#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x1q s THR 17 N 0.00 2.22 0.38 1.47 -4.23 -1.26 -4.74 115.64 109.48 1x1q s THR 17 Ca 0.00 -0.49 0.01 0.00 -1.18 0.00 0.00 61.69 60.03 1x1q s THR 17 Cb 0.00 -2.73 -0.02 0.00 1.34 0.00 0.00 72.50 71.09 1x1q s THR 17 CO 0.00 0.00 0.58 -0.76 -0.54 0.00 0.00 174.62 173.90 1x1q s LEU 18 N -5.19 3.90 0.45 4.79 1.43 -1.26 -5.08 118.68 117.72 1x1q s LEU 18 Ca 0.65 0.36 -0.21 0.00 -1.03 0.00 0.00 54.13 53.90 1x1q s LEU 18 Cb -0.07 -3.23 -0.10 0.00 0.03 0.00 0.00 46.19 42.82 1x1q s LEU 18 CO 0.45 -0.42 1.00 -2.16 0.23 0.00 0.00 176.35 175.44 1x1q s PRO 19 N -4.38 4.02 -0.56 1.29 0.04 -1.26 -5.01 135.00 129.14 1x1q s PRO 19 Ca 0.43 1.26 0.07 0.00 0.04 0.00 0.00 61.00 62.79 1x1q s PRO 19 Cb -0.10 -2.16 0.29 0.00 0.04 0.00 0.00 34.50 32.57 1x1q s PRO 19 CO 0.36 -0.23 0.77 -3.47 0.04 0.00 0.00 177.00 174.48 1x1q n ASP 20 N -0.76 3.17 -4.77 6.66 2.03 -1.26 -5.04 116.55 116.58 1x1q n ASP 20 Ca 0.08 -3.37 -0.37 0.00 0.52 0.00 0.00 54.79 51.66 1x1q n ASP 20 Cb 0.53 -0.63 -0.01 0.00 -0.72 0.00 0.00 41.12 40.29 1x1q n ASP 20 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1x1q s PHE 21 N -2.58 2.91 0.59 -0.67 0.08 -1.26 -4.94 117.98 112.10 1x1q s PHE 21 Ca 0.42 1.55 0.30 0.00 0.12 0.00 0.00 56.93 59.32 1x1q s PHE 21 Cb 0.21 -3.32 1.84 0.00 -0.57 0.00 0.00 43.02 41.17 1x1q s PHE 21 CO -0.07 -1.37 2.26 -1.00 -0.10 0.00 0.00 175.22 174.94 1x1q h PRO 22 N 2.00 0.00 -6.81 0.24 0.13 -1.98 -3.42 132.00 122.15 1x1q h PRO 22 Ca -0.49 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 63.96 1x1q h PRO 22 Cb 1.24 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.16 1x1q h PRO 22 CO 0.60 0.00 -0.86 -0.51 -0.23 0.00 0.00 178.00 177.01 1x1q s LEU 23 N -7.63 2.36 0.00 1.56 1.43 -1.26 -4.52 118.68 110.62 1x1q s LEU 23 Ca -0.05 -0.79 -0.11 0.00 -1.03 0.00 0.00 54.13 52.15 1x1q s LEU 23 Cb 0.15 -1.20 0.16 0.00 0.03 0.00 0.00 46.19 45.33 1x1q s LEU 23 CO 0.54 0.16 0.96 -0.81 0.23 0.00 0.00 176.35 177.43 1x1q n PRO 24 N 0.70 -0.83 -2.10 1.29 -0.04 -1.26 -5.11 135.00 127.65 1x1q n PRO 24 Ca -0.16 -1.60 -0.26 0.00 -0.04 0.00 0.00 63.50 61.44 1x1q n PRO 24 Cb 0.54 -0.95 0.17 0.00 -0.04 0.00 0.00 33.50 33.22 1x1q n PRO 24 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1x1q n ASP 25 N -3.55 0.55 -0.29 3.54 3.85 -0.84 -4.84 116.55 114.96 1x1q n ASP 25 Ca 0.12 -1.71 0.27 0.00 -0.71 0.00 0.00 54.79 52.77 1x1q n ASP 25 Cb 0.43 -0.86 0.62 0.00 -1.35 0.00 0.00 41.12 39.96 1x1q n ASP 25 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1x1q h ALA 26 N -1.37 2.61 0.00 2.12 0.00 -1.95 0.69 119.26 121.36 1x1q h ALA 26 Ca -0.39 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1x1q h ALA 26 Cb 1.17 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1x1q h ALA 26 CO 0.32 -0.95 -0.23 0.54 0.00 0.00 0.00 179.25 178.92 1x1q n ARG 27 N -4.42 0.21 -0.53 0.00 1.74 -1.26 -4.94 116.66 107.46 1x1q n ARG 27 Ca 0.23 0.12 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 1x1q n ARG 27 Cb 0.98 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 30.73 1x1q n ARG 27 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1x1q n GLY 28 N 1.36 1.47 3.51 -0.13 0.00 0.23 -4.84 105.19 106.81 1x1q n GLY 28 Ca 0.05 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 1x1q n GLY 28 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x1q s ARG 29 N -1.67 2.79 -0.73 1.61 1.81 -1.26 -4.52 118.95 116.98 1x1q s ARG 29 Ca 0.00 -0.62 -0.03 0.00 -1.72 0.00 0.00 55.73 53.36 1x1q s ARG 29 Cb 0.00 -2.53 0.19 0.00 -0.45 0.00 0.00 34.95 32.15 1x1q s ARG 29 CO 0.00 0.57 0.58 -0.06 -0.68 0.00 0.00 175.30 175.71 1x1q s PHE 30 N -0.57 3.59 0.00 -0.53 0.40 0.16 -1.99 117.98 119.03 1x1q s PHE 30 Ca 0.08 -2.79 0.00 0.00 -0.60 0.00 0.00 56.93 53.62 1x1q s PHE 30 Cb -0.12 -3.24 0.00 0.00 0.51 0.00 0.00 43.02 40.17 1x1q s PHE 30 CO 0.02 -0.81 0.00 0.41 0.70 0.00 0.00 175.22 175.54 1x1q n GLY 31 N 3.09 1.87 0.34 4.36 0.00 -1.26 -1.89 105.19 111.70 1x1q n GLY 31 Ca 0.13 -0.47 0.05 0.00 0.00 0.00 0.00 46.02 45.73 1x1q n GLY 31 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x1q n PRO 32 N 12.99 1.42 -4.10 1.61 -0.04 -1.26 -4.88 135.00 140.75 1x1q n PRO 32 Ca 0.00 -0.66 -0.26 0.00 -0.04 0.00 0.00 63.50 62.54 1x1q n PRO 32 Cb 0.00 -1.19 -0.06 0.00 -0.04 0.00 0.00 33.50 32.21 1x1q n PRO 32 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1x1q s TYR 33 N -1.78 3.11 0.00 0.54 1.51 -0.79 -4.70 117.35 115.24 1x1q s TYR 33 Ca 0.17 -0.04 0.00 0.00 -1.01 0.00 0.00 57.07 56.19 1x1q s TYR 33 Cb 0.09 -1.49 0.00 0.00 -0.11 0.00 0.00 41.96 40.45 1x1q s TYR 33 CO 0.12 0.52 0.00 0.41 -1.11 0.00 0.00 175.55 175.49 1x1q n GLY 34 N -0.37 2.73 3.61 0.71 0.00 -1.26 0.38 105.19 110.97 1x1q n GLY 34 Ca -0.08 -0.95 -0.51 0.00 0.00 0.00 0.00 46.02 44.47 1x1q n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x1q n GLY 35 N 0.00 0.61 3.09 -0.02 0.00 -1.26 -4.68 105.19 102.93 1x1q n GLY 35 Ca 0.00 0.70 -0.14 0.00 0.00 0.00 0.00 46.02 46.58 1x1q n GLY 35 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1x1q s ARG 36 N 0.66 0.61 -0.58 1.61 6.06 -1.26 -5.08 118.95 120.96 1x1q s ARG 36 Ca 0.84 -0.85 -0.23 0.00 -2.50 0.00 0.00 55.73 52.99 1x1q s ARG 36 Cb -0.90 -0.39 0.05 0.00 0.06 0.00 0.00 34.95 33.77 1x1q s ARG 36 CO 0.46 0.07 0.91 -0.47 -2.50 0.00 0.00 175.30 173.76 1x1q s TYR 37 N -1.55 2.78 -0.22 5.12 6.14 -1.26 -5.00 117.35 123.36 1x1q s TYR 37 Ca -0.06 -0.28 -0.04 0.00 0.64 0.00 0.00 57.07 57.32 1x1q s TYR 37 Cb -0.09 -4.08 -0.01 0.00 0.42 0.00 0.00 41.96 38.20 1x1q s TYR 37 CO 0.00 -1.42 -0.02 0.08 0.64 0.00 0.00 175.55 174.83 1x1q s VAL 38 N 3.81 3.56 0.52 3.14 1.01 -1.26 -5.09 120.40 126.09 1x1q s VAL 38 Ca 0.25 -0.43 -0.21 0.00 0.00 0.00 0.00 61.98 61.59 1x1q s VAL 38 Cb -0.15 -2.63 -0.07 0.00 0.00 0.00 0.00 36.38 33.53 1x1q s VAL 38 CO 0.15 0.41 1.00 -0.81 0.00 0.00 0.00 175.10 175.85 1x1q n PRO 39 N 4.74 1.17 -0.36 2.72 -0.04 -1.26 -4.76 135.00 137.22 1x1q n PRO 39 Ca -0.18 0.43 0.26 0.00 -0.04 0.00 0.00 63.50 63.97 1x1q n PRO 39 Cb 0.51 -2.14 0.51 0.00 -0.04 0.00 0.00 33.50 32.35 1x1q n PRO 39 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1x1q h GLU 40 N 1.04 0.32 0.00 0.54 5.08 -2.02 0.79 114.58 120.33 1x1q h GLU 40 Ca -0.47 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 1x1q h GLU 40 Cb 1.35 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1x1q h GLU 40 CO 0.54 0.21 0.00 0.25 -1.00 0.00 0.00 179.01 179.01 1x1q n THR 41 N -4.81 0.22 -0.04 1.13 -2.24 -1.26 -3.09 114.28 104.19 1x1q n THR 41 Ca 0.30 0.05 0.01 0.00 -2.27 0.00 0.00 64.05 62.15 1x1q n THR 41 Cb 1.02 -0.67 -0.13 0.00 -2.10 0.00 0.00 70.33 68.46 1x1q n THR 41 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1x1q n LEU 42 N -1.23 0.00 -0.25 3.22 0.00 0.26 -4.60 117.00 114.39 1x1q n LEU 42 Ca 0.12 0.00 0.05 0.00 0.00 0.00 0.00 56.01 56.18 1x1q n LEU 42 Cb 0.17 0.17 0.18 0.00 0.00 0.00 0.00 43.42 43.94 1x1q n LEU 42 CO 0.17 0.17 1.01 0.40 0.00 0.00 0.00 177.39 179.14 1x1q h ILE 43 N 0.00 0.65 -0.02 1.96 2.04 -1.46 -1.98 117.51 118.70 1x1q h ILE 43 Ca -0.19 -0.14 -0.07 0.00 1.00 0.00 0.00 64.86 65.45 1x1q h ILE 43 Cb 1.30 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 1x1q h ILE 43 CO 0.01 0.08 -0.33 1.55 0.00 0.00 0.00 178.15 179.46 1x1q h PRO 44 N 0.42 0.04 -0.10 2.37 0.13 -1.81 -2.10 132.00 130.95 1x1q h PRO 44 Ca 0.41 -0.01 -0.17 0.00 -0.87 0.00 0.00 66.00 65.35 1x1q h PRO 44 Cb 0.62 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.74 1x1q h PRO 44 CO -0.41 0.37 -0.65 0.00 -0.23 0.00 0.00 178.00 177.08 1x1q h ALA 45 N 1.63 0.68 0.00 -0.56 0.00 -1.66 -2.66 119.26 116.69 1x1q h ALA 45 Ca 0.00 -0.57 -0.13 0.00 0.00 0.00 0.00 54.91 54.22 1x1q h ALA 45 Cb 0.61 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1x1q h ALA 45 CO 0.04 0.73 -0.62 -0.07 0.00 0.00 0.00 179.25 179.34 1x1q h LEU 46 N 0.30 0.00 -0.12 0.00 3.38 -1.26 -2.16 115.31 115.45 1x1q h LEU 46 Ca -0.02 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.72 1x1q h LEU 46 Cb 1.20 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.97 1x1q h LEU 46 CO 0.11 0.62 -0.87 -0.33 0.09 0.00 0.00 178.44 178.06 1x1q h GLU 47 N 0.00 0.73 -0.46 1.13 5.08 -1.33 -2.31 114.58 117.42 1x1q h GLU 47 Ca -0.01 -0.67 -0.07 0.00 -1.00 0.00 0.00 59.36 57.62 1x1q h GLU 47 Cb 1.16 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.55 1x1q h GLU 47 CO 0.08 1.26 0.02 0.93 -1.00 0.00 0.00 179.01 180.30 1x1q h GLU 48 N 0.47 0.80 -0.93 2.33 4.39 -1.45 -1.85 114.58 118.34 1x1q h GLU 48 Ca -0.08 -0.25 0.03 0.00 0.34 0.00 0.00 59.36 59.41 1x1q h GLU 48 Cb 1.51 -0.08 -0.05 0.00 -0.10 0.00 0.00 28.75 30.03 1x1q h GLU 48 CO 0.17 0.85 0.60 1.25 -1.16 0.00 0.00 179.01 180.72 1x1q h LEU 49 N 0.65 1.01 -0.24 1.33 5.85 -1.38 -0.41 115.31 122.13 1x1q h LEU 49 Ca 0.13 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1x1q h LEU 49 Cb 0.47 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1x1q h LEU 49 CO 0.02 0.70 0.10 -0.08 -0.34 0.00 0.00 178.44 178.84 1x1q h GLU 50 N 1.18 0.35 0.00 1.25 4.81 -1.09 -1.07 114.58 120.01 1x1q h GLU 50 Ca 0.36 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.56 1x1q h GLU 50 Cb -0.02 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1x1q h GLU 50 CO -0.11 0.38 -0.11 0.00 -0.73 0.00 0.00 179.01 178.43 1x1q h ALA 51 N 0.95 -0.13 -0.10 2.92 0.00 -0.69 0.60 119.26 122.82 1x1q h ALA 51 Ca 0.08 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1x1q h ALA 51 Cb 0.15 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1x1q h ALA 51 CO -0.01 -0.61 0.05 0.00 0.00 0.00 0.00 179.25 178.69 1x1q h ALA 52 N 0.77 0.12 -0.29 0.00 0.00 -1.05 -1.73 119.26 117.08 1x1q h ALA 52 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1x1q h ALA 52 Cb 0.25 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1x1q h ALA 52 CO -0.11 -0.40 0.19 -0.92 0.00 0.00 0.00 179.25 178.00 1x1q h TYR 53 N 0.11 0.37 -0.88 0.00 5.03 -0.95 0.14 116.97 120.79 1x1q h TYR 53 Ca 0.04 0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.38 1x1q h TYR 53 Cb 0.00 -0.12 -0.05 0.00 1.55 0.00 0.00 36.73 38.11 1x1q h TYR 53 CO -0.08 0.25 0.57 -0.09 -1.32 0.00 0.00 178.16 177.49 1x1q h ARG 54 N 0.38 1.09 -0.23 1.82 9.65 -0.78 -1.90 114.38 124.42 1x1q h ARG 54 Ca 0.11 -0.07 -0.13 0.00 -1.10 0.00 0.00 59.98 58.79 1x1q h ARG 54 Cb -0.02 -0.25 -0.01 0.00 -1.39 0.00 0.00 29.97 28.30 1x1q h ARG 54 CO -0.02 0.72 -0.39 1.49 2.80 0.00 0.00 179.97 184.57 1x1q h GLU 55 N 1.12 0.53 -0.55 0.20 4.57 -0.86 -3.24 114.58 116.35 1x1q h GLU 55 Ca 0.35 -0.26 -0.05 0.00 -1.18 0.00 0.00 59.36 58.21 1x1q h GLU 55 Cb -0.02 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 1x1q h GLU 55 CO -0.11 0.84 0.14 0.00 -1.18 0.00 0.00 179.01 178.70 1x1q h ALA 56 N 1.13 0.73 0.00 2.92 0.00 0.05 -2.86 119.26 121.23 1x1q h ALA 56 Ca 0.04 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1x1q h ALA 56 Cb 0.88 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1x1q h ALA 56 CO 0.07 0.42 0.00 0.36 0.00 0.00 0.00 179.25 180.10 1x1q n LYS 57 N -4.41 0.49 0.03 0.00 2.85 -0.90 -1.39 118.16 114.82 1x1q n LYS 57 Ca 0.02 0.00 0.11 0.00 -1.05 0.00 0.00 58.31 57.40 1x1q n LYS 57 Cb 0.23 -1.50 -0.10 0.00 -0.65 0.00 0.00 35.03 33.01 1x1q n LYS 57 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1x1q n LYS 58 N -1.01 0.57 -3.04 -1.58 5.02 -1.08 -4.76 118.16 112.28 1x1q n LYS 58 Ca 0.12 -0.08 -0.43 0.00 -2.02 0.00 0.00 58.31 55.91 1x1q n LYS 58 Cb 0.06 -1.62 -0.06 0.00 -0.02 0.00 0.00 35.03 33.39 1x1q n LYS 58 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1x1q s ASP 59 N -4.63 6.41 0.26 4.39 3.68 -0.49 -4.96 116.67 121.33 1x1q s ASP 59 Ca -0.04 -0.04 -0.03 0.00 2.13 0.00 0.00 52.55 54.58 1x1q s ASP 59 Cb 0.13 -2.35 0.52 0.00 -1.45 0.00 0.00 42.92 39.77 1x1q s ASP 59 CO 0.86 -0.76 1.70 -0.65 0.13 0.00 0.00 175.17 176.45 1x1q h PRO 60 N 8.74 0.36 -0.43 4.34 0.11 -1.90 0.17 132.00 143.38 1x1q h PRO 60 Ca -0.25 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 65.92 1x1q h PRO 60 Cb 1.10 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 1x1q h PRO 60 CO 0.90 0.24 0.30 0.00 -0.21 0.00 0.00 178.00 179.22 1x1q h ALA 61 N 1.61 2.13 -0.03 -0.75 0.00 -1.94 0.16 119.26 120.44 1x1q h ALA 61 Ca 0.45 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.22 1x1q h ALA 61 Cb 0.76 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.52 1x1q h ALA 61 CO -0.47 -0.23 -0.49 0.35 0.00 0.00 0.00 179.25 178.41 1x1q h PHE 62 N 0.21 0.56 -0.64 0.00 3.04 -0.96 -2.73 116.94 116.42 1x1q h PHE 62 Ca 0.20 -0.28 -0.02 0.00 3.98 0.00 0.00 57.97 61.85 1x1q h PHE 62 Cb 0.51 -0.07 -0.03 0.00 2.56 0.00 0.00 35.95 38.92 1x1q h PHE 62 CO -0.00 1.07 0.33 -0.07 -2.02 0.00 0.00 178.31 177.62 1x1q h LEU 63 N -0.11 0.80 -0.10 0.59 3.38 -1.00 -2.38 115.31 116.48 1x1q h LEU 63 Ca -0.05 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 1x1q h LEU 63 Cb 1.18 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.72 1x1q h LEU 63 CO 0.10 0.67 0.05 -0.08 0.09 0.00 0.00 178.44 179.27 1x1q h GLU 64 N 0.90 0.14 -0.50 1.13 4.81 -0.99 -1.67 114.58 118.40 1x1q h GLU 64 Ca 0.22 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.34 1x1q h GLU 64 Cb 0.06 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 1x1q h GLU 64 CO -0.03 0.20 -0.07 0.93 -0.73 0.00 0.00 179.01 179.31 1x1q h GLU 65 N 0.05 0.90 0.19 1.92 5.08 -1.30 -0.66 114.58 120.76 1x1q h GLU 65 Ca 0.04 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 1x1q h GLU 65 Cb 0.10 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1x1q h GLU 65 CO -0.00 0.93 -0.09 1.25 -1.00 0.00 0.00 179.01 180.09 1x1q h LEU 66 N 0.81 -0.22 -0.33 1.33 5.85 -1.35 -1.31 115.31 120.10 1x1q h LEU 66 Ca 0.14 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1x1q h LEU 66 Cb 0.58 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 1x1q h LEU 66 CO 0.04 -0.12 0.18 -0.78 -0.34 0.00 0.00 178.44 177.42 1x1q h ASP 67 N -0.30 0.41 -0.38 1.25 1.82 -1.22 0.29 116.42 118.29 1x1q h ASP 67 Ca -0.03 -0.08 0.08 0.00 -0.39 0.00 0.00 57.03 56.61 1x1q h ASP 67 Cb 0.23 -0.10 -0.07 0.00 0.68 0.00 0.00 39.33 40.07 1x1q h ASP 67 CO 0.04 0.37 -0.12 -0.74 -1.61 0.00 0.00 179.24 177.19 1x1q h HIS 68 N 0.41 -0.26 -0.29 0.28 2.76 -1.00 0.63 115.15 117.68 1x1q h HIS 68 Ca 0.12 0.04 -0.17 0.00 -2.20 0.00 0.00 60.37 58.15 1x1q h HIS 68 Cb 0.05 0.17 -0.00 0.00 1.55 0.00 0.00 27.41 29.18 1x1q h HIS 68 CO -0.03 -0.19 -0.48 1.88 -1.30 0.00 0.00 177.93 177.81 1x1q h TYR 69 N -0.03 0.99 -0.87 5.26 0.05 -1.00 0.15 116.97 121.51 1x1q h TYR 69 Ca 0.18 -0.33 0.01 0.00 0.05 0.00 0.00 58.73 58.64 1x1q h TYR 69 Cb 0.31 -0.20 -0.04 0.00 1.01 0.00 0.00 36.73 37.81 1x1q h TYR 69 CO -0.36 1.13 0.58 -0.07 -1.05 0.00 0.00 178.16 178.39 1x1q h LEU 70 N 0.63 1.00 0.01 3.88 3.38 0.07 0.98 115.31 125.26 1x1q h LEU 70 Ca 0.03 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1x1q h LEU 70 Cb 1.07 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1x1q h LEU 70 CO 0.11 0.72 -0.01 0.03 0.09 0.00 0.00 178.44 179.38 1x1q h ARG 71 N 1.18 -0.02 0.00 1.13 3.08 -0.71 0.13 114.38 119.18 1x1q h ARG 71 Ca 0.32 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.30 1x1q h ARG 71 Cb -0.13 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 1x1q h ARG 71 CO -0.07 0.13 -0.34 1.96 -1.07 0.00 0.00 179.97 180.58 1x1q h GLN 72 N -1.00 0.00 0.00 0.04 1.08 -0.75 -2.25 115.11 112.23 1x1q h GLN 72 Ca -0.00 0.00 -0.26 0.00 -1.45 0.00 0.00 58.65 56.94 1x1q h GLN 72 Cb 0.15 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.54 1x1q h GLN 72 CO 0.00 0.34 -1.79 0.34 -0.95 0.00 0.00 178.83 176.77 1x1q n PHE 73 N -3.34 0.00 0.09 2.96 7.35 0.24 -4.66 117.46 120.09 1x1q n PHE 73 Ca 0.01 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.62 1x1q n PHE 73 Cb 0.56 -0.69 -0.01 0.00 0.35 0.00 0.00 39.48 39.68 1x1q n PHE 73 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1x1q h ALA 74 N -0.84 0.51 0.00 3.13 0.00 -1.25 -3.42 119.26 117.40 1x1q h ALA 74 Ca -0.39 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 53.78 1x1q h ALA 74 Cb 1.28 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1x1q h ALA 74 CO -0.23 0.94 0.00 0.41 0.00 0.00 0.00 179.25 180.37 1x1q n GLY 75 N 0.91 1.11 3.80 0.00 0.00 -0.51 -1.30 105.19 109.20 1x1q n GLY 75 Ca -0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 1x1q n GLY 75 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x1q s ARG 76 N -0.34 3.39 0.42 1.61 0.52 0.35 -4.39 118.95 120.50 1x1q s ARG 76 Ca 0.00 1.25 -0.21 0.00 -0.52 0.00 0.00 55.73 56.24 1x1q s ARG 76 Cb 0.00 -2.04 -0.11 0.00 0.52 0.00 0.00 34.95 33.32 1x1q s ARG 76 CO 0.00 -0.76 0.96 -1.25 0.02 0.00 0.00 175.30 174.27 1x1q s PRO 77 N -3.92 4.23 0.18 3.54 0.04 -1.26 -4.22 135.00 133.60 1x1q s PRO 77 Ca 0.65 1.16 -0.15 0.00 0.04 0.00 0.00 61.00 62.70 1x1q s PRO 77 Cb -0.16 -2.23 -0.07 0.00 0.04 0.00 0.00 34.50 32.07 1x1q s PRO 77 CO 0.34 -0.04 0.61 0.95 0.04 0.00 0.00 177.00 178.90 1x1q s THR 78 N -2.11 4.78 0.46 1.26 -4.23 -1.26 -5.05 115.64 109.50 1x1q s THR 78 Ca 0.61 0.92 -0.24 0.00 -1.18 0.00 0.00 61.69 61.80 1x1q s THR 78 Cb -0.11 -3.75 -0.07 0.00 1.34 0.00 0.00 72.50 69.92 1x1q s THR 78 CO 0.15 0.18 1.24 -2.16 -0.54 0.00 0.00 174.62 173.49 1x1q s PRO 79 N -2.11 3.69 -0.69 3.99 0.04 -1.26 -4.76 135.00 133.89 1x1q s PRO 79 Ca 0.41 1.98 -0.15 0.00 0.04 0.00 0.00 61.00 63.28 1x1q s PRO 79 Cb -0.15 -2.48 0.18 0.00 0.04 0.00 0.00 34.50 32.09 1x1q s PRO 79 CO 0.20 -0.67 0.64 -1.17 0.04 0.00 0.00 177.00 176.04 1x1q s LEU 80 N -2.96 6.49 0.08 -3.56 2.96 -1.26 -1.43 118.68 119.00 1x1q s LEU 80 Ca 0.63 -2.26 -0.25 0.00 -0.22 0.00 0.00 54.13 52.03 1x1q s LEU 80 Cb -0.34 -2.21 -0.06 0.00 0.50 0.00 0.00 46.19 44.08 1x1q s LEU 80 CO 0.41 -0.71 0.77 -0.47 -1.32 0.00 0.00 176.35 175.04 1x1q s TYR 81 N 0.85 3.78 -0.40 5.38 5.04 -0.19 -4.81 117.35 127.00 1x1q s TYR 81 Ca 0.11 1.52 -0.22 0.00 -2.44 0.00 0.00 57.07 56.04 1x1q s TYR 81 Cb -0.20 -2.81 0.01 0.00 0.35 0.00 0.00 41.96 39.32 1x1q s TYR 81 CO -0.03 0.34 0.70 -1.58 -1.34 0.00 0.00 175.55 173.63 1x1q s HIS 82 N -0.35 3.09 -1.19 4.97 5.65 -1.26 0.10 115.29 126.30 1x1q s HIS 82 Ca 0.38 0.25 -0.16 0.00 0.25 0.00 0.00 55.06 55.78 1x1q s HIS 82 Cb -0.21 -3.35 0.14 0.00 -1.18 0.00 0.00 32.58 27.98 1x1q s HIS 82 CO 0.24 -0.78 1.46 0.00 -0.65 0.00 0.00 174.74 175.01 1x1q s ALA 83 N 2.93 3.73 0.08 1.58 0.00 0.35 -4.87 121.76 125.57 1x1q s ALA 83 Ca 0.26 -3.15 -0.30 0.00 0.00 0.00 0.00 51.96 48.77 1x1q s ALA 83 Cb -0.14 -4.24 -0.17 0.00 0.00 0.00 0.00 23.12 18.58 1x1q s ALA 83 CO 0.18 -2.94 1.66 0.87 0.00 0.00 0.00 175.76 175.52 1x1q h LYS 84 N 7.55 -0.61 -0.39 0.00 1.57 -1.93 0.64 116.57 123.40 1x1q h LYS 84 Ca 0.32 0.04 0.02 0.00 -1.87 0.00 0.00 60.65 59.16 1x1q h LYS 84 Cb 0.90 0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 1x1q h LYS 84 CO 1.28 -0.40 0.26 0.00 -0.57 0.00 0.00 179.45 180.01 1x1q h ARG 85 N -0.63 0.43 0.00 3.15 3.08 -1.90 -0.32 114.38 118.19 1x1q h ARG 85 Ca -0.05 -0.03 -0.16 0.00 0.07 0.00 0.00 59.98 59.81 1x1q h ARG 85 Cb 0.50 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 1x1q h ARG 85 CO 0.08 0.28 -0.85 1.25 -1.07 0.00 0.00 179.97 179.66 1x1q h LEU 86 N 0.44 0.00 -0.56 3.04 5.85 -1.78 -1.62 115.31 120.68 1x1q h LEU 86 Ca 0.15 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.72 1x1q h LEU 86 Cb 0.07 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1x1q h LEU 86 CO -0.04 0.70 -0.70 0.28 -0.34 0.00 0.00 178.44 178.34 1x1q h SER 87 N 0.00 0.14 0.29 1.25 0.02 -0.07 -2.58 113.55 112.60 1x1q h SER 87 Ca -0.04 -0.09 -0.22 0.00 -0.84 0.00 0.00 61.79 60.59 1x1q h SER 87 Cb 1.57 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 64.07 1x1q h SER 87 CO 0.08 0.79 -0.91 -0.08 -1.14 0.00 0.00 176.83 175.58 1x1q h GLU 88 N 0.08 0.44 0.04 3.45 4.81 -1.07 -2.74 114.58 119.59 1x1q h GLU 88 Ca -0.01 -0.45 -0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1x1q h GLU 88 Cb 1.25 0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.75 1x1q h GLU 88 CO 0.10 1.11 -0.02 -0.92 -0.73 0.00 0.00 179.01 178.55 1x1q h TYR 89 N 0.26 -0.05 0.00 0.92 5.03 -1.19 -2.86 116.97 119.09 1x1q h TYR 89 Ca -0.07 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.23 1x1q h TYR 89 Cb 1.54 0.02 0.00 0.00 1.55 0.00 0.00 36.73 39.84 1x1q h TYR 89 CO 0.06 0.18 0.00 0.91 -1.32 0.00 0.00 178.16 177.99 1x1q n TRP 90 N -5.01 0.90 -0.20 -3.82 8.01 -0.98 -4.89 117.44 111.45 1x1q n TRP 90 Ca -0.08 0.32 0.00 0.00 -1.31 0.00 0.00 57.50 56.43 1x1q n TRP 90 Cb 0.14 -1.02 0.00 0.00 -2.01 0.00 0.00 31.31 28.43 1x1q n TRP 90 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1x1q n GLY 91 N 0.45 0.62 0.00 6.99 0.00 -1.03 -4.08 105.19 108.13 1x1q n GLY 91 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1x1q n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x1q n GLY 92 N -2.00 0.90 3.70 -0.02 0.00 -1.25 -4.64 105.19 101.89 1x1q n GLY 92 Ca 0.00 -0.44 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 1x1q n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x1q s ALA 93 N -3.52 1.42 0.18 4.61 0.00 -0.96 -3.50 121.76 119.99 1x1q s ALA 93 Ca 0.00 -0.07 -0.30 0.00 0.00 0.00 0.00 51.96 51.59 1x1q s ALA 93 Cb 0.00 -3.20 -0.08 0.00 0.00 0.00 0.00 23.12 19.85 1x1q s ALA 93 CO 0.00 -2.46 1.20 -0.65 0.00 0.00 0.00 175.76 173.85 1x1q s GLN 94 N -4.91 4.49 -0.21 0.00 -1.52 0.12 -4.83 119.66 112.79 1x1q s GLN 94 Ca 0.64 1.87 -0.04 0.00 -1.95 0.00 0.00 55.36 55.87 1x1q s GLN 94 Cb -0.18 -3.25 -0.02 0.00 -0.22 0.00 0.00 33.01 29.34 1x1q s GLN 94 CO 0.57 -0.10 -0.02 0.08 -0.25 0.00 0.00 175.29 175.57 1x1q s VAL 95 N 0.02 3.62 -0.08 1.09 1.01 -1.26 -0.15 120.40 124.65 1x1q s VAL 95 Ca 0.53 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 62.11 1x1q s VAL 95 Cb -0.32 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 1x1q s VAL 95 CO 0.36 0.42 -0.11 -0.36 0.00 0.00 0.00 175.10 175.41 1x1q s PHE 96 N 1.31 2.82 -0.24 5.22 0.08 0.61 -0.49 117.98 127.29 1x1q s PHE 96 Ca 0.04 -0.20 -0.05 0.00 0.12 0.00 0.00 56.93 56.84 1x1q s PHE 96 Cb -0.14 -1.72 -0.01 0.00 -0.57 0.00 0.00 43.02 40.58 1x1q s PHE 96 CO -0.01 0.14 -0.00 -0.51 -0.10 0.00 0.00 175.22 174.75 1x1q s LEU 97 N -0.48 3.15 -0.52 -0.37 1.43 0.28 0.11 118.68 122.29 1x1q s LEU 97 Ca 0.06 -0.40 -0.28 0.00 -1.03 0.00 0.00 54.13 52.48 1x1q s LEU 97 Cb -0.12 -1.80 0.01 0.00 0.03 0.00 0.00 46.19 44.31 1x1q s LEU 97 CO 0.02 -0.05 1.43 -0.75 0.23 0.00 0.00 176.35 177.23 1x1q s LYS 98 N 1.51 3.35 -0.68 1.70 2.47 -0.02 -1.03 119.74 127.05 1x1q s LYS 98 Ca 0.05 0.59 -0.05 0.00 -1.56 0.00 0.00 55.97 55.01 1x1q s LYS 98 Cb -0.15 -4.11 -0.07 0.00 -1.46 0.00 0.00 37.83 32.04 1x1q s LYS 98 CO -0.01 -1.86 2.08 0.54 0.16 0.00 0.00 175.35 176.26 1x1q n ARG 99 N 8.52 1.78 0.00 4.03 5.12 -0.51 -2.10 116.66 133.50 1x1q n ARG 99 Ca 0.14 -1.22 0.07 0.00 -1.93 0.00 0.00 57.85 54.91 1x1q n ARG 99 Cb 0.49 -2.28 0.36 0.00 -1.16 0.00 0.00 32.46 29.87 1x1q n ARG 99 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1x1q n GLU 100 N 3.90 0.27 0.00 5.56 -0.58 -1.11 -2.15 120.64 126.54 1x1q n GLU 100 Ca 0.38 0.11 0.14 0.00 -0.42 0.00 0.00 57.16 57.37 1x1q n GLU 100 Cb 0.21 -1.50 0.70 0.00 -0.57 0.00 0.00 31.44 30.28 1x1q n GLU 100 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 1x1q n ASP 101 N -1.19 0.01 0.02 1.62 5.75 -1.10 -3.25 116.55 118.42 1x1q n ASP 101 Ca 0.08 0.10 0.12 0.00 -0.01 0.00 0.00 54.79 55.08 1x1q n ASP 101 Cb 0.09 -0.36 0.23 0.00 -1.03 0.00 0.00 41.12 40.05 1x1q n ASP 101 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1x1q n LEU 102 N -1.37 0.55 -4.74 -2.12 4.77 -0.91 -4.51 117.00 108.67 1x1q n LEU 102 Ca 0.11 0.12 -0.38 0.00 -0.03 0.00 0.00 56.01 55.84 1x1q n LEU 102 Cb 0.28 -0.23 0.05 0.00 -2.33 0.00 0.00 43.42 41.19 1x1q n LEU 102 CO 0.25 0.04 0.94 -0.76 -1.33 0.00 0.00 177.39 176.53 1x1q s LEU 103 N -3.52 3.73 0.38 2.23 1.43 -1.20 -4.86 118.68 116.86 1x1q s LEU 103 Ca 0.09 2.66 -0.26 0.00 -1.03 0.00 0.00 54.13 55.60 1x1q s LEU 103 Cb 0.16 -4.44 -0.11 0.00 0.03 0.00 0.00 46.19 41.82 1x1q s LEU 103 CO 0.70 -1.73 1.05 1.57 0.23 0.00 0.00 176.35 178.17 1x1q n HIS 104 N -1.42 1.36 0.00 0.29 -0.00 -0.42 -0.17 115.22 114.86 1x1q n HIS 104 Ca 0.13 0.58 0.00 0.00 -0.00 0.00 0.00 57.72 58.43 1x1q n HIS 104 Cb 0.47 -2.26 0.00 0.00 -0.00 0.00 0.00 29.99 28.20 1x1q n HIS 104 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 1x1q n THR 105 N -0.23 0.00 -0.40 3.57 -2.24 -1.26 -4.12 114.28 109.60 1x1q n THR 105 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1x1q n THR 105 Cb 0.37 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.60 1x1q n THR 105 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x1q n GLY 106 N -2.00 1.09 3.36 3.38 0.00 0.76 -5.00 105.19 106.78 1x1q n GLY 106 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1x1q n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x1q s ALA 107 N -2.98 2.22 0.11 4.61 0.00 -1.26 -2.43 121.76 122.04 1x1q s ALA 107 Ca 0.00 -1.40 0.20 0.00 0.00 0.00 0.00 51.96 50.76 1x1q s ALA 107 Cb 0.00 -0.35 0.66 0.00 0.00 0.00 0.00 23.12 23.43 1x1q s ALA 107 CO 0.00 0.49 1.72 1.12 0.00 0.00 0.00 175.76 179.09 1x1q h HIS 108 N 3.99 0.00 0.00 0.00 -0.00 -1.63 -3.20 115.15 114.31 1x1q h HIS 108 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.88 1x1q h HIS 108 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.58 1x1q h HIS 108 CO 0.60 0.35 0.32 1.57 -0.00 0.00 0.00 177.93 180.76 1x1q h LYS 109 N 0.00 0.00 0.00 5.12 2.10 -1.95 -2.00 116.57 119.84 1x1q h LYS 109 Ca -0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1x1q h LYS 109 Cb 0.92 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.25 1x1q h LYS 109 CO 0.05 0.00 -0.01 0.97 -2.00 0.00 0.00 179.45 178.46 1x1q h ILE 110 N 0.00 0.03 -0.63 0.07 2.10 -1.91 -1.30 117.51 115.88 1x1q h ILE 110 Ca 0.00 -0.24 -0.07 0.00 1.08 0.00 0.00 64.86 65.64 1x1q h ILE 110 Cb 0.64 1.23 -0.03 0.00 -1.09 0.00 0.00 36.82 37.57 1x1q h ILE 110 CO 0.00 0.01 0.13 0.78 -1.08 0.00 0.00 178.15 177.98 1x1q h ASN 111 N 0.00 0.94 -0.01 2.19 2.35 -1.65 -1.33 115.58 118.07 1x1q h ASN 111 Ca -0.00 -0.20 -0.15 0.00 -0.55 0.00 0.00 56.30 55.40 1x1q h ASN 111 Cb 0.23 -0.25 0.01 0.00 0.05 0.00 0.00 38.32 38.36 1x1q h ASN 111 CO 0.00 0.93 -0.60 -1.13 -1.65 0.00 0.00 177.43 174.98 1x1q h ASN 112 N 0.95 0.54 -0.54 5.81 -1.24 -1.45 -3.00 115.58 116.64 1x1q h ASN 112 Ca 0.20 -0.75 -0.11 0.00 0.71 0.00 0.00 56.30 56.35 1x1q h ASN 112 Cb 0.37 -0.16 -0.02 0.00 0.73 0.00 0.00 38.32 39.24 1x1q h ASN 112 CO 0.00 1.22 -0.08 0.71 -1.29 0.00 0.00 177.43 177.99 1x1q h THR 113 N -0.09 1.27 -0.66 -3.57 1.35 -1.43 -0.98 112.91 108.80 1x1q h THR 113 Ca -0.07 -1.23 0.04 0.00 -0.55 0.00 0.00 66.41 64.59 1x1q h THR 113 Cb 1.30 0.95 -0.04 0.00 -1.73 0.00 0.00 68.15 68.63 1x1q h THR 113 CO 0.12 0.44 0.40 -0.07 -0.25 0.00 0.00 175.52 176.15 1x1q h LEU 114 N 0.89 0.64 -0.29 3.87 3.38 -1.35 0.01 115.31 122.46 1x1q h LEU 114 Ca 0.14 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1x1q h LEU 114 Cb 0.65 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1x1q h LEU 114 CO 0.04 0.44 0.11 1.23 0.09 0.00 0.00 178.44 180.35 1x1q h GLY 115 N 0.77 0.47 1.13 0.83 0.00 -1.34 -2.40 103.07 102.53 1x1q h GLY 115 Ca 0.27 -0.26 -0.11 0.00 0.00 0.00 0.00 47.33 47.23 1x1q h GLY 115 CO -0.12 0.25 -0.09 1.46 0.00 0.00 0.00 176.54 178.03 1x1q h GLN 116 N 0.32 1.02 -0.04 4.80 4.20 -0.77 -1.15 115.11 123.50 1x1q h GLN 116 Ca 0.10 -0.37 -0.08 0.00 0.06 0.00 0.00 58.65 58.36 1x1q h GLN 116 Cb 0.19 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1x1q h GLN 116 CO -0.01 1.05 -0.33 0.00 -0.67 0.00 0.00 178.83 178.87 1x1q h ALA 117 N 0.97 1.38 -0.36 3.87 0.00 -1.01 -0.30 119.26 123.81 1x1q h ALA 117 Ca 0.15 -0.32 -0.15 0.00 0.00 0.00 0.00 54.91 54.58 1x1q h ALA 117 Cb 0.65 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1x1q h ALA 117 CO 0.05 0.45 -0.38 1.25 0.00 0.00 0.00 179.25 180.62 1x1q h LEU 118 N 0.06 0.95 -0.55 0.00 5.85 -1.12 -2.21 115.31 118.29 1x1q h LEU 118 Ca 0.01 -0.47 -0.03 0.00 0.84 0.00 0.00 57.88 58.22 1x1q h LEU 118 Cb 0.62 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1x1q h LEU 118 CO 0.05 1.23 0.22 0.25 -0.34 0.00 0.00 178.44 179.85 1x1q h LEU 119 N 0.69 0.76 -0.98 2.25 5.85 -0.41 -1.75 115.31 121.73 1x1q h LEU 119 Ca 0.05 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.60 1x1q h LEU 119 Cb 0.97 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.76 1x1q h LEU 119 CO 0.09 0.72 0.57 0.00 -0.34 0.00 0.00 178.44 179.48 1x1q h ALA 120 N 1.07 1.23 -0.42 1.25 0.00 -0.99 -2.52 119.26 118.89 1x1q h ALA 120 Ca 0.18 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1x1q h ALA 120 Cb 0.20 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1x1q h ALA 120 CO -0.02 0.66 -0.04 -0.09 0.00 0.00 0.00 179.25 179.77 1x1q h ARG 121 N 1.29 0.76 -1.92 0.00 2.43 -1.08 0.33 114.38 116.19 1x1q h ARG 121 Ca 0.34 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1x1q h ARG 121 Cb -0.06 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1x1q h ARG 121 CO -0.06 0.86 0.00 -2.13 -1.51 0.00 0.00 179.97 177.12 1x1q n ARG 122 N -4.38 0.16 0.00 0.20 0.63 -0.68 -4.26 116.66 108.32 1x1q n ARG 122 Ca -0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 1x1q n ARG 122 Cb 0.32 -1.42 0.00 0.00 0.45 0.00 0.00 32.46 31.81 1x1q n ARG 122 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1x1q n GLY 124 N 1.43 -1.97 3.79 5.14 0.00 -0.90 -5.10 105.19 107.58 1x1q n GLY 124 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1x1q n GLY 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x1q s LYS 125 N 0.00 3.94 0.00 1.61 -0.14 0.11 -4.94 119.74 120.32 1x1q s LYS 125 Ca 0.00 1.39 0.00 0.00 -1.36 0.00 0.00 55.97 56.00 1x1q s LYS 125 Cb 0.00 -2.23 0.00 0.00 -1.68 0.00 0.00 37.83 33.92 1x1q s LYS 125 CO 0.00 -0.31 0.31 2.89 -0.76 0.00 0.00 175.35 177.48 1x1q n ARG 126 N -0.67 1.85 -4.28 1.68 1.85 -1.14 -4.33 116.66 111.63 1x1q n ARG 126 Ca 0.08 -0.31 -0.17 0.00 -1.00 0.00 0.00 57.85 56.44 1x1q n ARG 126 Cb 0.52 -0.81 -0.14 0.00 -1.05 0.00 0.00 32.46 30.98 1x1q n ARG 126 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 1x1q s ARG 127 N -0.35 0.69 -0.03 2.89 3.52 -0.98 -0.62 118.95 124.06 1x1q s ARG 127 Ca 0.00 -0.48 0.00 0.00 -0.13 0.00 0.00 55.73 55.13 1x1q s ARG 127 Cb 0.00 -0.64 0.03 0.00 -1.56 0.00 0.00 34.95 32.78 1x1q s ARG 127 CO 0.00 0.16 0.01 0.54 -0.81 0.00 0.00 175.30 175.20 1x1q s VAL 128 N -0.55 0.13 0.32 7.11 0.11 0.02 -1.06 120.40 126.49 1x1q s VAL 128 Ca 0.00 0.11 0.10 0.00 -2.93 0.00 0.00 61.98 59.27 1x1q s VAL 128 Cb -0.05 -0.24 -0.06 0.00 -1.53 0.00 0.00 36.38 34.50 1x1q s VAL 128 CO 0.00 0.14 -0.13 0.27 -3.33 0.00 0.00 175.10 172.04 1x1q s ILE 129 N 1.05 2.31 0.21 7.04 -4.36 0.12 -2.40 121.20 125.16 1x1q s ILE 129 Ca -0.09 -2.28 -0.22 0.00 -0.26 0.00 0.00 60.65 57.79 1x1q s ILE 129 Cb -0.13 -2.50 0.06 0.00 1.25 0.00 0.00 42.46 41.13 1x1q s ILE 129 CO -0.02 -0.28 0.92 0.00 0.24 0.00 0.00 174.94 175.80 1x1q s ALA 130 N -2.59 -1.45 0.08 2.27 0.00 -1.04 -1.70 121.76 117.33 1x1q s ALA 130 Ca 0.31 -0.17 0.05 0.00 0.00 0.00 0.00 51.96 52.16 1x1q s ALA 130 Cb -0.00 0.70 -0.03 0.00 0.00 0.00 0.00 23.12 23.79 1x1q s ALA 130 CO 0.16 -1.04 -0.14 -1.83 0.00 0.00 0.00 175.76 172.91 1x1q s GLU 131 N -2.99 0.85 -0.01 0.00 1.03 -1.26 -0.19 118.70 116.13 1x1q s GLU 131 Ca 0.15 -1.01 -0.12 0.00 0.03 0.00 0.00 54.97 54.01 1x1q s GLU 131 Cb -0.03 -0.82 0.02 0.00 -0.80 0.00 0.00 34.13 32.50 1x1q s GLU 131 CO 0.05 0.18 0.26 -0.08 -1.33 0.00 0.00 175.26 174.33 1x1q s THR 132 N -1.48 0.06 0.00 1.83 -1.32 -0.96 -4.69 115.64 109.08 1x1q s THR 132 Ca 0.00 -0.51 0.00 0.00 -1.21 0.00 0.00 61.69 59.97 1x1q s THR 132 Cb -0.09 -0.55 0.00 0.00 -1.51 0.00 0.00 72.50 70.35 1x1q s THR 132 CO 0.02 -0.28 0.00 0.61 -2.21 0.00 0.00 174.62 172.76 1x1q n GLY 133 N 1.43 0.28 0.20 6.08 0.00 -1.26 -4.48 105.19 107.43 1x1q n GLY 133 Ca -0.21 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.95 1x1q n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x1q h ALA 134 N -2.00 1.00 0.00 4.61 0.00 -1.99 -3.46 119.26 117.42 1x1q h ALA 134 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1x1q h ALA 134 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1x1q h ALA 134 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1x1q n GLY 135 N -0.13 0.71 0.22 0.00 0.00 -1.26 -4.90 105.19 99.82 1x1q n GLY 135 Ca 0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.96 1x1q n GLY 135 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1x1q h GLN 136 N 2.21 0.71 -0.29 1.61 1.08 -1.97 -1.84 115.11 116.62 1x1q h GLN 136 Ca 0.00 -0.07 -0.17 0.00 -1.45 0.00 0.00 58.65 56.96 1x1q h GLN 136 Cb 0.00 -0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 27.28 1x1q h GLN 136 CO 0.00 0.53 -0.48 1.25 -0.95 0.00 0.00 178.83 179.18 1x1q h HIS 137 N 0.68 0.96 -0.88 2.96 2.76 -1.94 -2.02 115.15 117.67 1x1q h HIS 137 Ca 0.18 -0.32 0.01 0.00 -2.20 0.00 0.00 60.37 58.05 1x1q h HIS 137 Cb 0.02 -0.19 -0.04 0.00 1.55 0.00 0.00 27.41 28.75 1x1q h HIS 137 CO -0.02 1.10 0.58 0.78 -1.30 0.00 0.00 177.93 179.08 1x1q h GLY 138 N 0.86 1.24 0.95 5.26 0.00 -1.78 -1.02 103.07 108.58 1x1q h GLY 138 Ca 0.03 -0.46 -0.13 0.00 0.00 0.00 0.00 47.33 46.77 1x1q h GLY 138 CO 0.10 0.45 -0.37 -2.08 0.00 0.00 0.00 176.54 174.65 1x1q h VAL 139 N 1.19 1.32 -0.23 4.60 2.07 -1.29 -0.84 116.25 123.07 1x1q h VAL 139 Ca 0.32 -1.58 0.02 0.00 0.82 0.00 0.00 66.70 66.29 1x1q h VAL 139 Cb -0.13 1.78 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 1x1q h VAL 139 CO -0.07 0.49 0.07 -1.28 0.02 0.00 0.00 177.57 176.80 1x1q h SER 140 N 0.35 0.07 -0.06 0.57 0.87 -1.08 0.61 113.55 114.88 1x1q h SER 140 Ca 0.02 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1x1q h SER 140 Cb 0.96 0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.94 1x1q h SER 140 CO 0.08 0.07 0.03 0.58 -0.53 0.00 0.00 176.83 177.06 1x1q h VAL 141 N 0.17 1.11 -0.90 2.23 2.07 -1.18 -2.54 116.25 117.21 1x1q h VAL 141 Ca 0.10 -0.33 0.08 0.00 0.82 0.00 0.00 66.70 67.36 1x1q h VAL 141 Cb 0.08 1.23 -0.06 0.00 -1.52 0.00 0.00 31.29 31.02 1x1q h VAL 141 CO -0.11 0.10 0.59 0.00 0.02 0.00 0.00 177.57 178.16 1x1q h ALA 142 N 0.89 1.55 0.47 1.67 0.00 -0.93 -1.02 119.26 121.90 1x1q h ALA 142 Ca 0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1x1q h ALA 142 Cb 0.13 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1x1q h ALA 142 CO -0.00 0.29 -0.23 1.15 0.00 0.00 0.00 179.25 180.47 1x1q h THR 143 N 0.98 0.53 0.00 0.00 2.02 -0.63 -1.89 112.91 113.93 1x1q h THR 143 Ca 0.40 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.47 1x1q h THR 143 Cb 0.28 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1x1q h THR 143 CO -0.16 0.02 0.00 1.33 0.37 0.00 0.00 175.52 177.08 1x1q n VAL 144 N -5.33 0.82 0.08 3.16 0.24 -0.98 -1.66 118.33 114.65 1x1q n VAL 144 Ca -0.11 0.19 -0.22 0.00 -2.04 0.00 0.00 64.34 62.16 1x1q n VAL 144 Cb 0.28 -1.08 -0.12 0.00 -1.47 0.00 0.00 33.84 31.45 1x1q n VAL 144 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1x1q h ALA 145 N 2.34 0.02 -0.25 2.33 0.00 -0.84 -2.58 119.26 120.29 1x1q h ALA 145 Ca 0.00 -0.75 -0.16 0.00 0.00 0.00 0.00 54.91 54.00 1x1q h ALA 145 Cb 0.38 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1x1q h ALA 145 CO 0.00 0.67 -0.50 0.00 0.00 0.00 0.00 179.25 179.43 1x1q h ALA 146 N 0.31 0.65 -0.62 0.00 0.00 -0.92 0.97 119.26 119.66 1x1q h ALA 146 Ca -0.17 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.24 1x1q h ALA 146 Cb 1.84 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.51 1x1q h ALA 146 CO 0.23 0.68 0.34 1.25 0.00 0.00 0.00 179.25 181.74 1x1q h LEU 147 N 0.54 0.75 -2.31 0.00 5.85 -1.31 -2.84 115.31 115.99 1x1q h LEU 147 Ca 0.02 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1x1q h LEU 147 Cb 1.05 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.89 1x1q h LEU 147 CO 0.10 0.61 0.00 0.49 -0.34 0.00 0.00 178.44 179.30 1x1q n PHE 148 N -4.38 0.45 -1.63 1.25 3.72 -0.98 -4.96 117.46 110.92 1x1q n PHE 148 Ca 0.06 -0.26 -0.10 0.00 -0.05 0.00 0.00 57.45 57.10 1x1q n PHE 148 Cb 0.10 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.61 1x1q n PHE 148 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1x1q n GLY 149 N 1.27 0.68 3.88 1.37 0.00 -0.70 -5.01 105.19 106.69 1x1q n GLY 149 Ca 0.17 -0.55 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 1x1q n GLY 149 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x1q s LEU 150 N -2.44 4.19 0.10 0.99 1.43 0.25 -5.02 118.68 118.19 1x1q s LEU 150 Ca 0.00 0.81 -0.30 0.00 -1.03 0.00 0.00 54.13 53.61 1x1q s LEU 150 Cb 0.00 -3.56 -0.06 0.00 0.03 0.00 0.00 46.19 42.60 1x1q s LEU 150 CO 0.00 -0.04 1.15 -0.70 0.23 0.00 0.00 176.35 176.99 1x1q s GLU 151 N -2.79 4.50 -0.07 1.70 2.12 0.20 -4.47 118.70 119.88 1x1q s GLU 151 Ca 0.45 1.73 0.03 0.00 0.36 0.00 0.00 54.97 57.55 1x1q s GLU 151 Cb -0.11 -3.33 0.01 0.00 0.26 0.00 0.00 34.13 30.95 1x1q s GLU 151 CO 0.23 -0.13 -0.17 0.00 -0.54 0.00 0.00 175.26 174.65 1x1q s VAL 153 N 0.46 0.94 -0.14 0.00 1.01 -1.01 -0.97 120.40 120.68 1x1q s VAL 153 Ca -0.14 -0.24 -0.02 0.00 0.00 0.00 0.00 61.98 61.57 1x1q s VAL 153 Cb -0.16 -0.97 -0.02 0.00 0.00 0.00 0.00 36.38 35.23 1x1q s VAL 153 CO 0.05 0.35 -0.08 -0.69 0.00 0.00 0.00 175.10 174.73 1x1q s VAL 154 N 1.65 3.49 0.33 2.92 1.01 -0.60 -2.50 120.40 126.70 1x1q s VAL 154 Ca 0.03 -0.50 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 1x1q s VAL 154 Cb -0.13 -2.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 1x1q s VAL 154 CO -0.07 0.51 0.55 -0.31 0.00 0.00 0.00 175.10 175.79 1x1q s TYR 155 N 0.30 3.50 0.01 5.22 1.51 0.73 -2.37 117.35 126.24 1x1q s TYR 155 Ca -0.07 0.43 0.08 0.00 -1.01 0.00 0.00 57.07 56.50 1x1q s TYR 155 Cb -0.15 -1.95 -0.02 0.00 -0.11 0.00 0.00 41.96 39.73 1x1q s TYR 155 CO 0.04 0.13 -0.25 0.20 -1.11 0.00 0.00 175.55 174.55 1x1q s GLY 157 N -3.82 1.29 0.30 0.71 0.00 -1.26 -2.25 107.32 102.29 1x1q s GLY 157 Ca 0.41 -1.15 0.07 0.00 0.00 0.00 0.00 44.72 44.05 1x1q s GLY 157 CO 0.35 -1.00 1.44 1.18 0.00 0.00 0.00 173.10 175.08 1x1q n GLU 158 N 2.19 -0.07 0.17 2.90 1.02 -1.26 -1.09 120.64 124.51 1x1q n GLU 158 Ca -0.16 1.34 -0.07 0.00 -0.02 0.00 0.00 57.16 58.25 1x1q n GLU 158 Cb 0.52 -2.22 -0.03 0.00 -0.02 0.00 0.00 31.44 29.69 1x1q n GLU 158 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1x1q h GLU 159 N 0.00 -0.44 -0.98 3.49 4.22 -1.97 -3.08 114.58 115.82 1x1q h GLU 159 Ca 0.63 0.03 0.29 0.00 0.08 0.00 0.00 59.36 60.39 1x1q h GLU 159 Cb 1.43 0.10 -0.14 0.00 0.50 0.00 0.00 28.75 30.64 1x1q h GLU 159 CO -0.82 -0.29 0.52 -0.44 -2.18 0.00 0.00 179.01 175.80 1x1q h ASP 160 N -0.59 0.47 -0.05 1.04 3.45 -1.68 0.19 116.42 119.25 1x1q h ASP 160 Ca -0.05 0.18 0.00 0.00 0.43 0.00 0.00 57.03 57.59 1x1q h ASP 160 Cb 0.35 0.13 -0.00 0.00 -0.56 0.00 0.00 39.33 39.25 1x1q h ASP 160 CO 0.08 -0.08 0.04 0.58 -1.57 0.00 0.00 179.24 178.28 1x1q h VAL 161 N 0.37 1.02 0.09 -1.35 2.07 -1.11 -0.74 116.25 116.59 1x1q h VAL 161 Ca 0.68 -0.03 -0.29 0.00 0.82 0.00 0.00 66.70 67.89 1x1q h VAL 161 Cb 1.47 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 1x1q h VAL 161 CO -0.58 0.01 -1.43 0.03 0.02 0.00 0.00 177.57 175.63 1x1q h ARG 162 N 0.07 0.19 0.00 1.57 3.08 -0.54 -3.33 114.38 115.42 1x1q h ARG 162 Ca 0.02 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.74 1x1q h ARG 162 Cb -0.01 0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1x1q h ARG 162 CO -0.00 1.05 -0.16 2.89 -1.07 0.00 0.00 179.97 182.68 1x1q n ARG 163 N -3.41 0.22 -2.96 0.04 1.85 -1.00 -4.11 116.66 107.29 1x1q n ARG 163 Ca -0.13 0.15 -0.28 0.00 -1.00 0.00 0.00 57.85 56.59 1x1q n ARG 163 Cb 1.03 -1.72 -0.04 0.00 -1.05 0.00 0.00 32.46 30.67 1x1q n ARG 163 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1x1q n GLN 164 N -2.09 3.34 -0.12 2.89 1.13 -0.32 -4.88 117.38 117.35 1x1q n GLN 164 Ca 0.05 -4.84 0.01 0.00 -1.94 0.00 0.00 57.00 50.28 1x1q n GLN 164 Cb 0.42 -2.26 0.29 0.00 0.11 0.00 0.00 30.24 28.80 1x1q n GLN 164 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1x1q h ALA 165 N 3.15 1.47 0.27 -1.58 0.00 -1.72 -2.26 119.26 118.59 1x1q h ALA 165 Ca 0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1x1q h ALA 165 Cb 0.50 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1x1q h ALA 165 CO 0.85 0.44 -0.13 1.25 0.00 0.00 0.00 179.25 181.66 1x1q h LEU 166 N 0.79 -0.31 -0.90 0.00 5.85 -1.94 -2.32 115.31 116.48 1x1q h LEU 166 Ca 0.20 0.01 0.21 0.00 0.84 0.00 0.00 57.88 59.14 1x1q h LEU 166 Cb 0.03 0.08 -0.12 0.00 0.37 0.00 0.00 40.66 41.02 1x1q h LEU 166 CO -0.03 -0.18 0.44 0.78 -0.34 0.00 0.00 178.44 179.10 1x1q h ASN 167 N -0.44 0.43 -0.75 1.25 2.35 -1.91 0.41 115.58 116.92 1x1q h ASN 167 Ca -0.04 0.14 0.04 0.00 -0.55 0.00 0.00 56.30 55.89 1x1q h ASN 167 Cb 0.28 0.09 -0.05 0.00 0.05 0.00 0.00 38.32 38.69 1x1q h ASN 167 CO 0.06 0.07 0.46 0.58 -1.65 0.00 0.00 177.43 176.95 1x1q h VAL 168 N 0.48 1.07 -0.30 2.81 2.07 -1.44 -2.21 116.25 118.74 1x1q h VAL 168 Ca 0.55 -0.30 -0.09 0.00 0.82 0.00 0.00 66.70 67.68 1x1q h VAL 168 Cb 0.99 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1x1q h VAL 168 CO -0.48 0.16 -0.16 0.15 0.02 0.00 0.00 177.57 177.25 1x1q h PHE 169 N 0.88 0.74 0.00 1.57 3.57 0.24 -1.57 116.94 122.37 1x1q h PHE 169 Ca 0.31 -0.19 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1x1q h PHE 169 Cb 0.07 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.65 1x1q h PHE 169 CO -0.04 0.88 0.00 0.54 -2.23 0.00 0.00 178.31 177.46 1x1q n ARG 170 N -4.38 0.00 0.00 1.11 1.74 0.50 -0.18 116.66 115.44 1x1q n ARG 170 Ca -0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 1x1q n ARG 170 Cb 0.39 -0.85 0.00 0.00 -1.02 0.00 0.00 32.46 30.98 1x1q n ARG 170 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1x1q n LYS 172 N 0.36 0.00 0.02 5.56 5.02 -0.59 -1.01 118.16 127.53 1x1q n LYS 172 Ca 0.00 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.24 1x1q n LYS 172 Cb 0.00 0.00 0.15 0.00 -0.02 0.00 0.00 35.03 35.16 1x1q n LYS 172 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1x1q h LEU 173 N 0.00 0.49 0.00 -0.35 3.38 -0.85 -2.17 115.31 115.81 1x1q h LEU 173 Ca 0.00 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1x1q h LEU 173 Cb 0.00 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1x1q h LEU 173 CO 0.00 0.82 0.00 0.18 0.09 0.00 0.00 178.44 179.53 1x1q n LEU 174 N -4.04 0.00 0.00 1.67 7.99 -0.18 -4.83 117.00 117.61 1x1q n LEU 174 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.99 1x1q n LEU 174 Cb 0.49 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.80 1x1q n LEU 174 CO 0.44 0.00 0.00 0.61 -1.51 0.00 0.00 177.39 176.93 1x1q n GLY 175 N 0.04 0.84 3.91 -0.72 0.00 -0.82 -4.44 105.19 104.01 1x1q n GLY 175 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 1x1q n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x1q s ALA 176 N -3.37 3.35 -0.22 4.61 0.00 -1.26 -4.75 121.76 120.12 1x1q s ALA 176 Ca 0.00 -0.51 -0.08 0.00 0.00 0.00 0.00 51.96 51.37 1x1q s ALA 176 Cb 0.00 -2.64 -0.04 0.00 0.00 0.00 0.00 23.12 20.44 1x1q s ALA 176 CO 0.00 -0.49 0.09 -2.00 0.00 0.00 0.00 175.76 173.36 1x1q s GLU 177 N -4.84 3.88 -0.35 0.00 2.12 -0.15 -4.26 118.70 115.10 1x1q s GLU 177 Ca 0.50 -0.38 -0.12 0.00 0.36 0.00 0.00 54.97 55.33 1x1q s GLU 177 Cb -0.10 -3.32 0.00 0.00 0.26 0.00 0.00 34.13 30.97 1x1q s GLU 177 CO 0.46 0.07 0.22 0.08 -0.54 0.00 0.00 175.26 175.55 1x1q s VAL 178 N 0.96 4.95 -0.13 3.70 1.01 -1.26 -1.55 120.40 128.07 1x1q s VAL 178 Ca 0.05 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.56 1x1q s VAL 178 Cb -0.14 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.62 1x1q s VAL 178 CO 0.03 -0.10 -0.22 0.00 0.00 0.00 0.00 175.10 174.82 1x1q s ARG 179 N 1.65 3.06 0.99 2.72 1.70 -1.00 -5.02 118.95 123.05 1x1q s ARG 179 Ca 0.05 -0.85 -0.12 0.00 -0.47 0.00 0.00 55.73 54.34 1x1q s ARG 179 Cb -0.18 -2.41 0.18 0.00 -0.57 0.00 0.00 34.95 31.97 1x1q s ARG 179 CO 0.08 0.07 1.08 -2.14 -1.08 0.00 0.00 175.30 173.32 1x1q s PRO 180 N 0.62 0.51 0.00 3.89 0.02 -1.26 -4.40 135.00 134.38 1x1q s PRO 180 Ca -0.11 0.94 0.00 0.00 0.02 0.00 0.00 61.00 61.85 1x1q s PRO 180 Cb -0.16 -1.71 0.00 0.00 0.02 0.00 0.00 34.50 32.64 1x1q s PRO 180 CO 0.03 -2.79 0.00 -2.37 -0.33 0.00 0.00 177.00 171.54 1x1q n THR 187 N -4.28 0.00 0.29 0.99 5.66 -1.26 -4.28 114.28 111.40 1x1q n THR 187 Ca 0.07 0.00 0.18 0.00 -3.05 0.00 0.00 64.05 61.24 1x1q n THR 187 Cb 0.54 0.00 0.87 0.00 -1.55 0.00 0.00 70.33 70.20 1x1q n THR 187 CO 0.00 0.00 0.00 0.17 -3.05 0.00 0.00 175.07 172.19 1x1q h LEU 188 N 0.06 0.00 -0.60 1.09 -0.00 -1.87 -2.70 115.31 111.29 1x1q h LEU 188 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 57.88 57.95 1x1q h LEU 188 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 40.60 1x1q h LEU 188 CO 0.00 0.04 0.29 0.50 -0.00 0.00 0.00 178.44 179.27 1x1q h LYS 189 N 0.00 0.52 0.00 0.17 3.64 -1.99 0.37 116.57 119.28 1x1q h LYS 189 Ca -0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1x1q h LYS 189 Cb 0.29 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1x1q h LYS 189 CO 0.01 0.34 0.00 -0.25 -2.27 0.00 0.00 179.45 177.28 1x1q n ASP 190 N -4.89 0.34 -0.04 4.20 9.92 -1.02 -2.93 116.55 122.14 1x1q n ASP 190 Ca 0.07 0.58 -0.05 0.00 -0.53 0.00 0.00 54.79 54.87 1x1q n ASP 190 Cb 0.20 -0.66 -0.14 0.00 -0.64 0.00 0.00 41.12 39.89 1x1q n ASP 190 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1x1q n ALA 191 N -1.64 1.71 0.21 2.24 0.00 0.04 -4.17 120.51 118.90 1x1q n ALA 191 Ca 0.03 -0.90 -0.11 0.00 0.00 0.00 0.00 53.44 52.46 1x1q n ALA 191 Cb 0.20 -0.62 -0.05 0.00 0.00 0.00 0.00 19.45 18.97 1x1q n ALA 191 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1x1q h THR 192 N 0.00 0.16 0.00 0.00 2.02 -1.22 -2.77 112.91 111.11 1x1q h THR 192 Ca -0.33 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.26 1x1q h THR 192 Cb 1.91 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 68.57 1x1q h THR 192 CO 0.05 0.04 0.00 -0.46 0.37 0.00 0.00 175.52 175.51 1x1q n ASN 193 N -5.18 0.00 -0.02 4.18 0.23 -1.24 -1.17 115.26 112.07 1x1q n ASN 193 Ca -0.08 -0.06 -0.10 0.00 -0.53 0.00 0.00 54.58 53.80 1x1q n ASN 193 Cb 0.26 -0.21 -0.14 0.00 -2.08 0.00 0.00 39.78 37.62 1x1q n ASN 193 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 1x1q n GLU 194 N -1.21 0.65 0.03 -3.83 4.07 -1.22 -3.77 120.64 115.36 1x1q n GLU 194 Ca 0.08 0.29 -0.19 0.00 -0.06 0.00 0.00 57.16 57.28 1x1q n GLU 194 Cb 0.09 -1.78 -0.12 0.00 -0.06 0.00 0.00 31.44 29.57 1x1q n GLU 194 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1x1q h ALA 195 N 0.88 0.04 -0.85 4.31 0.00 -0.84 -3.01 119.26 119.78 1x1q h ALA 195 Ca -0.30 -0.64 0.07 0.00 0.00 0.00 0.00 54.91 54.04 1x1q h ALA 195 Cb 2.02 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 19.81 1x1q h ALA 195 CO 0.08 0.46 0.56 0.82 0.00 0.00 0.00 179.25 181.17 1x1q h ILE 196 N -0.01 1.03 0.82 0.00 1.08 -1.48 0.13 117.51 119.08 1x1q h ILE 196 Ca -0.11 -0.32 -0.04 0.00 -0.39 0.00 0.00 64.86 64.00 1x1q h ILE 196 Cb 1.52 0.03 0.01 0.00 -3.07 0.00 0.00 36.82 35.31 1x1q h ILE 196 CO 0.16 0.17 -0.39 -0.09 -0.69 0.00 0.00 178.15 177.30 1x1q h ARG 197 N 0.92 -1.06 -0.69 2.37 9.65 -1.65 -1.65 114.38 122.28 1x1q h ARG 197 Ca 0.37 0.07 0.14 0.00 -1.10 0.00 0.00 59.98 59.46 1x1q h ARG 197 Cb 0.27 0.24 -0.10 0.00 -1.39 0.00 0.00 29.97 28.99 1x1q h ARG 197 CO -0.14 -0.70 0.17 0.22 2.80 0.00 0.00 179.97 182.32 1x1q h ASP 198 N -1.10 0.04 -0.12 -3.80 -0.00 -1.22 -1.38 116.42 108.85 1x1q h ASP 198 Ca -0.11 0.13 0.03 0.00 -0.00 0.00 0.00 57.03 57.07 1x1q h ASP 198 Cb 0.84 0.16 -0.03 0.00 -0.00 0.00 0.00 39.33 40.31 1x1q h ASP 198 CO 0.18 0.00 -0.06 -0.25 -0.00 0.00 0.00 179.24 179.12 1x1q h TRP 199 N 0.29 -0.13 -0.20 0.28 7.01 -0.56 -1.16 115.95 121.48 1x1q h TRP 199 Ca 0.37 0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.42 1x1q h TRP 199 Cb 0.60 0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 27.70 1x1q h TRP 199 CO -0.24 -0.09 0.01 0.82 -2.79 0.00 0.00 178.44 176.14 1x1q h ILE 200 N -0.04 0.87 -0.48 2.65 1.08 -0.38 0.35 117.51 121.56 1x1q h ILE 200 Ca 0.07 -0.03 0.01 0.00 -0.39 0.00 0.00 64.86 64.52 1x1q h ILE 200 Cb 0.14 0.79 -0.03 0.00 -3.07 0.00 0.00 36.82 34.66 1x1q h ILE 200 CO -0.15 0.01 0.30 0.74 -0.69 0.00 0.00 178.15 178.37 1x1q h THR 201 N 0.08 1.09 -0.57 -0.27 2.02 -1.04 -2.93 112.91 111.28 1x1q h THR 201 Ca 0.09 -0.21 -0.22 0.00 0.77 0.00 0.00 66.41 66.85 1x1q h THR 201 Cb 0.11 0.42 -0.13 0.00 -1.74 0.00 0.00 68.15 66.81 1x1q h THR 201 CO -0.15 0.11 0.18 0.59 0.37 0.00 0.00 175.52 176.62 1x1q n ASN 202 N -4.78 3.77 -0.32 4.18 3.02 -0.46 -4.69 115.26 115.98 1x1q n ASN 202 Ca 0.02 -3.42 0.17 0.00 -0.03 0.00 0.00 54.58 51.33 1x1q n ASN 202 Cb 0.04 -0.69 0.42 0.00 -0.61 0.00 0.00 39.78 38.94 1x1q n ASN 202 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 1x1q h VAL 203 N 1.72 0.64 -0.78 2.41 3.04 -0.09 0.30 116.25 123.48 1x1q h VAL 203 Ca 0.26 -0.20 0.20 0.00 -1.01 0.00 0.00 66.70 65.96 1x1q h VAL 203 Cb 2.06 0.02 -0.04 0.00 -2.01 0.00 0.00 31.29 31.31 1x1q h VAL 203 CO 0.60 0.10 0.54 -0.09 -1.01 0.00 0.00 177.57 177.71 1x1q h ARG 204 N 0.57 0.20 0.00 4.17 9.65 -1.85 -2.78 114.38 124.33 1x1q h ARG 204 Ca 0.56 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.43 1x1q h ARG 204 Cb 1.15 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.68 1x1q h ARG 204 CO -0.32 0.13 0.00 0.25 2.80 0.00 0.00 179.97 182.83 1x1q n THR 205 N -4.41 0.17 -4.70 0.20 -2.24 0.27 -4.80 114.28 98.76 1x1q n THR 205 Ca 0.16 -0.57 -0.25 0.00 -2.27 0.00 0.00 64.05 61.12 1x1q n THR 205 Cb 0.72 0.94 -0.15 0.00 -2.10 0.00 0.00 70.33 69.74 1x1q n THR 205 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1x1q s THR 206 N -0.17 1.49 -0.01 4.28 2.01 0.79 -2.33 115.64 121.70 1x1q s THR 206 Ca 0.00 -0.99 0.07 0.00 0.31 0.00 0.00 61.69 61.08 1x1q s THR 206 Cb 0.00 -1.28 -0.02 0.00 0.01 0.00 0.00 72.50 71.21 1x1q s THR 206 CO 0.00 0.26 -0.23 0.12 -0.69 0.00 0.00 174.62 174.08 1x1q s PHE 207 N -0.65 2.42 -0.34 4.92 2.19 -0.22 -4.61 117.98 121.68 1x1q s PHE 207 Ca 0.06 -0.37 -0.08 0.00 0.33 0.00 0.00 56.93 56.88 1x1q s PHE 207 Cb -0.08 -1.51 0.03 0.00 -1.31 0.00 0.00 43.02 40.15 1x1q s PHE 207 CO 0.01 0.05 0.14 -0.47 1.83 0.00 0.00 175.22 176.77 1x1q s TYR 208 N -0.68 3.24 -0.25 10.12 5.04 -1.26 -0.71 117.35 132.85 1x1q s TYR 208 Ca 0.11 -1.21 -0.26 0.00 -2.44 0.00 0.00 57.07 53.27 1x1q s TYR 208 Cb -0.10 -2.33 0.00 0.00 0.35 0.00 0.00 41.96 39.88 1x1q s TYR 208 CO 0.00 -0.68 0.89 0.42 -1.34 0.00 0.00 175.55 174.84 1x1q s ILE 209 N 1.47 4.77 -0.11 3.14 1.01 -0.69 -4.98 121.20 125.81 1x1q s ILE 209 Ca 0.00 1.64 0.03 0.00 0.00 0.00 0.00 60.65 62.32 1x1q s ILE 209 Cb -0.19 -4.18 0.00 0.00 0.01 0.00 0.00 42.46 38.10 1x1q s ILE 209 CO 0.04 -0.15 -0.22 -0.22 0.00 0.00 0.00 174.94 174.39 1x1q s LEU 210 N 2.99 2.16 -0.28 2.97 2.96 -1.26 -4.71 118.68 123.52 1x1q s LEU 210 Ca 0.37 -0.55 0.12 0.00 -0.22 0.00 0.00 54.13 53.85 1x1q s LEU 210 Cb -0.15 -1.44 0.68 0.00 0.50 0.00 0.00 46.19 45.78 1x1q s LEU 210 CO 0.08 0.14 1.67 0.61 -1.32 0.00 0.00 176.35 177.53 1x1q n GLY 211 N 3.67 3.82 3.61 7.98 0.00 -1.26 -4.92 105.19 118.10 1x1q n GLY 211 Ca -0.19 -1.03 -0.30 0.00 0.00 0.00 0.00 46.02 44.50 1x1q n GLY 211 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x1q s SER 212 N -1.40 4.62 -0.11 1.61 0.15 -1.26 -4.11 113.70 113.20 1x1q s SER 212 Ca 0.51 -0.30 0.19 0.00 0.70 0.00 0.00 55.95 57.05 1x1q s SER 212 Cb 0.41 -0.98 0.72 0.00 -1.71 0.00 0.00 66.02 64.46 1x1q s SER 212 CO 0.11 0.19 1.63 1.33 1.20 0.00 0.00 173.24 177.69 1x1q n VAL 213 N 0.74 1.81 0.40 4.45 0.24 -1.26 -4.26 118.33 120.44 1x1q n VAL 213 Ca -0.13 -1.20 0.05 0.00 -2.04 0.00 0.00 64.34 61.02 1x1q n VAL 213 Cb 0.52 0.14 0.03 0.00 -1.47 0.00 0.00 33.84 33.06 1x1q n VAL 213 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 1x1q n VAL 214 N 1.13 0.00 -1.15 3.34 0.24 -1.26 -4.07 118.33 116.55 1x1q n VAL 214 Ca 0.26 -0.47 -0.11 0.00 -2.04 0.00 0.00 64.34 61.98 1x1q n VAL 214 Cb 0.88 1.17 0.08 0.00 -1.47 0.00 0.00 33.84 34.50 1x1q n VAL 214 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1x1q n GLY 215 N 0.65 -1.65 3.84 7.63 0.00 -1.26 -4.54 105.19 109.86 1x1q n GLY 215 Ca 0.05 -1.62 -0.32 0.00 0.00 0.00 0.00 46.02 44.13 1x1q n GLY 215 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x1q s PRO 216 N -4.02 4.02 0.37 1.61 0.04 -1.26 -4.50 135.00 131.25 1x1q s PRO 216 Ca 0.27 0.88 -0.26 0.00 0.04 0.00 0.00 61.00 61.94 1x1q s PRO 216 Cb -0.01 -2.24 -0.12 0.00 0.04 0.00 0.00 34.50 32.17 1x1q s PRO 216 CO 0.20 -0.09 0.96 1.58 0.04 0.00 0.00 177.00 179.69 1x1q n HIS 217 N -1.04 1.03 -0.75 0.56 -0.00 -1.26 -1.83 115.22 111.93 1x1q n HIS 217 Ca 0.06 0.62 -0.07 0.00 -0.00 0.00 0.00 57.72 58.33 1x1q n HIS 217 Cb 0.54 -2.21 0.25 0.00 -0.00 0.00 0.00 29.99 28.57 1x1q n HIS 217 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1x1q n PRO 218 N 0.44 3.23 -0.09 1.57 -0.04 -1.26 -4.92 135.00 133.92 1x1q n PRO 218 Ca 0.10 -2.62 -0.12 0.00 -0.04 0.00 0.00 63.50 60.81 1x1q n PRO 218 Cb 0.36 -2.08 -0.04 0.00 -0.04 0.00 0.00 33.50 31.70 1x1q n PRO 218 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1x1q h TYR 219 N 2.17 0.61 -0.01 0.54 0.05 -1.68 -3.41 116.97 115.23 1x1q h TYR 219 Ca 0.26 -0.13 -0.60 0.00 0.05 0.00 0.00 58.73 58.31 1x1q h TYR 219 Cb 2.17 -0.15 0.12 0.00 1.01 0.00 0.00 36.73 39.88 1x1q h TYR 219 CO 1.14 0.75 1.62 -2.30 -1.05 0.00 0.00 178.16 178.32 1x1q n PRO 220 N -4.51 0.46 0.00 4.88 -0.02 -1.26 -4.44 135.00 130.12 1x1q n PRO 220 Ca -0.03 -1.28 0.00 0.00 -2.02 0.00 0.00 63.50 60.17 1x1q n PRO 220 Cb 0.32 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.14 1x1q n PRO 220 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1x1q n VAL 223 N 6.75 0.00 -0.24 -1.45 0.31 -1.26 -4.61 118.33 117.83 1x1q n VAL 223 Ca 0.48 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.76 1x1q n VAL 223 Cb 0.42 0.00 0.06 0.00 -0.91 0.00 0.00 33.84 33.41 1x1q n VAL 223 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1x1q h ARG 224 N 0.00 0.83 -0.24 5.55 1.12 -1.95 -0.54 114.38 119.16 1x1q h ARG 224 Ca 0.00 -0.05 -0.01 0.00 -1.11 0.00 0.00 59.98 58.81 1x1q h ARG 224 Cb 0.00 -0.19 -0.01 0.00 -0.01 0.00 0.00 29.97 29.76 1x1q h ARG 224 CO 0.00 0.55 0.11 -0.44 -3.11 0.00 0.00 179.97 177.08 1x1q h ASP 225 N 0.86 0.32 0.42 -3.80 3.32 -1.94 0.04 116.42 115.64 1x1q h ASP 225 Ca 0.26 -0.14 -0.11 0.00 0.02 0.00 0.00 57.03 57.06 1x1q h ASP 225 Cb -0.04 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1x1q h ASP 225 CO -0.08 0.37 -0.48 -0.26 -1.72 0.00 0.00 179.24 177.07 1x1q h PHE 226 N 0.25 0.09 0.00 4.55 0.04 -1.86 -2.96 116.94 117.06 1x1q h PHE 226 Ca 0.08 -0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 1x1q h PHE 226 Cb 0.14 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.27 1x1q h PHE 226 CO -0.02 0.55 -0.11 1.96 -0.60 0.00 0.00 178.31 180.09 1x1q h GLN 227 N 0.06 0.00 -0.83 1.51 1.08 -0.91 -3.33 115.11 112.70 1x1q h GLN 227 Ca 0.00 0.00 0.24 0.00 -1.45 0.00 0.00 58.65 57.44 1x1q h GLN 227 Cb 0.88 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.28 1x1q h GLN 227 CO 0.07 0.05 0.70 0.77 -0.95 0.00 0.00 178.83 179.47 1x1q h SER 228 N 0.00 0.00 -0.90 1.46 0.02 -0.80 -1.00 113.55 112.32 1x1q h SER 228 Ca -0.00 0.00 0.21 0.00 -0.84 0.00 0.00 61.79 61.16 1x1q h SER 228 Cb 1.04 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.52 1x1q h SER 228 CO 0.01 0.00 0.60 1.62 -1.14 0.00 0.00 176.83 177.92 1x1q h VAL 229 N 0.00 0.65 0.62 2.27 3.04 -1.75 -1.01 116.25 120.07 1x1q h VAL 229 Ca 0.40 -0.12 -0.03 0.00 -1.01 0.00 0.00 66.70 65.93 1x1q h VAL 229 Cb 1.79 0.27 0.01 0.00 -2.01 0.00 0.00 31.29 31.35 1x1q h VAL 229 CO -0.00 0.06 -0.30 0.40 -1.01 0.00 0.00 177.57 176.72 1x1q h ILE 230 N 0.35 0.34 -0.66 3.17 2.04 -1.37 -1.36 117.51 120.03 1x1q h ILE 230 Ca 0.47 -0.17 0.02 0.00 1.00 0.00 0.00 64.86 66.18 1x1q h ILE 230 Cb 1.25 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 37.69 1x1q h ILE 230 CO -0.16 0.02 0.42 1.23 0.00 0.00 0.00 178.15 179.66 1x1q h GLY 231 N -0.95 0.95 1.01 5.37 0.00 -0.44 -1.42 103.07 107.59 1x1q h GLY 231 Ca -0.08 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 46.92 1x1q h GLY 231 CO 0.14 0.29 0.45 0.83 0.00 0.00 0.00 176.54 178.25 1x1q h GLU 232 N 0.84 1.02 -0.31 4.80 4.39 -1.19 0.08 114.58 124.21 1x1q h GLU 232 Ca 0.26 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 59.86 1x1q h GLU 232 Cb -0.02 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.40 1x1q h GLU 232 CO -0.09 0.72 0.17 0.93 -1.16 0.00 0.00 179.01 179.58 1x1q h GLU 233 N 1.03 0.44 -0.26 2.33 5.08 -0.84 -1.54 114.58 120.82 1x1q h GLU 233 Ca 0.27 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 1x1q h GLU 233 Cb -0.03 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1x1q h GLU 233 CO -0.05 0.38 0.07 0.28 -1.00 0.00 0.00 179.01 178.69 1x1q h VAL 234 N 0.38 1.12 -0.36 3.13 2.07 -0.81 0.15 116.25 121.92 1x1q h VAL 234 Ca 0.11 -0.41 -0.06 0.00 0.82 0.00 0.00 66.70 67.16 1x1q h VAL 234 Cb 0.07 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1x1q h VAL 234 CO -0.02 0.15 -0.01 0.50 0.02 0.00 0.00 177.57 178.21 1x1q h LYS 235 N 0.37 0.65 0.00 1.57 3.64 -0.34 -0.72 116.57 121.74 1x1q h LYS 235 Ca 0.09 -0.22 -0.20 0.00 -1.27 0.00 0.00 60.65 59.06 1x1q h LYS 235 Cb 0.13 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 1x1q h LYS 235 CO -0.01 0.77 -0.93 0.07 -2.27 0.00 0.00 179.45 177.08 1x1q h ARG 236 N 0.47 0.00 -0.24 1.90 0.11 -0.77 -2.60 114.38 113.25 1x1q h ARG 236 Ca 0.10 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 60.01 1x1q h ARG 236 Cb 0.48 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.56 1x1q h ARG 236 CO 0.02 0.93 -0.55 1.96 0.10 0.00 0.00 179.97 182.43 1x1q h GLN 237 N 0.00 0.73 -0.40 0.08 4.20 -0.69 -1.95 115.11 117.08 1x1q h GLN 237 Ca -0.01 -0.46 -0.05 0.00 0.06 0.00 0.00 58.65 58.18 1x1q h GLN 237 Cb 1.69 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 29.51 1x1q h GLN 237 CO 0.12 1.09 0.05 0.77 -0.67 0.00 0.00 178.83 180.19 1x1q h SER 238 N 0.56 0.65 -0.81 1.46 0.02 -1.15 -2.04 113.55 112.24 1x1q h SER 238 Ca 0.01 -0.27 -0.03 0.00 -0.84 0.00 0.00 61.79 60.66 1x1q h SER 238 Cb 1.13 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.46 1x1q h SER 238 CO 0.11 0.76 0.40 -0.07 -1.14 0.00 0.00 176.83 176.90 1x1q h LEU 239 N 0.52 1.06 -0.55 5.07 3.38 -1.39 0.51 115.31 123.91 1x1q h LEU 239 Ca 0.12 -0.13 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 1x1q h LEU 239 Cb 0.40 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1x1q h LEU 239 CO 0.01 0.89 -0.72 1.05 0.09 0.00 0.00 178.44 179.76 1x1q h GLU 240 N 1.15 0.05 0.00 1.13 4.11 -1.27 0.21 114.58 119.96 1x1q h GLU 240 Ca 0.28 -0.04 -0.11 0.00 0.07 0.00 0.00 59.36 59.56 1x1q h GLU 240 Cb 0.10 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1x1q h GLU 240 CO -0.04 0.75 -1.79 -0.11 0.07 0.00 0.00 179.01 177.89 1x1q n LEU 241 N -3.71 0.31 0.00 3.06 7.94 -0.77 -4.57 117.00 119.26 1x1q n LEU 241 Ca -0.01 0.13 0.00 0.00 -1.11 0.00 0.00 56.01 55.02 1x1q n LEU 241 Cb 0.70 0.10 0.00 0.00 0.53 0.00 0.00 43.42 44.75 1x1q n LEU 241 CO 0.44 0.10 -0.49 0.49 -1.11 0.00 0.00 177.39 176.82 1x1q n PHE 242 N -2.55 0.00 -0.98 1.96 0.99 0.18 -4.99 117.46 112.06 1x1q n PHE 242 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.35 1x1q n PHE 242 Cb 0.74 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.22 1x1q n PHE 242 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1x1q n GLY 243 N 2.45 0.52 3.46 1.37 0.00 0.74 -4.95 105.19 108.78 1x1q n GLY 243 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1x1q n GLY 243 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1x1q s ARG 244 N -0.28 1.32 0.61 1.61 1.70 -1.25 -4.93 118.95 117.72 1x1q s ARG 244 Ca 0.00 -0.56 -0.14 0.00 -0.47 0.00 0.00 55.73 54.57 1x1q s ARG 244 Cb 0.00 0.58 -0.04 0.00 -0.57 0.00 0.00 34.95 34.92 1x1q s ARG 244 CO 0.00 -0.57 1.04 -0.51 -1.08 0.00 0.00 175.30 174.17 1x1q s LEU 245 N -2.78 3.39 0.97 -1.89 1.43 -1.26 -3.86 118.68 114.68 1x1q s LEU 245 Ca 0.02 1.64 -0.11 0.00 -1.03 0.00 0.00 54.13 54.65 1x1q s LEU 245 Cb -0.01 -4.51 0.15 0.00 0.03 0.00 0.00 46.19 41.85 1x1q s LEU 245 CO -0.11 -1.05 0.96 -2.65 0.23 0.00 0.00 176.35 173.74 1x1q n PRO 246 N -2.33 -0.74 0.11 1.29 -0.02 -1.26 -4.97 135.00 127.08 1x1q n PRO 246 Ca 0.07 -0.16 -0.20 0.00 -2.02 0.00 0.00 63.50 61.19 1x1q n PRO 246 Cb 0.53 -2.24 -0.15 0.00 -0.02 0.00 0.00 33.50 31.63 1x1q n PRO 246 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1x1q h ASP 247 N -1.96 0.61 -4.19 2.55 3.32 -1.56 -3.39 116.42 111.80 1x1q h ASP 247 Ca -0.46 -0.72 -0.14 0.00 0.02 0.00 0.00 57.03 55.74 1x1q h ASP 247 Cb 1.28 -0.20 -0.23 0.00 0.22 0.00 0.00 39.33 40.40 1x1q h ASP 247 CO 0.41 1.58 -0.32 0.00 -1.72 0.00 0.00 179.24 179.18 1x1q s ALA 248 N -2.62 -0.80 -0.09 3.45 0.00 -1.19 -1.51 121.76 119.01 1x1q s ALA 248 Ca -0.09 0.74 0.05 0.00 0.00 0.00 0.00 51.96 52.66 1x1q s ALA 248 Cb 0.06 -0.36 -0.00 0.00 0.00 0.00 0.00 23.12 22.82 1x1q s ALA 248 CO 0.90 -0.19 -0.24 -0.51 0.00 0.00 0.00 175.76 175.72 1x1q s LEU 249 N -0.27 2.08 -0.04 0.00 1.43 -0.24 -1.28 118.68 120.36 1x1q s LEU 249 Ca -0.04 -0.54 0.05 0.00 -1.03 0.00 0.00 54.13 52.56 1x1q s LEU 249 Cb -0.03 -1.40 -0.01 0.00 0.03 0.00 0.00 46.19 44.79 1x1q s LEU 249 CO 0.02 0.19 -0.18 -0.63 0.23 0.00 0.00 176.35 175.97 1x1q s ILE 250 N 0.19 1.50 -0.14 -0.59 1.01 -0.09 -0.95 121.20 122.14 1x1q s ILE 250 Ca -0.14 -0.77 -0.20 0.00 0.00 0.00 0.00 60.65 59.53 1x1q s ILE 250 Cb -0.17 -1.28 0.05 0.00 0.01 0.00 0.00 42.46 41.07 1x1q s ILE 250 CO 0.07 0.43 0.53 0.00 0.00 0.00 0.00 174.94 175.97 1x1q s ALA 251 N -0.08 -1.32 0.20 9.38 0.00 -0.96 -1.43 121.76 127.56 1x1q s ALA 251 Ca -0.02 1.27 -0.30 0.00 0.00 0.00 0.00 51.96 52.92 1x1q s ALA 251 Cb -0.11 -0.54 -0.08 0.00 0.00 0.00 0.00 23.12 22.39 1x1q s ALA 251 CO 0.02 -0.28 1.21 0.00 0.00 0.00 0.00 175.76 176.71 1x1q s ALA 252 N -0.29 3.45 -0.27 0.00 0.00 -1.26 -0.81 121.76 122.59 1x1q s ALA 252 Ca -0.05 0.99 -0.03 0.00 0.00 0.00 0.00 51.96 52.87 1x1q s ALA 252 Cb -0.03 -3.42 0.02 0.00 0.00 0.00 0.00 23.12 19.69 1x1q s ALA 252 CO 0.03 -0.40 -0.01 0.08 0.00 0.00 0.00 175.76 175.46 1x1q s VAL 253 N -0.19 3.22 0.00 0.00 1.01 0.31 -3.98 120.40 120.77 1x1q s VAL 253 Ca 0.52 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1x1q s VAL 253 Cb -0.34 -2.66 0.00 0.00 0.00 0.00 0.00 36.38 33.39 1x1q s VAL 253 CO 0.38 0.14 0.00 0.61 0.00 0.00 0.00 175.10 176.24 1x1q n GLY 254 N 4.73 -0.29 3.51 4.51 0.00 -1.26 -4.42 105.19 111.97 1x1q n GLY 254 Ca -0.16 0.46 -0.47 0.00 0.00 0.00 0.00 46.02 45.86 1x1q n GLY 254 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x1q n GLY 255 N 0.00 0.70 0.00 -0.02 0.00 -1.26 -4.65 105.19 99.96 1x1q n GLY 255 Ca 0.00 0.86 0.00 0.00 0.00 0.00 0.00 46.02 46.88 1x1q n GLY 255 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x1q n GLY 256 N 6.21 -0.35 0.89 -0.02 0.00 -1.26 -4.77 105.19 105.88 1x1q n GLY 256 Ca 0.36 -2.20 0.05 0.00 0.00 0.00 0.00 46.02 44.23 1x1q n GLY 256 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x1q n SER 257 N 0.00 1.34 0.40 1.61 3.41 -1.26 -4.43 113.62 114.69 1x1q n SER 257 Ca 0.00 -2.90 -0.18 0.00 -0.26 0.00 0.00 58.87 55.52 1x1q n SER 257 Cb 0.00 -0.40 -0.09 0.00 -0.26 0.00 0.00 64.21 63.46 1x1q n SER 257 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1x1q h ASN 258 N 0.81 -1.18 -0.19 4.04 -1.24 -1.86 -2.88 115.58 113.08 1x1q h ASN 258 Ca -0.09 0.07 -0.01 0.00 0.71 0.00 0.00 56.30 56.97 1x1q h ASN 258 Cb 1.39 0.35 -0.01 0.00 0.73 0.00 0.00 38.32 40.77 1x1q h ASN 258 CO 0.04 -0.71 0.08 0.00 -1.29 0.00 0.00 177.43 175.55 1x1q h ALA 259 N -1.21 1.70 -0.46 1.57 0.00 -1.90 -2.90 119.26 116.06 1x1q h ALA 259 Ca -0.10 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 1x1q h ALA 259 Cb 0.91 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1x1q h ALA 259 CO 0.09 0.24 -0.23 0.97 0.00 0.00 0.00 179.25 180.32 1x1q h ILE 260 N 0.33 1.27 -0.38 0.00 6.09 -1.92 0.49 117.51 123.39 1x1q h ILE 260 Ca 0.08 -1.39 -0.09 0.00 -1.37 0.00 0.00 64.86 62.10 1x1q h ILE 260 Cb 0.09 1.16 -0.02 0.00 0.47 0.00 0.00 36.82 38.52 1x1q h ILE 260 CO -0.01 0.48 -0.12 1.23 -3.07 0.00 0.00 178.15 176.65 1x1q h GLY 261 N 0.89 0.73 1.39 8.18 0.00 -1.30 -1.31 103.07 111.65 1x1q h GLY 261 Ca 0.10 -0.54 -0.27 0.00 0.00 0.00 0.00 47.33 46.62 1x1q h GLY 261 CO 0.07 0.50 -1.15 -2.00 0.00 0.00 0.00 176.54 173.96 1x1q h LEU 262 N 0.62 0.71 0.25 3.11 5.85 -1.46 -1.43 115.31 122.95 1x1q h LEU 262 Ca 0.11 -0.64 -0.01 0.00 0.84 0.00 0.00 57.88 58.18 1x1q h LEU 262 Cb 0.57 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1x1q h LEU 262 CO 0.04 1.45 -0.12 -0.26 -0.34 0.00 0.00 178.44 179.21 1x1q h PHE 263 N 0.24 -0.31 -0.96 1.25 -1.00 -0.76 -3.39 116.94 112.01 1x1q h PHE 263 Ca -0.14 -0.01 0.20 0.00 2.81 0.00 0.00 57.97 60.83 1x1q h PHE 263 Cb 1.81 0.10 -0.18 0.00 3.61 0.00 0.00 35.95 41.29 1x1q h PHE 263 CO 0.09 0.01 -0.21 0.00 -1.61 0.00 0.00 178.31 176.59 1x1q n ALA 264 N -2.64 0.26 0.52 2.45 0.00 -0.51 0.32 120.51 120.90 1x1q n ALA 264 Ca -0.07 1.05 0.05 0.00 0.00 0.00 0.00 53.44 54.47 1x1q n ALA 264 Cb 0.23 -0.65 0.27 0.00 0.00 0.00 0.00 19.45 19.30 1x1q n ALA 264 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1x1q n PRO 265 N -5.55 0.19 -0.04 0.00 -0.04 -1.26 -3.06 135.00 125.24 1x1q n PRO 265 Ca 0.16 0.14 -0.05 0.00 -0.04 0.00 0.00 63.50 63.72 1x1q n PRO 265 Cb 0.51 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.43 1x1q n PRO 265 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1x1q n PHE 266 N -1.21 0.00 0.08 0.54 3.01 0.15 -4.71 117.46 115.31 1x1q n PHE 266 Ca 0.06 0.00 0.20 0.00 1.01 0.00 0.00 57.45 58.71 1x1q n PHE 266 Cb 0.07 -0.29 0.74 0.00 -0.01 0.00 0.00 39.48 39.99 1x1q n PHE 266 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1x1q h ALA 267 N 0.09 2.22 -0.59 4.37 0.00 -1.07 -1.82 119.26 122.46 1x1q h ALA 267 Ca -0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1x1q h ALA 267 Cb 1.29 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1x1q h ALA 267 CO -0.02 -0.57 0.00 0.66 0.00 0.00 0.00 179.25 179.32 1x1q n TYR 268 N -4.03 1.22 -2.43 0.00 4.01 -1.25 -4.95 117.16 109.74 1x1q n TYR 268 Ca 0.07 -0.60 -0.42 0.00 -0.16 0.00 0.00 57.90 56.79 1x1q n TYR 268 Cb 0.55 -0.18 -0.03 0.00 -0.31 0.00 0.00 39.34 39.36 1x1q n TYR 268 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1x1q s LEU 269 N -1.68 4.41 0.35 7.72 1.43 -0.69 -4.91 118.68 125.32 1x1q s LEU 269 Ca 0.46 2.08 0.17 0.00 -1.03 0.00 0.00 54.13 55.81 1x1q s LEU 269 Cb 0.29 -3.59 1.16 0.00 0.03 0.00 0.00 46.19 44.08 1x1q s LEU 269 CO 0.24 -0.40 1.65 -0.65 0.23 0.00 0.00 176.35 177.42 1x1q h PRO 270 N 6.10 0.25 0.00 1.29 0.11 -1.93 -3.45 132.00 134.36 1x1q h PRO 270 Ca -0.43 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 65.78 1x1q h PRO 270 Cb 1.21 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 1x1q h PRO 270 CO 0.78 0.16 0.27 0.39 -0.21 0.00 0.00 178.00 179.40 1x1q n GLU 271 N -5.06 0.01 -1.10 1.05 -0.58 -1.26 -4.95 120.64 108.76 1x1q n GLU 271 Ca 0.33 -0.16 -0.03 0.00 -0.42 0.00 0.00 57.16 56.88 1x1q n GLU 271 Cb 1.06 0.30 -0.01 0.00 -0.57 0.00 0.00 31.44 32.22 1x1q n GLU 271 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1x1q n GLY 272 N -0.27 0.58 3.72 0.62 0.00 -1.26 -4.94 105.19 103.64 1x1q n GLY 272 Ca 0.02 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 1x1q n GLY 272 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1x1q s ARG 273 N -1.56 4.28 0.66 1.61 3.52 -1.26 -4.91 118.95 121.29 1x1q s ARG 273 Ca 0.00 2.20 -0.13 0.00 -0.13 0.00 0.00 55.73 57.67 1x1q s ARG 273 Cb 0.00 -3.19 -0.01 0.00 -1.56 0.00 0.00 34.95 30.19 1x1q s ARG 273 CO 0.00 -0.49 1.07 -2.14 -0.81 0.00 0.00 175.30 172.94 1x1q s PRO 274 N 0.87 2.98 0.00 5.12 0.02 -1.26 -4.95 135.00 137.78 1x1q s PRO 274 Ca 0.65 1.15 -0.30 0.00 0.02 0.00 0.00 61.00 62.53 1x1q s PRO 274 Cb -0.40 -1.99 -0.04 0.00 0.02 0.00 0.00 34.50 32.09 1x1q s PRO 274 CO 0.33 -1.08 1.20 0.21 -0.33 0.00 0.00 177.00 177.33 1x1q s LYS 275 N -4.48 4.40 -0.24 5.54 2.20 -0.57 -4.87 119.74 121.71 1x1q s LYS 275 Ca 0.62 1.72 -0.12 0.00 -0.36 0.00 0.00 55.97 57.84 1x1q s LYS 275 Cb -0.16 -3.46 -0.05 0.00 -1.51 0.00 0.00 37.83 32.65 1x1q s LYS 275 CO 0.46 -0.34 0.21 -0.51 -0.36 0.00 0.00 175.35 174.80 1x1q s LEU 276 N 1.63 4.11 -0.28 5.43 1.43 -1.26 -1.08 118.68 128.66 1x1q s LEU 276 Ca 0.57 0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.86 1x1q s LEU 276 Cb -0.27 -2.18 0.08 0.00 0.03 0.00 0.00 46.19 43.85 1x1q s LEU 276 CO 0.26 0.02 -0.00 -0.63 0.23 0.00 0.00 176.35 176.23 1x1q s ILE 277 N 1.19 1.74 0.05 -0.59 1.01 -0.12 -1.59 121.20 122.89 1x1q s ILE 277 Ca 0.10 -1.65 -0.18 0.00 0.00 0.00 0.00 60.65 58.92 1x1q s ILE 277 Cb -0.14 -2.11 -0.06 0.00 0.01 0.00 0.00 42.46 40.15 1x1q s ILE 277 CO 0.06 -0.34 0.52 -0.83 0.00 0.00 0.00 174.94 174.35 1x1q s GLY 278 N 1.24 2.61 -0.13 6.18 0.00 -0.71 -2.26 107.32 114.26 1x1q s GLY 278 Ca 0.01 -0.04 0.01 0.00 0.00 0.00 0.00 44.72 44.70 1x1q s GLY 278 CO -0.10 0.36 -0.15 0.14 0.00 0.00 0.00 173.10 173.36 1x1q s VAL 279 N -1.11 2.88 0.25 1.40 1.01 0.01 -1.17 120.40 123.66 1x1q s VAL 279 Ca 0.28 -0.72 0.07 0.00 0.00 0.00 0.00 61.98 61.60 1x1q s VAL 279 Cb -0.19 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 1x1q s VAL 279 CO 0.17 0.53 0.21 -1.61 0.00 0.00 0.00 175.10 174.41 1x1q s GLU 280 N 0.38 2.99 1.04 2.72 2.02 0.39 0.11 118.70 128.35 1x1q s GLU 280 Ca -0.12 -1.01 -0.15 0.00 0.02 0.00 0.00 54.97 53.71 1x1q s GLU 280 Cb -0.16 -2.60 0.21 0.00 0.10 0.00 0.00 34.13 31.67 1x1q s GLU 280 CO 0.06 0.41 1.14 0.00 0.02 0.00 0.00 175.26 176.89 1x1q s ALA 281 N -2.10 1.23 0.24 5.21 0.00 -1.26 -3.51 121.76 121.56 1x1q s ALA 281 Ca 0.33 -0.72 -0.06 0.00 0.00 0.00 0.00 51.96 51.52 1x1q s ALA 281 Cb -0.08 -2.97 0.44 0.00 0.00 0.00 0.00 23.12 20.51 1x1q s ALA 281 CO 0.25 -2.88 1.68 0.00 0.00 0.00 0.00 175.76 174.81 1x1q h ALA 282 N -1.98 0.92 0.00 0.00 0.00 -1.93 -3.44 119.26 112.83 1x1q h ALA 282 Ca -0.49 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1x1q h ALA 282 Cb 1.31 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1x1q h ALA 282 CO 0.49 -0.34 0.00 -1.13 0.00 0.00 0.00 179.25 178.27 1x1q n SER 323 N -5.16 0.00 -4.01 0.00 3.41 -1.26 -5.03 113.62 101.56 1x1q n SER 323 Ca 0.14 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.51 1x1q n SER 323 Cb 0.45 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.23 1x1q n SER 323 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1x1q s VAL 324 N 0.00 1.06 -0.36 -3.33 1.01 -1.26 -5.12 120.40 112.40 1x1q s VAL 324 Ca 0.00 -0.44 -0.07 0.00 0.00 0.00 0.00 61.98 61.47 1x1q s VAL 324 Cb 0.00 -0.98 0.05 0.00 0.00 0.00 0.00 36.38 35.46 1x1q s VAL 324 CO 0.00 0.34 0.15 -0.55 0.00 0.00 0.00 175.10 175.03 1x1q s SER 325 N 0.66 5.38 -0.06 3.32 0.15 -1.26 -5.07 113.70 116.81 1x1q s SER 325 Ca -0.14 -1.28 -0.06 0.00 0.70 0.00 0.00 55.95 55.17 1x1q s SER 325 Cb -0.15 -1.89 -0.04 0.00 -1.71 0.00 0.00 66.02 62.22 1x1q s SER 325 CO 0.03 -0.39 0.19 0.00 1.20 0.00 0.00 173.24 174.27 1x1q s ALA 326 N 1.39 3.88 0.00 5.45 0.00 -1.26 -4.93 121.76 126.29 1x1q s ALA 326 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.33 1x1q s ALA 326 Cb -0.20 -1.99 0.00 0.00 0.00 0.00 0.00 23.12 20.93 1x1q s ALA 326 CO 0.02 0.65 0.00 0.41 0.00 0.00 0.00 175.76 176.84 1x1q n GLY 327 N 1.57 2.52 0.21 0.00 0.00 -1.26 -2.35 105.19 105.88 1x1q n GLY 327 Ca -0.16 0.26 0.05 0.00 0.00 0.00 0.00 46.02 46.17 1x1q n GLY 327 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x1q n LEU 328 N 0.00 2.45 -4.81 0.99 4.77 -1.26 -5.00 117.00 114.14 1x1q n LEU 328 Ca 0.00 -2.47 -0.31 0.00 -0.03 0.00 0.00 56.01 53.21 1x1q n LEU 328 Cb 0.00 -0.23 0.06 0.00 -2.33 0.00 0.00 43.42 40.92 1x1q n LEU 328 CO 0.00 0.62 0.71 -0.62 -1.33 0.00 0.00 177.39 176.77 1x1q s ASP 329 N -1.71 5.09 -0.16 -1.43 2.15 -0.99 -4.37 116.67 115.24 1x1q s ASP 329 Ca 0.18 1.57 -0.16 0.00 0.43 0.00 0.00 52.55 54.57 1x1q s ASP 329 Cb 0.15 -2.40 0.04 0.00 -0.30 0.00 0.00 42.92 40.41 1x1q s ASP 329 CO 0.04 -1.62 0.46 -0.47 -0.17 0.00 0.00 175.17 173.40 1x1q s TYR 330 N -3.05 -0.49 0.59 -5.34 5.04 -1.26 -4.73 117.35 108.11 1x1q s TYR 330 Ca 0.59 1.19 -0.18 0.00 -2.44 0.00 0.00 57.07 56.22 1x1q s TYR 330 Cb -0.14 0.17 -0.03 0.00 0.35 0.00 0.00 41.96 42.31 1x1q s TYR 330 CO 0.55 -0.26 1.18 -1.25 -1.34 0.00 0.00 175.55 174.44 1x1q s PRO 331 N 0.15 3.00 0.00 4.97 0.04 -1.26 -4.89 135.00 137.01 1x1q s PRO 331 Ca -0.01 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.77 1x1q s PRO 331 Cb -0.03 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.57 1x1q s PRO 331 CO 0.01 -1.16 0.00 0.41 0.04 0.00 0.00 177.00 176.30 1x1q n GLY 332 N 0.34 -2.97 0.03 0.56 0.00 -1.26 -4.63 105.19 97.26 1x1q n GLY 332 Ca 0.13 -2.10 0.12 0.00 0.00 0.00 0.00 46.02 44.17 1x1q n GLY 332 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1x1q n VAL 333 N -0.02 0.16 0.00 1.61 0.24 -1.26 -4.97 118.33 114.09 1x1q n VAL 333 Ca 0.00 -0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 1x1q n VAL 333 Cb 0.00 -0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.29 1x1q n VAL 333 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1x1q n GLY 334 N 1.43 1.91 0.14 7.63 0.00 -1.26 -4.65 105.19 110.38 1x1q n GLY 334 Ca 0.05 -2.01 -0.07 0.00 0.00 0.00 0.00 46.02 44.00 1x1q n GLY 334 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1x1q h PRO 335 N 0.00 0.12 -0.53 1.61 0.11 -1.90 -2.89 132.00 128.52 1x1q h PRO 335 Ca 0.00 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.99 1x1q h PRO 335 Cb 0.00 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.06 1x1q h PRO 335 CO 0.00 0.08 -0.12 1.49 -0.21 0.00 0.00 178.00 179.24 1x1q h GLU 336 N 0.13 1.00 -0.03 1.05 4.81 -1.89 -1.42 114.58 118.24 1x1q h GLU 336 Ca 0.14 -0.37 -0.11 0.00 -0.13 0.00 0.00 59.36 58.88 1x1q h GLU 336 Cb 0.17 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 1x1q h GLU 336 CO -0.21 1.06 -0.51 0.45 -0.73 0.00 0.00 179.01 179.07 1x1q h HIS 337 N 0.89 0.10 -0.38 0.92 3.86 -1.82 -1.24 115.15 117.47 1x1q h HIS 337 Ca 0.14 -0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 59.20 1x1q h HIS 337 Cb 0.68 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 29.12 1x1q h HIS 337 CO 0.05 0.58 -0.21 0.77 0.86 0.00 0.00 177.93 179.97 1x1q h SER 338 N 0.07 0.85 -0.38 2.45 0.02 -1.31 -2.24 113.55 113.01 1x1q h SER 338 Ca -0.00 -0.42 -0.10 0.00 -0.84 0.00 0.00 61.79 60.43 1x1q h SER 338 Cb 0.92 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.21 1x1q h SER 338 CO 0.07 1.08 -0.12 0.22 -1.14 0.00 0.00 176.83 176.94 1x1q h TYR 339 N 0.62 0.93 -0.23 3.45 3.20 -1.05 -2.59 116.97 121.29 1x1q h TYR 339 Ca 0.08 -0.18 0.01 0.00 3.14 0.00 0.00 58.73 61.78 1x1q h TYR 339 Cb 0.77 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 1x1q h TYR 339 CO 0.06 0.91 0.14 1.88 -1.64 0.00 0.00 178.16 179.51 1x1q h TYR 340 N 0.75 0.27 0.21 -3.82 0.05 -1.08 -1.52 116.97 111.83 1x1q h TYR 340 Ca 0.12 0.01 0.01 0.00 0.05 0.00 0.00 58.73 58.92 1x1q h TYR 340 Cb 0.63 -0.09 -0.03 0.00 1.01 0.00 0.00 36.73 38.25 1x1q h TYR 340 CO 0.03 0.16 -0.29 0.00 -1.05 0.00 0.00 178.16 177.01 1x1q h ALA 341 N 1.09 -0.57 0.28 3.88 0.00 -1.27 0.21 119.26 122.88 1x1q h ALA 341 Ca 0.09 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1x1q h ALA 341 Cb -0.02 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1x1q h ALA 341 CO -0.03 -0.86 -0.37 -0.44 0.00 0.00 0.00 179.25 177.55 1x1q h ASP 342 N -0.57 -1.02 0.03 0.00 3.45 -1.38 -0.09 116.42 116.84 1x1q h ASP 342 Ca 0.01 0.10 0.00 0.00 0.43 0.00 0.00 57.03 57.57 1x1q h ASP 342 Cb 0.56 0.36 0.00 0.00 -0.56 0.00 0.00 39.33 39.68 1x1q h ASP 342 CO -0.11 -0.49 0.00 0.00 -1.57 0.00 0.00 179.24 177.07 1x1q h ALA 343 N -0.21 1.00 -0.09 3.45 0.00 -1.19 -3.46 119.26 118.77 1x1q h ALA 343 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1x1q h ALA 343 Cb 0.66 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1x1q h ALA 343 CO -0.12 0.00 -0.04 0.41 0.00 0.00 0.00 179.25 179.51 1x1q n GLY 344 N -1.15 0.53 0.35 0.00 0.00 0.57 -4.92 105.19 100.57 1x1q n GLY 344 Ca -0.02 -0.90 0.14 0.00 0.00 0.00 0.00 46.02 45.24 1x1q n GLY 344 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1x1q n VAL 345 N -2.93 0.00 -3.66 1.61 0.24 -0.23 -4.84 118.33 108.51 1x1q n VAL 345 Ca -0.02 -0.18 -0.14 0.00 -2.04 0.00 0.00 64.34 61.96 1x1q n VAL 345 Cb 0.07 0.36 -0.08 0.00 -1.47 0.00 0.00 33.84 32.71 1x1q n VAL 345 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1x1q s ALA 346 N -2.19 -1.40 0.12 2.33 0.00 -1.21 -4.27 121.76 115.14 1x1q s ALA 346 Ca 0.34 1.39 0.10 0.00 0.00 0.00 0.00 51.96 53.79 1x1q s ALA 346 Cb 0.20 -0.62 -0.04 0.00 0.00 0.00 0.00 23.12 22.66 1x1q s ALA 346 CO 0.41 -0.29 -0.26 -1.83 0.00 0.00 0.00 175.76 173.79 1x1q s GLU 347 N -0.20 1.35 0.16 0.00 -1.05 -0.62 -3.86 118.70 114.48 1x1q s GLU 347 Ca -0.04 -1.29 0.10 0.00 -0.15 0.00 0.00 54.97 53.59 1x1q s GLU 347 Cb -0.03 -1.78 -0.04 0.00 -0.44 0.00 0.00 34.13 31.83 1x1q s GLU 347 CO 0.03 0.42 -0.18 0.71 0.95 0.00 0.00 175.26 177.19 1x1q s TYR 348 N -1.07 2.48 0.31 4.83 1.51 -1.26 -1.75 117.35 122.40 1x1q s TYR 348 Ca 0.12 -0.29 -0.08 0.00 -1.01 0.00 0.00 57.07 55.81 1x1q s TYR 348 Cb -0.10 -1.26 0.01 0.00 -0.11 0.00 0.00 41.96 40.50 1x1q s TYR 348 CO 0.05 0.46 0.51 0.00 -1.11 0.00 0.00 175.55 175.46 1x1q s ALA 349 N -1.48 0.19 0.17 3.71 0.00 -0.32 -4.96 121.76 119.08 1x1q s ALA 349 Ca 0.21 -1.17 -0.07 0.00 0.00 0.00 0.00 51.96 50.92 1x1q s ALA 349 Cb -0.09 1.06 -0.02 0.00 0.00 0.00 0.00 23.12 24.08 1x1q s ALA 349 CO 0.11 -0.84 0.25 -1.54 0.00 0.00 0.00 175.76 173.75 1x1q s SER 350 N -3.13 0.08 0.09 0.00 1.04 -1.26 0.15 113.70 110.67 1x1q s SER 350 Ca 0.26 -0.98 -0.00 0.00 0.48 0.00 0.00 55.95 55.71 1x1q s SER 350 Cb -0.01 0.42 -0.04 0.00 0.10 0.00 0.00 66.02 66.49 1x1q s SER 350 CO 0.15 -0.88 -0.02 0.68 0.98 0.00 0.00 173.24 174.14 1x1q s VAL 351 N -4.00 0.34 0.60 5.02 -7.23 -1.23 -4.94 120.40 108.96 1x1q s VAL 351 Ca 0.21 -1.87 -0.12 0.00 -1.81 0.00 0.00 61.98 58.38 1x1q s VAL 351 Cb 0.04 -1.70 -0.04 0.00 0.56 0.00 0.00 36.38 35.23 1x1q s VAL 351 CO 0.02 -0.83 1.02 0.42 -0.31 0.00 0.00 175.10 175.43 1x1q s THR 352 N -3.86 4.59 0.24 5.32 -4.23 -1.26 -3.88 115.64 112.56 1x1q s THR 352 Ca 0.13 0.94 -0.04 0.00 -1.18 0.00 0.00 61.69 61.53 1x1q s THR 352 Cb 0.07 -3.78 0.21 0.00 1.34 0.00 0.00 72.50 70.34 1x1q s THR 352 CO -0.05 -1.00 1.78 0.44 -0.54 0.00 0.00 174.62 175.24 1x1q h ASP 353 N -0.05 0.51 -0.15 3.99 3.32 -1.98 -0.99 116.42 121.06 1x1q h ASP 353 Ca -0.45 0.07 -0.04 0.00 0.02 0.00 0.00 57.03 56.64 1x1q h ASP 353 Cb 1.19 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 1x1q h ASP 353 CO 0.61 0.26 -0.01 -0.08 -1.72 0.00 0.00 179.24 178.30 1x1q h GLU 354 N 0.63 0.39 -0.24 3.56 4.22 -1.99 -1.77 114.58 119.39 1x1q h GLU 354 Ca 0.40 -0.07 -0.20 0.00 0.08 0.00 0.00 59.36 59.57 1x1q h GLU 354 Cb 0.48 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1x1q h GLU 354 CO -0.31 0.43 -0.63 0.93 -2.18 0.00 0.00 179.01 177.26 1x1q h GLU 355 N 0.38 0.83 -0.35 1.92 5.08 -1.57 -2.68 114.58 118.19 1x1q h GLU 355 Ca 0.09 -0.58 -0.14 0.00 -1.00 0.00 0.00 59.36 57.73 1x1q h GLU 355 Cb 0.28 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1x1q h GLU 355 CO 0.01 1.20 -0.33 0.00 -1.00 0.00 0.00 179.01 178.89 1x1q h ALA 356 N 0.66 0.75 -0.30 3.43 0.00 -1.24 -2.37 119.26 120.20 1x1q h ALA 356 Ca -0.01 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 1x1q h ALA 356 Cb 1.24 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1x1q h ALA 356 CO 0.13 0.66 0.11 1.25 0.00 0.00 0.00 179.25 181.40 1x1q h LEU 357 N 0.66 0.37 -0.61 0.00 5.85 -1.30 -0.71 115.31 119.58 1x1q h LEU 357 Ca 0.07 -0.03 -0.14 0.00 0.84 0.00 0.00 57.88 58.62 1x1q h LEU 357 Cb 0.87 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.79 1x1q h LEU 357 CO 0.08 0.36 -0.65 -0.08 -0.34 0.00 0.00 178.44 177.80 1x1q h GLU 358 N 0.42 0.00 -0.19 1.25 4.57 -1.11 -3.10 114.58 116.41 1x1q h GLU 358 Ca 0.10 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 58.07 1x1q h GLU 358 Cb 0.11 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.71 1x1q h GLU 358 CO -0.01 0.65 -0.71 0.78 -1.18 0.00 0.00 179.01 178.54 1x1q h GLY 359 N 2.17 0.91 0.06 1.92 0.00 -0.68 -1.11 103.07 106.35 1x1q h GLY 359 Ca -0.01 -1.22 0.07 0.00 0.00 0.00 0.00 47.33 46.17 1x1q h GLY 359 CO 0.08 1.09 -0.26 -2.75 0.00 0.00 0.00 176.54 174.70 1x1q h PHE 360 N 0.59 -0.71 -0.29 5.60 3.04 -1.20 -1.41 116.94 122.55 1x1q h PHE 360 Ca -0.03 0.04 -0.11 0.00 3.98 0.00 0.00 57.97 61.85 1x1q h PHE 360 Cb 1.34 0.36 -0.01 0.00 2.56 0.00 0.00 35.95 40.19 1x1q h PHE 360 CO 0.08 -0.34 -0.29 0.87 -2.02 0.00 0.00 178.31 176.62 1x1q h LYS 361 N -0.25 0.60 -0.47 1.11 1.57 -1.51 -2.81 116.57 114.80 1x1q h LYS 361 Ca 0.15 -0.25 -0.04 0.00 -1.87 0.00 0.00 60.65 58.64 1x1q h LYS 361 Cb 0.49 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.75 1x1q h LYS 361 CO -0.43 0.82 0.15 1.25 -0.57 0.00 0.00 179.45 180.67 1x1q h LEU 362 N 0.52 0.68 -0.78 2.94 5.85 -0.44 -2.12 115.31 121.95 1x1q h LEU 362 Ca 0.07 -0.20 -0.11 0.00 0.84 0.00 0.00 57.88 58.47 1x1q h LEU 362 Cb 0.76 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 1x1q h LEU 362 CO 0.06 0.70 -0.54 0.25 -0.34 0.00 0.00 178.44 178.57 1x1q h LEU 363 N 0.63 0.00 -0.24 2.25 5.85 -1.29 -2.40 115.31 120.11 1x1q h LEU 363 Ca 0.15 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.79 1x1q h LEU 363 Cb 0.26 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.29 1x1q h LEU 363 CO -0.01 0.54 -0.19 0.00 -0.34 0.00 0.00 178.44 178.44 1x1q h ALA 364 N 1.46 0.34 -0.33 1.25 0.00 -1.31 -1.90 119.26 118.77 1x1q h ALA 364 Ca -0.01 -0.35 -0.15 0.00 0.00 0.00 0.00 54.91 54.40 1x1q h ALA 364 Cb 1.05 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 1x1q h ALA 364 CO 0.07 0.27 -0.40 -0.09 0.00 0.00 0.00 179.25 179.10 1x1q h ARG 365 N 0.25 0.84 0.02 0.00 2.43 -1.36 -2.42 114.38 114.14 1x1q h ARG 365 Ca 0.04 -0.47 -0.31 0.00 -0.81 0.00 0.00 59.98 58.43 1x1q h ARG 365 Cb 0.73 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.27 1x1q h ARG 365 CO 0.05 1.11 -1.81 1.28 -1.51 0.00 0.00 179.97 179.09 1x1q n LEU 366 N -4.12 1.09 -0.00 3.80 4.77 -0.91 -4.56 117.00 117.07 1x1q n LEU 366 Ca -0.03 0.35 0.03 0.00 -0.03 0.00 0.00 56.01 56.33 1x1q n LEU 366 Cb 0.55 -0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.59 1x1q n LEU 366 CO 0.48 0.47 -0.18 -0.62 -1.33 0.00 0.00 177.39 176.21 1x1q n GLU 367 N -3.09 3.43 -1.18 3.23 -0.58 -0.74 -4.63 120.64 117.09 1x1q n GLU 367 Ca -0.21 -0.02 -0.03 0.00 -0.42 0.00 0.00 57.16 56.49 1x1q n GLU 367 Cb 1.06 -0.93 -0.01 0.00 -0.57 0.00 0.00 31.44 30.99 1x1q n GLU 367 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1x1q n GLY 368 N 1.43 0.56 3.14 0.62 0.00 -0.91 -5.02 105.19 105.00 1x1q n GLY 368 Ca 0.01 -0.94 -0.33 0.00 0.00 0.00 0.00 46.02 44.76 1x1q n GLY 368 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x1q s ILE 369 N -2.11 2.20 -0.54 -0.61 1.01 -1.16 -4.98 121.20 115.02 1x1q s ILE 369 Ca 0.00 -0.92 -0.19 0.00 0.00 0.00 0.00 60.65 59.54 1x1q s ILE 369 Cb 0.00 -1.95 0.07 0.00 0.01 0.00 0.00 42.46 40.59 1x1q s ILE 369 CO 0.00 0.50 0.66 -0.63 0.00 0.00 0.00 174.94 175.48 1x1q s ILE 370 N 1.30 4.83 0.87 2.92 1.01 -1.26 -2.86 121.20 128.01 1x1q s ILE 370 Ca 0.05 -0.61 -0.12 0.00 0.00 0.00 0.00 60.65 59.96 1x1q s ILE 370 Cb -0.13 -4.37 0.11 0.00 0.01 0.00 0.00 42.46 38.08 1x1q s ILE 370 CO -0.12 -0.92 1.11 -2.16 0.00 0.00 0.00 174.94 172.85 1x1q s PRO 371 N 2.71 1.50 0.49 2.79 0.04 -1.26 -1.11 135.00 140.17 1x1q s PRO 371 Ca 0.15 0.51 -0.19 0.00 0.04 0.00 0.00 61.00 61.51 1x1q s PRO 371 Cb -0.20 -1.86 -0.08 0.00 0.04 0.00 0.00 34.50 32.39 1x1q s PRO 371 CO 0.10 -1.99 1.02 0.00 0.04 0.00 0.00 177.00 176.17 1x1q s ALA 372 N -3.16 2.90 0.49 8.56 0.00 -1.17 -3.00 121.76 126.38 1x1q s ALA 372 Ca 0.63 0.50 0.21 0.00 0.00 0.00 0.00 51.96 53.29 1x1q s ALA 372 Cb -0.15 -3.22 1.24 0.00 0.00 0.00 0.00 23.12 20.99 1x1q s ALA 372 CO 0.54 -0.29 1.98 -0.07 0.00 0.00 0.00 175.76 177.92 1x1q h LEU 373 N 1.42 0.17 -0.33 0.00 3.38 -1.91 -1.12 115.31 116.92 1x1q h LEU 373 Ca -0.49 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.46 1x1q h LEU 373 Cb 1.21 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1x1q h LEU 373 CO 0.59 0.09 0.07 -0.08 0.09 0.00 0.00 178.44 179.21 1x1q h GLU 374 N 0.18 0.53 0.00 1.13 4.81 -1.97 -2.59 114.58 116.67 1x1q h GLU 374 Ca 0.28 -0.13 -0.07 0.00 -0.13 0.00 0.00 59.36 59.31 1x1q h GLU 374 Cb 0.86 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 1x1q h GLU 374 CO -0.05 0.60 -0.31 0.77 -0.73 0.00 0.00 179.01 179.29 1x1q h SER 375 N 0.37 0.00 0.37 1.04 0.02 -1.57 -2.15 113.55 111.64 1x1q h SER 375 Ca 0.10 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 1x1q h SER 375 Cb 0.31 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.85 1x1q h SER 375 CO 0.00 0.31 -0.09 0.00 -1.14 0.00 0.00 176.83 175.92 1x1q h ALA 376 N 1.69 1.24 -0.37 3.77 0.00 -0.88 -0.95 119.26 123.75 1x1q h ALA 376 Ca -0.00 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.68 1x1q h ALA 376 Cb 0.65 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1x1q h ALA 376 CO 0.04 0.11 -0.35 0.45 0.00 0.00 0.00 179.25 179.50 1x1q h HIS 377 N 0.00 1.07 -0.30 0.00 -0.00 -1.25 -0.02 115.15 114.65 1x1q h HIS 377 Ca -0.00 -0.32 -0.18 0.00 -0.00 0.00 0.00 60.37 59.87 1x1q h HIS 377 Cb 0.30 -0.23 -0.00 0.00 -0.00 0.00 0.00 27.41 27.48 1x1q h HIS 377 CO 0.00 1.13 -0.52 0.00 -0.00 0.00 0.00 177.93 178.55 1x1q h ALA 378 N 0.77 0.52 0.10 2.45 0.00 -1.45 -1.34 119.26 120.30 1x1q h ALA 378 Ca 0.06 -0.50 0.01 0.00 0.00 0.00 0.00 54.91 54.48 1x1q h ALA 378 Cb 0.94 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 1x1q h ALA 378 CO 0.09 0.68 -0.19 0.82 0.00 0.00 0.00 179.25 180.65 1x1q h ILE 379 N 0.66 0.57 -0.69 0.00 1.08 -1.05 0.14 117.51 118.22 1x1q h ILE 379 Ca 0.02 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.60 1x1q h ILE 379 Cb 1.11 0.57 -0.08 0.00 -3.07 0.00 0.00 36.82 35.36 1x1q h ILE 379 CO 0.11 0.00 0.31 0.00 -0.69 0.00 0.00 178.15 177.89 1x1q h ALA 380 N 0.48 0.95 -0.57 1.87 0.00 -0.92 -1.20 119.26 119.86 1x1q h ALA 380 Ca 0.03 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1x1q h ALA 380 Cb 0.38 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1x1q h ALA 380 CO -0.11 -0.12 0.00 -0.92 0.00 0.00 0.00 179.25 178.11 1x1q h TYR 381 N 0.52 1.06 0.00 0.00 3.20 -0.45 -1.97 116.97 119.33 1x1q h TYR 381 Ca 0.35 -0.17 -0.02 0.00 3.14 0.00 0.00 58.73 62.03 1x1q h TYR 381 Cb 0.43 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 38.41 1x1q h TYR 381 CO -0.13 0.94 -0.11 0.00 -1.64 0.00 0.00 178.16 177.22 1x1q h ALA 382 N 1.09 1.60 0.00 1.82 0.00 0.33 -0.78 119.26 123.32 1x1q h ALA 382 Ca 0.16 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1x1q h ALA 382 Cb 0.52 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1x1q h ALA 382 CO 0.03 0.13 -0.04 0.00 0.00 0.00 0.00 179.25 179.37 1x1q h ALA 383 N 1.89 1.33 -0.01 0.00 0.00 -0.46 0.52 119.26 122.53 1x1q h ALA 383 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1x1q h ALA 383 Cb 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1x1q h ALA 383 CO 0.01 0.05 -0.30 1.63 0.00 0.00 0.00 179.25 180.64 1x1q n LYS 384 N -3.60 1.11 0.00 0.00 5.02 -0.30 -4.56 118.16 115.83 1x1q n LYS 384 Ca -0.02 -0.78 0.00 0.00 -2.02 0.00 0.00 58.31 55.49 1x1q n LYS 384 Cb 0.14 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.66 1x1q n LYS 384 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1x1q n VAL 385 N -0.27 0.00 -0.10 -0.18 0.24 -0.85 -4.88 118.33 112.30 1x1q n VAL 385 Ca 0.12 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.31 1x1q n VAL 385 Cb 0.40 -0.24 -0.03 0.00 -1.47 0.00 0.00 33.84 32.50 1x1q n VAL 385 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 1x1q h VAL 386 N 0.00 1.24 -0.38 3.34 2.07 -1.16 -3.14 116.25 118.22 1x1q h VAL 386 Ca 0.00 -0.83 0.06 0.00 0.82 0.00 0.00 66.70 66.75 1x1q h VAL 386 Cb 0.27 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1x1q h VAL 386 CO 0.00 0.27 0.26 1.55 0.02 0.00 0.00 177.57 179.67 1x1q h PRO 387 N 0.30 0.25 0.00 1.57 0.13 -1.78 -2.56 132.00 129.92 1x1q h PRO 387 Ca 0.09 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1x1q h PRO 387 Cb 0.36 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.44 1x1q h PRO 387 CO 0.01 0.16 0.00 0.39 -0.23 0.00 0.00 178.00 178.33 1x1q n GLU 388 N -4.47 0.35 -4.50 0.86 1.02 -1.19 -3.88 120.64 108.82 1x1q n GLU 388 Ca 0.05 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.88 1x1q n GLU 388 Cb 0.27 -1.10 -0.11 0.00 -0.02 0.00 0.00 31.44 30.48 1x1q n GLU 388 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1x1q s ASP 390 N -1.72 4.23 0.00 1.62 -0.00 -1.26 -4.97 116.67 114.58 1x1q s ASP 390 Ca 0.03 -0.31 0.01 0.00 -0.00 0.00 0.00 52.55 52.29 1x1q s ASP 390 Cb 0.01 -0.84 0.05 0.00 -0.00 0.00 0.00 42.92 42.15 1x1q s ASP 390 CO 0.02 0.25 0.96 0.29 -0.00 0.00 0.00 175.17 176.69 1x1q n LYS 391 N 1.41 0.01 0.00 8.23 5.02 -1.23 -0.78 118.16 130.82 1x1q n LYS 391 Ca -0.15 0.40 0.10 0.00 -2.02 0.00 0.00 58.31 56.64 1x1q n LYS 391 Cb 0.52 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 34.02 1x1q n LYS 391 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1x1q n ASP 392 N -1.42 1.91 -4.89 4.39 5.75 -1.26 -4.33 116.55 116.70 1x1q n ASP 392 Ca 0.00 -1.45 -0.30 0.00 -0.01 0.00 0.00 54.79 53.03 1x1q n ASP 392 Cb 0.01 0.50 -0.03 0.00 -1.03 0.00 0.00 41.12 40.57 1x1q n ASP 392 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1x1q s GLN 393 N -2.39 3.72 -0.06 0.11 -0.21 0.04 -4.92 119.66 115.95 1x1q s GLN 393 Ca 0.17 0.25 0.05 0.00 0.02 0.00 0.00 55.36 55.85 1x1q s GLN 393 Cb 0.17 -2.52 -0.02 0.00 1.00 0.00 0.00 33.01 31.64 1x1q s GLN 393 CO 0.55 0.10 -0.21 0.08 -2.12 0.00 0.00 175.29 173.70 1x1q s VAL 394 N -2.20 2.42 -0.08 1.09 1.01 -1.26 0.14 120.40 121.53 1x1q s VAL 394 Ca 0.48 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.53 1x1q s VAL 394 Cb -0.11 -1.91 0.02 0.00 0.00 0.00 0.00 36.38 34.38 1x1q s VAL 394 CO 0.30 0.57 -0.12 -0.69 0.00 0.00 0.00 175.10 175.16 1x1q s VAL 395 N -0.30 1.14 -0.19 2.92 1.01 0.78 -1.23 120.40 124.52 1x1q s VAL 395 Ca 0.01 -0.45 -0.07 0.00 0.00 0.00 0.00 61.98 61.46 1x1q s VAL 395 Cb -0.13 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 1x1q s VAL 395 CO 0.02 0.36 0.06 -0.69 0.00 0.00 0.00 175.10 174.86 1x1q s VAL 396 N 0.89 4.71 -0.12 2.92 1.01 -0.41 -0.28 120.40 129.13 1x1q s VAL 396 Ca -0.10 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 61.83 1x1q s VAL 396 Cb -0.15 -3.13 -0.01 0.00 0.00 0.00 0.00 36.38 33.08 1x1q s VAL 396 CO 0.01 0.44 -0.15 -0.63 0.00 0.00 0.00 175.10 174.77 1x1q s ILE 397 N 0.55 2.84 -0.16 2.22 1.01 0.12 -0.91 121.20 126.86 1x1q s ILE 397 Ca 0.03 -0.74 -0.24 0.00 0.00 0.00 0.00 60.65 59.70 1x1q s ILE 397 Cb -0.13 -2.17 -0.02 0.00 0.01 0.00 0.00 42.46 40.15 1x1q s ILE 397 CO 0.01 0.53 0.78 0.21 0.00 0.00 0.00 174.94 176.48 1x1q s ASN 398 N 0.31 6.91 -0.86 3.58 2.47 -0.51 -0.84 114.94 125.99 1x1q s ASN 398 Ca -0.12 1.11 -0.07 0.00 0.42 0.00 0.00 52.86 54.20 1x1q s ASN 398 Cb -0.16 -2.43 0.22 0.00 -1.45 0.00 0.00 41.25 37.43 1x1q s ASN 398 CO 0.06 -0.35 0.77 -0.76 -3.72 0.00 0.00 177.10 173.11 1x1q s LEU 399 N 1.98 6.04 0.19 3.21 1.02 -0.89 -4.72 118.68 125.51 1x1q s LEU 399 Ca 0.36 -3.18 -0.20 0.00 0.02 0.00 0.00 54.13 51.13 1x1q s LEU 399 Cb -0.17 -2.06 0.13 0.00 0.02 0.00 0.00 46.19 44.12 1x1q s LEU 399 CO 0.13 -0.37 1.59 0.77 0.02 0.00 0.00 176.35 178.49 1x1q h SER 400 N 6.93 -1.10 -4.34 2.29 4.64 -1.90 -2.86 113.55 117.21 1x1q h SER 400 Ca 0.11 0.22 -0.36 0.00 -0.47 0.00 0.00 61.79 61.29 1x1q h SER 400 Cb 0.93 0.56 -0.09 0.00 -0.31 0.00 0.00 62.40 63.48 1x1q h SER 400 CO 0.82 -0.30 -0.28 0.61 -0.87 0.00 0.00 176.83 176.82 1x1q n GLY 401 N -1.44 2.44 3.88 -0.77 0.00 -1.26 -2.32 105.19 105.72 1x1q n GLY 401 Ca 0.04 -1.73 -0.32 0.00 0.00 0.00 0.00 46.02 44.02 1x1q n GLY 401 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1x1q s ARG 402 N -3.02 3.72 -0.13 1.61 1.70 -1.02 -3.04 118.95 118.77 1x1q s ARG 402 Ca 0.33 0.11 0.10 0.00 -0.47 0.00 0.00 55.73 55.80 1x1q s ARG 402 Cb 0.00 -2.73 0.50 0.00 -0.57 0.00 0.00 34.95 32.15 1x1q s ARG 402 CO 0.24 0.38 1.30 0.41 -1.08 0.00 0.00 175.30 176.54 1x1q n GLY 403 N -0.07 2.25 0.00 3.88 0.00 -0.27 -4.38 105.19 106.61 1x1q n GLY 403 Ca -0.01 -0.57 0.04 0.00 0.00 0.00 0.00 46.02 45.48 1x1q n GLY 403 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1x1q n ASP 404 N 0.47 0.00 -0.12 1.61 8.00 -1.26 -1.80 116.55 123.46 1x1q n ASP 404 Ca 0.17 -0.11 -0.22 0.00 0.71 0.00 0.00 54.79 55.34 1x1q n ASP 404 Cb 0.78 -0.10 -0.09 0.00 -0.02 0.00 0.00 41.12 41.69 1x1q n ASP 404 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1x1q n LYS 405 N -1.10 0.51 0.00 -1.24 2.85 -1.26 -4.45 118.16 113.47 1x1q n LYS 405 Ca 0.05 0.19 0.11 0.00 -1.05 0.00 0.00 58.31 57.62 1x1q n LYS 405 Cb 0.04 -1.36 0.56 0.00 -0.65 0.00 0.00 35.03 33.62 1x1q n LYS 405 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1x1q n ASP 406 N -3.78 0.00 0.21 -5.58 8.00 -1.01 -3.31 116.55 111.08 1x1q n ASP 406 Ca -0.44 0.02 0.05 0.00 0.71 0.00 0.00 54.79 55.13 1x1q n ASP 406 Cb 0.85 -0.31 0.45 0.00 -0.02 0.00 0.00 41.12 42.09 1x1q n ASP 406 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 1x1q h VAL 407 N 0.00 1.06 -0.03 2.53 3.04 -1.57 0.58 116.25 121.86 1x1q h VAL 407 Ca 0.00 -1.07 -0.22 0.00 -1.01 0.00 0.00 66.70 64.40 1x1q h VAL 407 Cb 0.23 1.60 0.00 0.00 -2.01 0.00 0.00 31.29 31.12 1x1q h VAL 407 CO 0.00 0.29 -0.88 0.74 -1.01 0.00 0.00 177.57 176.71 1x1q h THR 408 N 0.00 1.38 -0.01 3.17 2.02 -1.84 -3.29 112.91 114.33 1x1q h THR 408 Ca -0.00 -2.32 -0.01 0.00 0.77 0.00 0.00 66.41 64.85 1x1q h THR 408 Cb 0.58 2.30 -0.00 0.00 -1.74 0.00 0.00 68.15 69.29 1x1q h THR 408 CO 0.04 0.70 -0.02 -0.08 0.37 0.00 0.00 175.52 176.52 1x1q h GLU 409 N 0.28 0.04 -2.00 6.66 4.81 -1.65 -2.99 114.58 119.74 1x1q h GLU 409 Ca -0.07 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1x1q h GLU 409 Cb 1.50 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.88 1x1q h GLU 409 CO 0.16 0.58 0.00 0.28 -0.73 0.00 0.00 179.01 179.30 1x1q n VAL 410 N -4.79 0.04 0.00 0.32 0.31 0.16 -2.78 118.33 111.60 1x1q n VAL 410 Ca -0.08 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1x1q n VAL 410 Cb 0.30 -0.95 0.00 0.00 -0.91 0.00 0.00 33.84 32.28 1x1q n VAL 410 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1x1q n ARG 412 N 1.86 0.00 0.00 5.55 0.63 -1.13 -3.31 116.66 120.25 1x1q n ARG 412 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1x1q n ARG 412 Cb 0.01 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.92 1x1q n ARG 412 CO 0.00 0.00 0.00 1.47 -2.51 0.00 0.00 177.63 176.59 1x1q n LEU 413 N 0.00 0.13 -0.26 6.15 -0.00 -1.12 -2.04 117.00 119.86 1x1q n LEU 413 Ca 0.00 -0.06 0.04 0.00 -0.00 0.00 0.00 56.01 55.98 1x1q n LEU 413 Cb 0.00 -0.06 0.05 0.00 -0.00 0.00 0.00 43.42 43.41 1x1q n LEU 413 CO 0.00 0.03 0.39 0.18 -0.00 0.00 0.00 177.39 177.99 1x1q n LEU 414 N -0.13 1.00 0.00 1.47 4.77 -1.21 -5.23 117.00 117.67 1x1q n LEU 414 Ca 0.00 -1.75 0.00 0.00 -0.03 0.00 0.00 56.01 54.23 1x1q n LEU 414 Cb 0.03 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1x1q n LEU 414 CO 0.00 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.08