s SER 571 CO 0.00 -0.47 1.85 0.00 1.20 0.00 0.00 173.24 175.82 1rm6 n GLN 572 N -1.43 0.20 -3.22 5.44 10.64 -1.26 -4.75 117.38 122.99 1rm6 n GLN 572 Ca 0.04 -0.04 -0.40 0.00 -1.83 0.00 0.00 57.00 54.77 1rm6 n GLN 572 Cb 0.54 -1.50 -0.07 0.00 -0.86 0.00 0.00 30.24 28.35 1rm6 n GLN 572 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1rm6 s ASP 573 N -2.83 6.48 0.63 2.61 -1.08 -1.26 -4.96 116.67 116.25 1rm6 s ASP 573 Ca 0.19 0.57 0.42 0.00 -0.52 0.00 0.00 52.55 53.21 1rm6 s ASP 573 Cb 0.19 -2.29 2.29 0.00 -1.46 0.00 0.00 42.92 41.65 1rm6 s ASP 573 CO 0.54 -0.27 2.29 -0.65 0.52 0.00 0.00 175.17 177.60 1rm6 h PRO 574 N 7.89 0.00 0.00 4.34 0.11 -1.96 -3.41 132.00 138.96 1rm6 h PRO 574 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1rm6 h PRO 574 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1rm6 h PRO 574 CO 0.73 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.93 1rm6 n GLY 575 N -1.10 0.08 3.31 -0.55 0.00 -1.26 -4.55 105.19 101.12 1rm6 n GLY 575 Ca -0.03 -1.49 -0.29 0.00 0.00 0.00 0.00 46.02 44.21 1rm6 n GLY 575 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rm6 s LEU 576 N 0.00 2.13 0.71 0.99 1.43 0.27 -4.94 118.68 119.27 1rm6 s LEU 576 Ca 0.00 -0.53 -0.11 0.00 -1.03 0.00 0.00 54.13 52.46 1rm6 s LEU 576 Cb 0.00 -1.23 0.02 0.00 0.03 0.00 0.00 46.19 45.01 1rm6 s LEU 576 CO 0.00 0.26 1.07 -0.94 0.23 0.00 0.00 176.35 176.96 1rm6 s SER 577 N -1.02 5.23 0.20 2.29 1.04 -1.26 -0.13 113.70 120.04 1rm6 s SER 577 Ca 0.10 1.56 -0.11 0.00 0.48 0.00 0.00 55.95 57.98 1rm6 s SER 577 Cb -0.10 -2.41 0.24 0.00 0.10 0.00 0.00 66.02 63.86 1rm6 s SER 577 CO 0.01 -1.53 1.71 0.15 0.98 0.00 0.00 173.24 174.56 1rm6 h PHE 578 N -0.78 0.20 -0.46 5.02 3.57 -1.40 -1.51 116.94 121.57 1rm6 h PHE 578 Ca -0.44 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.03 1rm6 h PHE 578 Cb 1.22 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.94 1rm6 h PHE 578 CO 0.59 -0.01 0.06 0.37 -2.23 0.00 0.00 178.31 177.09 1rm6 h GLN 579 N 0.26 0.72 -0.64 1.11 5.75 -1.92 0.11 115.11 120.50 1rm6 h GLN 579 Ca 0.28 -0.16 -0.04 0.00 -0.15 0.00 0.00 58.65 58.58 1rm6 h GLN 579 Cb 0.40 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.82 1rm6 h GLN 579 CO -0.36 0.70 0.22 0.93 -2.65 0.00 0.00 178.83 177.67 1rm6 h GLU 580 N 0.69 0.95 -0.18 1.69 5.08 -1.74 -1.75 114.58 119.32 1rm6 h GLU 580 Ca 0.15 -0.17 -0.14 0.00 -1.00 0.00 0.00 59.36 58.19 1rm6 h GLU 580 Cb 0.34 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1rm6 h GLU 580 CO 0.01 0.80 -0.50 0.28 -1.00 0.00 0.00 179.01 178.60 1rm6 h VAL 581 N 0.93 1.32 -0.37 3.13 2.07 -0.31 -1.93 116.25 121.10 1rm6 h VAL 581 Ca 0.21 -1.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.00 1rm6 h VAL 581 Cb 0.23 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 1rm6 h VAL 581 CO -0.01 0.53 0.23 0.58 0.02 0.00 0.00 177.57 178.92 1rm6 h VAL 582 N 0.38 1.12 -0.62 2.57 2.07 -0.43 0.41 116.25 121.74 1rm6 h VAL 582 Ca 0.02 -0.26 0.02 0.00 0.82 0.00 0.00 66.70 67.30 1rm6 h VAL 582 Cb 1.01 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 31.36 1rm6 h VAL 582 CO 0.09 0.12 0.39 0.11 0.02 0.00 0.00 177.57 178.29 1rm6 h LYS 583 N 0.49 0.75 -0.61 1.57 1.57 -1.19 -1.01 116.57 118.14 1rm6 h LYS 583 Ca 0.13 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 1rm6 h LYS 583 Cb -0.01 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.10 1rm6 h LYS 583 CO -0.03 0.50 0.12 0.00 -0.57 0.00 0.00 179.45 179.47 1rm6 h ALA 584 N 1.26 1.07 0.00 3.86 0.00 -0.92 -2.77 119.26 121.76 1rm6 h ALA 584 Ca 0.24 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1rm6 h ALA 584 Cb -0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1rm6 h ALA 584 CO -0.09 0.61 -0.12 0.00 0.00 0.00 0.00 179.25 179.65 1rm6 h ALA 585 N 1.21 1.02 0.00 0.00 0.00 -0.20 -2.74 119.26 118.55 1rm6 h ALA 585 Ca 0.19 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1rm6 h ALA 585 Cb 0.37 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1rm6 h ALA 585 CO 0.01 0.16 -0.41 0.52 0.00 0.00 0.00 179.25 179.52 1rm6 h MET 586 N 0.00 0.00 -6.58 0.00 2.07 -0.91 -3.41 114.93 106.10 1rm6 h MET 586 Ca -0.00 0.00 -0.54 0.00 -2.07 0.00 0.00 59.70 57.09 1rm6 h MET 586 Cb 0.64 0.00 0.05 0.00 -1.87 0.00 0.00 31.60 30.42 1rm6 h MET 586 CO 0.02 0.41 0.99 0.28 1.07 0.00 0.00 176.91 179.67 1rm6 n VAL 587 N -3.49 0.09 -2.07 -2.22 0.31 -1.04 -0.50 118.33 109.42 1rm6 n VAL 587 Ca 0.00 -0.02 -0.20 0.00 -0.01 0.00 0.00 64.34 64.11 1rm6 n VAL 587 Cb 0.55 -1.91 -0.04 0.00 -0.91 0.00 0.00 33.84 31.53 1rm6 n VAL 587 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1rm6 n ASP 588 N 4.27 -5.58 0.02 4.52 10.43 -1.26 -4.68 116.55 124.27 1rm6 n ASP 588 Ca 0.17 0.20 0.00 0.00 2.57 0.00 0.00 54.79 57.73 1rm6 n ASP 588 Cb 0.34 -4.77 0.00 0.00 1.84 0.00 0.00 41.12 38.53 1rm6 n ASP 588 CO 0.00 0.00 0.00 -0.24 -1.07 0.00 0.00 177.20 175.89 1rm6 n SER 589 N -1.71 -0.14 -0.13 -2.24 2.88 -0.47 -5.15 113.62 106.66 1rm6 n SER 589 Ca -0.22 0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.38 1rm6 n SER 589 Cb 0.67 0.28 0.00 0.00 -0.75 0.00 0.00 64.21 64.41 1rm6 n SER 589 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1rm6 n GLY 590 N 0.64 -0.77 3.12 0.46 0.00 0.35 -4.86 105.19 104.13 1rm6 n GLY 590 Ca 0.00 -1.14 -0.55 0.00 0.00 0.00 0.00 46.02 44.33 1rm6 n GLY 590 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1rm6 n THR 591 N -0.26 0.00 -3.53 2.61 -1.04 -1.26 -4.74 114.28 106.07 1rm6 n THR 591 Ca 0.00 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.64 1rm6 n THR 591 Cb 0.00 -0.28 -0.07 0.00 -1.82 0.00 0.00 70.33 68.16 1rm6 n THR 591 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1rm6 s ILE 592 N 1.66 5.30 -0.06 12.58 1.01 -0.02 -4.97 121.20 136.70 1rm6 s ILE 592 Ca 0.85 0.55 0.02 0.00 0.00 0.00 0.00 60.65 62.07 1rm6 s ILE 592 Cb -1.21 -3.64 0.01 0.00 0.01 0.00 0.00 42.46 37.64 1rm6 s ILE 592 CO 0.62 0.37 -0.11 0.42 0.00 0.00 0.00 174.94 176.24 1rm6 s THR 593 N 0.61 1.06 0.21 2.92 -4.23 -1.26 -0.87 115.64 114.08 1rm6 s THR 593 Ca 0.16 -0.44 0.05 0.00 -1.18 0.00 0.00 61.69 60.28 1rm6 s THR 593 Cb -0.13 -0.97 -0.05 0.00 1.34 0.00 0.00 72.50 72.69 1rm6 s THR 593 CO 0.04 0.34 -0.07 0.68 -0.54 0.00 0.00 174.62 175.07 1rm6 s VAL 594 N 0.62 1.35 -0.02 2.29 -7.23 -0.53 -4.99 120.40 111.88 1rm6 s VAL 594 Ca -0.13 -2.10 0.03 0.00 -1.81 0.00 0.00 61.98 57.97 1rm6 s VAL 594 Cb -0.15 -2.17 -0.00 0.00 0.56 0.00 0.00 36.38 34.62 1rm6 s VAL 594 CO 0.03 -0.49 -0.11 -0.75 -0.31 0.00 0.00 175.10 173.47 1rm6 s LYS 595 N -3.76 0.98 0.03 4.82 2.20 -1.26 -1.62 119.74 121.12 1rm6 s LYS 595 Ca 0.24 -0.37 0.07 0.00 -0.36 0.00 0.00 55.97 55.55 1rm6 s LYS 595 Cb 0.03 -0.92 -0.02 0.00 -1.51 0.00 0.00 37.83 35.40 1rm6 s LYS 595 CO 0.07 0.19 -0.20 0.20 -0.36 0.00 0.00 175.35 175.25 1rm6 s GLY 596 N -0.06 1.05 0.13 5.54 0.00 0.24 -4.54 107.32 109.68 1rm6 s GLY 596 Ca 0.01 -0.98 -0.00 0.00 0.00 0.00 0.00 44.72 43.75 1rm6 s GLY 596 CO 0.00 -0.89 0.03 -0.51 0.00 0.00 0.00 173.10 171.72 1rm6 s THR 597 N -0.71 0.31 -0.04 0.90 -4.23 -1.26 -0.85 115.64 109.76 1rm6 s THR 597 Ca 0.07 -1.92 -0.04 0.00 -1.18 0.00 0.00 61.69 58.61 1rm6 s THR 597 Cb -0.08 -2.00 0.01 0.00 1.34 0.00 0.00 72.50 71.76 1rm6 s THR 597 CO 0.01 -0.54 0.12 -0.47 -0.54 0.00 0.00 174.62 173.20 1rm6 s TYR 598 N -3.90 -0.10 -0.02 3.99 5.04 -0.63 -4.46 117.35 117.27 1rm6 s TYR 598 Ca 0.22 0.25 -0.01 0.00 -2.44 0.00 0.00 57.07 55.10 1rm6 s TYR 598 Cb 0.07 0.03 0.02 0.00 0.35 0.00 0.00 41.96 42.43 1rm6 s TYR 598 CO 0.01 -0.09 0.04 0.99 -1.34 0.00 0.00 175.55 175.16 1rm6 s THR 599 N -0.13 -0.03 0.12 4.34 2.01 -1.26 -0.39 115.64 120.30 1rm6 s THR 599 Ca -0.02 0.12 -0.31 0.00 0.31 0.00 0.00 61.69 61.79 1rm6 s THR 599 Cb -0.02 -0.08 -0.08 0.00 0.01 0.00 0.00 72.50 72.34 1rm6 s THR 599 CO 0.00 0.05 1.37 0.00 -0.69 0.00 0.00 174.62 175.35 1rm6 s PRO 601 N 1.00 2.67 0.38 0.00 0.02 -1.26 -4.91 135.00 132.89 1rm6 s PRO 601 Ca 0.63 1.88 0.12 0.00 0.02 0.00 0.00 61.00 63.65 1rm6 s PRO 601 Cb -0.36 -1.88 0.91 0.00 0.02 0.00 0.00 34.50 33.19 1rm6 s PRO 601 CO 0.31 -1.46 1.87 0.00 -0.33 0.00 0.00 177.00 177.39 1rm6 h THR 602 N 0.52 0.78 0.00 0.99 1.03 -1.98 -0.93 112.91 113.33 1rm6 h THR 602 Ca -0.50 -0.20 0.00 0.00 -0.01 0.00 0.00 66.41 65.70 1rm6 h THR 602 Cb 1.31 0.14 0.00 0.00 -1.07 0.00 0.00 68.15 68.53 1rm6 h THR 602 CO 0.53 0.11 0.00 1.05 -0.01 0.00 0.00 175.52 177.20 1rm6 h GLU 603 N 0.59 0.00 -0.50 0.00 9.09 -1.90 -1.09 114.58 120.76 1rm6 h GLU 603 Ca 0.45 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.86 1rm6 h GLU 603 Cb 0.86 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.96 1rm6 h GLU 603 CO -0.20 0.00 0.00 1.19 0.05 0.00 0.00 179.01 180.05 1rm6 n PHE 604 N -2.57 0.66 -1.16 2.06 3.01 -0.35 -4.32 117.46 114.78 1rm6 n PHE 604 Ca -0.01 -0.33 -0.13 0.00 1.01 0.00 0.00 57.45 58.00 1rm6 n PHE 604 Cb 0.13 0.00 0.24 0.00 -0.01 0.00 0.00 39.48 39.85 1rm6 n PHE 604 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1rm6 n GLN 605 N 1.25 2.90 0.00 -1.08 6.02 -0.41 -3.36 117.38 122.70 1rm6 n GLN 605 Ca 0.20 -3.06 0.00 0.00 -0.01 0.00 0.00 57.00 54.12 1rm6 n GLN 605 Cb 0.52 -2.15 0.00 0.00 1.02 0.00 0.00 30.24 29.63 1rm6 n GLN 605 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1rm6 n GLY 606 N -0.68 -1.26 3.57 1.08 0.00 -1.26 -4.45 105.19 102.19 1rm6 n GLY 606 Ca 0.48 -1.27 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 1rm6 n GLY 606 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rm6 s ASP 607 N -4.00 6.35 0.65 1.61 -1.08 -1.26 -4.91 116.67 114.03 1rm6 s ASP 607 Ca 0.00 0.09 0.34 0.00 -0.52 0.00 0.00 52.55 52.47 1rm6 s ASP 607 Cb 0.00 -2.28 1.89 0.00 -1.46 0.00 0.00 42.92 41.08 1rm6 s ASP 607 CO 0.00 -0.46 2.10 0.07 0.52 0.00 0.00 175.17 177.41 1rm6 h LYS 608 N 8.38 0.00 -0.01 4.34 2.10 -1.93 -0.27 116.57 129.18 1rm6 h LYS 608 Ca -0.28 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.37 1rm6 h LYS 608 Cb 1.13 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.46 1rm6 h LYS 608 CO 0.77 0.00 -0.29 1.63 -2.00 0.00 0.00 179.45 179.56 1rm6 n LYS 609 N -3.17 1.15 -3.95 0.07 4.76 -1.26 -4.65 118.16 111.11 1rm6 n LYS 609 Ca -0.01 -0.81 -0.32 0.00 -2.87 0.00 0.00 58.31 54.29 1rm6 n LYS 609 Cb 0.28 -1.48 -0.14 0.00 -1.84 0.00 0.00 35.03 31.85 1rm6 n LYS 609 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1rm6 s ILE 610 N -2.41 2.58 0.23 -0.18 1.01 -0.11 -5.00 121.20 117.32 1rm6 s ILE 610 Ca 0.24 -2.42 -0.06 0.00 0.00 0.00 0.00 60.65 58.41 1rm6 s ILE 610 Cb 0.19 -2.85 0.19 0.00 0.01 0.00 0.00 42.46 40.00 1rm6 s ILE 610 CO 0.50 -0.65 1.77 0.03 0.00 0.00 0.00 174.94 176.59 1rm6 h ARG 611 N 7.56 0.56 0.00 2.79 3.08 -1.82 -1.34 114.38 125.20 1rm6 h ARG 611 Ca -0.06 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.95 1rm6 h ARG 611 Cb 1.01 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.93 1rm6 h ARG 611 CO 0.58 0.37 0.00 0.78 -1.07 0.00 0.00 179.97 180.63 1rm6 h GLY 612 N 0.58 0.00 2.00 0.04 0.00 -1.94 -2.68 103.07 101.07 1rm6 h GLY 612 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 1rm6 h GLY 612 CO -0.30 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.10 1rm6 n SER 613 N -3.02 0.48 0.22 0.19 3.41 -0.51 -1.87 113.62 112.52 1rm6 n SER 613 Ca -0.01 0.62 0.05 0.00 -0.26 0.00 0.00 58.87 59.27 1rm6 n SER 613 Cb 0.18 -0.72 0.48 0.00 -0.26 0.00 0.00 64.21 63.89 1rm6 n SER 613 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rm6 h ALA 614 N 2.32 1.55 -1.91 7.33 0.00 -1.61 -3.30 119.26 123.64 1rm6 h ALA 614 Ca 0.00 -0.21 -0.58 0.00 0.00 0.00 0.00 54.91 54.12 1rm6 h ALA 614 Cb 0.32 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.99 1rm6 h ALA 614 CO 0.00 0.29 0.78 0.42 0.00 0.00 0.00 179.25 180.74 1rm6 s ILE 615 N -4.44 4.44 0.00 0.00 -1.09 -0.78 -2.18 121.20 117.14 1rm6 s ILE 615 Ca -0.03 1.35 0.00 0.00 -2.23 0.00 0.00 60.65 59.73 1rm6 s ILE 615 Cb 0.15 -4.45 0.00 0.00 -1.58 0.00 0.00 42.46 36.58 1rm6 s ILE 615 CO 0.69 -0.68 0.00 0.61 -1.23 0.00 0.00 174.94 174.33 1rm6 n GLY 616 N 4.40 1.98 3.79 6.18 0.00 -1.26 -4.81 105.19 115.47 1rm6 n GLY 616 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 1rm6 n GLY 616 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rm6 s ALA 617 N -2.26 3.42 0.20 4.61 0.00 -0.93 -4.92 121.76 121.87 1rm6 s ALA 617 Ca 0.00 0.33 -0.23 0.00 0.00 0.00 0.00 51.96 52.07 1rm6 s ALA 617 Cb 0.00 -2.95 0.05 0.00 0.00 0.00 0.00 23.12 20.22 1rm6 s ALA 617 CO 0.00 0.29 0.72 -0.08 0.00 0.00 0.00 175.76 176.69 1rm6 s THR 618 N -1.29 0.00 0.24 0.00 -1.32 -1.21 -2.41 115.64 109.65 1rm6 s THR 618 Ca 0.39 -0.52 0.17 0.00 -1.21 0.00 0.00 61.69 60.52 1rm6 s THR 618 Cb -0.21 -1.56 0.11 0.00 -1.51 0.00 0.00 72.50 69.33 1rm6 s THR 618 CO 0.25 0.00 1.75 0.24 -2.21 0.00 0.00 174.62 174.65 1rm6 h MET 619 N 2.00 0.00 -1.28 7.08 2.86 -1.81 -3.42 114.93 120.35 1rm6 h MET 619 Ca -0.25 0.00 0.31 0.00 -2.06 0.00 0.00 59.70 57.70 1rm6 h MET 619 Cb 1.27 0.00 -0.17 0.00 0.06 0.00 0.00 31.60 32.75 1rm6 h MET 619 CO 0.29 0.40 0.89 0.20 1.06 0.00 0.00 176.91 179.75 1rm6 s GLY 620 N -4.36 -0.32 -0.01 8.32 0.00 -1.26 -4.70 107.32 104.99 1rm6 s GLY 620 Ca -0.01 1.41 0.05 0.00 0.00 0.00 0.00 44.72 46.17 1rm6 s GLY 620 CO 0.70 0.43 -0.14 -1.36 0.00 0.00 0.00 173.10 172.73 1rm6 s PHE 621 N -2.26 2.69 -0.06 1.90 0.40 -1.26 -0.85 117.98 118.53 1rm6 s PHE 621 Ca 0.12 -0.17 -0.20 0.00 -0.60 0.00 0.00 56.93 56.08 1rm6 s PHE 621 Cb 0.01 -1.57 -0.05 0.00 0.51 0.00 0.00 43.02 41.93 1rm6 s PHE 621 CO -0.04 0.24 0.57 0.00 0.70 0.00 0.00 175.22 176.69 1rm6 s TYR 623 N 0.29 2.68 -0.00 0.00 1.51 -1.11 -1.82 117.35 118.90 1rm6 s TYR 623 Ca 0.30 -0.17 0.01 0.00 -1.01 0.00 0.00 57.07 56.20 1rm6 s TYR 623 Cb -0.17 -1.54 -0.00 0.00 -0.11 0.00 0.00 41.96 40.14 1rm6 s TYR 623 CO 0.15 0.27 -0.03 0.00 -1.11 0.00 0.00 175.55 174.83 1rm6 s ALA 624 N -0.90 0.24 -0.06 3.71 0.00 -0.30 -0.27 121.76 124.18 1rm6 s ALA 624 Ca 0.15 -0.10 0.05 0.00 0.00 0.00 0.00 51.96 52.06 1rm6 s ALA 624 Cb -0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 22.92 1rm6 s ALA 624 CO 0.05 0.05 -0.23 0.00 0.00 0.00 0.00 175.76 175.63 1rm6 s ALA 625 N 0.01 2.27 -0.01 0.00 0.00 -0.36 -1.54 121.76 122.14 1rm6 s ALA 625 Ca 0.00 -1.03 -0.03 0.00 0.00 0.00 0.00 51.96 50.90 1rm6 s ALA 625 Cb -0.02 -0.75 -0.00 0.00 0.00 0.00 0.00 23.12 22.35 1rm6 s ALA 625 CO -0.00 0.43 0.06 1.14 0.00 0.00 0.00 175.76 177.39 1rm6 s GLN 626 N -0.24 0.25 -0.09 0.00 -2.07 -0.51 -0.84 119.66 116.16 1rm6 s GLN 626 Ca -0.01 -0.23 0.03 0.00 -1.82 0.00 0.00 55.36 53.33 1rm6 s GLN 626 Cb -0.13 0.10 -0.01 0.00 -1.09 0.00 0.00 33.01 31.88 1rm6 s GLN 626 CO 0.03 -0.05 -0.19 0.08 -1.32 0.00 0.00 175.29 173.84 1rm6 s VAL 627 N -0.76 2.59 -0.08 3.63 1.01 0.33 -1.45 120.40 125.67 1rm6 s VAL 627 Ca -0.08 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.09 1rm6 s VAL 627 Cb -0.05 -2.02 -0.00 0.00 0.00 0.00 0.00 36.38 34.31 1rm6 s VAL 627 CO 0.00 0.56 -0.24 -0.69 0.00 0.00 0.00 175.10 174.73 1rm6 s VAL 628 N -0.03 2.02 -0.16 2.92 1.01 0.17 -0.89 120.40 125.44 1rm6 s VAL 628 Ca -0.05 -1.02 -0.04 0.00 0.00 0.00 0.00 61.98 60.87 1rm6 s VAL 628 Cb -0.14 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 1rm6 s VAL 628 CO 0.05 0.56 -0.02 -0.70 0.00 0.00 0.00 175.10 174.98 1rm6 s GLU 629 N 0.16 3.72 0.13 2.72 2.12 -0.27 -1.27 118.70 126.01 1rm6 s GLU 629 Ca -0.13 -0.49 -0.04 0.00 0.36 0.00 0.00 54.97 54.67 1rm6 s GLU 629 Cb -0.16 -2.96 -0.03 0.00 0.26 0.00 0.00 34.13 31.24 1rm6 s GLU 629 CO 0.07 0.25 0.13 0.00 -0.54 0.00 0.00 175.26 175.17 1rm6 s ALA 630 N 0.36 0.46 0.15 6.30 0.00 -0.64 -0.85 121.76 127.54 1rm6 s ALA 630 Ca -0.03 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 50.77 1rm6 s ALA 630 Cb -0.14 0.78 -0.04 0.00 0.00 0.00 0.00 23.12 23.71 1rm6 s ALA 630 CO 0.03 -0.53 -0.04 -1.54 0.00 0.00 0.00 175.76 173.68 1rm6 s SER 631 N -2.99 1.34 -0.04 0.00 1.04 -0.38 -0.94 113.70 111.73 1rm6 s SER 631 Ca 0.19 -1.10 0.02 0.00 0.48 0.00 0.00 55.95 55.54 1rm6 s SER 631 Cb 0.06 0.08 0.01 0.00 0.10 0.00 0.00 66.02 66.27 1rm6 s SER 631 CO -0.01 -0.49 -0.08 -0.69 0.98 0.00 0.00 173.24 172.96 1rm6 s VAL 632 N -3.57 0.75 -0.39 5.02 1.01 -0.62 -0.65 120.40 121.94 1rm6 s VAL 632 Ca 0.19 -0.27 -0.21 0.00 0.00 0.00 0.00 61.98 61.69 1rm6 s VAL 632 Cb 0.05 -0.71 0.01 0.00 0.00 0.00 0.00 36.38 35.73 1rm6 s VAL 632 CO 0.01 0.26 0.67 -0.62 0.00 0.00 0.00 175.10 175.42 1rm6 s ASP 633 N 0.66 6.40 0.55 3.32 -1.08 0.07 -4.86 116.67 121.72 1rm6 s ASP 633 Ca -0.10 -0.02 0.34 0.00 -0.52 0.00 0.00 52.55 52.24 1rm6 s ASP 633 Cb -0.13 -2.34 1.38 0.00 -1.46 0.00 0.00 42.92 40.37 1rm6 s ASP 633 CO 0.01 -0.70 1.99 -0.33 0.52 0.00 0.00 175.17 176.66 1rm6 h GLU 634 N 8.66 0.00 -0.25 4.34 5.08 -1.93 0.78 114.58 131.26 1rm6 h GLU 634 Ca -0.26 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 57.91 1rm6 h GLU 634 Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1rm6 h GLU 634 CO 0.87 0.00 -0.61 0.82 -1.00 0.00 0.00 179.01 179.09 1rm6 h ILE 635 N 0.00 1.27 0.00 3.13 2.04 -1.98 -3.34 117.51 118.64 1rm6 h ILE 635 Ca 0.00 -1.80 0.00 0.00 1.00 0.00 0.00 64.86 64.06 1rm6 h ILE 635 Cb 0.50 1.73 0.00 0.00 -0.74 0.00 0.00 36.82 38.31 1rm6 h ILE 635 CO 0.00 0.58 -1.31 0.35 0.00 0.00 0.00 178.15 177.77 1rm6 n THR 636 N -3.98 0.00 -0.92 -0.27 -2.24 -1.14 -4.99 114.28 100.74 1rm6 n THR 636 Ca -0.05 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1rm6 n THR 636 Cb 0.66 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 69.37 1rm6 n THR 636 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rm6 n GLY 637 N 1.53 0.78 3.72 3.38 0.00 0.27 -4.77 105.19 110.10 1rm6 n GLY 637 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1rm6 n GLY 637 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1rm6 s LYS 638 N -0.08 4.46 -0.17 1.61 2.20 -1.19 -4.29 119.74 122.29 1rm6 s LYS 638 Ca 0.00 1.79 -0.12 0.00 -0.36 0.00 0.00 55.97 57.28 1rm6 s LYS 638 Cb 0.00 -3.32 -0.05 0.00 -1.51 0.00 0.00 37.83 32.96 1rm6 s LYS 638 CO 0.00 -0.19 0.22 0.08 -0.36 0.00 0.00 175.35 175.11 1rm6 s VAL 639 N 0.70 5.35 -0.16 4.02 1.01 -1.26 -0.75 120.40 129.31 1rm6 s VAL 639 Ca 0.57 0.40 0.01 0.00 0.00 0.00 0.00 61.98 62.95 1rm6 s VAL 639 Cb -0.30 -3.56 0.01 0.00 0.00 0.00 0.00 36.38 32.53 1rm6 s VAL 639 CO 0.31 0.43 -0.19 -0.89 0.00 0.00 0.00 175.10 174.76 1rm6 s THR 640 N 0.30 2.30 -0.21 3.92 2.01 0.17 -4.99 115.64 119.15 1rm6 s THR 640 Ca 0.13 -0.88 -0.23 0.00 0.31 0.00 0.00 61.69 61.02 1rm6 s THR 640 Cb -0.12 -1.96 -0.02 0.00 0.01 0.00 0.00 72.50 70.42 1rm6 s THR 640 CO 0.02 0.53 0.73 0.00 -0.69 0.00 0.00 174.62 175.20 1rm6 s ALA 641 N 0.97 3.57 -0.21 7.40 0.00 -1.26 -1.25 121.76 130.97 1rm6 s ALA 641 Ca -0.03 -0.18 -0.11 0.00 0.00 0.00 0.00 51.96 51.64 1rm6 s ALA 641 Cb -0.15 -3.11 -0.19 0.00 0.00 0.00 0.00 23.12 19.67 1rm6 s ALA 641 CO -0.04 -0.69 0.03 0.72 0.00 0.00 0.00 175.76 175.77 1rm6 n HIS 642 N 5.38 0.63 -3.64 0.00 8.25 -0.03 -3.88 115.22 121.94 1rm6 n HIS 642 Ca 0.02 0.20 -0.16 0.00 -0.26 0.00 0.00 57.72 57.52 1rm6 n HIS 642 Cb 0.49 -1.07 -0.07 0.00 1.12 0.00 0.00 29.99 30.45 1rm6 n HIS 642 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1rm6 s LYS 643 N -2.48 0.86 -0.05 -0.41 2.20 -1.15 -2.06 119.74 116.66 1rm6 s LYS 643 Ca -0.31 0.04 0.03 0.00 -0.36 0.00 0.00 55.97 55.37 1rm6 s LYS 643 Cb 0.09 0.40 0.00 0.00 -1.51 0.00 0.00 37.83 36.81 1rm6 s LYS 643 CO 0.61 -0.26 -0.14 0.08 -0.36 0.00 0.00 175.35 175.29 1rm6 s VAL 644 N -1.25 1.20 -0.21 4.02 1.01 0.04 -1.12 120.40 124.09 1rm6 s VAL 644 Ca -0.12 -0.57 -0.04 0.00 0.00 0.00 0.00 61.98 61.25 1rm6 s VAL 644 Cb -0.03 -1.06 -0.01 0.00 0.00 0.00 0.00 36.38 35.28 1rm6 s VAL 644 CO 0.07 0.36 -0.04 0.26 0.00 0.00 0.00 175.10 175.75 1rm6 s TRP 645 N 0.29 2.96 -0.06 5.22 0.51 -0.07 -0.76 118.94 127.02 1rm6 s TRP 645 Ca -0.08 -0.87 0.01 0.00 -2.12 0.00 0.00 56.10 53.05 1rm6 s TRP 645 Cb -0.12 -2.09 0.02 0.00 -0.81 0.00 0.00 33.47 30.46 1rm6 s TRP 645 CO 0.02 -0.50 -0.09 0.54 -0.51 0.00 0.00 176.95 176.42 1rm6 s VAL 646 N 1.38 0.88 -0.18 4.03 0.11 -0.29 -0.52 120.40 125.82 1rm6 s VAL 646 Ca 0.05 -0.31 -0.03 0.00 -2.93 0.00 0.00 61.98 58.75 1rm6 s VAL 646 Cb -0.14 -0.85 -0.02 0.00 -1.53 0.00 0.00 36.38 33.84 1rm6 s VAL 646 CO -0.02 0.30 -0.05 0.00 -3.33 0.00 0.00 175.10 172.00 1rm6 s ALA 647 N 0.88 2.87 -0.10 1.54 0.00 -0.02 -0.56 121.76 126.37 1rm6 s ALA 647 Ca -0.11 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 50.91 1rm6 s ALA 647 Cb -0.15 -1.57 0.01 0.00 0.00 0.00 0.00 23.12 21.40 1rm6 s ALA 647 CO 0.01 -0.04 -0.21 0.54 0.00 0.00 0.00 175.76 176.06 1rm6 s VAL 648 N 0.82 1.83 -0.53 0.00 0.11 -0.40 -1.22 120.40 121.01 1rm6 s VAL 648 Ca -0.02 -0.87 -0.22 0.00 -2.93 0.00 0.00 61.98 57.95 1rm6 s VAL 648 Cb -0.15 -1.61 0.05 0.00 -1.53 0.00 0.00 36.38 33.15 1rm6 s VAL 648 CO 0.02 0.51 0.78 -0.62 -3.33 0.00 0.00 175.10 172.46 1rm6 s ASP 649 N 0.56 6.28 -0.09 3.54 3.68 0.63 -0.60 116.67 130.67 1rm6 s ASP 649 Ca -0.15 -0.63 0.13 0.00 2.13 0.00 0.00 52.55 54.04 1rm6 s ASP 649 Cb -0.17 -2.36 0.41 0.00 -1.45 0.00 0.00 42.92 39.34 1rm6 s ASP 649 CO 0.05 -1.06 1.33 1.33 0.13 0.00 0.00 175.17 176.95 1rm6 n VAL 650 N 5.91 1.65 0.00 1.11 0.24 -0.70 -2.75 118.33 123.78 1rm6 n VAL 650 Ca -0.02 -1.46 0.00 0.00 -2.04 0.00 0.00 64.34 60.82 1rm6 n VAL 650 Cb 0.46 0.12 0.00 0.00 -1.47 0.00 0.00 33.84 32.95 1rm6 n VAL 650 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rm6 n GLY 651 N -0.06 1.87 3.58 7.63 0.00 -1.24 -0.89 105.19 116.08 1rm6 n GLY 651 Ca 0.16 -0.04 -0.05 0.00 0.00 0.00 0.00 46.02 46.09 1rm6 n GLY 651 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1rm6 s LYS 652 N 0.00 0.59 -0.52 1.61 2.47 -1.20 -0.68 119.74 122.02 1rm6 s LYS 652 Ca 0.00 1.28 -0.29 0.00 -1.56 0.00 0.00 55.97 55.41 1rm6 s LYS 652 Cb 0.00 0.48 0.03 0.00 -1.46 0.00 0.00 37.83 36.88 1rm6 s LYS 652 CO 0.00 -0.18 1.15 0.00 0.16 0.00 0.00 175.35 176.48 1rm6 s ALA 653 N 2.28 3.10 0.12 3.13 0.00 -1.26 -4.36 121.76 124.77 1rm6 s ALA 653 Ca -0.07 -0.62 -0.13 0.00 0.00 0.00 0.00 51.96 51.13 1rm6 s ALA 653 Cb -0.09 -3.94 -0.04 0.00 0.00 0.00 0.00 23.12 19.05 1rm6 s ALA 653 CO -0.18 -2.40 1.49 -0.07 0.00 0.00 0.00 175.76 174.59 1rm6 h LEU 654 N 11.46 0.83 -7.05 0.00 3.38 -1.94 -3.33 115.31 118.66 1rm6 h LEU 654 Ca -0.24 -0.42 -0.60 0.00 0.09 0.00 0.00 57.88 56.71 1rm6 h LEU 654 Cb 1.06 -0.23 -0.40 0.00 0.09 0.00 0.00 40.66 41.18 1rm6 h LEU 654 CO 1.15 1.07 -0.75 0.21 0.09 0.00 0.00 178.44 180.20 1rm6 s ASN 655 N -6.55 3.80 0.40 -0.43 3.84 -1.26 -0.40 114.94 114.33 1rm6 s ASN 655 Ca -0.12 -2.17 0.14 0.00 0.21 0.00 0.00 52.86 50.92 1rm6 s ASN 655 Cb 0.10 -0.94 0.98 0.00 -0.55 0.00 0.00 41.25 40.84 1rm6 s ASN 655 CO 0.84 -0.34 1.87 -0.65 -2.79 0.00 0.00 177.10 176.04 1rm6 h PRO 656 N 7.35 0.50 -0.19 0.43 0.11 -1.75 -0.03 132.00 138.41 1rm6 h PRO 656 Ca -0.06 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.02 1rm6 h PRO 656 Cb 0.97 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 1rm6 h PRO 656 CO 0.46 0.33 0.12 1.25 -0.21 0.00 0.00 178.00 179.95 1rm6 h LEU 657 N 0.51 0.23 -0.53 2.35 5.85 -1.90 -1.09 115.31 120.74 1rm6 h LEU 657 Ca 0.44 -0.04 -0.14 0.00 0.84 0.00 0.00 57.88 58.99 1rm6 h LEU 657 Cb 0.93 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 1rm6 h LEU 657 CO -0.18 0.20 -0.28 0.00 -0.34 0.00 0.00 178.44 177.84 1rm6 h ALA 658 N 1.04 0.71 -0.80 1.25 0.00 -1.54 -2.20 119.26 117.73 1rm6 h ALA 658 Ca 0.07 -0.41 0.03 0.00 0.00 0.00 0.00 54.91 54.60 1rm6 h ALA 658 Cb 0.01 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 1rm6 h ALA 658 CO -0.01 0.67 0.51 0.28 0.00 0.00 0.00 179.25 180.69 1rm6 h VAL 659 N 0.76 1.12 -0.15 0.00 2.07 -0.86 0.11 116.25 119.30 1rm6 h VAL 659 Ca 0.09 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 1rm6 h VAL 659 Cb 0.84 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1rm6 h VAL 659 CO 0.07 0.18 0.09 -0.33 0.02 0.00 0.00 177.57 177.60 1rm6 h GLU 660 N 0.99 0.20 -0.51 1.57 5.08 -1.01 -0.76 114.58 120.13 1rm6 h GLU 660 Ca 0.32 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.59 1rm6 h GLU 660 Cb 0.01 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 1rm6 h GLU 660 CO -0.11 0.19 0.02 0.78 -1.00 0.00 0.00 179.01 178.88 1rm6 h GLY 661 N 0.16 0.91 1.02 -3.84 0.00 -0.95 -0.48 103.07 99.88 1rm6 h GLY 661 Ca 0.05 -0.61 -0.07 0.00 0.00 0.00 0.00 47.33 46.71 1rm6 h GLY 661 CO -0.01 0.56 0.09 1.46 0.00 0.00 0.00 176.54 178.65 1rm6 h GLN 662 N 0.79 0.93 -0.51 4.80 1.08 -0.69 -0.25 115.11 121.26 1rm6 h GLN 662 Ca 0.15 -0.25 -0.11 0.00 -1.45 0.00 0.00 58.65 56.99 1rm6 h GLN 662 Cb 0.45 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.76 1rm6 h GLN 662 CO 0.02 0.89 -0.13 1.15 -0.95 0.00 0.00 178.83 179.81 1rm6 h THR 663 N 0.82 1.27 -0.66 -0.54 2.02 -0.86 -0.99 112.91 113.98 1rm6 h THR 663 Ca 0.17 -1.27 -0.04 0.00 0.77 0.00 0.00 66.41 66.03 1rm6 h THR 663 Cb 0.41 1.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 1rm6 h THR 663 CO 0.01 0.44 0.25 1.56 0.37 0.00 0.00 175.52 178.15 1rm6 h GLN 664 N 0.84 1.00 -0.83 6.66 4.20 -0.94 -0.59 115.11 125.45 1rm6 h GLN 664 Ca 0.13 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.61 1rm6 h GLN 664 Cb 0.69 -0.16 -0.04 0.00 0.30 0.00 0.00 27.48 28.28 1rm6 h GLN 664 CO 0.05 0.84 0.37 0.78 -0.67 0.00 0.00 178.83 180.21 1rm6 h GLY 665 N 0.94 1.29 0.64 3.46 0.00 -0.82 -0.96 103.07 107.62 1rm6 h GLY 665 Ca 0.22 -0.66 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 1rm6 h GLY 665 CO -0.01 0.62 -0.05 -1.33 0.00 0.00 0.00 176.54 175.78 1rm6 h GLY 666 N 1.19 0.16 1.01 4.60 0.00 -0.88 -1.11 103.07 108.04 1rm6 h GLY 666 Ca 0.28 -0.15 0.01 0.00 0.00 0.00 0.00 47.33 47.46 1rm6 h GLY 666 CO -0.03 0.14 0.45 -2.08 0.00 0.00 0.00 176.54 175.02 1rm6 h VAL 667 N -0.25 1.18 -0.59 4.60 2.07 -1.09 -2.37 116.25 119.80 1rm6 h VAL 667 Ca 0.01 -0.32 -0.07 0.00 0.82 0.00 0.00 66.70 67.14 1rm6 h VAL 667 Cb 0.51 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1rm6 h VAL 667 CO 0.01 0.17 0.10 -0.25 0.02 0.00 0.00 177.57 177.62 1rm6 h TRP 668 N 0.93 1.00 -0.78 1.57 7.01 -1.09 -0.19 115.95 124.40 1rm6 h TRP 668 Ca 0.25 -0.12 -0.04 0.00 2.11 0.00 0.00 58.89 61.09 1rm6 h TRP 668 Cb -0.11 -0.28 -0.04 0.00 -2.10 0.00 0.00 29.16 26.64 1rm6 h TRP 668 CO -0.03 0.85 0.34 1.98 -2.79 0.00 0.00 178.44 178.80 1rm6 h MET 669 N 0.90 1.14 -0.86 2.65 4.05 -0.96 -0.67 114.93 121.18 1rm6 h MET 669 Ca 0.18 -0.19 -0.02 0.00 -0.28 0.00 0.00 59.70 59.40 1rm6 h MET 669 Cb 0.39 -0.20 -0.04 0.00 -0.80 0.00 0.00 31.60 30.96 1rm6 h MET 669 CO 0.01 0.91 0.45 0.78 0.23 0.00 0.00 176.91 179.28 1rm6 h GLY 670 N 1.15 1.31 1.32 1.39 0.00 -0.85 -2.29 103.07 105.09 1rm6 h GLY 670 Ca 0.27 -0.61 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 1rm6 h GLY 670 CO -0.03 0.59 0.23 1.98 0.00 0.00 0.00 176.54 179.31 1rm6 h MET 671 N 1.22 0.88 -0.43 4.80 -1.53 0.11 0.22 114.93 120.20 1rm6 h MET 671 Ca 0.30 -0.14 -0.02 0.00 -3.44 0.00 0.00 59.70 56.40 1rm6 h MET 671 Cb 0.06 -0.15 -0.02 0.00 -0.55 0.00 0.00 31.60 30.94 1rm6 h MET 671 CO -0.04 0.73 0.19 0.78 0.14 0.00 0.00 176.91 178.70 1rm6 h GLY 672 N 0.98 0.67 1.39 1.39 0.00 -0.64 -0.84 103.07 106.02 1rm6 h GLY 672 Ca 0.20 -0.35 -0.09 0.00 0.00 0.00 0.00 47.33 47.10 1rm6 h GLY 672 CO -0.02 0.33 -0.09 -1.61 0.00 0.00 0.00 176.54 175.16 1rm6 h GLN 673 N 0.55 0.73 -0.26 4.80 4.15 -1.03 0.47 115.11 124.52 1rm6 h GLN 673 Ca 0.15 -0.23 -0.11 0.00 0.77 0.00 0.00 58.65 59.23 1rm6 h GLN 673 Cb 0.15 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.76 1rm6 h GLN 673 CO -0.02 0.81 -0.30 0.00 -1.93 0.00 0.00 178.83 177.40 1rm6 h ALA 674 N 1.23 1.00 0.00 3.38 0.00 -0.17 -3.36 119.26 121.34 1rm6 h ALA 674 Ca 0.12 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 1rm6 h ALA 674 Cb 0.55 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1rm6 h ALA 674 CO 0.03 0.59 -1.37 1.28 0.00 0.00 0.00 179.25 179.79 1rm6 n LEU 675 N -4.09 0.00 0.00 0.00 4.77 -0.36 0.16 117.00 117.49 1rm6 n LEU 675 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1rm6 n LEU 675 Cb 0.44 0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1rm6 n LEU 675 CO 0.43 0.13 0.00 -1.54 -1.33 0.00 0.00 177.39 175.08 1rm6 n SER 676 N -2.18 0.00 -4.75 -1.43 3.41 -0.32 -3.54 113.62 104.81 1rm6 n SER 676 Ca -0.08 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.14 1rm6 n SER 676 Cb 0.65 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.55 1rm6 n SER 676 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1rm6 s GLU 677 N 0.00 4.33 -0.28 4.33 2.02 0.00 -4.29 118.70 124.81 1rm6 s GLU 677 Ca 0.00 0.70 -0.24 0.00 0.02 0.00 0.00 54.97 55.45 1rm6 s GLU 677 Cb 0.00 -3.37 0.12 0.00 0.10 0.00 0.00 34.13 30.98 1rm6 s GLU 677 CO 0.00 0.30 0.99 -1.83 0.02 0.00 0.00 175.26 174.74 1rm6 s GLU 678 N 0.07 0.52 0.56 1.61 -1.05 -1.26 -4.49 118.70 114.67 1rm6 s GLU 678 Ca 0.31 0.66 -0.07 0.00 -0.15 0.00 0.00 54.97 55.72 1rm6 s GLU 678 Cb -0.18 0.24 -0.01 0.00 -0.44 0.00 0.00 34.13 33.74 1rm6 s GLU 678 CO 0.16 -0.07 0.89 0.95 0.95 0.00 0.00 175.26 178.14 1rm6 s THR 679 N 0.40 4.25 -0.11 1.83 -4.23 -0.74 -4.83 115.64 112.22 1rm6 s THR 679 Ca 0.01 0.23 -0.04 0.00 -1.18 0.00 0.00 61.69 60.71 1rm6 s THR 679 Cb -0.05 -3.66 0.05 0.00 1.34 0.00 0.00 72.50 70.18 1rm6 s THR 679 CO -0.07 -0.71 0.23 -0.69 -0.54 0.00 0.00 174.62 172.83 1rm6 s VAL 680 N -2.95 -0.20 0.13 2.29 1.01 -1.26 -4.78 120.40 114.63 1rm6 s VAL 680 Ca 0.52 0.23 0.10 0.00 0.00 0.00 0.00 61.98 62.83 1rm6 s VAL 680 Cb -0.11 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.86 1rm6 s VAL 680 CO 0.47 0.09 -0.23 -0.31 0.00 0.00 0.00 175.10 175.12 1rm6 s TYR 681 N 1.79 2.41 -0.25 5.22 1.51 -1.26 -0.75 117.35 126.02 1rm6 s TYR 681 Ca -0.04 -0.33 -0.02 0.00 -1.01 0.00 0.00 57.07 55.67 1rm6 s TYR 681 Cb -0.11 -1.28 0.08 0.00 -0.11 0.00 0.00 41.96 40.53 1rm6 s TYR 681 CO -0.08 0.37 0.08 0.34 -1.11 0.00 0.00 175.55 175.15 1rm6 s ASP 682 N -2.14 3.39 -1.45 2.29 3.68 0.20 -4.83 116.67 117.81 1rm6 s ASP 682 Ca 0.16 -1.18 -0.01 0.00 2.13 0.00 0.00 52.55 53.65 1rm6 s ASP 682 Cb -0.10 -0.63 0.01 0.00 -1.45 0.00 0.00 42.92 40.75 1rm6 s ASP 682 CO 0.08 -0.37 0.36 0.59 0.13 0.00 0.00 175.17 175.97 1rm6 n ASN 683 N 5.02 -0.25 0.00 -0.34 3.02 -1.26 -0.69 115.26 120.76 1rm6 n ASN 683 Ca -0.06 -1.05 0.00 0.00 -0.03 0.00 0.00 54.58 53.44 1rm6 n ASN 683 Cb 0.44 -2.78 0.00 0.00 -0.61 0.00 0.00 39.78 36.83 1rm6 n ASN 683 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rm6 n GLY 684 N -2.05 3.21 3.72 7.41 0.00 -1.26 -4.86 105.19 111.35 1rm6 n GLY 684 Ca -0.29 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 1rm6 n GLY 684 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rm6 s ARG 685 N -0.43 4.56 0.04 1.61 0.52 0.13 -4.45 118.95 120.92 1rm6 s ARG 685 Ca 0.00 1.26 -0.30 0.00 -0.52 0.00 0.00 55.73 56.17 1rm6 s ARG 685 Cb 0.00 -3.42 -0.05 0.00 0.52 0.00 0.00 34.95 32.00 1rm6 s ARG 685 CO 0.00 0.09 1.13 1.41 0.02 0.00 0.00 175.30 177.94 1rm6 s MET 686 N 0.57 4.47 -0.05 3.54 -2.45 -1.26 -0.63 119.30 123.49 1rm6 s MET 686 Ca 0.46 1.66 0.17 0.00 -1.25 0.00 0.00 55.69 56.73 1rm6 s MET 686 Cb -0.21 -3.38 -0.26 0.00 1.25 0.00 0.00 34.83 32.23 1rm6 s MET 686 CO 0.26 -0.19 0.32 0.28 1.05 0.00 0.00 175.02 176.74 1rm6 n VAL 687 N 3.91 0.20 -0.61 10.11 0.31 0.07 -4.57 118.33 127.75 1rm6 n VAL 687 Ca 0.08 -0.45 0.06 0.00 -0.01 0.00 0.00 64.34 64.02 1rm6 n VAL 687 Cb 0.48 -0.02 0.35 0.00 -0.91 0.00 0.00 33.84 33.74 1rm6 n VAL 687 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1rm6 n HIS 688 N -2.19 1.77 -0.14 3.52 1.44 -1.25 -4.81 115.22 113.57 1rm6 n HIS 688 Ca -0.07 -0.62 0.00 0.00 -2.01 0.00 0.00 57.72 55.02 1rm6 n HIS 688 Cb 0.55 -0.45 0.00 0.00 0.12 0.00 0.00 29.99 30.22 1rm6 n HIS 688 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1rm6 n GLY 689 N 0.55 1.60 3.68 -1.39 0.00 -1.26 -4.06 105.19 104.31 1rm6 n GLY 689 Ca 0.24 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.17 1rm6 n GLY 689 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rm6 s ASN 690 N 1.82 -0.17 -0.22 1.61 2.20 -1.26 -4.00 114.94 114.91 1rm6 s ASN 690 Ca 0.00 -0.75 0.10 0.00 -0.94 0.00 0.00 52.86 51.27 1rm6 s ASN 690 Cb 0.00 0.64 0.65 0.00 -2.00 0.00 0.00 41.25 40.54 1rm6 s ASN 690 CO 0.00 -1.20 1.56 -0.38 -2.94 0.00 0.00 177.10 174.13 1rm6 n ILE 691 N -0.40 2.34 -0.13 0.54 5.41 -1.26 -2.32 119.36 123.54 1rm6 n ILE 691 Ca -0.04 -1.20 -0.25 0.00 1.00 0.00 0.00 62.75 62.26 1rm6 n ILE 691 Cb 0.61 -0.36 -0.08 0.00 -0.71 0.00 0.00 39.64 39.10 1rm6 n ILE 691 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 1rm6 n LEU 692 N 0.31 1.94 0.01 1.39 7.94 -1.26 -4.60 117.00 122.73 1rm6 n LEU 692 Ca 0.27 0.34 0.13 0.00 -1.11 0.00 0.00 56.01 55.63 1rm6 n LEU 692 Cb 1.09 -0.80 0.35 0.00 0.53 0.00 0.00 43.42 44.60 1rm6 n LEU 692 CO 0.30 0.39 0.60 0.47 -1.11 0.00 0.00 177.39 178.04 1rm6 n ASP 693 N -4.29 0.38 -4.29 1.96 8.00 -1.25 -4.33 116.55 112.73 1rm6 n ASP 693 Ca -0.46 0.01 -0.42 0.00 0.71 0.00 0.00 54.79 54.64 1rm6 n ASP 693 Cb 0.81 0.01 -0.09 0.00 -0.02 0.00 0.00 41.12 41.83 1rm6 n ASP 693 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1rm6 s TYR 694 N -3.02 3.32 -1.37 1.24 5.04 -0.98 -4.87 117.35 116.71 1rm6 s TYR 694 Ca 0.11 -1.42 -0.13 0.00 -2.44 0.00 0.00 57.07 53.19 1rm6 s TYR 694 Cb 0.17 -3.12 0.09 0.00 0.35 0.00 0.00 41.96 39.45 1rm6 s TYR 694 CO 0.65 -0.86 2.02 0.54 -1.34 0.00 0.00 175.55 176.56 1rm6 n ARG 695 N 5.00 3.13 -1.80 4.97 1.74 -1.26 -4.53 116.66 123.91 1rm6 n ARG 695 Ca -0.10 -3.02 -0.42 0.00 -0.77 0.00 0.00 57.85 53.54 1rm6 n ARG 695 Cb 0.43 -3.21 -0.03 0.00 -1.02 0.00 0.00 32.46 28.63 1rm6 n ARG 695 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1rm6 s VAL 696 N 2.53 2.22 0.41 1.55 1.01 -1.26 -4.16 120.40 122.70 1rm6 s VAL 696 Ca 0.46 0.16 -0.27 0.00 0.00 0.00 0.00 61.98 62.33 1rm6 s VAL 696 Cb 0.10 -3.10 -0.10 0.00 0.00 0.00 0.00 36.38 33.28 1rm6 s VAL 696 CO -0.03 0.02 1.48 -2.84 0.00 0.00 0.00 175.10 173.72 1rm6 s PRO 697 N 0.83 3.91 0.66 2.72 0.02 -1.26 -5.01 135.00 136.87 1rm6 s PRO 697 Ca 0.71 2.54 -0.05 0.00 0.02 0.00 0.00 61.00 64.21 1rm6 s PRO 697 Cb -0.47 -2.83 0.05 0.00 0.02 0.00 0.00 34.50 31.26 1rm6 s PRO 697 CO 0.35 -0.68 0.96 0.95 -0.33 0.00 0.00 177.00 178.24 1rm6 s THR 698 N -1.15 2.65 0.36 0.99 -4.23 -1.26 -4.97 115.64 108.02 1rm6 s THR 698 Ca 0.56 -0.26 0.36 0.00 -1.18 0.00 0.00 61.69 61.18 1rm6 s THR 698 Cb -0.46 -3.11 0.39 0.00 1.34 0.00 0.00 72.50 70.67 1rm6 s THR 698 CO 0.61 -0.11 2.14 -0.29 -0.54 0.00 0.00 174.62 176.43 1rm6 h ILE 699 N -0.41 0.11 -0.16 2.99 2.10 -1.95 -2.94 117.51 117.25 1rm6 h ILE 699 Ca -0.44 -0.35 -0.04 0.00 1.08 0.00 0.00 64.86 65.11 1rm6 h ILE 699 Cb 1.30 1.31 -0.00 0.00 -1.09 0.00 0.00 36.82 38.33 1rm6 h ILE 699 CO 0.59 0.03 -0.04 0.58 -1.08 0.00 0.00 178.15 178.23 1rm6 h VAL 700 N 0.00 1.29 -0.00 2.19 2.07 -2.03 -3.15 116.25 116.62 1rm6 h VAL 700 Ca -0.00 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.52 1rm6 h VAL 700 Cb 0.31 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 1rm6 h VAL 700 CO 0.00 0.29 -0.32 -1.84 0.02 0.00 0.00 177.57 175.73 1rm6 n GLU 701 N -4.68 0.51 -2.24 1.57 0.00 -1.19 -4.91 120.64 109.70 1rm6 n GLU 701 Ca -0.05 -0.29 -0.41 0.00 0.00 0.00 0.00 57.16 56.41 1rm6 n GLU 701 Cb 0.26 -1.49 -0.03 0.00 0.00 0.00 0.00 31.44 30.18 1rm6 n GLU 701 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 1rm6 s SER 702 N -2.68 6.93 0.70 -1.84 0.01 -1.12 -4.50 113.70 111.20 1rm6 s SER 702 Ca 0.20 2.50 -0.11 0.00 1.31 0.00 0.00 55.95 59.85 1rm6 s SER 702 Cb 0.19 -2.63 0.01 0.00 0.21 0.00 0.00 66.02 63.79 1rm6 s SER 702 CO 0.58 -0.43 1.06 -2.16 0.41 0.00 0.00 173.24 172.70 1rm6 s PRO 703 N -1.21 2.91 0.44 12.44 0.04 -1.25 -4.99 135.00 143.38 1rm6 s PRO 703 Ca 0.50 0.94 -0.22 0.00 0.04 0.00 0.00 61.00 62.27 1rm6 s PRO 703 Cb -0.37 -1.99 -0.09 0.00 0.04 0.00 0.00 34.50 32.09 1rm6 s PRO 703 CO 0.46 -1.11 1.01 0.34 0.04 0.00 0.00 177.00 177.73 1rm6 s ASP 704 N -3.80 6.65 -0.07 6.66 3.68 -0.87 -4.92 116.67 123.99 1rm6 s ASP 704 Ca 0.58 1.89 -0.02 0.00 2.13 0.00 0.00 52.55 57.13 1rm6 s ASP 704 Cb -0.14 -2.56 0.03 0.00 -1.45 0.00 0.00 42.92 38.80 1rm6 s ASP 704 CO 0.55 -0.57 0.03 -0.63 0.13 0.00 0.00 175.17 174.68 1rm6 s ILE 705 N -1.94 0.19 -0.23 4.11 1.01 -1.26 -0.78 121.20 122.30 1rm6 s ILE 705 Ca 0.63 0.18 -0.08 0.00 0.00 0.00 0.00 60.65 61.38 1rm6 s ILE 705 Cb -0.16 -0.42 -0.04 0.00 0.01 0.00 0.00 42.46 41.85 1rm6 s ILE 705 CO 0.20 0.18 0.09 -0.70 0.00 0.00 0.00 174.94 174.72 1rm6 s GLU 706 N 2.05 3.85 -0.16 2.79 2.12 0.06 -4.98 118.70 124.43 1rm6 s GLU 706 Ca 0.05 -0.39 -0.06 0.00 0.36 0.00 0.00 54.97 54.93 1rm6 s GLU 706 Cb -0.13 -3.36 -0.04 0.00 0.26 0.00 0.00 34.13 30.87 1rm6 s GLU 706 CO -0.05 0.00 0.03 0.08 -0.54 0.00 0.00 175.26 174.79 1rm6 s VAL 707 N 1.14 4.53 -0.18 3.70 1.01 -1.26 -1.14 120.40 128.19 1rm6 s VAL 707 Ca 0.05 -0.14 -0.00 0.00 0.00 0.00 0.00 61.98 61.89 1rm6 s VAL 707 Cb -0.14 -3.00 0.01 0.00 0.00 0.00 0.00 36.38 33.24 1rm6 s VAL 707 CO 0.04 0.50 -0.15 -0.63 0.00 0.00 0.00 175.10 174.86 1rm6 s ILE 708 N 0.11 2.53 -0.11 2.22 1.01 0.28 -4.98 121.20 122.25 1rm6 s ILE 708 Ca 0.03 -0.79 -0.19 0.00 0.00 0.00 0.00 60.65 59.70 1rm6 s ILE 708 Cb -0.13 -2.09 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 1rm6 s ILE 708 CO 0.01 0.51 0.50 -0.63 0.00 0.00 0.00 174.94 175.33 1rm6 s ILE 709 N 1.19 5.17 -0.09 2.92 1.01 -1.26 -1.27 121.20 128.86 1rm6 s ILE 709 Ca 0.02 1.01 0.01 0.00 0.00 0.00 0.00 60.65 61.69 1rm6 s ILE 709 Cb -0.14 -3.84 -0.02 0.00 0.01 0.00 0.00 42.46 38.46 1rm6 s ILE 709 CO -0.07 0.32 -0.11 -0.69 0.00 0.00 0.00 174.94 174.39 1rm6 s VAL 710 N 0.64 3.29 -0.56 2.92 1.01 0.23 -4.92 120.40 123.00 1rm6 s VAL 710 Ca 0.27 -0.61 0.04 0.00 0.00 0.00 0.00 61.98 61.68 1rm6 s VAL 710 Cb -0.15 -2.35 0.15 0.00 0.00 0.00 0.00 36.38 34.03 1rm6 s VAL 710 CO 0.11 0.56 0.35 -1.61 0.00 0.00 0.00 175.10 174.51 1rm6 s GLU 711 N -0.24 1.91 0.15 2.72 2.02 -1.26 -1.72 118.70 122.27 1rm6 s GLU 711 Ca 0.02 -2.71 0.18 0.00 0.02 0.00 0.00 54.97 52.48 1rm6 s GLU 711 Cb -0.13 -2.96 0.79 0.00 0.10 0.00 0.00 34.13 31.93 1rm6 s GLU 711 CO 0.03 -1.21 1.57 -1.13 0.02 0.00 0.00 175.26 174.53 1rm6 n SER 712 N 2.76 0.36 -2.90 -0.19 3.41 -1.10 -4.84 113.62 111.12 1rm6 n SER 712 Ca 0.14 0.60 -0.10 0.00 -0.26 0.00 0.00 58.87 59.25 1rm6 n SER 712 Cb 0.35 -0.67 0.01 0.00 -0.26 0.00 0.00 64.21 63.64 1rm6 n SER 712 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1rm6 n MET 713 N -1.91 -2.48 -2.23 4.33 2.81 0.14 -4.78 117.12 113.01 1rm6 n MET 713 Ca 0.02 2.15 -0.42 0.00 -1.81 0.00 0.00 57.70 57.64 1rm6 n MET 713 Cb 0.18 -5.23 -0.03 0.00 -0.71 0.00 0.00 33.22 27.43 1rm6 n MET 713 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1rm6 s ASP 714 N -2.33 6.90 0.37 7.83 -1.08 -0.20 -4.90 116.67 123.26 1rm6 s ASP 714 Ca 0.22 2.33 0.26 0.00 -0.52 0.00 0.00 52.55 54.84 1rm6 s ASP 714 Cb -0.06 -2.60 1.31 0.00 -1.46 0.00 0.00 42.92 40.12 1rm6 s ASP 714 CO 0.77 -0.56 1.80 1.55 0.52 0.00 0.00 175.17 179.25 1rm6 h PRO 715 N 6.00 0.00 -0.00 4.34 0.13 -1.88 -2.99 132.00 137.60 1rm6 h PRO 715 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1rm6 h PRO 715 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1rm6 h PRO 715 CO 0.81 0.00 -0.18 0.09 -0.23 0.00 0.00 178.00 178.48 1rm6 n ASN 716 N -2.44 0.41 -4.86 1.44 3.02 -1.26 -4.98 115.26 106.59 1rm6 n ASN 716 Ca -0.00 -0.71 -0.30 0.00 -0.03 0.00 0.00 54.58 53.53 1rm6 n ASN 716 Cb 0.12 0.84 0.04 0.00 -0.61 0.00 0.00 39.78 40.17 1rm6 n ASN 716 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1rm6 s GLY 717 N -1.27 1.64 -0.24 7.41 0.00 -1.13 -4.96 107.32 108.77 1rm6 s GLY 717 Ca 0.02 -0.19 -0.29 0.00 0.00 0.00 0.00 44.72 44.27 1rm6 s GLY 717 CO 0.17 0.15 1.64 2.56 0.00 0.00 0.00 173.10 177.62 1rm6 s PRO 718 N -5.23 3.72 -2.09 2.90 0.04 -1.25 -1.58 135.00 131.50 1rm6 s PRO 718 Ca 0.57 1.61 0.00 0.00 0.04 0.00 0.00 61.00 63.23 1rm6 s PRO 718 Cb -0.12 -4.06 0.00 0.00 0.04 0.00 0.00 34.50 30.36 1rm6 s PRO 718 CO 0.53 -1.39 0.00 1.19 0.04 0.00 0.00 177.00 177.38 1rm6 n PHE 719 N 8.73 -0.23 -0.34 0.56 3.72 -1.26 -1.50 117.46 127.14 1rm6 n PHE 719 Ca 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.59 1rm6 n PHE 719 Cb 0.45 -3.54 0.00 0.00 -0.94 0.00 0.00 39.48 35.45 1rm6 n PHE 719 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1rm6 n GLY 720 N -0.51 0.75 3.81 1.37 0.00 -0.62 -4.74 105.19 105.26 1rm6 n GLY 720 Ca -0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 1rm6 n GLY 720 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rm6 s ALA 721 N -2.35 2.93 0.28 4.61 0.00 -0.56 -1.04 121.76 125.63 1rm6 s ALA 721 Ca 0.00 0.43 0.02 0.00 0.00 0.00 0.00 51.96 52.42 1rm6 s ALA 721 Cb 0.00 -3.20 -0.01 0.00 0.00 0.00 0.00 23.12 19.92 1rm6 s ALA 721 CO 0.00 -0.25 0.08 1.63 0.00 0.00 0.00 175.76 177.22 1rm6 n LYS 722 N -1.16 0.79 -1.25 0.00 5.02 -0.07 -3.91 118.16 117.58 1rm6 n LYS 722 Ca 0.08 -2.30 -0.29 0.00 -2.02 0.00 0.00 58.31 53.78 1rm6 n LYS 722 Cb 0.53 1.13 0.16 0.00 -0.02 0.00 0.00 35.03 36.83 1rm6 n LYS 722 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1rm6 s GLU 723 N -3.06 0.65 0.00 1.97 4.04 -1.26 -4.77 118.70 116.27 1rm6 s GLU 723 Ca 0.11 0.49 0.15 0.00 0.04 0.00 0.00 54.97 55.76 1rm6 s GLU 723 Cb 0.01 -1.77 0.25 0.00 0.02 0.00 0.00 34.13 32.64 1rm6 s GLU 723 CO 0.08 -2.58 1.08 0.00 -1.84 0.00 0.00 175.26 172.01 1rm6 n ALA 724 N -4.06 2.76 0.00 -0.84 0.00 -1.26 -4.54 120.51 112.57 1rm6 n ALA 724 Ca 0.06 -1.66 0.00 0.00 0.00 0.00 0.00 53.44 51.83 1rm6 n ALA 724 Cb 0.57 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1rm6 n ALA 724 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1rm6 n SER 725 N 0.29 0.68 -0.00 0.00 3.41 -1.26 -3.98 113.62 112.76 1rm6 n SER 725 Ca -0.05 -0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1rm6 n SER 725 Cb 0.96 0.23 -0.00 0.00 -0.26 0.00 0.00 64.21 65.14 1rm6 n SER 725 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1rm6 n GLU 726 N -0.30 2.04 0.12 4.33 1.02 -1.26 -4.63 120.64 121.96 1rm6 n GLU 726 Ca 0.00 -0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.24 1rm6 n GLU 726 Cb 0.00 -1.01 0.48 0.00 -0.02 0.00 0.00 31.44 30.90 1rm6 n GLU 726 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rm6 n GLY 727 N 2.74 -1.05 0.29 0.62 0.00 -1.26 -2.86 105.19 103.67 1rm6 n GLY 727 Ca -0.00 0.11 0.10 0.00 0.00 0.00 0.00 46.02 46.23 1rm6 n GLY 727 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1rm6 n MET 728 N -2.15 1.16 -0.06 1.61 0.00 -1.26 -2.95 117.12 113.47 1rm6 n MET 728 Ca 0.01 -0.61 -0.13 0.00 0.00 0.00 0.00 57.70 56.97 1rm6 n MET 728 Cb 0.14 -1.40 -0.06 0.00 0.00 0.00 0.00 33.22 31.89 1rm6 n MET 728 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 1rm6 h LEU 729 N 1.44 0.51 -1.28 3.17 6.46 -1.71 -3.32 115.31 120.59 1rm6 h LEU 729 Ca 0.00 -0.49 -0.07 0.00 -0.12 0.00 0.00 57.88 57.20 1rm6 h LEU 729 Cb 0.60 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.37 1rm6 h LEU 729 CO 0.00 0.90 -0.23 0.00 -0.62 0.00 0.00 178.44 178.50 1rm6 h ALA 730 N 0.62 1.40 0.00 1.25 0.00 -1.82 -2.85 119.26 117.87 1rm6 h ALA 730 Ca 0.03 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1rm6 h ALA 730 Cb 0.77 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1rm6 h ALA 730 CO 0.05 0.42 -0.01 0.78 0.00 0.00 0.00 179.25 180.49 1rm6 h GLY 731 N 0.89 0.00 1.36 0.00 0.00 -1.80 -2.67 103.07 100.86 1rm6 h GLY 731 Ca 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.29 1rm6 h GLY 731 CO 0.03 0.00 -0.00 -2.75 0.00 0.00 0.00 176.54 173.82 1rm6 h PHE 732 N 0.00 0.83 0.41 5.60 3.57 -1.69 -2.44 116.94 123.22 1rm6 h PHE 732 Ca -0.00 -0.11 -0.02 0.00 3.53 0.00 0.00 57.97 61.37 1rm6 h PHE 732 Cb 0.02 -0.23 -0.00 0.00 2.79 0.00 0.00 35.95 38.53 1rm6 h PHE 732 CO 0.00 0.77 -0.22 -0.07 -2.23 0.00 0.00 178.31 176.55 1rm6 h LEU 733 N 0.73 -0.55 -0.91 0.59 4.07 -1.69 -0.84 115.31 116.71 1rm6 h LEU 733 Ca 0.14 0.03 -0.11 0.00 0.08 0.00 0.00 57.88 58.02 1rm6 h LEU 733 Cb 0.45 0.15 -0.01 0.00 1.08 0.00 0.00 40.66 42.33 1rm6 h LEU 733 CO 0.02 -0.37 -0.41 1.55 -1.08 0.00 0.00 178.44 178.15 1rm6 h PRO 734 N -0.59 0.28 -0.36 1.13 0.13 -1.72 -1.48 132.00 129.38 1rm6 h PRO 734 Ca -0.05 -0.13 -0.03 0.00 -0.87 0.00 0.00 66.00 64.92 1rm6 h PRO 734 Cb 0.47 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.59 1rm6 h PRO 734 CO 0.07 0.65 0.12 0.00 -0.23 0.00 0.00 178.00 178.61 1rm6 h ALA 735 N 1.34 0.47 0.00 -0.56 0.00 -1.25 -0.89 119.26 118.37 1rm6 h ALA 735 Ca 0.02 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 1rm6 h ALA 735 Cb 0.83 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1rm6 h ALA 735 CO 0.07 0.10 -0.44 0.97 0.00 0.00 0.00 179.25 179.95 1rm6 h ILE 736 N 0.43 1.00 -0.61 0.00 2.10 -1.07 -1.74 117.51 117.62 1rm6 h ILE 736 Ca 0.12 -1.71 -0.01 0.00 1.08 0.00 0.00 64.86 64.34 1rm6 h ILE 736 Cb 0.23 2.02 -0.03 0.00 -1.09 0.00 0.00 36.82 37.95 1rm6 h ILE 736 CO -0.01 0.43 0.34 -0.74 -1.08 0.00 0.00 178.15 177.09 1rm6 h HIS 737 N 0.00 0.83 -0.44 2.19 2.76 -0.82 -0.20 115.15 119.47 1rm6 h HIS 737 Ca -0.00 -0.02 -0.12 0.00 -2.20 0.00 0.00 60.37 58.03 1rm6 h HIS 737 Cb 0.98 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 29.66 1rm6 h HIS 737 CO 0.00 0.60 -0.18 1.49 -1.30 0.00 0.00 177.93 178.54 1rm6 h GLU 738 N 0.83 0.90 -0.72 5.26 4.81 -0.86 -2.43 114.58 122.38 1rm6 h GLU 738 Ca 0.22 -0.38 0.04 0.00 -0.13 0.00 0.00 59.36 59.11 1rm6 h GLU 738 Cb 0.03 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.33 1rm6 h GLU 738 CO -0.04 1.03 0.44 0.00 -0.73 0.00 0.00 179.01 179.72 1rm6 h ALA 739 N 0.85 0.96 -0.71 2.92 0.00 -0.90 -1.03 119.26 121.34 1rm6 h ALA 739 Ca 0.10 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1rm6 h ALA 739 Cb 0.74 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1rm6 h ALA 739 CO 0.06 0.19 0.28 0.28 0.00 0.00 0.00 179.25 180.05 1rm6 h VAL 740 N 0.84 1.24 -0.29 0.00 2.07 -0.91 0.69 116.25 119.90 1rm6 h VAL 740 Ca 0.30 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 67.03 1rm6 h VAL 740 Cb 0.08 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1rm6 h VAL 740 CO -0.14 0.31 0.11 0.22 0.02 0.00 0.00 177.57 178.09 1rm6 h TYR 741 N 1.03 0.44 -0.76 1.57 3.20 -0.84 0.03 116.97 121.65 1rm6 h TYR 741 Ca 0.24 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 1rm6 h TYR 741 Cb 0.20 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 1rm6 h TYR 741 CO 0.02 0.45 0.38 1.49 -1.64 0.00 0.00 178.16 178.86 1rm6 h GLU 742 N 0.31 1.07 -0.15 1.82 4.81 -0.91 0.25 114.58 121.77 1rm6 h GLU 742 Ca 0.09 -0.14 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 1rm6 h GLU 742 Cb 0.20 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.37 1rm6 h GLU 742 CO -0.01 0.81 -0.08 0.00 -0.73 0.00 0.00 179.01 179.01 1rm6 h ALA 743 N 1.35 0.22 0.00 2.92 0.00 -0.45 -3.41 119.26 119.89 1rm6 h ALA 743 Ca 0.26 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1rm6 h ALA 743 Cb 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1rm6 h ALA 743 CO -0.04 0.02 0.00 1.33 0.00 0.00 0.00 179.25 180.57 1rm6 n VAL 744 N -4.63 0.18 -1.57 0.00 0.24 -0.04 -2.80 118.33 109.70 1rm6 n VAL 744 Ca -0.06 -0.26 -0.07 0.00 -2.04 0.00 0.00 64.34 61.92 1rm6 n VAL 744 Cb 0.30 1.23 -0.02 0.00 -1.47 0.00 0.00 33.84 33.89 1rm6 n VAL 744 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rm6 n GLY 745 N -0.09 0.57 3.44 7.63 0.00 0.87 -5.02 105.19 112.61 1rm6 n GLY 745 Ca 0.00 -0.69 -0.29 0.00 0.00 0.00 0.00 46.02 45.04 1rm6 n GLY 745 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1rm6 s VAL 746 N -2.29 2.61 -0.41 1.61 -7.23 -1.26 -5.01 120.40 108.42 1rm6 s VAL 746 Ca 0.00 -1.55 -0.10 0.00 -1.81 0.00 0.00 61.98 58.52 1rm6 s VAL 746 Cb 0.00 -2.16 0.07 0.00 0.56 0.00 0.00 36.38 34.84 1rm6 s VAL 746 CO 0.00 0.14 0.26 -0.13 -0.31 0.00 0.00 175.10 175.05 1rm6 s ARG 747 N -1.99 2.68 -0.55 4.82 0.52 -1.26 -3.65 118.95 119.53 1rm6 s ARG 747 Ca 0.16 -1.36 -0.19 0.00 -0.52 0.00 0.00 55.73 53.82 1rm6 s ARG 747 Cb -0.10 -3.79 0.08 0.00 0.52 0.00 0.00 34.95 31.65 1rm6 s ARG 747 CO 0.08 -0.90 0.67 0.00 0.02 0.00 0.00 175.30 175.17 1rm6 s ALA 748 N 1.47 3.38 -1.06 2.13 0.00 -1.26 -4.91 121.76 121.51 1rm6 s ALA 748 Ca 0.03 -1.94 0.26 0.00 0.00 0.00 0.00 51.96 50.31 1rm6 s ALA 748 Cb -0.22 -3.45 0.63 0.00 0.00 0.00 0.00 23.12 20.08 1rm6 s ALA 748 CO 0.03 -2.18 1.50 0.25 0.00 0.00 0.00 175.76 175.36 1rm6 n THR 749 N 5.61 0.00 -4.16 0.00 -2.24 -1.26 -4.83 114.28 107.41 1rm6 n THR 749 Ca -0.08 -0.01 -0.34 0.00 -2.27 0.00 0.00 64.05 61.35 1rm6 n THR 749 Cb 0.44 0.16 -0.11 0.00 -2.10 0.00 0.00 70.33 68.72 1rm6 n THR 749 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1rm6 s ASP 750 N -2.96 5.26 0.01 3.42 -1.08 -1.26 -1.82 116.67 118.25 1rm6 s ASP 750 Ca 0.13 -0.02 0.03 0.00 -0.52 0.00 0.00 52.55 52.17 1rm6 s ASP 750 Cb 0.18 -1.89 -0.03 0.00 -1.46 0.00 0.00 42.92 39.72 1rm6 s ASP 750 CO 0.66 0.16 -0.05 -0.36 0.52 0.00 0.00 175.17 176.10 1rm6 s PHE 751 N 0.43 2.92 0.55 -5.34 0.40 -0.22 -4.07 117.98 112.65 1rm6 s PHE 751 Ca 0.00 -0.02 -0.18 0.00 -0.60 0.00 0.00 56.93 56.13 1rm6 s PHE 751 Cb -0.13 -1.61 -0.06 0.00 0.51 0.00 0.00 43.02 41.73 1rm6 s PHE 751 CO 0.01 0.40 1.05 -1.25 0.70 0.00 0.00 175.22 176.13 1rm6 s PRO 752 N -1.53 3.54 -1.31 0.24 0.04 -1.26 -1.49 135.00 133.23 1rm6 s PRO 752 Ca 0.18 1.25 -0.09 0.00 0.04 0.00 0.00 61.00 62.39 1rm6 s PRO 752 Cb -0.11 -2.06 -0.10 0.00 0.04 0.00 0.00 34.50 32.27 1rm6 s PRO 752 CO 0.09 -0.63 3.02 1.28 0.04 0.00 0.00 177.00 180.80 1rm6 n LEU 753 N -1.59 8.10 -4.80 -3.56 4.77 0.12 -4.84 117.00 115.21 1rm6 n LEU 753 Ca 0.09 -4.21 -0.30 0.00 -0.03 0.00 0.00 56.01 51.55 1rm6 n LEU 753 Cb 0.53 -1.51 0.09 0.00 -2.33 0.00 0.00 43.42 40.19 1rm6 n LEU 753 CO 0.44 2.01 0.71 -0.94 -1.33 0.00 0.00 177.39 178.28 1rm6 s SER 754 N 1.95 4.58 0.34 -1.43 1.04 -1.23 -4.68 113.70 114.27 1rm6 s SER 754 Ca 0.68 1.43 0.09 0.00 0.48 0.00 0.00 55.95 58.63 1rm6 s SER 754 Cb 0.21 -2.19 0.84 0.00 0.10 0.00 0.00 66.02 64.97 1rm6 s SER 754 CO -0.06 -1.93 1.81 -0.65 0.98 0.00 0.00 173.24 173.39 1rm6 h PRO 755 N -1.06 0.65 -0.65 4.02 0.11 -1.85 -1.48 132.00 131.74 1rm6 h PRO 755 Ca -0.46 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 1rm6 h PRO 755 Cb 1.25 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 1rm6 h PRO 755 CO 0.58 0.43 0.35 0.38 -0.21 0.00 0.00 178.00 179.53 1rm6 h ASP 756 N 0.67 0.82 -0.38 -2.05 -0.00 -1.88 -0.07 116.42 113.53 1rm6 h ASP 756 Ca 0.53 -0.10 -0.12 0.00 -0.00 0.00 0.00 57.03 57.34 1rm6 h ASP 756 Cb 0.95 -0.21 -0.01 0.00 -0.00 0.00 0.00 39.33 40.06 1rm6 h ASP 756 CO -0.30 0.69 -0.24 0.03 -0.00 0.00 0.00 179.24 179.42 1rm6 h ARG 757 N 0.89 0.84 -0.45 4.15 3.08 -1.61 -2.52 114.38 118.76 1rm6 h ARG 757 Ca 0.23 -0.39 -0.03 0.00 0.07 0.00 0.00 59.98 59.86 1rm6 h ARG 757 Cb 0.05 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 1rm6 h ARG 757 CO -0.04 1.03 0.17 0.82 -1.07 0.00 0.00 179.97 180.88 1rm6 h ILE 758 N 0.64 1.21 -0.55 2.04 1.08 -1.22 -2.18 117.51 118.54 1rm6 h ILE 758 Ca 0.08 -0.67 -0.04 0.00 -0.39 0.00 0.00 64.86 63.85 1rm6 h ILE 758 Cb 0.80 0.81 -0.03 0.00 -3.07 0.00 0.00 36.82 35.33 1rm6 h ILE 758 CO 0.07 0.24 0.19 0.71 -0.69 0.00 0.00 178.15 178.67 1rm6 h THR 759 N 0.59 1.21 -0.61 -0.27 1.35 -0.96 0.57 112.91 114.78 1rm6 h THR 759 Ca 0.15 -0.68 -0.07 0.00 -0.55 0.00 0.00 66.41 65.26 1rm6 h THR 759 Cb 0.22 0.58 -0.02 0.00 -1.73 0.00 0.00 68.15 67.20 1rm6 h THR 759 CO -0.01 0.26 0.12 -0.33 -0.25 0.00 0.00 175.52 175.31 1rm6 h GLU 760 N 0.79 1.00 -0.60 4.72 5.08 -1.20 -1.40 114.58 122.96 1rm6 h GLU 760 Ca 0.18 -0.26 -0.08 0.00 -1.00 0.00 0.00 59.36 58.20 1rm6 h GLU 760 Cb 0.20 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 1rm6 h GLU 760 CO -0.01 0.93 0.04 -0.07 -1.00 0.00 0.00 179.01 178.90 1rm6 h LEU 761 N 0.91 0.99 -0.83 1.33 3.38 -0.74 -1.47 115.31 118.88 1rm6 h LEU 761 Ca 0.19 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 1rm6 h LEU 761 Cb 0.40 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1rm6 h LEU 761 CO 0.01 1.02 0.05 -0.07 0.09 0.00 0.00 178.44 179.53 1rm6 h LEU 762 N 0.94 0.89 -0.44 1.67 3.38 -0.68 -1.32 115.31 119.75 1rm6 h LEU 762 Ca 0.18 -0.21 -0.15 0.00 0.09 0.00 0.00 57.88 57.79 1rm6 h LEU 762 Cb 0.49 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1rm6 h LEU 762 CO 0.02 0.92 -0.31 0.44 0.09 0.00 0.00 178.44 179.60 1rm6 h ASP 763 N 0.86 1.02 -0.62 -0.43 3.32 -0.96 -1.86 116.42 117.76 1rm6 h ASP 763 Ca 0.17 -0.43 -0.02 0.00 0.02 0.00 0.00 57.03 56.77 1rm6 h ASP 763 Cb 0.44 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 1rm6 h ASP 763 CO 0.02 1.24 0.33 0.00 -1.72 0.00 0.00 179.24 179.10 1rm6 h ALA 764 N 0.82 0.80 -0.32 3.45 0.00 -1.12 0.11 119.26 123.00 1rm6 h ALA 764 Ca 0.08 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1rm6 h ALA 764 Cb 0.90 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1rm6 h ALA 764 CO 0.08 0.33 0.20 -0.22 0.00 0.00 0.00 179.25 179.65 1rm6 h LYS 765 N 0.85 0.43 0.23 0.00 3.64 -1.10 -2.27 116.57 118.35 1rm6 h LYS 765 Ca 0.22 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.56 1rm6 h LYS 765 Cb 0.06 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1rm6 h LYS 765 CO -0.03 0.30 -0.11 1.49 -2.27 0.00 0.00 179.45 178.83 1rm6 h GLU 766 N 0.42 -0.30 -1.02 1.90 4.81 -1.13 -3.17 114.58 116.09 1rm6 h GLU 766 Ca 0.12 0.02 0.30 0.00 -0.13 0.00 0.00 59.36 59.66 1rm6 h GLU 766 Cb -0.02 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.38 1rm6 h GLU 766 CO -0.02 0.07 0.77 0.00 -0.73 0.00 0.00 179.01 179.11 1rm6 h ALA 767 N -0.34 2.94 -3.00 2.92 0.00 -0.81 -3.38 119.26 117.59 1rm6 h ALA 767 Ca -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1rm6 h ALA 767 Cb 0.51 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1rm6 h ALA 767 CO 0.05 -1.30 0.00 0.00 0.00 0.00 0.00 179.25 178.00 1rm6 n ALA 768 N -2.69 0.00 0.00 0.00 0.00 -0.86 -5.08 120.51 111.89 1rm6 n ALA 768 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1rm6 n ALA 768 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.57 1rm6 n ALA 768 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50