#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 0.25 -2.37 2.61 -2.24 -1.26 -4.89 114.28 106.38 1rm6 n THR 10 Ca 0.00 -0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.23 1rm6 n THR 10 Cb 0.00 -0.84 -0.03 0.00 -2.10 0.00 0.00 70.33 67.35 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 -2.09 3.64 0.00 2.28 1.01 -1.26 -2.75 120.40 121.24 1rm6 s VAL 11 Ca -0.03 1.32 0.00 0.00 0.00 0.00 0.00 61.98 63.27 1rm6 s VAL 11 Cb 0.01 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.55 1rm6 s VAL 11 CO 0.13 0.18 0.00 0.61 0.00 0.00 0.00 175.10 176.03 1rm6 n GLY 12 N 2.50 1.15 3.77 4.51 0.00 0.57 -5.04 105.19 112.64 1rm6 n GLY 12 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.73 4.76 -0.18 1.61 1.01 -1.11 -4.64 120.40 119.13 1rm6 s VAL 13 Ca 0.00 1.40 -0.29 0.00 0.00 0.00 0.00 61.98 63.09 1rm6 s VAL 13 Cb 0.00 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 1rm6 s VAL 13 CO 0.00 0.44 1.48 -0.13 0.00 0.00 0.00 175.10 176.89 1rm6 s ARG 14 N -0.45 4.03 -0.11 2.72 0.52 -1.26 -4.30 118.95 120.10 1rm6 s ARG 14 Ca 0.33 1.73 -0.00 0.00 -0.52 0.00 0.00 55.73 57.27 1rm6 s ARG 14 Cb -0.20 -3.92 0.02 0.00 0.52 0.00 0.00 34.95 31.37 1rm6 s ARG 14 CO 0.20 -0.99 -0.09 0.99 0.02 0.00 0.00 175.30 175.43 1rm6 s THR 15 N 4.32 1.09 0.59 0.02 2.01 -1.26 -4.96 115.64 117.46 1rm6 s THR 15 Ca 0.65 -0.34 -0.20 0.00 0.31 0.00 0.00 61.69 62.11 1rm6 s THR 15 Cb -0.25 -1.09 -0.03 0.00 0.01 0.00 0.00 72.50 71.14 1rm6 s THR 15 CO 0.24 0.38 1.30 -2.84 -0.69 0.00 0.00 174.62 173.01 1rm6 s PRO 16 N 1.59 2.90 0.43 4.92 0.02 -1.26 -4.74 135.00 138.86 1rm6 s PRO 16 Ca 0.03 2.09 -0.25 0.00 0.02 0.00 0.00 61.00 62.88 1rm6 s PRO 16 Cb -0.13 -2.04 -0.08 0.00 0.02 0.00 0.00 34.50 32.27 1rm6 s PRO 16 CO -0.07 -1.33 1.32 -0.51 -0.33 0.00 0.00 177.00 176.07 1rm6 s LEU 17 N -3.93 4.15 0.34 -5.54 1.43 -1.26 -4.87 118.68 108.99 1rm6 s LEU 17 Ca 0.77 2.68 0.25 0.00 -1.03 0.00 0.00 54.13 56.79 1rm6 s LEU 17 Cb -0.37 -3.97 1.22 0.00 0.03 0.00 0.00 46.19 43.10 1rm6 s LEU 17 CO 0.42 -0.98 1.76 -0.37 0.23 0.00 0.00 176.35 177.41 1rm6 h VAL 18 N 2.29 0.00 -0.33 -1.59 -1.51 -1.92 -0.79 116.25 112.40 1rm6 h VAL 18 Ca -0.50 -0.11 0.00 0.00 -1.23 0.00 0.00 66.70 64.86 1rm6 h VAL 18 Cb 1.25 0.75 0.00 0.00 -2.13 0.00 0.00 31.29 31.17 1rm6 h VAL 18 CO 0.62 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 176.06 1rm6 n ASP 19 N -2.37 3.37 0.18 4.19 5.75 -1.26 -4.68 116.55 121.73 1rm6 n ASP 19 Ca -0.00 -2.39 0.02 0.00 -0.01 0.00 0.00 54.79 52.42 1rm6 n ASP 19 Cb 0.12 -0.36 0.37 0.00 -1.03 0.00 0.00 41.12 40.22 1rm6 n ASP 19 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1rm6 h GLY 20 N 2.06 0.04 0.88 6.12 0.00 -1.50 -3.04 103.07 107.63 1rm6 h GLY 20 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 47.33 47.33 1rm6 h GLY 20 CO 0.09 0.03 0.51 -2.08 0.00 0.00 0.00 176.54 175.08 1rm6 h VAL 21 N 0.03 1.13 0.00 4.60 2.07 -1.83 -1.68 116.25 120.56 1rm6 h VAL 21 Ca 0.00 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 67.12 1rm6 h VAL 21 Cb 0.61 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 1rm6 h VAL 21 CO 0.04 0.18 -0.30 -0.33 0.02 0.00 0.00 177.57 177.18 1rm6 h GLU 22 N 0.99 0.00 -0.07 1.57 3.07 -1.90 -2.95 114.58 115.29 1rm6 h GLU 22 Ca 0.31 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.96 1rm6 h GLU 22 Cb 0.00 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 27.93 1rm6 h GLU 22 CO -0.11 0.30 -0.78 0.87 -1.40 0.00 0.00 179.01 177.90 1rm6 h LYS 23 N 0.00 0.65 0.00 2.33 1.57 -1.34 -1.16 116.57 118.62 1rm6 h LYS 23 Ca -0.00 -0.61 0.00 0.00 -1.87 0.00 0.00 60.65 58.17 1rm6 h LYS 23 Cb 0.73 0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.19 1rm6 h LYS 23 CO 0.04 1.21 0.00 1.33 -0.57 0.00 0.00 179.45 181.46 1rm6 n VAL 24 N -4.02 0.18 0.76 0.50 0.24 -0.86 -3.11 118.33 112.03 1rm6 n VAL 24 Ca -0.09 -0.07 0.08 0.00 -2.04 0.00 0.00 64.34 62.22 1rm6 n VAL 24 Cb 0.75 -0.54 -0.05 0.00 -1.47 0.00 0.00 33.84 32.53 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 -1.70 0.00 -1.00 3.34 -2.24 -1.12 -4.98 114.28 106.58 1rm6 n THR 25 Ca 0.07 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1rm6 n THR 25 Cb 0.36 1.09 0.00 0.00 -2.10 0.00 0.00 70.33 69.68 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 1.30 0.50 0.16 3.38 0.00 -1.07 -4.90 105.19 104.55 1rm6 n GLY 26 Ca 0.05 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.11 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 1.05 0.00 -6.54 1.61 1.57 -1.68 -3.45 116.57 109.13 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 0.05 0.00 0.04 0.00 0.08 0.00 0.00 32.23 32.40 1rm6 h LYS 27 CO 0.00 0.41 1.05 0.00 -0.57 0.00 0.00 179.45 180.35 1rm6 s ALA 28 N -3.07 3.79 -0.36 3.86 0.00 -0.51 -4.96 121.76 120.51 1rm6 s ALA 28 Ca 0.04 1.44 -0.13 0.00 0.00 0.00 0.00 51.96 53.31 1rm6 s ALA 28 Cb 0.08 -3.73 -0.00 0.00 0.00 0.00 0.00 23.12 19.47 1rm6 s ALA 28 CO 0.72 -1.10 0.25 0.15 0.00 0.00 0.00 175.76 175.78 1rm6 s LYS 29 N 2.23 3.26 0.70 0.00 -0.14 -1.26 -5.00 119.74 119.52 1rm6 s LYS 29 Ca 0.78 -0.81 -0.04 0.00 -1.36 0.00 0.00 55.97 54.54 1rm6 s LYS 29 Cb -0.46 -3.84 0.09 0.00 -1.68 0.00 0.00 37.83 31.94 1rm6 s LYS 29 CO 0.34 -0.56 0.99 0.71 -0.76 0.00 0.00 175.35 176.07 1rm6 s TYR 30 N 1.69 2.42 0.22 3.18 1.51 -1.26 -2.49 117.35 122.61 1rm6 s TYR 30 Ca 0.05 0.13 -0.09 0.00 -1.01 0.00 0.00 57.07 56.16 1rm6 s TYR 30 Cb -0.18 -3.14 0.33 0.00 -0.11 0.00 0.00 41.96 38.86 1rm6 s TYR 30 CO 0.10 -1.49 1.70 1.15 -1.11 0.00 0.00 175.55 175.89 1rm6 h THR 31 N -0.53 0.59 0.00 -0.71 2.02 -1.93 0.53 112.91 112.89 1rm6 h THR 31 Ca -0.42 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 66.68 1rm6 h THR 31 Cb 1.29 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 68.03 1rm6 h THR 31 CO 0.51 0.04 0.00 0.00 0.37 0.00 0.00 175.52 176.44 1rm6 n ALA 32 N -2.64 2.15 0.56 6.16 0.00 -1.26 -2.66 120.51 122.82 1rm6 n ALA 32 Ca 0.10 -0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.55 1rm6 n ALA 32 Cb 0.35 -1.37 0.11 0.00 0.00 0.00 0.00 19.45 18.54 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 0.66 -4.69 0.00 8.00 0.17 -4.93 116.55 114.43 1rm6 n ASP 33 Ca 0.10 -0.01 -0.42 0.00 0.71 0.00 0.00 54.79 55.17 1rm6 n ASP 33 Cb 0.20 0.42 -0.03 0.00 -0.02 0.00 0.00 41.12 41.69 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 -3.18 3.26 0.26 0.53 1.01 -1.09 -4.92 121.20 117.07 1rm6 s ILE 34 Ca 0.05 0.73 -0.29 0.00 0.00 0.00 0.00 60.65 61.14 1rm6 s ILE 34 Cb 0.14 -3.47 -0.09 0.00 0.01 0.00 0.00 42.46 39.04 1rm6 s ILE 34 CO 0.75 0.01 1.18 0.00 0.00 0.00 0.00 174.94 176.88 1rm6 s ALA 35 N 2.27 3.44 -0.49 9.38 0.00 -1.26 -4.96 121.76 130.15 1rm6 s ALA 35 Ca 0.69 0.99 0.05 0.00 0.00 0.00 0.00 51.96 53.69 1rm6 s ALA 35 Cb -0.37 -3.39 0.20 0.00 0.00 0.00 0.00 23.12 19.56 1rm6 s ALA 35 CO 0.30 -0.33 0.80 0.00 0.00 0.00 0.00 175.76 176.52 1rm6 n ALA 36 N 1.58 -2.21 0.08 0.00 0.00 -1.26 -5.04 120.51 113.66 1rm6 n ALA 36 Ca 0.01 -0.84 0.20 0.00 0.00 0.00 0.00 53.44 52.81 1rm6 n ALA 36 Cb 0.44 -1.80 0.75 0.00 0.00 0.00 0.00 19.45 18.84 1rm6 n ALA 36 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1rm6 h PRO 37 N 4.84 0.00 -0.11 0.00 0.11 -2.03 -1.09 132.00 133.71 1rm6 h PRO 37 Ca 0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1rm6 h PRO 37 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1rm6 h PRO 37 CO -0.00 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 177.54 1rm6 n ASP 38 N -3.86 1.54 -4.74 -2.05 10.43 -1.26 -4.94 116.55 111.67 1rm6 n ASP 38 Ca 0.07 -1.62 -0.41 0.00 2.57 0.00 0.00 54.79 55.40 1rm6 n ASP 38 Cb 0.58 -0.07 -0.03 0.00 1.84 0.00 0.00 41.12 43.45 1rm6 n ASP 38 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1rm6 s ALA 39 N -1.87 3.52 0.61 2.24 0.00 -0.42 -4.61 121.76 121.23 1rm6 s ALA 39 Ca 0.34 1.10 -0.08 0.00 0.00 0.00 0.00 51.96 53.32 1rm6 s ALA 39 Cb 0.19 -3.48 -0.01 0.00 0.00 0.00 0.00 23.12 19.82 1rm6 s ALA 39 CO 0.29 -0.53 0.95 -0.51 0.00 0.00 0.00 175.76 175.96 1rm6 s LEU 40 N -0.09 3.21 -0.21 0.00 1.43 0.28 -4.82 118.68 118.47 1rm6 s LEU 40 Ca 0.57 0.97 -0.16 0.00 -1.03 0.00 0.00 54.13 54.48 1rm6 s LEU 40 Cb -0.36 -3.85 -0.04 0.00 0.03 0.00 0.00 46.19 41.97 1rm6 s LEU 40 CO 0.38 -1.02 0.43 -0.69 0.23 0.00 0.00 176.35 175.68 1rm6 s VAL 41 N -3.08 5.17 -0.01 -1.59 1.01 0.77 -0.74 120.40 121.93 1rm6 s VAL 41 Ca 0.54 0.76 -0.05 0.00 0.00 0.00 0.00 61.98 63.23 1rm6 s VAL 41 Cb -0.11 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 1rm6 s VAL 41 CO 0.48 0.21 0.21 -0.83 0.00 0.00 0.00 175.10 175.18 1rm6 s GLY 42 N 1.17 2.21 -0.03 4.51 0.00 -0.32 -0.90 107.32 113.95 1rm6 s GLY 42 Ca 0.20 -0.67 -0.07 0.00 0.00 0.00 0.00 44.72 44.18 1rm6 s GLY 42 CO 0.09 -0.52 0.16 0.50 0.00 0.00 0.00 173.10 173.33 1rm6 s ARG 43 N -1.78 0.34 -0.12 2.90 1.81 -0.45 -4.38 118.95 117.26 1rm6 s ARG 43 Ca 0.26 -0.06 -0.02 0.00 -1.72 0.00 0.00 55.73 54.19 1rm6 s ARG 43 Cb -0.13 0.15 -0.03 0.00 -0.45 0.00 0.00 34.95 34.49 1rm6 s ARG 43 CO 0.16 -0.07 -0.04 0.42 -0.68 0.00 0.00 175.30 175.10 1rm6 s ILE 44 N -0.61 3.92 -0.32 1.52 1.01 -1.26 -0.95 121.20 124.51 1rm6 s ILE 44 Ca -0.07 -0.37 -0.23 0.00 0.00 0.00 0.00 60.65 59.98 1rm6 s ILE 44 Cb -0.04 -2.67 0.00 0.00 0.01 0.00 0.00 42.46 39.75 1rm6 s ILE 44 CO 0.01 0.54 0.75 -0.22 0.00 0.00 0.00 174.94 176.03 1rm6 s LEU 45 N -0.20 4.11 -0.01 2.97 2.96 0.74 -4.98 118.68 124.27 1rm6 s LEU 45 Ca 0.04 0.55 0.01 0.00 -0.22 0.00 0.00 54.13 54.51 1rm6 s LEU 45 Cb -0.13 -3.01 -0.04 0.00 0.50 0.00 0.00 46.19 43.52 1rm6 s LEU 45 CO 0.02 -0.61 0.02 -0.13 -1.32 0.00 0.00 176.35 174.34 1rm6 s ARG 46 N 2.91 2.87 0.20 1.98 0.52 -1.26 -0.78 118.95 125.39 1rm6 s ARG 46 Ca 0.31 -0.56 -0.32 0.00 -0.52 0.00 0.00 55.73 54.63 1rm6 s ARG 46 Cb -0.14 -2.73 -0.12 0.00 0.52 0.00 0.00 34.95 32.48 1rm6 s ARG 46 CO 0.13 0.64 1.71 0.45 0.02 0.00 0.00 175.30 178.25 1rm6 n SER 47 N 1.42 3.86 -0.35 0.23 2.88 0.56 -4.77 113.62 117.46 1rm6 n SER 47 Ca -0.15 1.06 0.14 0.00 -1.33 0.00 0.00 58.87 58.60 1rm6 n SER 47 Cb 0.53 -1.55 0.59 0.00 -0.75 0.00 0.00 64.21 63.03 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 3.98 1.40 -4.62 -1.46 -0.04 -1.26 -0.98 135.00 132.01 1rm6 n PRO 48 Ca 0.16 -0.70 -0.33 0.00 -0.04 0.00 0.00 63.50 62.59 1rm6 n PRO 48 Cb 0.34 -1.49 -0.11 0.00 -0.04 0.00 0.00 33.50 32.20 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 -2.08 2.88 0.08 0.54 3.76 -1.26 -4.94 115.29 114.27 1rm6 s HIS 49 Ca 0.38 -0.02 0.23 0.00 -0.15 0.00 0.00 55.06 55.49 1rm6 s HIS 49 Cb 0.21 -1.67 0.78 0.00 1.11 0.00 0.00 32.58 33.02 1rm6 s HIS 49 CO 0.37 0.32 1.77 0.00 -0.85 0.00 0.00 174.74 176.35 1rm6 h ALA 50 N 5.06 0.98 -1.84 -1.40 0.00 -1.88 -3.21 119.26 116.97 1rm6 h ALA 50 Ca -0.48 -0.24 0.08 0.00 0.00 0.00 0.00 54.91 54.27 1rm6 h ALA 50 Cb 1.17 -0.04 -0.20 0.00 0.00 0.00 0.00 17.79 18.71 1rm6 h ALA 50 CO 0.52 0.32 -0.16 -1.58 0.00 0.00 0.00 179.25 178.36 1rm6 s HIS 51 N -3.55 -1.39 -0.13 0.00 5.65 -1.26 -1.58 115.29 113.03 1rm6 s HIS 51 Ca 0.01 2.23 -0.30 0.00 0.25 0.00 0.00 55.06 57.26 1rm6 s HIS 51 Cb 0.10 0.77 0.10 0.00 -1.18 0.00 0.00 32.58 32.36 1rm6 s HIS 51 CO 0.65 -0.70 0.83 0.00 -0.65 0.00 0.00 174.74 174.87 1rm6 s ALA 52 N 2.89 -1.85 0.33 1.58 0.00 -0.90 -0.88 121.76 122.93 1rm6 s ALA 52 Ca -0.01 1.54 -0.16 0.00 0.00 0.00 0.00 51.96 53.32 1rm6 s ALA 52 Cb -0.13 -0.51 -0.09 0.00 0.00 0.00 0.00 23.12 22.39 1rm6 s ALA 52 CO -0.19 -0.33 0.77 1.03 0.00 0.00 0.00 175.76 177.03 1rm6 s ARG 53 N -0.87 4.05 -0.36 0.00 0.52 0.24 -0.59 118.95 121.94 1rm6 s ARG 53 Ca -0.05 0.75 -0.13 0.00 -0.52 0.00 0.00 55.73 55.78 1rm6 s ARG 53 Cb -0.01 -2.43 -0.00 0.00 0.52 0.00 0.00 34.95 33.03 1rm6 s ARG 53 CO 0.05 0.15 0.25 0.42 0.02 0.00 0.00 175.30 176.18 1rm6 s ILE 54 N -1.98 5.18 -0.00 1.52 1.01 0.32 -0.94 121.20 126.30 1rm6 s ILE 54 Ca 0.55 -0.41 0.04 0.00 0.00 0.00 0.00 60.65 60.83 1rm6 s ILE 54 Cb -0.10 -3.74 -0.25 0.00 0.01 0.00 0.00 42.46 38.38 1rm6 s ILE 54 CO 0.17 -0.11 0.82 -0.07 0.00 0.00 0.00 174.94 175.75 1rm6 h LEU 55 N 8.52 0.18 -7.00 2.97 3.38 -0.89 -3.44 115.31 119.03 1rm6 h LEU 55 Ca -0.30 -0.28 0.07 0.00 0.09 0.00 0.00 57.88 57.46 1rm6 h LEU 55 Cb 1.14 -0.06 -0.18 0.00 0.09 0.00 0.00 40.66 41.66 1rm6 h LEU 55 CO 0.66 1.24 0.46 0.00 0.09 0.00 0.00 178.44 180.89 1rm6 s ALA 56 N -2.62 -1.83 -0.09 1.53 0.00 -1.17 -4.99 121.76 112.59 1rm6 s ALA 56 Ca -0.07 1.17 -0.04 0.00 0.00 0.00 0.00 51.96 53.02 1rm6 s ALA 56 Cb 0.08 0.09 0.05 0.00 0.00 0.00 0.00 23.12 23.34 1rm6 s ALA 56 CO 0.83 -0.56 0.22 0.42 0.00 0.00 0.00 175.76 176.67 1rm6 s ILE 57 N -2.41 -0.08 -0.22 0.00 1.01 -1.26 -0.81 121.20 117.43 1rm6 s ILE 57 Ca 0.01 0.18 0.02 0.00 0.00 0.00 0.00 60.65 60.86 1rm6 s ILE 57 Cb -0.01 -0.34 0.04 0.00 0.01 0.00 0.00 42.46 42.16 1rm6 s ILE 57 CO -0.04 0.07 -0.13 -0.62 0.00 0.00 0.00 174.94 174.22 1rm6 s ASP 58 N 1.37 3.76 0.00 3.58 -1.08 0.18 -4.97 116.67 119.51 1rm6 s ASP 58 Ca -0.08 -1.04 0.17 0.00 -0.52 0.00 0.00 52.55 51.08 1rm6 s ASP 58 Cb -0.11 -1.43 0.30 0.00 -1.46 0.00 0.00 42.92 40.22 1rm6 s ASP 58 CO -0.08 -0.13 1.21 0.35 0.52 0.00 0.00 175.17 177.05 1rm6 n THR 59 N 4.56 0.51 -0.17 1.71 -2.24 -1.26 -1.73 114.28 115.67 1rm6 n THR 59 Ca -0.16 -0.76 -0.01 0.00 -2.27 0.00 0.00 64.05 60.85 1rm6 n THR 59 Cb 0.46 0.92 0.07 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 3.19 -0.17 0.15 3.42 4.64 -1.93 -0.27 113.55 122.58 1rm6 h SER 60 Ca 0.00 0.12 -0.09 0.00 -0.47 0.00 0.00 61.79 61.35 1rm6 h SER 60 Cb 0.78 0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 63.06 1rm6 h SER 60 CO 0.00 -0.06 -0.30 0.00 -0.87 0.00 0.00 176.83 175.60 1rm6 h ALA 61 N 1.46 1.25 -0.25 5.18 0.00 -1.84 -1.92 119.26 123.15 1rm6 h ALA 61 Ca 0.27 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 1rm6 h ALA 61 Cb 0.41 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1rm6 h ALA 61 CO -0.42 0.50 -0.41 0.00 0.00 0.00 0.00 179.25 178.92 1rm6 h ALA 62 N 1.48 0.39 -0.10 0.00 0.00 -1.51 -3.08 119.26 116.44 1rm6 h ALA 62 Ca 0.03 -0.46 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 1rm6 h ALA 62 Cb 0.65 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1rm6 h ALA 62 CO 0.05 0.50 -0.13 0.93 0.00 0.00 0.00 179.25 180.60 1rm6 h GLU 63 N 0.45 0.15 0.00 0.00 5.08 -0.80 -2.64 114.58 116.82 1rm6 h GLU 63 Ca 0.02 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1rm6 h GLU 63 Cb 1.01 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1rm6 h GLU 63 CO 0.09 0.29 0.00 0.00 -1.00 0.00 0.00 179.01 178.39 1rm6 n ALA 64 N -2.50 2.09 -2.12 3.43 0.00 -0.75 -4.82 120.51 115.84 1rm6 n ALA 64 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 1rm6 n ALA 64 Cb 0.25 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.23 1rm6 n ALA 64 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1rm6 s LEU 65 N -4.35 4.38 0.24 0.00 2.96 -1.00 -4.94 118.68 115.98 1rm6 s LEU 65 Ca 0.09 2.34 -0.30 0.00 -0.22 0.00 0.00 54.13 56.04 1rm6 s LEU 65 Cb 0.12 -3.59 -0.11 0.00 0.50 0.00 0.00 46.19 43.11 1rm6 s LEU 65 CO 0.52 -0.61 1.54 -0.70 -1.32 0.00 0.00 176.35 175.79 1rm6 s GLU 66 N 0.70 4.19 0.00 1.98 2.12 -1.26 -1.85 118.70 124.58 1rm6 s GLU 66 Ca 0.62 2.44 0.00 0.00 0.36 0.00 0.00 54.97 58.38 1rm6 s GLU 66 Cb -0.37 -3.09 0.00 0.00 0.26 0.00 0.00 34.13 30.94 1rm6 s GLU 66 CO 0.33 -0.56 0.00 0.41 -0.54 0.00 0.00 175.26 174.90 1rm6 n GLY 67 N 2.68 2.50 3.63 -1.50 0.00 -1.26 -5.00 105.19 106.25 1rm6 n GLY 67 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.68 5.04 -0.15 1.61 1.01 -0.77 -0.78 120.40 123.68 1rm6 s VAL 68 Ca 0.00 1.01 0.16 0.00 0.00 0.00 0.00 61.98 63.15 1rm6 s VAL 68 Cb 0.00 -3.88 -0.24 0.00 0.00 0.00 0.00 36.38 32.26 1rm6 s VAL 68 CO 0.00 0.09 0.25 -0.38 0.00 0.00 0.00 175.10 175.06 1rm6 n ILE 69 N 4.99 1.46 -3.65 2.22 2.08 0.11 -4.88 119.36 121.69 1rm6 n ILE 69 Ca -0.03 -0.83 -0.15 0.00 0.56 0.00 0.00 62.75 62.30 1rm6 n ILE 69 Cb 0.50 -0.67 -0.08 0.00 -0.75 0.00 0.00 39.64 38.64 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 -2.52 -1.38 -0.04 -1.39 0.00 -1.06 -4.69 121.76 110.68 1rm6 s ALA 70 Ca -0.09 1.25 0.01 0.00 0.00 0.00 0.00 51.96 53.13 1rm6 s ALA 70 Cb 0.07 -0.45 0.02 0.00 0.00 0.00 0.00 23.12 22.76 1rm6 s ALA 70 CO 0.82 -0.30 -0.04 0.08 0.00 0.00 0.00 175.76 176.33 1rm6 s VAL 71 N -0.48 0.46 0.12 0.00 1.01 -1.26 -0.70 120.40 119.55 1rm6 s VAL 71 Ca -0.06 -0.10 0.08 0.00 0.00 0.00 0.00 61.98 61.91 1rm6 s VAL 71 Cb -0.03 -0.48 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 1rm6 s VAL 71 CO 0.04 0.20 -0.20 0.00 0.00 0.00 0.00 175.10 175.14 1rm6 s THR 73 N -1.43 0.26 -0.28 0.00 -4.23 -1.26 -1.62 115.64 107.08 1rm6 s THR 73 Ca 0.10 -2.00 0.22 0.00 -1.18 0.00 0.00 61.69 58.83 1rm6 s THR 73 Cb -0.09 -2.43 0.23 0.00 1.34 0.00 0.00 72.50 71.55 1rm6 s THR 73 CO 0.05 0.00 1.68 0.61 -0.54 0.00 0.00 174.62 176.43 1rm6 n GLY 74 N -0.73 -1.00 0.30 3.99 0.00 -1.25 -1.39 105.19 105.10 1rm6 n GLY 74 Ca 0.01 0.17 0.16 0.00 0.00 0.00 0.00 46.02 46.36 1rm6 n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rm6 h ALA 75 N 2.08 1.29 -0.09 4.61 0.00 -1.89 -1.72 119.26 123.54 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 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1rm6 h ALA 75 CO 0.00 0.05 0.00 0.39 0.00 0.00 0.00 179.25 179.69 1rm6 n GLU 76 N -3.55 2.06 -3.42 0.00 1.02 -0.49 -4.55 120.64 111.71 1rm6 n GLU 76 Ca -0.02 -1.55 -0.26 0.00 -0.02 0.00 0.00 57.16 55.30 1rm6 n GLU 76 Cb 0.14 -1.47 -0.09 0.00 -0.02 0.00 0.00 31.44 30.01 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 0.85 0.47 1.98 2.62 -2.24 -0.65 -4.95 114.28 112.37 1rm6 n THR 77 Ca 0.17 -4.39 0.16 0.00 -2.27 0.00 0.00 64.05 57.72 1rm6 n THR 77 Cb 0.49 -1.98 0.94 0.00 -2.10 0.00 0.00 70.33 67.68 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 1.63 1.01 -4.26 -0.78 -0.04 -1.26 -4.68 135.00 126.62 1rm6 n PRO 78 Ca 0.25 -0.03 -0.34 0.00 -0.04 0.00 0.00 63.50 63.35 1rm6 n PRO 78 Cb 0.45 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.27 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 -2.01 2.99 0.76 0.52 1.01 -1.26 -5.11 120.40 117.30 1rm6 s VAL 79 Ca 0.47 -0.64 -0.09 0.00 0.00 0.00 0.00 61.98 61.72 1rm6 s VAL 79 Cb 0.22 -2.31 0.08 0.00 0.00 0.00 0.00 36.38 34.37 1rm6 s VAL 79 CO 0.37 0.48 1.09 -2.16 0.00 0.00 0.00 175.10 174.89 1rm6 s PRO 80 N 1.04 1.99 0.12 2.72 0.04 -1.26 -4.60 135.00 135.05 1rm6 s PRO 80 Ca -0.00 -0.16 0.00 0.00 0.04 0.00 0.00 61.00 60.88 1rm6 s PRO 80 Cb -0.15 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 1rm6 s PRO 80 CO -0.02 -1.45 -0.00 -0.59 0.04 0.00 0.00 177.00 174.98 1rm6 s PHE 81 N -3.41 0.87 -0.15 0.56 -0.12 0.61 -4.87 117.98 111.48 1rm6 s PHE 81 Ca 0.62 -1.08 -0.30 0.00 -0.05 0.00 0.00 56.93 56.12 1rm6 s PHE 81 Cb -0.10 -0.52 0.12 0.00 -0.63 0.00 0.00 43.02 41.89 1rm6 s PHE 81 CO 0.47 -0.33 0.99 0.20 -0.05 0.00 0.00 175.22 176.49 1rm6 s GLY 82 N -3.05 -0.29 0.41 1.99 0.00 -1.26 -2.35 107.32 102.78 1rm6 s GLY 82 Ca 0.17 1.95 0.17 0.00 0.00 0.00 0.00 44.72 47.02 1rm6 s GLY 82 CO -0.02 0.98 1.87 -0.24 0.00 0.00 0.00 173.10 175.70 1rm6 h VAL 83 N 2.53 1.04 -3.26 1.40 3.04 -1.82 -3.41 116.25 115.77 1rm6 h VAL 83 Ca -0.19 -1.12 -0.60 0.00 -1.01 0.00 0.00 66.70 63.78 1rm6 h VAL 83 Cb 1.17 1.64 -0.12 0.00 -2.01 0.00 0.00 31.29 31.97 1rm6 h VAL 83 CO 0.31 0.30 -0.48 -0.76 -1.01 0.00 0.00 177.57 175.93 1rm6 s LEU 84 N -7.82 4.21 0.50 3.16 1.43 -1.26 -4.98 118.68 113.93 1rm6 s LEU 84 Ca -0.02 0.25 0.23 0.00 -1.03 0.00 0.00 54.13 53.55 1rm6 s LEU 84 Cb 0.14 -2.10 1.31 0.00 0.03 0.00 0.00 46.19 45.56 1rm6 s LEU 84 CO 0.69 0.18 1.98 -0.65 0.23 0.00 0.00 176.35 178.77 1rm6 h PRO 85 N 6.65 0.10 -0.00 1.29 0.11 -1.86 -1.26 132.00 137.04 1rm6 h PRO 85 Ca -0.41 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1rm6 h PRO 85 Cb 1.15 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1rm6 h PRO 85 CO 0.76 0.07 -0.02 0.44 -0.21 0.00 0.00 178.00 179.04 1rm6 n ILE 86 N -4.40 0.00 -3.06 4.15 -5.35 -1.26 -4.39 119.36 105.04 1rm6 n ILE 86 Ca 0.11 -0.04 -0.19 0.00 -0.27 0.00 0.00 62.75 62.36 1rm6 n ILE 86 Cb 0.58 -0.34 -0.03 0.00 -1.74 0.00 0.00 39.64 38.11 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 -0.92 1.28 -3.53 -1.28 0.00 -0.47 -5.05 120.51 110.53 1rm6 n ALA 87 Ca 0.20 -2.81 -0.41 0.00 0.00 0.00 0.00 53.44 50.42 1rm6 n ALA 87 Cb 0.19 -0.97 -0.07 0.00 0.00 0.00 0.00 19.45 18.59 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 -0.65 2.72 -0.06 0.00 2.02 -1.25 -4.41 118.70 117.07 1rm6 s GLU 88 Ca 0.34 -2.04 0.09 0.00 0.02 0.00 0.00 54.97 53.38 1rm6 s GLU 88 Cb 0.19 -4.00 0.13 0.00 0.10 0.00 0.00 34.13 30.56 1rm6 s GLU 88 CO -0.15 -1.22 1.03 0.27 0.02 0.00 0.00 175.26 175.21 1rm6 n ASN 89 N 4.48 1.32 -4.49 -0.19 0.23 -1.18 -4.51 115.26 110.92 1rm6 n ASN 89 Ca -0.01 -2.42 -0.34 0.00 -0.53 0.00 0.00 54.58 51.28 1rm6 n ASN 89 Cb 0.41 -0.27 -0.12 0.00 -2.08 0.00 0.00 39.78 37.72 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 -1.45 3.66 0.06 -3.83 2.12 -0.99 -4.92 118.70 113.36 1rm6 s GLU 90 Ca 0.15 -0.53 -0.05 0.00 0.36 0.00 0.00 54.97 54.90 1rm6 s GLU 90 Cb 0.13 -2.90 -0.05 0.00 0.26 0.00 0.00 34.13 31.57 1rm6 s GLU 90 CO 0.01 0.24 0.29 0.71 -0.54 0.00 0.00 175.26 175.98 1rm6 s TYR 91 N 0.35 3.53 0.20 5.30 2.02 -1.26 -0.28 117.35 127.21 1rm6 s TYR 91 Ca -0.05 0.50 -0.11 0.00 -0.37 0.00 0.00 57.07 57.05 1rm6 s TYR 91 Cb -0.14 -1.95 0.22 0.00 -0.40 0.00 0.00 41.96 39.69 1rm6 s TYR 91 CO 0.03 0.55 1.78 -1.35 -1.57 0.00 0.00 175.55 174.99 1rm6 h PRO 92 N 3.45 0.50 -5.99 -1.71 0.11 -1.83 -3.39 132.00 123.13 1rm6 h PRO 92 Ca -0.48 -0.03 -0.62 0.00 0.11 0.00 0.00 66.00 64.99 1rm6 h PRO 92 Cb 1.18 -0.11 -0.30 0.00 0.11 0.00 0.00 31.00 31.88 1rm6 h PRO 92 CO 0.70 0.33 -0.86 -0.51 -0.21 0.00 0.00 178.00 177.45 1rm6 s LEU 93 N -10.31 2.03 0.50 2.35 1.43 -1.26 -4.75 118.68 108.67 1rm6 s LEU 93 Ca -0.13 -0.39 -0.23 0.00 -1.03 0.00 0.00 54.13 52.35 1rm6 s LEU 93 Cb 0.16 -1.11 -0.07 0.00 0.03 0.00 0.00 46.19 45.20 1rm6 s LEU 93 CO 0.74 0.25 1.31 0.00 0.23 0.00 0.00 176.35 178.89 1rm6 n ALA 94 N 2.67 1.46 -3.56 4.21 0.00 0.40 -4.26 120.51 121.42 1rm6 n ALA 94 Ca -0.16 0.17 -0.27 0.00 0.00 0.00 0.00 53.44 53.19 1rm6 n ALA 94 Cb 0.53 -2.32 -0.17 0.00 0.00 0.00 0.00 19.45 17.49 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 -2.63 1.93 0.00 0.00 0.52 -1.26 -3.83 118.95 113.68 1rm6 s ARG 95 Ca 0.68 -0.47 0.00 0.00 -0.52 0.00 0.00 55.73 55.42 1rm6 s ARG 95 Cb -0.45 -1.64 0.00 0.00 0.52 0.00 0.00 34.95 33.39 1rm6 s ARG 95 CO 0.53 -0.03 0.00 -0.25 0.02 0.00 0.00 175.30 175.57 1rm6 n ASP 96 N 4.06 0.00 -3.66 0.23 8.00 -1.26 -4.82 116.55 119.09 1rm6 n ASP 96 Ca -0.20 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.20 1rm6 n ASP 96 Cb 0.51 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.57 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 1.19 0.10 -1.24 -2.85 -1.26 -0.52 119.74 115.16 1rm6 s LYS 97 Ca 0.00 -0.76 0.05 0.00 -1.00 0.00 0.00 55.97 54.26 1rm6 s LYS 97 Cb 0.00 0.49 -0.04 0.00 -2.06 0.00 0.00 37.83 36.22 1rm6 s LYS 97 CO 0.00 -0.49 0.03 0.14 0.10 0.00 0.00 175.35 175.13 1rm6 s VAL 98 N -3.83 4.15 0.00 1.79 -7.23 0.24 -4.88 120.40 110.64 1rm6 s VAL 98 Ca 0.05 -0.97 0.00 0.00 -1.81 0.00 0.00 61.98 59.26 1rm6 s VAL 98 Cb 0.01 -3.00 0.00 0.00 0.56 0.00 0.00 36.38 33.95 1rm6 s VAL 98 CO -0.09 0.09 0.48 0.54 -0.31 0.00 0.00 175.10 175.82 1rm6 n ARG 99 N 0.45 0.04 -3.48 4.82 1.74 -1.26 -2.12 116.66 116.85 1rm6 n ARG 99 Ca -0.10 -0.57 -0.14 0.00 -0.77 0.00 0.00 57.85 56.28 1rm6 n ARG 99 Cb 0.52 -0.85 -0.04 0.00 -1.02 0.00 0.00 32.46 31.08 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 -0.18 -0.52 -0.30 -1.55 1.13 -0.61 -4.01 117.35 111.31 1rm6 s TYR 100 Ca 0.00 0.51 -0.29 0.00 -1.41 0.00 0.00 57.07 55.88 1rm6 s TYR 100 Cb 0.00 0.47 0.01 0.00 -1.10 0.00 0.00 41.96 41.33 1rm6 s TYR 100 CO 0.00 -0.75 1.20 0.50 -2.51 0.00 0.00 175.55 173.99 1rm6 s ARG 101 N -2.94 4.01 0.00 -3.49 3.52 -1.21 -1.62 118.95 117.21 1rm6 s ARG 101 Ca -0.03 1.20 0.00 0.00 -0.13 0.00 0.00 55.73 56.77 1rm6 s ARG 101 Cb -0.01 -3.81 0.00 0.00 -1.56 0.00 0.00 34.95 29.58 1rm6 s ARG 101 CO -0.06 -0.99 0.00 0.41 -0.81 0.00 0.00 175.30 173.85 1rm6 n GLY 102 N 4.07 1.52 3.71 8.12 0.00 -0.15 -4.82 105.19 117.64 1rm6 n GLY 102 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1rm6 n GLY 102 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rm6 s ASP 103 N -1.98 6.46 0.20 1.61 3.68 -0.64 -4.33 116.67 121.67 1rm6 s ASP 103 Ca 0.00 2.74 -0.31 0.00 2.13 0.00 0.00 52.55 57.11 1rm6 s ASP 103 Cb 0.00 -2.58 -0.10 0.00 -1.45 0.00 0.00 42.92 38.78 1rm6 s ASP 103 CO 0.00 -0.94 1.54 -2.84 0.13 0.00 0.00 175.17 173.06 1rm6 s PRO 104 N 1.82 4.22 -0.10 4.34 0.02 -1.26 -0.32 135.00 143.71 1rm6 s PRO 104 Ca 0.76 2.37 0.03 0.00 0.02 0.00 0.00 61.00 64.17 1rm6 s PRO 104 Cb -0.46 -3.13 -0.08 0.00 0.02 0.00 0.00 34.50 30.85 1rm6 s PRO 104 CO 0.33 -0.57 -0.06 0.28 -0.33 0.00 0.00 177.00 176.66 1rm6 n VAL 105 N 3.42 0.60 -3.93 3.83 0.31 0.04 -0.46 118.33 122.15 1rm6 n VAL 105 Ca 0.12 -0.27 -0.10 0.00 -0.01 0.00 0.00 64.34 64.08 1rm6 n VAL 105 Cb 0.39 -0.85 -0.02 0.00 -0.91 0.00 0.00 33.84 32.45 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 -2.21 -0.41 0.06 3.52 0.00 -1.13 -4.08 121.76 117.52 1rm6 s ALA 106 Ca -0.11 -0.84 -0.17 0.00 0.00 0.00 0.00 51.96 50.84 1rm6 s ALA 106 Cb 0.03 0.93 0.03 0.00 0.00 0.00 0.00 23.12 24.11 1rm6 s ALA 106 CO 0.27 -0.92 0.40 0.00 0.00 0.00 0.00 175.76 175.51 1rm6 s ALA 107 N -3.34 -0.96 0.07 0.00 0.00 -0.64 -0.18 121.76 116.71 1rm6 s ALA 107 Ca 0.19 0.20 0.02 0.00 0.00 0.00 0.00 51.96 52.38 1rm6 s ALA 107 Cb -0.03 0.41 -0.03 0.00 0.00 0.00 0.00 23.12 23.47 1rm6 s ALA 107 CO 0.11 -0.49 -0.07 0.14 0.00 0.00 0.00 175.76 175.45 1rm6 s VAL 108 N -2.75 0.59 -0.12 0.00 -7.23 -0.13 -0.97 120.40 109.79 1rm6 s VAL 108 Ca -0.04 -1.47 0.02 0.00 -1.81 0.00 0.00 61.98 58.68 1rm6 s VAL 108 Cb -0.00 -1.10 0.02 0.00 0.56 0.00 0.00 36.38 35.86 1rm6 s VAL 108 CO -0.04 -0.61 -0.16 0.00 -0.31 0.00 0.00 175.10 173.97 1rm6 s ALA 109 N -2.42 1.84 0.22 1.32 0.00 0.12 -1.35 121.76 121.48 1rm6 s ALA 109 Ca -0.00 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.12 1rm6 s ALA 109 Cb -0.03 -0.92 -0.05 0.00 0.00 0.00 0.00 23.12 22.13 1rm6 s ALA 109 CO -0.02 -0.14 0.07 0.00 0.00 0.00 0.00 175.76 175.67 1rm6 s ALA 110 N 1.07 1.46 0.34 0.00 0.00 -0.07 -0.71 121.76 123.85 1rm6 s ALA 110 Ca -0.04 -1.73 0.22 0.00 0.00 0.00 0.00 51.96 50.41 1rm6 s ALA 110 Cb -0.14 0.95 1.11 0.00 0.00 0.00 0.00 23.12 25.03 1rm6 s ALA 110 CO -0.04 -0.45 1.94 -0.84 0.00 0.00 0.00 175.76 176.38 1rm6 h ILE 111 N 2.55 0.79 -3.52 0.00 3.07 -1.27 0.22 117.51 119.34 1rm6 h ILE 111 Ca -0.37 -0.89 -0.07 0.00 1.55 0.00 0.00 64.86 65.08 1rm6 h ILE 111 Cb 1.23 1.54 -0.07 0.00 -0.27 0.00 0.00 36.82 39.25 1rm6 h ILE 111 CO 0.60 0.22 -0.01 1.51 -1.05 0.00 0.00 178.15 179.41 1rm6 s ASP 112 N -6.42 0.06 0.16 2.16 1.47 -1.26 -4.57 116.67 108.28 1rm6 s ASP 112 Ca -0.02 -1.00 -0.15 0.00 1.18 0.00 0.00 52.55 52.56 1rm6 s ASP 112 Cb 0.13 0.66 0.04 0.00 -0.34 0.00 0.00 42.92 43.41 1rm6 s ASP 112 CO 0.64 -1.28 1.78 -0.33 0.68 0.00 0.00 175.17 176.65 1rm6 h GLU 113 N 2.15 0.67 -0.65 2.11 3.07 -1.94 -1.49 114.58 118.51 1rm6 h GLU 113 Ca -0.26 -0.07 -0.06 0.00 -0.50 0.00 0.00 59.36 58.47 1rm6 h GLU 113 Cb 1.25 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 28.99 1rm6 h GLU 113 CO 0.35 0.52 0.18 0.28 -1.40 0.00 0.00 179.01 178.93 1rm6 h VAL 114 N 0.65 1.25 -0.45 3.13 2.07 -1.99 -1.09 116.25 119.81 1rm6 h VAL 114 Ca 0.17 -0.88 -0.11 0.00 0.82 0.00 0.00 66.70 66.70 1rm6 h VAL 114 Cb 0.03 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1rm6 h VAL 114 CO -0.03 0.34 -0.15 0.74 0.02 0.00 0.00 177.57 178.49 1rm6 h THR 115 N 0.96 1.27 -0.82 2.57 2.02 -1.94 -1.85 112.91 115.13 1rm6 h THR 115 Ca 0.21 -1.28 -0.03 0.00 0.77 0.00 0.00 66.41 66.08 1rm6 h THR 115 Cb 0.31 1.17 -0.04 0.00 -1.74 0.00 0.00 68.15 67.85 1rm6 h THR 115 CO -0.00 0.44 0.38 0.00 0.37 0.00 0.00 175.52 176.70 1rm6 h ALA 116 N 0.86 1.11 -0.38 6.16 0.00 -0.99 -0.86 119.26 125.16 1rm6 h ALA 116 Ca 0.11 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1rm6 h ALA 116 Cb 0.70 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1rm6 h ALA 116 CO 0.05 0.66 0.15 1.49 0.00 0.00 0.00 179.25 181.59 1rm6 h GLU 117 N 1.18 0.58 -0.73 0.00 4.57 -1.06 -1.95 114.58 117.17 1rm6 h GLU 117 Ca 0.28 -0.11 0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1rm6 h GLU 117 Cb 0.14 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.61 1rm6 h GLU 117 CO -0.03 0.56 0.47 0.87 -1.18 0.00 0.00 179.01 179.70 1rm6 h LYS 118 N 0.47 0.97 -0.73 1.92 1.57 -0.98 -2.49 116.57 117.30 1rm6 h LYS 118 Ca 0.13 -0.07 0.03 0.00 -1.87 0.00 0.00 60.65 58.87 1rm6 h LYS 118 Cb 0.20 -0.21 -0.04 0.00 0.08 0.00 0.00 32.23 32.26 1rm6 h LYS 118 CO -0.01 0.65 0.47 0.00 -0.57 0.00 0.00 179.45 179.99 1rm6 h ALA 119 N 1.26 0.95 -0.80 3.86 0.00 -0.90 -1.99 119.26 121.63 1rm6 h ALA 119 Ca 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1rm6 h ALA 119 Cb -0.09 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.41 1rm6 h ALA 119 CO -0.06 0.27 0.51 -0.07 0.00 0.00 0.00 179.25 179.90 1rm6 h LEU 120 N 0.92 0.94 -1.50 0.00 3.38 -0.92 -1.47 115.31 116.64 1rm6 h LEU 120 Ca 0.29 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.18 1rm6 h LEU 120 Cb -0.01 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1rm6 h LEU 120 CO -0.10 0.70 -0.17 0.00 0.09 0.00 0.00 178.44 178.96 1rm6 h ALA 121 N 1.47 1.12 0.00 1.53 0.00 -1.05 -2.81 119.26 119.52 1rm6 h ALA 121 Ca 0.29 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1rm6 h ALA 121 Cb -0.09 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1rm6 h ALA 121 CO -0.06 0.21 -0.27 1.28 0.00 0.00 0.00 179.25 180.41 1rm6 n LEU 122 N -3.47 0.41 -4.71 0.00 4.77 -0.57 -4.84 117.00 108.59 1rm6 n LEU 122 Ca -0.01 0.30 -0.42 0.00 -0.03 0.00 0.00 56.01 55.86 1rm6 n LEU 122 Cb 0.34 -0.33 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1rm6 n LEU 122 CO 0.31 0.00 0.80 -0.63 -1.33 0.00 0.00 177.39 176.54 1rm6 s ILE 123 N -3.05 4.34 -0.24 -0.08 1.01 -1.06 -4.33 121.20 117.79 1rm6 s ILE 123 Ca 0.11 1.71 -0.07 0.00 0.00 0.00 0.00 60.65 62.41 1rm6 s ILE 123 Cb 0.16 -4.10 -0.02 0.00 0.01 0.00 0.00 42.46 38.51 1rm6 s ILE 123 CO 0.63 0.15 0.05 -0.54 0.00 0.00 0.00 174.94 175.22 1rm6 s LYS 124 N 0.90 3.61 -0.08 2.79 1.02 -0.70 -4.98 119.74 122.29 1rm6 s LYS 124 Ca 0.55 -0.50 0.04 0.00 0.02 0.00 0.00 55.97 56.08 1rm6 s LYS 124 Cb -0.26 -3.25 -0.01 0.00 -0.52 0.00 0.00 37.83 33.79 1rm6 s LYS 124 CO 0.29 -0.17 -0.23 0.08 -0.92 0.00 0.00 175.35 174.41 1rm6 s VAL 125 N 1.52 2.23 -0.30 3.17 1.01 -1.26 -0.65 120.40 126.12 1rm6 s VAL 125 Ca 0.06 -0.98 -0.09 0.00 0.00 0.00 0.00 61.98 60.97 1rm6 s VAL 125 Cb -0.15 -1.84 -0.01 0.00 0.00 0.00 0.00 36.38 34.38 1rm6 s VAL 125 CO 0.02 0.56 0.13 -1.81 0.00 0.00 0.00 175.10 174.00 1rm6 s ASP 126 N 0.07 5.40 0.15 3.32 -0.00 0.01 -5.00 116.67 120.62 1rm6 s ASP 126 Ca -0.10 -0.53 0.07 0.00 -0.00 0.00 0.00 52.55 51.99 1rm6 s ASP 126 Cb -0.16 -1.96 -0.04 0.00 -0.00 0.00 0.00 42.92 40.76 1rm6 s ASP 126 CO 0.06 -0.17 -0.01 -0.31 -0.00 0.00 0.00 175.17 174.74 1rm6 s TYR 127 N 1.59 2.88 -0.35 4.23 1.51 -1.26 -0.21 117.35 125.74 1rm6 s TYR 127 Ca 0.04 -0.11 0.01 0.00 -1.01 0.00 0.00 57.07 56.00 1rm6 s TYR 127 Cb -0.17 -1.42 0.09 0.00 -0.11 0.00 0.00 41.96 40.35 1rm6 s TYR 127 CO 0.05 0.50 0.07 -2.00 -1.11 0.00 0.00 175.55 173.06 1rm6 s GLU 128 N -2.74 1.89 0.22 -0.62 2.12 -0.12 -4.88 118.70 114.56 1rm6 s GLU 128 Ca 0.27 -1.70 -0.30 0.00 0.36 0.00 0.00 54.97 53.60 1rm6 s GLU 128 Cb -0.10 -3.28 -0.09 0.00 0.26 0.00 0.00 34.13 30.92 1rm6 s GLU 128 CO 0.18 -0.88 1.26 0.08 -0.54 0.00 0.00 175.26 175.36 1rm6 s VAL 129 N 1.06 3.28 0.24 3.70 1.01 -1.26 -0.59 120.40 127.84 1rm6 s VAL 129 Ca 0.05 1.10 0.11 0.00 0.00 0.00 0.00 61.98 63.24 1rm6 s VAL 129 Cb -0.20 -3.70 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 1rm6 s VAL 129 CO -0.05 0.19 -0.13 -0.76 0.00 0.00 0.00 175.10 174.34 1rm6 s LEU 130 N -0.44 2.81 0.54 3.92 1.43 -0.06 -4.93 118.68 121.95 1rm6 s LEU 130 Ca 0.54 -0.80 -0.22 0.00 -1.03 0.00 0.00 54.13 52.62 1rm6 s LEU 130 Cb -0.35 -1.40 -0.05 0.00 0.03 0.00 0.00 46.19 44.42 1rm6 s LEU 130 CO 0.40 0.06 1.33 -2.84 0.23 0.00 0.00 176.35 175.52 1rm6 s PRO 131 N -3.26 3.17 0.14 1.29 0.02 -1.26 -4.51 135.00 130.59 1rm6 s PRO 131 Ca 0.28 2.17 0.09 0.00 0.02 0.00 0.00 61.00 63.55 1rm6 s PRO 131 Cb -0.07 -2.24 -0.04 0.00 0.02 0.00 0.00 34.50 32.17 1rm6 s PRO 131 CO 0.15 -1.15 -0.17 0.00 -0.33 0.00 0.00 177.00 175.51 1rm6 s ALA 132 N -1.34 2.73 -0.19 -1.55 0.00 -1.26 -4.83 121.76 115.32 1rm6 s ALA 132 Ca 0.72 -1.42 0.01 0.00 0.00 0.00 0.00 51.96 51.26 1rm6 s ALA 132 Cb -0.39 -0.63 0.02 0.00 0.00 0.00 0.00 23.12 22.13 1rm6 s ALA 132 CO 0.45 0.54 -0.19 0.71 0.00 0.00 0.00 175.76 177.27 1rm6 s TYR 133 N -1.37 2.83 -0.16 0.00 1.51 -1.26 -5.00 117.35 113.91 1rm6 s TYR 133 Ca 0.20 -1.71 0.20 0.00 -1.01 0.00 0.00 57.07 54.75 1rm6 s TYR 133 Cb -0.10 -1.92 -0.10 0.00 -0.11 0.00 0.00 41.96 39.73 1rm6 s TYR 133 CO 0.11 -0.81 0.86 -1.33 -1.11 0.00 0.00 175.55 173.27 1rm6 n MET 134 N 4.60 0.62 -4.43 -0.62 2.81 -1.26 -0.90 117.12 117.94 1rm6 n MET 134 Ca -0.20 0.14 -0.25 0.00 -1.81 0.00 0.00 57.70 55.58 1rm6 n MET 134 Cb 0.49 -1.78 -0.11 0.00 -0.71 0.00 0.00 33.22 31.11 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 -3.14 2.34 0.22 2.03 -4.23 -1.26 -4.89 115.64 106.71 1rm6 s THR 135 Ca -0.03 -2.20 -0.09 0.00 -1.18 0.00 0.00 61.69 58.19 1rm6 s THR 135 Cb 0.09 -2.18 0.18 0.00 1.34 0.00 0.00 72.50 71.93 1rm6 s THR 135 CO 0.81 -0.28 1.89 -0.65 -0.54 0.00 0.00 174.62 175.85 1rm6 h PRO 136 N 2.76 1.04 -0.57 3.99 0.11 -1.91 -1.53 132.00 135.89 1rm6 h PRO 136 Ca -0.43 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 65.65 1rm6 h PRO 136 Cb 1.23 -0.23 -0.04 0.00 0.11 0.00 0.00 31.00 32.07 1rm6 h PRO 136 CO 0.54 0.69 0.33 -0.22 -0.21 0.00 0.00 178.00 179.13 1rm6 h LYS 137 N 1.07 0.62 -0.54 1.05 3.64 -1.97 -0.81 116.57 119.63 1rm6 h LYS 137 Ca 0.30 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.60 1rm6 h LYS 137 Cb -0.10 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.55 1rm6 h LYS 137 CO -0.07 0.41 0.16 0.00 -2.27 0.00 0.00 179.45 177.68 1rm6 h ALA 138 N 1.27 0.71 0.00 5.00 0.00 -1.88 -2.89 119.26 121.46 1rm6 h ALA 138 Ca 0.24 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1rm6 h ALA 138 Cb 0.07 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1rm6 h ALA 138 CO -0.13 0.38 -0.28 0.00 0.00 0.00 0.00 179.25 179.22 1rm6 h ALA 139 N 1.03 1.53 -0.01 0.00 0.00 -0.86 -2.87 119.26 118.07 1rm6 h ALA 139 Ca 0.17 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1rm6 h ALA 139 Cb 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1rm6 h ALA 139 CO -0.00 0.35 -0.17 -1.33 0.00 0.00 0.00 179.25 178.10 1rm6 n MET 140 N -4.19 0.94 -1.80 0.00 2.81 -0.35 -4.43 117.12 110.11 1rm6 n MET 140 Ca -0.02 -0.49 -0.39 0.00 -1.81 0.00 0.00 57.70 54.99 1rm6 n MET 140 Cb 0.33 -1.49 0.03 0.00 -0.71 0.00 0.00 33.22 31.37 1rm6 n MET 140 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1rm6 s LYS 141 N -2.40 3.47 0.43 0.03 1.02 -1.09 -4.88 119.74 116.32 1rm6 s LYS 141 Ca 0.28 2.34 0.15 0.00 0.02 0.00 0.00 55.97 58.76 1rm6 s LYS 141 Cb 0.20 -2.49 1.04 0.00 -0.52 0.00 0.00 37.83 36.06 1rm6 s LYS 141 CO 0.47 -0.97 1.92 0.00 -0.92 0.00 0.00 175.35 175.86 1rm6 h ALA 142 N 1.97 2.10 -0.23 5.17 0.00 -1.91 -1.63 119.26 124.73 1rm6 h ALA 142 Ca -0.51 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1rm6 h ALA 142 Cb 1.28 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1rm6 h ALA 142 CO 0.60 -0.29 0.00 0.41 0.00 0.00 0.00 179.25 179.96 1rm6 n GLY 143 N -1.52 0.25 3.80 0.00 0.00 -1.26 -4.90 105.19 101.56 1rm6 n GLY 143 Ca 0.14 -0.34 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.70 3.03 0.28 4.61 0.00 -0.61 -5.01 121.76 122.36 1rm6 s ALA 144 Ca 0.25 0.55 -0.29 0.00 0.00 0.00 0.00 51.96 52.46 1rm6 s ALA 144 Cb 0.13 -3.21 -0.10 0.00 0.00 0.00 0.00 23.12 19.94 1rm6 s ALA 144 CO 0.19 -0.06 1.15 0.42 0.00 0.00 0.00 175.76 177.45 1rm6 s ILE 145 N -1.91 3.34 -0.01 0.00 1.01 -1.26 -4.99 121.20 117.38 1rm6 s ILE 145 Ca 0.60 1.33 -0.30 0.00 0.00 0.00 0.00 60.65 62.28 1rm6 s ILE 145 Cb -0.16 -3.84 -0.04 0.00 0.01 0.00 0.00 42.46 38.43 1rm6 s ILE 145 CO 0.20 0.31 1.13 0.00 0.00 0.00 0.00 174.94 176.58 1rm6 s ALA 146 N -1.05 3.38 0.20 9.38 0.00 -1.26 -4.90 121.76 127.51 1rm6 s ALA 146 Ca 0.46 0.65 -0.08 0.00 0.00 0.00 0.00 51.96 53.00 1rm6 s ALA 146 Cb -0.34 -3.45 0.14 0.00 0.00 0.00 0.00 23.12 19.47 1rm6 s ALA 146 CO 0.43 -0.53 1.70 -0.07 0.00 0.00 0.00 175.76 177.29 1rm6 h LEU 147 N 7.43 1.04 -8.16 0.00 4.07 -1.92 -3.42 115.31 114.35 1rm6 h LEU 147 Ca -0.38 -0.25 -0.59 0.00 0.08 0.00 0.00 57.88 56.75 1rm6 h LEU 147 Cb 1.19 -0.28 -0.33 0.00 1.08 0.00 0.00 40.66 42.32 1rm6 h LEU 147 CO 0.83 1.03 -0.85 -1.00 -1.08 0.00 0.00 178.44 177.37 1rm6 s HIS 148 N -5.19 1.96 0.53 1.13 3.76 -1.26 -5.05 115.29 111.17 1rm6 s HIS 148 Ca -0.12 -0.75 0.22 0.00 -0.15 0.00 0.00 55.06 54.26 1rm6 s HIS 148 Cb 0.14 -1.36 1.35 0.00 1.11 0.00 0.00 32.58 33.83 1rm6 s HIS 148 CO 0.85 -0.33 2.06 0.22 -0.85 0.00 0.00 174.74 176.68 1rm6 h ASP 149 N 6.79 0.00 0.44 1.40 1.82 -2.01 -1.62 116.42 123.23 1rm6 h ASP 149 Ca -0.26 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.38 1rm6 h ASP 149 Cb 1.21 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.22 1rm6 h ASP 149 CO 0.47 0.00 -0.00 -0.90 -1.61 0.00 0.00 179.24 177.20 1rm6 n ASP 150 N -4.44 0.02 -3.48 2.28 3.85 -1.26 -4.16 116.55 109.35 1rm6 n ASP 150 Ca 0.05 -0.35 -0.27 0.00 -0.71 0.00 0.00 54.79 53.51 1rm6 n ASP 150 Cb 0.41 -0.21 -0.10 0.00 -1.35 0.00 0.00 41.12 39.87 1rm6 n ASP 150 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1rm6 n LYS 151 N -1.21 0.93 0.01 0.11 4.76 -0.61 -4.99 118.16 117.16 1rm6 n LYS 151 Ca 0.16 -3.66 0.22 0.00 -2.87 0.00 0.00 58.31 52.16 1rm6 n LYS 151 Cb 0.21 -1.80 0.73 0.00 -1.84 0.00 0.00 35.03 32.33 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 5.12 0.00 -0.72 1.97 0.11 -1.72 -0.50 132.00 136.26 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 0.52 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.58 1rm6 n ASN 153 N -4.03 4.24 -0.62 -2.05 0.23 -1.26 -4.41 115.26 107.35 1rm6 n ASN 153 Ca 0.10 -2.14 -0.08 0.00 -0.53 0.00 0.00 54.58 51.93 1rm6 n ASN 153 Cb 0.68 -0.52 -0.03 0.00 -2.08 0.00 0.00 39.78 37.82 1rm6 n ASN 153 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1rm6 n ASN 154 N 1.51 -5.50 -4.44 0.53 3.02 -0.20 -4.21 115.26 105.97 1rm6 n ASN 154 Ca 0.25 0.20 -0.44 0.00 -0.03 0.00 0.00 54.58 54.56 1rm6 n ASN 154 Cb 0.71 -3.71 -0.07 0.00 -0.61 0.00 0.00 39.78 36.10 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 -1.79 4.96 0.15 2.41 1.01 -1.26 -0.55 121.20 126.13 1rm6 s ILE 155 Ca 0.00 -0.56 -0.15 0.00 0.00 0.00 0.00 60.65 59.94 1rm6 s ILE 155 Cb 0.00 -4.24 0.02 0.00 0.01 0.00 0.00 42.46 38.25 1rm6 s ILE 155 CO 0.00 -0.72 1.71 0.25 0.00 0.00 0.00 174.94 176.18 1rm6 h LEU 156 N 9.47 0.62 -7.17 2.97 5.85 -1.28 -3.46 115.31 122.32 1rm6 h LEU 156 Ca -0.27 -0.15 -0.08 0.00 0.84 0.00 0.00 57.88 58.21 1rm6 h LEU 156 Cb 1.10 -0.16 -0.21 0.00 0.37 0.00 0.00 40.66 41.76 1rm6 h LEU 156 CO 0.93 0.60 -0.02 -0.60 -0.34 0.00 0.00 178.44 179.02 1rm6 s ARG 157 N -5.62 0.78 0.11 1.25 6.06 -1.18 -5.02 118.95 115.33 1rm6 s ARG 157 Ca -0.13 0.49 0.10 0.00 -2.50 0.00 0.00 55.73 53.69 1rm6 s ARG 157 Cb 0.11 0.37 -0.04 0.00 0.06 0.00 0.00 34.95 35.45 1rm6 s ARG 157 CO 0.76 -0.16 -0.24 -1.21 -2.50 0.00 0.00 175.30 171.95 1rm6 s GLU 158 N -0.37 1.29 -0.06 5.12 2.02 -1.26 -1.01 118.70 124.43 1rm6 s GLU 158 Ca -0.05 -1.25 0.03 0.00 0.02 0.00 0.00 54.97 53.72 1rm6 s GLU 158 Cb -0.03 -1.66 0.01 0.00 0.10 0.00 0.00 34.13 32.55 1rm6 s GLU 158 CO 0.04 0.39 -0.12 0.08 0.02 0.00 0.00 175.26 175.67 1rm6 s VAL 159 N -1.09 1.13 -0.24 2.63 1.01 -0.17 -4.96 120.40 118.70 1rm6 s VAL 159 Ca 0.10 -0.49 -0.04 0.00 0.00 0.00 0.00 61.98 61.55 1rm6 s VAL 159 Cb -0.10 -1.02 0.09 0.00 0.00 0.00 0.00 36.38 35.35 1rm6 s VAL 159 CO 0.05 0.35 0.15 -1.00 0.00 0.00 0.00 175.10 174.65 1rm6 s HIS 160 N 0.55 0.11 0.04 5.22 3.76 -1.26 -1.01 115.29 122.71 1rm6 s HIS 160 Ca -0.12 -0.48 0.03 0.00 -0.15 0.00 0.00 55.06 54.34 1rm6 s HIS 160 Cb -0.15 -0.71 -0.02 0.00 1.11 0.00 0.00 32.58 32.81 1rm6 s HIS 160 CO 0.03 -0.71 -0.09 0.00 -0.85 0.00 0.00 174.74 173.12 1rm6 s ALA 161 N 2.17 0.67 -0.03 -1.40 0.00 0.01 -5.02 121.76 118.16 1rm6 s ALA 161 Ca 0.07 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.28 1rm6 s ALA 161 Cb -0.16 -0.00 0.03 0.00 0.00 0.00 0.00 23.12 22.99 1rm6 s ALA 161 CO -0.24 0.03 0.01 -1.21 0.00 0.00 0.00 175.76 174.34 1rm6 s GLU 162 N -1.44 0.26 -0.24 0.00 2.02 -1.26 -0.74 118.70 117.31 1rm6 s GLU 162 Ca -0.07 0.11 -0.01 0.00 0.02 0.00 0.00 54.97 55.02 1rm6 s GLU 162 Cb -0.09 -0.49 0.03 0.00 0.10 0.00 0.00 34.13 33.68 1rm6 s GLU 162 CO 0.01 -0.16 -0.08 -0.06 0.02 0.00 0.00 175.26 174.99 1rm6 s PHE 163 N 1.15 3.06 0.00 1.61 0.08 0.10 -5.00 117.98 118.98 1rm6 s PHE 163 Ca -0.08 -1.63 0.00 0.00 0.12 0.00 0.00 56.93 55.34 1rm6 s PHE 163 Cb -0.13 -2.03 0.00 0.00 -0.57 0.00 0.00 43.02 40.28 1rm6 s PHE 163 CO -0.02 -0.75 0.00 0.41 -0.10 0.00 0.00 175.22 174.76 1rm6 n GLY 164 N 4.64 -2.44 3.39 4.36 0.00 -1.26 -1.06 105.19 112.82 1rm6 n GLY 164 Ca -0.17 -1.61 -0.45 0.00 0.00 0.00 0.00 46.02 43.80 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 -2.42 6.32 0.18 1.61 -1.08 -1.26 -4.85 116.67 115.18 1rm6 s ASP 165 Ca 0.00 -1.62 -0.08 0.00 -0.52 0.00 0.00 52.55 50.33 1rm6 s ASP 165 Cb 0.00 -2.32 0.07 0.00 -1.46 0.00 0.00 42.92 39.21 1rm6 s ASP 165 CO 0.00 -1.09 1.59 0.58 0.52 0.00 0.00 175.17 176.77 1rm6 h VAL 166 N 5.79 1.27 -0.49 1.11 2.07 -1.92 -1.57 116.25 122.52 1rm6 h VAL 166 Ca -0.17 -1.32 -0.04 0.00 0.82 0.00 0.00 66.70 65.99 1rm6 h VAL 166 Cb 1.07 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.89 1rm6 h VAL 166 CO 1.08 0.46 0.15 0.00 0.02 0.00 0.00 177.57 179.28 1rm6 h ALA 167 N 0.95 0.64 -0.16 1.67 0.00 -2.00 -1.31 119.26 119.06 1rm6 h ALA 167 Ca 0.12 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1rm6 h ALA 167 Cb 0.73 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1rm6 h ALA 167 CO 0.06 0.29 -0.37 0.00 0.00 0.00 0.00 179.25 179.22 1rm6 h ALA 168 N 1.01 1.07 -0.35 0.00 0.00 -1.96 -2.39 119.26 116.64 1rm6 h ALA 168 Ca 0.16 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 1rm6 h ALA 168 Cb 0.27 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1rm6 h ALA 168 CO -0.01 0.59 -0.02 0.00 0.00 0.00 0.00 179.25 179.82 1rm6 h ALA 169 N 1.32 0.47 0.00 0.00 0.00 -0.92 -2.44 119.26 117.69 1rm6 h ALA 169 Ca 0.03 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1rm6 h ALA 169 Cb 0.80 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1rm6 h ALA 169 CO 0.06 0.25 -0.17 0.74 0.00 0.00 0.00 179.25 180.14 1rm6 h PHE 170 N 0.43 0.00 0.00 0.00 0.04 -1.14 -2.18 116.94 114.09 1rm6 h PHE 170 Ca 0.10 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.79 1rm6 h PHE 170 Cb 0.48 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.62 1rm6 h PHE 170 CO 0.04 0.17 -0.37 0.00 -0.60 0.00 0.00 178.31 177.54 1rm6 h ALA 171 N 1.83 0.99 0.00 2.45 0.00 -0.97 -2.77 119.26 120.79 1rm6 h ALA 171 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1rm6 h ALA 171 Cb 0.49 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1rm6 h ALA 171 CO 0.02 0.47 -0.16 -1.91 0.00 0.00 0.00 179.25 177.66 1rm6 n GLU 172 N -3.53 0.11 -2.66 0.00 2.13 -0.83 -4.90 120.64 110.96 1rm6 n GLU 172 Ca -0.00 0.07 -0.34 0.00 0.66 0.00 0.00 57.16 57.55 1rm6 n GLU 172 Cb 0.51 -1.61 -0.05 0.00 0.27 0.00 0.00 31.44 30.56 1rm6 n GLU 172 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1rm6 s ALA 173 N -3.05 2.94 -0.11 4.31 0.00 -1.05 -4.87 121.76 119.94 1rm6 s ALA 173 Ca 0.12 0.53 0.16 0.00 0.00 0.00 0.00 51.96 52.76 1rm6 s ALA 173 Cb 0.16 -3.21 -0.21 0.00 0.00 0.00 0.00 23.12 19.86 1rm6 s ALA 173 CO 0.60 -0.13 0.57 -0.25 0.00 0.00 0.00 175.76 176.55 1rm6 n ASP 174 N -0.81 0.60 -3.78 0.00 8.00 0.26 -4.90 116.55 115.92 1rm6 n ASP 174 Ca 0.08 0.27 -0.15 0.00 0.71 0.00 0.00 54.79 55.71 1rm6 n ASP 174 Cb 0.53 0.43 -0.16 0.00 -0.02 0.00 0.00 41.12 41.90 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 -5.71 1.12 -0.07 0.64 2.96 -0.68 -4.96 118.68 111.98 1rm6 s LEU 175 Ca -0.05 0.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.91 1rm6 s LEU 175 Cb 0.08 -0.05 0.02 0.00 0.50 0.00 0.00 46.19 46.74 1rm6 s LEU 175 CO 0.83 -0.12 -0.09 -0.63 -1.32 0.00 0.00 176.35 175.01 1rm6 s ILE 176 N 1.01 0.96 0.07 6.68 1.01 -1.26 -0.54 121.20 129.13 1rm6 s ILE 176 Ca -0.08 -0.34 0.02 0.00 0.00 0.00 0.00 60.65 60.24 1rm6 s ILE 176 Cb -0.12 -0.92 -0.03 0.00 0.01 0.00 0.00 42.46 41.40 1rm6 s ILE 176 CO -0.03 0.33 -0.07 -0.13 0.00 0.00 0.00 174.94 175.03 1rm6 s ARG 177 N 0.96 0.68 -0.02 2.79 1.81 -0.82 -5.01 118.95 119.35 1rm6 s ARG 177 Ca -0.09 -1.04 -0.05 0.00 -1.72 0.00 0.00 55.73 52.83 1rm6 s ARG 177 Cb -0.15 -0.26 0.00 0.00 -0.45 0.00 0.00 34.95 34.10 1rm6 s ARG 177 CO 0.00 0.02 0.10 -2.00 -0.68 0.00 0.00 175.30 172.75 1rm6 s GLU 178 N -2.67 0.31 -0.00 3.54 2.12 -1.26 -1.62 118.70 119.12 1rm6 s GLU 178 Ca 0.01 -0.19 -0.17 0.00 0.36 0.00 0.00 54.97 54.98 1rm6 s GLU 178 Cb -0.03 0.13 0.03 0.00 0.26 0.00 0.00 34.13 34.52 1rm6 s GLU 178 CO -0.02 -0.06 0.36 0.21 -0.54 0.00 0.00 175.26 175.21 1rm6 s LYS 179 N -0.77 0.77 -0.12 4.30 2.20 -0.44 -4.99 119.74 120.69 1rm6 s LYS 179 Ca -0.09 -0.22 -0.02 0.00 -0.36 0.00 0.00 55.97 55.29 1rm6 s LYS 179 Cb -0.05 0.34 -0.03 0.00 -1.51 0.00 0.00 37.83 36.58 1rm6 s LYS 179 CO 0.01 -0.23 -0.05 0.99 -0.36 0.00 0.00 175.35 175.71 1rm6 s THR 180 N -1.67 3.85 0.03 3.43 2.01 -1.26 -0.99 115.64 121.04 1rm6 s THR 180 Ca -0.11 -0.40 0.08 0.00 0.31 0.00 0.00 61.69 61.58 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 0.03 0.54 -0.25 -0.31 -0.69 0.00 0.00 174.62 173.95 1rm6 s TYR 181 N -0.17 2.16 0.05 4.92 2.02 0.21 -4.92 117.35 121.63 1rm6 s TYR 181 Ca 0.03 -0.40 0.08 0.00 -0.37 0.00 0.00 57.07 56.40 1rm6 s TYR 181 Cb -0.13 -1.31 -0.03 0.00 -0.40 0.00 0.00 41.96 40.09 1rm6 s TYR 181 CO 0.03 0.08 -0.21 0.95 -1.57 0.00 0.00 175.55 174.83 1rm6 s THR 182 N -0.75 1.71 -0.10 -0.71 -4.23 -0.55 -0.62 115.64 110.39 1rm6 s THR 182 Ca 0.10 -1.27 0.00 0.00 -1.18 0.00 0.00 61.69 59.35 1rm6 s THR 182 Cb -0.10 -1.49 0.02 0.00 1.34 0.00 0.00 72.50 72.27 1rm6 s THR 182 CO 0.01 0.18 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.82 1rm6 s PHE 183 N -0.86 1.44 0.77 3.99 0.40 0.01 -0.83 117.98 122.90 1rm6 s PHE 183 Ca 0.08 -0.67 -0.14 0.00 -0.60 0.00 0.00 56.93 55.60 1rm6 s PHE 183 Cb -0.09 -1.17 0.06 0.00 0.51 0.00 0.00 43.02 42.33 1rm6 s PHE 183 CO 0.02 -0.45 1.21 0.00 0.70 0.00 0.00 175.22 176.70 1rm6 s ALA 184 N 1.45 1.99 0.35 5.36 0.00 -0.66 -1.47 121.76 128.79 1rm6 s ALA 184 Ca 0.00 0.86 -0.27 0.00 0.00 0.00 0.00 51.96 52.55 1rm6 s ALA 184 Cb -0.13 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.42 1rm6 s ALA 184 CO -0.05 -2.07 1.13 -2.00 0.00 0.00 0.00 175.76 172.77 1rm6 s GLU 185 N -4.03 4.33 0.21 0.00 2.12 -1.26 -4.50 118.70 115.57 1rm6 s GLU 185 Ca 0.74 1.79 0.04 0.00 0.36 0.00 0.00 54.97 57.90 1rm6 s GLU 185 Cb -0.29 -2.88 -0.05 0.00 0.26 0.00 0.00 34.13 31.17 1rm6 s GLU 185 CO 0.48 -0.06 -0.05 0.14 -0.54 0.00 0.00 175.26 175.23 1rm6 s VAL 186 N -1.34 1.16 0.16 3.70 -7.23 -0.95 -1.49 120.40 114.40 1rm6 s VAL 186 Ca 0.52 -2.06 0.09 0.00 -1.81 0.00 0.00 61.98 58.72 1rm6 s VAL 186 Cb -0.30 -2.18 -0.04 0.00 0.56 0.00 0.00 36.38 34.42 1rm6 s VAL 186 CO 0.38 -0.47 -0.20 0.21 -0.31 0.00 0.00 175.10 174.71 1rm6 s ASN 187 N -3.27 2.82 0.36 4.85 3.84 -1.26 -1.94 114.94 120.34 1rm6 s ASN 187 Ca 0.25 -0.82 0.14 0.00 0.21 0.00 0.00 52.86 52.63 1rm6 s ASN 187 Cb 0.04 -0.17 0.70 0.00 -0.55 0.00 0.00 41.25 41.27 1rm6 s ASN 187 CO 0.06 0.02 1.80 0.45 -2.79 0.00 0.00 177.10 176.64 1rm6 h HIS 188 N 3.45 0.00 -6.95 0.43 3.86 -1.90 -3.48 115.15 110.55 1rm6 h HIS 188 Ca -0.44 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.24 1rm6 h HIS 188 Cb 1.20 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 29.59 1rm6 h HIS 188 CO 0.66 0.40 -0.87 0.28 0.86 0.00 0.00 177.93 179.26 1rm6 n VAL 189 N -3.96 -1.72 -1.97 2.45 0.31 -1.26 -4.90 118.33 107.28 1rm6 n VAL 189 Ca -0.02 -0.48 -0.39 0.00 -0.01 0.00 0.00 64.34 63.45 1rm6 n VAL 189 Cb 0.44 -1.51 0.01 0.00 -0.91 0.00 0.00 33.84 31.87 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 -3.91 2.61 0.07 3.52 -3.43 -1.26 -4.90 115.29 107.99 1rm6 s HIS 190 Ca 0.27 1.40 0.22 0.00 -0.80 0.00 0.00 55.06 56.15 1rm6 s HIS 190 Cb -0.15 -3.70 0.76 0.00 -1.43 0.00 0.00 32.58 28.07 1rm6 s HIS 190 CO 0.86 -2.37 1.76 0.52 -2.00 0.00 0.00 174.74 173.51 1rm6 h MET 191 N 2.12 0.00 -6.45 -0.38 2.86 -1.91 -3.43 114.93 107.75 1rm6 h MET 191 Ca -0.50 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 56.61 1rm6 h MET 191 Cb 1.27 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.90 1rm6 h MET 191 CO 0.60 0.26 0.32 -2.00 1.06 0.00 0.00 176.91 177.15 1rm6 s GLU 192 N -3.53 4.61 0.48 1.72 2.12 -1.23 -5.03 118.70 117.84 1rm6 s GLU 192 Ca 0.01 1.35 -0.21 0.00 0.36 0.00 0.00 54.97 56.48 1rm6 s GLU 192 Cb 0.10 -3.40 -0.08 0.00 0.26 0.00 0.00 34.13 31.01 1rm6 s GLU 192 CO 0.65 0.14 1.09 -0.51 -0.54 0.00 0.00 175.26 176.10 1rm6 s LEU 193 N 0.33 3.91 0.56 2.70 1.43 -1.26 -4.97 118.68 121.38 1rm6 s LEU 193 Ca 0.47 2.10 -0.21 0.00 -1.03 0.00 0.00 54.13 55.46 1rm6 s LEU 193 Cb -0.22 -4.43 -0.04 0.00 0.03 0.00 0.00 46.19 41.53 1rm6 s LEU 193 CO 0.28 -0.88 1.32 0.20 0.23 0.00 0.00 176.35 177.49 1rm6 s ASN 194 N -1.71 5.22 -0.09 2.29 0.01 -1.26 -4.87 114.94 114.53 1rm6 s ASN 194 Ca 0.66 2.68 -0.30 0.00 -0.71 0.00 0.00 52.86 55.20 1rm6 s ASN 194 Cb -0.22 -2.63 0.11 0.00 0.41 0.00 0.00 41.25 38.92 1rm6 s ASN 194 CO 0.26 -1.60 0.88 0.00 -1.51 0.00 0.00 177.10 175.13 1rm6 s ALA 195 N -1.35 -1.85 -0.07 0.60 0.00 -1.26 -1.38 121.76 116.44 1rm6 s ALA 195 Ca 0.73 1.35 -0.05 0.00 0.00 0.00 0.00 51.96 54.00 1rm6 s ALA 195 Cb -0.38 -0.23 0.03 0.00 0.00 0.00 0.00 23.12 22.54 1rm6 s ALA 195 CO 0.44 -0.42 0.17 0.99 0.00 0.00 0.00 175.76 176.94 1rm6 s THR 196 N -1.67 -0.02 -0.24 0.00 2.01 -0.58 -2.32 115.64 112.82 1rm6 s THR 196 Ca -0.03 0.09 -0.03 0.00 0.31 0.00 0.00 61.69 62.03 1rm6 s THR 196 Cb -0.00 -0.26 0.01 0.00 0.01 0.00 0.00 72.50 72.26 1rm6 s THR 196 CO 0.01 0.04 -0.03 -0.22 -0.69 0.00 0.00 174.62 173.72 1rm6 s LEU 197 N 0.65 3.16 -0.19 4.42 2.96 0.27 -0.77 118.68 129.18 1rm6 s LEU 197 Ca -0.05 -0.64 -0.01 0.00 -0.22 0.00 0.00 54.13 53.21 1rm6 s LEU 197 Cb -0.06 -1.73 0.01 0.00 0.50 0.00 0.00 46.19 44.91 1rm6 s LEU 197 CO -0.03 -0.09 -0.15 0.00 -1.32 0.00 0.00 176.35 174.75 1rm6 s ALA 198 N 1.42 2.49 -0.30 5.97 0.00 -0.02 -1.06 121.76 130.25 1rm6 s ALA 198 Ca 0.03 -1.19 -0.05 0.00 0.00 0.00 0.00 51.96 50.75 1rm6 s ALA 198 Cb -0.16 -1.34 0.03 0.00 0.00 0.00 0.00 23.12 21.65 1rm6 s ALA 198 CO -0.03 -0.35 0.05 -1.21 0.00 0.00 0.00 175.76 174.22 1rm6 s GLU 199 N 1.31 2.75 -0.18 0.00 2.02 0.43 -0.59 118.70 124.45 1rm6 s GLU 199 Ca 0.04 -1.07 -0.06 0.00 0.02 0.00 0.00 54.97 53.90 1rm6 s GLU 199 Cb -0.14 -3.31 -0.03 0.00 0.10 0.00 0.00 34.13 30.75 1rm6 s GLU 199 CO -0.09 -0.55 0.03 -0.47 0.02 0.00 0.00 175.26 174.20 1rm6 s TYR 200 N 1.39 3.15 -0.45 1.61 5.04 -0.16 -0.69 117.35 127.24 1rm6 s TYR 200 Ca -0.01 -0.11 -0.12 0.00 -2.44 0.00 0.00 57.07 54.40 1rm6 s TYR 200 Cb -0.18 -2.05 0.09 0.00 0.35 0.00 0.00 41.96 40.16 1rm6 s TYR 200 CO 0.01 0.04 0.33 0.34 -1.34 0.00 0.00 175.55 174.93 1rm6 s ASP 201 N 0.48 5.84 0.36 4.32 -1.08 0.22 -3.81 116.67 123.00 1rm6 s ASP 201 Ca 0.01 -1.55 0.27 0.00 -0.52 0.00 0.00 52.55 50.76 1rm6 s ASP 201 Cb -0.13 -2.06 0.92 0.00 -1.46 0.00 0.00 42.92 40.18 1rm6 s ASP 201 CO 0.01 -0.62 1.78 1.55 0.52 0.00 0.00 175.17 178.41 1rm6 h PRO 202 N 8.55 0.00 -0.31 4.34 0.13 -1.86 0.38 132.00 143.24 1rm6 h PRO 202 Ca -0.25 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.70 1rm6 h PRO 202 Cb 1.09 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 1rm6 h PRO 202 CO 0.83 0.00 -0.51 0.28 -0.23 0.00 0.00 178.00 178.38 1rm6 h VAL 203 N 0.00 1.27 -0.00 1.56 2.07 -1.96 -3.28 116.25 115.91 1rm6 h VAL 203 Ca 0.00 -1.69 0.00 0.00 0.82 0.00 0.00 66.70 65.83 1rm6 h VAL 203 Cb 0.61 1.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1rm6 h VAL 203 CO 0.00 0.55 -0.70 0.54 0.02 0.00 0.00 177.57 177.98 1rm6 n ARG 204 N -4.03 1.46 -3.38 1.57 1.74 -1.17 -5.01 116.66 107.84 1rm6 n ARG 204 Ca -0.04 -0.19 -0.19 0.00 -0.77 0.00 0.00 57.85 56.66 1rm6 n ARG 204 Cb 0.61 -1.30 0.06 0.00 -1.02 0.00 0.00 32.46 30.80 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 -1.10 -6.33 -3.87 0.55 2.03 0.13 -5.03 116.55 102.93 1rm6 n ASP 205 Ca 0.04 -0.76 -0.12 0.00 0.52 0.00 0.00 54.79 54.47 1rm6 n ASP 205 Cb 0.29 -4.60 -0.14 0.00 -0.72 0.00 0.00 41.12 35.95 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 -4.77 0.02 -0.07 -0.67 -1.94 -0.92 -4.87 119.30 106.09 1rm6 s MET 206 Ca 0.42 -0.01 0.05 0.00 -1.71 0.00 0.00 55.69 54.44 1rm6 s MET 206 Cb -0.09 -0.03 -0.00 0.00 2.01 0.00 0.00 34.83 36.72 1rm6 s MET 206 CO 0.78 0.00 -0.22 -1.17 -0.01 0.00 0.00 175.02 174.40 1rm6 s LEU 207 N 0.01 2.02 -0.09 -0.03 2.96 0.36 -0.61 118.68 123.30 1rm6 s LEU 207 Ca -0.00 -0.49 0.03 0.00 -0.22 0.00 0.00 54.13 53.46 1rm6 s LEU 207 Cb -0.00 -1.28 0.00 0.00 0.50 0.00 0.00 46.19 45.42 1rm6 s LEU 207 CO -0.00 0.18 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.12 1rm6 s THR 208 N 0.13 1.71 -0.04 3.68 2.01 0.13 -1.12 115.64 122.14 1rm6 s THR 208 Ca -0.10 -0.82 0.06 0.00 0.31 0.00 0.00 61.69 61.14 1rm6 s THR 208 Cb -0.15 -1.50 -0.01 0.00 0.01 0.00 0.00 72.50 70.85 1rm6 s THR 208 CO 0.05 0.48 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.49 1rm6 s LEU 209 N 0.46 2.01 -0.16 4.42 1.43 -0.24 -0.43 118.68 126.18 1rm6 s LEU 209 Ca -0.17 -0.42 -0.00 0.00 -1.03 0.00 0.00 54.13 52.50 1rm6 s LEU 209 Cb -0.17 -1.16 -0.00 0.00 0.03 0.00 0.00 46.19 44.89 1rm6 s LEU 209 CO 0.07 0.23 -0.13 0.20 0.23 0.00 0.00 176.35 176.94 1rm6 s ASN 210 N -0.24 3.80 0.08 2.29 0.01 -0.23 -0.69 114.94 119.95 1rm6 s ASN 210 Ca 0.01 -0.44 -0.09 0.00 -0.71 0.00 0.00 52.86 51.63 1rm6 s ASN 210 Cb -0.11 -1.59 0.00 0.00 0.41 0.00 0.00 41.25 39.96 1rm6 s ASN 210 CO 0.01 0.08 0.21 0.28 -1.51 0.00 0.00 177.10 176.17 1rm6 s THR 211 N 0.84 0.13 -1.31 1.60 -1.32 -1.06 -0.57 115.64 113.96 1rm6 s THR 211 Ca -0.04 -1.08 -0.16 0.00 -1.21 0.00 0.00 61.69 59.20 1rm6 s THR 211 Cb -0.15 -1.25 0.09 0.00 -1.51 0.00 0.00 72.50 69.67 1rm6 s THR 211 CO -0.00 -0.60 1.79 0.35 -2.21 0.00 0.00 174.62 173.95 1rm6 n THR 212 N 0.06 3.94 -4.18 5.08 -2.24 -0.98 -4.49 114.28 111.46 1rm6 n THR 212 Ca -0.16 -4.03 -0.18 0.00 -2.27 0.00 0.00 64.05 57.41 1rm6 n THR 212 Cb 0.62 -2.42 -0.12 0.00 -2.10 0.00 0.00 70.33 66.31 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 3.28 1.05 -1.82 4.28 -1.32 -1.26 -4.88 115.64 114.97 1rm6 s THR 213 Ca 0.50 -1.24 0.24 0.00 -1.21 0.00 0.00 61.69 59.98 1rm6 s THR 213 Cb 0.05 -1.01 0.07 0.00 -1.51 0.00 0.00 72.50 70.10 1rm6 s THR 213 CO 0.03 -0.21 1.26 0.00 -2.21 0.00 0.00 174.62 173.48 1rm6 n GLN 214 N 1.39 0.94 -3.19 7.08 6.02 -0.02 -4.64 117.38 124.96 1rm6 n GLN 214 Ca -0.21 -0.70 -0.23 0.00 -0.01 0.00 0.00 57.00 55.85 1rm6 n GLN 214 Cb 0.54 -1.49 -0.05 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 -0.42 0.55 -0.02 5.09 0.24 -1.21 -1.54 118.33 121.02 1rm6 n VAL 215 Ca 0.10 -4.64 0.18 0.00 -2.04 0.00 0.00 64.34 57.94 1rm6 n VAL 215 Cb 0.41 -1.34 0.64 0.00 -1.47 0.00 0.00 33.84 32.08 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 3.54 0.10 -0.30 7.34 0.13 -1.90 -0.62 132.00 140.30 1rm6 h PRO 216 Ca 0.11 -0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 65.20 1rm6 h PRO 216 Cb 0.82 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.91 1rm6 h PRO 216 CO 0.59 0.07 0.03 -0.92 -0.23 0.00 0.00 178.00 177.54 1rm6 h TYR 217 N 0.11 0.53 -0.64 1.56 -0.00 -1.90 -0.40 116.97 116.23 1rm6 h TYR 217 Ca 0.26 -0.08 -0.04 0.00 -0.00 0.00 0.00 58.73 58.87 1rm6 h TYR 217 Cb 0.89 -0.14 -0.03 0.00 -0.00 0.00 0.00 36.73 37.44 1rm6 h TYR 217 CO -0.00 0.60 0.23 1.88 -0.00 0.00 0.00 178.16 180.88 1rm6 h TYR 218 N 0.31 0.97 -0.55 -3.82 0.05 -1.47 -1.12 116.97 111.34 1rm6 h TYR 218 Ca 0.09 -0.07 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 1rm6 h TYR 218 Cb 0.37 -0.29 -0.03 0.00 1.01 0.00 0.00 36.73 37.79 1rm6 h TYR 218 CO 0.03 0.76 0.30 0.28 -1.05 0.00 0.00 178.16 178.48 1rm6 h VAL 219 N 0.94 1.18 -0.55 -2.88 2.07 -1.04 -0.78 116.25 115.19 1rm6 h VAL 219 Ca 0.22 -0.46 0.04 0.00 0.82 0.00 0.00 66.70 67.32 1rm6 h VAL 219 Cb 0.22 0.49 -0.05 0.00 -1.52 0.00 0.00 31.29 30.43 1rm6 h VAL 219 CO -0.02 0.20 0.29 -0.74 0.02 0.00 0.00 177.57 177.32 1rm6 h HIS 220 N 0.74 0.54 -0.33 1.57 6.17 -0.40 0.18 115.15 123.62 1rm6 h HIS 220 Ca 0.19 0.02 -0.04 0.00 0.71 0.00 0.00 60.37 61.25 1rm6 h HIS 220 Cb 0.04 -0.16 -0.01 0.00 2.52 0.00 0.00 27.41 29.80 1rm6 h HIS 220 CO -0.01 0.27 0.05 -0.07 0.71 0.00 0.00 177.93 178.87 1rm6 h LEU 221 N 0.56 0.53 -0.40 0.26 3.38 -0.84 -2.13 115.31 116.67 1rm6 h LEU 221 Ca 0.24 -0.26 -0.18 0.00 0.09 0.00 0.00 57.88 57.77 1rm6 h LEU 221 Cb 0.13 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1rm6 h LEU 221 CO -0.15 0.66 -0.79 0.11 0.09 0.00 0.00 178.44 178.36 1rm6 h LYS 222 N 0.39 0.17 -0.35 1.13 1.79 -0.88 -1.30 116.57 117.52 1rm6 h LYS 222 Ca 0.10 -0.16 -0.09 0.00 -2.18 0.00 0.00 60.65 58.32 1rm6 h LYS 222 Cb 0.36 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.04 1rm6 h LYS 222 CO 0.01 0.87 -0.12 0.28 -1.08 0.00 0.00 179.45 179.41 1rm6 h VAL 223 N 0.10 1.28 -0.41 0.50 2.07 -0.97 0.88 116.25 119.71 1rm6 h VAL 223 Ca -0.03 -1.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.27 1rm6 h VAL 223 Cb 1.38 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 32.48 1rm6 h VAL 223 CO 0.12 0.40 0.23 0.00 0.02 0.00 0.00 177.57 178.34 1rm6 h ALA 224 N 0.80 0.52 -0.18 1.67 0.00 -1.31 -0.74 119.26 120.02 1rm6 h ALA 224 Ca 0.08 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1rm6 h ALA 224 Cb 0.64 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1rm6 h ALA 224 CO 0.04 0.04 -0.05 0.00 0.00 0.00 0.00 179.25 179.28 1rm6 h ALA 225 N 1.09 0.25 -0.05 0.00 0.00 -1.10 -1.08 119.26 118.37 1rm6 h ALA 225 Ca 0.14 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 1rm6 h ALA 225 Cb 0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1rm6 h ALA 225 CO -0.02 0.02 -0.59 0.00 0.00 0.00 0.00 179.25 178.66 1rm6 n LEU 227 N -3.87 1.10 -3.68 0.00 4.77 -0.29 -4.61 117.00 110.43 1rm6 n LEU 227 Ca -0.02 -0.30 -0.21 0.00 -0.03 0.00 0.00 56.01 55.45 1rm6 n LEU 227 Cb 0.60 -0.11 0.04 0.00 -2.33 0.00 0.00 43.42 41.62 1rm6 n LEU 227 CO 0.44 0.20 -0.06 0.00 -1.33 0.00 0.00 177.39 176.64 1rm6 n GLN 228 N -0.53 -4.84 -5.00 3.23 6.02 -0.52 -5.00 117.38 110.74 1rm6 n GLN 228 Ca 0.13 0.63 -0.28 0.00 -0.01 0.00 0.00 57.00 57.47 1rm6 n GLN 228 Cb 0.35 -5.19 -0.16 0.00 1.02 0.00 0.00 30.24 26.26 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 -5.91 1.94 0.32 -1.09 1.75 -0.53 -5.05 119.30 110.73 1rm6 s MET 229 Ca 0.02 -0.72 -0.29 0.00 -1.25 0.00 0.00 55.69 53.45 1rm6 s MET 229 Cb -0.01 -1.72 -0.12 0.00 2.84 0.00 0.00 34.83 35.83 1rm6 s MET 229 CO 0.81 0.34 1.52 -3.47 -0.65 0.00 0.00 175.02 173.57 1rm6 n ASP 230 N 2.92 3.68 0.23 1.11 2.03 -1.26 -4.52 116.55 120.74 1rm6 n ASP 230 Ca -0.17 1.18 0.17 0.00 0.52 0.00 0.00 54.79 56.49 1rm6 n ASP 230 Cb 0.53 -1.58 0.86 0.00 -0.72 0.00 0.00 41.12 40.20 1rm6 n ASP 230 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1rm6 h SER 231 N 3.90 0.00 0.72 1.67 4.64 -1.93 -0.59 113.55 121.97 1rm6 h SER 231 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1rm6 h SER 231 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1rm6 h SER 231 CO 0.72 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.68 1rm6 n ALA 232 N -2.30 1.89 0.22 5.18 0.00 -1.26 -2.33 120.51 121.90 1rm6 n ALA 232 Ca 0.00 -0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.51 1rm6 n ALA 232 Cb 0.27 -1.33 0.26 0.00 0.00 0.00 0.00 19.45 18.65 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 -1.61 2.47 -5.08 0.00 1.74 -0.23 -4.94 116.66 109.02 1rm6 n ARG 233 Ca 0.05 -2.24 -0.28 0.00 -0.77 0.00 0.00 57.85 54.60 1rm6 n ARG 233 Cb 0.24 -1.51 -0.16 0.00 -1.02 0.00 0.00 32.46 30.01 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 -1.37 1.72 -0.06 0.55 1.01 -0.99 -0.49 121.20 121.57 1rm6 s ILE 234 Ca 0.41 -0.93 0.03 0.00 0.00 0.00 0.00 60.65 60.16 1rm6 s ILE 234 Cb 0.23 -1.43 0.01 0.00 0.01 0.00 0.00 42.46 41.27 1rm6 s ILE 234 CO 0.31 0.49 -0.15 -0.60 0.00 0.00 0.00 174.94 174.99 1rm6 s ARG 235 N -0.48 1.89 -0.12 2.79 3.52 -0.28 -4.97 118.95 121.30 1rm6 s ARG 235 Ca 0.07 -0.52 0.03 0.00 -0.13 0.00 0.00 55.73 55.18 1rm6 s ARG 235 Cb -0.09 -1.55 0.00 0.00 -1.56 0.00 0.00 34.95 31.75 1rm6 s ARG 235 CO -0.01 0.10 -0.22 0.08 -0.81 0.00 0.00 175.30 174.44 1rm6 s VAL 236 N 0.46 2.16 -0.05 7.11 1.01 -1.26 -1.08 120.40 128.75 1rm6 s VAL 236 Ca -0.13 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 60.93 1rm6 s VAL 236 Cb -0.15 -1.85 -0.00 0.00 0.00 0.00 0.00 36.38 34.38 1rm6 s VAL 236 CO 0.04 0.55 -0.17 -0.63 0.00 0.00 0.00 175.10 174.89 1rm6 s ILE 237 N 0.55 1.46 -0.32 2.22 1.01 0.13 -1.48 121.20 124.77 1rm6 s ILE 237 Ca -0.13 -0.72 -0.09 0.00 0.00 0.00 0.00 60.65 59.71 1rm6 s ILE 237 Cb -0.17 -1.26 0.01 0.00 0.01 0.00 0.00 42.46 41.05 1rm6 s ILE 237 CO 0.04 0.42 0.14 -0.75 0.00 0.00 0.00 174.94 174.79 1rm6 s LYS 238 N 0.16 3.13 0.00 2.79 2.20 -0.78 -2.55 119.74 124.70 1rm6 s LYS 238 Ca -0.07 -0.85 0.00 0.00 -0.36 0.00 0.00 55.97 54.69 1rm6 s LYS 238 Cb -0.13 -3.53 0.00 0.00 -1.51 0.00 0.00 37.83 32.66 1rm6 s LYS 238 CO 0.03 -0.49 0.00 -0.35 -0.36 0.00 0.00 175.35 174.18 1rm6 n PRO 239 N 4.94 1.33 -1.79 4.03 -0.04 -1.26 -4.85 135.00 137.36 1rm6 n PRO 239 Ca -0.14 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 62.94 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 0.25 2.31 -0.08 0.54 0.08 -1.04 -4.94 117.98 115.10 1rm6 s PHE 240 Ca 0.00 1.36 0.03 0.00 0.12 0.00 0.00 56.93 58.44 1rm6 s PHE 240 Cb 0.00 -3.81 0.00 0.00 -0.57 0.00 0.00 43.02 38.64 1rm6 s PHE 240 CO 0.00 -2.90 -0.18 -1.17 -0.10 0.00 0.00 175.22 170.87 1rm6 s LEU 241 N -3.42 1.88 -0.73 -0.37 2.96 -1.26 -4.02 118.68 113.72 1rm6 s LEU 241 Ca 0.70 -0.43 -0.07 0.00 -0.22 0.00 0.00 54.13 54.12 1rm6 s LEU 241 Cb -0.41 -1.12 -0.09 0.00 0.50 0.00 0.00 46.19 45.07 1rm6 s LEU 241 CO 0.49 0.11 3.09 0.61 -1.32 0.00 0.00 176.35 179.32 1rm6 n GLY 242 N 3.58 3.95 0.06 7.98 0.00 -1.26 -4.44 105.19 115.07 1rm6 n GLY 242 Ca -0.20 -1.56 0.01 0.00 0.00 0.00 0.00 46.02 44.27 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 2.34 -1.34 0.74 -0.02 0.00 -1.19 -3.52 105.19 102.20 1rm6 n GLY 243 Ca 0.57 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 45.07 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 -1.22 -0.23 2.38 -0.02 0.00 -1.26 -4.93 105.19 99.91 1rm6 n GLY 244 Ca 0.00 0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.91 -0.50 0.00 1.61 3.72 -1.26 -1.28 117.46 117.84 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 -3.27 0.00 0.00 -0.94 0.00 0.00 39.48 35.27 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 -0.54 2.10 0.36 1.37 0.00 -1.26 -1.17 105.19 106.05 1rm6 n GLY 246 Ca -0.19 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.94 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 1.94 -0.57 4.61 0.00 -1.24 -2.29 119.26 121.71 1rm6 h ALA 247 Ca 0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.59 1rm6 h ALA 247 Cb 0.00 -0.11 -0.19 0.00 0.00 0.00 0.00 17.79 17.49 1rm6 h ALA 247 CO 0.00 -0.09 0.10 0.54 0.00 0.00 0.00 179.25 179.80 1rm6 n ARG 248 N -4.48 2.08 -0.54 0.00 1.74 -1.26 -4.51 116.66 109.69 1rm6 n ARG 248 Ca 0.12 -3.22 0.09 0.00 -0.77 0.00 0.00 57.85 54.06 1rm6 n ARG 248 Cb 0.38 -1.96 0.32 0.00 -1.02 0.00 0.00 32.46 30.18 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 -1.10 1.58 -4.00 0.55 -2.24 -0.86 -0.84 114.28 107.37 1rm6 n THR 249 Ca 0.42 -1.04 -0.09 0.00 -2.27 0.00 0.00 64.05 61.06 1rm6 n THR 249 Cb 1.16 0.11 -0.11 0.00 -2.10 0.00 0.00 70.33 69.39 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 -1.76 0.35 0.21 -0.78 -1.05 -1.26 -4.89 118.70 109.53 1rm6 s GLU 250 Ca 0.46 -0.65 -0.31 0.00 -0.15 0.00 0.00 54.97 54.32 1rm6 s GLU 250 Cb 0.29 0.06 -0.10 0.00 -0.44 0.00 0.00 34.13 33.94 1rm6 s GLU 250 CO 0.23 -0.04 1.48 0.00 0.95 0.00 0.00 175.26 177.88 1rm6 s ALA 251 N -1.55 3.67 0.12 -0.84 0.00 -1.26 -4.95 121.76 116.95 1rm6 s ALA 251 Ca -0.14 1.33 0.04 0.00 0.00 0.00 0.00 51.96 53.18 1rm6 s ALA 251 Cb -0.09 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.41 1rm6 s ALA 251 CO -0.01 -0.75 0.12 -0.51 0.00 0.00 0.00 175.76 174.61 1rm6 s LEU 252 N 0.19 3.85 0.29 0.00 1.43 -1.26 -4.93 118.68 118.25 1rm6 s LEU 252 Ca 0.63 -0.04 0.03 0.00 -1.03 0.00 0.00 54.13 53.72 1rm6 s LEU 252 Cb -0.42 -2.49 0.69 0.00 0.03 0.00 0.00 46.19 43.99 1rm6 s LEU 252 CO 0.39 0.13 1.72 1.12 0.23 0.00 0.00 176.35 179.93 1rm6 h HIS 253 N 2.88 0.70 0.00 0.29 2.07 -1.94 -1.60 115.15 117.55 1rm6 h HIS 253 Ca -0.47 0.04 -0.05 0.00 -2.85 0.00 0.00 60.37 57.04 1rm6 h HIS 253 Cb 1.18 -0.17 -0.01 0.00 2.57 0.00 0.00 27.41 30.98 1rm6 h HIS 253 CO 0.59 0.02 -0.25 0.27 -3.07 0.00 0.00 177.93 175.50 1rm6 h PHE 254 N 0.47 0.00 -0.16 6.12 -0.00 -1.96 0.64 116.94 122.06 1rm6 h PHE 254 Ca 0.54 0.00 -0.04 0.00 -0.00 0.00 0.00 57.97 58.47 1rm6 h PHE 254 Cb 0.96 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.91 1rm6 h PHE 254 CO -0.12 0.25 -0.05 0.93 -0.00 0.00 0.00 178.31 179.32 1rm6 h GLU 255 N 0.00 0.31 -0.48 6.09 5.08 -1.68 -0.54 114.58 123.36 1rm6 h GLU 255 Ca -0.00 -0.12 -0.09 0.00 -1.00 0.00 0.00 59.36 58.14 1rm6 h GLU 255 Cb 0.46 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1rm6 h GLU 255 CO 0.03 0.60 -0.07 0.82 -1.00 0.00 0.00 179.01 179.39 1rm6 h ILE 256 N -0.00 1.27 -0.80 3.13 2.04 -1.34 -2.63 117.51 119.18 1rm6 h ILE 256 Ca 0.04 -1.18 -0.04 0.00 1.00 0.00 0.00 64.86 64.68 1rm6 h ILE 256 Cb 0.49 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 1rm6 h ILE 256 CO 0.02 0.41 0.34 0.40 0.00 0.00 0.00 178.15 179.32 1rm6 h ILE 257 N 0.74 1.26 -0.76 -0.67 2.04 -0.81 -0.57 117.51 118.74 1rm6 h ILE 257 Ca 0.13 -0.77 0.01 0.00 1.00 0.00 0.00 64.86 65.22 1rm6 h ILE 257 Cb 0.61 0.27 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 1rm6 h ILE 257 CO 0.04 0.32 0.50 0.00 0.00 0.00 0.00 178.15 179.01 1rm6 h ALA 258 N 1.23 0.96 -0.48 1.87 0.00 -0.91 0.87 119.26 122.80 1rm6 h ALA 258 Ca 0.27 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1rm6 h ALA 258 Cb 0.17 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1rm6 h ALA 258 CO -0.03 0.37 0.17 0.78 0.00 0.00 0.00 179.25 180.54 1rm6 h GLY 259 N 1.02 0.79 0.99 0.00 0.00 -1.08 -0.43 103.07 104.37 1rm6 h GLY 259 Ca 0.28 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1rm6 h GLY 259 CO -0.06 0.42 0.19 -2.00 0.00 0.00 0.00 176.54 175.09 1rm6 h LEU 260 N 0.63 0.35 -0.62 3.11 5.85 -0.70 -1.77 115.31 122.16 1rm6 h LEU 260 Ca 0.16 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 1rm6 h LEU 260 Cb 0.24 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1rm6 h LEU 260 CO -0.01 0.27 0.08 -0.07 -0.34 0.00 0.00 178.44 178.37 1rm6 h LEU 261 N 0.40 1.01 -0.86 2.25 3.38 -0.66 -1.41 115.31 119.42 1rm6 h LEU 261 Ca 0.11 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1rm6 h LEU 261 Cb -0.03 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.41 1rm6 h LEU 261 CO -0.02 1.02 0.48 0.00 0.09 0.00 0.00 178.44 180.02 1rm6 h ALA 262 N 1.02 1.10 -0.40 1.53 0.00 -0.84 0.59 119.26 122.26 1rm6 h ALA 262 Ca 0.19 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 1rm6 h ALA 262 Cb 0.46 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1rm6 h ALA 262 CO 0.02 0.60 -0.26 -0.09 0.00 0.00 0.00 179.25 179.51 1rm6 h ARG 263 N 1.20 0.89 -0.64 0.00 2.43 -1.16 0.63 114.38 117.72 1rm6 h ARG 263 Ca 0.31 -0.42 -0.08 0.00 -0.81 0.00 0.00 59.98 58.97 1rm6 h ARG 263 Cb 0.01 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 1rm6 h ARG 263 CO -0.05 1.07 0.07 -0.22 -1.51 0.00 0.00 179.97 179.33 1rm6 h LYS 264 N 0.70 1.08 0.00 0.20 1.63 -0.86 -2.38 116.57 116.94 1rm6 h LYS 264 Ca 0.08 -0.31 0.00 0.00 -0.85 0.00 0.00 60.65 59.57 1rm6 h LYS 264 Cb 0.84 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.35 1rm6 h LYS 264 CO 0.07 1.01 0.00 0.00 -3.45 0.00 0.00 179.45 177.09 1rm6 n ALA 265 N -2.47 2.31 -3.73 5.00 0.00 0.16 -4.90 120.51 116.88 1rm6 n ALA 265 Ca 0.04 -0.09 -0.25 0.00 0.00 0.00 0.00 53.44 53.14 1rm6 n ALA 265 Cb 0.31 -1.47 0.05 0.00 0.00 0.00 0.00 19.45 18.34 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 -1.59 -6.24 0.00 0.00 5.02 0.08 -4.90 118.16 110.53 1rm6 n LYS 266 Ca 0.07 0.69 0.00 0.00 -2.02 0.00 0.00 58.31 57.05 1rm6 n LYS 266 Cb 0.35 -5.58 0.00 0.00 -0.02 0.00 0.00 35.03 29.77 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 -1.71 3.64 3.39 0.72 0.00 -0.40 -4.63 105.19 106.20 1rm6 n GLY 267 Ca -0.07 -0.35 -0.32 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.44 2.81 -0.06 2.61 2.01 -1.26 -0.98 115.64 120.32 1rm6 s THR 268 Ca 0.00 -0.79 0.02 0.00 0.31 0.00 0.00 61.69 61.23 1rm6 s THR 268 Cb 0.00 -2.11 0.01 0.00 0.01 0.00 0.00 72.50 70.41 1rm6 s THR 268 CO 0.00 0.56 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.70 1rm6 s VAL 269 N -0.23 1.01 -0.28 3.82 1.01 0.24 -0.55 120.40 125.42 1rm6 s VAL 269 Ca 0.00 -0.41 -0.07 0.00 0.00 0.00 0.00 61.98 61.50 1rm6 s VAL 269 Cb -0.13 -0.94 -0.00 0.00 0.00 0.00 0.00 36.38 35.30 1rm6 s VAL 269 CO 0.03 0.33 0.09 -0.60 0.00 0.00 0.00 175.10 174.95 1rm6 s ARG 270 N 0.68 3.30 -0.38 2.72 3.52 0.08 -0.84 118.95 128.04 1rm6 s ARG 270 Ca -0.14 -0.72 -0.04 0.00 -0.13 0.00 0.00 55.73 54.70 1rm6 s ARG 270 Cb -0.15 -3.39 0.08 0.00 -1.56 0.00 0.00 34.95 29.93 1rm6 s ARG 270 CO 0.03 -0.36 0.16 -1.17 -0.81 0.00 0.00 175.30 173.15 1rm6 s LEU 271 N 1.55 4.82 0.16 -0.88 2.96 0.05 -1.18 118.68 126.16 1rm6 s LEU 271 Ca 0.04 -1.64 -0.01 0.00 -0.22 0.00 0.00 54.13 52.30 1rm6 s LEU 271 Cb -0.16 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.64 1rm6 s LEU 271 CO 0.03 -0.45 0.34 -0.76 -1.32 0.00 0.00 176.35 174.19 1rm6 s LEU 272 N 1.26 4.27 0.08 -0.68 1.43 -1.26 -1.52 118.68 122.26 1rm6 s LEU 272 Ca 0.03 0.37 0.10 0.00 -1.03 0.00 0.00 54.13 53.60 1rm6 s LEU 272 Cb -0.22 -3.12 -0.03 0.00 0.03 0.00 0.00 46.19 42.85 1rm6 s LEU 272 CO -0.01 0.02 -0.26 -1.10 0.23 0.00 0.00 176.35 175.23 1rm6 s GLN 273 N -3.06 1.62 0.90 1.70 -1.52 -0.48 -4.95 119.66 113.87 1rm6 s GLN 273 Ca 0.38 -1.21 -0.14 0.00 -1.95 0.00 0.00 55.36 52.43 1rm6 s GLN 273 Cb -0.12 -1.93 0.15 0.00 -0.22 0.00 0.00 33.01 30.90 1rm6 s GLN 273 CO 0.28 0.48 1.27 0.95 -0.25 0.00 0.00 175.29 178.02 1rm6 s THR 274 N -0.92 2.00 0.19 -0.19 -4.23 -1.26 -4.47 115.64 106.76 1rm6 s THR 274 Ca 0.13 -0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.56 1rm6 s THR 274 Cb -0.10 -3.00 0.06 0.00 1.34 0.00 0.00 72.50 70.80 1rm6 s THR 274 CO 0.04 0.00 1.64 -0.09 -0.54 0.00 0.00 174.62 175.67 1rm6 h ARG 275 N -1.41 1.01 -0.53 3.99 9.65 -1.98 -0.23 114.38 124.88 1rm6 h ARG 275 Ca -0.45 -0.34 0.04 0.00 -1.10 0.00 0.00 59.98 58.14 1rm6 h ARG 275 Cb 1.27 -0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 29.73 1rm6 h ARG 275 CO 0.49 1.02 0.28 1.49 2.80 0.00 0.00 179.97 186.05 1rm6 h GLU 276 N 0.91 0.53 -0.01 0.20 4.81 -1.94 -0.60 114.58 118.48 1rm6 h GLU 276 Ca 0.15 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 1rm6 h GLU 276 Cb 0.60 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 1rm6 h GLU 276 CO 0.04 0.35 -0.30 0.93 -0.73 0.00 0.00 179.01 179.30 1rm6 h GLU 277 N 0.55 0.01 -0.43 1.92 5.08 -1.82 -0.17 114.58 119.73 1rm6 h GLU 277 Ca 0.23 -0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.45 1rm6 h GLU 277 Cb 0.12 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1rm6 h GLU 277 CO -0.15 0.31 -0.27 1.15 -1.00 0.00 0.00 179.01 179.05 1rm6 h THR 278 N 0.01 1.27 -0.38 1.13 2.02 -0.15 -0.75 112.91 116.06 1rm6 h THR 278 Ca -0.00 -1.43 -0.06 0.00 0.77 0.00 0.00 66.41 65.69 1rm6 h THR 278 Cb 0.53 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 1rm6 h THR 278 CO 0.04 0.49 -0.02 -0.26 0.37 0.00 0.00 175.52 176.13 1rm6 h PHE 279 N 0.78 0.65 -0.34 3.16 -1.00 -0.44 -2.56 116.94 117.19 1rm6 h PHE 279 Ca 0.09 -0.08 -0.09 0.00 2.81 0.00 0.00 57.97 60.70 1rm6 h PHE 279 Cb 0.84 -0.18 -0.02 0.00 3.61 0.00 0.00 35.95 40.20 1rm6 h PHE 279 CO 0.05 0.64 -0.18 0.82 -1.61 0.00 0.00 178.31 178.03 1rm6 h ILE 280 N 0.58 1.26 -0.68 -0.55 2.04 -0.66 -2.66 117.51 116.84 1rm6 h ILE 280 Ca 0.12 -1.20 0.02 0.00 1.00 0.00 0.00 64.86 64.80 1rm6 h ILE 280 Cb 0.40 1.19 -0.04 0.00 -0.74 0.00 0.00 36.82 37.63 1rm6 h ILE 280 CO 0.02 0.40 0.44 0.00 0.00 0.00 0.00 178.15 179.00 1rm6 h ALA 281 N 1.25 0.88 -0.69 1.87 0.00 -0.79 -3.44 119.26 118.34 1rm6 h ALA 281 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1rm6 h ALA 281 Cb 0.62 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1rm6 h ALA 281 CO 0.04 0.24 0.00 1.58 0.00 0.00 0.00 179.25 181.11 1rm6 n HIS 282 N -4.65 0.00 -2.22 0.00 -0.00 -1.00 -4.68 115.22 102.67 1rm6 n HIS 282 Ca 0.07 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.66 1rm6 n HIS 282 Cb 0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.04 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 0.23 -1.01 -0.28 1.57 5.12 -0.10 -4.80 116.66 117.37 1rm6 n ARG 283 Ca 0.00 0.63 0.00 0.00 -1.93 0.00 0.00 57.85 56.55 1rm6 n ARG 283 Cb 0.00 -4.83 0.00 0.00 -1.16 0.00 0.00 32.46 26.47 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 -1.02 0.22 3.69 -0.13 0.00 -1.26 -1.78 105.19 104.91 1rm6 n GLY 284 Ca -0.15 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 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 -1.34 4.37 0.53 1.61 3.52 -0.82 -0.85 118.95 125.97 1rm6 s ARG 285 Ca 0.00 1.62 -0.20 0.00 -0.13 0.00 0.00 55.73 57.03 1rm6 s ARG 285 Cb 0.00 -3.54 -0.06 0.00 -1.56 0.00 0.00 34.95 29.79 1rm6 s ARG 285 CO 0.00 -0.41 1.13 -1.25 -0.81 0.00 0.00 175.30 173.96 1rm6 s PRO 286 N 2.11 3.41 0.28 5.12 0.04 -1.26 -2.23 135.00 142.46 1rm6 s PRO 286 Ca 0.55 1.62 -0.30 0.00 0.04 0.00 0.00 61.00 62.90 1rm6 s PRO 286 Cb -0.24 -2.05 -0.13 0.00 0.04 0.00 0.00 34.50 32.13 1rm6 s PRO 286 CO 0.22 -0.80 1.47 1.87 0.04 0.00 0.00 177.00 179.79 1rm6 n TRP 287 N -1.21 2.47 -3.83 0.56 -0.00 -1.26 -4.50 117.44 109.67 1rm6 n TRP 287 Ca 0.11 0.38 -0.13 0.00 -0.00 0.00 0.00 57.50 57.86 1rm6 n TRP 287 Cb 0.51 -2.51 -0.14 0.00 -0.00 0.00 0.00 31.31 29.17 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 -0.20 -0.01 -0.17 5.87 2.01 -0.54 -1.59 115.64 121.01 1rm6 s THR 288 Ca 0.65 0.05 -0.02 0.00 0.31 0.00 0.00 61.69 62.68 1rm6 s THR 288 Cb -0.58 -0.09 -0.02 0.00 0.01 0.00 0.00 72.50 71.83 1rm6 s THR 288 CO 0.51 0.02 -0.07 -0.70 -0.69 0.00 0.00 174.62 173.69 1rm6 s GLU 289 N 0.32 3.47 -0.16 4.92 2.12 -0.43 -0.81 118.70 128.13 1rm6 s GLU 289 Ca -0.02 -0.61 0.01 0.00 0.36 0.00 0.00 54.97 54.70 1rm6 s GLU 289 Cb -0.04 -2.84 0.02 0.00 0.26 0.00 0.00 34.13 31.53 1rm6 s GLU 289 CO -0.01 0.09 -0.19 0.08 -0.54 0.00 0.00 175.26 174.69 1rm6 s VAL 290 N 0.71 1.92 -0.22 3.70 1.01 0.21 -1.34 120.40 126.38 1rm6 s VAL 290 Ca -0.04 -0.86 -0.09 0.00 0.00 0.00 0.00 61.98 60.99 1rm6 s VAL 290 Cb -0.15 -1.73 -0.05 0.00 0.00 0.00 0.00 36.38 34.45 1rm6 s VAL 290 CO 0.02 0.52 0.12 -0.75 0.00 0.00 0.00 175.10 175.01 1rm6 s LYS 291 N 1.18 4.03 -0.09 2.72 2.20 -0.09 -0.62 119.74 129.07 1rm6 s LYS 291 Ca 0.01 -0.30 0.04 0.00 -0.36 0.00 0.00 55.97 55.37 1rm6 s LYS 291 Cb -0.14 -3.42 -0.00 0.00 -1.51 0.00 0.00 37.83 32.76 1rm6 s LYS 291 CO -0.09 0.13 -0.24 1.41 -0.36 0.00 0.00 175.35 176.20 1rm6 s MET 292 N 0.83 2.95 -0.07 4.03 -2.45 -0.16 -0.89 119.30 123.54 1rm6 s MET 292 Ca 0.06 -0.88 -0.01 0.00 -1.25 0.00 0.00 55.69 53.61 1rm6 s MET 292 Cb -0.13 -2.28 0.03 0.00 1.25 0.00 0.00 34.83 33.70 1rm6 s MET 292 CO 0.02 0.22 -0.00 0.21 1.05 0.00 0.00 175.02 176.53 1rm6 s LYS 293 N 0.23 0.61 -0.02 4.11 2.20 -0.11 -1.32 119.74 125.44 1rm6 s LYS 293 Ca -0.16 0.10 0.05 0.00 -0.36 0.00 0.00 55.97 55.61 1rm6 s LYS 293 Cb -0.17 -0.96 -0.01 0.00 -1.51 0.00 0.00 37.83 35.18 1rm6 s LYS 293 CO 0.08 -0.29 -0.18 0.42 -0.36 0.00 0.00 175.35 175.02 1rm6 s ILE 294 N 1.91 1.45 -0.11 5.43 1.01 -0.64 -1.00 121.20 129.25 1rm6 s ILE 294 Ca 0.04 -0.77 0.01 0.00 0.00 0.00 0.00 60.65 59.93 1rm6 s ILE 294 Cb -0.12 -1.22 -0.02 0.00 0.01 0.00 0.00 42.46 41.11 1rm6 s ILE 294 CO -0.05 0.41 -0.14 -0.83 0.00 0.00 0.00 174.94 174.34 1rm6 s GLY 295 N -0.29 1.53 0.18 6.18 0.00 -0.21 -1.94 107.32 112.78 1rm6 s GLY 295 Ca 0.04 -0.91 0.08 0.00 0.00 0.00 0.00 44.72 43.93 1rm6 s GLY 295 CO 0.00 -0.29 -0.16 1.08 0.00 0.00 0.00 173.10 173.73 1rm6 s LEU 296 N 0.16 2.49 0.50 0.66 1.43 0.30 -0.33 118.68 123.90 1rm6 s LEU 296 Ca -0.07 -0.93 -0.04 0.00 -1.03 0.00 0.00 54.13 52.05 1rm6 s LEU 296 Cb -0.15 -0.72 -0.01 0.00 0.03 0.00 0.00 46.19 45.33 1rm6 s LEU 296 CO 0.05 -0.11 0.79 -0.54 0.23 0.00 0.00 176.35 176.77 1rm6 s LYS 297 N -3.19 3.22 0.59 1.70 -0.14 0.29 -0.57 119.74 121.64 1rm6 s LYS 297 Ca 0.18 -0.04 0.35 0.00 -1.36 0.00 0.00 55.97 55.10 1rm6 s LYS 297 Cb -0.03 -2.39 1.82 0.00 -1.68 0.00 0.00 37.83 35.55 1rm6 s LYS 297 CO 0.06 -0.37 2.18 1.57 -0.76 0.00 0.00 175.35 178.03 1rm6 h LYS 298 N 0.15 0.00 -0.04 1.68 2.10 -1.93 -0.90 116.57 117.64 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 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1rm6 h LYS 298 CO 0.60 0.04 0.00 -0.40 -2.00 0.00 0.00 179.45 177.69 1rm6 n ASP 299 N -3.33 0.80 0.00 7.07 5.75 -1.26 -4.90 116.55 120.68 1rm6 n ASP 299 Ca -0.02 -1.40 0.00 0.00 -0.01 0.00 0.00 54.79 53.36 1rm6 n ASP 299 Cb 0.18 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.25 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 1.03 0.41 3.75 6.12 0.00 -0.34 -5.06 105.19 111.10 1rm6 n GLY 300 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.95 4.31 0.15 1.61 -0.14 -1.26 -4.73 119.74 118.74 1rm6 s LYS 301 Ca 0.00 2.25 -0.30 0.00 -1.36 0.00 0.00 55.97 56.55 1rm6 s LYS 301 Cb 0.00 -3.10 -0.08 0.00 -1.68 0.00 0.00 37.83 32.97 1rm6 s LYS 301 CO 0.00 -0.31 1.25 0.42 -0.76 0.00 0.00 175.35 175.94 1rm6 s ILE 302 N -0.47 3.56 -0.20 2.17 1.01 -1.26 -0.54 121.20 125.47 1rm6 s ILE 302 Ca 0.55 1.24 0.06 0.00 0.00 0.00 0.00 60.65 62.49 1rm6 s ILE 302 Cb -0.40 -3.79 -0.16 0.00 0.01 0.00 0.00 42.46 38.11 1rm6 s ILE 302 CO 0.47 0.16 -0.11 0.00 0.00 0.00 0.00 174.94 175.46 1rm6 n ALA 303 N 3.03 1.56 -3.54 9.38 0.00 0.55 -4.45 120.51 127.04 1rm6 n ALA 303 Ca 0.07 -0.97 -0.08 0.00 0.00 0.00 0.00 53.44 52.46 1rm6 n ALA 303 Cb 0.44 -0.03 -0.02 0.00 0.00 0.00 0.00 19.45 19.85 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 -2.42 -1.77 -0.02 0.00 0.00 -0.98 -4.07 121.76 112.50 1rm6 s ALA 304 Ca -0.22 0.80 -0.01 0.00 0.00 0.00 0.00 51.96 52.53 1rm6 s ALA 304 Cb 0.07 0.51 0.01 0.00 0.00 0.00 0.00 23.12 23.70 1rm6 s ALA 304 CO 0.55 -0.76 0.05 -1.17 0.00 0.00 0.00 175.76 174.44 1rm6 s LEU 305 N -2.59 1.55 -0.03 0.00 2.96 -0.66 -1.04 118.68 118.87 1rm6 s LEU 305 Ca 0.06 0.10 -0.00 0.00 -0.22 0.00 0.00 54.13 54.07 1rm6 s LEU 305 Cb -0.01 0.13 0.03 0.00 0.50 0.00 0.00 46.19 46.84 1rm6 s LEU 305 CO -0.07 -0.05 0.02 0.00 -1.32 0.00 0.00 176.35 174.92 1rm6 s ALA 306 N 0.37 0.24 0.07 5.97 0.00 -0.17 -0.97 121.76 127.27 1rm6 s ALA 306 Ca -0.03 0.20 0.02 0.00 0.00 0.00 0.00 51.96 52.15 1rm6 s ALA 306 Cb -0.04 -0.36 -0.03 0.00 0.00 0.00 0.00 23.12 22.68 1rm6 s ALA 306 CO -0.01 -0.17 -0.07 -0.48 0.00 0.00 0.00 175.76 175.03 1rm6 s LEU 307 N 1.26 2.40 -0.03 0.00 2.34 -0.35 -0.94 118.68 123.36 1rm6 s LEU 307 Ca -0.06 -0.80 0.04 0.00 0.06 0.00 0.00 54.13 53.36 1rm6 s LEU 307 Cb -0.13 -0.08 -0.00 0.00 -0.56 0.00 0.00 46.19 45.42 1rm6 s LEU 307 CO -0.03 -0.37 -0.14 -1.61 -1.06 0.00 0.00 176.35 173.15 1rm6 s GLU 308 N -2.83 1.40 -0.04 1.48 2.02 -0.07 -1.84 118.70 118.81 1rm6 s GLU 308 Ca 0.01 -0.49 0.01 0.00 0.02 0.00 0.00 54.97 54.53 1rm6 s GLU 308 Cb -0.01 -1.26 0.02 0.00 0.10 0.00 0.00 34.13 32.98 1rm6 s GLU 308 CO -0.03 0.21 -0.04 0.00 0.02 0.00 0.00 175.26 175.42 1rm6 s ALA 309 N 0.04 0.62 -0.13 5.21 0.00 -0.63 -0.91 121.76 125.96 1rm6 s ALA 309 Ca -0.02 -0.02 0.03 0.00 0.00 0.00 0.00 51.96 51.94 1rm6 s ALA 309 Cb -0.10 -0.40 0.01 0.00 0.00 0.00 0.00 23.12 22.64 1rm6 s ALA 309 CO 0.01 -0.01 -0.22 0.99 0.00 0.00 0.00 175.76 176.54 1rm6 s THR 310 N 0.89 2.02 -0.08 0.00 2.01 -0.45 -0.78 115.64 119.24 1rm6 s THR 310 Ca -0.12 -0.96 0.03 0.00 0.31 0.00 0.00 61.69 60.95 1rm6 s THR 310 Cb -0.14 -1.78 -0.02 0.00 0.01 0.00 0.00 72.50 70.57 1rm6 s THR 310 CO 0.00 0.54 -0.18 -1.10 -0.69 0.00 0.00 174.62 173.19 1rm6 s GLN 311 N 0.75 2.85 -0.48 4.92 -0.21 -0.22 -1.32 119.66 125.96 1rm6 s GLN 311 Ca -0.09 -0.78 -0.22 0.00 0.02 0.00 0.00 55.36 54.29 1rm6 s GLN 311 Cb -0.16 -2.38 0.03 0.00 1.00 0.00 0.00 33.01 31.50 1rm6 s GLN 311 CO -0.00 0.38 0.78 0.00 -2.12 0.00 0.00 175.29 174.32 1rm6 s ALA 312 N -0.11 3.28 -2.56 6.09 0.00 -0.62 -1.07 121.76 126.77 1rm6 s ALA 312 Ca -0.03 -1.17 0.23 0.00 0.00 0.00 0.00 51.96 50.99 1rm6 s ALA 312 Cb -0.14 -3.49 0.52 0.00 0.00 0.00 0.00 23.12 20.01 1rm6 s ALA 312 CO 0.04 -2.01 1.44 0.41 0.00 0.00 0.00 175.76 175.64 1rm6 n GLY 313 N 5.04 1.02 5.29 0.00 0.00 0.85 -4.06 105.19 113.35 1rm6 n GLY 313 Ca 0.01 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 1.35 -2.13 0.06 -0.02 0.00 -1.26 -1.20 105.19 102.00 1rm6 n GLY 314 Ca 0.17 -1.52 0.12 0.00 0.00 0.00 0.00 46.02 44.80 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 2.75 -2.23 4.61 0.00 0.31 -1.74 120.51 124.10 1rm6 n ALA 315 Ca 0.00 -0.18 -0.13 0.00 0.00 0.00 0.00 53.44 53.13 1rm6 n ALA 315 Cb 0.00 -1.28 -0.10 0.00 0.00 0.00 0.00 19.45 18.07 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 -3.11 1.18 0.04 0.00 1.51 -1.26 -4.92 117.35 110.79 1rm6 s TYR 316 Ca 0.09 -0.79 -0.30 0.00 -1.01 0.00 0.00 57.07 55.06 1rm6 s TYR 316 Cb 0.14 -0.61 -0.18 0.00 -0.11 0.00 0.00 41.96 41.20 1rm6 s TYR 316 CO 0.67 0.03 1.43 0.00 -1.11 0.00 0.00 175.55 176.57 1rm6 h ALA 317 N 2.82 -0.79 -0.50 3.71 0.00 -1.91 -3.45 119.26 119.15 1rm6 h ALA 317 Ca -0.36 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1rm6 h ALA 317 Cb 1.18 0.30 0.00 0.00 0.00 0.00 0.00 17.79 19.28 1rm6 h ALA 317 CO 0.64 -0.87 0.00 0.41 0.00 0.00 0.00 179.25 179.43 1rm6 n GLY 318 N -1.03 2.84 0.02 0.00 0.00 -1.26 -1.18 105.19 104.57 1rm6 n GLY 318 Ca -0.12 -0.11 0.15 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.34 1.61 4.02 -1.26 -4.38 117.16 130.81 1rm6 n TYR 319 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.97 1rm6 n TYR 319 Cb 0.00 -0.17 0.17 0.00 -0.02 0.00 0.00 39.34 39.32 1rm6 n TYR 319 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1rm6 n GLY 320 N 1.18 -1.54 0.36 2.72 0.00 -0.32 -0.23 105.19 107.36 1rm6 n GLY 320 Ca 0.18 1.01 -0.03 0.00 0.00 0.00 0.00 46.02 47.18 1rm6 n GLY 320 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1rm6 h ILE 321 N 0.00 1.25 -0.23 -0.61 2.04 -1.80 -1.20 117.51 116.96 1rm6 h ILE 321 Ca 0.50 -0.53 -0.09 0.00 1.00 0.00 0.00 64.86 65.74 1rm6 h ILE 321 Cb 0.84 -0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.85 1rm6 h ILE 321 CO -0.97 0.26 -0.22 0.40 0.00 0.00 0.00 178.15 177.62 1rm6 h ILE 322 N 1.27 1.32 -0.72 -0.67 2.04 -0.95 -2.85 117.51 116.96 1rm6 h ILE 322 Ca 0.33 -1.38 0.02 0.00 1.00 0.00 0.00 64.86 64.83 1rm6 h ILE 322 Cb -0.08 1.70 -0.04 0.00 -0.74 0.00 0.00 36.82 37.66 1rm6 h ILE 322 CO -0.06 0.43 0.47 0.74 0.00 0.00 0.00 178.15 179.72 1rm6 h THR 323 N 0.25 1.15 -0.03 -0.27 2.02 -0.80 -1.26 112.91 113.97 1rm6 h THR 323 Ca 0.04 -0.32 -0.12 0.00 0.77 0.00 0.00 66.41 66.78 1rm6 h THR 323 Cb 0.77 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 1rm6 h THR 323 CO 0.06 0.17 -0.53 -0.29 0.37 0.00 0.00 175.52 175.30 1rm6 h ILE 324 N 0.94 1.38 -0.21 3.11 6.09 -1.23 -2.31 117.51 125.28 1rm6 h ILE 324 Ca 0.27 -1.82 -0.12 0.00 -1.37 0.00 0.00 64.86 61.82 1rm6 h ILE 324 Cb -0.06 1.95 -0.01 0.00 0.47 0.00 0.00 36.82 39.17 1rm6 h ILE 324 CO -0.08 0.53 -0.40 -0.07 -3.07 0.00 0.00 178.15 175.06 1rm6 h LEU 325 N 0.06 0.51 -2.09 2.19 3.38 -1.19 -2.79 115.31 115.39 1rm6 h LEU 325 Ca -0.00 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 1rm6 h LEU 325 Cb 0.96 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 1rm6 h LEU 325 CO 0.07 0.86 -0.02 1.88 0.09 0.00 0.00 178.44 181.32 1rm6 h TYR 326 N 0.40 0.00 0.00 1.13 0.99 -0.68 -2.01 116.97 116.80 1rm6 h TYR 326 Ca 0.04 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.75 1rm6 h TYR 326 Cb 0.87 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.60 1rm6 h TYR 326 CO 0.03 0.02 -0.06 1.79 -0.00 0.00 0.00 178.16 179.94 1rm6 h THR 327 N 0.00 0.56 0.00 -2.88 1.35 -1.24 -3.15 112.91 107.55 1rm6 h THR 327 Ca -0.00 -0.26 -0.01 0.00 -0.55 0.00 0.00 66.41 65.60 1rm6 h THR 327 Cb 0.30 1.16 -0.00 0.00 -1.73 0.00 0.00 68.15 67.88 1rm6 h THR 327 CO 0.00 0.06 -1.36 0.61 -0.25 0.00 0.00 175.52 174.58 1rm6 n GLY 328 N -1.03 -0.35 0.33 5.82 0.00 -0.91 -4.70 105.19 104.34 1rm6 n GLY 328 Ca -0.02 -0.18 0.01 0.00 0.00 0.00 0.00 46.02 45.82 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 0.69 1.47 -0.82 4.61 0.00 -1.34 -2.46 119.26 121.41 1rm6 h ALA 329 Ca -0.01 -0.08 -0.31 0.00 0.00 0.00 0.00 54.91 54.51 1rm6 h ALA 329 Cb 0.40 -0.25 -0.18 0.00 0.00 0.00 0.00 17.79 17.75 1rm6 h ALA 329 CO 0.00 0.45 0.39 1.28 0.00 0.00 0.00 179.25 181.37 1rm6 n LEU 330 N -4.40 6.33 0.07 0.00 4.32 -1.25 -3.29 117.00 118.77 1rm6 n LEU 330 Ca 0.06 -3.34 0.13 0.00 -0.02 0.00 0.00 56.01 52.84 1rm6 n LEU 330 Cb 0.08 -0.78 0.40 0.00 -1.62 0.00 0.00 43.42 41.51 1rm6 n LEU 330 CO 0.37 0.88 0.78 0.23 -1.22 0.00 0.00 177.39 178.44 1rm6 n MET 331 N -0.45 0.20 -4.04 3.23 2.81 -0.93 -4.83 117.12 113.12 1rm6 n MET 331 Ca 0.47 0.13 -0.24 0.00 -1.81 0.00 0.00 57.70 56.26 1rm6 n MET 331 Cb 1.48 -1.70 -0.04 0.00 -0.71 0.00 0.00 33.22 32.25 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 -3.08 3.28 0.00 2.03 3.76 -1.21 -4.69 115.29 115.38 1rm6 s HIS 332 Ca 0.11 -0.02 0.00 0.00 -0.15 0.00 0.00 55.06 55.00 1rm6 s HIS 332 Cb 0.14 -1.52 0.00 0.00 1.11 0.00 0.00 32.58 32.31 1rm6 s HIS 332 CO 0.61 0.50 0.00 0.41 -0.85 0.00 0.00 174.74 175.41 1rm6 n GLY 333 N -0.91 0.83 0.83 -2.22 0.00 -1.26 -4.89 105.19 97.56 1rm6 n GLY 333 Ca -0.08 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.91 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 1.09 -4.63 0.99 7.94 -1.26 -5.03 117.00 116.11 1rm6 n LEU 334 Ca 0.00 0.16 -0.24 0.00 -1.11 0.00 0.00 56.01 54.81 1rm6 n LEU 334 Cb 0.00 -0.37 -0.08 0.00 0.53 0.00 0.00 43.42 43.50 1rm6 n LEU 334 CO 0.00 -0.46 -0.35 -0.31 -1.11 0.00 0.00 177.39 175.16 1rm6 s TYR 335 N -2.18 2.69 -0.20 1.96 2.02 -1.26 -4.04 117.35 116.34 1rm6 s TYR 335 Ca -0.07 -0.21 -0.27 0.00 -0.37 0.00 0.00 57.07 56.15 1rm6 s TYR 335 Cb 0.02 -1.24 -0.00 0.00 -0.40 0.00 0.00 41.96 40.33 1rm6 s TYR 335 CO 0.10 0.58 0.93 -1.58 -1.57 0.00 0.00 175.55 174.01 1rm6 s HIS 336 N -2.08 3.38 -0.12 2.71 5.65 -0.58 -4.84 115.29 119.41 1rm6 s HIS 336 Ca 0.29 1.35 0.00 0.00 0.25 0.00 0.00 55.06 56.95 1rm6 s HIS 336 Cb -0.07 -3.14 0.02 0.00 -1.18 0.00 0.00 32.58 28.21 1rm6 s HIS 336 CO 0.18 -0.36 -0.10 0.42 -0.65 0.00 0.00 174.74 174.23 1rm6 s ILE 337 N 2.68 1.21 0.36 0.89 1.01 -1.26 -4.71 121.20 121.38 1rm6 s ILE 337 Ca 0.41 -0.42 0.03 0.00 0.00 0.00 0.00 60.65 60.67 1rm6 s ILE 337 Cb -0.16 -1.18 0.26 0.00 0.01 0.00 0.00 42.46 41.38 1rm6 s ILE 337 CO 0.10 0.40 2.01 -0.65 0.00 0.00 0.00 174.94 176.79 1rm6 h PRO 338 N 8.02 0.75 -2.63 2.79 0.11 -1.78 -3.44 132.00 135.81 1rm6 h PRO 338 Ca -0.32 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.63 1rm6 h PRO 338 Cb 1.14 -0.17 -0.23 0.00 0.11 0.00 0.00 31.00 31.86 1rm6 h PRO 338 CO 0.45 0.51 -0.16 0.00 -0.21 0.00 0.00 178.00 178.59 1rm6 s ALA 339 N -5.62 -1.14 -0.03 -0.75 0.00 -1.26 -4.70 121.76 108.27 1rm6 s ALA 339 Ca -0.09 1.18 0.01 0.00 0.00 0.00 0.00 51.96 53.06 1rm6 s ALA 339 Cb 0.17 -0.61 0.02 0.00 0.00 0.00 0.00 23.12 22.70 1rm6 s ALA 339 CO 0.76 -0.23 -0.02 0.42 0.00 0.00 0.00 175.76 176.68 1rm6 s ILE 340 N -0.04 0.31 -0.12 0.00 1.01 -0.22 -1.65 121.20 120.48 1rm6 s ILE 340 Ca -0.02 -0.04 0.02 0.00 0.00 0.00 0.00 60.65 60.61 1rm6 s ILE 340 Cb -0.03 -0.35 -0.00 0.00 0.01 0.00 0.00 42.46 42.09 1rm6 s ILE 340 CO 0.02 0.15 -0.19 -0.75 0.00 0.00 0.00 174.94 174.16 1rm6 s LYS 341 N 0.68 3.17 -0.09 2.79 2.20 -0.14 0.01 119.74 128.36 1rm6 s LYS 341 Ca -0.07 -0.80 0.01 0.00 -0.36 0.00 0.00 55.97 54.74 1rm6 s LYS 341 Cb -0.11 -2.45 0.02 0.00 -1.51 0.00 0.00 37.83 33.78 1rm6 s LYS 341 CO -0.01 0.16 -0.09 -1.58 -0.36 0.00 0.00 175.35 173.48 1rm6 s HIS 342 N 0.43 1.36 -0.04 4.03 5.65 0.08 -1.21 115.29 125.60 1rm6 s HIS 342 Ca -0.14 -0.58 0.03 0.00 0.25 0.00 0.00 55.06 54.62 1rm6 s HIS 342 Cb -0.17 -1.09 0.00 0.00 -1.18 0.00 0.00 32.58 30.14 1rm6 s HIS 342 CO 0.06 -0.39 -0.13 -0.51 -0.65 0.00 0.00 174.74 173.13 1rm6 s ASP 343 N 1.26 1.66 0.02 9.88 1.01 -0.77 -0.81 116.67 128.92 1rm6 s ASP 343 Ca -0.04 -0.27 -0.17 0.00 0.71 0.00 0.00 52.55 52.78 1rm6 s ASP 343 Cb -0.14 -0.47 0.03 0.00 1.01 0.00 0.00 42.92 43.35 1rm6 s ASP 343 CO -0.03 0.10 0.38 0.00 0.21 0.00 0.00 175.17 175.83 1rm6 s ALA 344 N 0.15 -0.93 -0.04 5.23 0.00 -0.18 -1.61 121.76 124.39 1rm6 s ALA 344 Ca -0.04 0.33 -0.00 0.00 0.00 0.00 0.00 51.96 52.25 1rm6 s ALA 344 Cb -0.10 0.24 0.03 0.00 0.00 0.00 0.00 23.12 23.28 1rm6 s ALA 344 CO 0.01 -0.38 0.01 -1.58 0.00 0.00 0.00 175.76 173.82 1rm6 s TRP 345 N -2.06 0.35 -0.30 0.00 0.51 0.03 -1.00 118.94 116.47 1rm6 s TRP 345 Ca -0.08 0.00 -0.08 0.00 -2.12 0.00 0.00 56.10 53.82 1rm6 s TRP 345 Cb -0.02 -0.48 -0.00 0.00 -0.81 0.00 0.00 33.47 32.15 1rm6 s TRP 345 CO 0.00 -0.17 0.12 0.50 -0.51 0.00 0.00 176.95 176.89 1rm6 s ARG 346 N 1.30 3.24 -0.11 4.98 6.06 -0.18 -1.05 118.95 133.20 1rm6 s ARG 346 Ca -0.06 -0.77 0.02 0.00 -2.50 0.00 0.00 55.73 52.42 1rm6 s ARG 346 Cb -0.13 -3.46 -0.01 0.00 0.06 0.00 0.00 34.95 31.40 1rm6 s ARG 346 CO -0.02 -0.42 -0.16 0.08 -2.50 0.00 0.00 175.30 172.28 1rm6 s VAL 347 N 1.56 2.78 0.40 7.11 1.01 -0.24 -0.70 120.40 132.32 1rm6 s VAL 347 Ca 0.04 -0.78 -0.26 0.00 0.00 0.00 0.00 61.98 60.98 1rm6 s VAL 347 Cb -0.17 -2.12 -0.09 0.00 0.00 0.00 0.00 36.38 34.00 1rm6 s VAL 347 CO 0.04 0.54 1.23 -0.31 0.00 0.00 0.00 175.10 176.61 1rm6 s TYR 348 N 0.14 2.98 0.05 5.22 2.02 0.29 -0.10 117.35 127.94 1rm6 s TYR 348 Ca -0.09 1.49 -0.01 0.00 -0.37 0.00 0.00 57.07 58.10 1rm6 s TYR 348 Cb -0.15 -3.52 -0.04 0.00 -0.40 0.00 0.00 41.96 37.85 1rm6 s TYR 348 CO 0.05 -1.65 -0.03 0.95 -1.57 0.00 0.00 175.55 173.31 1rm6 s THR 349 N -1.32 0.21 -1.48 -0.71 -4.23 -0.71 -4.79 115.64 102.60 1rm6 s THR 349 Ca 0.56 -1.71 -0.08 0.00 -1.18 0.00 0.00 61.69 59.28 1rm6 s THR 349 Cb -0.34 -1.37 0.01 0.00 1.34 0.00 0.00 72.50 72.14 1rm6 s THR 349 CO 0.44 -0.94 2.64 0.59 -0.54 0.00 0.00 174.62 176.81 1rm6 n ASN 350 N 0.28 8.01 -4.14 3.99 4.13 -0.08 -1.56 115.26 125.90 1rm6 n ASN 350 Ca -0.15 -2.84 -0.10 0.00 1.68 0.00 0.00 54.58 53.17 1rm6 n ASN 350 Cb 0.60 -1.48 -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 0.84 0.08 0.22 3.41 -4.23 -1.26 -4.46 115.64 110.24 1rm6 s THR 351 Ca 0.61 -1.88 -0.32 0.00 -1.18 0.00 0.00 61.69 58.92 1rm6 s THR 351 Cb 0.18 -2.13 -0.14 0.00 1.34 0.00 0.00 72.50 71.74 1rm6 s THR 351 CO -0.07 -0.34 1.26 -2.65 -0.54 0.00 0.00 174.62 172.28 1rm6 n PRO 352 N -0.15 1.59 -1.69 3.99 -0.02 -1.26 -0.53 135.00 136.94 1rm6 n PRO 352 Ca -0.04 0.57 -0.44 0.00 -2.02 0.00 0.00 63.50 61.57 1rm6 n PRO 352 Cb 0.64 -2.13 -0.02 0.00 -0.02 0.00 0.00 33.50 31.98 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 1.76 2.14 -2.22 0.52 -0.02 -1.26 -4.36 135.00 131.56 1rm6 n PRO 353 Ca 0.13 0.76 -0.27 0.00 -2.02 0.00 0.00 63.50 62.10 1rm6 n PRO 353 Cb 0.29 -2.40 0.06 0.00 -0.02 0.00 0.00 33.50 31.42 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 -2.84 3.58 3.73 0.00 0.00 -0.03 -4.48 105.19 105.14 1rm6 n GLY 355 Ca 0.07 -0.24 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 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 3.53 -0.01 4.61 0.00 -0.98 -4.48 121.76 123.42 1rm6 s ALA 356 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 51.96 51.68 1rm6 s ALA 356 Cb 0.00 -2.54 0.01 0.00 0.00 0.00 0.00 23.12 20.58 1rm6 s ALA 356 CO 0.00 0.06 0.00 1.41 0.00 0.00 0.00 175.76 177.23 1rm6 s MET 357 N 0.49 0.03 0.00 0.00 0.00 -1.26 -3.55 119.30 115.01 1rm6 s MET 357 Ca 0.22 0.04 0.00 0.00 0.00 0.00 0.00 55.69 55.95 1rm6 s MET 357 Cb -0.14 -0.11 0.00 0.00 0.00 0.00 0.00 34.83 34.58 1rm6 s MET 357 CO 0.08 -0.04 0.00 -2.13 0.00 0.00 0.00 175.02 172.93 1rm6 n ARG 358 N 3.39 0.00 -0.29 4.11 0.63 -0.32 -0.68 116.66 123.51 1rm6 n ARG 358 Ca -0.17 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.76 1rm6 n ARG 358 Cb 0.57 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.48 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 0.84 0.00 5.14 0.00 -1.26 -4.93 105.19 104.98 1rm6 n GLY 359 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.28 0.00 -0.40 1.61 -0.00 0.15 -1.13 115.22 113.17 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 1.13 0.11 1.57 0.00 -1.26 -4.78 105.19 101.95 1rm6 n GLY 361 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.00 2.61 -2.24 -0.28 -2.78 114.28 109.59 1rm6 n THR 362 Ca 0.00 -0.25 -0.13 0.00 -2.27 0.00 0.00 64.05 61.40 1rm6 n THR 362 Cb 0.00 1.06 -0.10 0.00 -2.10 0.00 0.00 70.33 69.19 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 0.53 1.33 -0.35 2.28 2.07 -1.86 -2.44 116.25 117.81 1rm6 h VAL 363 Ca 0.00 -1.11 -0.10 0.00 0.82 0.00 0.00 66.70 66.31 1rm6 h VAL 363 Cb 0.37 2.07 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 1rm6 h VAL 363 CO 0.00 0.28 -0.19 0.44 0.02 0.00 0.00 177.57 178.13 1rm6 h ASP 364 N -0.51 0.76 0.49 0.57 3.45 -1.93 -0.38 116.42 118.86 1rm6 h ASP 364 Ca -0.00 -0.41 -0.12 0.00 0.43 0.00 0.00 57.03 56.92 1rm6 h ASP 364 Cb 0.49 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 39.03 1rm6 h ASP 364 CO 0.00 1.01 -0.55 0.71 -1.57 0.00 0.00 179.24 178.85 1rm6 h THR 365 N 0.52 1.39 -0.39 0.35 1.35 -1.84 -1.52 112.91 112.76 1rm6 h THR 365 Ca 0.07 -1.87 -0.06 0.00 -0.55 0.00 0.00 66.41 64.00 1rm6 h THR 365 Cb 0.73 1.99 -0.01 0.00 -1.73 0.00 0.00 68.15 69.13 1rm6 h THR 365 CO 0.05 0.54 0.00 -0.09 -0.25 0.00 0.00 175.52 175.78 1rm6 h ARG 366 N 0.05 0.69 -0.40 4.72 9.65 -1.19 -1.26 114.38 126.64 1rm6 h ARG 366 Ca -0.00 -0.22 0.01 0.00 -1.10 0.00 0.00 59.98 58.67 1rm6 h ARG 366 Cb 0.98 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 29.48 1rm6 h ARG 366 CO 0.07 0.78 0.26 0.00 2.80 0.00 0.00 179.97 183.88 1rm6 h ALA 367 N 0.88 0.51 -0.51 2.80 0.00 -0.83 -0.76 119.26 121.35 1rm6 h ALA 367 Ca 0.11 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1rm6 h ALA 367 Cb 0.47 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1rm6 h ALA 367 CO 0.02 -0.05 0.28 0.00 0.00 0.00 0.00 179.25 179.50 1rm6 h ALA 368 N 1.16 0.65 -0.17 0.00 0.00 -1.17 -1.27 119.26 118.46 1rm6 h ALA 368 Ca 0.15 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1rm6 h ALA 368 Cb -0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1rm6 h ALA 368 CO -0.04 0.17 0.09 0.35 0.00 0.00 0.00 179.25 179.82 1rm6 h PHE 369 N 0.68 0.23 -0.86 0.00 3.57 -0.87 -1.92 116.94 117.76 1rm6 h PHE 369 Ca 0.18 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.65 1rm6 h PHE 369 Cb 0.05 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.67 1rm6 h PHE 369 CO -0.02 0.22 0.43 0.93 -2.23 0.00 0.00 178.31 177.64 1rm6 h GLU 370 N 0.17 1.23 -0.39 1.11 4.39 -1.00 -0.71 114.58 119.38 1rm6 h GLU 370 Ca 0.06 -0.17 -0.09 0.00 0.34 0.00 0.00 59.36 59.50 1rm6 h GLU 370 Cb 0.06 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.47 1rm6 h GLU 370 CO -0.01 0.93 -0.09 0.00 -1.16 0.00 0.00 179.01 178.67 1rm6 h ALA 371 N 1.23 0.53 -0.24 3.43 0.00 -1.08 -2.10 119.26 121.03 1rm6 h ALA 371 Ca 0.30 -0.31 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 1rm6 h ALA 371 Cb 0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1rm6 h ALA 371 CO -0.04 0.40 -0.49 1.25 0.00 0.00 0.00 179.25 180.37 1rm6 h LEU 372 N 0.55 0.72 -0.80 0.00 5.85 -1.15 -1.68 115.31 118.80 1rm6 h LEU 372 Ca 0.10 -0.36 0.03 0.00 0.84 0.00 0.00 57.88 58.49 1rm6 h LEU 372 Cb 0.61 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 1rm6 h LEU 372 CO 0.04 1.09 0.51 0.25 -0.34 0.00 0.00 178.44 179.99 1rm6 h LEU 373 N 0.52 0.85 -0.46 2.25 5.85 -1.03 0.16 115.31 123.45 1rm6 h LEU 373 Ca 0.03 -0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.65 1rm6 h LEU 373 Cb 1.04 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.87 1rm6 h LEU 373 CO 0.10 0.58 -0.07 0.74 -0.34 0.00 0.00 178.44 179.45 1rm6 h THR 374 N 1.00 1.27 -0.61 1.05 2.02 -1.23 -0.77 112.91 115.64 1rm6 h THR 374 Ca 0.32 -1.17 -0.04 0.00 0.77 0.00 0.00 66.41 66.29 1rm6 h THR 374 Cb 0.02 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 1rm6 h THR 374 CO -0.12 0.40 0.21 -0.08 0.37 0.00 0.00 175.52 176.31 1rm6 h GLU 375 N 0.69 0.93 -0.23 6.66 4.81 -0.57 -1.22 114.58 125.65 1rm6 h GLU 375 Ca 0.12 -0.19 -0.11 0.00 -0.13 0.00 0.00 59.36 59.05 1rm6 h GLU 375 Cb 0.60 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 1rm6 h GLU 375 CO 0.04 0.82 -0.34 0.52 -0.73 0.00 0.00 179.01 179.31 1rm6 h MET 376 N 0.86 0.49 -0.81 1.92 2.86 -0.60 -2.57 114.93 117.07 1rm6 h MET 376 Ca 0.20 -0.22 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 1rm6 h MET 376 Cb 0.26 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.87 1rm6 h MET 376 CO -0.01 0.77 0.42 0.78 1.06 0.00 0.00 176.91 179.93 1rm6 h GLY 377 N 1.07 1.23 1.00 8.32 0.00 -0.63 -1.56 103.07 112.50 1rm6 h GLY 377 Ca 0.05 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.80 1rm6 h GLY 377 CO 0.06 0.56 0.23 -2.09 0.00 0.00 0.00 176.54 175.30 1rm6 h GLU 378 N 1.14 0.48 -0.09 4.80 4.81 -0.92 0.42 114.58 125.22 1rm6 h GLU 378 Ca 0.28 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1rm6 h GLU 378 Cb 0.07 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 1rm6 h GLU 378 CO -0.04 0.33 0.05 1.49 -0.73 0.00 0.00 179.01 180.11 1rm6 h GLU 379 N 0.48 0.11 -0.00 1.92 4.81 -1.01 -0.93 114.58 119.97 1rm6 h GLU 379 Ca 0.13 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1rm6 h GLU 379 Cb -0.04 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.32 1rm6 h GLU 379 CO -0.03 0.08 -0.24 1.28 -0.73 0.00 0.00 179.01 179.38 1rm6 n LEU 380 N -4.52 0.67 -0.49 1.64 4.77 -0.65 -4.94 117.00 113.48 1rm6 n LEU 380 Ca -0.02 -0.07 -0.04 0.00 -0.03 0.00 0.00 56.01 55.85 1rm6 n LEU 380 Cb 0.09 -0.19 -0.00 0.00 -2.33 0.00 0.00 43.42 40.98 1rm6 n LEU 380 CO 0.34 0.13 -0.06 0.61 -1.33 0.00 0.00 177.39 177.09 1rm6 n GLY 381 N 1.36 0.21 3.38 -0.72 0.00 -0.35 -5.04 105.19 104.02 1rm6 n GLY 381 Ca 0.11 -0.71 -0.33 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.22 3.06 0.39 -0.61 1.01 0.00 -5.02 121.20 117.81 1rm6 s ILE 382 Ca 0.00 -0.66 -0.27 0.00 0.00 0.00 0.00 60.65 59.72 1rm6 s ILE 382 Cb 0.00 -2.28 -0.11 0.00 0.01 0.00 0.00 42.46 40.08 1rm6 s ILE 382 CO 0.00 0.53 1.31 -0.67 0.00 0.00 0.00 174.94 176.11 1rm6 n ASP 383 N 3.44 2.80 0.25 3.58 2.03 -1.26 -3.92 116.55 123.46 1rm6 n ASP 383 Ca -0.18 1.16 0.10 0.00 0.52 0.00 0.00 54.79 56.39 1rm6 n ASP 383 Cb 0.53 -1.51 0.67 0.00 -0.72 0.00 0.00 41.12 40.09 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 2.37 0.00 0.20 1.67 4.64 -1.94 -0.30 113.55 120.20 1rm6 h SER 384 Ca -0.48 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.54 1rm6 h SER 384 Cb 1.28 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.41 1rm6 h SER 384 CO 0.61 0.11 -1.31 0.25 -0.87 0.00 0.00 176.83 175.63 1rm6 h LEU 385 N 0.00 0.81 -0.83 5.97 6.46 -1.94 -3.28 115.31 122.49 1rm6 h LEU 385 Ca -0.00 -0.89 -0.03 0.00 -0.12 0.00 0.00 57.88 56.83 1rm6 h LEU 385 Cb 0.24 -0.26 -0.04 0.00 -0.73 0.00 0.00 40.66 39.88 1rm6 h LEU 385 CO 0.01 1.64 0.41 0.50 -0.62 0.00 0.00 178.44 180.38 1rm6 h LYS 386 N 0.11 1.20 0.00 1.25 1.63 -1.79 -2.14 116.57 116.82 1rm6 h LYS 386 Ca -0.22 -0.17 -0.03 0.00 -0.85 0.00 0.00 60.65 59.38 1rm6 h LYS 386 Cb 2.02 -0.22 -0.00 0.00 -0.60 0.00 0.00 32.23 33.42 1rm6 h LYS 386 CO 0.25 0.92 -0.13 0.97 -3.45 0.00 0.00 179.45 178.01 1rm6 h ILE 387 N 1.18 0.66 0.09 2.00 2.10 -1.16 -0.66 117.51 121.72 1rm6 h ILE 387 Ca 0.29 -0.53 -0.25 0.00 1.08 0.00 0.00 64.86 65.44 1rm6 h ILE 387 Cb 0.11 1.33 0.02 0.00 -1.09 0.00 0.00 36.82 37.20 1rm6 h ILE 387 CO -0.04 0.13 -1.02 0.03 -1.08 0.00 0.00 178.15 176.16 1rm6 h ARG 388 N 0.00 0.53 -0.99 2.19 3.08 -1.47 -3.14 114.38 114.58 1rm6 h ARG 388 Ca -0.00 -0.69 0.01 0.00 0.07 0.00 0.00 59.98 59.37 1rm6 h ARG 388 Cb 0.32 0.23 -0.05 0.00 0.08 0.00 0.00 29.97 30.55 1rm6 h ARG 388 CO 0.02 1.30 0.66 1.96 -1.07 0.00 0.00 179.97 182.83 1rm6 h GLN 389 N 0.09 1.30 -0.21 0.04 4.20 -0.77 -1.93 115.11 117.83 1rm6 h GLN 389 Ca -0.15 -0.08 0.03 0.00 0.06 0.00 0.00 58.65 58.50 1rm6 h GLN 389 Cb 1.73 -0.29 -0.01 0.00 0.30 0.00 0.00 27.48 29.21 1rm6 h GLN 389 CO 0.20 0.86 0.14 0.82 -0.67 0.00 0.00 178.83 180.18 1rm6 h ILE 390 N 1.34 0.98 -0.60 2.54 2.04 -1.20 -2.97 117.51 119.64 1rm6 h ILE 390 Ca 0.37 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 66.17 1rm6 h ILE 390 Cb -0.15 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1rm6 h ILE 390 CO -0.08 0.03 0.00 0.59 0.00 0.00 0.00 178.15 178.69 1rm6 n ASN 391 N -4.50 4.21 -4.73 1.72 3.02 -0.74 -4.91 115.26 109.34 1rm6 n ASN 391 Ca 0.01 -2.29 -0.32 0.00 -0.03 0.00 0.00 54.58 51.95 1rm6 n ASN 391 Cb 0.17 -0.50 0.11 0.00 -0.61 0.00 0.00 39.78 38.95 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 -1.54 1.85 0.18 3.52 -1.94 -1.12 -1.52 119.30 118.73 1rm6 s MET 392 Ca 0.46 1.43 -0.33 0.00 -1.71 0.00 0.00 55.69 55.54 1rm6 s MET 392 Cb 0.28 -1.83 -0.13 0.00 2.01 0.00 0.00 34.83 35.15 1rm6 s MET 392 CO 0.25 -1.99 1.60 1.28 -0.01 0.00 0.00 175.02 176.15 1rm6 n LEU 393 N -3.53 3.39 0.19 -0.03 4.77 -1.26 -4.36 117.00 116.18 1rm6 n LEU 393 Ca 0.11 1.08 0.05 0.00 -0.03 0.00 0.00 56.01 57.22 1rm6 n LEU 393 Cb 0.52 -1.47 0.39 0.00 -2.33 0.00 0.00 43.42 40.53 1rm6 n LEU 393 CO 0.50 -0.16 0.73 1.55 -1.33 0.00 0.00 177.39 178.68 1rm6 h PRO 394 N 5.98 0.00 -3.31 3.23 0.13 -1.98 -3.46 132.00 132.59 1rm6 h PRO 394 Ca -0.44 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.61 1rm6 h PRO 394 Cb 1.24 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.22 1rm6 h PRO 394 CO 0.89 0.35 -0.15 1.14 -0.23 0.00 0.00 178.00 180.01 1rm6 s GLN 395 N -3.90 0.94 -0.04 0.86 0.00 -1.26 -5.16 119.66 111.11 1rm6 s GLN 395 Ca -0.01 -0.59 0.02 0.00 -0.00 0.00 0.00 55.36 54.78 1rm6 s GLN 395 Cb 0.13 0.41 0.01 0.00 0.00 0.00 0.00 33.01 33.56 1rm6 s GLN 395 CO 0.69 -0.34 -0.09 0.42 0.00 0.00 0.00 175.29 175.97 1rm6 s ILE 396 N -3.14 0.81 0.69 3.63 -1.09 -1.26 -3.94 121.20 116.90 1rm6 s ILE 396 Ca -0.01 -0.35 -0.16 0.00 -2.23 0.00 0.00 60.65 57.90 1rm6 s ILE 396 Cb 0.01 -0.74 0.01 0.00 -1.58 0.00 0.00 42.46 40.16 1rm6 s ILE 396 CO -0.07 0.26 1.23 -2.16 -1.23 0.00 0.00 174.94 172.97 1rm6 s PRO 397 N 0.38 2.36 -0.04 2.79 0.04 -1.26 -5.09 135.00 134.18 1rm6 s PRO 397 Ca -0.06 1.86 0.01 0.00 0.04 0.00 0.00 61.00 62.85 1rm6 s PRO 397 Cb -0.11 -1.85 0.02 0.00 0.04 0.00 0.00 34.50 32.60 1rm6 s PRO 397 CO 0.01 -1.69 -0.05 -0.47 0.04 0.00 0.00 177.00 174.84 1rm6 s TYR 398 N -1.76 0.75 -0.24 0.56 5.04 -0.55 -4.99 117.35 116.16 1rm6 s TYR 398 Ca 0.77 -0.21 -0.07 0.00 -2.44 0.00 0.00 57.07 55.12 1rm6 s TYR 398 Cb -0.32 -0.65 -0.03 0.00 0.35 0.00 0.00 41.96 41.31 1rm6 s TYR 398 CO 0.42 -0.18 0.07 0.08 -1.34 0.00 0.00 175.55 174.60 1rm6 s VAL 399 N 0.82 4.40 0.81 3.14 1.01 -1.26 -0.47 120.40 128.86 1rm6 s VAL 399 Ca -0.11 -0.15 -0.12 0.00 0.00 0.00 0.00 61.98 61.60 1rm6 s VAL 399 Cb -0.14 -3.04 0.08 0.00 0.00 0.00 0.00 36.38 33.27 1rm6 s VAL 399 CO 0.00 0.36 1.13 0.42 0.00 0.00 0.00 175.10 177.02 1rm6 s THR 400 N 1.38 2.56 -0.00 3.92 -4.23 -0.22 -4.91 115.64 114.14 1rm6 s THR 400 Ca 0.05 0.18 0.31 0.00 -1.18 0.00 0.00 61.69 61.05 1rm6 s THR 400 Cb -0.15 -3.06 0.33 0.00 1.34 0.00 0.00 72.50 70.96 1rm6 s THR 400 CO 0.04 -0.24 1.93 0.24 -0.54 0.00 0.00 174.62 176.04 1rm6 h MET 401 N -1.08 0.00 -0.14 3.99 2.86 -1.95 -0.20 114.93 118.41 1rm6 h MET 401 Ca -0.47 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 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 0.63 0.00 0.00 0.98 1.06 0.00 0.00 176.91 179.58 1rm6 n TYR 402 N -2.68 0.17 -1.09 -0.22 4.19 -1.26 -4.93 117.16 111.34 1rm6 n TYR 402 Ca -0.00 -0.09 -0.03 0.00 3.31 0.00 0.00 57.90 61.09 1rm6 n TYR 402 Cb 0.18 0.00 -0.01 0.00 0.49 0.00 0.00 39.34 40.00 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 0.40 -0.05 -1.90 2.98 0.00 -0.08 -4.61 120.51 117.26 1rm6 n ALA 403 Ca 0.17 0.05 -0.34 0.00 0.00 0.00 0.00 53.44 53.32 1rm6 n ALA 403 Cb 0.36 -0.72 -0.07 0.00 0.00 0.00 0.00 19.45 19.03 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 -2.17 4.25 -0.39 0.00 -0.21 -1.26 -4.29 119.66 115.59 1rm6 s GLN 404 Ca 0.00 1.05 -0.05 0.00 0.02 0.00 0.00 55.36 56.38 1rm6 s GLN 404 Cb 0.00 -2.38 0.09 0.00 1.00 0.00 0.00 33.01 31.71 1rm6 s GLN 404 CO 0.00 0.09 0.19 1.03 -2.12 0.00 0.00 175.29 174.48 1rm6 s ARG 405 N -2.87 2.31 -0.47 2.91 0.52 -1.26 -1.06 118.95 119.03 1rm6 s ARG 405 Ca 0.57 -1.59 -0.22 0.00 -0.52 0.00 0.00 55.73 53.97 1rm6 s ARG 405 Cb -0.11 -3.59 0.03 0.00 0.52 0.00 0.00 34.95 31.80 1rm6 s ARG 405 CO 0.16 -0.95 0.76 0.08 0.02 0.00 0.00 175.30 175.38 1rm6 s VAL 406 N 1.27 4.67 -0.86 3.52 1.01 0.38 -4.72 120.40 125.67 1rm6 s VAL 406 Ca 0.04 0.23 0.20 0.00 0.00 0.00 0.00 61.98 62.44 1rm6 s VAL 406 Cb -0.22 -4.33 -0.22 0.00 0.00 0.00 0.00 36.38 31.60 1rm6 s VAL 406 CO -0.01 -0.77 0.80 0.23 0.00 0.00 0.00 175.10 175.35 1rm6 n MET 407 N 6.69 0.51 -3.76 2.72 0.00 -1.26 -1.48 117.12 120.54 1rm6 n MET 407 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 57.70 57.56 1rm6 n MET 407 Cb 0.48 -1.43 -0.10 0.00 0.00 0.00 0.00 33.22 32.16 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 -2.98 -0.34 -0.28 7.83 1.04 -1.26 -4.68 113.70 113.03 1rm6 s SER 408 Ca 0.06 0.62 0.01 0.00 0.48 0.00 0.00 55.95 57.12 1rm6 s SER 408 Cb 0.15 0.65 0.16 0.00 0.10 0.00 0.00 66.02 67.08 1rm6 s SER 408 CO 0.81 -0.16 0.41 -0.47 0.98 0.00 0.00 173.24 174.81 1rm6 s TYR 409 N 0.00 -0.99 -1.66 5.02 5.04 -1.26 -4.77 117.35 118.73 1rm6 s TYR 409 Ca -0.02 0.39 0.15 0.00 -2.44 0.00 0.00 57.07 55.16 1rm6 s TYR 409 Cb -0.03 -0.13 0.51 0.00 0.35 0.00 0.00 41.96 42.66 1rm6 s TYR 409 CO 0.01 -0.95 1.41 0.41 -1.34 0.00 0.00 175.55 175.08 1rm6 n GLY 410 N 5.35 1.79 0.26 8.97 0.00 -1.26 -4.57 105.19 115.74 1rm6 n GLY 410 Ca 0.00 -0.61 0.03 0.00 0.00 0.00 0.00 46.02 45.44 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 3.15 0.71 -0.62 1.61 2.07 -1.95 -0.90 116.25 120.33 1rm6 h VAL 411 Ca 0.00 -0.15 0.08 0.00 0.82 0.00 0.00 66.70 67.45 1rm6 h VAL 411 Cb 0.92 0.23 -0.06 0.00 -1.52 0.00 0.00 31.29 30.86 1rm6 h VAL 411 CO 0.08 0.08 0.28 -0.65 0.02 0.00 0.00 177.57 177.38 1rm6 h PRO 412 N 0.44 0.50 -0.37 1.57 0.11 -2.00 -0.15 132.00 132.09 1rm6 h PRO 412 Ca 0.37 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 66.30 1rm6 h PRO 412 Cb 0.51 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 1rm6 h PRO 412 CO -0.36 0.33 -0.35 1.49 -0.21 0.00 0.00 178.00 178.90 1rm6 h GLU 413 N 0.51 0.86 -0.53 1.05 4.81 -1.74 -1.44 114.58 118.09 1rm6 h GLU 413 Ca 0.30 -0.43 0.02 0.00 -0.13 0.00 0.00 59.36 59.12 1rm6 h GLU 413 Cb 0.29 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 1rm6 h GLU 413 CO -0.24 1.07 0.33 0.00 -0.73 0.00 0.00 179.01 179.44 1rm6 h LEU 415 N 0.67 0.62 -0.83 0.00 3.38 -0.86 -1.78 115.31 116.51 1rm6 h LEU 415 Ca 0.21 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 1rm6 h LEU 415 Cb -0.01 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 1rm6 h LEU 415 CO -0.08 0.74 0.19 -0.33 0.09 0.00 0.00 178.44 179.05 1rm6 h GLU 416 N 0.48 1.05 -0.36 1.13 4.39 -0.93 -1.41 114.58 118.93 1rm6 h GLU 416 Ca 0.11 -0.23 -0.06 0.00 0.34 0.00 0.00 59.36 59.52 1rm6 h GLU 416 Cb 0.40 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 1rm6 h GLU 416 CO 0.01 0.92 -0.01 0.87 -1.16 0.00 0.00 179.01 179.64 1rm6 h LYS 417 N 1.01 0.64 -0.02 2.33 1.79 -0.75 -1.82 116.57 119.76 1rm6 h LYS 417 Ca 0.22 -0.21 -0.15 0.00 -2.18 0.00 0.00 60.65 58.32 1rm6 h LYS 417 Cb 0.32 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.90 1rm6 h LYS 417 CO -0.00 0.76 -0.70 -0.39 -1.08 0.00 0.00 179.45 178.03 1rm6 h VAL 418 N 0.46 1.47 -0.21 0.50 -1.51 -1.26 -0.77 116.25 114.93 1rm6 h VAL 418 Ca 0.10 -2.31 0.02 0.00 -1.23 0.00 0.00 66.70 63.29 1rm6 h VAL 418 Cb 0.47 2.24 -0.02 0.00 -2.13 0.00 0.00 31.29 31.84 1rm6 h VAL 418 CO 0.02 0.67 0.07 0.50 -1.23 0.00 0.00 177.57 177.60 1rm6 h LYS 419 N 0.07 0.16 -0.07 5.19 3.64 -1.12 -1.77 116.57 122.66 1rm6 h LYS 419 Ca -0.01 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 1rm6 h LYS 419 Cb 1.24 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1rm6 h LYS 419 CO 0.10 0.11 -0.04 0.00 -2.27 0.00 0.00 179.45 177.35 1rm6 h ALA 420 N 1.13 0.09 -0.07 5.00 0.00 -1.19 -2.18 119.26 122.04 1rm6 h ALA 420 Ca 0.09 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1rm6 h ALA 420 Cb 0.06 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1rm6 h ALA 420 CO -0.09 -0.15 -0.10 0.00 0.00 0.00 0.00 179.25 178.91 1rm6 h ALA 421 N 0.61 1.70 -0.01 0.00 0.00 -1.08 -2.33 119.26 118.16 1rm6 h ALA 421 Ca 0.01 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1rm6 h ALA 421 Cb 0.49 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1rm6 h ALA 421 CO 0.01 0.23 -0.38 -1.13 0.00 0.00 0.00 179.25 177.97 1rm6 n SER 422 N -4.36 0.91 -1.66 0.00 3.41 -0.67 -4.94 113.62 106.30 1rm6 n SER 422 Ca -0.02 -0.72 -0.14 0.00 -0.26 0.00 0.00 58.87 57.73 1rm6 n SER 422 Cb 0.21 0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 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 1.40 -0.17 0.17 5.00 0.00 -0.88 -4.89 105.19 105.83 1rm6 n GLY 423 Ca 0.09 -0.29 -0.08 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.20 -0.29 -0.78 1.61 2.91 -1.66 0.76 115.95 118.29 1rm6 h TRP 424 Ca -0.33 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 59.70 1rm6 h TRP 424 Cb 1.24 0.17 -0.04 0.00 -0.51 0.00 0.00 29.16 30.02 1rm6 h TRP 424 CO 0.36 -0.18 0.44 0.93 -1.03 0.00 0.00 178.44 178.95 1rm6 h GLU 425 N -0.10 1.08 -0.54 2.65 5.08 -1.92 -0.22 114.58 120.62 1rm6 h GLU 425 Ca 0.12 -0.12 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 1rm6 h GLU 425 Cb 0.28 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 1rm6 h GLU 425 CO -0.29 0.79 -0.09 0.93 -1.00 0.00 0.00 179.01 179.35 1rm6 h GLU 426 N 1.08 1.00 0.00 2.33 3.07 -1.82 -3.39 114.58 116.85 1rm6 h GLU 426 Ca 0.28 -0.36 -0.12 0.00 -0.50 0.00 0.00 59.36 58.66 1rm6 h GLU 426 Cb 0.02 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 27.83 1rm6 h GLU 426 CO -0.05 1.03 -1.71 0.54 -1.40 0.00 0.00 179.01 177.43 1rm6 n ARG 427 N -4.15 1.36 -1.69 2.33 1.74 0.22 -4.85 116.66 111.61 1rm6 n ARG 427 Ca 0.02 -0.05 -0.43 0.00 -0.77 0.00 0.00 57.85 56.61 1rm6 n ARG 427 Cb 0.39 -1.30 -0.03 0.00 -1.02 0.00 0.00 32.46 30.50 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 -2.22 2.67 -0.92 5.56 3.00 -0.11 -0.55 118.16 125.59 1rm6 n LYS 428 Ca -0.12 0.97 0.00 0.00 -0.00 0.00 0.00 58.31 59.16 1rm6 n LYS 428 Cb 0.65 -2.84 0.00 0.00 0.00 0.00 0.00 35.03 32.84 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 4.09 0.85 0.50 3.14 0.00 -1.26 -4.89 105.19 107.62 1rm6 n GLY 429 Ca 0.18 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.27 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 -2.24 1.26 -3.79 1.61 5.02 0.29 -5.05 118.16 115.25 1rm6 n LYS 430 Ca 0.00 -2.83 -0.23 0.00 -2.02 0.00 0.00 58.31 53.23 1rm6 n LYS 430 Cb 0.00 -1.38 -0.02 0.00 -0.02 0.00 0.00 35.03 33.61 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 -2.66 4.24 0.74 -0.35 1.43 -1.25 -5.02 118.68 115.81 1rm6 s LEU 431 Ca 0.34 0.21 -0.15 0.00 -1.03 0.00 0.00 54.13 53.50 1rm6 s LEU 431 Cb 0.32 -3.01 0.04 0.00 0.03 0.00 0.00 46.19 43.57 1rm6 s LEU 431 CO -0.04 -0.11 1.20 -2.84 0.23 0.00 0.00 176.35 174.79 1rm6 s PRO 432 N -3.90 2.10 0.35 1.29 0.02 -1.26 -4.90 135.00 128.70 1rm6 s PRO 432 Ca 0.36 1.75 -0.29 0.00 0.02 0.00 0.00 61.00 62.84 1rm6 s PRO 432 Cb -0.10 -1.83 -0.11 0.00 0.02 0.00 0.00 34.50 32.48 1rm6 s PRO 432 CO 0.31 -1.86 1.53 0.21 -0.33 0.00 0.00 177.00 176.85 1rm6 s LYS 433 N -3.95 4.11 0.00 5.54 2.20 -1.26 -1.99 119.74 124.40 1rm6 s LYS 433 Ca 0.74 2.58 0.00 0.00 -0.36 0.00 0.00 55.97 58.93 1rm6 s LYS 433 Cb -0.29 -2.99 0.00 0.00 -1.51 0.00 0.00 37.83 33.05 1rm6 s LYS 433 CO 0.46 -0.57 0.00 0.41 -0.36 0.00 0.00 175.35 175.29 1rm6 n GLY 434 N 1.05 0.17 3.22 5.54 0.00 -0.34 -5.04 105.19 109.80 1rm6 n GLY 434 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.84 1rm6 n GLY 434 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1rm6 s ARG 435 N -0.98 1.04 0.24 1.61 3.52 -0.84 -0.95 118.95 122.59 1rm6 s ARG 435 Ca 0.00 -0.99 -0.17 0.00 -0.13 0.00 0.00 55.73 54.44 1rm6 s ARG 435 Cb 0.00 -1.16 0.01 0.00 -1.56 0.00 0.00 34.95 32.24 1rm6 s ARG 435 CO 0.00 0.27 0.56 0.20 -0.81 0.00 0.00 175.30 175.53 1rm6 s GLY 436 N -1.61 0.18 0.06 8.12 0.00 0.16 -3.59 107.32 110.63 1rm6 s GLY 436 Ca 0.03 -0.53 0.06 0.00 0.00 0.00 0.00 44.72 44.28 1rm6 s GLY 436 CO 0.03 -0.37 -0.17 1.08 0.00 0.00 0.00 173.10 173.67 1rm6 s LEU 437 N -2.95 2.21 0.03 0.66 1.43 -1.26 -1.65 118.68 117.15 1rm6 s LEU 437 Ca 0.15 -0.54 -0.09 0.00 -1.03 0.00 0.00 54.13 52.62 1rm6 s LEU 437 Cb -0.02 -0.76 0.00 0.00 0.03 0.00 0.00 46.19 45.44 1rm6 s LEU 437 CO 0.05 0.06 0.19 -0.83 0.23 0.00 0.00 176.35 176.05 1rm6 s GLY 438 N -1.37 0.03 0.07 -3.19 0.00 -0.51 -3.71 107.32 98.64 1rm6 s GLY 438 Ca 0.04 -0.23 0.04 0.00 0.00 0.00 0.00 44.72 44.56 1rm6 s GLY 438 CO 0.02 -0.40 -0.11 -1.50 0.00 0.00 0.00 173.10 171.11 1rm6 s ILE 439 N -2.29 0.91 0.13 0.90 2.07 -1.26 -0.84 121.20 120.82 1rm6 s ILE 439 Ca -0.07 -1.33 -0.24 0.00 -1.41 0.00 0.00 60.65 57.60 1rm6 s ILE 439 Cb -0.02 -1.02 0.07 0.00 0.13 0.00 0.00 42.46 41.62 1rm6 s ILE 439 CO -0.02 -0.36 0.60 0.00 -1.91 0.00 0.00 174.94 173.25 1rm6 s ALA 440 N -1.61 -1.60 0.19 1.50 0.00 -0.67 -4.43 121.76 115.15 1rm6 s ALA 440 Ca -0.02 0.59 0.09 0.00 0.00 0.00 0.00 51.96 52.61 1rm6 s ALA 440 Cb -0.08 0.76 -0.04 0.00 0.00 0.00 0.00 23.12 23.76 1rm6 s ALA 440 CO 0.01 -0.71 -0.07 -0.51 0.00 0.00 0.00 175.76 174.48 1rm6 s LEU 441 N -2.53 3.03 0.19 0.00 1.43 -1.26 -1.40 118.68 118.13 1rm6 s LEU 441 Ca -0.01 -0.57 -0.19 0.00 -1.03 0.00 0.00 54.13 52.33 1rm6 s LEU 441 Cb -0.01 -1.69 0.04 0.00 0.03 0.00 0.00 46.19 44.56 1rm6 s LEU 441 CO -0.10 0.09 0.55 -0.94 0.23 0.00 0.00 176.35 176.18 1rm6 s SER 442 N -2.96 -0.33 0.18 2.29 1.04 -0.62 -4.53 113.70 108.77 1rm6 s SER 442 Ca 0.26 -0.36 -0.18 0.00 0.48 0.00 0.00 55.95 56.15 1rm6 s SER 442 Cb -0.08 0.59 0.03 0.00 0.10 0.00 0.00 66.02 66.66 1rm6 s SER 442 CO 0.16 -1.05 0.51 -1.38 0.98 0.00 0.00 173.24 172.46 1rm6 s HIS 443 N -3.84 -0.17 0.16 5.02 -3.43 -1.13 -1.12 115.29 110.78 1rm6 s HIS 443 Ca 0.07 -0.16 -0.13 0.00 -0.80 0.00 0.00 55.06 54.04 1rm6 s HIS 443 Cb -0.01 0.38 0.01 0.00 -1.43 0.00 0.00 32.58 31.53 1rm6 s HIS 443 CO -0.05 -0.87 0.38 0.12 -2.00 0.00 0.00 174.74 172.32 1rm6 s PHE 444 N -3.85 0.10 0.60 0.38 5.36 -0.82 -4.69 117.98 115.05 1rm6 s PHE 444 Ca 0.07 -0.45 -0.15 0.00 -0.96 0.00 0.00 56.93 55.45 1rm6 s PHE 444 Cb -0.00 0.16 -0.04 0.00 -0.34 0.00 0.00 43.02 42.80 1rm6 s PHE 444 CO -0.05 -0.77 1.04 0.14 -1.46 0.00 0.00 175.22 174.12 1rm6 s VAL 445 N -3.90 4.05 -0.90 3.12 -7.23 -1.26 -1.45 120.40 112.82 1rm6 s VAL 445 Ca 0.11 0.89 -0.01 0.00 -1.81 0.00 0.00 61.98 61.16 1rm6 s VAL 445 Cb 0.02 -3.48 0.34 0.00 0.56 0.00 0.00 36.38 33.81 1rm6 s VAL 445 CO -0.04 -0.65 1.79 -1.20 -0.31 0.00 0.00 175.10 174.69 1rm6 n SER 446 N -2.22 7.07 0.00 4.85 7.64 -0.08 -4.58 113.62 126.29 1rm6 n SER 446 Ca 0.08 -3.74 0.00 0.00 1.01 0.00 0.00 58.87 56.21 1rm6 n SER 446 Cb 0.53 -1.05 0.00 0.00 -1.01 0.00 0.00 64.21 62.68 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 -0.26 2.06 3.69 0.23 0.00 0.27 -4.48 105.19 106.70 1rm6 n GLY 447 Ca 0.48 -1.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.55 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 4.13 -1.54 2.61 2.01 -1.26 -4.25 115.64 116.60 1rm6 s THR 448 Ca 0.00 1.47 0.23 0.00 0.31 0.00 0.00 61.69 63.70 1rm6 s THR 448 Cb 0.00 -3.94 0.46 0.00 0.01 0.00 0.00 72.50 69.02 1rm6 s THR 448 CO 0.00 0.00 1.77 -1.54 -0.69 0.00 0.00 174.62 174.16 1rm6 n SER 449 N 5.17 0.00 -4.12 3.53 3.41 -0.99 -4.59 113.62 116.03 1rm6 n SER 449 Ca 0.11 -0.18 -0.32 0.00 -0.26 0.00 0.00 58.87 58.22 1rm6 n SER 449 Cb 0.46 -0.23 -0.16 0.00 -0.26 0.00 0.00 64.21 64.01 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 -2.46 1.98 0.82 6.66 2.01 -1.26 -4.73 115.64 118.66 1rm6 s THR 450 Ca 0.25 -0.91 -0.11 0.00 0.31 0.00 0.00 61.69 61.23 1rm6 s THR 450 Cb 0.16 -1.78 0.09 0.00 0.01 0.00 0.00 72.50 70.97 1rm6 s THR 450 CO 0.34 0.53 1.13 -2.84 -0.69 0.00 0.00 174.62 173.09 1rm6 s PRO 451 N 1.13 1.77 0.26 4.92 0.02 -1.26 -4.95 135.00 136.89 1rm6 s PRO 451 Ca 0.00 1.42 0.08 0.00 0.02 0.00 0.00 61.00 62.52 1rm6 s PRO 451 Cb -0.14 -1.82 0.31 0.00 0.02 0.00 0.00 34.50 32.87 1rm6 s PRO 451 CO -0.08 -2.05 1.59 0.87 -0.33 0.00 0.00 177.00 177.00 1rm6 h LYS 452 N -1.23 0.11 -5.15 5.54 1.57 -1.97 -3.42 116.57 112.01 1rm6 h LYS 452 Ca -0.44 -0.07 -0.64 0.00 -1.87 0.00 0.00 60.65 57.62 1rm6 h LYS 452 Cb 1.26 0.01 -0.22 0.00 0.08 0.00 0.00 32.23 33.36 1rm6 h LYS 452 CO 0.47 0.68 -0.64 -1.01 -0.57 0.00 0.00 179.45 178.38 1rm6 s HIS 453 N -3.69 3.07 -0.61 -1.35 3.76 -1.26 -4.76 115.29 110.45 1rm6 s HIS 453 Ca -0.03 -0.35 -0.27 0.00 -0.15 0.00 0.00 55.06 54.26 1rm6 s HIS 453 Cb 0.12 -2.08 0.03 0.00 1.11 0.00 0.00 32.58 31.77 1rm6 s HIS 453 CO 0.78 -0.16 1.17 -0.46 -0.85 0.00 0.00 174.74 175.21 1rm6 s TRP 454 N 0.87 2.58 0.00 1.40 -0.00 -1.26 -4.70 118.94 117.83 1rm6 s TRP 454 Ca 0.01 0.25 0.00 0.00 -0.00 0.00 0.00 56.10 56.36 1rm6 s TRP 454 Cb -0.14 -4.47 0.00 0.00 -0.00 0.00 0.00 33.47 28.86 1rm6 s TRP 454 CO 0.02 -1.64 0.16 0.25 -0.00 0.00 0.00 176.95 175.74 1rm6 n THR 455 N 6.53 0.00 -1.09 5.86 -2.24 -1.26 -5.02 114.28 117.07 1rm6 n THR 455 Ca 0.06 -0.35 -0.03 0.00 -2.27 0.00 0.00 64.05 61.46 1rm6 n THR 455 Cb 0.49 1.14 -0.01 0.00 -2.10 0.00 0.00 70.33 69.84 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 0.38 0.52 3.93 3.38 0.00 -1.26 -5.01 105.19 107.13 1rm6 n GLY 456 Ca 0.00 -0.17 -0.26 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.51 2.90 0.84 1.61 2.02 -1.26 -5.04 118.70 118.25 1rm6 s GLU 457 Ca 0.00 -0.12 -0.11 0.00 0.02 0.00 0.00 54.97 54.76 1rm6 s GLU 457 Cb 0.00 -2.32 0.10 0.00 0.10 0.00 0.00 34.13 32.01 1rm6 s GLU 457 CO 0.00 -0.66 1.13 -1.25 0.02 0.00 0.00 175.26 174.51 1rm6 s PRO 458 N -4.93 1.57 0.18 0.39 0.04 -1.26 -4.90 135.00 126.08 1rm6 s PRO 458 Ca 0.53 1.45 0.27 0.00 0.04 0.00 0.00 61.00 63.29 1rm6 s PRO 458 Cb -0.10 -1.80 0.88 0.00 0.04 0.00 0.00 34.50 33.52 1rm6 s PRO 458 CO 0.44 -2.20 1.80 0.72 0.04 0.00 0.00 177.00 177.79 1rm6 n HIS 459 N -3.81 0.78 -3.55 0.56 8.25 0.28 -4.81 115.22 112.93 1rm6 n HIS 459 Ca 0.11 0.23 -0.17 0.00 -0.26 0.00 0.00 57.72 57.63 1rm6 n HIS 459 Cb 0.52 -0.87 -0.06 0.00 1.12 0.00 0.00 29.99 30.70 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 -3.09 -1.76 -0.03 -1.41 0.00 -0.80 -4.66 121.76 110.02 1rm6 s ALA 460 Ca 0.11 1.45 -0.01 0.00 0.00 0.00 0.00 51.96 53.51 1rm6 s ALA 460 Cb 0.13 -0.23 0.03 0.00 0.00 0.00 0.00 23.12 23.05 1rm6 s ALA 460 CO 0.58 -0.36 0.06 0.99 0.00 0.00 0.00 175.76 177.03 1rm6 s THR 461 N -0.88 -0.05 -0.03 0.00 2.01 -1.26 -1.60 115.64 113.83 1rm6 s THR 461 Ca -0.09 0.20 0.03 0.00 0.31 0.00 0.00 61.69 62.14 1rm6 s THR 461 Cb -0.01 -0.12 -0.00 0.00 0.01 0.00 0.00 72.50 72.37 1rm6 s THR 461 CO 0.08 0.08 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.28 1rm6 s VAL 462 N 1.05 1.02 0.03 3.82 1.01 -0.23 -4.63 120.40 122.48 1rm6 s VAL 462 Ca -0.09 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 61.43 1rm6 s VAL 462 Cb -0.12 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 1rm6 s VAL 462 CO -0.04 0.30 -0.06 0.20 0.00 0.00 0.00 175.10 175.50 1rm6 s ASN 463 N 0.05 4.65 0.05 3.32 0.02 -0.82 -0.70 114.94 121.52 1rm6 s ASN 463 Ca -0.02 -0.18 0.08 0.00 -1.02 0.00 0.00 52.86 51.72 1rm6 s ASN 463 Cb -0.09 -1.06 -0.03 0.00 0.02 0.00 0.00 41.25 40.09 1rm6 s ASN 463 CO 0.01 0.25 -0.21 -0.76 0.02 0.00 0.00 177.10 176.41 1rm6 s LEU 464 N -1.67 2.19 -0.05 0.60 1.43 -0.59 -0.47 118.68 120.12 1rm6 s LEU 464 Ca 0.19 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 52.76 1rm6 s LEU 464 Cb -0.11 -0.98 0.01 0.00 0.03 0.00 0.00 46.19 45.14 1rm6 s LEU 464 CO 0.10 0.15 -0.13 -0.75 0.23 0.00 0.00 176.35 175.95 1rm6 s LYS 465 N -1.31 1.56 -0.05 1.70 2.36 -0.09 -1.33 119.74 122.58 1rm6 s LYS 465 Ca 0.08 -0.43 -0.01 0.00 -2.55 0.00 0.00 55.97 53.05 1rm6 s LYS 465 Cb -0.09 -1.33 0.03 0.00 -1.05 0.00 0.00 37.83 35.38 1rm6 s LYS 465 CO 0.02 0.09 0.02 -1.17 1.55 0.00 0.00 175.35 175.87 1rm6 s LEU 466 N 0.42 0.49 0.00 5.43 2.96 -0.22 -0.91 118.68 126.86 1rm6 s LEU 466 Ca -0.10 -0.01 0.00 0.00 -0.22 0.00 0.00 54.13 53.80 1rm6 s LEU 466 Cb -0.13 -0.30 0.00 0.00 0.50 0.00 0.00 46.19 46.26 1rm6 s LEU 466 CO 0.03 -0.20 0.00 -0.67 -1.32 0.00 0.00 176.35 174.18 1rm6 n ASP 467 N 5.07 1.96 -0.16 3.68 4.64 -1.26 -0.97 116.55 129.51 1rm6 n ASP 467 Ca -0.08 -0.99 0.24 0.00 -1.38 0.00 0.00 54.79 52.58 1rm6 n ASP 467 Cb 0.50 0.00 0.65 0.00 -1.04 0.00 0.00 41.12 41.23 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 0.97 0.16 0.00 -0.67 -5.15 -1.94 -1.75 116.94 108.56 1rm6 h PHE 468 Ca 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 1rm6 h PHE 468 Cb 0.00 -0.05 0.00 0.00 0.22 0.00 0.00 35.95 36.12 1rm6 h PHE 468 CO 0.00 0.04 0.00 0.38 -2.00 0.00 0.00 178.31 176.73 1rm6 h ASP 469 N 0.12 0.00 0.00 -0.68 3.04 -1.98 -3.45 116.42 113.47 1rm6 h ASP 469 Ca 0.40 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.19 1rm6 h ASP 469 Cb 1.38 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.67 1rm6 h ASP 469 CO -0.05 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.76 1rm6 n GLY 470 N 0.14 1.19 3.76 7.15 0.00 -0.66 -5.05 105.19 111.72 1rm6 n GLY 470 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.77 2.95 -0.23 -0.02 0.00 -1.26 -4.96 107.32 102.02 1rm6 s GLY 471 Ca 0.00 0.42 -0.10 0.00 0.00 0.00 0.00 44.72 45.04 1rm6 s GLY 471 CO 0.00 1.02 0.14 -0.42 0.00 0.00 0.00 173.10 173.84 1rm6 s ILE 472 N -0.88 5.26 -0.20 0.90 1.01 -0.43 -4.20 121.20 122.65 1rm6 s ILE 472 Ca 0.38 0.14 -0.09 0.00 0.00 0.00 0.00 60.65 61.08 1rm6 s ILE 472 Cb -0.23 -3.44 -0.05 0.00 0.01 0.00 0.00 42.46 38.75 1rm6 s ILE 472 CO 0.27 0.36 0.12 -0.89 0.00 0.00 0.00 174.94 174.80 1rm6 s THR 473 N 0.97 5.26 -0.22 2.92 2.01 -0.09 -0.86 115.64 125.64 1rm6 s THR 473 Ca 0.07 0.14 -0.06 0.00 0.31 0.00 0.00 61.69 62.15 1rm6 s THR 473 Cb -0.13 -3.40 -0.02 0.00 0.01 0.00 0.00 72.50 68.95 1rm6 s THR 473 CO 0.04 0.44 0.02 -0.22 -0.69 0.00 0.00 174.62 174.21 1rm6 s LEU 474 N 0.40 3.30 -0.21 4.42 0.20 0.38 -0.91 118.68 126.25 1rm6 s LEU 474 Ca 0.07 -0.22 -0.05 0.00 0.69 0.00 0.00 54.13 54.62 1rm6 s LEU 474 Cb -0.11 -1.85 -0.02 0.00 -0.43 0.00 0.00 46.19 43.77 1rm6 s LEU 474 CO -0.01 0.02 -0.01 -0.76 -0.29 0.00 0.00 176.35 175.30 1rm6 s LEU 475 N 1.26 3.14 0.00 -0.68 1.02 0.38 -0.86 118.68 122.94 1rm6 s LEU 475 Ca 0.04 -0.27 -0.00 0.00 0.02 0.00 0.00 54.13 53.92 1rm6 s LEU 475 Cb -0.15 -1.80 -0.00 0.00 0.02 0.00 0.00 46.19 44.26 1rm6 s LEU 475 CO 0.02 0.03 0.00 0.28 0.02 0.00 0.00 176.35 176.70 1rm6 s THR 476 N 1.20 0.03 -2.03 5.49 -1.32 -0.81 -1.94 115.64 116.25 1rm6 s THR 476 Ca 0.03 -0.24 0.30 0.00 -1.21 0.00 0.00 61.69 60.57 1rm6 s THR 476 Cb -0.15 -0.09 0.73 0.00 -1.51 0.00 0.00 72.50 71.49 1rm6 s THR 476 CO 0.01 -0.13 2.05 0.61 -2.21 0.00 0.00 174.62 174.94 1rm6 n GLY 477 N 2.67 -0.78 3.77 6.08 0.00 -0.60 -1.33 105.19 115.00 1rm6 n GLY 477 Ca -0.15 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.11 3.44 -0.32 4.61 0.00 -1.26 -4.12 121.76 122.00 1rm6 s ALA 478 Ca 0.42 1.23 -0.19 0.00 0.00 0.00 0.00 51.96 53.42 1rm6 s ALA 478 Cb 0.21 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.86 1rm6 s ALA 478 CO 0.38 -0.65 0.55 0.00 0.00 0.00 0.00 175.76 176.04 1rm6 s ALA 479 N -1.18 3.51 -0.23 0.00 0.00 -1.26 -4.08 121.76 118.51 1rm6 s ALA 479 Ca 0.50 -0.84 -0.21 0.00 0.00 0.00 0.00 51.96 51.41 1rm6 s ALA 479 Cb -0.39 -3.02 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 1rm6 s ALA 479 CO 0.51 -1.10 0.66 0.34 0.00 0.00 0.00 175.76 176.16 1rm6 s ASP 480 N 1.70 6.65 -0.15 0.00 -1.08 -1.26 -4.77 116.67 117.76 1rm6 s ASP 480 Ca 0.21 0.79 0.17 0.00 -0.52 0.00 0.00 52.55 53.21 1rm6 s ASP 480 Cb -0.15 -2.35 0.40 0.00 -1.46 0.00 0.00 42.92 39.35 1rm6 s ASP 480 CO 0.12 -0.36 1.28 2.30 0.52 0.00 0.00 175.17 179.04 1rm6 n ILE 481 N 5.05 2.05 0.00 4.11 -5.35 -1.26 -4.46 119.36 119.50 1rm6 n ILE 481 Ca 0.00 -2.03 0.00 0.00 -0.27 0.00 0.00 62.75 60.45 1rm6 n ILE 481 Cb 0.49 -0.22 0.00 0.00 -1.74 0.00 0.00 39.64 38.17 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 -0.93 1.00 0.17 3.28 0.00 -1.26 -3.17 105.19 104.27 1rm6 n GLY 482 Ca 0.18 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.28 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 1.92 0.00 0.00 1.61 -0.00 -1.94 -3.48 115.11 113.23 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 0.21 0.00 0.41 -0.00 0.00 0.00 178.83 179.45 1rm6 n GLY 484 N 1.18 1.47 0.32 0.06 0.00 -1.26 -5.00 105.19 101.96 1rm6 n GLY 484 Ca 0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.10 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 0.44 -0.08 1.61 4.64 -1.93 0.19 113.55 118.43 1rm6 h SER 485 Ca 0.00 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1rm6 h SER 485 Cb 0.00 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 61.97 1rm6 h SER 485 CO 0.00 0.30 -0.13 0.78 -0.87 0.00 0.00 176.83 176.91 1rm6 h ASN 486 N 0.51 0.39 -0.07 4.97 2.35 -1.93 -0.66 115.58 121.14 1rm6 h ASN 486 Ca 0.19 -0.10 -0.08 0.00 -0.55 0.00 0.00 56.30 55.77 1rm6 h ASN 486 Cb 0.12 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.39 1rm6 h ASN 486 CO -0.05 0.56 -0.26 0.74 -1.65 0.00 0.00 177.43 176.77 1rm6 h THR 487 N 0.38 1.42 -0.30 2.81 2.02 -1.50 -2.75 112.91 114.99 1rm6 h THR 487 Ca 0.07 -1.64 0.06 0.00 0.77 0.00 0.00 66.41 65.67 1rm6 h THR 487 Cb 0.47 2.29 -0.06 0.00 -1.74 0.00 0.00 68.15 69.11 1rm6 h THR 487 CO 0.03 0.47 -0.08 -0.03 0.37 0.00 0.00 175.52 176.27 1rm6 h MET 488 N -0.19 -0.01 -0.84 6.66 1.85 -0.86 0.87 114.93 122.41 1rm6 h MET 488 Ca -0.01 0.00 -0.03 0.00 -0.61 0.00 0.00 59.70 59.05 1rm6 h MET 488 Cb 0.89 0.00 -0.04 0.00 0.43 0.00 0.00 31.60 32.88 1rm6 h MET 488 CO 0.05 -0.01 0.40 0.00 -0.40 0.00 0.00 176.91 176.96 1rm6 h ALA 489 N 1.28 1.13 -0.27 0.39 0.00 -1.19 -1.72 119.26 118.89 1rm6 h ALA 489 Ca 0.15 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1rm6 h ALA 489 Cb 0.23 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1rm6 h ALA 489 CO -0.31 0.66 0.08 0.77 0.00 0.00 0.00 179.25 180.44 1rm6 h SER 490 N 1.19 0.40 -0.39 0.00 0.02 -1.14 -2.59 113.55 111.04 1rm6 h SER 490 Ca 0.29 -0.21 0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1rm6 h SER 490 Cb 0.11 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.53 1rm6 h SER 490 CO -0.04 0.51 0.24 1.56 -1.14 0.00 0.00 176.83 177.96 1rm6 h GLN 491 N 0.27 0.48 -0.15 3.45 4.20 -0.40 -0.27 115.11 122.69 1rm6 h GLN 491 Ca 0.09 -0.03 -0.15 0.00 0.06 0.00 0.00 58.65 58.62 1rm6 h GLN 491 Cb 0.25 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 1rm6 h GLN 491 CO -0.00 0.32 -0.55 -0.39 -0.67 0.00 0.00 178.83 177.54 1rm6 h VAL 492 N 0.50 1.33 -0.36 -0.54 -1.51 -1.33 -1.30 116.25 113.04 1rm6 h VAL 492 Ca 0.15 -1.81 -0.12 0.00 -1.23 0.00 0.00 66.70 63.69 1rm6 h VAL 492 Cb -0.03 1.81 -0.01 0.00 -2.13 0.00 0.00 31.29 30.93 1rm6 h VAL 492 CO -0.05 0.55 -0.23 0.00 -1.23 0.00 0.00 177.57 176.62 1rm6 h ALA 493 N 1.06 0.52 -0.45 5.19 0.00 -1.33 -2.53 119.26 121.72 1rm6 h ALA 493 Ca 0.01 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 1rm6 h ALA 493 Cb 1.07 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1rm6 h ALA 493 CO 0.10 0.50 0.00 0.00 0.00 0.00 0.00 179.25 179.85 1rm6 h ALA 494 N 0.78 1.16 -0.26 0.00 0.00 -0.92 -1.71 119.26 118.30 1rm6 h ALA 494 Ca 0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1rm6 h ALA 494 Cb 0.79 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1rm6 h ALA 494 CO 0.06 0.54 0.12 1.49 0.00 0.00 0.00 179.25 181.47 1rm6 h GLU 495 N 0.69 0.38 -0.55 0.00 4.57 -1.11 0.44 114.58 119.01 1rm6 h GLU 495 Ca 0.14 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.26 1rm6 h GLU 495 Cb 0.42 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.92 1rm6 h GLU 495 CO 0.02 0.38 0.32 0.28 -1.18 0.00 0.00 179.01 178.83 1rm6 h VAL 496 N 0.29 1.17 0.00 0.32 2.07 -1.16 -2.92 116.25 116.02 1rm6 h VAL 496 Ca 0.09 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1rm6 h VAL 496 Cb 0.13 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1rm6 h VAL 496 CO -0.01 0.17 0.00 0.18 0.02 0.00 0.00 177.57 177.93 1rm6 n LEU 497 N -4.65 0.76 -0.74 2.57 4.77 -0.67 -4.91 117.00 114.12 1rm6 n LEU 497 Ca 0.03 0.60 -0.07 0.00 -0.03 0.00 0.00 56.01 56.54 1rm6 n LEU 497 Cb 0.06 -0.39 -0.01 0.00 -2.33 0.00 0.00 43.42 40.75 1rm6 n LEU 497 CO 0.36 -0.28 -0.09 0.61 -1.33 0.00 0.00 177.39 176.66 1rm6 n GLY 498 N 0.95 0.30 3.75 -0.72 0.00 0.07 -4.85 105.19 104.68 1rm6 n GLY 498 Ca 0.05 -0.62 -0.24 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.33 2.51 0.43 1.61 -7.23 -0.73 -0.94 120.40 113.72 1rm6 s VAL 499 Ca 0.00 -1.67 -0.22 0.00 -1.81 0.00 0.00 61.98 58.28 1rm6 s VAL 499 Cb 0.00 -2.98 -0.10 0.00 0.56 0.00 0.00 36.38 33.86 1rm6 s VAL 499 CO 0.00 -0.05 1.00 -0.13 -0.31 0.00 0.00 175.10 175.61 1rm6 s ARG 500 N -3.91 4.10 0.44 4.82 0.52 -1.26 -4.59 118.95 119.07 1rm6 s ARG 500 Ca 0.41 1.31 0.15 0.00 -0.52 0.00 0.00 55.73 57.07 1rm6 s ARG 500 Cb 0.02 -2.28 1.05 0.00 0.52 0.00 0.00 34.95 34.26 1rm6 s ARG 500 CO 0.23 -0.17 1.97 1.25 0.02 0.00 0.00 175.30 178.61 1rm6 h LEU 501 N 2.03 0.35 -1.22 2.53 5.85 -1.93 -0.62 115.31 122.30 1rm6 h LEU 501 Ca -0.49 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1rm6 h LEU 501 Cb 1.20 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.17 1rm6 h LEU 501 CO 0.61 0.20 0.00 0.77 -0.34 0.00 0.00 178.44 179.68 1rm6 h SER 502 N 0.39 0.00 0.89 1.25 4.64 -1.98 -1.73 113.55 117.00 1rm6 h SER 502 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 1rm6 h SER 502 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1rm6 h SER 502 CO -0.08 0.00 -0.04 -1.14 -0.87 0.00 0.00 176.83 174.70 1rm6 n ARG 503 N -2.31 0.07 -3.98 4.77 0.63 -0.24 -4.77 116.66 110.84 1rm6 n ARG 503 Ca -0.00 -0.01 -0.35 0.00 -0.92 0.00 0.00 57.85 56.57 1rm6 n ARG 503 Cb 0.12 -1.50 -0.11 0.00 0.45 0.00 0.00 32.46 31.41 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 -2.93 4.41 -0.23 5.15 1.01 -0.65 -1.32 121.20 126.64 1rm6 s ILE 504 Ca 0.16 -0.16 -0.06 0.00 0.00 0.00 0.00 60.65 60.59 1rm6 s ILE 504 Cb 0.19 -3.01 -0.03 0.00 0.01 0.00 0.00 42.46 39.62 1rm6 s ILE 504 CO 0.53 0.41 0.04 -0.60 0.00 0.00 0.00 174.94 175.33 1rm6 s ARG 505 N 0.91 3.63 -0.20 2.79 3.52 -0.04 -4.98 118.95 124.58 1rm6 s ARG 505 Ca 0.03 -0.50 -0.13 0.00 -0.13 0.00 0.00 55.73 55.01 1rm6 s ARG 505 Cb -0.14 -3.23 -0.05 0.00 -1.56 0.00 0.00 34.95 29.97 1rm6 s ARG 505 CO 0.02 -0.13 0.25 0.08 -0.81 0.00 0.00 175.30 174.71 1rm6 s VAL 506 N 1.42 5.32 -0.17 7.11 1.01 -1.26 -0.47 120.40 133.35 1rm6 s VAL 506 Ca 0.05 0.42 -0.03 0.00 0.00 0.00 0.00 61.98 62.41 1rm6 s VAL 506 Cb -0.15 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 1rm6 s VAL 506 CO 0.02 0.36 -0.05 -0.63 0.00 0.00 0.00 175.10 174.80 1rm6 s ILE 507 N 0.77 3.63 0.04 2.22 -1.09 -0.04 -4.95 121.20 121.77 1rm6 s ILE 507 Ca 0.13 -0.44 0.01 0.00 -2.23 0.00 0.00 60.65 58.12 1rm6 s ILE 507 Cb -0.13 -2.60 -0.02 0.00 -1.58 0.00 0.00 42.46 38.12 1rm6 s ILE 507 CO 0.04 0.47 -0.05 -0.94 -1.23 0.00 0.00 174.94 173.22 1rm6 s SER 508 N 0.73 0.56 -1.26 3.58 1.04 -1.26 -1.93 113.70 115.17 1rm6 s SER 508 Ca -0.02 -0.58 -0.10 0.00 0.48 0.00 0.00 55.95 55.73 1rm6 s SER 508 Cb -0.15 0.08 -0.01 0.00 0.10 0.00 0.00 66.02 66.05 1rm6 s SER 508 CO 0.02 -0.29 0.65 0.00 0.98 0.00 0.00 173.24 174.61 1rm6 n ALA 509 N 1.36 -2.27 -3.70 5.32 0.00 -0.44 -4.80 120.51 115.98 1rm6 n ALA 509 Ca -0.22 -0.23 -0.28 0.00 0.00 0.00 0.00 53.44 52.71 1rm6 n ALA 509 Cb 0.56 -2.88 -0.16 0.00 0.00 0.00 0.00 19.45 16.97 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 -3.94 2.95 0.62 0.00 -1.08 -1.26 -1.86 116.67 112.09 1rm6 s ASP 510 Ca 0.23 -0.89 0.31 0.00 -0.52 0.00 0.00 52.55 51.68 1rm6 s ASP 510 Cb -0.08 -0.54 1.71 0.00 -1.46 0.00 0.00 42.92 42.56 1rm6 s ASP 510 CO 0.86 -0.33 2.05 0.77 0.52 0.00 0.00 175.17 179.03 1rm6 h SER 511 N 8.27 0.00 1.46 -0.34 4.64 -1.53 0.67 113.55 126.72 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 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1rm6 h SER 511 CO 0.35 0.00 -0.05 0.00 -0.87 0.00 0.00 176.83 176.26 1rm6 h ALA 512 N 1.62 0.97 0.00 5.18 0.00 -1.94 -3.39 119.26 121.70 1rm6 h ALA 512 Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1rm6 h ALA 512 Cb 0.60 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1rm6 h ALA 512 CO -0.00 0.00 -1.15 1.28 0.00 0.00 0.00 179.25 179.37 1rm6 n LEU 513 N -2.30 2.16 -4.78 0.00 4.77 0.03 -5.08 117.00 111.80 1rm6 n LEU 513 Ca 0.05 -0.01 -0.31 0.00 -0.03 0.00 0.00 56.01 55.71 1rm6 n LEU 513 Cb 0.44 -0.05 -0.07 0.00 -2.33 0.00 0.00 43.42 41.41 1rm6 n LEU 513 CO 0.31 0.41 -0.26 0.42 -1.33 0.00 0.00 177.39 176.94 1rm6 s THR 514 N -2.05 4.56 0.47 -5.08 -4.23 -0.05 -4.97 115.64 104.28 1rm6 s THR 514 Ca -0.03 -0.72 -0.24 0.00 -1.18 0.00 0.00 61.69 59.52 1rm6 s THR 514 Cb 0.01 -3.18 -0.07 0.00 1.34 0.00 0.00 72.50 70.60 1rm6 s THR 514 CO 0.07 0.15 1.31 -2.16 -0.54 0.00 0.00 174.62 173.46 1rm6 s PRO 515 N -2.31 3.59 0.37 3.99 0.04 -1.26 -4.67 135.00 134.76 1rm6 s PRO 515 Ca 0.29 2.14 -0.27 0.00 0.04 0.00 0.00 61.00 63.20 1rm6 s PRO 515 Cb -0.12 -2.49 -0.11 0.00 0.04 0.00 0.00 34.50 31.81 1rm6 s PRO 515 CO 0.21 -0.80 1.31 1.17 0.04 0.00 0.00 177.00 178.93 1rm6 n LYS 516 N -0.45 2.13 -4.39 4.56 0.00 -1.26 -1.56 118.16 117.19 1rm6 n LYS 516 Ca 0.07 0.75 -0.21 0.00 0.00 0.00 0.00 58.31 58.92 1rm6 n LYS 516 Cb 0.45 -2.39 -0.13 0.00 0.00 0.00 0.00 35.03 32.96 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 -0.36 1.79 0.26 3.14 -1.08 -1.26 -4.47 116.67 114.69 1rm6 s ASP 517 Ca 0.57 -0.47 0.23 0.00 -0.52 0.00 0.00 52.55 52.36 1rm6 s ASP 517 Cb -0.54 -0.12 0.99 0.00 -1.46 0.00 0.00 42.92 41.80 1rm6 s ASP 517 CO 0.61 0.05 1.70 0.59 0.52 0.00 0.00 175.17 178.64 1rm6 n ASN 518 N 1.86 0.65 0.00 -0.34 3.02 -1.26 -4.44 115.26 114.75 1rm6 n ASN 518 Ca -0.18 0.67 0.00 0.00 -0.03 0.00 0.00 54.58 55.04 1rm6 n ASN 518 Cb 0.54 -0.81 0.00 0.00 -0.61 0.00 0.00 39.78 38.91 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 -0.13 3.45 3.41 7.41 0.00 -1.26 -4.79 105.19 113.28 1rm6 n GLY 519 Ca 0.02 -1.88 -0.45 0.00 0.00 0.00 0.00 46.02 43.71 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 7.07 0.03 1.61 0.01 -0.59 -4.77 113.70 117.06 1rm6 s SER 520 Ca 0.00 -3.05 -0.10 0.00 1.31 0.00 0.00 55.95 54.12 1rm6 s SER 520 Cb 0.00 -2.32 0.01 0.00 0.21 0.00 0.00 66.02 63.91 1rm6 s SER 520 CO 0.00 -0.62 0.20 -0.72 0.41 0.00 0.00 173.24 172.50 1rm6 s TYR 521 N 0.69 0.03 -1.66 2.43 -0.85 -1.26 -4.89 117.35 111.85 1rm6 s TYR 521 Ca 0.36 -0.21 0.00 0.00 -0.52 0.00 0.00 57.07 56.70 1rm6 s TYR 521 Cb -0.06 -0.02 0.00 0.00 0.38 0.00 0.00 41.96 42.26 1rm6 s TYR 521 CO -0.04 -0.41 0.00 -1.13 -1.52 0.00 0.00 175.55 172.45 1rm6 n SER 522 N 0.85 -4.66 -3.72 -0.18 3.41 -1.26 -2.71 113.62 105.35 1rm6 n SER 522 Ca -0.20 0.29 -0.25 0.00 -0.26 0.00 0.00 58.87 58.45 1rm6 n SER 522 Cb 0.58 -4.09 0.05 0.00 -0.26 0.00 0.00 64.21 60.49 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 -1.32 -4.09 0.01 4.04 7.64 -1.26 -0.56 113.62 118.08 1rm6 n SER 523 Ca -0.18 -0.70 0.11 0.00 1.01 0.00 0.00 58.87 59.11 1rm6 n SER 523 Cb 0.59 -4.41 0.05 0.00 -1.01 0.00 0.00 64.21 59.44 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 -4.62 0.14 -0.05 1.43 1.85 -1.10 -2.33 116.66 111.99 1rm6 n ARG 524 Ca -0.09 -0.00 -0.13 0.00 -1.00 0.00 0.00 57.85 56.63 1rm6 n ARG 524 Cb 0.59 -1.54 -0.08 0.00 -1.05 0.00 0.00 32.46 30.38 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 1.35 -0.25 8.89 2.07 -1.86 -1.57 116.25 124.88 1rm6 h VAL 525 Ca 0.00 -1.24 -0.00 0.00 0.82 0.00 0.00 66.70 66.28 1rm6 h VAL 525 Cb 0.61 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 32.28 1rm6 h VAL 525 CO 0.00 0.36 0.14 0.74 0.02 0.00 0.00 177.57 178.83 1rm6 h THR 526 N -0.11 1.11 -0.02 2.57 2.02 -1.95 0.16 112.91 116.69 1rm6 h THR 526 Ca 0.02 -0.29 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 1rm6 h THR 526 Cb 0.61 0.85 -0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1rm6 h THR 526 CO 0.03 0.11 0.01 0.15 0.37 0.00 0.00 175.52 176.18 1rm6 h PHE 527 N 0.30 0.02 0.00 3.16 3.57 -1.83 0.25 116.94 122.42 1rm6 h PHE 527 Ca 0.09 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 1rm6 h PHE 527 Cb 0.05 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1rm6 h PHE 527 CO -0.04 0.11 -0.21 0.52 -2.23 0.00 0.00 178.31 176.47 1rm6 h MET 528 N -0.07 0.00 -0.10 1.11 2.86 -1.22 -2.53 114.93 114.98 1rm6 h MET 528 Ca 0.01 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.52 1rm6 h MET 528 Cb 0.10 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 1rm6 h MET 528 CO -0.00 0.86 -0.51 0.28 1.06 0.00 0.00 176.91 178.60 1rm6 h VAL 529 N -1.00 1.35 -0.42 -2.22 2.07 -0.83 -1.10 116.25 114.09 1rm6 h VAL 529 Ca -0.05 -1.77 -0.01 0.00 0.82 0.00 0.00 66.70 65.69 1rm6 h VAL 529 Cb 0.92 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 32.52 1rm6 h VAL 529 CO -0.03 0.53 0.24 1.23 0.02 0.00 0.00 177.57 179.55 1rm6 h GLY 530 N 1.34 0.62 1.18 2.17 0.00 -0.70 0.73 103.07 108.40 1rm6 h GLY 530 Ca 0.01 -0.27 -0.11 0.00 0.00 0.00 0.00 47.33 46.96 1rm6 h GLY 530 CO 0.08 0.26 -0.12 3.43 0.00 0.00 0.00 176.54 180.19 1rm6 h ASN 531 N 0.55 0.96 -0.31 0.19 2.35 -1.22 -1.76 115.58 116.33 1rm6 h ASN 531 Ca 0.15 -0.31 -0.06 0.00 -0.55 0.00 0.00 56.30 55.53 1rm6 h ASN 531 Cb 0.03 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.12 1rm6 h ASN 531 CO -0.03 1.08 0.01 0.00 -1.65 0.00 0.00 177.43 176.84 1rm6 h ALA 532 N 1.00 1.25 -0.46 -0.83 0.00 -0.93 -1.24 119.26 118.06 1rm6 h ALA 532 Ca 0.13 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1rm6 h ALA 532 Cb 0.67 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1rm6 h ALA 532 CO 0.05 0.50 -0.17 0.77 0.00 0.00 0.00 179.25 180.40 1rm6 h SER 533 N 0.62 0.91 -0.47 0.00 0.02 -0.54 -1.00 113.55 113.08 1rm6 h SER 533 Ca 0.13 -0.32 -0.03 0.00 -0.84 0.00 0.00 61.79 60.73 1rm6 h SER 533 Cb 0.38 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 1rm6 h SER 533 CO 0.01 1.06 0.17 0.40 -1.14 0.00 0.00 176.83 177.34 1rm6 h ILE 534 N 0.79 1.21 -0.65 3.27 2.04 -1.01 -0.28 117.51 122.87 1rm6 h ILE 534 Ca 0.12 -0.68 0.05 0.00 1.00 0.00 0.00 64.86 65.34 1rm6 h ILE 534 Cb 0.71 0.78 -0.05 0.00 -0.74 0.00 0.00 36.82 37.52 1rm6 h ILE 534 CO 0.05 0.25 0.37 0.28 0.00 0.00 0.00 178.15 179.11 1rm6 h SER 535 N 0.62 0.57 -0.31 1.72 0.02 -0.91 0.43 113.55 115.69 1rm6 h SER 535 Ca 0.15 0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 61.04 1rm6 h SER 535 Cb 0.22 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 1rm6 h SER 535 CO -0.01 0.37 -0.15 0.00 -1.14 0.00 0.00 176.83 175.90 1rm6 h ALA 536 N 1.33 0.44 -0.42 3.77 0.00 -0.97 -2.58 119.26 120.81 1rm6 h ALA 536 Ca 0.29 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1rm6 h ALA 536 Cb 0.14 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1rm6 h ALA 536 CO -0.16 0.34 0.06 0.00 0.00 0.00 0.00 179.25 179.48 1rm6 h ALA 537 N 0.76 1.31 -0.25 0.00 0.00 -0.55 -1.28 119.26 119.25 1rm6 h ALA 537 Ca 0.07 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 1rm6 h ALA 537 Cb 0.68 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1rm6 h ALA 537 CO 0.05 0.48 -0.26 0.93 0.00 0.00 0.00 179.25 180.44 1rm6 h GLU 538 N 0.63 0.48 -0.38 0.00 4.39 -0.82 0.12 114.58 119.00 1rm6 h GLU 538 Ca 0.14 -0.19 -0.06 0.00 0.34 0.00 0.00 59.36 59.59 1rm6 h GLU 538 Cb 0.31 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 1rm6 h GLU 538 CO 0.01 0.71 0.00 0.93 -1.16 0.00 0.00 179.01 179.50 1rm6 h GLU 539 N 0.43 0.66 -0.41 2.33 4.39 -0.97 -1.34 114.58 119.68 1rm6 h GLU 539 Ca 0.06 -0.21 -0.10 0.00 0.34 0.00 0.00 59.36 59.45 1rm6 h GLU 539 Cb 0.68 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.26 1rm6 h GLU 539 CO 0.05 0.76 -0.13 1.25 -1.16 0.00 0.00 179.01 179.79 1rm6 h LEU 540 N 0.48 0.81 -0.89 1.33 5.85 -1.02 -2.72 115.31 119.16 1rm6 h LEU 540 Ca 0.11 -0.38 0.03 0.00 0.84 0.00 0.00 57.88 58.48 1rm6 h LEU 540 Cb 0.46 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 1rm6 h LEU 540 CO 0.02 1.00 0.58 0.50 -0.34 0.00 0.00 178.44 180.20 1rm6 h LYS 541 N 0.62 1.10 -0.70 1.25 3.64 -0.66 -1.63 116.57 120.18 1rm6 h LYS 541 Ca 0.10 -0.07 0.06 0.00 -1.27 0.00 0.00 60.65 59.48 1rm6 h LYS 541 Cb 0.66 -0.25 -0.06 0.00 -0.41 0.00 0.00 32.23 32.18 1rm6 h LYS 541 CO 0.05 0.73 0.40 0.78 -2.27 0.00 0.00 179.45 179.13 1rm6 h GLY 542 N 1.13 1.04 1.02 5.01 0.00 -1.00 0.70 103.07 110.97 1rm6 h GLY 542 Ca 0.35 -0.28 -0.06 0.00 0.00 0.00 0.00 47.33 47.34 1rm6 h GLY 542 CO -0.11 0.17 0.10 -2.08 0.00 0.00 0.00 176.54 174.62 1rm6 h VAL 543 N 0.73 1.25 -0.22 4.60 2.07 -1.08 -2.04 116.25 121.55 1rm6 h VAL 543 Ca 0.32 -0.95 -0.18 0.00 0.82 0.00 0.00 66.70 66.70 1rm6 h VAL 543 Cb 0.20 0.77 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1rm6 h VAL 543 CO -0.19 0.35 -0.58 -0.07 0.02 0.00 0.00 177.57 177.10 1rm6 h LEU 544 N 0.83 0.80 -0.70 2.57 3.38 -0.80 -2.52 115.31 118.87 1rm6 h LEU 544 Ca 0.17 -0.44 -0.09 0.00 0.09 0.00 0.00 57.88 57.62 1rm6 h LEU 544 Cb 0.40 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1rm6 h LEU 544 CO 0.01 1.20 0.05 0.58 0.09 0.00 0.00 178.44 180.37 1rm6 h VAL 545 N 0.54 1.26 -0.23 1.22 2.07 -0.82 -0.05 116.25 120.24 1rm6 h VAL 545 Ca 0.00 -1.08 0.02 0.00 0.82 0.00 0.00 66.70 66.46 1rm6 h VAL 545 Cb 1.16 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 1rm6 h VAL 545 CO 0.12 0.40 0.10 0.50 0.02 0.00 0.00 177.57 178.70 1rm6 h LYS 546 N 0.97 0.21 -0.55 1.57 3.64 -1.29 0.11 116.57 121.22 1rm6 h LYS 546 Ca 0.18 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.46 1rm6 h LYS 546 Cb 0.49 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 1rm6 h LYS 546 CO 0.02 0.14 -0.01 0.00 -2.27 0.00 0.00 179.45 177.32 1rm6 h ALA 547 N 1.13 0.93 -0.28 5.00 0.00 -1.11 -2.35 119.26 122.60 1rm6 h ALA 547 Ca 0.10 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 1rm6 h ALA 547 Cb 0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1rm6 h ALA 547 CO -0.09 0.64 -0.03 0.00 0.00 0.00 0.00 179.25 179.77 1rm6 h ALA 548 N 1.09 0.38 -0.72 0.00 0.00 -0.65 -2.06 119.26 117.30 1rm6 h ALA 548 Ca 0.16 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.86 1rm6 h ALA 548 Cb 0.54 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 1rm6 h ALA 548 CO 0.03 0.15 0.44 0.00 0.00 0.00 0.00 179.25 179.87 1rm6 h ALA 549 N 0.80 0.96 -0.32 0.00 0.00 -0.71 0.19 119.26 120.17 1rm6 h ALA 549 Ca 0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1rm6 h ALA 549 Cb 0.48 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1rm6 h ALA 549 CO 0.02 0.19 0.11 -0.22 0.00 0.00 0.00 179.25 179.35 1rm6 h LYS 550 N 0.84 0.49 0.00 0.00 3.64 -1.32 0.30 116.57 120.52 1rm6 h LYS 550 Ca 0.30 -0.10 -0.04 0.00 -1.27 0.00 0.00 60.65 59.54 1rm6 h LYS 550 Cb 0.08 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 1rm6 h LYS 550 CO -0.13 0.52 -0.21 -0.22 -2.27 0.00 0.00 179.45 177.14 1rm6 h LYS 551 N 0.37 0.00 -0.02 1.90 3.64 -0.70 -2.46 116.57 119.29 1rm6 h LYS 551 Ca 0.10 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1rm6 h LYS 551 Cb 0.23 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1rm6 h LYS 551 CO -0.01 0.21 -0.16 1.28 -2.27 0.00 0.00 179.45 178.51 1rm6 n LEU 552 N -3.57 2.45 -2.65 5.20 4.77 0.61 -4.96 117.00 118.86 1rm6 n LEU 552 Ca -0.01 -0.84 -0.20 0.00 -0.03 0.00 0.00 56.01 54.93 1rm6 n LEU 552 Cb 0.35 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1rm6 n LEU 552 CO 0.33 0.42 -0.16 -0.67 -1.33 0.00 0.00 177.39 175.98 1rm6 n ASP 553 N 0.71 -5.56 -4.73 -1.43 -0.08 0.87 -4.98 116.55 101.35 1rm6 n ASP 553 Ca 0.13 -0.09 -0.25 0.00 -1.51 0.00 0.00 54.79 53.07 1rm6 n ASP 553 Cb 0.52 -4.59 -0.07 0.00 2.34 0.00 0.00 41.12 39.32 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 -3.01 3.59 0.24 -1.67 0.00 -0.17 -5.02 121.76 115.71 1rm6 s ALA 554 Ca 0.11 -2.06 -0.16 0.00 0.00 0.00 0.00 51.96 49.85 1rm6 s ALA 554 Cb -0.05 -0.34 -0.08 0.00 0.00 0.00 0.00 23.12 22.65 1rm6 s ALA 554 CO 0.14 -0.17 0.67 -0.98 0.00 0.00 0.00 175.76 175.43 1rm6 s ARG 555 N -3.90 4.06 0.37 0.00 1.70 -1.26 -4.42 118.95 115.49 1rm6 s ARG 555 Ca 0.40 0.65 0.08 0.00 -0.47 0.00 0.00 55.73 56.39 1rm6 s ARG 555 Cb 0.04 -2.70 0.81 0.00 -0.57 0.00 0.00 34.95 32.53 1rm6 s ARG 555 CO 0.22 0.32 1.93 0.93 -1.08 0.00 0.00 175.30 177.61 1rm6 h GLU 556 N 2.92 0.66 0.00 3.89 5.08 -1.92 -1.05 114.58 124.16 1rm6 h GLU 556 Ca -0.48 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 57.83 1rm6 h GLU 556 Cb 1.18 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 30.28 1rm6 h GLU 556 CO 0.66 0.44 -0.05 0.93 -1.00 0.00 0.00 179.01 179.99 1rm6 h GLU 557 N 0.68 0.00 -0.18 2.33 3.07 -1.97 -2.23 114.58 116.27 1rm6 h GLU 557 Ca 0.35 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.21 1rm6 h GLU 557 Cb 0.47 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.38 1rm6 h GLU 557 CO -0.13 0.05 0.00 -0.25 -1.40 0.00 0.00 179.01 177.28 1rm6 n ASP 558 N -3.95 2.04 -4.75 1.42 9.92 -0.40 -4.91 116.55 115.92 1rm6 n ASP 558 Ca -0.03 -1.75 -0.39 0.00 -0.53 0.00 0.00 54.79 52.10 1rm6 n ASP 558 Cb 0.14 -0.11 -0.06 0.00 -0.64 0.00 0.00 41.12 40.45 1rm6 n ASP 558 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1rm6 s ILE 559 N -1.77 5.02 -0.02 0.53 -1.09 -0.84 0.11 121.20 123.13 1rm6 s ILE 559 Ca 0.34 1.14 0.06 0.00 -2.23 0.00 0.00 60.65 59.96 1rm6 s ILE 559 Cb 0.19 -3.89 -0.01 0.00 -1.58 0.00 0.00 42.46 37.17 1rm6 s ILE 559 CO 0.28 0.39 -0.21 -1.61 -1.23 0.00 0.00 174.94 172.56 1rm6 s GLU 560 N 0.08 1.75 -0.37 2.79 2.02 0.54 -4.90 118.70 120.61 1rm6 s GLU 560 Ca 0.29 -0.74 -0.08 0.00 0.02 0.00 0.00 54.97 54.46 1rm6 s GLU 560 Cb -0.17 -1.66 0.05 0.00 0.10 0.00 0.00 34.13 32.45 1rm6 s GLU 560 CO 0.15 0.43 0.17 0.08 0.02 0.00 0.00 175.26 176.11 1rm6 s VAL 561 N -0.42 4.02 -0.24 2.63 1.01 -1.26 -0.13 120.40 126.01 1rm6 s VAL 561 Ca 0.06 -1.21 0.01 0.00 0.00 0.00 0.00 61.98 60.84 1rm6 s VAL 561 Cb -0.09 -3.35 0.04 0.00 0.00 0.00 0.00 36.38 32.99 1rm6 s VAL 561 CO -0.00 -0.31 -0.12 -0.63 0.00 0.00 0.00 175.10 174.04 1rm6 s ILE 562 N 1.42 2.33 -0.94 2.22 1.01 0.84 -4.77 121.20 123.31 1rm6 s ILE 562 Ca 0.01 -1.29 -0.10 0.00 0.00 0.00 0.00 60.65 59.27 1rm6 s ILE 562 Cb -0.21 -2.22 0.01 0.00 0.01 0.00 0.00 42.46 40.06 1rm6 s ILE 562 CO 0.03 0.18 0.63 -0.67 0.00 0.00 0.00 174.94 175.11 1rm6 n ASP 563 N 4.55 -4.68 -1.79 3.58 2.03 -1.24 -1.40 116.55 117.59 1rm6 n ASP 563 Ca -0.17 -1.05 -0.18 0.00 0.52 0.00 0.00 54.79 53.91 1rm6 n ASP 563 Cb 0.45 -1.71 -0.04 0.00 -0.72 0.00 0.00 41.12 39.10 1rm6 n ASP 563 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1rm6 n GLU 564 N -3.31 -1.39 -4.60 -0.67 1.02 -0.12 -5.00 120.64 106.57 1rm6 n GLU 564 Ca -0.26 1.01 -0.23 0.00 -0.02 0.00 0.00 57.16 57.65 1rm6 n GLU 564 Cb 0.66 -5.42 -0.16 0.00 -0.02 0.00 0.00 31.44 26.50 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 -4.31 1.41 -0.36 3.49 -1.94 -0.50 -1.51 119.30 115.59 1rm6 s MET 565 Ca 0.00 -0.44 -0.11 0.00 -1.71 0.00 0.00 55.69 53.42 1rm6 s MET 565 Cb 0.00 -1.25 0.01 0.00 2.01 0.00 0.00 34.83 35.61 1rm6 s MET 565 CO 0.00 0.15 0.21 -0.06 -0.01 0.00 0.00 175.02 175.31 1rm6 s PHE 566 N 0.21 3.22 0.30 -0.03 0.40 0.44 -0.12 117.98 122.41 1rm6 s PHE 566 Ca -0.05 -0.75 0.09 0.00 -0.60 0.00 0.00 56.93 55.62 1rm6 s PHE 566 Cb -0.11 -2.44 -0.05 0.00 0.51 0.00 0.00 43.02 40.94 1rm6 s PHE 566 CO 0.02 -0.56 0.01 -1.64 0.70 0.00 0.00 175.22 173.74 1rm6 s MET 567 N 1.60 2.20 -0.30 0.44 -1.94 0.81 -0.66 119.30 121.45 1rm6 s MET 567 Ca 0.03 -1.55 -0.11 0.00 -1.71 0.00 0.00 55.69 52.35 1rm6 s MET 567 Cb -0.18 -2.07 -0.03 0.00 2.01 0.00 0.00 34.83 34.55 1rm6 s MET 567 CO 0.07 0.26 0.20 0.08 -0.01 0.00 0.00 175.02 175.62 1rm6 s VAL 568 N -2.41 5.16 0.06 -6.03 1.01 -1.26 -0.34 120.40 116.58 1rm6 s VAL 568 Ca 0.33 -0.05 -0.37 0.00 0.00 0.00 0.00 61.98 61.89 1rm6 s VAL 568 Cb -0.04 -3.54 -0.17 0.00 0.00 0.00 0.00 36.38 32.64 1rm6 s VAL 568 CO 0.20 0.15 1.38 -0.24 0.00 0.00 0.00 175.10 176.59 1rm6 n SER 569 N 5.06 1.74 0.00 3.32 2.88 0.12 -1.33 113.62 125.40 1rm6 n SER 569 Ca -0.14 1.11 0.00 0.00 -1.33 0.00 0.00 58.87 58.52 1rm6 n SER 569 Cb 0.51 -1.19 0.00 0.00 -0.75 0.00 0.00 64.21 62.78 1rm6 n SER 569 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1rm6 n GLY 570 N 2.69 1.29 3.29 0.46 0.00 -1.26 -4.98 105.19 106.68 1rm6 n GLY 570 Ca 0.19 -0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1rm6 n GLY 570 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1rm6 n SER 571 N 1.84 -2.35 -0.09 1.61 2.88 -0.45 -4.97 113.62 112.10 1rm6 n SER 571 Ca 0.00 -0.05 -0.10 0.00 -1.33 0.00 0.00 58.87 57.39 1rm6 n SER 571 Cb 0.00 -0.99 -0.15 0.00 -0.75 0.00 0.00 64.21 62.32 1rm6 n SER 571 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1rm6 n GLN 572 N -1.97 0.92 -1.44 -1.46 10.64 -1.26 -4.91 117.38 117.89 1rm6 n GLN 572 Ca 0.01 -0.00 -0.51 0.00 -1.83 0.00 0.00 57.00 54.67 1rm6 n GLN 572 Cb 0.61 -1.48 -0.04 0.00 -0.86 0.00 0.00 30.24 28.47 1rm6 n GLN 572 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1rm6 n ASP 573 N -2.72 -0.70 0.25 2.61 -0.08 -1.26 -4.79 116.55 109.86 1rm6 n ASP 573 Ca -0.31 1.14 0.17 0.00 -1.51 0.00 0.00 54.79 54.28 1rm6 n ASP 573 Cb 1.11 -0.97 0.85 0.00 2.34 0.00 0.00 41.12 44.45 1rm6 n ASP 573 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1rm6 h PRO 574 N 1.67 0.00 0.00 -0.67 0.11 -1.97 -3.44 132.00 127.70 1rm6 h PRO 574 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1rm6 h PRO 574 Cb 1.43 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.54 1rm6 h PRO 574 CO 0.60 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.80 1rm6 n GLY 575 N -0.84 -1.89 3.44 -0.55 0.00 -1.26 -4.84 105.19 99.25 1rm6 n GLY 575 Ca -0.01 -1.53 -0.32 0.00 0.00 0.00 0.00 46.02 44.16 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 2.57 0.75 0.99 1.43 0.17 -4.93 118.68 119.66 1rm6 s LEU 576 Ca 0.00 -0.28 -0.11 0.00 -1.03 0.00 0.00 54.13 52.72 1rm6 s LEU 576 Cb 0.00 -1.51 0.04 0.00 0.03 0.00 0.00 46.19 44.75 1rm6 s LEU 576 CO 0.00 0.33 1.08 -0.94 0.23 0.00 0.00 176.35 177.05 1rm6 s SER 577 N -0.77 4.80 0.22 2.29 1.04 -1.26 -0.42 113.70 119.59 1rm6 s SER 577 Ca 0.11 1.76 -0.08 0.00 0.48 0.00 0.00 55.95 58.22 1rm6 s SER 577 Cb -0.10 -2.51 0.28 0.00 0.10 0.00 0.00 66.02 63.78 1rm6 s SER 577 CO 0.01 -1.84 1.80 0.15 0.98 0.00 0.00 173.24 174.34 1rm6 h PHE 578 N -0.97 0.68 -0.43 5.02 3.57 -1.65 -1.48 116.94 121.67 1rm6 h PHE 578 Ca -0.44 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.04 1rm6 h PHE 578 Cb 1.22 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.74 1rm6 h PHE 578 CO 0.59 0.30 0.07 0.37 -2.23 0.00 0.00 178.31 177.41 1rm6 h GLN 579 N 0.67 0.66 -0.40 1.11 5.75 -1.92 -0.09 115.11 120.89 1rm6 h GLN 579 Ca 0.32 -0.14 -0.08 0.00 -0.15 0.00 0.00 58.65 58.60 1rm6 h GLN 579 Cb 0.25 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.68 1rm6 h GLN 579 CO -0.21 0.64 -0.09 0.93 -2.65 0.00 0.00 178.83 177.45 1rm6 h GLU 580 N 0.64 0.70 -0.32 1.69 5.08 -1.66 -1.94 114.58 118.77 1rm6 h GLU 580 Ca 0.14 -0.21 -0.17 0.00 -1.00 0.00 0.00 59.36 58.12 1rm6 h GLU 580 Cb 0.30 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 1rm6 h GLU 580 CO 0.00 0.78 -0.47 0.28 -1.00 0.00 0.00 179.01 178.60 1rm6 h VAL 581 N 0.64 1.28 -0.28 3.13 2.07 -0.53 -2.02 116.25 120.54 1rm6 h VAL 581 Ca 0.12 -1.65 0.03 0.00 0.82 0.00 0.00 66.70 66.02 1rm6 h VAL 581 Cb 0.53 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.80 1rm6 h VAL 581 CO 0.03 0.54 0.09 0.58 0.02 0.00 0.00 177.57 178.83 1rm6 h VAL 582 N 0.67 0.92 -0.69 2.57 2.07 -0.80 0.21 116.25 121.21 1rm6 h VAL 582 Ca 0.04 -0.07 0.05 0.00 0.82 0.00 0.00 66.70 67.53 1rm6 h VAL 582 Cb 1.05 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 31.46 1rm6 h VAL 582 CO 0.11 0.04 0.40 0.11 0.02 0.00 0.00 177.57 178.25 1rm6 h LYS 583 N 0.21 0.73 -0.51 1.57 1.57 -1.26 -1.03 116.57 117.86 1rm6 h LYS 583 Ca 0.12 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.75 1rm6 h LYS 583 Cb 0.09 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 1rm6 h LYS 583 CO -0.13 0.48 -0.11 0.00 -0.57 0.00 0.00 179.45 179.12 1rm6 h ALA 584 N 1.34 0.85 0.00 3.86 0.00 -0.75 -2.86 119.26 121.70 1rm6 h ALA 584 Ca 0.30 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1rm6 h ALA 584 Cb 0.14 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1rm6 h ALA 584 CO -0.16 0.65 -0.07 0.00 0.00 0.00 0.00 179.25 179.67 1rm6 h ALA 585 N 1.02 1.04 0.00 0.00 0.00 0.25 -2.75 119.26 118.81 1rm6 h ALA 585 Ca 0.13 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1rm6 h ALA 585 Cb 0.65 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1rm6 h ALA 585 CO 0.05 0.09 -0.40 0.52 0.00 0.00 0.00 179.25 179.50 1rm6 h MET 586 N 0.00 0.00 -6.63 0.00 2.07 -0.98 -3.42 114.93 105.97 1rm6 h MET 586 Ca -0.00 0.00 -0.53 0.00 -2.07 0.00 0.00 59.70 57.10 1rm6 h MET 586 Cb 0.51 0.00 0.06 0.00 -1.87 0.00 0.00 31.60 30.30 1rm6 h MET 586 CO 0.01 0.40 0.97 0.28 1.07 0.00 0.00 176.91 179.64 1rm6 n VAL 587 N -3.43 0.02 -2.08 -2.22 0.31 -1.04 -0.54 118.33 109.34 1rm6 n VAL 587 Ca 0.00 -0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.14 1rm6 n VAL 587 Cb 0.57 -1.91 -0.04 0.00 -0.91 0.00 0.00 33.84 31.55 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 3.85 -5.26 0.07 4.52 9.92 -1.26 -4.69 116.55 123.70 1rm6 n ASP 588 Ca 0.16 0.20 0.00 0.00 -0.53 0.00 0.00 54.79 54.62 1rm6 n ASP 588 Cb 0.34 -4.50 0.00 0.00 -0.64 0.00 0.00 41.12 36.32 1rm6 n ASP 588 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 1rm6 n SER 589 N -1.66 -0.37 -0.12 -2.24 2.88 -0.53 -5.15 113.62 106.43 1rm6 n SER 589 Ca -0.21 0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.58 1rm6 n SER 589 Cb 0.65 0.48 0.00 0.00 -0.75 0.00 0.00 64.21 64.59 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 1.03 -0.96 2.99 0.46 0.00 0.30 -4.86 105.19 104.14 1rm6 n GLY 590 Ca 0.00 -1.18 -0.52 0.00 0.00 0.00 0.00 46.02 44.32 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 -0.24 0.00 -3.46 2.61 -1.04 -1.26 -4.74 114.28 106.15 1rm6 n THR 591 Ca 0.00 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.63 1rm6 n THR 591 Cb 0.00 -0.20 -0.08 0.00 -1.82 0.00 0.00 70.33 68.23 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 1.22 5.24 -0.08 12.58 1.01 -0.15 -4.98 121.20 136.05 1rm6 s ILE 592 Ca 0.81 0.56 0.03 0.00 0.00 0.00 0.00 60.65 62.05 1rm6 s ILE 592 Cb -1.14 -3.67 0.01 0.00 0.01 0.00 0.00 42.46 37.67 1rm6 s ILE 592 CO 0.57 0.27 -0.17 0.42 0.00 0.00 0.00 174.94 176.02 1rm6 s THR 593 N 1.32 1.53 0.18 2.92 -4.23 -1.26 -1.05 115.64 115.05 1rm6 s THR 593 Ca 0.16 -0.72 0.06 0.00 -1.18 0.00 0.00 61.69 60.00 1rm6 s THR 593 Cb -0.15 -1.35 -0.05 0.00 1.34 0.00 0.00 72.50 72.30 1rm6 s THR 593 CO 0.07 0.44 -0.10 0.68 -0.54 0.00 0.00 174.62 175.17 1rm6 s VAL 594 N 0.45 1.36 -0.04 2.29 -7.23 -0.44 -4.99 120.40 111.81 1rm6 s VAL 594 Ca -0.15 -2.11 0.03 0.00 -1.81 0.00 0.00 61.98 57.94 1rm6 s VAL 594 Cb -0.16 -2.01 0.00 0.00 0.56 0.00 0.00 36.38 34.78 1rm6 s VAL 594 CO 0.06 -0.62 -0.13 -0.75 -0.31 0.00 0.00 175.10 173.35 1rm6 s LYS 595 N -3.73 1.43 0.05 4.82 2.20 -1.26 -1.54 119.74 121.71 1rm6 s LYS 595 Ca 0.21 -0.44 0.08 0.00 -0.36 0.00 0.00 55.97 55.46 1rm6 s LYS 595 Cb 0.02 -1.26 -0.03 0.00 -1.51 0.00 0.00 37.83 35.06 1rm6 s LYS 595 CO 0.04 0.14 -0.23 0.20 -0.36 0.00 0.00 175.35 175.14 1rm6 s GLY 596 N 0.24 1.24 0.16 5.54 0.00 0.12 -4.56 107.32 110.07 1rm6 s GLY 596 Ca -0.06 -1.15 0.00 0.00 0.00 0.00 0.00 44.72 43.51 1rm6 s GLY 596 CO 0.02 -1.07 0.04 -0.51 0.00 0.00 0.00 173.10 171.58 1rm6 s THR 597 N -0.81 0.37 -0.07 0.90 -4.23 -1.26 -1.06 115.64 109.48 1rm6 s THR 597 Ca 0.09 -1.95 -0.06 0.00 -1.18 0.00 0.00 61.69 58.59 1rm6 s THR 597 Cb -0.09 -2.12 0.02 0.00 1.34 0.00 0.00 72.50 71.64 1rm6 s THR 597 CO 0.02 -0.43 0.18 -0.47 -0.54 0.00 0.00 174.62 173.38 1rm6 s TYR 598 N -3.87 -0.19 -0.02 3.99 5.04 -0.63 -4.47 117.35 117.19 1rm6 s TYR 598 Ca 0.25 0.47 0.00 0.00 -2.44 0.00 0.00 57.07 55.35 1rm6 s TYR 598 Cb 0.07 0.07 0.03 0.00 0.35 0.00 0.00 41.96 42.47 1rm6 s TYR 598 CO 0.04 -0.10 0.02 0.99 -1.34 0.00 0.00 175.55 175.15 1rm6 s THR 599 N 0.05 0.04 0.15 4.34 2.01 -1.26 -0.56 115.64 120.41 1rm6 s THR 599 Ca -0.01 0.15 -0.31 0.00 0.31 0.00 0.00 61.69 61.84 1rm6 s THR 599 Cb -0.01 -0.15 -0.09 0.00 0.01 0.00 0.00 72.50 72.25 1rm6 s THR 599 CO 0.00 0.11 1.46 0.00 -0.69 0.00 0.00 174.62 175.50 1rm6 s PRO 601 N 0.92 2.54 0.44 0.00 0.02 -1.26 -4.91 135.00 132.75 1rm6 s PRO 601 Ca 0.66 1.79 0.13 0.00 0.02 0.00 0.00 61.00 63.60 1rm6 s PRO 601 Cb -0.40 -1.88 1.04 0.00 0.02 0.00 0.00 34.50 33.28 1rm6 s PRO 601 CO 0.32 -1.53 2.01 1.15 -0.33 0.00 0.00 177.00 178.62 1rm6 h THR 602 N 0.25 0.93 -1.12 0.99 2.02 -1.98 -1.10 112.91 112.90 1rm6 h THR 602 Ca -0.49 -0.13 0.31 0.00 0.77 0.00 0.00 66.41 66.87 1rm6 h THR 602 Cb 1.30 0.52 -0.09 0.00 -1.74 0.00 0.00 68.15 68.14 1rm6 h THR 602 CO 0.52 0.07 0.75 -0.33 0.37 0.00 0.00 175.52 176.90 1rm6 h GLU 603 N 0.38 0.24 -0.58 6.66 5.08 -1.91 -1.02 114.58 123.43 1rm6 h GLU 603 Ca 0.23 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1rm6 h GLU 603 Cb 0.42 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1rm6 h GLU 603 CO -0.06 0.16 0.00 1.19 -1.00 0.00 0.00 179.01 179.30 1rm6 n PHE 604 N -4.51 0.78 -1.13 4.33 3.01 -0.42 -4.38 117.46 115.14 1rm6 n PHE 604 Ca 0.27 -0.39 -0.04 0.00 1.01 0.00 0.00 57.45 58.31 1rm6 n PHE 604 Cb 1.06 0.00 0.27 0.00 -0.01 0.00 0.00 39.48 40.79 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 1.29 3.07 0.00 -1.08 6.02 -0.39 -3.30 117.38 122.99 1rm6 n GLN 605 Ca 0.20 -3.05 0.00 0.00 -0.01 0.00 0.00 57.00 54.14 1rm6 n GLN 605 Cb 0.52 -2.05 0.00 0.00 1.02 0.00 0.00 30.24 29.73 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 -0.50 -1.35 2.83 1.08 0.00 -1.26 -4.26 105.19 101.73 1rm6 n GLY 606 Ca 0.36 -1.67 -0.23 0.00 0.00 0.00 0.00 46.02 44.49 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 1.59 0.59 1.61 -1.08 -1.26 -4.90 116.67 109.21 1rm6 s ASP 607 Ca 0.00 -0.15 0.29 0.00 -0.52 0.00 0.00 52.55 52.17 1rm6 s ASP 607 Cb 0.00 -0.54 1.71 0.00 -1.46 0.00 0.00 42.92 42.64 1rm6 s ASP 607 CO 0.00 -0.14 2.17 0.11 0.52 0.00 0.00 175.17 177.82 1rm6 h LYS 608 N 8.02 0.00 0.00 4.34 1.57 -1.99 -0.74 116.57 127.76 1rm6 h LYS 608 Ca -0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1rm6 h LYS 608 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1rm6 h LYS 608 CO 0.34 0.00 0.00 0.87 -0.57 0.00 0.00 179.45 180.09 1rm6 h LYS 609 N 0.00 0.00 -4.28 3.15 1.57 -2.02 -3.38 116.57 111.60 1rm6 h LYS 609 Ca 0.05 0.00 -0.73 0.00 -1.87 0.00 0.00 60.65 58.09 1rm6 h LYS 609 Cb 0.27 0.00 -0.26 0.00 0.08 0.00 0.00 32.23 32.32 1rm6 h LYS 609 CO -0.00 0.00 -0.35 0.42 -0.57 0.00 0.00 179.45 178.94 1rm6 s ILE 610 N -3.64 4.67 0.21 1.86 1.01 -0.28 -5.04 121.20 119.98 1rm6 s ILE 610 Ca 0.01 -1.48 -0.32 0.00 0.00 0.00 0.00 60.65 58.87 1rm6 s ILE 610 Cb 0.09 -3.94 -0.13 0.00 0.01 0.00 0.00 42.46 38.49 1rm6 s ILE 610 CO 0.54 -0.69 1.63 -1.14 0.00 0.00 0.00 174.94 175.28 1rm6 n ARG 611 N 5.05 2.50 -0.98 2.79 0.63 -1.26 -1.36 116.66 124.03 1rm6 n ARG 611 Ca -0.11 0.90 0.00 0.00 -0.92 0.00 0.00 57.85 57.72 1rm6 n ARG 611 Cb 0.42 -2.69 0.00 0.00 0.45 0.00 0.00 32.46 30.63 1rm6 n ARG 611 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1rm6 n GLY 612 N 3.33 0.77 0.03 5.14 0.00 -1.26 -4.91 105.19 108.28 1rm6 n GLY 612 Ca 0.15 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.23 1rm6 n GLY 612 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1rm6 n SER 613 N -0.02 0.12 0.23 1.61 3.41 -0.47 -1.27 113.62 117.22 1rm6 n SER 613 Ca 0.00 0.54 0.06 0.00 -0.26 0.00 0.00 58.87 59.21 1rm6 n SER 613 Cb 0.01 -0.56 0.55 0.00 -0.26 0.00 0.00 64.21 63.95 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 1.81 -1.77 7.33 0.00 -1.83 -3.23 119.26 123.88 1rm6 h ALA 614 Ca 0.00 -0.10 -0.57 0.00 0.00 0.00 0.00 54.91 54.24 1rm6 h ALA 614 Cb 0.19 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.87 1rm6 h ALA 614 CO 0.00 0.14 0.83 0.42 0.00 0.00 0.00 179.25 180.64 1rm6 s ILE 615 N -4.84 4.27 0.00 0.00 -1.09 -0.40 -2.18 121.20 116.97 1rm6 s ILE 615 Ca -0.05 1.04 0.00 0.00 -2.23 0.00 0.00 60.65 59.41 1rm6 s ILE 615 Cb 0.16 -4.57 0.00 0.00 -1.58 0.00 0.00 42.46 36.48 1rm6 s ILE 615 CO 0.69 -0.99 0.00 0.61 -1.23 0.00 0.00 174.94 174.02 1rm6 n GLY 616 N 4.90 1.58 3.82 6.18 0.00 -1.26 -4.81 105.19 115.60 1rm6 n GLY 616 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.07 3.55 0.23 4.61 0.00 -0.93 -4.92 121.76 122.23 1rm6 s ALA 617 Ca 0.00 0.02 -0.23 0.00 0.00 0.00 0.00 51.96 51.75 1rm6 s ALA 617 Cb 0.00 -2.64 0.04 0.00 0.00 0.00 0.00 23.12 20.51 1rm6 s ALA 617 CO 0.00 0.40 0.78 -0.08 0.00 0.00 0.00 175.76 176.87 1rm6 s THR 618 N -1.31 0.00 0.14 0.00 -1.32 -1.21 -2.34 115.64 109.60 1rm6 s THR 618 Ca 0.35 -0.80 0.15 0.00 -1.21 0.00 0.00 61.69 60.18 1rm6 s THR 618 Cb -0.18 -1.90 0.06 0.00 -1.51 0.00 0.00 72.50 68.98 1rm6 s THR 618 CO 0.20 0.00 1.63 0.24 -2.21 0.00 0.00 174.62 174.47 1rm6 h MET 619 N 2.00 0.00 -1.12 7.08 2.86 -1.81 -3.42 114.93 120.52 1rm6 h MET 619 Ca -0.22 0.00 0.33 0.00 -2.06 0.00 0.00 59.70 57.75 1rm6 h MET 619 Cb 1.25 0.00 -0.19 0.00 0.06 0.00 0.00 31.60 32.72 1rm6 h MET 619 CO 0.25 0.50 0.95 0.20 1.06 0.00 0.00 176.91 179.87 1rm6 s GLY 620 N -4.42 -0.27 -0.01 8.32 0.00 -1.26 -4.73 107.32 104.94 1rm6 s GLY 620 Ca 0.00 1.68 0.04 0.00 0.00 0.00 0.00 44.72 46.44 1rm6 s GLY 620 CO 0.72 0.53 -0.10 -1.36 0.00 0.00 0.00 173.10 172.89 1rm6 s PHE 621 N -2.11 2.80 -0.01 1.90 0.40 -1.26 -0.90 117.98 118.80 1rm6 s PHE 621 Ca 0.12 -0.10 -0.20 0.00 -0.60 0.00 0.00 56.93 56.16 1rm6 s PHE 621 Cb 0.01 -1.60 -0.05 0.00 0.51 0.00 0.00 43.02 41.88 1rm6 s PHE 621 CO -0.03 0.31 0.57 0.00 0.70 0.00 0.00 175.22 176.77 1rm6 s TYR 623 N -0.22 2.48 0.00 0.00 1.51 -1.09 -1.95 117.35 118.09 1rm6 s TYR 623 Ca 0.30 -0.31 0.00 0.00 -1.01 0.00 0.00 57.07 56.06 1rm6 s TYR 623 Cb -0.18 -1.45 -0.00 0.00 -0.11 0.00 0.00 41.96 40.22 1rm6 s TYR 623 CO 0.16 0.20 -0.01 0.00 -1.11 0.00 0.00 175.55 174.79 1rm6 s ALA 624 N -0.86 0.11 -0.05 3.71 0.00 -0.28 -0.39 121.76 124.00 1rm6 s ALA 624 Ca 0.13 -0.11 0.06 0.00 0.00 0.00 0.00 51.96 52.05 1rm6 s ALA 624 Cb -0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.99 1rm6 s ALA 624 CO 0.04 0.01 -0.25 0.00 0.00 0.00 0.00 175.76 175.56 1rm6 s ALA 625 N -0.17 2.19 -0.00 0.00 0.00 -0.34 -1.58 121.76 121.86 1rm6 s ALA 625 Ca -0.01 -1.07 -0.03 0.00 0.00 0.00 0.00 51.96 50.86 1rm6 s ALA 625 Cb -0.01 -0.66 -0.00 0.00 0.00 0.00 0.00 23.12 22.44 1rm6 s ALA 625 CO -0.00 0.45 0.05 1.14 0.00 0.00 0.00 175.76 177.40 1rm6 s GLN 626 N -0.32 0.27 -0.08 0.00 -2.07 -0.50 -0.77 119.66 116.20 1rm6 s GLN 626 Ca 0.01 -0.30 0.03 0.00 -1.82 0.00 0.00 55.36 53.28 1rm6 s GLN 626 Cb -0.13 0.11 -0.02 0.00 -1.09 0.00 0.00 33.01 31.88 1rm6 s GLN 626 CO 0.02 -0.05 -0.17 0.08 -1.32 0.00 0.00 175.29 173.85 1rm6 s VAL 627 N -0.89 2.77 -0.06 3.63 1.01 0.05 -1.67 120.40 125.24 1rm6 s VAL 627 Ca -0.10 -0.80 0.05 0.00 0.00 0.00 0.00 61.98 61.13 1rm6 s VAL 627 Cb -0.06 -2.09 -0.00 0.00 0.00 0.00 0.00 36.38 34.22 1rm6 s VAL 627 CO 0.00 0.56 -0.22 -0.69 0.00 0.00 0.00 175.10 174.75 1rm6 s VAL 628 N -0.22 1.84 -0.16 2.92 1.01 -0.02 -1.05 120.40 124.72 1rm6 s VAL 628 Ca -0.00 -0.93 -0.04 0.00 0.00 0.00 0.00 61.98 61.01 1rm6 s VAL 628 Cb -0.13 -1.57 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 1rm6 s VAL 628 CO 0.03 0.51 -0.04 -0.70 0.00 0.00 0.00 175.10 174.91 1rm6 s GLU 629 N 0.05 3.66 0.11 2.72 2.12 -0.20 -1.42 118.70 125.73 1rm6 s GLU 629 Ca -0.08 -0.53 -0.07 0.00 0.36 0.00 0.00 54.97 54.66 1rm6 s GLU 629 Cb -0.14 -2.92 -0.01 0.00 0.26 0.00 0.00 34.13 31.32 1rm6 s GLU 629 CO 0.04 0.22 0.16 0.00 -0.54 0.00 0.00 175.26 175.15 1rm6 s ALA 630 N 0.41 0.08 0.14 6.30 0.00 -0.66 -1.09 121.76 126.94 1rm6 s ALA 630 Ca -0.04 -0.88 0.05 0.00 0.00 0.00 0.00 51.96 51.08 1rm6 s ALA 630 Cb -0.14 0.59 -0.04 0.00 0.00 0.00 0.00 23.12 23.53 1rm6 s ALA 630 CO 0.03 -0.52 -0.11 -1.54 0.00 0.00 0.00 175.76 173.62 1rm6 s SER 631 N -2.92 1.79 -0.05 0.00 1.04 -0.35 -0.67 113.70 112.54 1rm6 s SER 631 Ca 0.11 -0.98 0.02 0.00 0.48 0.00 0.00 55.95 55.58 1rm6 s SER 631 Cb 0.05 -0.02 0.01 0.00 0.10 0.00 0.00 66.02 66.17 1rm6 s SER 631 CO -0.07 -0.31 -0.11 -0.69 0.98 0.00 0.00 173.24 173.05 1rm6 s VAL 632 N -3.15 1.01 -0.36 5.02 1.01 -0.13 -0.75 120.40 123.06 1rm6 s VAL 632 Ca 0.15 -0.43 -0.21 0.00 0.00 0.00 0.00 61.98 61.49 1rm6 s VAL 632 Cb 0.01 -0.93 0.01 0.00 0.00 0.00 0.00 36.38 35.47 1rm6 s VAL 632 CO 0.01 0.32 0.67 -0.62 0.00 0.00 0.00 175.10 175.48 1rm6 s ASP 633 N 0.58 6.45 0.51 3.32 -1.08 -0.17 -4.79 116.67 121.47 1rm6 s ASP 633 Ca -0.12 0.16 0.31 0.00 -0.52 0.00 0.00 52.55 52.38 1rm6 s ASP 633 Cb -0.14 -2.34 1.18 0.00 -1.46 0.00 0.00 42.92 40.16 1rm6 s ASP 633 CO 0.03 -0.64 1.91 -0.33 0.52 0.00 0.00 175.17 176.65 1rm6 h GLU 634 N 8.50 0.00 0.09 4.34 5.08 -1.94 0.42 114.58 131.07 1rm6 h GLU 634 Ca -0.26 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1rm6 h GLU 634 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 1rm6 h GLU 634 CO 0.86 0.00 -0.04 0.82 -1.00 0.00 0.00 179.01 179.65 1rm6 h ILE 635 N 0.00 1.14 0.00 3.13 2.04 -1.98 -3.33 117.51 118.50 1rm6 h ILE 635 Ca 0.00 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 64.98 1rm6 h ILE 635 Cb 0.57 1.69 0.00 0.00 -0.74 0.00 0.00 36.82 38.35 1rm6 h ILE 635 CO 0.00 0.21 -1.24 0.35 0.00 0.00 0.00 178.15 177.47 1rm6 n THR 636 N -4.95 0.18 -0.96 -0.27 -2.24 -1.20 -4.96 114.28 99.87 1rm6 n THR 636 Ca -0.08 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1rm6 n THR 636 Cb 0.23 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 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 1.33 0.84 3.71 3.38 0.00 0.15 -4.77 105.19 109.83 1rm6 n GLY 637 Ca 0.00 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 -0.04 4.31 -0.14 1.61 2.47 -1.19 -4.25 119.74 122.50 1rm6 s LYS 638 Ca 0.00 2.04 -0.13 0.00 -1.56 0.00 0.00 55.97 56.33 1rm6 s LYS 638 Cb 0.00 -3.36 -0.05 0.00 -1.46 0.00 0.00 37.83 32.96 1rm6 s LYS 638 CO 0.00 -0.48 0.27 0.08 0.16 0.00 0.00 175.35 175.38 1rm6 s VAL 639 N 1.54 5.31 -0.15 4.02 1.01 -1.26 -1.00 120.40 129.87 1rm6 s VAL 639 Ca 0.65 0.51 0.02 0.00 0.00 0.00 0.00 61.98 63.15 1rm6 s VAL 639 Cb -0.35 -3.60 0.01 0.00 0.00 0.00 0.00 36.38 32.44 1rm6 s VAL 639 CO 0.29 0.44 -0.20 -0.89 0.00 0.00 0.00 175.10 174.74 1rm6 s THR 640 N 0.14 1.98 -0.25 3.92 2.01 0.08 -4.98 115.64 118.53 1rm6 s THR 640 Ca 0.16 -0.91 -0.21 0.00 0.31 0.00 0.00 61.69 61.04 1rm6 s THR 640 Cb -0.13 -1.77 -0.02 0.00 0.01 0.00 0.00 72.50 70.59 1rm6 s THR 640 CO 0.04 0.53 0.66 0.00 -0.69 0.00 0.00 174.62 175.16 1rm6 s ALA 641 N 1.05 3.61 -0.17 7.40 0.00 -1.26 -1.21 121.76 131.17 1rm6 s ALA 641 Ca -0.02 -0.37 -0.14 0.00 0.00 0.00 0.00 51.96 51.43 1rm6 s ALA 641 Cb -0.14 -3.07 -0.22 0.00 0.00 0.00 0.00 23.12 19.69 1rm6 s ALA 641 CO -0.07 -0.80 0.25 0.72 0.00 0.00 0.00 175.76 175.86 1rm6 n HIS 642 N 5.68 1.06 -3.62 0.00 8.25 -0.25 -3.78 115.22 122.56 1rm6 n HIS 642 Ca 0.00 0.33 -0.16 0.00 -0.26 0.00 0.00 57.72 57.64 1rm6 n HIS 642 Cb 0.49 -1.12 -0.07 0.00 1.12 0.00 0.00 29.99 30.40 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 -2.46 0.88 -0.04 -0.41 2.20 -1.16 -2.12 119.74 116.64 1rm6 s LYS 643 Ca -0.27 0.15 0.04 0.00 -0.36 0.00 0.00 55.97 55.53 1rm6 s LYS 643 Cb 0.07 0.41 -0.00 0.00 -1.51 0.00 0.00 37.83 36.79 1rm6 s LYS 643 CO 0.67 -0.25 -0.16 0.08 -0.36 0.00 0.00 175.35 175.32 1rm6 s VAL 644 N -1.10 1.37 -0.20 4.02 1.01 -0.37 -1.04 120.40 124.10 1rm6 s VAL 644 Ca -0.11 -0.69 -0.02 0.00 0.00 0.00 0.00 61.98 61.16 1rm6 s VAL 644 Cb -0.02 -1.18 -0.00 0.00 0.00 0.00 0.00 36.38 35.17 1rm6 s VAL 644 CO 0.07 0.40 -0.09 0.26 0.00 0.00 0.00 175.10 175.74 1rm6 s TRP 645 N 0.02 2.90 -0.06 5.22 0.51 -0.21 -0.83 118.94 126.49 1rm6 s TRP 645 Ca -0.03 -1.02 0.01 0.00 -2.12 0.00 0.00 56.10 52.93 1rm6 s TRP 645 Cb -0.11 -2.02 0.02 0.00 -0.81 0.00 0.00 33.47 30.55 1rm6 s TRP 645 CO 0.02 -0.54 -0.05 0.54 -0.51 0.00 0.00 176.95 176.41 1rm6 s VAL 646 N 1.24 0.65 -0.18 4.03 0.11 -0.32 -0.77 120.40 125.15 1rm6 s VAL 646 Ca 0.03 -0.16 -0.04 0.00 -2.93 0.00 0.00 61.98 58.88 1rm6 s VAL 646 Cb -0.14 -0.67 -0.02 0.00 -1.53 0.00 0.00 36.38 34.01 1rm6 s VAL 646 CO -0.04 0.26 -0.03 0.00 -3.33 0.00 0.00 175.10 171.96 1rm6 s ALA 647 N 1.09 2.93 -0.12 1.54 0.00 0.05 -0.65 121.76 126.61 1rm6 s ALA 647 Ca -0.08 -0.96 0.03 0.00 0.00 0.00 0.00 51.96 50.95 1rm6 s ALA 647 Cb -0.14 -1.63 0.00 0.00 0.00 0.00 0.00 23.12 21.35 1rm6 s ALA 647 CO -0.01 -0.05 -0.21 0.54 0.00 0.00 0.00 175.76 176.03 1rm6 s VAL 648 N 0.83 2.24 -0.54 0.00 0.11 -0.25 -1.20 120.40 121.58 1rm6 s VAL 648 Ca -0.01 -0.95 -0.21 0.00 -2.93 0.00 0.00 61.98 57.89 1rm6 s VAL 648 Cb -0.14 -1.88 0.06 0.00 -1.53 0.00 0.00 36.38 32.89 1rm6 s VAL 648 CO 0.02 0.55 0.75 -0.62 -3.33 0.00 0.00 175.10 172.46 1rm6 s ASP 649 N 0.49 6.24 -0.15 3.54 3.68 0.47 -0.17 116.67 130.78 1rm6 s ASP 649 Ca -0.14 -0.85 0.15 0.00 2.13 0.00 0.00 52.55 53.85 1rm6 s ASP 649 Cb -0.17 -2.34 0.52 0.00 -1.45 0.00 0.00 42.92 39.48 1rm6 s ASP 649 CO 0.05 -1.06 1.42 1.33 0.13 0.00 0.00 175.17 177.05 1rm6 n VAL 650 N 5.78 2.07 0.00 1.11 0.24 -0.86 -2.67 118.33 124.01 1rm6 n VAL 650 Ca -0.05 -1.66 0.00 0.00 -2.04 0.00 0.00 64.34 60.59 1rm6 n VAL 650 Cb 0.45 -0.10 0.00 0.00 -1.47 0.00 0.00 33.84 32.72 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 -0.19 1.16 3.56 7.63 0.00 -1.25 -0.75 105.19 115.36 1rm6 n GLY 651 Ca 0.20 -0.02 -0.04 0.00 0.00 0.00 0.00 46.02 46.16 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 0.56 -0.45 1.61 2.47 -1.19 -0.67 119.74 122.07 1rm6 s LYS 652 Ca 0.00 1.29 -0.29 0.00 -1.56 0.00 0.00 55.97 55.41 1rm6 s LYS 652 Cb 0.00 0.55 0.03 0.00 -1.46 0.00 0.00 37.83 36.94 1rm6 s LYS 652 CO 0.00 -0.19 1.14 0.00 0.16 0.00 0.00 175.35 176.46 1rm6 s ALA 653 N 2.43 3.20 0.14 3.13 0.00 -1.26 -4.34 121.76 125.06 1rm6 s ALA 653 Ca -0.07 -0.41 -0.11 0.00 0.00 0.00 0.00 51.96 51.37 1rm6 s ALA 653 Cb -0.10 -3.87 -0.04 0.00 0.00 0.00 0.00 23.12 19.11 1rm6 s ALA 653 CO -0.18 -2.16 1.47 -0.07 0.00 0.00 0.00 175.76 174.83 1rm6 h LEU 654 N 11.09 0.99 -6.98 0.00 3.38 -1.95 -3.34 115.31 118.50 1rm6 h LEU 654 Ca -0.23 -0.46 -0.59 0.00 0.09 0.00 0.00 57.88 56.69 1rm6 h LEU 654 Cb 1.06 -0.28 -0.40 0.00 0.09 0.00 0.00 40.66 41.13 1rm6 h LEU 654 CO 1.11 1.25 -0.76 0.21 0.09 0.00 0.00 178.44 180.34 1rm6 s ASN 655 N -6.81 3.68 0.46 -0.43 3.84 -1.26 -0.32 114.94 114.11 1rm6 s ASN 655 Ca -0.11 -2.11 0.18 0.00 0.21 0.00 0.00 52.86 51.03 1rm6 s ASN 655 Cb 0.11 -0.83 1.15 0.00 -0.55 0.00 0.00 41.25 41.13 1rm6 s ASN 655 CO 0.88 -0.34 1.95 -0.65 -2.79 0.00 0.00 177.10 176.15 1rm6 h PRO 656 N 7.38 0.28 -0.16 0.43 0.11 -1.75 -0.02 132.00 138.28 1rm6 h PRO 656 Ca -0.06 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.03 1rm6 h PRO 656 Cb 0.97 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 1rm6 h PRO 656 CO 0.44 0.19 0.06 1.25 -0.21 0.00 0.00 178.00 179.73 1rm6 h LEU 657 N 0.29 0.23 -0.47 2.35 5.85 -1.90 -0.97 115.31 120.68 1rm6 h LEU 657 Ca 0.32 -0.17 -0.15 0.00 0.84 0.00 0.00 57.88 58.71 1rm6 h LEU 657 Cb 0.84 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 1rm6 h LEU 657 CO -0.08 0.34 -0.35 0.00 -0.34 0.00 0.00 178.44 178.01 1rm6 h ALA 658 N 0.90 0.66 -0.75 1.25 0.00 -1.63 -2.15 119.26 117.54 1rm6 h ALA 658 Ca 0.05 -0.44 0.03 0.00 0.00 0.00 0.00 54.91 54.55 1rm6 h ALA 658 Cb 0.19 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1rm6 h ALA 658 CO -0.00 0.67 0.47 0.28 0.00 0.00 0.00 179.25 180.67 1rm6 h VAL 659 N 0.73 1.11 -0.32 0.00 2.07 -0.88 0.11 116.25 119.06 1rm6 h VAL 659 Ca 0.07 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 1rm6 h VAL 659 Cb 0.93 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1rm6 h VAL 659 CO 0.09 0.17 0.17 -0.33 0.02 0.00 0.00 177.57 177.69 1rm6 h GLU 660 N 0.93 0.46 -0.69 1.57 5.08 -1.00 -1.14 114.58 119.77 1rm6 h GLU 660 Ca 0.30 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.54 1rm6 h GLU 660 Cb 0.01 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1rm6 h GLU 660 CO -0.11 0.40 0.20 0.78 -1.00 0.00 0.00 179.01 179.28 1rm6 h GLY 661 N 0.40 1.17 0.99 -3.84 0.00 -0.88 -0.55 103.07 100.37 1rm6 h GLY 661 Ca 0.11 -0.71 -0.04 0.00 0.00 0.00 0.00 47.33 46.69 1rm6 h GLY 661 CO -0.02 0.66 0.18 1.46 0.00 0.00 0.00 176.54 178.83 1rm6 h GLN 662 N 1.03 0.88 -0.51 4.80 1.08 -0.71 -0.56 115.11 121.11 1rm6 h GLN 662 Ca 0.22 -0.19 -0.10 0.00 -1.45 0.00 0.00 58.65 57.13 1rm6 h GLN 662 Cb 0.33 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.61 1rm6 h GLN 662 CO -0.00 0.79 -0.09 1.15 -0.95 0.00 0.00 178.83 179.72 1rm6 h THR 663 N 0.79 1.26 -0.46 -0.54 2.02 -0.96 -0.98 112.91 114.04 1rm6 h THR 663 Ca 0.18 -1.22 -0.10 0.00 0.77 0.00 0.00 66.41 66.05 1rm6 h THR 663 Cb 0.27 0.97 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 1rm6 h THR 663 CO -0.01 0.43 -0.09 1.56 0.37 0.00 0.00 175.52 177.78 1rm6 h GLN 664 N 0.84 0.87 -0.74 6.66 4.20 -0.92 -1.14 115.11 124.89 1rm6 h GLN 664 Ca 0.14 -0.32 -0.03 0.00 0.06 0.00 0.00 58.65 58.49 1rm6 h GLN 664 Cb 0.63 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.32 1rm6 h GLN 664 CO 0.04 0.96 0.34 0.78 -0.67 0.00 0.00 178.83 180.28 1rm6 h GLY 665 N 0.71 1.15 0.62 3.46 0.00 -0.91 -0.59 103.07 107.51 1rm6 h GLY 665 Ca 0.12 -0.58 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 1rm6 h GLY 665 CO 0.04 0.55 -0.01 -1.33 0.00 0.00 0.00 176.54 175.78 1rm6 h GLY 666 N 1.11 0.07 0.74 4.60 0.00 -0.98 -1.28 103.07 107.32 1rm6 h GLY 666 Ca 0.25 -0.06 0.04 0.00 0.00 0.00 0.00 47.33 47.57 1rm6 h GLY 666 CO -0.03 0.05 0.22 -2.08 0.00 0.00 0.00 176.54 174.71 1rm6 h VAL 667 N -0.34 0.95 -0.90 4.60 2.07 -1.14 -2.39 116.25 119.10 1rm6 h VAL 667 Ca 0.01 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 1rm6 h VAL 667 Cb 0.44 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 1rm6 h VAL 667 CO 0.00 0.08 0.51 -0.25 0.02 0.00 0.00 177.57 177.94 1rm6 h TRP 668 N 0.44 1.21 -0.62 1.57 7.01 -1.04 -0.06 115.95 124.46 1rm6 h TRP 668 Ca 0.20 -0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.15 1rm6 h TRP 668 Cb 0.12 -0.39 -0.03 0.00 -2.10 0.00 0.00 29.16 26.76 1rm6 h TRP 668 CO -0.11 0.82 0.25 1.98 -2.79 0.00 0.00 178.44 178.59 1rm6 h MET 669 N 1.24 0.90 -0.68 2.65 4.05 -0.95 -0.85 114.93 121.29 1rm6 h MET 669 Ca 0.32 -0.14 -0.05 0.00 -0.28 0.00 0.00 59.70 59.55 1rm6 h MET 669 Cb -0.01 -0.16 -0.03 0.00 -0.80 0.00 0.00 31.60 30.60 1rm6 h MET 669 CO -0.06 0.73 0.23 0.78 0.23 0.00 0.00 176.91 178.83 1rm6 h GLY 670 N 0.99 1.10 1.02 1.39 0.00 -0.82 -2.16 103.07 104.59 1rm6 h GLY 670 Ca 0.21 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 1rm6 h GLY 670 CO -0.02 0.58 0.55 1.98 0.00 0.00 0.00 176.54 179.62 1rm6 h MET 671 N 0.99 1.26 -0.32 4.80 -1.53 0.18 0.24 114.93 120.56 1rm6 h MET 671 Ca 0.22 -0.12 0.01 0.00 -3.44 0.00 0.00 59.70 56.37 1rm6 h MET 671 Cb 0.25 -0.26 -0.02 0.00 -0.55 0.00 0.00 31.60 31.02 1rm6 h MET 671 CO -0.01 0.89 0.20 0.78 0.14 0.00 0.00 176.91 178.90 1rm6 h GLY 672 N 1.28 0.44 1.29 1.39 0.00 -0.61 -0.81 103.07 106.05 1rm6 h GLY 672 Ca 0.33 -0.15 -0.09 0.00 0.00 0.00 0.00 47.33 47.41 1rm6 h GLY 672 CO -0.06 0.14 -0.08 -1.61 0.00 0.00 0.00 176.54 174.93 1rm6 h GLN 673 N 0.40 0.84 -0.30 4.80 4.15 -1.06 0.69 115.11 124.64 1rm6 h GLN 673 Ca 0.12 -0.27 -0.09 0.00 0.77 0.00 0.00 58.65 59.17 1rm6 h GLN 673 Cb -0.02 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.58 1rm6 h GLN 673 CO -0.04 0.90 -0.21 0.00 -1.93 0.00 0.00 178.83 177.55 1rm6 h ALA 674 N 1.14 1.08 0.00 3.38 0.00 -0.10 -3.36 119.26 121.41 1rm6 h ALA 674 Ca 0.13 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 1rm6 h ALA 674 Cb 0.58 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1rm6 h ALA 674 CO 0.04 0.56 -1.25 1.28 0.00 0.00 0.00 179.25 179.87 1rm6 n LEU 675 N -4.14 0.00 0.00 0.00 4.77 -0.35 0.07 117.00 117.35 1rm6 n LEU 675 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1rm6 n LEU 675 Cb 0.39 0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1rm6 n LEU 675 CO 0.42 0.07 0.00 -1.54 -1.33 0.00 0.00 177.39 175.01 1rm6 n SER 676 N -1.98 0.00 -4.75 -1.43 3.41 -0.28 -3.64 113.62 104.95 1rm6 n SER 676 Ca -0.05 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.17 1rm6 n SER 676 Cb 0.46 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.36 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 4.41 -0.28 4.33 2.02 0.08 -4.31 118.70 124.94 1rm6 s GLU 677 Ca 0.00 0.89 -0.24 0.00 0.02 0.00 0.00 54.97 55.64 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 0.28 0.99 -1.83 0.02 0.00 0.00 175.26 174.72 1rm6 s GLU 678 N 0.04 0.52 0.53 1.61 -1.05 -1.26 -4.49 118.70 114.60 1rm6 s GLU 678 Ca 0.35 0.66 -0.07 0.00 -0.15 0.00 0.00 54.97 55.76 1rm6 s GLU 678 Cb -0.19 0.24 -0.04 0.00 -0.44 0.00 0.00 34.13 33.70 1rm6 s GLU 678 CO 0.20 -0.07 0.88 0.95 0.95 0.00 0.00 175.26 178.16 1rm6 s THR 679 N 0.40 4.84 -0.08 1.83 -4.23 -0.56 -4.84 115.64 113.01 1rm6 s THR 679 Ca 0.01 0.45 -0.03 0.00 -1.18 0.00 0.00 61.69 60.94 1rm6 s THR 679 Cb -0.05 -3.87 0.04 0.00 1.34 0.00 0.00 72.50 69.97 1rm6 s THR 679 CO -0.07 -0.96 0.16 -0.69 -0.54 0.00 0.00 174.62 172.52 1rm6 s VAL 680 N -2.90 -0.14 0.16 2.29 1.01 -1.26 -4.78 120.40 114.78 1rm6 s VAL 680 Ca 0.50 0.25 0.10 0.00 0.00 0.00 0.00 61.98 62.83 1rm6 s VAL 680 Cb -0.11 -0.27 -0.04 0.00 0.00 0.00 0.00 36.38 35.96 1rm6 s VAL 680 CO 0.48 0.10 -0.19 -0.31 0.00 0.00 0.00 175.10 175.18 1rm6 s TYR 681 N 1.64 2.45 -0.26 5.22 1.51 -1.26 -0.84 117.35 125.81 1rm6 s TYR 681 Ca -0.04 -0.30 -0.03 0.00 -1.01 0.00 0.00 57.07 55.69 1rm6 s TYR 681 Cb -0.12 -1.24 0.08 0.00 -0.11 0.00 0.00 41.96 40.58 1rm6 s TYR 681 CO -0.06 0.46 0.09 0.34 -1.11 0.00 0.00 175.55 175.26 1rm6 s ASP 682 N -2.51 3.38 -1.51 2.29 3.68 0.18 -4.84 116.67 117.35 1rm6 s ASP 682 Ca 0.20 -1.19 -0.06 0.00 2.13 0.00 0.00 52.55 53.63 1rm6 s ASP 682 Cb -0.09 -0.56 0.05 0.00 -1.45 0.00 0.00 42.92 40.87 1rm6 s ASP 682 CO 0.11 -0.38 0.51 -3.20 0.13 0.00 0.00 175.17 172.33 1rm6 n ASN 683 N 5.08 -1.20 0.00 -0.34 4.05 -1.26 -0.71 115.26 120.87 1rm6 n ASN 683 Ca -0.06 -1.02 0.00 0.00 0.45 0.00 0.00 54.58 53.95 1rm6 n ASN 683 Cb 0.44 -2.87 0.00 0.00 1.23 0.00 0.00 39.78 38.58 1rm6 n ASN 683 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1rm6 n GLY 684 N -1.85 3.07 3.73 8.20 0.00 -1.26 -4.83 105.19 112.25 1rm6 n GLY 684 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.57 4.58 -0.03 1.61 0.52 0.11 -4.43 118.95 120.74 1rm6 s ARG 685 Ca 0.00 1.25 -0.30 0.00 -0.52 0.00 0.00 55.73 56.16 1rm6 s ARG 685 Cb 0.00 -3.39 -0.03 0.00 0.52 0.00 0.00 34.95 32.05 1rm6 s ARG 685 CO 0.00 0.19 1.09 1.41 0.02 0.00 0.00 175.30 178.01 1rm6 s MET 686 N 0.18 4.44 -0.05 3.54 -2.45 -1.26 -0.65 119.30 123.05 1rm6 s MET 686 Ca 0.44 1.55 0.20 0.00 -1.25 0.00 0.00 55.69 56.62 1rm6 s MET 686 Cb -0.21 -3.49 -0.30 0.00 1.25 0.00 0.00 34.83 32.08 1rm6 s MET 686 CO 0.26 -0.27 0.38 0.28 1.05 0.00 0.00 175.02 176.72 1rm6 n VAL 687 N 4.28 0.21 -0.65 10.11 0.31 -0.02 -4.55 118.33 128.01 1rm6 n VAL 687 Ca 0.09 -0.52 0.07 0.00 -0.01 0.00 0.00 64.34 63.97 1rm6 n VAL 687 Cb 0.48 -0.05 0.36 0.00 -0.91 0.00 0.00 33.84 33.73 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 -2.28 1.74 -0.23 3.52 1.44 -1.25 -4.81 115.22 113.35 1rm6 n HIS 688 Ca -0.08 -0.63 -0.01 0.00 -2.01 0.00 0.00 57.72 54.99 1rm6 n HIS 688 Cb 0.62 -0.39 -0.01 0.00 0.12 0.00 0.00 29.99 30.34 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 0.80 1.40 3.74 -1.39 0.00 -1.26 -3.97 105.19 104.50 1rm6 n GLY 689 Ca 0.25 -0.05 -0.08 0.00 0.00 0.00 0.00 46.02 46.14 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 2.06 -0.29 -0.19 1.61 2.20 -1.26 -4.04 114.94 115.02 1rm6 s ASN 690 Ca 0.03 -0.54 0.11 0.00 -0.94 0.00 0.00 52.86 51.52 1rm6 s ASN 690 Cb 0.01 0.68 0.66 0.00 -2.00 0.00 0.00 41.25 40.60 1rm6 s ASN 690 CO 0.00 -1.24 1.50 -0.38 -2.94 0.00 0.00 177.10 174.03 1rm6 n ILE 691 N -0.43 2.20 -0.12 0.54 5.41 -1.26 -2.10 119.36 123.59 1rm6 n ILE 691 Ca -0.06 -1.11 -0.24 0.00 1.00 0.00 0.00 62.75 62.33 1rm6 n ILE 691 Cb 0.60 -0.32 -0.08 0.00 -0.71 0.00 0.00 39.64 39.13 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 0.51 1.94 0.01 1.39 7.94 -1.26 -4.58 117.00 122.94 1rm6 n LEU 692 Ca 0.22 0.36 0.12 0.00 -1.11 0.00 0.00 56.01 55.60 1rm6 n LEU 692 Cb 1.01 -0.82 0.27 0.00 0.53 0.00 0.00 43.42 44.41 1rm6 n LEU 692 CO 0.26 0.34 0.49 0.47 -1.11 0.00 0.00 177.39 177.84 1rm6 n ASP 693 N -4.32 0.48 -4.36 1.96 8.00 -1.25 -4.31 116.55 112.75 1rm6 n ASP 693 Ca -0.43 -0.11 -0.43 0.00 0.71 0.00 0.00 54.79 54.54 1rm6 n ASP 693 Cb 0.77 0.16 -0.09 0.00 -0.02 0.00 0.00 41.12 41.95 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 -3.03 3.27 -1.33 1.24 5.04 -0.89 -4.88 117.35 116.77 1rm6 s TYR 694 Ca 0.10 -1.09 -0.14 0.00 -2.44 0.00 0.00 57.07 53.51 1rm6 s TYR 694 Cb 0.17 -3.02 0.10 0.00 0.35 0.00 0.00 41.96 39.56 1rm6 s TYR 694 CO 0.69 -0.79 1.88 0.54 -1.34 0.00 0.00 175.55 176.52 1rm6 n ARG 695 N 5.10 3.23 -1.87 4.97 1.74 -1.26 -4.51 116.66 124.07 1rm6 n ARG 695 Ca -0.12 -3.23 -0.42 0.00 -0.77 0.00 0.00 57.85 53.31 1rm6 n ARG 695 Cb 0.44 -3.20 -0.03 0.00 -1.02 0.00 0.00 32.46 28.65 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 2.41 2.40 0.41 1.55 1.01 -1.26 -4.17 120.40 122.75 1rm6 s VAL 696 Ca 0.46 0.30 -0.26 0.00 0.00 0.00 0.00 61.98 62.47 1rm6 s VAL 696 Cb 0.07 -3.19 -0.10 0.00 0.00 0.00 0.00 36.38 33.17 1rm6 s VAL 696 CO -0.01 0.03 1.40 -2.65 0.00 0.00 0.00 175.10 173.87 1rm6 n PRO 697 N 3.56 2.28 -2.45 2.72 -0.02 -1.26 -5.01 135.00 134.83 1rm6 n PRO 697 Ca 0.13 0.81 -0.23 0.00 -2.02 0.00 0.00 63.50 62.18 1rm6 n PRO 697 Cb 0.38 -2.55 0.05 0.00 -0.02 0.00 0.00 33.50 31.36 1rm6 n PRO 697 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1rm6 s THR 698 N -1.16 2.49 0.42 3.45 -4.23 -1.26 -4.97 115.64 110.37 1rm6 s THR 698 Ca 0.58 -0.49 0.36 0.00 -1.18 0.00 0.00 61.69 60.96 1rm6 s THR 698 Cb -0.48 -3.00 0.38 0.00 1.34 0.00 0.00 72.50 70.74 1rm6 s THR 698 CO 0.60 0.00 2.16 -0.29 -0.54 0.00 0.00 174.62 176.55 1rm6 h ILE 699 N -0.23 0.20 -0.17 2.99 2.10 -1.95 -2.89 117.51 117.56 1rm6 h ILE 699 Ca -0.43 -0.32 -0.05 0.00 1.08 0.00 0.00 64.86 65.14 1rm6 h ILE 699 Cb 1.31 1.26 -0.00 0.00 -1.09 0.00 0.00 36.82 38.29 1rm6 h ILE 699 CO 0.56 0.04 -0.09 0.58 -1.08 0.00 0.00 178.15 178.15 1rm6 h VAL 700 N 0.00 1.31 -0.01 2.19 2.07 -2.02 -3.07 116.25 116.72 1rm6 h VAL 700 Ca -0.00 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.37 1rm6 h VAL 700 Cb 0.25 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.73 1rm6 h VAL 700 CO 0.00 0.34 -0.31 -1.84 0.02 0.00 0.00 177.57 175.78 1rm6 n GLU 701 N -4.60 0.73 -2.26 1.57 0.00 -1.20 -4.92 120.64 109.95 1rm6 n GLU 701 Ca -0.05 -0.44 -0.41 0.00 0.00 0.00 0.00 57.16 56.26 1rm6 n GLU 701 Cb 0.31 -1.49 -0.03 0.00 0.00 0.00 0.00 31.44 30.23 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 -2.58 6.96 0.68 -1.84 0.01 -1.10 -4.48 113.70 111.37 1rm6 s SER 702 Ca 0.22 2.47 -0.12 0.00 1.31 0.00 0.00 55.95 59.83 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 0.55 -0.41 1.07 -2.16 0.41 0.00 0.00 173.24 172.70 1rm6 s PRO 703 N -1.18 2.87 0.50 12.44 0.04 -1.25 -4.98 135.00 143.44 1rm6 s PRO 703 Ca 0.50 1.11 -0.19 0.00 0.04 0.00 0.00 61.00 62.46 1rm6 s PRO 703 Cb -0.36 -1.98 -0.08 0.00 0.04 0.00 0.00 34.50 32.12 1rm6 s PRO 703 CO 0.45 -1.16 1.02 0.34 0.04 0.00 0.00 177.00 177.68 1rm6 s ASP 704 N -3.33 6.40 -0.05 6.66 3.68 -0.90 -4.91 116.67 124.21 1rm6 s ASP 704 Ca 0.61 1.80 -0.02 0.00 2.13 0.00 0.00 52.55 57.07 1rm6 s ASP 704 Cb -0.16 -2.54 0.03 0.00 -1.45 0.00 0.00 42.92 38.80 1rm6 s ASP 704 CO 0.49 -0.74 0.04 -0.63 0.13 0.00 0.00 175.17 174.46 1rm6 s ILE 705 N -2.22 0.07 -0.24 4.11 1.01 -1.26 -1.23 121.20 121.43 1rm6 s ILE 705 Ca 0.64 0.32 -0.09 0.00 0.00 0.00 0.00 60.65 61.52 1rm6 s ILE 705 Cb -0.14 -0.29 -0.04 0.00 0.01 0.00 0.00 42.46 42.00 1rm6 s ILE 705 CO 0.24 0.21 0.11 -0.70 0.00 0.00 0.00 174.94 174.80 1rm6 s GLU 706 N 2.09 3.85 -0.15 2.79 2.12 -0.01 -4.98 118.70 124.41 1rm6 s GLU 706 Ca 0.05 -0.38 -0.05 0.00 0.36 0.00 0.00 54.97 54.94 1rm6 s GLU 706 Cb -0.12 -3.41 -0.03 0.00 0.26 0.00 0.00 34.13 30.83 1rm6 s GLU 706 CO -0.04 -0.06 0.02 0.08 -0.54 0.00 0.00 175.26 174.72 1rm6 s VAL 707 N 1.31 4.39 -0.15 3.70 1.01 -1.26 -1.18 120.40 128.23 1rm6 s VAL 707 Ca 0.06 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 61.85 1rm6 s VAL 707 Cb -0.15 -2.94 -0.00 0.00 0.00 0.00 0.00 36.38 33.29 1rm6 s VAL 707 CO 0.05 0.50 -0.15 -0.63 0.00 0.00 0.00 175.10 174.88 1rm6 s ILE 708 N 0.10 2.75 -0.16 2.22 1.01 0.18 -4.98 121.20 122.32 1rm6 s ILE 708 Ca 0.02 -0.75 -0.15 0.00 0.00 0.00 0.00 60.65 59.78 1rm6 s ILE 708 Cb -0.13 -2.16 -0.05 0.00 0.01 0.00 0.00 42.46 40.14 1rm6 s ILE 708 CO 0.02 0.51 0.32 -0.63 0.00 0.00 0.00 174.94 175.16 1rm6 s ILE 709 N 0.77 5.28 -0.10 2.92 1.01 -1.26 -1.09 121.20 128.73 1rm6 s ILE 709 Ca -0.06 0.61 0.01 0.00 0.00 0.00 0.00 60.65 61.21 1rm6 s ILE 709 Cb -0.15 -3.66 -0.02 0.00 0.01 0.00 0.00 42.46 38.63 1rm6 s ILE 709 CO 0.01 0.37 -0.11 -0.69 0.00 0.00 0.00 174.94 174.51 1rm6 s VAL 710 N 0.58 3.28 -0.55 2.92 1.01 0.76 -4.92 120.40 123.47 1rm6 s VAL 710 Ca 0.18 -0.61 0.04 0.00 0.00 0.00 0.00 61.98 61.59 1rm6 s VAL 710 Cb -0.13 -2.35 0.14 0.00 0.00 0.00 0.00 36.38 34.04 1rm6 s VAL 710 CO 0.05 0.55 0.32 -1.61 0.00 0.00 0.00 175.10 174.41 1rm6 s GLU 711 N -0.18 1.99 0.16 2.72 2.02 -1.26 -2.02 118.70 122.12 1rm6 s GLU 711 Ca 0.01 -2.72 0.21 0.00 0.02 0.00 0.00 54.97 52.49 1rm6 s GLU 711 Cb -0.13 -3.18 0.86 0.00 0.10 0.00 0.00 34.13 31.78 1rm6 s GLU 711 CO 0.03 -1.17 1.65 -1.13 0.02 0.00 0.00 175.26 174.66 1rm6 n SER 712 N 2.86 0.43 -2.84 -0.19 3.41 -1.11 -4.86 113.62 111.33 1rm6 n SER 712 Ca 0.10 0.60 -0.07 0.00 -0.26 0.00 0.00 58.87 59.24 1rm6 n SER 712 Cb 0.33 -0.69 0.01 0.00 -0.26 0.00 0.00 64.21 63.60 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 -1.96 -2.64 -2.30 4.33 2.81 0.16 -4.78 117.12 112.74 1rm6 n MET 713 Ca 0.03 2.27 -0.42 0.00 -1.81 0.00 0.00 57.70 57.77 1rm6 n MET 713 Cb 0.23 -5.49 -0.03 0.00 -0.71 0.00 0.00 33.22 27.21 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 -2.34 6.98 0.64 7.83 -1.08 -0.00 -4.91 116.67 123.79 1rm6 s ASP 714 Ca 0.19 2.24 0.42 0.00 -0.52 0.00 0.00 52.55 54.88 1rm6 s ASP 714 Cb -0.05 -2.59 2.19 0.00 -1.46 0.00 0.00 42.92 41.01 1rm6 s ASP 714 CO 0.77 -0.50 2.29 1.55 0.52 0.00 0.00 175.17 179.80 1rm6 h PRO 715 N 6.08 0.00 0.00 4.34 0.13 -1.88 -3.03 132.00 137.64 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 0.80 0.00 -0.65 0.09 -0.23 0.00 0.00 178.00 178.01 1rm6 n ASN 716 N -3.10 0.71 -4.85 1.44 4.13 -1.26 -4.97 115.26 107.36 1rm6 n ASN 716 Ca -0.02 -0.71 -0.30 0.00 1.68 0.00 0.00 54.58 55.22 1rm6 n ASN 716 Cb 0.12 1.05 0.05 0.00 -1.54 0.00 0.00 39.78 39.46 1rm6 n ASN 716 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1rm6 s GLY 717 N -2.24 1.64 -0.20 7.41 0.00 -1.14 -4.95 107.32 107.84 1rm6 s GLY 717 Ca 0.04 -0.16 -0.29 0.00 0.00 0.00 0.00 44.72 44.31 1rm6 s GLY 717 CO 0.49 0.19 1.80 2.56 0.00 0.00 0.00 173.10 178.14 1rm6 s PRO 718 N -5.20 3.67 -1.80 2.90 0.04 -1.26 -1.38 135.00 131.97 1rm6 s PRO 718 Ca 0.58 1.84 0.00 0.00 0.04 0.00 0.00 61.00 63.46 1rm6 s PRO 718 Cb -0.12 -4.13 0.00 0.00 0.04 0.00 0.00 34.50 30.28 1rm6 s PRO 718 CO 0.54 -1.46 0.00 1.19 0.04 0.00 0.00 177.00 177.31 1rm6 n PHE 719 N 9.12 -0.31 -0.29 0.56 3.72 -1.26 -1.38 117.46 127.62 1rm6 n PHE 719 Ca 0.21 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.61 1rm6 n PHE 719 Cb 0.45 -3.13 0.00 0.00 -0.94 0.00 0.00 39.48 35.85 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 -0.41 0.67 3.78 1.37 0.00 -0.48 -4.74 105.19 105.39 1rm6 n GLY 720 Ca -0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.51 2.88 0.26 4.61 0.00 -0.48 -0.82 121.76 125.71 1rm6 s ALA 721 Ca 0.00 0.78 0.01 0.00 0.00 0.00 0.00 51.96 52.75 1rm6 s ALA 721 Cb 0.00 -3.32 -0.01 0.00 0.00 0.00 0.00 23.12 19.79 1rm6 s ALA 721 CO 0.00 -0.53 0.05 1.63 0.00 0.00 0.00 175.76 176.92 1rm6 n LYS 722 N -0.78 0.95 -1.28 0.00 5.02 0.07 -4.02 118.16 118.12 1rm6 n LYS 722 Ca 0.09 -2.08 -0.29 0.00 -2.02 0.00 0.00 58.31 54.01 1rm6 n LYS 722 Cb 0.50 0.89 0.17 0.00 -0.02 0.00 0.00 35.03 36.58 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 -2.98 0.42 -0.04 1.97 4.04 -1.26 -4.76 118.70 116.08 1rm6 s GLU 723 Ca 0.07 0.35 0.16 0.00 0.04 0.00 0.00 54.97 55.59 1rm6 s GLU 723 Cb 0.00 -1.75 0.28 0.00 0.02 0.00 0.00 34.13 32.69 1rm6 s GLU 723 CO 0.05 -2.70 1.13 0.00 -1.84 0.00 0.00 175.26 171.90 1rm6 n ALA 724 N -4.13 2.91 0.00 -0.84 0.00 -1.26 -4.52 120.51 112.68 1rm6 n ALA 724 Ca 0.06 -1.71 0.00 0.00 0.00 0.00 0.00 53.44 51.79 1rm6 n ALA 724 Cb 0.58 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.42 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 0.11 0.17 0.00 0.00 3.41 -1.26 -3.94 113.62 112.10 1rm6 n SER 725 Ca -0.07 -0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 1rm6 n SER 725 Cb 0.95 0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.97 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 -0.09 1.88 0.08 4.33 1.02 -1.26 -4.63 120.64 121.97 1rm6 n GLU 726 Ca 0.00 0.00 0.09 0.00 -0.02 0.00 0.00 57.16 57.23 1rm6 n GLU 726 Cb 0.00 -0.98 0.39 0.00 -0.02 0.00 0.00 31.44 30.84 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 2.61 -1.02 0.35 0.62 0.00 -1.26 -2.74 105.19 103.75 1rm6 n GLY 727 Ca 0.00 0.06 0.10 0.00 0.00 0.00 0.00 46.02 46.18 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 -1.94 1.23 -0.03 1.61 0.00 -1.26 -2.83 117.12 113.90 1rm6 n MET 728 Ca 0.02 -0.73 -0.13 0.00 0.00 0.00 0.00 57.70 56.86 1rm6 n MET 728 Cb 0.15 -1.41 -0.08 0.00 0.00 0.00 0.00 33.22 31.88 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 1.73 0.16 -1.47 3.17 6.46 -1.70 -3.31 115.31 120.35 1rm6 h LEU 729 Ca 0.00 -0.43 -0.04 0.00 -0.12 0.00 0.00 57.88 57.29 1rm6 h LEU 729 Cb 0.63 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.51 1rm6 h LEU 729 CO 0.00 0.56 -0.06 0.00 -0.62 0.00 0.00 178.44 178.32 1rm6 h ALA 730 N 0.61 1.57 0.00 1.25 0.00 -1.82 -2.95 119.26 117.93 1rm6 h ALA 730 Ca 0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1rm6 h ALA 730 Cb 0.50 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1rm6 h ALA 730 CO 0.01 0.31 -0.05 0.78 0.00 0.00 0.00 179.25 180.31 1rm6 h GLY 731 N 0.65 0.00 1.02 0.00 0.00 -1.80 -2.79 103.07 100.15 1rm6 h GLY 731 Ca 0.06 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.35 1rm6 h GLY 731 CO 0.01 0.00 0.30 -2.75 0.00 0.00 0.00 176.54 174.10 1rm6 h PHE 732 N 0.00 1.07 0.33 5.60 3.57 -1.70 -2.33 116.94 123.49 1rm6 h PHE 732 Ca -0.00 -0.07 -0.00 0.00 3.53 0.00 0.00 57.97 61.42 1rm6 h PHE 732 Cb 0.15 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 38.55 1rm6 h PHE 732 CO 0.00 0.82 -0.36 -0.07 -2.23 0.00 0.00 178.31 176.47 1rm6 h LEU 733 N 1.01 -0.98 -1.01 0.59 4.07 -1.71 0.06 115.31 117.34 1rm6 h LEU 733 Ca 0.24 0.09 -0.10 0.00 0.08 0.00 0.00 57.88 58.18 1rm6 h LEU 733 Cb 0.19 0.33 -0.01 0.00 1.08 0.00 0.00 40.66 42.25 1rm6 h LEU 733 CO -0.02 -0.49 -0.43 1.55 -1.08 0.00 0.00 178.44 177.97 1rm6 h PRO 734 N -0.72 0.14 -0.22 1.13 0.13 -1.72 -1.65 132.00 129.09 1rm6 h PRO 734 Ca -0.02 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 65.03 1rm6 h PRO 734 Cb 0.66 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.78 1rm6 h PRO 734 CO -0.08 0.54 0.08 0.00 -0.23 0.00 0.00 178.00 178.31 1rm6 h ALA 735 N 1.45 0.28 0.00 -0.56 0.00 -1.11 -0.92 119.26 118.40 1rm6 h ALA 735 Ca 0.01 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1rm6 h ALA 735 Cb 0.81 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1rm6 h ALA 735 CO 0.06 -0.11 -0.28 0.97 0.00 0.00 0.00 179.25 179.89 1rm6 h ILE 736 N 0.19 0.68 -0.37 0.00 2.10 -0.91 -1.28 117.51 117.91 1rm6 h ILE 736 Ca 0.07 -1.29 -0.00 0.00 1.08 0.00 0.00 64.86 64.72 1rm6 h ILE 736 Cb 0.20 1.84 -0.02 0.00 -1.09 0.00 0.00 36.82 37.75 1rm6 h ILE 736 CO -0.00 0.28 0.23 -0.74 -1.08 0.00 0.00 178.15 176.84 1rm6 h HIS 737 N 0.00 0.49 -0.46 2.19 2.76 -0.88 -0.30 115.15 118.95 1rm6 h HIS 737 Ca -0.00 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.10 1rm6 h HIS 737 Cb 0.82 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.60 1rm6 h HIS 737 CO 0.00 0.34 0.03 1.49 -1.30 0.00 0.00 177.93 178.48 1rm6 h GLU 738 N 0.49 0.79 -0.84 5.26 4.81 -0.76 -2.26 114.58 122.07 1rm6 h GLU 738 Ca 0.14 -0.24 0.05 0.00 -0.13 0.00 0.00 59.36 59.17 1rm6 h GLU 738 Cb -0.02 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.23 1rm6 h GLU 738 CO -0.03 0.83 0.55 0.00 -0.73 0.00 0.00 179.01 179.64 1rm6 h ALA 739 N 0.93 1.52 -0.35 2.92 0.00 -0.85 -0.67 119.26 122.75 1rm6 h ALA 739 Ca 0.13 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 1rm6 h ALA 739 Cb 0.46 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1rm6 h ALA 739 CO 0.02 0.38 -0.29 0.28 0.00 0.00 0.00 179.25 179.64 1rm6 h VAL 740 N 1.01 1.28 -0.39 0.00 2.07 -0.85 -0.05 116.25 119.31 1rm6 h VAL 740 Ca 0.35 -1.42 -0.05 0.00 0.82 0.00 0.00 66.70 66.40 1rm6 h VAL 740 Cb 0.10 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1rm6 h VAL 740 CO -0.11 0.47 0.06 0.22 0.02 0.00 0.00 177.57 178.23 1rm6 h TYR 741 N 0.63 0.69 -0.61 1.57 3.20 -0.75 -0.94 116.97 120.77 1rm6 h TYR 741 Ca 0.08 -0.10 -0.06 0.00 3.14 0.00 0.00 58.73 61.79 1rm6 h TYR 741 Cb 0.80 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.86 1rm6 h TYR 741 CO 0.04 0.69 0.14 1.49 -1.64 0.00 0.00 178.16 178.88 1rm6 h GLU 742 N 0.50 0.95 -0.06 1.82 4.81 -0.99 0.29 114.58 121.90 1rm6 h GLU 742 Ca 0.12 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.13 1rm6 h GLU 742 Cb 0.37 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.61 1rm6 h GLU 742 CO 0.01 0.85 0.00 0.00 -0.73 0.00 0.00 179.01 179.14 1rm6 h ALA 743 N 1.24 0.08 0.00 2.92 0.00 -0.77 -3.41 119.26 119.33 1rm6 h ALA 743 Ca 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1rm6 h ALA 743 Cb 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1rm6 h ALA 743 CO 0.00 -0.25 0.00 1.33 0.00 0.00 0.00 179.25 180.33 1rm6 n VAL 744 N -4.88 0.20 -1.17 0.00 0.24 -0.38 -1.19 118.33 111.16 1rm6 n VAL 744 Ca -0.07 -0.30 -0.06 0.00 -2.04 0.00 0.00 64.34 61.87 1rm6 n VAL 744 Cb 0.18 1.20 -0.02 0.00 -1.47 0.00 0.00 33.84 33.72 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 -0.10 0.82 3.56 7.63 0.00 0.10 -5.02 105.19 112.19 1rm6 n GLY 745 Ca 0.00 -0.79 -0.29 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.21 3.25 -0.41 1.61 -7.23 -1.26 -4.99 120.40 109.16 1rm6 s VAL 746 Ca 0.00 -1.37 -0.12 0.00 -1.81 0.00 0.00 61.98 58.68 1rm6 s VAL 746 Cb 0.00 -2.53 0.05 0.00 0.56 0.00 0.00 36.38 34.46 1rm6 s VAL 746 CO 0.00 0.07 0.26 -0.13 -0.31 0.00 0.00 175.10 175.00 1rm6 s ARG 747 N -2.30 2.79 -0.53 4.82 0.52 -1.26 -3.52 118.95 119.47 1rm6 s ARG 747 Ca 0.21 -1.24 -0.21 0.00 -0.52 0.00 0.00 55.73 53.97 1rm6 s ARG 747 Cb -0.11 -3.84 0.06 0.00 0.52 0.00 0.00 34.95 31.58 1rm6 s ARG 747 CO 0.13 -0.84 0.75 0.00 0.02 0.00 0.00 175.30 175.36 1rm6 s ALA 748 N 1.54 3.30 -1.15 2.13 0.00 -1.26 -4.92 121.76 121.40 1rm6 s ALA 748 Ca 0.03 -1.62 0.26 0.00 0.00 0.00 0.00 51.96 50.62 1rm6 s ALA 748 Cb -0.21 -3.51 0.62 0.00 0.00 0.00 0.00 23.12 20.02 1rm6 s ALA 748 CO 0.06 -2.19 1.49 0.25 0.00 0.00 0.00 175.76 175.36 1rm6 n THR 749 N 5.81 0.00 -4.73 0.00 -2.24 -1.26 -4.83 114.28 107.03 1rm6 n THR 749 Ca -0.04 -0.02 -0.33 0.00 -2.27 0.00 0.00 64.05 61.39 1rm6 n THR 749 Cb 0.46 0.22 -0.15 0.00 -2.10 0.00 0.00 70.33 68.75 1rm6 n THR 749 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1rm6 s ASP 750 N -2.89 3.69 0.04 3.42 1.01 -1.26 -1.48 116.67 119.20 1rm6 s ASP 750 Ca 0.14 -0.43 0.02 0.00 0.71 0.00 0.00 52.55 52.98 1rm6 s ASP 750 Cb 0.18 -1.56 -0.04 0.00 1.01 0.00 0.00 42.92 42.52 1rm6 s ASP 750 CO 0.65 0.12 0.07 -0.36 0.21 0.00 0.00 175.17 175.87 1rm6 s PHE 751 N 0.58 3.22 0.65 4.23 0.40 -0.01 -4.12 117.98 122.92 1rm6 s PHE 751 Ca -0.09 0.13 -0.14 0.00 -0.60 0.00 0.00 56.93 56.22 1rm6 s PHE 751 Cb -0.16 -1.67 -0.01 0.00 0.51 0.00 0.00 43.02 41.69 1rm6 s PHE 751 CO 0.03 0.53 1.07 -1.25 0.70 0.00 0.00 175.22 176.31 1rm6 s PRO 752 N -2.06 3.01 -1.14 0.24 0.04 -1.26 -1.65 135.00 132.18 1rm6 s PRO 752 Ca 0.26 1.20 -0.07 0.00 0.04 0.00 0.00 61.00 62.43 1rm6 s PRO 752 Cb -0.12 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 1rm6 s PRO 752 CO 0.18 -1.06 2.85 1.28 0.04 0.00 0.00 177.00 180.29 1rm6 n LEU 753 N -2.48 7.73 -4.79 -3.56 4.77 0.11 -4.84 117.00 113.94 1rm6 n LEU 753 Ca 0.09 -4.33 -0.30 0.00 -0.03 0.00 0.00 56.01 51.44 1rm6 n LEU 753 Cb 0.53 -1.43 0.10 0.00 -2.33 0.00 0.00 43.42 40.28 1rm6 n LEU 753 CO 0.49 1.98 0.71 -0.94 -1.33 0.00 0.00 177.39 178.30 1rm6 s SER 754 N 1.32 4.39 0.43 -1.43 1.04 -1.24 -4.68 113.70 113.54 1rm6 s SER 754 Ca 0.63 1.34 0.16 0.00 0.48 0.00 0.00 55.95 58.56 1rm6 s SER 754 Cb 0.23 -2.07 1.07 0.00 0.10 0.00 0.00 66.02 65.35 1rm6 s SER 754 CO -0.08 -2.04 1.93 -0.65 0.98 0.00 0.00 173.24 173.38 1rm6 h PRO 755 N -1.13 0.38 -0.59 4.02 0.11 -1.86 -1.36 132.00 131.57 1rm6 h PRO 755 Ca -0.47 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 1rm6 h PRO 755 Cb 1.27 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 1rm6 h PRO 755 CO 0.59 0.25 0.13 0.38 -0.21 0.00 0.00 178.00 179.14 1rm6 h ASP 756 N 0.39 0.90 -0.30 -2.05 2.03 -1.88 0.03 116.42 115.54 1rm6 h ASP 756 Ca 0.36 -0.24 -0.17 0.00 -0.73 0.00 0.00 57.03 56.25 1rm6 h ASP 756 Cb 0.85 -0.24 -0.00 0.00 -0.83 0.00 0.00 39.33 39.11 1rm6 h ASP 756 CO -0.11 0.91 -0.48 0.03 -1.03 0.00 0.00 179.24 178.56 1rm6 h ARG 757 N 0.85 0.88 -0.45 4.15 3.08 -1.60 -2.69 114.38 118.60 1rm6 h ARG 757 Ca 0.18 -0.52 -0.05 0.00 0.07 0.00 0.00 59.98 59.66 1rm6 h ARG 757 Cb 0.37 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 1rm6 h ARG 757 CO 0.00 1.16 0.08 0.82 -1.07 0.00 0.00 179.97 180.96 1rm6 h ILE 758 N 0.70 1.24 -0.44 2.04 1.08 -1.18 -2.46 117.51 118.49 1rm6 h ILE 758 Ca 0.03 -0.89 -0.06 0.00 -0.39 0.00 0.00 64.86 63.56 1rm6 h ILE 758 Cb 1.08 0.95 -0.02 0.00 -3.07 0.00 0.00 36.82 35.76 1rm6 h ILE 758 CO 0.11 0.31 0.04 0.71 -0.69 0.00 0.00 178.15 178.63 1rm6 h THR 759 N 0.61 1.22 -0.68 -0.27 1.35 -0.97 0.02 112.91 114.19 1rm6 h THR 759 Ca 0.14 -0.85 -0.02 0.00 -0.55 0.00 0.00 66.41 65.12 1rm6 h THR 759 Cb 0.38 0.85 -0.03 0.00 -1.73 0.00 0.00 68.15 67.61 1rm6 h THR 759 CO 0.01 0.30 0.34 -0.33 -0.25 0.00 0.00 175.52 175.59 1rm6 h GLU 760 N 0.65 0.97 -0.58 4.72 5.08 -1.27 0.11 114.58 124.26 1rm6 h GLU 760 Ca 0.14 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 1rm6 h GLU 760 Cb 0.35 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 1rm6 h GLU 760 CO 0.01 0.76 -0.00 -0.07 -1.00 0.00 0.00 179.01 178.70 1rm6 h LEU 761 N 0.93 1.01 -0.70 1.33 3.38 -0.90 -1.46 115.31 118.90 1rm6 h LEU 761 Ca 0.23 -0.31 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 1rm6 h LEU 761 Cb 0.10 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1rm6 h LEU 761 CO -0.03 1.07 0.01 -0.07 0.09 0.00 0.00 178.44 179.51 1rm6 h LEU 762 N 0.92 0.98 -0.79 1.67 3.38 -0.74 -0.56 115.31 120.17 1rm6 h LEU 762 Ca 0.16 -0.27 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 1rm6 h LEU 762 Cb 0.56 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1rm6 h LEU 762 CO 0.03 1.03 -0.15 0.44 0.09 0.00 0.00 178.44 179.88 1rm6 h ASP 763 N 0.93 0.75 -0.42 -0.43 3.32 -0.78 -1.63 116.42 118.15 1rm6 h ASP 763 Ca 0.17 -0.24 -0.14 0.00 0.02 0.00 0.00 57.03 56.84 1rm6 h ASP 763 Cb 0.53 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 1rm6 h ASP 763 CO 0.03 0.91 -0.28 0.00 -1.72 0.00 0.00 179.24 178.18 1rm6 h ALA 764 N 1.16 0.61 0.21 3.45 0.00 -1.10 -0.33 119.26 123.25 1rm6 h ALA 764 Ca 0.11 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1rm6 h ALA 764 Cb 0.63 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1rm6 h ALA 764 CO 0.04 0.64 -0.19 -0.22 0.00 0.00 0.00 179.25 179.52 1rm6 h LYS 765 N 0.77 -0.40 -0.87 0.00 3.64 -0.81 -1.14 116.57 117.76 1rm6 h LYS 765 Ca 0.09 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.47 1rm6 h LYS 765 Cb 0.86 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.73 1rm6 h LYS 765 CO 0.08 -0.27 0.44 0.93 -2.27 0.00 0.00 179.45 178.35 1rm6 h GLU 766 N -0.42 1.23 -0.83 1.90 3.07 -1.28 -2.49 114.58 115.76 1rm6 h GLU 766 Ca -0.00 -0.17 0.03 0.00 -0.50 0.00 0.00 59.36 58.72 1rm6 h GLU 766 Cb 0.39 -0.23 -0.05 0.00 -0.84 0.00 0.00 28.75 28.02 1rm6 h GLU 766 CO -0.03 0.93 0.53 0.00 -1.40 0.00 0.00 179.01 179.04 1rm6 h ALA 767 N 1.25 1.09 0.00 3.43 0.00 -0.70 -3.51 119.26 120.82 1rm6 h ALA 767 Ca 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1rm6 h ALA 767 Cb 0.09 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1rm6 h ALA 767 CO -0.04 0.36 0.00 0.00 0.00 0.00 0.00 179.25 179.56