#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h2m n PRO 16 N 0.00 2.34 -1.15 5.31 -0.02 -1.26 -4.94 135.00 135.28 1h2m n PRO 16 Ca 0.00 0.83 -0.31 0.00 -2.02 0.00 0.00 63.50 62.00 1h2m n PRO 16 Cb 0.00 -2.53 0.11 0.00 -0.02 0.00 0.00 33.50 31.06 1h2m n PRO 16 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1h2m s ARG 17 N -0.77 1.96 -0.16 -0.52 0.52 -1.26 -4.86 118.95 113.86 1h2m s ARG 17 Ca 0.64 1.30 -0.13 0.00 -0.52 0.00 0.00 55.73 57.02 1h2m s ARG 17 Cb -0.57 -1.85 -0.05 0.00 0.52 0.00 0.00 34.95 33.00 1h2m s ARG 17 CO 0.52 -1.88 0.27 -1.21 0.02 0.00 0.00 175.30 173.01 1h2m s GLU 18 N -4.75 4.22 0.21 3.54 0.41 -1.26 -2.81 118.70 118.25 1h2m s GLU 18 Ca 0.63 0.05 -0.30 0.00 -0.41 0.00 0.00 54.97 54.95 1h2m s GLU 18 Cb -0.19 -3.41 -0.08 0.00 -1.78 0.00 0.00 34.13 28.66 1h2m s GLU 18 CO 0.55 0.27 1.20 -1.21 -0.49 0.00 0.00 175.26 175.58 1h2m s GLU 19 N 0.38 4.50 0.29 1.61 2.02 -0.46 -4.96 118.70 122.08 1h2m s GLU 19 Ca 0.15 1.89 -0.28 0.00 0.02 0.00 0.00 54.97 56.75 1h2m s GLU 19 Cb -0.13 -3.22 -0.14 0.00 0.10 0.00 0.00 34.13 30.74 1h2m s GLU 19 CO 0.03 -0.06 1.03 0.00 0.02 0.00 0.00 175.26 176.28 1h2m n ALA 20 N 2.25 -0.18 -0.66 5.21 0.00 -1.26 -2.76 120.51 123.11 1h2m n ALA 20 Ca 0.03 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1h2m n ALA 20 Cb 0.44 -2.03 0.00 0.00 0.00 0.00 0.00 19.45 17.86 1h2m n ALA 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h2m n GLY 21 N 1.25 0.61 3.28 0.00 0.00 -1.26 -3.97 105.19 105.10 1h2m n GLY 21 Ca 0.10 -0.56 -0.22 0.00 0.00 0.00 0.00 46.02 45.34 1h2m n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2m n ALA 22 N -0.03 -1.12 1.59 4.61 0.00 -1.12 -4.88 120.51 119.57 1h2m n ALA 22 Ca 0.00 0.35 0.06 0.00 0.00 0.00 0.00 53.44 53.84 1h2m n ALA 22 Cb 0.00 -4.71 0.26 0.00 0.00 0.00 0.00 19.45 15.00 1h2m n ALA 22 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1h2m n LEU 23 N -4.41 0.76 0.00 0.00 4.77 -1.11 -5.00 117.00 112.00 1h2m n LEU 23 Ca -0.03 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 1h2m n LEU 23 Cb 0.58 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1h2m n LEU 23 CO 0.55 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.40 1h2m n GLY 24 N 0.83 -2.16 3.75 -0.72 0.00 -1.26 -4.86 105.19 100.77 1h2m n GLY 24 Ca 0.10 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 44.02 1h2m n GLY 24 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h2m s PRO 25 N -0.19 4.50 0.28 1.61 0.04 -1.26 -1.35 135.00 138.63 1h2m s PRO 25 Ca 0.00 1.95 -0.02 0.00 0.04 0.00 0.00 61.00 62.97 1h2m s PRO 25 Cb 0.00 -3.18 0.41 0.00 0.04 0.00 0.00 34.50 31.77 1h2m s PRO 25 CO 0.00 -0.04 1.89 0.00 0.04 0.00 0.00 177.00 178.90 1h2m h ALA 26 N 4.40 1.30 -2.98 8.56 0.00 -1.85 -3.47 119.26 125.21 1h2m h ALA 26 Ca -0.46 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.25 1h2m h ALA 26 Cb 1.22 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1h2m h ALA 26 CO 0.70 0.55 0.17 1.67 0.00 0.00 0.00 179.25 182.34 1h2m s TRP 27 N -5.58 0.30 0.19 0.00 1.48 -1.26 -5.07 118.94 108.99 1h2m s TRP 27 Ca -0.11 -0.86 0.00 0.00 -1.06 0.00 0.00 56.10 54.07 1h2m s TRP 27 Cb 0.17 0.63 -0.04 0.00 -1.16 0.00 0.00 33.47 33.06 1h2m s TRP 27 CO 0.80 -1.45 0.07 0.16 -4.06 0.00 0.00 176.95 172.48 1h2m s ASP 28 N -3.09 0.65 0.34 -2.66 1.47 -1.26 -4.80 116.67 107.32 1h2m s ASP 28 Ca 0.18 -1.29 0.11 0.00 1.18 0.00 0.00 52.55 52.73 1h2m s ASP 28 Cb -0.04 0.25 0.91 0.00 -0.34 0.00 0.00 42.92 43.70 1h2m s ASP 28 CO 0.13 -0.73 1.75 1.05 0.68 0.00 0.00 175.17 178.06 1h2m h GLU 29 N 2.65 0.56 0.00 2.11 -0.00 -2.03 -1.28 114.58 116.59 1h2m h GLU 29 Ca -0.36 -0.03 0.00 0.00 -0.00 0.00 0.00 59.36 58.96 1h2m h GLU 29 Cb 1.22 -0.13 0.00 0.00 -0.00 0.00 0.00 28.75 29.85 1h2m h GLU 29 CO 0.59 0.37 0.00 -1.13 -0.00 0.00 0.00 179.01 178.83 1h2m n SER 30 N -4.78 0.60 -0.23 3.06 3.41 -1.26 -0.84 113.62 113.58 1h2m n SER 30 Ca 0.26 0.76 0.13 0.00 -0.26 0.00 0.00 58.87 59.75 1h2m n SER 30 Cb 0.74 -0.84 0.43 0.00 -0.26 0.00 0.00 64.21 64.28 1h2m n SER 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1h2m n GLN 31 N -2.28 0.84 -3.64 4.33 6.02 -0.48 -4.86 117.38 117.31 1h2m n GLN 31 Ca -0.01 -0.46 -0.37 0.00 -0.01 0.00 0.00 57.00 56.15 1h2m n GLN 31 Cb 0.07 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 29.77 1h2m n GLN 31 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1h2m s LEU 32 N -2.48 4.38 0.69 1.08 1.43 -0.02 -2.19 118.68 121.58 1h2m s LEU 32 Ca 0.26 0.67 -0.12 0.00 -1.03 0.00 0.00 54.13 53.91 1h2m s LEU 32 Cb 0.19 -2.35 0.01 0.00 0.03 0.00 0.00 46.19 44.07 1h2m s LEU 32 CO 0.50 0.29 1.07 -0.13 0.23 0.00 0.00 176.35 178.31 1h2m s ARG 33 N -0.64 2.85 -0.04 1.70 0.52 -1.26 -5.04 118.95 117.05 1h2m s ARG 33 Ca 0.19 1.07 0.01 0.00 -0.52 0.00 0.00 55.73 56.47 1h2m s ARG 33 Cb -0.14 -1.97 -0.03 0.00 0.52 0.00 0.00 34.95 33.32 1h2m s ARG 33 CO 0.08 -1.18 -0.02 -1.54 0.02 0.00 0.00 175.30 172.66 1h2m s SER 34 N -3.46 5.03 0.23 0.23 1.04 -1.26 -5.10 113.70 110.40 1h2m s SER 34 Ca 0.60 0.02 -0.00 0.00 0.48 0.00 0.00 55.95 57.05 1h2m s SER 34 Cb -0.15 -1.32 -0.04 0.00 0.10 0.00 0.00 66.02 64.60 1h2m s SER 34 CO 0.51 0.32 0.12 -0.31 0.98 0.00 0.00 173.24 174.86 1h2m s TYR 35 N -0.98 1.32 -2.30 5.02 2.02 -1.26 -4.95 117.35 116.23 1h2m s TYR 35 Ca 0.16 -1.30 0.29 0.00 -0.37 0.00 0.00 57.07 55.86 1h2m s TYR 35 Cb -0.11 -0.71 1.29 0.00 -0.40 0.00 0.00 41.96 42.03 1h2m s TYR 35 CO 0.06 -0.51 1.88 -1.13 -1.57 0.00 0.00 175.55 174.28 1h2m n SER 36 N -0.36 1.02 -4.42 2.29 3.41 -1.26 -4.90 113.62 109.40 1h2m n SER 36 Ca 0.01 -1.30 -0.26 0.00 -0.26 0.00 0.00 58.87 57.06 1h2m n SER 36 Cb 0.66 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.50 1h2m n SER 36 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1h2m s PHE 37 N -2.04 2.26 0.63 7.33 -0.12 -1.26 -5.09 117.98 119.69 1h2m s PHE 37 Ca 0.40 -0.36 -0.08 0.00 -0.05 0.00 0.00 56.93 56.84 1h2m s PHE 37 Cb 0.21 -1.11 0.01 0.00 -0.63 0.00 0.00 43.02 41.51 1h2m s PHE 37 CO 0.36 0.51 0.97 -1.25 -0.05 0.00 0.00 175.22 175.75 1h2m s PRO 38 N -2.76 2.86 0.14 1.99 0.04 -1.26 -4.94 135.00 131.08 1h2m s PRO 38 Ca 0.21 0.13 -0.08 0.00 0.04 0.00 0.00 61.00 61.30 1h2m s PRO 38 Cb -0.07 -2.19 -0.01 0.00 0.04 0.00 0.00 34.50 32.26 1h2m s PRO 38 CO 0.10 -0.83 0.23 0.95 0.04 0.00 0.00 177.00 177.48 1h2m s THR 39 N -3.12 0.09 0.20 1.26 -4.23 -1.26 -1.92 115.64 106.66 1h2m s THR 39 Ca 0.55 -1.42 0.10 0.00 -1.18 0.00 0.00 61.69 59.75 1h2m s THR 39 Cb -0.11 -1.75 -0.04 0.00 1.34 0.00 0.00 72.50 71.94 1h2m s THR 39 CO 0.47 -0.42 -0.20 -0.13 -0.54 0.00 0.00 174.62 173.80 1h2m s ARG 40 N -3.95 1.45 0.34 3.99 1.81 0.12 -4.93 118.95 117.78 1h2m s ARG 40 Ca 0.15 -1.54 -0.26 0.00 -1.72 0.00 0.00 55.73 52.36 1h2m s ARG 40 Cb 0.04 -1.60 -0.09 0.00 -0.45 0.00 0.00 34.95 32.85 1h2m s ARG 40 CO -0.02 0.32 1.04 -1.25 -0.68 0.00 0.00 175.30 174.71 1h2m s PRO 41 N -2.96 4.42 0.23 3.54 0.05 -1.26 0.40 135.00 139.43 1h2m s PRO 41 Ca 0.21 1.57 -0.27 0.00 0.05 0.00 0.00 61.00 62.56 1h2m s PRO 41 Cb -0.06 -2.83 -0.09 0.00 0.05 0.00 0.00 34.50 31.57 1h2m s PRO 41 CO 0.10 0.08 0.87 0.42 0.05 0.00 0.00 177.00 178.52 1h2m s ILE 42 N -1.46 4.23 0.36 0.56 1.01 -0.09 -4.73 121.20 121.08 1h2m s ILE 42 Ca 0.51 1.85 -0.28 0.00 0.00 0.00 0.00 60.65 62.73 1h2m s ILE 42 Cb -0.25 -4.16 -0.10 0.00 0.01 0.00 0.00 42.46 37.96 1h2m s ILE 42 CO 0.31 0.40 1.37 -2.84 0.00 0.00 0.00 174.94 174.19 1h2m s PRO 43 N -1.43 4.20 -0.24 2.79 0.02 -1.26 -4.84 135.00 134.23 1h2m s PRO 43 Ca 0.42 2.34 -0.05 0.00 0.02 0.00 0.00 61.00 63.73 1h2m s PRO 43 Cb -0.23 -2.98 -0.01 0.00 0.02 0.00 0.00 34.50 31.30 1h2m s PRO 43 CO 0.28 -0.37 0.01 1.03 -0.33 0.00 0.00 177.00 177.62 1h2m s ARG 44 N -1.98 3.44 0.09 5.54 0.52 -1.26 -1.04 118.95 124.26 1h2m s ARG 44 Ca 0.52 -0.60 -0.02 0.00 -0.52 0.00 0.00 55.73 55.11 1h2m s ARG 44 Cb -0.42 -3.16 -0.04 0.00 0.52 0.00 0.00 34.95 31.85 1h2m s ARG 44 CO 0.56 -0.22 0.03 -0.51 0.02 0.00 0.00 175.30 175.18 1h2m s LEU 45 N 1.53 2.09 0.50 2.53 1.43 0.06 -4.99 118.68 121.84 1h2m s LEU 45 Ca 0.06 -1.04 -0.19 0.00 -1.03 0.00 0.00 54.13 51.93 1h2m s LEU 45 Cb -0.15 0.34 -0.08 0.00 0.03 0.00 0.00 46.19 46.33 1h2m s LEU 45 CO -0.00 -0.67 1.01 -0.55 0.23 0.00 0.00 176.35 176.37 1h2m s SER 46 N -2.96 6.41 0.46 2.29 0.15 -1.26 -1.80 113.70 116.99 1h2m s SER 46 Ca 0.13 1.78 0.20 0.00 0.70 0.00 0.00 55.95 58.76 1h2m s SER 46 Cb 0.07 -2.54 1.12 0.00 -1.71 0.00 0.00 66.02 62.96 1h2m s SER 46 CO -0.05 -0.73 1.98 -0.61 1.20 0.00 0.00 173.24 175.02 1h2m h GLN 47 N 1.26 0.00 -0.00 5.44 -0.00 -1.95 -2.18 115.11 117.68 1h2m h GLN 47 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.17 1h2m h GLN 47 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.68 1h2m h GLN 47 CO 0.60 0.20 -0.14 -1.13 0.00 0.00 0.00 178.83 178.36 1h2m n SER 48 N -3.93 0.15 -4.67 -0.69 3.41 -1.26 -4.83 113.62 101.80 1h2m n SER 48 Ca -0.02 0.26 -0.43 0.00 -0.26 0.00 0.00 58.87 58.42 1h2m n SER 48 Cb 0.29 -0.28 -0.02 0.00 -0.26 0.00 0.00 64.21 63.94 1h2m n SER 48 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1h2m s ASP 49 N -2.98 7.01 0.51 4.04 -1.08 -0.82 -4.91 116.67 118.44 1h2m s ASP 49 Ca 0.14 1.72 0.26 0.00 -0.52 0.00 0.00 52.55 54.15 1h2m s ASP 49 Cb 0.19 -2.55 1.35 0.00 -1.46 0.00 0.00 42.92 40.45 1h2m s ASP 49 CO 0.58 -0.67 1.93 -0.65 0.52 0.00 0.00 175.17 176.88 1h2m h PRO 50 N 7.79 0.10 0.00 4.34 0.11 -1.88 0.15 132.00 142.61 1h2m h PRO 50 Ca -0.30 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.77 1h2m h PRO 50 Cb 1.13 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1h2m h PRO 50 CO 0.93 0.06 -0.18 0.00 -0.21 0.00 0.00 178.00 178.60 1h2m h ARG 51 N 0.10 0.00 -0.23 1.05 3.08 -1.93 -1.51 114.38 114.94 1h2m h ARG 51 Ca 0.36 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 60.22 1h2m h ARG 51 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.33 1h2m h ARG 51 CO -0.04 0.18 -0.60 0.00 -1.07 0.00 0.00 179.97 178.44 1h2m h ALA 52 N 1.82 0.51 -0.55 0.04 0.00 -0.98 -2.27 119.26 117.82 1h2m h ALA 52 Ca -0.00 -0.54 -0.11 0.00 0.00 0.00 0.00 54.91 54.27 1h2m h ALA 52 Cb 0.35 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1h2m h ALA 52 CO 0.02 0.69 -0.07 1.49 0.00 0.00 0.00 179.25 181.38 1h2m h GLU 53 N 0.56 1.02 -0.68 0.00 4.57 -1.34 -2.40 114.58 116.31 1h2m h GLU 53 Ca -0.00 -0.36 0.01 0.00 -1.18 0.00 0.00 59.36 57.83 1h2m h GLU 53 Cb 1.19 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.68 1h2m h GLU 53 CO 0.12 1.05 0.45 0.93 -1.18 0.00 0.00 179.01 180.38 1h2m h GLU 54 N 0.90 0.88 -0.09 1.92 5.08 -1.17 -1.45 114.58 120.64 1h2m h GLU 54 Ca 0.15 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 1h2m h GLU 54 Cb 0.63 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 1h2m h GLU 54 CO 0.04 0.58 -0.07 -0.07 -1.00 0.00 0.00 179.01 178.50 1h2m h LEU 55 N 0.91 0.22 -0.59 1.33 3.38 -0.94 -2.18 115.31 117.45 1h2m h LEU 55 Ca 0.25 -0.45 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1h2m h LEU 55 Cb -0.08 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1h2m h LEU 55 CO -0.06 0.63 0.28 0.40 0.09 0.00 0.00 178.44 179.78 1h2m h ILE 56 N -0.18 1.21 -0.88 1.22 2.04 -1.29 -0.06 117.51 119.57 1h2m h ILE 56 Ca 0.02 -0.61 0.06 0.00 1.00 0.00 0.00 64.86 65.34 1h2m h ILE 56 Cb 0.56 0.53 -0.06 0.00 -0.74 0.00 0.00 36.82 37.11 1h2m h ILE 56 CO 0.02 0.24 0.57 -0.08 0.00 0.00 0.00 178.15 178.90 1h2m h GLU 57 N 0.80 0.96 -0.45 2.37 4.57 -1.24 -0.89 114.58 120.70 1h2m h GLU 57 Ca 0.20 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.32 1h2m h GLU 57 Cb 0.13 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 1h2m h GLU 57 CO -0.02 0.63 0.00 0.09 -1.18 0.00 0.00 179.01 178.53 1h2m n ASN 58 N -4.49 2.33 -3.67 1.04 4.13 -0.82 -4.94 115.26 108.85 1h2m n ASN 58 Ca 0.13 -2.07 -0.22 0.00 1.68 0.00 0.00 54.58 54.11 1h2m n ASN 58 Cb 0.20 -0.31 0.04 0.00 -1.54 0.00 0.00 39.78 38.18 1h2m n ASN 58 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1h2m n GLU 59 N 0.63 -5.49 -4.74 3.52 1.02 -0.34 -5.00 120.64 110.24 1h2m n GLU 59 Ca 0.14 0.67 -0.27 0.00 -0.02 0.00 0.00 57.16 57.68 1h2m n GLU 59 Cb 0.39 -5.39 -0.14 0.00 -0.02 0.00 0.00 31.44 26.28 1h2m n GLU 59 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1h2m s GLU 60 N -5.97 1.51 0.64 3.49 2.02 -0.11 -4.86 118.70 115.42 1h2m s GLU 60 Ca 0.13 -0.94 -0.17 0.00 0.02 0.00 0.00 54.97 54.00 1h2m s GLU 60 Cb -0.06 -1.61 -0.01 0.00 0.10 0.00 0.00 34.13 32.55 1h2m s GLU 60 CO 0.79 0.42 1.19 -1.25 0.02 0.00 0.00 175.26 176.43 1h2m s PRO 61 N -1.09 2.74 -0.21 0.39 0.04 -1.26 -3.95 135.00 131.66 1h2m s PRO 61 Ca 0.08 1.73 -0.27 0.00 0.04 0.00 0.00 61.00 62.59 1h2m s PRO 61 Cb -0.09 -1.91 0.07 0.00 0.04 0.00 0.00 34.50 32.61 1h2m s PRO 61 CO 0.01 -1.36 0.70 0.54 0.04 0.00 0.00 177.00 176.94 1h2m s VAL 62 N -1.82 0.00 -0.25 -0.36 0.11 -1.24 -4.67 120.40 112.17 1h2m s VAL 62 Ca 0.75 -0.00 -0.10 0.00 -2.93 0.00 0.00 61.98 59.69 1h2m s VAL 62 Cb -0.28 -0.99 -0.05 0.00 -1.53 0.00 0.00 36.38 33.53 1h2m s VAL 62 CO 0.37 -0.00 0.16 -0.69 -3.33 0.00 0.00 175.10 171.61 1h2m s VAL 63 N -0.07 5.22 -0.23 2.04 1.01 -0.21 -1.12 120.40 127.05 1h2m s VAL 63 Ca -0.03 0.14 -0.11 0.00 0.00 0.00 0.00 61.98 61.98 1h2m s VAL 63 Cb -0.04 -3.45 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 1h2m s VAL 63 CO 0.04 0.32 0.18 -0.76 0.00 0.00 0.00 175.10 174.87 1h2m s LEU 64 N 1.31 4.14 0.09 3.92 1.43 0.18 -0.76 118.68 128.98 1h2m s LEU 64 Ca 0.07 0.17 0.23 0.00 -1.03 0.00 0.00 54.13 53.57 1h2m s LEU 64 Cb -0.14 -2.14 -0.05 0.00 0.03 0.00 0.00 46.19 43.88 1h2m s LEU 64 CO 0.06 0.07 0.91 0.35 0.23 0.00 0.00 176.35 177.98 1h2m n THR 65 N 4.15 0.30 -2.49 5.49 -2.24 -0.74 -1.39 114.28 117.34 1h2m n THR 65 Ca -0.15 -0.41 -0.04 0.00 -2.27 0.00 0.00 64.05 61.18 1h2m n THR 65 Cb 0.52 -0.04 0.05 0.00 -2.10 0.00 0.00 70.33 68.76 1h2m n THR 65 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1h2m n ASP 66 N -2.29 2.26 0.14 3.42 5.75 -1.26 -4.65 116.55 119.91 1h2m n ASP 66 Ca -0.00 -2.56 0.01 0.00 -0.01 0.00 0.00 54.79 52.22 1h2m n ASP 66 Cb 0.51 -0.42 0.11 0.00 -1.03 0.00 0.00 41.12 40.29 1h2m n ASP 66 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 1h2m h THR 67 N 4.70 1.17 -0.87 2.12 1.35 -1.83 -3.45 112.91 116.10 1h2m h THR 67 Ca -0.03 -2.27 -0.33 0.00 -0.55 0.00 0.00 66.41 63.24 1h2m h THR 67 Cb 1.42 2.32 -0.12 0.00 -1.73 0.00 0.00 68.15 70.04 1h2m h THR 67 CO 0.29 0.59 -0.31 0.59 -0.25 0.00 0.00 175.52 176.43 1h2m n ASN 68 N -3.45 -4.92 -0.22 5.36 3.02 -1.26 -4.87 115.26 108.92 1h2m n ASN 68 Ca 0.00 0.37 0.03 0.00 -0.03 0.00 0.00 54.58 54.95 1h2m n ASN 68 Cb 0.69 -3.85 0.14 0.00 -0.61 0.00 0.00 39.78 36.16 1h2m n ASN 68 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1h2m h LEU 69 N 0.00 -0.00 -3.50 3.41 5.85 -1.90 -2.44 115.31 116.74 1h2m h LEU 69 Ca -0.33 0.13 -0.31 0.00 0.84 0.00 0.00 57.88 58.21 1h2m h LEU 69 Cb 1.06 0.18 -0.26 0.00 0.37 0.00 0.00 40.66 42.01 1h2m h LEU 69 CO 0.48 -0.02 -0.71 1.33 -0.34 0.00 0.00 178.44 179.18 1h2m n VAL 70 N -5.15 2.27 -0.36 1.05 0.24 -1.26 -0.87 118.33 114.25 1h2m n VAL 70 Ca 0.12 -3.68 0.03 0.00 -2.04 0.00 0.00 64.34 58.76 1h2m n VAL 70 Cb 0.39 -0.62 0.10 0.00 -1.47 0.00 0.00 33.84 32.24 1h2m n VAL 70 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1h2m n TYR 71 N -0.83 0.22 0.30 6.34 9.36 -0.92 0.21 117.16 131.84 1h2m n TYR 71 Ca 0.31 1.20 0.16 0.00 3.32 0.00 0.00 57.90 62.89 1h2m n TYR 71 Cb 0.86 -0.98 0.74 0.00 -0.63 0.00 0.00 39.34 39.33 1h2m n TYR 71 CO 0.00 0.00 0.00 -1.35 0.22 0.00 0.00 176.86 175.73 1h2m h PRO 72 N 0.00 0.00 -0.01 2.98 0.11 -1.85 -2.12 132.00 131.12 1h2m h PRO 72 Ca 0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.53 1h2m h PRO 72 Cb 0.66 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.77 1h2m h PRO 72 CO -0.99 0.00 -0.19 0.00 -0.21 0.00 0.00 178.00 176.61 1h2m n ALA 73 N -1.94 2.93 0.31 -0.75 0.00 0.13 -4.00 120.51 117.19 1h2m n ALA 73 Ca -0.00 -0.33 0.21 0.00 0.00 0.00 0.00 53.44 53.31 1h2m n ALA 73 Cb 0.17 -1.23 1.07 0.00 0.00 0.00 0.00 19.45 19.46 1h2m n ALA 73 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1h2m h LEU 74 N 0.84 0.00 0.00 0.00 3.38 -1.31 -0.58 115.31 117.64 1h2m h LEU 74 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h2m h LEU 74 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1h2m h LEU 74 CO 0.00 0.00 -0.54 2.29 0.09 0.00 0.00 178.44 180.28 1h2m n LYS 75 N -2.97 0.19 -1.69 1.13 2.85 -1.26 -4.94 118.16 111.48 1h2m n LYS 75 Ca -0.02 0.06 -0.42 0.00 -1.05 0.00 0.00 58.31 56.88 1h2m n LYS 75 Cb 0.10 -1.62 -0.00 0.00 -0.65 0.00 0.00 35.03 32.86 1h2m n LYS 75 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 177.40 178.26 1h2m n TRP 76 N -1.90 2.18 -3.90 5.58 7.02 -0.23 -4.94 117.44 121.26 1h2m n TRP 76 Ca 0.04 0.54 -0.10 0.00 -1.02 0.00 0.00 57.50 56.97 1h2m n TRP 76 Cb 0.40 -2.40 -0.01 0.00 -2.42 0.00 0.00 31.31 26.89 1h2m n TRP 76 CO 0.00 0.00 0.00 0.16 -2.02 0.00 0.00 177.69 175.83 1h2m s ASP 77 N -0.39 0.11 0.27 -0.99 1.47 -1.26 -4.90 116.67 110.98 1h2m s ASP 77 Ca 0.57 -1.07 -0.04 0.00 1.18 0.00 0.00 52.55 53.20 1h2m s ASP 77 Cb -0.55 0.75 0.36 0.00 -0.34 0.00 0.00 42.92 43.14 1h2m s ASP 77 CO 0.61 -1.47 1.93 -0.07 0.68 0.00 0.00 175.17 176.85 1h2m h LEU 78 N 2.06 1.07 0.19 2.11 3.38 -1.99 -1.88 115.31 120.25 1h2m h LEU 78 Ca -0.28 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1h2m h LEU 78 Cb 1.25 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1h2m h LEU 78 CO 0.36 0.75 -0.09 -0.08 0.09 0.00 0.00 178.44 179.46 1h2m h GLU 79 N 1.25 -0.24 -0.98 1.13 4.81 -1.98 0.36 114.58 118.91 1h2m h GLU 79 Ca 0.37 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.62 1h2m h GLU 79 Cb -0.05 0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.34 1h2m h GLU 79 CO -0.10 -0.12 0.64 -0.92 -0.73 0.00 0.00 179.01 177.78 1h2m h TYR 80 N -0.31 1.25 -0.27 0.92 3.20 -1.87 -1.39 116.97 118.50 1h2m h TYR 80 Ca -0.03 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.75 1h2m h TYR 80 Cb 0.24 -0.42 -0.00 0.00 1.54 0.00 0.00 36.73 38.09 1h2m h TYR 80 CO -0.05 0.79 -0.31 -0.07 -1.64 0.00 0.00 178.16 176.89 1h2m h LEU 81 N 1.34 0.73 -0.88 2.82 3.38 -1.20 -1.06 115.31 120.43 1h2m h LEU 81 Ca 0.36 -0.49 0.01 0.00 0.09 0.00 0.00 57.88 57.85 1h2m h LEU 81 Cb -0.14 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.36 1h2m h LEU 81 CO -0.08 1.07 0.58 -0.61 0.09 0.00 0.00 178.44 179.50 1h2m h GLN 82 N 0.41 1.14 -0.01 1.13 4.15 -0.78 0.27 115.11 121.42 1h2m h GLN 82 Ca 0.04 -0.07 -0.10 0.00 0.77 0.00 0.00 58.65 59.29 1h2m h GLN 82 Cb 0.88 -0.26 -0.01 0.00 0.21 0.00 0.00 27.48 28.30 1h2m h GLN 82 CO 0.07 0.76 -0.45 1.49 -1.93 0.00 0.00 178.83 178.77 1h2m h GLU 83 N 1.18 0.03 0.00 1.69 4.57 -1.07 -3.39 114.58 117.59 1h2m h GLU 83 Ca 0.33 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.49 1h2m h GLU 83 Cb -0.11 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.48 1h2m h GLU 83 CO -0.08 0.47 -0.03 0.09 -1.18 0.00 0.00 179.01 178.28 1h2m n ASN 84 N -4.00 0.17 -0.19 1.04 3.02 -0.42 -4.77 115.26 110.11 1h2m n ASN 84 Ca -0.02 -0.43 0.10 0.00 -0.03 0.00 0.00 54.58 54.20 1h2m n ASN 84 Cb 0.48 0.90 0.48 0.00 -0.61 0.00 0.00 39.78 41.03 1h2m n ASN 84 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1h2m n ILE 85 N -0.92 0.07 -0.95 2.41 3.06 0.88 -2.36 119.36 121.56 1h2m n ILE 85 Ca 0.00 -0.12 0.00 0.00 -2.50 0.00 0.00 62.75 60.13 1h2m n ILE 85 Cb 0.00 -0.06 0.00 0.00 0.54 0.00 0.00 39.64 40.12 1h2m n ILE 85 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1h2m n GLY 86 N 0.90 -2.49 0.69 4.50 0.00 -1.26 -3.71 105.19 103.81 1h2m n GLY 86 Ca 0.14 -1.85 0.09 0.00 0.00 0.00 0.00 46.02 44.40 1h2m n GLY 86 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h2m n ASN 87 N 0.10 3.51 -4.70 1.61 5.03 -1.26 -4.74 115.26 114.80 1h2m n ASN 87 Ca 0.00 -3.04 -0.30 0.00 0.87 0.00 0.00 54.58 52.11 1h2m n ASN 87 Cb 0.00 -0.52 0.14 0.00 -1.02 0.00 0.00 39.78 38.38 1h2m n ASN 87 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1h2m s GLY 88 N -2.17 1.62 0.34 7.41 0.00 -1.26 -4.96 107.32 108.30 1h2m s GLY 88 Ca 0.40 0.02 -0.26 0.00 0.00 0.00 0.00 44.72 44.88 1h2m s GLY 88 CO 0.07 0.50 0.98 0.99 0.00 0.00 0.00 173.10 175.65 1h2m s ASP 89 N -3.30 7.19 -0.10 1.64 1.01 -1.26 -4.48 116.67 117.37 1h2m s ASP 89 Ca 0.64 1.90 0.04 0.00 0.71 0.00 0.00 52.55 55.84 1h2m s ASP 89 Cb -0.19 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.16 1h2m s ASP 89 CO 0.57 -0.18 -0.22 -0.36 0.21 0.00 0.00 175.17 175.20 1h2m s PHE 90 N -1.62 2.41 -0.02 4.23 0.40 0.34 -4.90 117.98 118.82 1h2m s PHE 90 Ca 0.52 -1.01 -0.30 0.00 -0.60 0.00 0.00 56.93 55.54 1h2m s PHE 90 Cb -0.20 -1.63 -0.05 0.00 0.51 0.00 0.00 43.02 41.65 1h2m s PHE 90 CO 0.25 -0.42 1.35 -1.12 0.70 0.00 0.00 175.22 175.98 1h2m s SER 91 N 0.45 6.90 -0.08 1.36 0.01 -1.26 -1.55 113.70 119.53 1h2m s SER 91 Ca -0.17 2.02 0.00 0.00 1.31 0.00 0.00 55.95 59.12 1h2m s SER 91 Cb -0.17 -2.56 0.02 0.00 0.21 0.00 0.00 66.02 63.52 1h2m s SER 91 CO 0.07 -0.69 -0.07 -0.69 0.41 0.00 0.00 173.24 172.27 1h2m s VAL 92 N 2.42 0.84 0.11 3.43 1.01 -0.06 -1.66 120.40 126.50 1h2m s VAL 92 Ca 0.62 -0.24 -0.10 0.00 0.00 0.00 0.00 61.98 62.26 1h2m s VAL 92 Cb -0.29 -0.85 -0.06 0.00 0.00 0.00 0.00 36.38 35.17 1h2m s VAL 92 CO 0.25 0.31 0.44 -0.31 0.00 0.00 0.00 175.10 175.79 1h2m s TYR 93 N 1.28 3.56 -0.01 5.22 2.02 -0.17 -0.83 117.35 128.42 1h2m s TYR 93 Ca -0.04 0.83 0.06 0.00 -0.37 0.00 0.00 57.07 57.54 1h2m s TYR 93 Cb -0.14 -2.19 -0.01 0.00 -0.40 0.00 0.00 41.96 39.22 1h2m s TYR 93 CO -0.03 0.47 -0.18 0.45 -1.57 0.00 0.00 175.55 174.70 1h2m s SER 94 N -1.86 2.11 0.07 2.29 0.15 -0.34 -0.80 113.70 115.32 1h2m s SER 94 Ca 0.36 -0.33 -0.17 0.00 0.70 0.00 0.00 55.95 56.51 1h2m s SER 94 Cb -0.14 -0.23 0.03 0.00 -1.71 0.00 0.00 66.02 63.97 1h2m s SER 94 CO 0.19 0.22 0.40 0.00 1.20 0.00 0.00 173.24 175.25 1h2m s ALA 95 N -0.43 -0.94 -1.79 5.45 0.00 -0.62 -1.88 121.76 121.55 1h2m s ALA 95 Ca 0.07 0.17 0.19 0.00 0.00 0.00 0.00 51.96 52.38 1h2m s ALA 95 Cb -0.07 0.44 0.43 0.00 0.00 0.00 0.00 23.12 23.92 1h2m s ALA 95 CO -0.01 -0.50 1.35 0.45 0.00 0.00 0.00 175.76 177.06 1h2m n SER 96 N 0.31 3.34 -4.41 0.00 2.88 -1.26 -1.91 113.62 112.58 1h2m n SER 96 Ca -0.18 -1.95 -0.20 0.00 -1.33 0.00 0.00 58.87 55.21 1h2m n SER 96 Cb 0.61 -0.30 -0.10 0.00 -0.75 0.00 0.00 64.21 63.67 1h2m n SER 96 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1h2m s THR 97 N -1.15 1.21 -0.83 2.46 -1.32 -1.26 -4.99 115.64 109.76 1h2m s THR 97 Ca 0.35 -2.03 0.23 0.00 -1.21 0.00 0.00 61.69 59.03 1h2m s THR 97 Cb 0.20 -2.59 0.21 0.00 -1.51 0.00 0.00 72.50 68.80 1h2m s THR 97 CO 0.26 -0.15 1.71 0.00 -2.21 0.00 0.00 174.62 174.23 1h2m n HIS 98 N -0.58 0.36 -3.21 9.09 -0.00 -1.26 -4.75 115.22 114.87 1h2m n HIS 98 Ca -0.04 0.12 -0.42 0.00 -0.00 0.00 0.00 57.72 57.39 1h2m n HIS 98 Cb 0.65 -0.70 -0.08 0.00 -0.00 0.00 0.00 29.99 29.86 1h2m n HIS 98 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.34 176.49 1h2m s LYS 99 N -3.09 3.58 -1.09 -1.40 1.02 -1.26 -0.82 119.74 116.68 1h2m s LYS 99 Ca 0.09 -0.17 -0.04 0.00 0.02 0.00 0.00 55.97 55.87 1h2m s LYS 99 Cb 0.13 -3.83 0.31 0.00 -0.52 0.00 0.00 37.83 33.91 1h2m s LYS 99 CO 0.43 -0.70 1.49 1.19 -0.92 0.00 0.00 175.35 176.83 1h2m n PHE 100 N 5.83 2.33 -1.67 3.18 3.01 0.46 -4.89 117.46 125.71 1h2m n PHE 100 Ca -0.04 -2.61 -0.45 0.00 1.01 0.00 0.00 57.45 55.36 1h2m n PHE 100 Cb 0.49 -1.28 -0.04 0.00 -0.01 0.00 0.00 39.48 38.64 1h2m n PHE 100 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 1h2m n LEU 101 N 1.40 3.78 -4.76 4.37 7.94 -1.26 -4.40 117.00 124.07 1h2m n LEU 101 Ca 0.26 0.95 -0.41 0.00 -1.11 0.00 0.00 56.01 55.70 1h2m n LEU 101 Cb 0.33 -1.45 -0.02 0.00 0.53 0.00 0.00 43.42 42.81 1h2m n LEU 101 CO 0.72 0.06 0.99 -0.47 -1.11 0.00 0.00 177.39 177.58 1h2m s TYR 102 N 4.07 3.13 0.01 1.96 5.04 -1.26 -4.86 117.35 125.45 1h2m s TYR 102 Ca 0.90 1.33 -0.02 0.00 -2.44 0.00 0.00 57.07 56.85 1h2m s TYR 102 Cb -0.57 -3.66 -0.01 0.00 0.35 0.00 0.00 41.96 38.07 1h2m s TYR 102 CO 0.46 -1.90 0.01 1.52 -1.34 0.00 0.00 175.55 174.31 1h2m s TYR 103 N -0.68 0.19 -0.41 4.97 1.13 -1.26 -4.57 117.35 116.72 1h2m s TYR 103 Ca 0.52 -0.39 -0.15 0.00 -1.41 0.00 0.00 57.07 55.64 1h2m s TYR 103 Cb -0.39 -0.14 0.02 0.00 -1.10 0.00 0.00 41.96 40.35 1h2m s TYR 103 CO 0.47 -0.19 0.33 0.34 -2.51 0.00 0.00 175.55 173.99 1h2m s ASP 104 N -1.29 6.13 0.35 -0.18 -1.08 -0.14 -4.95 116.67 115.51 1h2m s ASP 104 Ca -0.14 -0.81 0.05 0.00 -0.52 0.00 0.00 52.55 51.13 1h2m s ASP 104 Cb -0.09 -2.17 0.69 0.00 -1.46 0.00 0.00 42.92 39.89 1h2m s ASP 104 CO -0.00 -0.47 1.94 -0.33 0.52 0.00 0.00 175.17 176.84 1h2m h GLU 105 N 8.64 0.80 0.00 4.34 5.08 -2.00 -1.95 114.58 129.49 1h2m h GLU 105 Ca -0.27 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1h2m h GLU 105 Cb 1.12 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 1h2m h GLU 105 CO 0.74 0.53 -0.01 0.87 -1.00 0.00 0.00 179.01 180.14 1h2m h LYS 106 N 0.83 0.00 -0.02 2.33 6.56 -1.98 -0.77 116.57 123.51 1h2m h LYS 106 Ca 0.33 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.92 1h2m h LYS 106 Cb 0.25 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.91 1h2m h LYS 106 CO -0.12 0.01 -0.12 1.63 -2.06 0.00 0.00 179.45 178.79 1h2m n LYS 107 N -3.28 1.84 -0.05 3.15 5.02 -0.73 -4.45 118.16 119.65 1h2m n LYS 107 Ca -0.03 -1.42 0.01 0.00 -2.02 0.00 0.00 58.31 54.86 1h2m n LYS 107 Cb 0.09 -1.47 0.33 0.00 -0.02 0.00 0.00 35.03 33.96 1h2m n LYS 107 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 1h2m h MET 108 N 3.46 0.65 -0.91 1.97 2.86 -1.16 -3.05 114.93 118.74 1h2m h MET 108 Ca 0.00 -0.08 0.09 0.00 -2.06 0.00 0.00 59.70 57.66 1h2m h MET 108 Cb 0.80 -0.13 -0.07 0.00 0.06 0.00 0.00 31.60 32.27 1h2m h MET 108 CO 0.00 0.52 0.59 0.00 1.06 0.00 0.00 176.91 179.08 1h2m h ALA 109 N 1.58 1.60 0.00 6.32 0.00 -1.79 -1.40 119.26 125.57 1h2m h ALA 109 Ca 0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1h2m h ALA 109 Cb 0.09 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1h2m h ALA 109 CO -0.02 0.22 0.00 0.09 0.00 0.00 0.00 179.25 179.54 1h2m n ASN 110 N -4.53 0.00 -3.19 0.00 3.02 -1.15 -3.81 115.26 105.59 1h2m n ASN 110 Ca 0.15 -0.68 -0.22 0.00 -0.03 0.00 0.00 54.58 53.80 1h2m n ASN 110 Cb 0.29 -0.08 -0.06 0.00 -0.61 0.00 0.00 39.78 39.32 1h2m n ASN 110 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1h2m n PHE 111 N -1.08 -0.13 -0.32 3.10 3.01 -0.53 -4.89 117.46 116.63 1h2m n PHE 111 Ca 0.20 -3.65 0.33 0.00 1.01 0.00 0.00 57.45 55.33 1h2m n PHE 111 Cb 0.14 -0.38 0.71 0.00 -0.01 0.00 0.00 39.48 39.94 1h2m n PHE 111 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 1h2m h GLN 112 N 3.69 0.06 -0.03 -1.08 1.08 -1.65 0.13 115.11 117.30 1h2m h GLN 112 Ca 0.08 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 1h2m h GLN 112 Cb 0.90 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.32 1h2m h GLN 112 CO 0.48 0.04 0.00 0.09 -0.95 0.00 0.00 178.83 178.49 1h2m n ASN 113 N -4.26 0.42 -4.68 1.46 3.02 -1.26 -4.82 115.26 105.14 1h2m n ASN 113 Ca 0.25 -1.38 -0.40 0.00 -0.03 0.00 0.00 54.58 53.02 1h2m n ASN 113 Cb 1.18 -0.02 -0.05 0.00 -0.61 0.00 0.00 39.78 40.27 1h2m n ASN 113 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1h2m s PHE 114 N -1.96 3.43 -0.32 3.10 5.36 0.45 -5.02 117.98 123.02 1h2m s PHE 114 Ca 0.34 1.04 0.03 0.00 -0.96 0.00 0.00 56.93 57.38 1h2m s PHE 114 Cb 0.16 -2.82 0.08 0.00 -0.34 0.00 0.00 43.02 40.11 1h2m s PHE 114 CO 0.27 -0.11 0.00 -1.59 -1.46 0.00 0.00 175.22 172.33 1h2m s LYS 115 N 1.64 1.84 0.40 10.12 0.00 -1.26 -5.08 119.74 127.40 1h2m s LYS 115 Ca 0.32 -1.66 -0.27 0.00 0.00 0.00 0.00 55.97 54.37 1h2m s LYS 115 Cb -0.16 -3.13 -0.09 0.00 0.00 0.00 0.00 37.83 34.45 1h2m s LYS 115 CO 0.12 -0.80 1.36 -2.14 0.00 0.00 0.00 175.35 173.89 1h2m s PRO 116 N 1.01 3.98 0.08 1.78 0.02 -1.26 -4.90 135.00 135.71 1h2m s PRO 116 Ca 0.03 2.29 0.26 0.00 0.02 0.00 0.00 61.00 63.59 1h2m s PRO 116 Cb -0.20 -2.81 0.70 0.00 0.02 0.00 0.00 34.50 32.21 1h2m s PRO 116 CO -0.06 -0.53 1.59 2.89 -0.33 0.00 0.00 177.00 180.55 1h2m n ARG 117 N 0.20 0.15 -4.37 5.54 0.00 -1.26 -4.83 116.66 112.09 1h2m n ARG 117 Ca 0.03 0.07 -0.22 0.00 -0.00 0.00 0.00 57.85 57.74 1h2m n ARG 117 Cb 0.42 -1.62 -0.13 0.00 -0.00 0.00 0.00 32.46 31.13 1h2m n ARG 117 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1h2m s SER 118 N -3.70 2.04 0.07 2.89 1.04 -1.26 -4.26 113.70 110.52 1h2m s SER 118 Ca 0.10 -0.55 0.08 0.00 0.48 0.00 0.00 55.95 56.06 1h2m s SER 118 Cb 0.15 -0.12 -0.04 0.00 0.10 0.00 0.00 66.02 66.11 1h2m s SER 118 CO 0.64 0.05 -0.18 0.20 0.98 0.00 0.00 173.24 174.93 1h2m s ASN 119 N -1.43 3.84 -0.11 7.02 0.01 -0.79 -4.93 114.94 118.56 1h2m s ASN 119 Ca 0.03 -0.48 -0.11 0.00 -0.71 0.00 0.00 52.86 51.59 1h2m s ASN 119 Cb -0.09 -0.59 -0.05 0.00 0.41 0.00 0.00 41.25 40.94 1h2m s ASN 119 CO 0.02 0.23 0.25 -0.60 -1.51 0.00 0.00 177.10 175.49 1h2m s ARG 120 N -1.71 3.87 -0.01 -0.60 3.52 -1.26 -1.19 118.95 121.56 1h2m s ARG 120 Ca 0.16 0.06 0.02 0.00 -0.13 0.00 0.00 55.73 55.85 1h2m s ARG 120 Cb -0.11 -3.29 -0.00 0.00 -1.56 0.00 0.00 34.95 29.99 1h2m s ARG 120 CO 0.07 0.55 -0.08 -2.00 -0.81 0.00 0.00 175.30 173.03 1h2m s GLU 121 N -0.47 0.75 -0.17 5.12 2.12 -0.01 -4.97 118.70 121.07 1h2m s GLU 121 Ca 0.17 -0.29 -0.13 0.00 0.36 0.00 0.00 54.97 55.08 1h2m s GLU 121 Cb -0.13 -0.72 -0.05 0.00 0.26 0.00 0.00 34.13 33.49 1h2m s GLU 121 CO 0.06 0.15 0.25 -1.21 -0.54 0.00 0.00 175.26 173.97 1h2m s GLU 122 N -0.06 4.22 0.27 4.30 0.41 -1.26 -0.88 118.70 125.70 1h2m s GLU 122 Ca 0.01 0.01 -0.12 0.00 -0.41 0.00 0.00 54.97 54.46 1h2m s GLU 122 Cb -0.05 -3.42 0.00 0.00 -1.78 0.00 0.00 34.13 28.88 1h2m s GLU 122 CO -0.00 0.27 0.51 0.00 -0.49 0.00 0.00 175.26 175.55 1h2m s MET 123 N 0.40 1.65 0.51 1.61 0.23 -0.60 -4.89 119.30 118.20 1h2m s MET 123 Ca 0.14 -1.30 -0.13 0.00 -1.03 0.00 0.00 55.69 53.37 1h2m s MET 123 Cb -0.12 0.49 -0.06 0.00 -1.53 0.00 0.00 34.83 33.60 1h2m s MET 123 CO 0.02 -0.70 0.93 0.15 -2.03 0.00 0.00 175.02 173.39 1h2m s LYS 124 N -3.80 3.80 0.22 3.16 -0.14 -1.26 0.13 119.74 121.84 1h2m s LYS 124 Ca 0.22 0.73 -0.09 0.00 -1.36 0.00 0.00 55.97 55.47 1h2m s LYS 124 Cb -0.01 -2.20 0.20 0.00 -1.68 0.00 0.00 37.83 34.13 1h2m s LYS 124 CO 0.10 -0.27 1.88 0.35 -0.76 0.00 0.00 175.35 176.65 1h2m h PHE 125 N 0.68 0.97 -0.15 3.18 3.57 -1.85 0.12 116.94 123.46 1h2m h PHE 125 Ca -0.46 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.04 1h2m h PHE 125 Cb 1.19 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.59 1h2m h PHE 125 CO 0.63 0.59 -0.02 1.12 -2.23 0.00 0.00 178.31 178.40 1h2m h HIS 126 N 1.03 0.22 -0.39 0.41 2.07 -1.92 0.08 115.15 116.65 1h2m h HIS 126 Ca 0.30 -0.01 -0.15 0.00 -2.85 0.00 0.00 60.37 57.66 1h2m h HIS 126 Cb -0.06 -0.07 -0.01 0.00 2.57 0.00 0.00 27.41 29.84 1h2m h HIS 126 CO -0.02 0.25 -0.35 0.93 -3.07 0.00 0.00 177.93 175.66 1h2m h GLU 127 N 0.22 0.92 -0.31 5.12 5.08 -1.19 0.05 114.58 124.46 1h2m h GLU 127 Ca 0.05 -0.46 -0.02 0.00 -1.00 0.00 0.00 59.36 57.93 1h2m h GLU 127 Cb 0.18 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1h2m h GLU 127 CO 0.01 1.12 0.11 0.35 -1.00 0.00 0.00 179.01 179.59 1h2m h PHE 128 N 0.76 0.49 -0.69 4.33 3.57 0.05 -0.37 116.94 125.08 1h2m h PHE 128 Ca 0.07 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1h2m h PHE 128 Cb 0.94 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.50 1h2m h PHE 128 CO 0.06 0.49 0.39 0.28 -2.23 0.00 0.00 178.31 177.29 1h2m h VAL 129 N 0.35 1.21 0.04 1.41 2.07 -0.78 -0.96 116.25 119.60 1h2m h VAL 129 Ca 0.10 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 67.10 1h2m h VAL 129 Cb 0.22 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1h2m h VAL 129 CO -0.01 0.23 -0.02 -0.33 0.02 0.00 0.00 177.57 177.46 1h2m h GLU 130 N 0.95 -0.06 -0.67 1.57 5.08 -0.70 -1.36 114.58 119.39 1h2m h GLU 130 Ca 0.24 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.71 1h2m h GLU 130 Cb 0.03 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.21 1h2m h GLU 130 CO -0.04 -0.02 0.27 0.87 -1.00 0.00 0.00 179.01 179.09 1h2m h LYS 131 N -0.07 0.44 -0.95 2.33 1.57 -0.67 0.35 116.57 119.57 1h2m h LYS 131 Ca -0.01 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.78 1h2m h LYS 131 Cb 0.06 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.21 1h2m h LYS 131 CO 0.01 0.29 0.62 -0.07 -0.57 0.00 0.00 179.45 179.74 1h2m h LEU 132 N 0.46 1.04 -0.25 2.94 3.38 -0.63 -2.24 115.31 120.01 1h2m h LEU 132 Ca 0.35 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.29 1h2m h LEU 132 Cb 0.44 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1h2m h LEU 132 CO -0.33 0.72 0.09 1.56 0.09 0.00 0.00 178.44 180.58 1h2m h GLN 133 N 1.22 0.38 -0.67 1.13 4.20 -0.08 -2.60 115.11 118.69 1h2m h GLN 133 Ca 0.37 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 59.00 1h2m h GLN 133 Cb -0.02 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.67 1h2m h GLN 133 CO -0.12 0.43 0.37 0.22 -0.67 0.00 0.00 178.83 179.07 1h2m h ASP 134 N 0.24 0.82 0.10 1.46 1.82 -0.57 -1.45 116.42 118.85 1h2m h ASP 134 Ca 0.08 -0.06 -0.00 0.00 -0.39 0.00 0.00 57.03 56.66 1h2m h ASP 134 Cb 0.20 -0.21 0.00 0.00 0.68 0.00 0.00 39.33 40.00 1h2m h ASP 134 CO -0.01 0.65 -0.05 0.40 -1.61 0.00 0.00 179.24 178.63 1h2m h ILE 135 N 0.93 1.06 0.00 2.25 2.04 -1.39 -0.87 117.51 121.54 1h2m h ILE 135 Ca 0.24 -0.61 0.03 0.00 1.00 0.00 0.00 64.86 65.52 1h2m h ILE 135 Cb 0.01 1.45 -0.05 0.00 -0.74 0.00 0.00 36.82 37.49 1h2m h ILE 135 CO -0.04 0.15 -0.37 1.56 0.00 0.00 0.00 178.15 179.45 1h2m h GLN 136 N -0.41 -0.51 -0.84 2.37 4.20 -1.14 -1.15 115.11 117.63 1h2m h GLN 136 Ca -0.01 0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.74 1h2m h GLN 136 Cb 0.35 0.12 -0.04 0.00 0.30 0.00 0.00 27.48 28.20 1h2m h GLN 136 CO 0.02 -0.34 0.55 -0.56 -0.67 0.00 0.00 178.83 177.84 1h2m h GLN 137 N -0.53 1.10 -0.22 1.46 -0.00 -1.27 -1.52 115.11 114.13 1h2m h GLN 137 Ca 0.05 -0.07 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 1h2m h GLN 137 Cb 0.61 -0.25 0.00 0.00 -0.00 0.00 0.00 27.48 27.85 1h2m h GLN 137 CO -0.29 0.73 0.00 2.89 -0.00 0.00 0.00 178.83 182.15 1h2m n ARG 138 N -4.50 1.48 -2.69 0.06 1.85 -0.33 -4.89 116.66 107.63 1h2m n ARG 138 Ca 0.09 -0.72 -0.13 0.00 -1.00 0.00 0.00 57.85 56.08 1h2m n ARG 138 Cb 0.02 -1.17 -0.00 0.00 -1.05 0.00 0.00 32.46 30.25 1h2m n ARG 138 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1h2m n GLY 139 N 0.80 -0.50 3.77 2.89 0.00 -0.53 -4.93 105.19 106.70 1h2m n GLY 139 Ca 0.07 0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 1h2m n GLY 139 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h2m s GLY 140 N -2.20 1.73 0.00 -0.02 0.00 -0.66 -4.98 107.32 101.19 1h2m s GLY 140 Ca 0.10 0.30 0.23 0.00 0.00 0.00 0.00 44.72 45.36 1h2m s GLY 140 CO 0.13 0.65 1.17 1.18 0.00 0.00 0.00 173.10 176.23 1h2m n GLU 141 N -3.42 0.31 -1.58 2.90 -0.58 -1.26 -4.87 120.64 112.13 1h2m n GLU 141 Ca 0.09 -0.23 -0.37 0.00 -0.42 0.00 0.00 57.16 56.23 1h2m n GLU 141 Cb 0.53 -1.50 0.06 0.00 -0.57 0.00 0.00 31.44 29.96 1h2m n GLU 141 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1h2m n GLU 142 N -1.15 0.80 -4.32 3.49 2.13 -1.26 -4.88 120.64 115.44 1h2m n GLU 142 Ca 0.06 0.32 -0.19 0.00 0.66 0.00 0.00 57.16 58.01 1h2m n GLU 142 Cb 0.36 -2.15 -0.14 0.00 0.27 0.00 0.00 31.44 29.79 1h2m n GLU 142 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1h2m s ARG 143 N -2.81 0.82 0.08 5.31 0.52 -0.80 -5.01 118.95 117.05 1h2m s ARG 143 Ca 0.76 -0.61 0.08 0.00 -0.52 0.00 0.00 55.73 55.44 1h2m s ARG 143 Cb -0.40 -0.78 -0.03 0.00 0.52 0.00 0.00 34.95 34.25 1h2m s ARG 143 CO 0.47 0.20 -0.20 -0.51 0.02 0.00 0.00 175.30 175.27 1h2m s LEU 144 N -0.87 2.26 -0.15 2.53 1.43 -1.26 -1.58 118.68 121.03 1h2m s LEU 144 Ca 0.01 -0.63 -0.04 0.00 -1.03 0.00 0.00 54.13 52.44 1h2m s LEU 144 Cb -0.07 -0.89 0.06 0.00 0.03 0.00 0.00 46.19 45.32 1h2m s LEU 144 CO 0.01 0.08 0.10 -0.47 0.23 0.00 0.00 176.35 176.29 1h2m s TYR 145 N -1.05 0.12 0.04 0.29 6.14 0.02 -3.61 117.35 119.30 1h2m s TYR 145 Ca 0.06 -0.13 -0.25 0.00 0.64 0.00 0.00 57.07 57.39 1h2m s TYR 145 Cb -0.10 -0.61 -0.05 0.00 0.42 0.00 0.00 41.96 41.62 1h2m s TYR 145 CO 0.03 -0.45 0.77 -1.17 0.64 0.00 0.00 175.55 175.38 1h2m s LEU 146 N 2.16 4.44 -0.25 6.97 0.20 0.03 -1.00 118.68 131.24 1h2m s LEU 146 Ca 0.03 1.45 -0.02 0.00 0.69 0.00 0.00 54.13 56.28 1h2m s LEU 146 Cb -0.15 -3.24 0.13 0.00 -0.43 0.00 0.00 46.19 42.50 1h2m s LEU 146 CO -0.08 0.00 0.34 -1.10 -0.29 0.00 0.00 176.35 175.22 1h2m s GLN 147 N -0.01 0.32 -0.19 1.98 -0.21 -0.66 -1.30 119.66 119.59 1h2m s GLN 147 Ca 0.39 0.32 -0.10 0.00 0.02 0.00 0.00 55.36 55.98 1h2m s GLN 147 Cb -0.20 -0.63 0.07 0.00 1.00 0.00 0.00 33.01 33.25 1h2m s GLN 147 CO 0.23 -0.75 0.46 -1.14 -2.12 0.00 0.00 175.29 171.96 1h2m s GLN 148 N 2.48 0.44 0.26 2.91 2.00 -0.85 -4.27 119.66 122.62 1h2m s GLN 148 Ca 0.11 0.90 -0.30 0.00 -2.00 0.00 0.00 55.36 54.07 1h2m s GLN 148 Cb -0.15 0.05 -0.10 0.00 0.80 0.00 0.00 33.01 33.62 1h2m s GLN 148 CO -0.20 -0.17 1.35 0.99 -0.50 0.00 0.00 175.29 176.77 1h2m s THR 149 N 1.59 2.86 -0.02 -0.34 2.01 -1.26 -0.73 115.64 119.74 1h2m s THR 149 Ca -0.09 0.76 -0.30 0.00 0.31 0.00 0.00 61.69 62.37 1h2m s THR 149 Cb -0.08 -3.48 -0.05 0.00 0.01 0.00 0.00 72.50 68.90 1h2m s THR 149 CO -0.14 0.14 1.30 -0.76 -0.69 0.00 0.00 174.62 174.47 1h2m s LEU 150 N -0.78 4.30 0.00 4.42 1.43 -0.66 -4.88 118.68 122.52 1h2m s LEU 150 Ca 0.55 1.98 0.00 0.00 -1.03 0.00 0.00 54.13 55.63 1h2m s LEU 150 Cb -0.39 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.27 1h2m s LEU 150 CO 0.45 -0.64 0.00 -0.46 0.23 0.00 0.00 176.35 175.92 1h2m n ASN 151 N 5.20 0.54 0.32 2.29 0.23 -1.26 -4.80 115.26 117.78 1h2m n ASN 151 Ca 0.12 -0.84 0.22 0.00 -0.53 0.00 0.00 54.58 53.55 1h2m n ASN 151 Cb 0.45 0.00 1.17 0.00 -2.08 0.00 0.00 39.78 39.31 1h2m n ASN 151 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1h2m h ASP 152 N 0.00 0.00 0.68 0.53 3.32 -2.02 -2.78 116.42 116.15 1h2m h ASP 152 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1h2m h ASP 152 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1h2m h ASP 152 CO 0.00 0.00 -0.04 0.35 -1.72 0.00 0.00 179.24 177.83 1h2m n THR 153 N -3.01 0.00 -1.69 0.35 -2.24 -1.26 -4.85 114.28 101.58 1h2m n THR 153 Ca -0.03 -0.01 -0.34 0.00 -2.27 0.00 0.00 64.05 61.40 1h2m n THR 153 Cb 0.07 -0.42 0.06 0.00 -2.10 0.00 0.00 70.33 67.94 1h2m n THR 153 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1h2m s VAL 154 N -2.72 2.76 0.90 2.28 -7.23 -1.05 -4.27 120.40 111.06 1h2m s VAL 154 Ca 0.23 0.38 -0.14 0.00 -1.81 0.00 0.00 61.98 60.64 1h2m s VAL 154 Cb 0.20 -2.96 0.14 0.00 0.56 0.00 0.00 36.38 34.32 1h2m s VAL 154 CO 0.50 -0.19 1.23 -0.83 -0.31 0.00 0.00 175.10 175.50 1h2m s GLY 155 N -2.15 1.67 0.13 2.32 0.00 -0.99 -4.82 107.32 103.48 1h2m s GLY 155 Ca 0.72 -0.88 -0.22 0.00 0.00 0.00 0.00 44.72 44.34 1h2m s GLY 155 CO 0.41 -0.25 1.67 3.21 0.00 0.00 0.00 173.10 178.14 1h2m h ARG 156 N -1.40 -0.16 -0.98 2.90 2.47 -1.95 -0.15 114.38 115.10 1h2m h ARG 156 Ca -0.46 0.01 0.02 0.00 -1.26 0.00 0.00 59.98 58.30 1h2m h ARG 156 Cb 1.29 0.04 -0.05 0.00 -1.65 0.00 0.00 29.97 29.59 1h2m h ARG 156 CO 0.53 -0.11 0.64 0.87 0.56 0.00 0.00 179.97 182.46 1h2m h LYS 157 N -0.17 1.24 -0.36 0.04 6.56 -1.95 -0.63 116.57 121.31 1h2m h LYS 157 Ca 0.10 -0.07 -0.12 0.00 -1.06 0.00 0.00 60.65 59.49 1h2m h LYS 157 Cb 0.31 -0.28 -0.01 0.00 -0.57 0.00 0.00 32.23 31.67 1h2m h LYS 157 CO -0.24 0.82 -0.28 0.82 -2.06 0.00 0.00 179.45 178.51 1h2m h ILE 158 N 1.28 1.28 -0.60 1.86 1.08 -1.45 -0.85 117.51 120.10 1h2m h ILE 158 Ca 0.37 -1.41 -0.01 0.00 -0.39 0.00 0.00 64.86 63.42 1h2m h ILE 158 Cb -0.07 1.30 -0.03 0.00 -3.07 0.00 0.00 36.82 34.95 1h2m h ILE 158 CO -0.10 0.46 0.33 0.58 -0.69 0.00 0.00 178.15 178.74 1h2m h VAL 159 N 0.64 1.19 -0.22 1.67 2.07 -0.51 0.73 116.25 121.83 1h2m h VAL 159 Ca 0.08 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.11 1h2m h VAL 159 Cb 0.80 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1h2m h VAL 159 CO 0.07 0.21 0.14 0.24 0.02 0.00 0.00 177.57 178.25 1h2m h MET 160 N 0.82 0.29 -0.43 1.57 2.86 -0.53 -1.20 114.93 118.31 1h2m h MET 160 Ca 0.21 -0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.90 1h2m h MET 160 Cb 0.04 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.58 1h2m h MET 160 CO -0.03 0.20 0.12 -0.44 1.06 0.00 0.00 176.91 177.81 1h2m h ASP 161 N 0.29 0.08 -0.76 1.22 3.32 -0.73 -2.06 116.42 117.78 1h2m h ASP 161 Ca 0.08 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 1h2m h ASP 161 Cb -0.02 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 1h2m h ASP 161 CO -0.02 0.08 0.37 0.15 -1.72 0.00 0.00 179.24 178.10 1h2m h PHE 162 N 0.26 1.08 0.00 4.55 3.57 -0.57 -1.40 116.94 124.44 1h2m h PHE 162 Ca 0.21 -0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.60 1h2m h PHE 162 Cb 0.23 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 1h2m h PHE 162 CO -0.18 0.79 -0.27 -0.07 -2.23 0.00 0.00 178.31 176.35 1h2m h LEU 163 N 1.06 0.00 -0.12 0.59 3.38 -0.93 -2.60 115.31 116.69 1h2m h LEU 163 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1h2m h LEU 163 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1h2m h LEU 163 CO -0.03 0.27 0.00 0.61 0.09 0.00 0.00 178.44 179.37 1h2m n GLY 164 N -0.35 -0.87 3.72 0.83 0.00 -0.54 -4.88 105.19 103.10 1h2m n GLY 164 Ca -0.01 -0.20 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 1h2m n GLY 164 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1h2m s PHE 165 N -1.99 2.06 -1.37 1.61 0.08 -0.98 -4.60 117.98 112.79 1h2m s PHE 165 Ca 0.41 1.64 -0.15 0.00 0.12 0.00 0.00 56.93 58.95 1h2m s PHE 165 Cb 0.19 -3.36 0.02 0.00 -0.57 0.00 0.00 43.02 39.30 1h2m s PHE 165 CO 0.32 -2.47 2.17 -1.71 -0.10 0.00 0.00 175.22 173.43 1h2m n ASN 166 N -3.18 3.73 -0.14 1.36 2.85 -0.05 -4.69 115.26 115.14 1h2m n ASN 166 Ca 0.12 -2.82 0.03 0.00 -0.11 0.00 0.00 54.58 51.80 1h2m n ASN 166 Cb 0.51 -1.60 0.32 0.00 1.24 0.00 0.00 39.78 40.26 1h2m n ASN 166 CO 0.00 0.00 0.00 -0.50 -2.11 0.00 0.00 177.26 174.65 1h2m h TRP 167 N 6.31 0.78 -0.33 1.20 4.06 -1.89 -1.76 115.95 124.32 1h2m h TRP 167 Ca 0.55 0.02 0.06 0.00 2.06 0.00 0.00 58.89 61.58 1h2m h TRP 167 Cb 0.65 -0.26 -0.06 0.00 -1.00 0.00 0.00 29.16 28.49 1h2m h TRP 167 CO 1.43 0.47 -0.05 -0.97 -3.56 0.00 0.00 178.44 175.76 1h2m h ASN 168 N 0.82 -0.25 -0.16 -3.49 -1.24 -2.00 0.16 115.58 109.43 1h2m h ASN 168 Ca 0.25 0.09 -0.10 0.00 0.71 0.00 0.00 56.30 57.25 1h2m h ASN 168 Cb -0.02 0.18 -0.00 0.00 0.73 0.00 0.00 38.32 39.20 1h2m h ASN 168 CO -0.06 -0.08 -0.28 -0.25 -1.29 0.00 0.00 177.43 175.46 1h2m h TRP 169 N 0.03 0.60 -0.18 0.67 7.01 -1.82 -2.83 115.95 119.43 1h2m h TRP 169 Ca 0.16 -0.21 -0.15 0.00 2.11 0.00 0.00 58.89 60.79 1h2m h TRP 169 Cb 0.23 -0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.17 1h2m h TRP 169 CO -0.28 0.92 -0.53 0.97 -2.79 0.00 0.00 178.44 176.72 1h2m h ILE 170 N 0.12 1.32 -0.71 2.65 2.10 -1.10 -2.37 117.51 119.51 1h2m h ILE 170 Ca 0.01 -1.78 -0.02 0.00 1.08 0.00 0.00 64.86 64.15 1h2m h ILE 170 Cb 0.87 1.77 -0.03 0.00 -1.09 0.00 0.00 36.82 38.33 1h2m h ILE 170 CO 0.06 0.55 0.36 0.78 -1.08 0.00 0.00 178.15 178.83 1h2m h ASN 171 N 0.40 0.90 -0.13 2.19 2.35 -0.74 -0.32 115.58 120.24 1h2m h ASN 171 Ca 0.01 -0.09 -0.07 0.00 -0.55 0.00 0.00 56.30 55.60 1h2m h ASN 171 Cb 1.06 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 39.19 1h2m h ASN 171 CO 0.10 0.75 -0.14 0.11 -1.65 0.00 0.00 177.43 176.60 1h2m h LYS 172 N 1.00 0.49 -0.11 0.81 1.57 -1.30 -0.21 116.57 118.83 1h2m h LYS 172 Ca 0.25 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 1h2m h LYS 172 Cb 0.07 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 1h2m h LYS 172 CO -0.04 0.62 0.02 1.96 -0.57 0.00 0.00 179.45 181.44 1h2m h GLN 173 N 0.45 0.18 -0.84 3.15 1.08 -0.72 0.55 115.11 118.97 1h2m h GLN 173 Ca 0.08 -0.05 0.06 0.00 -1.45 0.00 0.00 58.65 57.30 1h2m h GLN 173 Cb 0.50 -0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 27.85 1h2m h GLN 173 CO 0.03 0.37 0.51 0.37 -0.95 0.00 0.00 178.83 179.17 1h2m h GLN 174 N -0.04 0.91 -0.15 1.46 4.15 -0.85 -1.59 115.11 119.00 1h2m h GLN 174 Ca 0.03 -0.05 -0.12 0.00 0.77 0.00 0.00 58.65 59.28 1h2m h GLN 174 Cb 0.28 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.77 1h2m h GLN 174 CO 0.00 0.60 -0.37 0.78 -1.93 0.00 0.00 178.83 177.91 1h2m h GLY 175 N 0.94 0.57 1.27 2.39 0.00 -0.70 -2.56 103.07 104.98 1h2m h GLY 175 Ca 0.37 -0.71 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 1h2m h GLY 175 CO -0.17 0.63 0.33 0.50 0.00 0.00 0.00 176.54 177.83 1h2m h LYS 176 N 0.15 0.95 -0.11 4.80 1.57 0.45 -2.97 116.57 121.40 1h2m h LYS 176 Ca -0.00 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1h2m h LYS 176 Cb 0.98 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.11 1h2m h LYS 176 CO 0.08 0.72 0.00 0.54 -0.57 0.00 0.00 179.45 180.22 1h2m n ARG 177 N -4.35 1.79 -1.02 3.15 5.12 -0.63 -4.93 116.66 115.79 1h2m n ARG 177 Ca 0.06 -1.16 -0.01 0.00 -1.93 0.00 0.00 57.85 54.81 1h2m n ARG 177 Cb 0.12 -1.44 -0.00 0.00 -1.16 0.00 0.00 32.46 29.98 1h2m n ARG 177 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1h2m n GLY 178 N 1.18 0.37 3.51 -0.13 0.00 -1.07 -4.73 105.19 104.33 1h2m n GLY 178 Ca 0.17 -0.06 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1h2m n GLY 178 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1h2m n TRP 179 N -2.63 -0.47 -0.60 1.61 8.01 -0.99 -4.17 117.44 118.20 1h2m n TRP 179 Ca -0.01 0.23 0.00 0.00 -1.31 0.00 0.00 57.50 56.41 1h2m n TRP 179 Cb 0.20 -1.83 0.00 0.00 -2.01 0.00 0.00 31.31 27.66 1h2m n TRP 179 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1h2m n GLY 180 N 0.97 -0.25 3.80 6.99 0.00 0.58 -4.83 105.19 112.46 1h2m n GLY 180 Ca 0.08 -1.72 -0.33 0.00 0.00 0.00 0.00 46.02 44.05 1h2m n GLY 180 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1h2m s GLN 181 N 0.02 3.24 -0.00 1.61 -2.07 -1.26 -4.30 119.66 116.89 1h2m s GLN 181 Ca 0.00 1.20 -0.30 0.00 -1.82 0.00 0.00 55.36 54.44 1h2m s GLN 181 Cb 0.00 -2.02 -0.07 0.00 -1.09 0.00 0.00 33.01 29.83 1h2m s GLN 181 CO 0.00 -0.87 1.80 -1.17 -1.32 0.00 0.00 175.29 173.72 1h2m s LEU 182 N -4.62 4.38 -0.11 2.60 0.20 -1.26 -2.12 118.68 117.75 1h2m s LEU 182 Ca 0.63 2.45 0.16 0.00 0.69 0.00 0.00 54.13 58.07 1h2m s LEU 182 Cb -0.16 -3.53 -0.24 0.00 -0.43 0.00 0.00 46.19 41.83 1h2m s LEU 182 CO 0.39 -0.98 0.39 0.35 -0.29 0.00 0.00 176.35 176.21 1h2m n THR 183 N 5.46 1.39 -3.56 3.68 -2.24 0.66 -4.99 114.28 114.69 1h2m n THR 183 Ca 0.18 -0.80 0.04 0.00 -2.27 0.00 0.00 64.05 61.20 1h2m n THR 183 Cb 0.42 -0.69 -0.00 0.00 -2.10 0.00 0.00 70.33 67.96 1h2m n THR 183 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1h2m s SER 184 N -5.70 -0.00 -0.12 3.42 1.04 -1.22 -5.03 113.70 106.08 1h2m s SER 184 Ca -0.07 -0.01 -0.01 0.00 0.48 0.00 0.00 55.95 56.34 1h2m s SER 184 Cb 0.07 0.01 0.03 0.00 0.10 0.00 0.00 66.02 66.23 1h2m s SER 184 CO 0.83 -0.02 -0.05 0.20 0.98 0.00 0.00 173.24 175.18 1h2m s ASN 185 N -2.97 2.24 -0.17 7.02 -0.87 -1.26 -1.83 114.94 117.10 1h2m s ASN 185 Ca 0.15 -0.36 -0.13 0.00 -1.57 0.00 0.00 52.86 50.94 1h2m s ASN 185 Cb 0.08 -0.77 -0.05 0.00 -0.02 0.00 0.00 41.25 40.49 1h2m s ASN 185 CO -0.07 -0.16 0.28 -0.22 -2.57 0.00 0.00 177.10 174.36 1h2m s LEU 186 N 1.75 4.23 -0.18 0.60 2.96 -1.21 -1.65 118.68 125.19 1h2m s LEU 186 Ca 0.04 0.47 -0.18 0.00 -0.22 0.00 0.00 54.13 54.24 1h2m s LEU 186 Cb -0.13 -2.35 -0.03 0.00 0.50 0.00 0.00 46.19 44.18 1h2m s LEU 186 CO -0.08 0.10 0.50 -0.22 -1.32 0.00 0.00 176.35 175.34 1h2m s LEU 187 N 0.50 4.18 -0.17 -0.68 2.96 0.09 -2.15 118.68 123.41 1h2m s LEU 187 Ca 0.16 0.71 0.01 0.00 -0.22 0.00 0.00 54.13 54.79 1h2m s LEU 187 Cb -0.13 -2.70 0.02 0.00 0.50 0.00 0.00 46.19 43.88 1h2m s LEU 187 CO 0.03 -0.13 -0.20 -0.76 -1.32 0.00 0.00 176.35 173.98 1h2m s LEU 188 N 1.34 2.16 -0.13 -0.68 1.02 -0.05 -2.01 118.68 120.33 1h2m s LEU 188 Ca 0.24 -0.62 -0.00 0.00 0.02 0.00 0.00 54.13 53.77 1h2m s LEU 188 Cb -0.15 -1.48 0.02 0.00 0.02 0.00 0.00 46.19 44.60 1h2m s LEU 188 CO 0.10 0.03 -0.11 -0.63 0.02 0.00 0.00 176.35 175.76 1h2m s ILE 189 N 1.13 1.30 0.16 -0.59 1.01 -0.42 -1.23 121.20 122.57 1h2m s ILE 189 Ca 0.01 -0.49 0.06 0.00 0.00 0.00 0.00 60.65 60.23 1h2m s ILE 189 Cb -0.14 -1.28 -0.04 0.00 0.01 0.00 0.00 42.46 41.01 1h2m s ILE 189 CO -0.09 0.39 -0.13 -0.83 0.00 0.00 0.00 174.94 174.29 1h2m s GLY 190 N 1.59 1.21 0.33 6.18 0.00 -0.80 -0.79 107.32 115.04 1h2m s GLY 190 Ca 0.05 -1.51 -0.10 0.00 0.00 0.00 0.00 44.72 43.15 1h2m s GLY 190 CO -0.09 -1.60 0.67 1.06 0.00 0.00 0.00 173.10 173.13 1h2m s MET 191 N -3.47 3.79 0.36 2.90 -1.94 -1.24 -0.97 119.30 118.72 1h2m s MET 191 Ca 0.17 0.35 -0.27 0.00 -1.71 0.00 0.00 55.69 54.23 1h2m s MET 191 Cb -0.00 -2.51 -0.12 0.00 2.01 0.00 0.00 34.83 34.21 1h2m s MET 191 CO 0.03 0.12 1.24 -0.85 -0.01 0.00 0.00 175.02 175.55 1h2m n GLU 192 N -0.83 1.95 0.00 2.03 0.28 -1.20 -1.42 120.64 121.44 1h2m n GLU 192 Ca 0.01 0.69 0.00 0.00 -0.16 0.00 0.00 57.16 57.70 1h2m n GLU 192 Cb 0.54 -2.27 0.00 0.00 1.43 0.00 0.00 31.44 31.14 1h2m n GLU 192 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1h2m n GLY 193 N 0.85 2.31 3.76 -1.84 0.00 -0.17 -4.82 105.19 105.29 1h2m n GLY 193 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 1h2m n GLY 193 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1h2m s ASN 194 N -2.83 6.01 -0.03 1.61 -0.87 -0.51 -4.74 114.94 113.58 1h2m s ASN 194 Ca 0.00 2.73 0.03 0.00 -1.57 0.00 0.00 52.86 54.06 1h2m s ASN 194 Cb 0.00 -2.64 -0.00 0.00 -0.02 0.00 0.00 41.25 38.59 1h2m s ASN 194 CO 0.00 -1.06 -0.13 -0.69 -2.57 0.00 0.00 177.10 172.65 1h2m s VAL 195 N -1.27 1.08 -0.33 1.60 1.01 0.00 -1.05 120.40 121.44 1h2m s VAL 195 Ca 0.61 -0.53 -0.10 0.00 0.00 0.00 0.00 61.98 61.96 1h2m s VAL 195 Cb -0.40 -0.94 0.00 0.00 0.00 0.00 0.00 36.38 35.05 1h2m s VAL 195 CO 0.50 0.32 0.18 -0.89 0.00 0.00 0.00 175.10 175.21 1h2m s THR 196 N 0.09 4.66 0.81 3.92 2.01 0.02 -0.40 115.64 126.75 1h2m s THR 196 Ca -0.03 -0.52 -0.12 0.00 0.31 0.00 0.00 61.69 61.34 1h2m s THR 196 Cb -0.10 -3.44 0.08 0.00 0.01 0.00 0.00 72.50 69.06 1h2m s THR 196 CO 0.01 -0.02 1.14 -2.84 -0.69 0.00 0.00 174.62 172.21 1h2m s PRO 197 N 1.61 1.81 0.20 4.92 0.02 -1.26 -1.86 135.00 140.44 1h2m s PRO 197 Ca 0.04 1.45 -0.32 0.00 0.02 0.00 0.00 61.00 62.18 1h2m s PRO 197 Cb -0.18 -1.83 -0.14 0.00 0.02 0.00 0.00 34.50 32.38 1h2m s PRO 197 CO 0.07 -2.02 1.48 0.00 -0.33 0.00 0.00 177.00 176.20 1h2m n ALA 198 N -3.54 1.20 -3.84 -1.55 0.00 -1.25 -4.76 120.51 106.77 1h2m n ALA 198 Ca 0.11 0.43 -0.07 0.00 0.00 0.00 0.00 53.44 53.91 1h2m n ALA 198 Cb 0.52 -2.31 -0.01 0.00 0.00 0.00 0.00 19.45 17.65 1h2m n ALA 198 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1h2m s HIS 199 N 0.37 -0.14 0.15 0.00 -3.43 -0.93 -0.67 115.29 110.65 1h2m s HIS 199 Ca 0.73 -0.32 0.09 0.00 -0.80 0.00 0.00 55.06 54.76 1h2m s HIS 199 Cb -0.67 0.71 -0.04 0.00 -1.43 0.00 0.00 32.58 31.16 1h2m s HIS 199 CO 0.44 -1.21 -0.22 1.52 -2.00 0.00 0.00 174.74 173.28 1h2m s TYR 200 N -3.59 1.99 0.15 0.38 -0.85 -0.89 0.14 117.35 114.67 1h2m s TYR 200 Ca 0.12 -0.42 0.10 0.00 -0.52 0.00 0.00 57.07 56.35 1h2m s TYR 200 Cb -0.05 -1.03 -0.04 0.00 0.38 0.00 0.00 41.96 41.22 1h2m s TYR 200 CO 0.07 0.33 -0.20 -0.51 -1.52 0.00 0.00 175.55 173.72 1h2m s ASP 201 N -2.35 3.75 -0.14 -0.18 1.01 -1.26 -4.84 116.67 112.65 1h2m s ASP 201 Ca 0.14 -0.66 0.06 0.00 0.71 0.00 0.00 52.55 52.80 1h2m s ASP 201 Cb -0.08 -0.45 0.40 0.00 1.01 0.00 0.00 42.92 43.79 1h2m s ASP 201 CO 0.07 0.15 1.18 -0.62 0.21 0.00 0.00 175.17 176.16 1h2m n GLU 202 N 0.59 2.72 -4.32 8.23 1.02 -1.26 -1.98 120.64 125.64 1h2m n GLU 202 Ca -0.15 -1.55 -0.17 0.00 -0.02 0.00 0.00 57.16 55.27 1h2m n GLU 202 Cb 0.54 -1.83 -0.10 0.00 -0.02 0.00 0.00 31.44 30.02 1h2m n GLU 202 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1h2m s GLN 203 N -1.83 1.27 0.24 3.49 -0.21 -1.26 -4.53 119.66 116.82 1h2m s GLN 203 Ca 0.27 -1.60 -0.22 0.00 0.02 0.00 0.00 55.36 53.82 1h2m s GLN 203 Cb 0.21 -0.74 -0.09 0.00 1.00 0.00 0.00 33.01 33.40 1h2m s GLN 203 CO 0.07 0.01 0.79 -0.65 -2.12 0.00 0.00 175.29 173.40 1h2m s GLN 204 N -3.78 4.40 -0.07 2.91 -1.52 -0.18 -3.84 119.66 117.58 1h2m s GLN 204 Ca 0.24 1.05 -0.01 0.00 -1.95 0.00 0.00 55.36 54.69 1h2m s GLN 204 Cb 0.04 -2.93 0.03 0.00 -0.22 0.00 0.00 33.01 29.92 1h2m s GLN 204 CO 0.06 0.40 -0.02 1.21 -0.25 0.00 0.00 175.29 176.69 1h2m s ASN 205 N -1.54 1.54 -0.28 5.90 3.84 -0.90 -0.95 114.94 122.55 1h2m s ASN 205 Ca 0.43 -0.12 -0.12 0.00 0.21 0.00 0.00 52.86 53.27 1h2m s ASN 205 Cb -0.18 -0.49 -0.05 0.00 -0.55 0.00 0.00 41.25 39.98 1h2m s ASN 205 CO 0.23 -0.16 0.22 -0.36 -2.79 0.00 0.00 177.10 174.24 1h2m s PHE 206 N 1.74 3.23 -0.42 0.43 0.08 -0.65 -0.76 117.98 121.64 1h2m s PHE 206 Ca 0.02 0.18 -0.09 0.00 0.12 0.00 0.00 56.93 57.17 1h2m s PHE 206 Cb -0.13 -2.41 0.08 0.00 -0.57 0.00 0.00 43.02 39.99 1h2m s PHE 206 CO -0.05 -0.16 0.25 0.12 -0.10 0.00 0.00 175.22 175.28 1h2m s PHE 207 N 1.78 3.35 -0.42 0.36 2.19 -0.16 -0.73 117.98 124.36 1h2m s PHE 207 Ca 0.09 -1.61 -0.14 0.00 0.33 0.00 0.00 56.93 55.60 1h2m s PHE 207 Cb -0.16 -2.97 0.04 0.00 -1.31 0.00 0.00 43.02 38.62 1h2m s PHE 207 CO 0.10 -0.86 0.30 0.00 1.83 0.00 0.00 175.22 176.60 1h2m s ALA 208 N 1.40 3.45 0.17 11.12 0.00 -0.46 -0.80 121.76 136.64 1h2m s ALA 208 Ca 0.03 -1.83 -0.27 0.00 0.00 0.00 0.00 51.96 49.89 1h2m s ALA 208 Cb -0.23 -2.87 -0.08 0.00 0.00 0.00 0.00 23.12 19.94 1h2m s ALA 208 CO 0.01 -1.52 0.84 -1.14 0.00 0.00 0.00 175.76 173.95 1h2m s GLN 209 N 1.64 4.66 0.01 0.00 2.00 -0.47 -1.21 119.66 126.29 1h2m s GLN 209 Ca 0.04 1.27 0.00 0.00 -2.00 0.00 0.00 55.36 54.67 1h2m s GLN 209 Cb -0.20 -3.28 0.00 0.00 0.80 0.00 0.00 33.01 30.32 1h2m s GLN 209 CO 0.08 0.51 0.00 -0.89 -0.50 0.00 0.00 175.29 174.49 1h2m n ILE 210 N 1.75 0.09 -4.10 -2.34 5.41 -0.41 -1.84 119.36 117.91 1h2m n ILE 210 Ca -0.04 0.03 -0.16 0.00 1.00 0.00 0.00 62.75 63.58 1h2m n ILE 210 Cb 0.48 -1.43 -0.15 0.00 -0.71 0.00 0.00 39.64 37.83 1h2m n ILE 210 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1h2m s LYS 211 N -2.00 0.39 0.85 0.38 2.20 -0.92 -4.49 119.74 116.16 1h2m s LYS 211 Ca 0.00 -0.13 0.00 0.00 -0.36 0.00 0.00 55.97 55.48 1h2m s LYS 211 Cb 0.00 -0.41 0.00 0.00 -1.51 0.00 0.00 37.83 35.91 1h2m s LYS 211 CO 0.00 0.06 0.00 0.41 -0.36 0.00 0.00 175.35 175.46 1h2m n GLY 212 N 3.18 -1.96 3.15 5.54 0.00 -1.26 -0.67 105.19 113.16 1h2m n GLY 212 Ca -0.15 -1.37 -0.26 0.00 0.00 0.00 0.00 46.02 44.24 1h2m n GLY 212 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1h2m s TYR 213 N -0.40 1.68 -0.06 1.61 1.51 -1.26 -3.91 117.35 116.52 1h2m s TYR 213 Ca 0.00 -0.43 0.04 0.00 -1.01 0.00 0.00 57.07 55.67 1h2m s TYR 213 Cb 0.00 -1.12 -0.00 0.00 -0.11 0.00 0.00 41.96 40.73 1h2m s TYR 213 CO 0.00 -0.12 -0.19 0.15 -1.11 0.00 0.00 175.55 174.28 1h2m s LYS 214 N -0.11 2.15 -0.20 -0.62 1.02 -0.78 -2.17 119.74 119.03 1h2m s LYS 214 Ca -0.00 -0.68 -0.18 0.00 0.02 0.00 0.00 55.97 55.12 1h2m s LYS 214 Cb -0.10 -1.78 -0.03 0.00 -0.52 0.00 0.00 37.83 35.39 1h2m s LYS 214 CO 0.01 0.23 0.50 0.50 -0.92 0.00 0.00 175.35 175.67 1h2m s ARG 215 N 0.15 4.18 -0.20 1.68 3.52 0.12 -1.41 118.95 127.00 1h2m s ARG 215 Ca -0.08 0.37 -0.02 0.00 -0.13 0.00 0.00 55.73 55.87 1h2m s ARG 215 Cb -0.14 -3.56 -0.00 0.00 -1.56 0.00 0.00 34.95 29.69 1h2m s ARG 215 CO 0.04 -0.14 -0.09 0.00 -0.81 0.00 0.00 175.30 174.30 1h2m s ILE 217 N 1.28 3.04 0.12 0.00 1.01 0.20 -2.08 121.20 124.77 1h2m s ILE 217 Ca 0.03 -0.63 0.10 0.00 0.00 0.00 0.00 60.65 60.15 1h2m s ILE 217 Cb -0.14 -2.32 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 1h2m s ILE 217 CO -0.04 0.49 -0.22 -0.76 0.00 0.00 0.00 174.94 174.40 1h2m s LEU 218 N 0.95 2.52 -0.02 2.97 1.02 0.01 -0.16 118.68 125.96 1h2m s LEU 218 Ca -0.02 -0.65 0.02 0.00 0.02 0.00 0.00 54.13 53.51 1h2m s LEU 218 Cb -0.15 -1.39 0.00 0.00 0.02 0.00 0.00 46.19 44.67 1h2m s LEU 218 CO -0.01 0.18 -0.08 -0.36 0.02 0.00 0.00 176.35 176.11 1h2m s PHE 219 N -1.10 0.83 0.86 0.29 0.40 -0.48 -1.11 117.98 117.67 1h2m s PHE 219 Ca 0.16 -0.20 -0.11 0.00 -0.60 0.00 0.00 56.93 56.19 1h2m s PHE 219 Cb -0.10 -0.60 0.11 0.00 0.51 0.00 0.00 43.02 42.94 1h2m s PHE 219 CO 0.08 -0.08 1.11 -2.14 0.70 0.00 0.00 175.22 174.88 1h2m s PRO 220 N 0.18 1.49 0.65 0.24 0.02 -1.26 -0.89 135.00 135.44 1h2m s PRO 220 Ca -0.03 1.24 0.41 0.00 0.02 0.00 0.00 61.00 62.64 1h2m s PRO 220 Cb -0.08 -1.80 2.28 0.00 0.02 0.00 0.00 34.50 34.92 1h2m s PRO 220 CO 0.00 -2.20 2.34 -1.35 -0.33 0.00 0.00 177.00 175.46 1h2m h PRO 221 N -1.54 0.00 -0.16 5.54 0.11 -1.95 -1.56 132.00 132.44 1h2m h PRO 221 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1h2m h PRO 221 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1h2m h PRO 221 CO 0.48 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.87 1h2m n ASP 222 N -3.25 0.59 -1.17 -2.05 5.68 -1.26 -2.14 116.55 112.95 1h2m n ASP 222 Ca -0.03 -2.01 0.08 0.00 -0.50 0.00 0.00 54.79 52.33 1h2m n ASP 222 Cb 0.08 -0.10 0.28 0.00 -1.14 0.00 0.00 41.12 40.24 1h2m n ASP 222 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1h2m n GLN 223 N -0.20 3.40 -0.29 0.11 6.02 -0.59 -4.58 117.38 121.25 1h2m n GLN 223 Ca 0.03 -2.72 0.06 0.00 -0.01 0.00 0.00 57.00 54.36 1h2m n GLN 223 Cb 0.10 -1.78 0.16 0.00 1.02 0.00 0.00 30.24 29.74 1h2m n GLN 223 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 1h2m h PHE 224 N 2.81 -0.21 -0.01 1.08 3.04 -1.63 0.25 116.94 122.28 1h2m h PHE 224 Ca 0.00 0.07 0.00 0.00 3.98 0.00 0.00 57.97 62.02 1h2m h PHE 224 Cb 1.35 0.22 -0.00 0.00 2.56 0.00 0.00 35.95 40.09 1h2m h PHE 224 CO 0.59 -0.32 0.01 0.93 -2.02 0.00 0.00 178.31 177.50 1h2m h GLU 225 N 0.04 0.00 0.00 1.11 5.08 -1.88 -2.25 114.58 116.68 1h2m h GLU 225 Ca 0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.80 1h2m h GLU 225 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1h2m h GLU 225 CO -0.79 0.00 -1.09 0.00 -1.00 0.00 0.00 179.01 176.13 1h2m n LEU 227 N -1.83 0.54 -3.63 0.00 4.77 -0.86 -3.60 117.00 112.40 1h2m n LEU 227 Ca 0.02 -0.43 -0.25 0.00 -0.03 0.00 0.00 56.01 55.33 1h2m n LEU 227 Cb 0.41 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.52 1h2m n LEU 227 CO 0.41 0.14 -0.05 -1.22 -1.33 0.00 0.00 177.39 175.34 1h2m n TYR 228 N -1.42 -2.11 -1.81 -1.77 4.01 -1.17 -3.53 117.16 109.35 1h2m n TYR 228 Ca 0.02 0.66 -0.37 0.00 -0.16 0.00 0.00 57.90 58.05 1h2m n TYR 228 Cb 0.23 -3.31 0.06 0.00 -0.31 0.00 0.00 39.34 36.01 1h2m n TYR 228 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1h2m s PRO 229 N -5.22 2.70 1.04 -0.72 0.04 -1.26 -1.28 135.00 130.30 1h2m s PRO 229 Ca 0.24 2.02 -0.11 0.00 0.04 0.00 0.00 61.00 63.19 1h2m s PRO 229 Cb -0.10 -1.90 0.21 0.00 0.04 0.00 0.00 34.50 32.75 1h2m s PRO 229 CO 0.86 -1.47 1.06 0.66 0.04 0.00 0.00 177.00 178.15 1h2m n TYR 230 N -1.75 -0.13 -1.66 0.56 4.02 -0.81 -4.80 117.16 112.59 1h2m n TYR 230 Ca 0.15 0.15 -0.38 0.00 -0.01 0.00 0.00 57.90 57.82 1h2m n TYR 230 Cb 0.48 -1.86 0.05 0.00 -0.02 0.00 0.00 39.34 37.99 1h2m n TYR 230 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1h2m n PRO 231 N -4.49 1.05 -0.18 -0.72 -0.02 -1.26 -4.50 135.00 124.88 1h2m n PRO 231 Ca 0.08 0.41 0.05 0.00 -2.02 0.00 0.00 63.50 62.02 1h2m n PRO 231 Cb 0.53 -2.30 0.34 0.00 -0.02 0.00 0.00 33.50 32.05 1h2m n PRO 231 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1h2m h VAL 232 N 0.64 1.05 -0.00 -1.45 2.07 -1.96 -1.67 116.25 114.93 1h2m h VAL 232 Ca -0.49 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 66.76 1h2m h VAL 232 Cb 1.35 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 1h2m h VAL 232 CO 0.52 0.14 -0.11 1.41 0.02 0.00 0.00 177.57 179.56 1h2m n HIS 233 N -4.47 0.00 -2.82 1.57 8.25 -1.26 -4.58 115.22 111.91 1h2m n HIS 233 Ca 0.10 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.20 1h2m n HIS 233 Cb 0.19 -0.21 -0.06 0.00 1.12 0.00 0.00 29.99 31.02 1h2m n HIS 233 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1h2m s HIS 234 N -2.54 3.65 0.63 4.41 5.04 -0.63 -4.89 115.29 120.97 1h2m s HIS 234 Ca 0.27 1.73 0.30 0.00 -1.54 0.00 0.00 55.06 55.82 1h2m s HIS 234 Cb 0.20 -2.88 1.63 0.00 0.04 0.00 0.00 32.58 31.57 1h2m s HIS 234 CO 0.49 0.19 1.97 -1.35 -2.34 0.00 0.00 174.74 173.70 1h2m h PRO 235 N 3.07 0.00 -0.75 2.88 0.11 -1.83 0.93 132.00 136.41 1h2m h PRO 235 Ca -0.47 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.41 1h2m h PRO 235 Cb 1.19 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.17 1h2m h PRO 235 CO 0.65 0.00 0.28 0.00 -0.21 0.00 0.00 178.00 178.72 1h2m n ASP 237 N -0.20 0.32 0.00 0.00 2.03 0.32 -0.74 116.55 118.28 1h2m n ASP 237 Ca 0.42 1.02 0.00 0.00 0.52 0.00 0.00 54.79 56.75 1h2m n ASP 237 Cb 1.40 -0.79 0.00 0.00 -0.72 0.00 0.00 41.12 41.01 1h2m n ASP 237 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1h2m n ARG 238 N 1.99 0.00 -3.55 -0.67 1.74 -1.26 -4.99 116.66 109.91 1h2m n ARG 238 Ca 0.20 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.97 1h2m n ARG 238 Cb 0.03 -0.95 -0.05 0.00 -1.02 0.00 0.00 32.46 30.47 1h2m n ARG 238 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1h2m s GLN 239 N -0.34 3.68 0.35 5.56 -1.52 0.08 -2.09 119.66 125.39 1h2m s GLN 239 Ca 0.00 0.04 -0.26 0.00 -1.95 0.00 0.00 55.36 53.19 1h2m s GLN 239 Cb 0.00 -2.76 -0.09 0.00 -0.22 0.00 0.00 33.01 29.94 1h2m s GLN 239 CO 0.00 0.39 1.06 0.45 -0.25 0.00 0.00 175.29 176.94 1h2m s SER 240 N -2.49 6.96 0.03 5.90 0.15 0.15 -1.93 113.70 122.48 1h2m s SER 240 Ca 0.43 2.12 0.27 0.00 0.70 0.00 0.00 55.95 59.48 1h2m s SER 240 Cb -0.12 -2.60 0.95 0.00 -1.71 0.00 0.00 66.02 62.54 1h2m s SER 240 CO 0.24 -0.35 1.74 0.00 1.20 0.00 0.00 173.24 176.07 1h2m n GLN 241 N 0.43 0.04 -2.76 5.44 6.02 -0.40 -4.84 117.38 121.32 1h2m n GLN 241 Ca 0.03 0.03 -0.41 0.00 -0.01 0.00 0.00 57.00 56.63 1h2m n GLN 241 Cb 0.48 -1.54 -0.04 0.00 1.02 0.00 0.00 30.24 30.16 1h2m n GLN 241 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1h2m s VAL 242 N -3.02 4.69 -0.55 5.09 1.01 -1.26 -4.97 120.40 121.39 1h2m s VAL 242 Ca 0.12 2.00 -0.26 0.00 0.00 0.00 0.00 61.98 63.84 1h2m s VAL 242 Cb 0.18 -4.29 0.03 0.00 0.00 0.00 0.00 36.38 32.30 1h2m s VAL 242 CO 0.59 0.26 1.07 -0.62 0.00 0.00 0.00 175.10 176.40 1h2m s ASP 243 N 0.43 6.42 0.54 3.32 -1.08 -1.26 -4.90 116.67 120.15 1h2m s ASP 243 Ca 0.48 -0.04 0.22 0.00 -0.52 0.00 0.00 52.55 52.69 1h2m s ASP 243 Cb -0.22 -2.50 1.45 0.00 -1.46 0.00 0.00 42.92 40.19 1h2m s ASP 243 CO 0.28 -1.33 2.12 -0.26 0.52 0.00 0.00 175.17 176.50 1h2m h PHE 244 N 9.39 0.00 0.00 -5.34 -1.00 -1.98 -0.19 116.94 117.82 1h2m h PHE 244 Ca -0.25 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.51 1h2m h PHE 244 Cb 1.06 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.62 1h2m h PHE 244 CO 0.97 0.00 -0.08 -0.44 -1.61 0.00 0.00 178.31 177.15 1h2m h ASP 245 N 0.00 0.00 -0.89 2.17 3.32 -1.92 -3.41 116.42 115.69 1h2m h ASP 245 Ca 0.07 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.78 1h2m h ASP 245 Cb 0.30 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 39.62 1h2m h ASP 245 CO -0.00 0.08 -0.71 -3.20 -1.72 0.00 0.00 179.24 173.69 1h2m n ASN 246 N -3.14 -1.87 -4.72 6.45 5.15 -0.15 -5.09 115.26 111.89 1h2m n ASN 246 Ca 0.03 -3.01 -0.42 0.00 -0.60 0.00 0.00 54.58 50.58 1h2m n ASN 246 Cb 0.50 0.91 -0.03 0.00 -0.53 0.00 0.00 39.78 40.63 1h2m n ASN 246 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1h2m s PRO 247 N 0.10 4.27 -0.78 1.20 0.02 -0.81 -4.59 135.00 134.41 1h2m s PRO 247 Ca 0.33 2.23 -0.19 0.00 0.02 0.00 0.00 61.00 63.39 1h2m s PRO 247 Cb 0.17 -3.18 0.13 0.00 0.02 0.00 0.00 34.50 31.63 1h2m s PRO 247 CO -0.18 -0.50 0.94 0.34 -0.33 0.00 0.00 177.00 177.27 1h2m s ASP 248 N 0.98 6.46 0.38 2.53 -1.08 -1.26 -4.88 116.67 119.79 1h2m s ASP 248 Ca 0.66 -1.80 0.28 0.00 -0.52 0.00 0.00 52.55 51.16 1h2m s ASP 248 Cb -0.41 -2.35 1.25 0.00 -1.46 0.00 0.00 42.92 39.95 1h2m s ASP 248 CO 0.33 -1.07 1.83 1.88 0.52 0.00 0.00 175.17 178.66 1h2m h TYR 249 N 8.90 0.00 -0.15 -5.34 0.05 -1.93 -0.12 116.97 118.38 1h2m h TYR 249 Ca -0.04 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.67 1h2m h TYR 249 Cb 1.05 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.79 1h2m h TYR 249 CO 1.03 0.00 -0.18 0.93 -1.05 0.00 0.00 178.16 178.88 1h2m h GLU 250 N 0.00 0.39 0.00 4.88 5.08 -1.96 -2.37 114.58 120.60 1h2m h GLU 250 Ca 0.00 -0.22 -0.22 0.00 -1.00 0.00 0.00 59.36 57.93 1h2m h GLU 250 Cb 0.30 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 1h2m h GLU 250 CO 0.00 0.79 -1.06 0.00 -1.00 0.00 0.00 179.01 177.74 1h2m h ARG 251 N 0.01 0.00 -2.11 2.33 3.08 -1.91 -3.40 114.38 112.38 1h2m h ARG 251 Ca 0.02 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.50 1h2m h ARG 251 Cb 0.74 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.38 1h2m h ARG 251 CO 0.04 0.94 -0.86 1.19 -1.07 0.00 0.00 179.97 180.21 1h2m n PHE 252 N -3.32 1.84 -0.14 3.04 3.72 -0.08 -4.94 117.46 117.57 1h2m n PHE 252 Ca -0.02 -3.88 -0.02 0.00 -0.05 0.00 0.00 57.45 53.49 1h2m n PHE 252 Cb 0.95 -0.46 0.22 0.00 -0.94 0.00 0.00 39.48 39.24 1h2m n PHE 252 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1h2m h PRO 253 N 3.84 0.85 0.00 -1.08 0.13 -1.65 -1.27 132.00 132.83 1h2m h PRO 253 Ca 0.13 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1h2m h PRO 253 Cb 0.76 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 31.74 1h2m h PRO 253 CO 0.66 0.70 0.00 0.09 -0.23 0.00 0.00 178.00 179.22 1h2m n ASN 254 N -4.32 0.00 0.10 1.44 4.13 -1.26 -1.84 115.26 113.51 1h2m n ASN 254 Ca 0.05 -0.27 0.10 0.00 1.68 0.00 0.00 54.58 56.14 1h2m n ASN 254 Cb 0.17 -0.16 0.44 0.00 -1.54 0.00 0.00 39.78 38.68 1h2m n ASN 254 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 1h2m n PHE 255 N -1.16 0.58 0.69 3.10 7.35 -0.48 -1.23 117.46 126.31 1h2m n PHE 255 Ca 0.12 0.25 0.11 0.00 -0.76 0.00 0.00 57.45 57.17 1h2m n PHE 255 Cb 0.12 -0.90 0.46 0.00 0.35 0.00 0.00 39.48 39.51 1h2m n PHE 255 CO 0.00 0.00 0.00 1.04 -0.76 0.00 0.00 176.76 177.04 1h2m n GLN 256 N -2.05 0.05 -0.08 -4.13 6.02 -0.77 -2.89 117.38 113.54 1h2m n GLN 256 Ca 0.01 0.17 0.07 0.00 -0.01 0.00 0.00 57.00 57.24 1h2m n GLN 256 Cb 0.15 -1.58 0.10 0.00 1.02 0.00 0.00 30.24 29.93 1h2m n GLN 256 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1h2m n ASN 257 N -1.68 2.46 -4.77 1.08 4.13 -0.36 -5.03 115.26 111.08 1h2m n ASN 257 Ca 0.05 -1.71 -0.38 0.00 1.68 0.00 0.00 54.58 54.22 1h2m n ASN 257 Cb 0.27 -0.10 -0.03 0.00 -1.54 0.00 0.00 39.78 38.39 1h2m n ASN 257 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1h2m s VAL 258 N -1.05 3.32 -0.06 2.41 0.11 -1.14 -5.04 120.40 118.94 1h2m s VAL 258 Ca 0.20 1.09 -0.02 0.00 -2.93 0.00 0.00 61.98 60.32 1h2m s VAL 258 Cb 0.12 -3.60 0.03 0.00 -1.53 0.00 0.00 36.38 31.40 1h2m s VAL 258 CO 0.17 0.08 0.04 -0.69 -3.33 0.00 0.00 175.10 171.37 1h2m s VAL 259 N -1.47 0.10 0.48 2.04 1.01 -1.26 -4.43 120.40 116.87 1h2m s VAL 259 Ca 0.57 0.24 0.02 0.00 0.00 0.00 0.00 61.98 62.81 1h2m s VAL 259 Cb -0.28 -0.35 0.02 0.00 0.00 0.00 0.00 36.38 35.76 1h2m s VAL 259 CO 0.36 0.17 0.69 -0.83 0.00 0.00 0.00 175.10 175.48 1h2m s GLY 260 N 2.08 1.74 -0.18 4.51 0.00 -0.81 -4.80 107.32 109.86 1h2m s GLY 260 Ca 0.05 -1.30 -0.01 0.00 0.00 0.00 0.00 44.72 43.46 1h2m s GLY 260 CO -0.04 -1.08 -0.14 -0.19 0.00 0.00 0.00 173.10 171.65 1h2m s TYR 261 N -2.59 2.83 0.23 1.90 2.02 -0.26 -0.70 117.35 120.76 1h2m s TYR 261 Ca 0.53 -1.15 0.06 0.00 -0.37 0.00 0.00 57.07 56.14 1h2m s TYR 261 Cb -0.10 -1.95 -0.05 0.00 -0.40 0.00 0.00 41.96 39.46 1h2m s TYR 261 CO 0.37 -0.57 -0.08 -1.83 -1.57 0.00 0.00 175.55 171.87 1h2m s GLU 262 N 1.09 1.36 0.07 -0.62 -1.05 0.16 -0.81 118.70 118.90 1h2m s GLU 262 Ca -0.00 -1.65 -0.27 0.00 -0.15 0.00 0.00 54.97 52.90 1h2m s GLU 262 Cb -0.14 -0.95 0.08 0.00 -0.44 0.00 0.00 34.13 32.68 1h2m s GLU 262 CO -0.04 0.06 0.85 -0.08 0.95 0.00 0.00 175.26 177.00 1h2m s THR 263 N -3.13 0.00 -0.17 1.83 -1.32 -0.88 -0.92 115.64 111.05 1h2m s THR 263 Ca 0.25 -0.20 0.01 0.00 -1.21 0.00 0.00 61.69 60.54 1h2m s THR 263 Cb 0.03 -1.28 0.02 0.00 -1.51 0.00 0.00 72.50 69.76 1h2m s THR 263 CO 0.08 0.00 -0.18 -0.69 -2.21 0.00 0.00 174.62 171.62 1h2m s VAL 264 N -3.30 1.88 -0.01 5.08 1.01 -1.26 -0.41 120.40 123.39 1h2m s VAL 264 Ca 0.06 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 1h2m s VAL 264 Cb -0.01 -1.71 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 1h2m s VAL 264 CO -0.06 0.51 0.09 0.68 0.00 0.00 0.00 175.10 176.31 1h2m s VAL 265 N 1.34 4.77 0.23 2.92 -7.23 -0.50 -4.95 120.40 116.98 1h2m s VAL 265 Ca 0.04 -0.38 0.01 0.00 -1.81 0.00 0.00 61.98 59.85 1h2m s VAL 265 Cb -0.13 -3.18 -0.01 0.00 0.56 0.00 0.00 36.38 33.62 1h2m s VAL 265 CO -0.12 0.36 0.05 0.61 -0.31 0.00 0.00 175.10 175.69 1h2m n GLY 266 N 1.20 3.72 3.64 2.32 0.00 -1.26 -1.86 105.19 112.95 1h2m n GLY 266 Ca -0.13 -2.11 -0.51 0.00 0.00 0.00 0.00 46.02 43.27 1h2m n GLY 266 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1h2m n PRO 267 N -0.55 1.53 0.00 1.61 -0.02 -1.25 -1.07 135.00 135.24 1h2m n PRO 267 Ca -0.06 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 1h2m n PRO 267 Cb 0.33 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1h2m n PRO 267 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h2m n GLY 268 N 3.23 3.09 3.86 -1.23 0.00 -0.77 -4.97 105.19 108.40 1h2m n GLY 268 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 1h2m n GLY 268 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1h2m s ASP 269 N -1.13 6.66 -0.11 1.61 1.01 -0.24 -4.59 116.67 119.89 1h2m s ASP 269 Ca 0.00 1.22 -0.00 0.00 0.71 0.00 0.00 52.55 54.48 1h2m s ASP 269 Cb 0.00 -2.35 0.02 0.00 1.01 0.00 0.00 42.92 41.60 1h2m s ASP 269 CO 0.00 -0.29 -0.08 -0.69 0.21 0.00 0.00 175.17 174.32 1h2m s VAL 270 N -2.16 1.00 -0.24 -1.27 1.01 -0.49 -1.37 120.40 116.89 1h2m s VAL 270 Ca 0.53 -0.28 -0.10 0.00 0.00 0.00 0.00 61.98 62.13 1h2m s VAL 270 Cb -0.10 -1.02 -0.05 0.00 0.00 0.00 0.00 36.38 35.21 1h2m s VAL 270 CO 0.23 0.36 0.14 -0.22 0.00 0.00 0.00 175.10 175.61 1h2m s LEU 271 N 1.63 3.95 -0.31 3.92 2.96 0.02 -0.65 118.68 130.20 1h2m s LEU 271 Ca 0.03 0.03 -0.27 0.00 -0.22 0.00 0.00 54.13 53.71 1h2m s LEU 271 Cb -0.13 -2.06 0.01 0.00 0.50 0.00 0.00 46.19 44.51 1h2m s LEU 271 CO -0.07 0.04 0.96 -0.47 -1.32 0.00 0.00 176.35 175.48 1h2m s TYR 272 N 1.19 3.19 -0.41 5.38 5.04 -0.27 -0.99 117.35 130.48 1h2m s TYR 272 Ca 0.07 1.06 -0.05 0.00 -2.44 0.00 0.00 57.07 55.71 1h2m s TYR 272 Cb -0.14 -3.46 0.10 0.00 0.35 0.00 0.00 41.96 38.81 1h2m s TYR 272 CO 0.05 -0.66 0.22 0.42 -1.34 0.00 0.00 175.55 174.24 1h2m s ILE 273 N 3.33 3.55 0.47 3.14 1.01 0.06 -3.64 121.20 129.13 1h2m s ILE 273 Ca 0.40 -1.86 -0.22 0.00 0.00 0.00 0.00 60.65 58.97 1h2m s ILE 273 Cb -0.13 -3.35 -0.07 0.00 0.01 0.00 0.00 42.46 38.92 1h2m s ILE 273 CO 0.13 -0.63 1.15 -2.84 0.00 0.00 0.00 174.94 172.75 1h2m s PRO 274 N 1.23 3.70 0.26 2.79 0.02 -1.26 -2.11 135.00 139.63 1h2m s PRO 274 Ca 0.06 1.71 -0.30 0.00 0.02 0.00 0.00 61.00 62.49 1h2m s PRO 274 Cb -0.23 -2.32 -0.13 0.00 0.02 0.00 0.00 34.50 31.83 1h2m s PRO 274 CO -0.02 -0.58 1.38 -0.12 -0.33 0.00 0.00 177.00 177.32 1h2m n MET 275 N -0.64 2.06 -0.16 5.54 1.56 -1.25 -1.71 117.12 122.52 1h2m n MET 275 Ca 0.08 0.73 0.00 0.00 -0.27 0.00 0.00 57.70 58.24 1h2m n MET 275 Cb 0.49 -2.37 0.00 0.00 2.15 0.00 0.00 33.22 33.49 1h2m n MET 275 CO 0.00 0.00 0.00 0.66 -0.73 0.00 0.00 175.97 175.90 1h2m n TYR 276 N 1.53 0.00 -2.69 1.12 4.01 -0.84 -5.00 117.16 115.30 1h2m n TYR 276 Ca 0.10 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.42 1h2m n TYR 276 Cb 0.33 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.32 1h2m n TYR 276 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1h2m s TRP 277 N -3.16 3.68 0.46 -0.72 0.52 -0.69 -4.28 118.94 114.75 1h2m s TRP 277 Ca 0.00 1.69 -0.23 0.00 0.02 0.00 0.00 56.10 57.58 1h2m s TRP 277 Cb 0.00 -3.13 -0.07 0.00 -1.15 0.00 0.00 33.47 29.12 1h2m s TRP 277 CO 0.00 -0.07 1.20 -1.58 0.02 0.00 0.00 176.95 176.52 1h2m s TRP 278 N 0.70 2.83 -0.07 -1.98 0.52 -0.06 -4.49 118.94 116.39 1h2m s TRP 278 Ca 0.51 1.51 -0.09 0.00 0.02 0.00 0.00 56.10 58.05 1h2m s TRP 278 Cb -0.23 -3.46 0.02 0.00 -1.15 0.00 0.00 33.47 28.66 1h2m s TRP 278 CO 0.29 -1.69 0.24 -3.38 0.02 0.00 0.00 176.95 172.43 1h2m s HIS 279 N -1.47 -0.22 -0.10 -1.98 -3.43 0.12 -1.39 115.29 106.82 1h2m s HIS 279 Ca 0.63 0.50 0.03 0.00 -0.80 0.00 0.00 55.06 55.42 1h2m s HIS 279 Cb -0.31 0.07 0.01 0.00 -1.43 0.00 0.00 32.58 30.92 1h2m s HIS 279 CO 0.38 -0.18 -0.20 -1.58 -2.00 0.00 0.00 174.74 171.16 1h2m s HIS 280 N -0.26 2.25 -0.07 0.38 5.04 0.77 -2.18 115.29 121.21 1h2m s HIS 280 Ca -0.04 -0.98 0.02 0.00 -1.54 0.00 0.00 55.06 52.52 1h2m s HIS 280 Cb -0.03 -1.55 0.02 0.00 0.04 0.00 0.00 32.58 31.06 1h2m s HIS 280 CO 0.01 -0.44 -0.11 0.42 -2.34 0.00 0.00 174.74 172.29 1h2m s ILE 281 N 0.62 1.05 -0.03 0.89 1.01 -0.78 -0.63 121.20 123.34 1h2m s ILE 281 Ca -0.14 -0.41 0.02 0.00 0.00 0.00 0.00 60.65 60.12 1h2m s ILE 281 Cb -0.17 -0.98 0.01 0.00 0.01 0.00 0.00 42.46 41.33 1h2m s ILE 281 CO 0.04 0.34 -0.06 -1.83 0.00 0.00 0.00 174.94 173.44 1h2m s GLU 282 N 0.83 0.71 -0.12 2.79 -1.05 -0.05 -0.80 118.70 121.02 1h2m s GLU 282 Ca -0.12 -0.17 -0.28 0.00 -0.15 0.00 0.00 54.97 54.26 1h2m s GLU 282 Cb -0.15 -0.70 -0.01 0.00 -0.44 0.00 0.00 34.13 32.82 1h2m s GLU 282 CO 0.02 0.02 0.94 -1.12 0.95 0.00 0.00 175.26 176.07 1h2m s SER 283 N 0.43 7.14 0.31 0.83 0.01 -0.22 0.14 113.70 122.34 1h2m s SER 283 Ca -0.05 1.40 -0.28 0.00 1.31 0.00 0.00 55.95 58.33 1h2m s SER 283 Cb -0.09 -2.52 -0.14 0.00 0.21 0.00 0.00 66.02 63.48 1h2m s SER 283 CO 0.00 -0.42 1.06 0.18 0.41 0.00 0.00 173.24 174.47 1h2m n LEU 284 N 5.02 2.16 -4.75 2.44 4.77 -0.92 -1.00 117.00 124.72 1h2m n LEU 284 Ca 0.07 1.18 -0.42 0.00 -0.03 0.00 0.00 56.01 56.81 1h2m n LEU 284 Cb 0.49 -1.33 -0.01 0.00 -2.33 0.00 0.00 43.42 40.24 1h2m n LEU 284 CO 0.51 -1.23 1.21 0.18 -1.33 0.00 0.00 177.39 176.72 1h2m n LEU 285 N 1.11 4.40 -2.14 2.23 4.77 -0.93 -2.28 117.00 124.16 1h2m n LEU 285 Ca 0.09 1.16 -0.19 0.00 -0.03 0.00 0.00 56.01 57.04 1h2m n LEU 285 Cb 0.33 -1.59 -0.03 0.00 -2.33 0.00 0.00 43.42 39.80 1h2m n LEU 285 CO 0.60 0.12 -0.23 0.59 -1.33 0.00 0.00 177.39 177.15 1h2m n ASN 286 N 1.78 -5.39 -0.67 -1.43 3.02 -1.26 -4.75 115.26 106.56 1h2m n ASN 286 Ca 0.07 0.17 0.08 0.00 -0.03 0.00 0.00 54.58 54.87 1h2m n ASN 286 Cb 0.37 -4.59 0.08 0.00 -0.61 0.00 0.00 39.78 35.03 1h2m n ASN 286 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h2m n GLY 287 N -0.78 0.37 4.15 7.41 0.00 -0.96 -5.10 105.19 110.27 1h2m n GLY 287 Ca -0.22 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1h2m n GLY 287 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h2m n GLY 288 N 0.91 -2.21 3.79 -0.02 0.00 -1.26 -4.75 105.19 101.65 1h2m n GLY 288 Ca 0.10 -1.56 -0.33 0.00 0.00 0.00 0.00 46.02 44.22 1h2m n GLY 288 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1h2m s ILE 289 N -0.29 3.59 0.16 -0.61 -4.36 -1.26 -3.26 121.20 115.18 1h2m s ILE 289 Ca 0.00 0.81 0.10 0.00 -0.26 0.00 0.00 60.65 61.30 1h2m s ILE 289 Cb 0.00 -3.31 -0.04 0.00 1.25 0.00 0.00 42.46 40.35 1h2m s ILE 289 CO 0.00 -0.39 -0.18 0.42 0.24 0.00 0.00 174.94 175.03 1h2m s THR 290 N -2.28 2.73 -0.01 8.37 -4.23 -0.15 -4.17 115.64 115.90 1h2m s THR 290 Ca 0.66 -1.76 0.01 0.00 -1.18 0.00 0.00 61.69 59.42 1h2m s THR 290 Cb -0.18 -2.30 0.01 0.00 1.34 0.00 0.00 72.50 71.36 1h2m s THR 290 CO 0.34 -0.04 -0.03 -0.63 -0.54 0.00 0.00 174.62 173.72 1h2m s ILE 291 N -1.49 0.32 0.01 2.99 1.01 0.15 -1.91 121.20 122.28 1h2m s ILE 291 Ca 0.21 -0.11 -0.06 0.00 0.00 0.00 0.00 60.65 60.69 1h2m s ILE 291 Cb -0.09 -0.32 -0.00 0.00 0.01 0.00 0.00 42.46 42.06 1h2m s ILE 291 CO 0.11 0.12 0.11 -0.89 0.00 0.00 0.00 174.94 174.39 1h2m s THR 292 N 0.30 0.09 -0.09 2.92 2.01 -0.37 -1.29 115.64 119.22 1h2m s THR 292 Ca -0.03 -0.74 0.01 0.00 0.31 0.00 0.00 61.69 61.24 1h2m s THR 292 Cb -0.06 -0.41 0.02 0.00 0.01 0.00 0.00 72.50 72.05 1h2m s THR 292 CO -0.00 -0.41 -0.10 -0.69 -0.69 0.00 0.00 174.62 172.73 1h2m s VAL 293 N -1.42 1.08 0.39 3.82 1.01 -0.35 -0.87 120.40 124.06 1h2m s VAL 293 Ca -0.15 -0.39 0.08 0.00 0.00 0.00 0.00 61.98 61.51 1h2m s VAL 293 Cb -0.08 -1.03 -0.01 0.00 0.00 0.00 0.00 36.38 35.26 1h2m s VAL 293 CO 0.01 0.36 0.46 0.54 0.00 0.00 0.00 175.10 176.47 1h2m s ASN 294 N 1.12 5.51 -0.26 3.32 2.20 -0.91 -1.36 114.94 124.56 1h2m s ASN 294 Ca -0.06 -0.47 -0.02 0.00 -0.94 0.00 0.00 52.86 51.37 1h2m s ASN 294 Cb -0.14 -0.79 0.08 0.00 -2.00 0.00 0.00 41.25 38.39 1h2m s ASN 294 CO -0.02 -0.61 0.07 -0.36 -2.94 0.00 0.00 177.10 173.24 1h2m s PHE 295 N -2.34 1.30 -0.25 1.54 0.40 0.09 -3.34 117.98 115.38 1h2m s PHE 295 Ca 0.49 -1.28 -0.10 0.00 -0.60 0.00 0.00 56.93 55.44 1h2m s PHE 295 Cb -0.08 -1.34 -0.05 0.00 0.51 0.00 0.00 43.02 42.07 1h2m s PHE 295 CO 0.30 -0.76 0.15 -1.58 0.70 0.00 0.00 175.22 174.03 1h2m s TRP 296 N 1.76 3.25 0.00 0.36 0.51 -0.76 -1.64 118.94 122.42 1h2m s TRP 296 Ca 0.05 0.09 0.07 0.00 -2.12 0.00 0.00 56.10 54.18 1h2m s TRP 296 Cb -0.17 -2.28 -0.03 0.00 -0.81 0.00 0.00 33.47 30.18 1h2m s TRP 296 CO -0.19 -0.06 -0.22 0.71 -0.51 0.00 0.00 176.95 176.68 1h2m s TYR 297 N 1.30 2.45 0.46 -1.98 1.51 -0.12 -0.24 117.35 120.73 1h2m s TYR 297 Ca 0.07 -0.34 -0.24 0.00 -1.01 0.00 0.00 57.07 55.55 1h2m s TYR 297 Cb -0.14 -1.50 -0.07 0.00 -0.11 0.00 0.00 41.96 40.14 1h2m s TYR 297 CO 0.06 0.10 1.24 0.15 -1.11 0.00 0.00 175.55 176.00 1h2m s LYS 298 N -0.94 3.68 0.96 -0.62 1.02 -0.90 -1.01 119.74 121.93 1h2m s LYS 298 Ca 0.12 1.97 -0.12 0.00 0.02 0.00 0.00 55.97 57.96 1h2m s LYS 298 Cb -0.10 -2.47 0.16 0.00 -0.52 0.00 0.00 37.83 34.90 1h2m s LYS 298 CO 0.01 -0.67 1.10 0.20 -0.92 0.00 0.00 175.35 175.07 1h2m s GLY 299 N -1.11 1.58 1.17 -3.33 0.00 -1.26 -0.30 107.32 104.07 1h2m s GLY 299 Ca 0.63 -0.30 -0.13 0.00 0.00 0.00 0.00 44.72 44.92 1h2m s GLY 299 CO 0.41 0.26 1.03 0.00 0.00 0.00 0.00 173.10 174.80 1h2m s ALA 300 N -3.01 -0.48 0.49 3.20 0.00 -1.26 -3.55 121.76 117.16 1h2m s ALA 300 Ca 0.64 -0.21 -0.20 0.00 0.00 0.00 0.00 51.96 52.20 1h2m s ALA 300 Cb -0.18 -3.22 -0.08 0.00 0.00 0.00 0.00 23.12 19.64 1h2m s ALA 300 CO 0.57 -3.85 1.02 -1.25 0.00 0.00 0.00 175.76 172.25 1h2m s PRO 301 N -4.51 3.81 -0.17 0.00 0.04 -1.26 -4.95 135.00 127.95 1h2m s PRO 301 Ca 0.68 1.28 -0.29 0.00 0.04 0.00 0.00 61.00 62.71 1h2m s PRO 301 Cb -0.24 -2.10 -0.01 0.00 0.04 0.00 0.00 34.50 32.18 1h2m s PRO 301 CO 0.64 -0.41 1.24 0.99 0.04 0.00 0.00 177.00 179.50 1h2m s THR 302 N -2.11 4.32 0.00 1.26 2.01 -1.26 -5.18 115.64 114.68 1h2m s THR 302 Ca 0.65 1.60 0.00 0.00 0.31 0.00 0.00 61.69 64.26 1h2m s THR 302 Cb -0.15 -4.03 0.00 0.00 0.01 0.00 0.00 72.50 68.33 1h2m s THR 302 CO 0.22 -0.14 0.00 -2.65 -0.69 0.00 0.00 174.62 171.36 1h2m n PRO 303 N 6.55 0.00 0.00 4.92 -0.02 -1.26 -5.33 135.00 139.87 1h2m n PRO 303 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1h2m n PRO 303 Cb 0.45 -0.39 0.00 0.00 -0.02 0.00 0.00 33.50 33.54 1h2m n PRO 303 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1h2m n GLU 307 N 0.00 0.00 -3.44 -0.52 2.13 -1.26 -5.32 120.64 112.23 1h2m n GLU 307 Ca 0.00 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 57.56 1h2m n GLU 307 Cb 0.00 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 31.69 1h2m n GLU 307 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 1h2m s TYR 308 N -0.98 3.49 0.41 4.31 2.02 -1.26 -4.23 117.35 121.11 1h2m s TYR 308 Ca 0.00 0.46 -0.23 0.00 -0.37 0.00 0.00 57.07 56.93 1h2m s TYR 308 Cb 0.00 -1.96 -0.10 0.00 -0.40 0.00 0.00 41.96 39.50 1h2m s TYR 308 CO 0.00 0.20 0.97 -1.25 -1.57 0.00 0.00 175.55 173.91 1h2m s PRO 309 N -3.79 4.26 0.36 -1.71 0.04 -1.26 -5.12 135.00 127.78 1h2m s PRO 309 Ca 0.41 1.26 -0.27 0.00 0.04 0.00 0.00 61.00 62.44 1h2m s PRO 309 Cb -0.10 -2.38 -0.09 0.00 0.04 0.00 0.00 34.50 31.97 1h2m s PRO 309 CO 0.32 -0.02 1.25 -0.51 0.04 0.00 0.00 177.00 178.09 1h2m s LEU 310 N -2.86 4.33 0.54 -3.56 1.02 -1.26 -5.01 118.68 111.89 1h2m s LEU 310 Ca 0.59 2.56 -0.18 0.00 0.02 0.00 0.00 54.13 57.13 1h2m s LEU 310 Cb -0.14 -3.79 -0.06 0.00 0.02 0.00 0.00 46.19 42.21 1h2m s LEU 310 CO 0.19 -0.61 1.04 -1.59 0.02 0.00 0.00 176.35 175.40 1h2m s LYS 311 N -1.98 3.58 0.26 1.70 -2.85 -1.26 -4.90 119.74 114.29 1h2m s LYS 311 Ca 0.52 1.24 -0.01 0.00 -1.00 0.00 0.00 55.97 56.71 1h2m s LYS 311 Cb -0.37 -2.07 0.58 0.00 -2.06 0.00 0.00 37.83 33.91 1h2m s LYS 311 CO 0.48 -0.60 1.68 0.00 0.10 0.00 0.00 175.35 177.01 1h2m h ALA 312 N 0.94 1.14 0.00 0.59 0.00 -1.95 0.83 119.26 120.80 1h2m h ALA 312 Ca -0.48 0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1h2m h ALA 312 Cb 1.22 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1h2m h ALA 312 CO 0.58 -0.36 -0.30 1.12 0.00 0.00 0.00 179.25 180.30 1h2m h HIS 313 N 0.29 0.00 -0.36 0.00 -0.00 -1.92 -1.67 115.15 111.49 1h2m h HIS 313 Ca 0.48 0.00 -0.16 0.00 -0.00 0.00 0.00 60.37 60.69 1h2m h HIS 313 Cb 0.87 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.27 1h2m h HIS 313 CO -0.23 0.30 -0.40 1.96 -0.00 0.00 0.00 177.93 179.56 1h2m h GLN 314 N 0.00 0.89 -0.48 5.12 4.20 -1.23 -1.48 115.11 122.13 1h2m h GLN 314 Ca -0.00 -0.47 -0.05 0.00 0.06 0.00 0.00 58.65 58.19 1h2m h GLN 314 Cb 0.64 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.41 1h2m h GLN 314 CO 0.04 1.12 0.10 0.87 -0.67 0.00 0.00 178.83 180.29 1h2m h LYS 315 N 0.72 0.73 -0.54 1.46 1.57 -0.63 -0.42 116.57 119.46 1h2m h LYS 315 Ca 0.06 -0.14 -0.05 0.00 -1.87 0.00 0.00 60.65 58.64 1h2m h LYS 315 Cb 0.98 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.16 1h2m h LYS 315 CO 0.09 0.67 0.14 0.28 -0.57 0.00 0.00 179.45 180.07 1h2m h VAL 316 N 0.71 1.24 -0.91 0.50 2.07 -1.05 -0.55 116.25 118.26 1h2m h VAL 316 Ca 0.16 -0.86 0.06 0.00 0.82 0.00 0.00 66.70 66.88 1h2m h VAL 316 Cb 0.28 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 30.76 1h2m h VAL 316 CO -0.00 0.32 0.59 0.00 0.02 0.00 0.00 177.57 178.50 1h2m h ALA 317 N 1.01 1.50 -0.17 1.67 0.00 -0.45 -1.75 119.26 121.07 1h2m h ALA 317 Ca 0.17 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1h2m h ALA 317 Cb 0.33 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1h2m h ALA 317 CO 0.00 0.36 -0.01 0.82 0.00 0.00 0.00 179.25 180.42 1h2m h ILE 318 N 1.04 1.26 -0.84 0.00 2.04 -0.26 -2.42 117.51 118.32 1h2m h ILE 318 Ca 0.39 -0.89 -0.02 0.00 1.00 0.00 0.00 64.86 65.34 1h2m h ILE 318 Cb 0.19 1.51 -0.04 0.00 -0.74 0.00 0.00 36.82 37.74 1h2m h ILE 318 CO -0.15 0.27 0.43 0.24 0.00 0.00 0.00 178.15 178.94 1h2m h MET 319 N 0.05 1.19 -0.64 2.37 2.86 -0.46 -1.20 114.93 119.11 1h2m h MET 319 Ca 0.05 -0.15 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 1h2m h MET 319 Cb 0.41 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 31.81 1h2m h MET 319 CO 0.01 0.89 0.36 0.00 1.06 0.00 0.00 176.91 179.23 1h2m h ARG 320 N 1.19 0.88 -0.55 1.72 3.08 -1.31 -1.48 114.38 117.92 1h2m h ARG 320 Ca 0.29 -0.10 -0.06 0.00 0.07 0.00 0.00 59.98 60.19 1h2m h ARG 320 Cb 0.07 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 1h2m h ARG 320 CO -0.04 0.66 0.11 -0.91 -1.07 0.00 0.00 179.97 178.72 1h2m h ASN 321 N 0.87 0.85 -0.29 7.04 2.35 -0.80 0.42 115.58 126.01 1h2m h ASN 321 Ca 0.23 -0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1h2m h ASN 321 Cb 0.03 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 1h2m h ASN 321 CO -0.04 0.87 0.19 0.40 -1.65 0.00 0.00 177.43 177.21 1h2m h ILE 322 N 0.78 1.08 -0.67 2.81 1.08 -0.84 0.11 117.51 121.86 1h2m h ILE 322 Ca 0.17 -0.15 0.01 0.00 -0.39 0.00 0.00 64.86 64.50 1h2m h ILE 322 Cb 0.37 0.65 -0.03 0.00 -3.07 0.00 0.00 36.82 34.74 1h2m h ILE 322 CO 0.01 0.08 0.44 -0.33 -0.69 0.00 0.00 178.15 177.65 1h2m h GLU 323 N 0.40 0.87 -0.13 2.37 5.08 -0.81 -1.39 114.58 120.96 1h2m h GLU 323 Ca 0.11 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1h2m h GLU 323 Cb -0.04 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.01 1h2m h GLU 323 CO -0.02 0.57 0.07 0.87 -1.00 0.00 0.00 179.01 179.50 1h2m h LYS 324 N 0.89 0.19 -0.81 2.33 1.57 -0.35 -2.32 116.57 118.07 1h2m h LYS 324 Ca 0.25 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.99 1h2m h LYS 324 Cb -0.09 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.15 1h2m h LYS 324 CO -0.06 0.23 0.44 0.52 -0.57 0.00 0.00 179.45 180.01 1h2m h MET 325 N 0.10 1.13 -0.57 3.15 2.86 -0.64 -2.22 114.93 118.73 1h2m h MET 325 Ca 0.05 -0.13 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1h2m h MET 325 Cb 0.10 -0.22 -0.03 0.00 0.06 0.00 0.00 31.60 31.51 1h2m h MET 325 CO -0.01 0.83 0.27 -0.07 1.06 0.00 0.00 176.91 179.00 1h2m h LEU 326 N 1.12 0.76 -0.67 1.22 4.07 -1.17 0.14 115.31 120.78 1h2m h LEU 326 Ca 0.28 -0.13 0.01 0.00 0.08 0.00 0.00 57.88 58.13 1h2m h LEU 326 Cb 0.03 -0.19 -0.04 0.00 1.08 0.00 0.00 40.66 41.54 1h2m h LEU 326 CO -0.05 0.68 0.44 1.23 -1.08 0.00 0.00 178.44 179.66 1h2m h GLY 327 N 0.78 0.96 1.00 0.83 0.00 -1.13 0.23 103.07 105.74 1h2m h GLY 327 Ca 0.20 -0.34 -0.14 0.00 0.00 0.00 0.00 47.33 47.05 1h2m h GLY 327 CO -0.02 0.32 -0.37 0.83 0.00 0.00 0.00 176.54 177.30 1h2m h GLU 328 N 0.88 0.72 -0.25 4.80 4.39 -1.14 -2.75 114.58 121.24 1h2m h GLU 328 Ca 0.26 -0.42 -0.11 0.00 0.34 0.00 0.00 59.36 59.43 1h2m h GLU 328 Cb -0.06 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 1h2m h GLU 328 CO -0.07 1.04 -0.31 0.00 -1.16 0.00 0.00 179.01 178.50 1h2m h ALA 329 N 0.67 1.00 0.00 3.43 0.00 -0.22 -2.49 119.26 121.64 1h2m h ALA 329 Ca 0.03 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1h2m h ALA 329 Cb 0.95 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1h2m h ALA 329 CO 0.09 0.60 -0.29 1.28 0.00 0.00 0.00 179.25 180.92 1h2m n LEU 330 N -4.08 0.44 0.00 0.00 4.77 0.03 -4.94 117.00 113.22 1h2m n LEU 330 Ca -0.01 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 1h2m n LEU 330 Cb 0.45 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1h2m n LEU 330 CO 0.43 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 1h2m n GLY 331 N 1.43 0.75 3.18 -0.72 0.00 -0.94 -4.94 105.19 103.95 1h2m n GLY 331 Ca 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.00 1h2m n GLY 331 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1h2m s ASN 332 N -2.73 -0.26 0.57 1.61 3.84 -1.23 -5.03 114.94 111.72 1h2m s ASN 332 Ca 0.00 0.80 0.29 0.00 0.21 0.00 0.00 52.86 54.16 1h2m s ASN 332 Cb 0.00 1.41 1.73 0.00 -0.55 0.00 0.00 41.25 43.84 1h2m s ASN 332 CO 0.00 -0.25 2.21 -0.65 -2.79 0.00 0.00 177.10 175.62 1h2m h PRO 333 N 8.15 0.00 0.00 0.43 0.11 -1.93 0.77 132.00 139.54 1h2m h PRO 333 Ca -0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.93 1h2m h PRO 333 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1h2m h PRO 333 CO 0.17 0.03 0.00 1.04 -0.21 0.00 0.00 178.00 179.03 1h2m n GLN 334 N -3.80 0.09 0.00 1.05 6.02 -1.26 -1.59 117.38 117.89 1h2m n GLN 334 Ca -0.03 0.35 0.13 0.00 -0.01 0.00 0.00 57.00 57.44 1h2m n GLN 334 Cb 0.12 -1.69 0.41 0.00 1.02 0.00 0.00 30.24 30.10 1h2m n GLN 334 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1h2m n GLU 335 N -1.86 0.51 -0.12 -1.09 1.02 0.26 -4.25 120.64 115.11 1h2m n GLU 335 Ca 0.03 -0.26 -0.08 0.00 -0.02 0.00 0.00 57.16 56.82 1h2m n GLU 335 Cb 0.19 -1.49 -0.00 0.00 -0.02 0.00 0.00 31.44 30.11 1h2m n GLU 335 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1h2m h VAL 336 N 0.65 1.12 0.84 2.62 2.07 -1.42 -2.86 116.25 119.26 1h2m h VAL 336 Ca 0.00 -0.28 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 1h2m h VAL 336 Cb 0.47 0.61 0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1h2m h VAL 336 CO 0.00 0.12 -0.40 1.23 0.02 0.00 0.00 177.57 178.54 1h2m h GLY 337 N 0.51 -1.17 0.25 2.17 0.00 -1.78 -2.22 103.07 100.83 1h2m h GLY 337 Ca 0.14 0.43 0.15 0.00 0.00 0.00 0.00 47.33 48.06 1h2m h GLY 337 CO -0.03 -0.43 0.52 -2.55 0.00 0.00 0.00 176.54 174.06 1h2m h PRO 338 N -1.14 0.71 -0.24 4.80 0.11 -1.81 0.13 132.00 134.57 1h2m h PRO 338 Ca -0.11 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.94 1h2m h PRO 338 Cb 0.86 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.80 1h2m h PRO 338 CO 0.19 0.47 0.08 1.25 -0.21 0.00 0.00 178.00 179.78 1h2m h LEU 339 N 0.73 0.34 -0.69 2.35 6.46 -1.45 0.58 115.31 123.63 1h2m h LEU 339 Ca 0.50 -0.18 0.03 0.00 -0.12 0.00 0.00 57.88 58.11 1h2m h LEU 339 Cb 0.69 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 40.49 1h2m h LEU 339 CO -0.35 0.43 0.43 -0.07 -0.62 0.00 0.00 178.44 178.26 1h2m h LEU 340 N 0.22 0.70 -0.57 2.25 3.38 -0.72 0.22 115.31 120.79 1h2m h LEU 340 Ca 0.08 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1h2m h LEU 340 Cb 0.21 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 1h2m h LEU 340 CO -0.00 0.48 0.25 0.78 0.09 0.00 0.00 178.44 180.03 1h2m h ASN 341 N 0.83 0.77 -0.54 -0.43 2.35 -0.50 -1.19 115.58 116.88 1h2m h ASN 341 Ca 0.28 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 1h2m h ASN 341 Cb 0.04 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.18 1h2m h ASN 341 CO -0.12 0.71 0.32 0.74 -1.65 0.00 0.00 177.43 177.44 1h2m h THR 342 N 0.78 1.16 -0.64 2.81 2.02 0.02 -1.70 112.91 117.36 1h2m h THR 342 Ca 0.19 -0.37 -0.09 0.00 0.77 0.00 0.00 66.41 66.91 1h2m h THR 342 Cb 0.17 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 1h2m h THR 342 CO -0.02 0.17 0.04 0.24 0.37 0.00 0.00 175.52 176.32 1h2m h MET 343 N 0.76 1.10 0.01 6.66 2.86 0.57 -3.36 114.93 123.53 1h2m h MET 343 Ca 0.20 -0.33 -0.33 0.00 -2.06 0.00 0.00 59.70 57.18 1h2m h MET 343 Cb -0.01 -0.11 -0.06 0.00 0.06 0.00 0.00 31.60 31.48 1h2m h MET 343 CO -0.04 1.04 -2.06 0.44 1.06 0.00 0.00 176.91 177.35 1h2m n ILE 344 N -4.19 1.52 -2.02 -1.22 -5.35 -0.73 -4.57 119.36 102.80 1h2m n ILE 344 Ca 0.04 -0.81 -0.42 0.00 -0.27 0.00 0.00 62.75 61.29 1h2m n ILE 344 Cb 0.33 -0.84 -0.03 0.00 -1.74 0.00 0.00 39.64 37.37 1h2m n ILE 344 CO 0.00 0.00 0.00 -1.59 -1.76 0.00 0.00 176.55 173.20 1h2m s LYS 345 N -2.54 4.23 0.00 6.28 -2.85 -0.67 -0.33 119.74 123.85 1h2m s LYS 345 Ca -0.09 2.23 0.00 0.00 -1.00 0.00 0.00 55.97 57.10 1h2m s LYS 345 Cb 0.07 -3.52 0.00 0.00 -2.06 0.00 0.00 37.83 32.32 1h2m s LYS 345 CO 0.81 -0.66 0.00 0.41 0.10 0.00 0.00 175.35 176.01 1h2m n GLY 346 N 3.85 0.55 1.08 0.59 0.00 -1.26 -4.79 105.19 105.20 1h2m n GLY 346 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1h2m n GLY 346 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h2m n ARG 347 N -2.12 0.00 0.00 1.61 1.74 0.35 -4.91 116.66 113.33 1h2m n ARG 347 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1h2m n ARG 347 Cb 0.06 -0.44 0.00 0.00 -1.02 0.00 0.00 32.46 31.06 1h2m n ARG 347 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1h2m n TYR 348 N -2.78 0.00 0.63 -1.55 4.01 0.55 -5.06 117.16 112.96 1h2m n TYR 348 Ca 0.00 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.82 1h2m n TYR 348 Cb 0.37 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.46 1h2m n TYR 348 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67